A0AA82MZX1_SCHMA Loading...

Multiple PDZ domain protein

AlphaFold DB (A0A5K4F4B7), UniProt , Accession A0AA82MZX1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 805 aa.

						>A0AA82MZX1_SCHMA|A0AA82MZX1
MSTDPNLYNVSLTSKQTKMPSTPYFFGETCQDLHQQHSKSGNDNKTNDKENYGHNKNETEMIESNEMDLIYTQTDNDNLTPSIILTSDDTDWKPCEQGSISSMESISNSPSPRTSYNSLLHWGINNAKDEREYLLNKYSELPGEIITFELPLSSLTVEASHHKNVNLGLKLAGSRDLNQMSVFVCGIQPGSIIERDGHIEVGDQLLELNNQVLYGLSHLNAAPLIRSIYMEVIGRSSNIFRRSKCNALRFVIQRHSSNTNLMAALATNQHADSSSDRSSRHPSVDTTTSALTSPVKNINKAKQSIEFMNLAFGSSHGPLTQQIYSTTLYRGSKGFGFAIMERSATNEEGIYIKQIVEGGPADKDGILCPGDQLIKINKKDVTHASYDTVVDWIRSAKHVLHVQVTRWGFNTQASAETKPSTKRFSDPSVLNTFTSVLLGKDNEIKNFLSPVDTCRELINTKTLNVLSSIESGASWLVPRQIVSRYRRASFPNIGYKREHIPTTVLQPLPNYSTTSINLQGDTNFDKISILINDEPEIEATIRPIKPGSETEISIAINNSCGLGIGCIGGCETALNIPVIHEIYPNGAAAKDGRLRPGDRISKVNRISLAGVPFLEAMNKLQMAYISKSSMIKLDSDDENENISLLNQEQSYLNLTIFRPTEQSQKWYDQELIIELLKKSGKGLGICIADRCVHLKPDENLSENENTLKVQDNSYVNTSEMQTSYGVIITEIIKGSIAATDGRLMANDQILEVNGKDTSTLTSEIVGALLKAAPYKVVLKVGRLKNQIAIPNSAAFLFNDPYQVRR
					

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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	37.1	Very low	32.8	Very low	235 Å²	235	147.6 Å²	147.6	100%	1.158	81%	0.811	S	S	*	*				0	81.6	0	-63.7	166.8	174.4	0	0	105
2	S	32.2	Very low	32.6	Very low	103 Å²	103	147.6 Å²	147.6	72%	0.72	81%	0.807	S	S	*	*				66.7	100.5	79	-68.2	0	0	0	0	109.7
3	T	32.9	Very low	32.6	Very low	116 Å²	116	146 Å²	146	71%	0.712	81%	0.805	S	S	*	*				69.3	135.4	85.5	65.1	0	0	0	0	111
4	D	34.9	Very low	32.1	Very low	144 Å²	144	143.6 Å²	143.6	77%	0.77	80%	0.804	S	S	*	*			cis	-141.4	163.1	29.2	-72	-79.5	0	0	0	114.3
5	P	34.3	Very low	32	Very low	101 Å²	101	147.6 Å²	147.6	66%	0.656	81%	0.809	S	S	*	*			trans	-96.6	165.5	161.3	37.9	-31.8	0	0	0	112.9
6	N	31.6	Very low	31.5	Very low	151 Å²	151	150.6 Å²	150.6	81%	0.807	82%	0.816	S	S	*	*			trans	69.6	102.5	170.5	-54.8	-33.6	0	0	0	118.1
7	L	34.5	Very low	31.3	Very low	159 Å²	159	148.7 Å²	148.7	83%	0.832	81%	0.811	S	S	*	*			trans	-173.5	122	130.7	-106.2	159.2	0	0	0	110.7
8	Y	34.1	Very low	31	Very low	213 Å²	213	152.4 Å²	152.4	84%	0.835	82%	0.818	S	S	*	*				176.2	101.7	125.9	-101.8	-67.7	0	0	0	110.6
9	N	28.3	Very low	30.7	Very low	163 Å²	163	152.9 Å²	152.9	87%	0.872	82%	0.816	S	S	*	*			trans	-80.9	130.5	162.8	-90	-28.5	0	0	0	109.1
10	V	33.4	Very low	30.5	Very low	125 Å²	125	150.1 Å²	150.1	76%	0.758	81%	0.807	S	S	*	*			trans	-133.9	107.5	159	-178.2	0	0	0	0	108.6
11	S	27.2	Very low	30.4	Very low	114 Å²	114	147 Å²	147	80%	0.797	80%	0.797	S	S	*	*			trans	-88.4	133.1	176.6	54.1	0	0	0	0	111.2
12	L	31.1	Very low	30.1	Very low	147 Å²	147	140.7 Å²	140.7	77%	0.77	77%	0.772	S	S	*	*			trans	-147.6	97.8	167.6	-108.6	162.4	0	0	0	112.8
13	T	31.7	Very low	30.1	Very low	127 Å²	127	140.6 Å²	140.6	78%	0.779	77%	0.769	S	S	*	*			trans	42.2	122.3	146.3	57.6	0	0	0	0	120.9
14	S	26.1	Very low	30.1	Very low	113 Å²	113	143.1 Å²	143.1	79%	0.79	77%	0.766	S	S	*	*			trans	-65.6	143.1	171.1	53.3	0	0	0	0	115.2
15	K	30.5	Very low	29.8	Very low	203 Å²	203	141 Å²	141	88%	0.883	75%	0.75	S	S	*	*			trans	-130.8	127.2	144.6	-84.1	-172.9	174.2	179.1	0	109.2
16	Q	24.3	Very low	29.7	Very low	195 Å²	195	143.2 Å²	143.2	91%	0.911	75%	0.75	S	S	*	*			trans	-78.5	126.2	175.3	-69.2	171.1	-37.8	0	0	110.1
17	T	27.9	Very low	29.7	Very low	119 Å²	119	139.3 Å²	139.3	73%	0.73	75%	0.746	S	S	*	*			trans	-141	119.4	161.9	42.7	0	0	0	0	109.2
18	K	25.1	Very low	29.6	Very low	216 Å²	216	140.6 Å²	140.6	94%	0.939	75%	0.748	S	S	*	*			trans	-79.7	123.3	177.9	-155.9	175.9	-173.7	-178.5	0	108.2
19	M	25.7	Very low	29.3	Very low	161 Å²	161	136.3 Å²	136.3	79%	0.793	74%	0.744	S	S	*	*			trans	-131.7	145	-177.7	-77.7	-69.4	-164.8	0	0	110.7
20	P	26.5	Very low	29.5	Very low	97 Å²	97	134.8 Å²	134.8	63%	0.63	74%	0.744	S	S	*	*			trans	-84.4	155.1	-178.3	34.3	-35.3	0	0	0	113.1	T22	P20-T22 PolarHBondContact O-N 2.81Å; P20-T22 PolarHBondContact O-OG1 3.07Å
21	S	28	Very low	29.1	Very low	84 Å²	84	137.1 Å²	137.1	59%	0.587	75%	0.747	S	S	*	*			trans	-57.5	122.6	173.6	51.7	0	0	0	0	111.9
22	T	31.7	Very low	29.4	Very low	104 Å²	104	139.5 Å²	139.5	64%	0.638	75%	0.751	S	S	*	*			trans	-142.8	148.7	179.3	39	0	0	0	0	109.8	P20 Y24	P20-T22 PolarHBondContact O-N 2.81Å; P20-T22 PolarHBondContact O-OG1 3.07Å; T22-Y24 PolarHBondContact O-N 3.5Å
23	P	31.9	Very low	29.3	Very low	100 Å²	100	139 Å²	139	65%	0.649	75%	0.748	S	S	*	*			trans	-68.8	129.9	-174.5	26.8	-34	0	0	0	112	F25	P23-F25 PolarHBondContact O-N 3.24Å; P23-F25 VanDerWaalsContact O-N 3.14Å
24	Y	32.6	Very low	29.4	Very low	169 Å²	169	142.1 Å²	142.1	66%	0.663	75%	0.753	S	S	*	*			trans	-74.5	100.1	-175.3	-80.1	-83.2	0	0	0	113	T22 F26	T22-Y24 PolarHBondContact O-N 3.5Å; Y24-F26 HydrophobicContact CG-CE2 4.5Å
25	F	29.6	Very low	29.5	Very low	99 Å²	99	143.9 Å²	143.9	43%	0.434	75%	0.749	S	S	.	*			trans	-69.3	127.4	163.5	-94.6	-90.7	0	0	0	111.1	P23 N117 L120	P23-F25 PolarHBondContact O-N 3.24Å; P23-F25 VanDerWaalsContact O-N 3.14Å; F25-N117 WeakPolarHBondContact CE2-OD1 3.39Å; F25-L120 HydrophobicContact CD1-CD1 4.06Å; F25-L120 HydrophobicContact CE1-CD1 3.65Å
26	F	31.6	Very low	29.5	Very low	148 Å²	148	141.4 Å²	141.4	65%	0.649	74%	0.741	S	S	*	*			trans	-116.5	100.5	172.4	-84.1	-72.4	0	0	0	111.7	Y24	Y24-F26 HydrophobicContact CG-CE2 4.5Å
27	G	31.4	Very low	30	Very low	70 Å²	70	140.4 Å²	140.4	72%	0.722	74%	0.735	S	S	*	*			trans	-167.9	81.7	176.2	0	0	0	0	0	111.5
28	E	32.1	Very low	30.1	Very low	186 Å²	186	139.2 Å²	139.2	87%	0.869	73%	0.732	S	S	*	*			trans	-78.1	126.4	177	-67.4	173.4	138.3	0	0	110.6
29	T	29	Very low	30.5	Very low	123 Å²	123	138.4 Å²	138.4	76%	0.755	73%	0.729	S	S	*	*			trans	-98.8	111.8	174	51.8	0	0	0	0	110.6	Q31	T29-Q31 PolarHBondContact O-N 3.24Å
30	C	31.1	Very low	30.8	Very low	130 Å²	130	136 Å²	136	88%	0.878	73%	0.728	S	S	*	*			trans	-66.4	124.9	164.7	-70.7	0	0	0	0	109.8
31	Q	26.9	Very low	31.2	Very low	175 Å²	175	135 Å²	135	82%	0.818	74%	0.735	S	S	*	*			trans	-87.7	136.6	162	-65	175.4	-35.9	0	0	108.2	T29	T29-Q31 PolarHBondContact O-N 3.24Å
32	D	33.5	Very low	31.5	Very low	164 Å²	164	137.7 Å²	137.7	88%	0.877	74%	0.743	S	S	*	*			trans	-138.6	134.1	156.6	-105.7	-46.6	0	0	0	109
33	L	27.6	Very low	31.8	Very low	136 Å²	136	139 Å²	139	71%	0.712	75%	0.746	S	S	*	*			trans	-87.7	148.1	176.1	-69	80.2	0	0	0	109.2
34	H	34.4	Very low	32	Very low	193 Å²	193	139.4 Å²	139.4	89%	0.894	74%	0.743	S	S	*	*			trans	-151.4	166.7	131.1	-111.8	72.8	0	0	0	111.3
35	Q	29.2	Very low	32.1	Very low	149 Å²	149	139.9 Å²	139.9	70%	0.696	75%	0.748	S	S	*	*			trans	-106.4	153.1	-155.3	-68.1	177.8	-9.6	0	0	114.5
36	Q	29.6	Very low	32.4	Very low	152 Å²	152	141.1 Å²	141.1	71%	0.71	76%	0.764	S	S	*	*			trans	43.1	120.3	142.2	-62.5	172.2	6.3	0	0	119.4
37	H	34.9	Very low	32.4	Very low	173 Å²	173	140.5 Å²	140.5	80%	0.801	77%	0.767	S	S	*	*				-163.3	176.1	91.3	-114.6	-78.7	0	0	0	113
38	S	29.6	Very low	32.7	Very low	95 Å²	95	144 Å²	144	66%	0.664	77%	0.769	S	S	*	*			trans	-129.8	151.4	-163.5	53.2	0	0	0	0	113.9
39	K	34	Very low	32.9	Very low	199 Å²	199	142.7 Å²	142.7	87%	0.865	76%	0.761	S	S	*	*			trans	153.8	148	156	-87.8	157.8	-176.6	-179.4	0	108.8
40	S	31	Very low	33.2	Very low	111 Å²	111	143.2 Å²	143.2	78%	0.776	76%	0.755	S	S	*	*			cis	145.1	129.4	-19.2	57.4	0	0	0	0	107.6
41	G	35.4	Very low	33.3	Very low	75 Å²	75	142.6 Å²	142.6	77%	0.773	74%	0.743	S	S	*	*			trans	127.4	96.4	-171.7	0	0	0	0	0	109.6
42	N	33.7	Very low	33.5	Very low	141 Å²	141	144.9 Å²	144.9	75%	0.754	75%	0.745	S	S	*	*			cis	92.4	151.7	29.2	-147.2	80	0	0	0	113.5
43	D	39.7	Very low	33.5	Very low	131 Å²	131	140.7 Å²	140.7	70%	0.701	74%	0.741	S	S	*	*			trans	77.4	141	177.2	-56.4	-32.7	0	0	0	118
44	N	34.3	Very low	33.8	Very low	109 Å²	109	142.5 Å²	142.5	58%	0.583	75%	0.746	S	S	*	*			cis	-171.9	140.7	-30.8	-124.4	-55.2	0	0	0	110.7
45	K	35.4	Very low	33.9	Very low	178 Å²	178	139 Å²	139	77%	0.774	73%	0.733	S	S	*	*			trans	63.5	163.3	151.2	-68.8	168.4	-173.9	179.5	0	118.8
46	T	35.8	Very low	34.1	Very low	125 Å²	125	140.1 Å²	140.1	77%	0.767	74%	0.736	S	S	*	*			cis	-148	162.6	-7.7	-1.6	0	0	0	0	112.3
47	N	32.1	Very low	34.2	Very low	136 Å²	136	138.5 Å²	138.5	73%	0.727	73%	0.732	S	S	*	*			trans	-65.4	165.7	171.8	-51	-27.5	0	0	0	114.9
48	D	38	Very low	34.3	Very low	143 Å²	143	137.4 Å²	137.4	77%	0.765	73%	0.728	S	S	*	*				151.9	161.7	123.7	-79.1	-20.4	0	0	0	111.7
49	K	35.4	Very low	34.4	Very low	158 Å²	158	138.3 Å²	138.3	69%	0.687	73%	0.729	S	S	*	*			cis	-176.2	149.3	-46.2	-136.2	-177.1	163.6	-136.7	0	108
50	E	34.7	Very low	34.4	Very low	135 Å²	135	136 Å²	136	63%	0.631	72%	0.721	S	S	*	*			trans	66.6	158.7	158.5	-69.9	173.7	-135.7	0	0	117.7
51	N	34.4	Very low	34.3	Very low	116 Å²	116	137.6 Å²	137.6	62%	0.62	72%	0.718	S	S	*	*			cis	-157.7	159.8	-9	-110.9	-21.1	0	0	0	113.5
52	Y	30.1	Very low	34.1	Very low	223 Å²	223	139.9 Å²	139.9	88%	0.875	71%	0.712	S	S	*	*			trans	7.6	147.1	157	-76.1	-97.2	0	0	0	124.5
53	G	34.4	Very low	33.9	Very low	77 Å²	77	141 Å²	141	79%	0.794	71%	0.712	S	S	*	*			trans	-177	115.1	155.3	0	0	0	0	0	118.1
54	H	34.4	Very low	33.4	Very low	174 Å²	174	138.8 Å²	138.8	81%	0.806	71%	0.707	S	S	*	*			trans	-61.9	173	167.7	-88	-70.8	0	0	0	114.1
55	N	34.8	Very low	33.1	Very low	118 Å²	118	140.5 Å²	140.5	63%	0.631	72%	0.716	S	S	*	*			cis	-162.7	141.6	14.5	-120.4	-16.3	0	0	0	109.5
56	K	34.2	Very low	32.8	Very low	173 Å²	173	140.6 Å²	140.6	75%	0.752	72%	0.72	S	S	*	*				80.3	147	92.6	-104.6	-171.5	177.6	-171.7	0	119.3
57	N	33	Very low	32.4	Very low	119 Å²	119	142.5 Å²	142.5	64%	0.636	72%	0.722	S	S	*	*			trans	74.7	151.9	159.8	-64.2	20.2	0	0	0	116.5
58	E	35.7	Very low	32.4	Very low	150 Å²	150	143.8 Å²	143.8	70%	0.701	73%	0.729	S	S	*	*			cis	-159.4	150.3	7.7	-131.1	154	-126.1	0	0	112.6
59	T	32.2	Very low	31.8	Very low	114 Å²	114	143.5 Å²	143.5	70%	0.699	73%	0.727	S	S	*	*			trans	45	163.3	143.9	42.2	0	0	0	0	123.3
60	E	34.2	Very low	31.6	Very low	149 Å²	149	144.2 Å²	144.2	70%	0.696	74%	0.736	S	S	*	*			cis	-165.1	158.4	7.6	-126.4	173.9	-148.1	0	0	112.8
61	M	29.3	Very low	31	Very low	145 Å²	145	147.4 Å²	147.4	71%	0.714	74%	0.744	S	S	*	*			trans	60.7	158.4	147.5	-57.9	-56	-145.9	0	0	121.6
62	I	30.6	Very low	30.8	Very low	123 Å²	123	149 Å²	149	63%	0.631	76%	0.758	S	S	*	*			cis	-157.5	169	-13.4	-118.4	169.4	0	0	0	112.8
63	E	28.8	Very low	30.5	Very low	164 Å²	164	146.2 Å²	146.2	77%	0.766	75%	0.753	S	S	*	*			trans	-23.8	175.5	163.4	-56.2	165.8	153.1	0	0	121
64	S	28.6	Very low	30.3	Very low	86 Å²	86	149.1 Å²	149.1	60%	0.601	76%	0.755	S	S	*	*			cis	-176	169	-33.1	67.8	0	0	0	0	110.3
65	N	28.3	Very low	29.9	Very low	144 Å²	144	147 Å²	147	77%	0.77	75%	0.75	S	S	*	*			trans	66.2	164.4	169.6	-53.2	-22.8	0	0	0	116.4
66	E	30.5	Very low	29.7	Very low	180 Å²	180	149.2 Å²	149.2	84%	0.841	76%	0.762	S	S	*	*			cis	-142.6	-163.3	-2.1	-144.1	169.1	155.2	0	0	111.8
67	M	25.8	Very low	29.4	Very low	165 Å²	165	147.9 Å²	147.9	81%	0.813	76%	0.763	S	S	*	*			trans	-81.9	158	-174.4	-54.7	-174.4	-171.5	0	0	114.6
68	D	32.5	Very low	29.3	Very low	163 Å²	163	149.4 Å²	149.4	87%	0.872	77%	0.771	S	S	*	*				-160.3	164.8	120.7	-125.4	-27.8	0	0	0	113.4
69	L	26	Very low	29	Very low	138 Å²	138	150.9 Å²	150.9	72%	0.723	78%	0.783	S	S	*	*			trans	-106.6	153.1	177.3	-91	72.6	0	0	0	112
70	I	30.1	Very low	29.1	Very low	173 Å²	173	148.5 Å²	148.5	89%	0.887	77%	0.768	S	S	*	*			trans	-173.8	150.6	131.3	-99.3	153.6	0	0	0	111.8
71	Y	23.7	Very low	29.3	Very low	202 Å²	202	145.2 Å²	145.2	79%	0.792	76%	0.76	S	S	*	*			trans	-80.9	145.2	-179.7	-81.8	-112.8	0	0	0	113.8
72	T	29.2	Very low	29.8	Very low	149 Å²	149	140.6 Å²	140.6	91%	0.914	74%	0.742	S	S	*	*			trans	-138.8	162.1	140.8	48	0	0	0	0	110.4
73	Q	24.5	Very low	30.5	Very low	165 Å²	165	137.2 Å²	137.2	77%	0.771	72%	0.724	S	S	*	*			trans	-138.1	124.8	-165.8	171.8	-172.4	-7.2	0	0	110.2
74	T	29.8	Very low	31.5	Very low	138 Å²	138	133.5 Å²	133.5	85%	0.847	71%	0.709	S	S	*	*			trans	-152.9	139.3	164.1	47.1	0	0	0	0	110.8
75	D	26.1	Very low	32.2	Very low	128 Å²	128	129.9 Å²	129.9	68%	0.684	68%	0.683	S	S	*	*			trans	-86.7	162.4	-173.4	-37.7	-90	0	0	0	112.7
76	N	30.3	Very low	32.8	Very low	166 Å²	166	125 Å²	125	89%	0.888	66%	0.658	S	S	*	*			trans	-171.8	138.4	145.9	-105.9	-70.6	0	0	0	111.6
77	D	27.1	Very low	33.1	Very low	145 Å²	145	117.4 Å²	117.4	78%	0.775	63%	0.625	S	S	*	*			trans	-80.2	143.9	178.9	-61.2	-76.6	0	0	0	113.2
78	N	31.1	Very low	33.5	Very low	151 Å²	151	114.5 Å²	114.5	81%	0.807	61%	0.613	S	S	*	*			trans	177.4	100	142.4	-99.2	-61.5	0	0	0	111.1
79	L	31	Very low	33.7	Very low	181 Å²	181	114.2 Å²	114.2	95%	0.948	61%	0.611	S	S	*	*			trans	-101.4	113.7	167	-81.5	103.9	0	0	0	111.1
80	T	34.1	Very low	33.9	Very low	64 Å²	64	113.6 Å²	113.6	39%	0.393	61%	0.614	S	S	.	*			trans	-106.3	146	171.1	54	0	0	0	0	110.9	S82	T80-S82 PolarHBondContact O-N 3Å; T80-S82 VanDerWaalsContact O-N 3.13Å
81	P	37.4	Very low	33.8	Very low	79 Å²	79	112.7 Å²	112.7	51%	0.513	61%	0.61	S	S	.	*			trans	-75.9	103.7	-179.8	30.2	-33.3	0	0	0	110.7
82	S	39.6	Very low	34	Very low	49 Å²	49	115.3 Å²	115.3	34%	0.343	62%	0.619	S	S	.	*			trans	-136	140.5	170.6	63.2	0	0	0	0	110.6	T80 L171	T80-S82 PolarHBondContact O-N 3Å; T80-S82 VanDerWaalsContact O-N 3.13Å; S82-L171 WeakPolarHBondContact CA-O 3.42Å
83	I	46.2	Very low	33.8	Very low	51 Å²	51	117.6 Å²	117.6	26%	0.262	62%	0.616	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-99.7	132	173.1	-64.7	174.2	0	0	0	108.8	L85 K170 L171 L219 A222	I83-L85 HydrophobicContact CG2-CD2 4.24Å; I83-K170 VanDerWaalsContact O-CA 3.29Å; I83-K170 WeakPolarHBondContact O-CA 3.48Å; I83-L171 PolarHBondContact N-O 2.87Å; I83-L171 VanDerWaalsContact N-O 3.09Å; I83-L171 PolarHBondContact O-N 2.82Å; I83-L219 HydrophobicContact CD1-CD2 3.78Å; I83-A222 HydrophobicContact CB-CB 4.24Å; I83-A222 HydrophobicContact CD1-CB 3.76Å; I83-A222 HydrophobicContact CG2-CB 3.84Å
84	I	50.1	Low	34	Very low	86 Å²	86	115.9 Å²	115.9	44%	0.441	62%	0.62	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-102.1	129.8	171.7	-47.8	-179.1	0	0	0	108.7	T86 K170	I84-T86 HydrophobicContact CG2-CG2 3.85Å; I84-T86 PolarHBondContact O-N 2.92Å; I84-K170 HydrophobicContact CG1-CD 4.38Å; I84-K170 HydrophobicContact CG1-CG 4.24Å; I84-K170 HydrophobicContact CG2-CG 4.49Å
85	L	43	Very low	33.9	Very low	10 Å²	10	115.8 Å²	115.8	5%	0.052	62%	0.623	C	S	.	*			trans	-93.3	78.9	179.3	-65.9	179.6	0	0	0	112.3	I83 L169 L171 A222 I225 R226	I83-L85 HydrophobicContact CG2-CD2 4.24Å; L85-L169 HydrophobicContact CD1-CB 4.46Å; L85-L169 PolarHBondContact N-O 2.82Å; L85-L171 HydrophobicContact CD1-CD1 4.16Å; L85-A222 HydrophobicContact CD2-CB 4.12Å; L85-I225 HydrophobicContact CD1-CB 4.21Å; L85-I225 HydrophobicContact CD1-CG2 3.68Å; L85-R226 HydrophobicContact CD2-CB 4.28Å
86	T	40.4	Very low	34	Very low	41 Å²	41	117.8 Å²	117.8	25%	0.252	63%	0.628	S	S	.	*			trans	-96.2	141	172.5	62.9	0	0	0	0	112.4	I84 D88 R226	I84-T86 HydrophobicContact CG2-CG2 3.85Å; I84-T86 PolarHBondContact O-N 2.92Å; T86-D88 WeakPolarHBondContact CB-OD2 3.49Å; T86-D88 PolarHBondContact O-N 2.93Å; T86-D88 PolarHBondContact OG1-OD2 2.78Å; T86-R226 VanDerWaalsContact O-CZ 3.23Å; T86-R226 PolarHBondContact O-NH1 2.91Å; T86-R226 PolarHBondContact O-NH2 2.96Å
87	S	37.3	Very low	33.9	Very low	22 Å²	22	118.4 Å²	118.4	15%	0.154	63%	0.626	C	S	.	*			trans	-93.9	83.3	173.2	40.9	0	0	0	0	111.1	N164 N166	S87-N164 PolarHBondContact O-ND2 3.45Å; S87-N166 PolarHBondContact N-OD1 2.83Å; S87-N166 PolarHBondContact OG-OD1 2.84Å
88	D	33.4	Very low	33.9	Very low	104 Å²	104	115.6 Å²	115.6	56%	0.556	63%	0.631	S	S	*	*			trans	-113.4	92.3	177.9	-59	-59.1	0	0	0	111	T86	T86-D88 WeakPolarHBondContact CB-OD2 3.49Å; T86-D88 PolarHBondContact O-N 2.93Å; T86-D88 PolarHBondContact OG1-OD2 2.78Å
89	D	37.2	Very low	33.7	Very low	156 Å²	156	113.6 Å²	113.6	83%	0.834	63%	0.628	S	S	*	*			trans	-138.4	129.2	154.6	-93.9	-55	0	0	0	106.5
90	T	30	Very low	33.7	Very low	126 Å²	126	113.7 Å²	113.7	77%	0.773	63%	0.628	S	S	*	*			trans	-100	152.8	-165.7	50	0	0	0	0	113.7
91	D	27.6	Very low	33.3	Very low	153 Å²	153	115.2 Å²	115.2	82%	0.818	64%	0.642	S	S	*	*			trans	67	113.8	177.2	-59.5	-32	0	0	0	116.3
92	W	28.2	Very low	32.9	Very low	257 Å²	257	116.1 Å²	116.1	97%	0.973	65%	0.649	S	S	*	*			trans	-164.5	150.2	135.8	-116	52.7	0	0	0	109.1
93	K	25.5	Very low	32.4	Very low	198 Å²	198	122.7 Å²	122.7	86%	0.861	68%	0.677	S	S	*	*			trans	-115.6	129.3	178.3	-74.5	-172	175.4	-174.5	0	111
94	P	28.2	Very low	31.6	Very low	129 Å²	129	128.7 Å²	128.7	84%	0.838	70%	0.704	S	S	*	*			trans	-77.6	153.3	168.7	33	-33.5	0	0	0	111.2
95	C	27.7	Very low	30.5	Very low	135 Å²	135	129.3 Å²	129.3	91%	0.912	72%	0.716	S	S	*	*			trans	-115.4	160.6	172.4	-149.8	0	0	0	0	110.3
96	E	29.5	Very low	29.7	Very low	171 Å²	171	136.2 Å²	136.2	80%	0.799	75%	0.752	S	S	*	*			trans	-89.6	143.8	-155.9	-64.5	-174.1	116.2	0	0	116.8
97	Q	27.1	Very low	29.1	Very low	179 Å²	179	138.8 Å²	138.8	84%	0.836	77%	0.771	S	S	*	*			trans	22.7	124.1	144.5	-52.2	-173.6	23	0	0	120.5
98	G	28.2	Very low	28.5	Very low	85 Å²	85	145.5 Å²	145.5	88%	0.876	81%	0.805	S	S	*	*			trans	-146	104.8	155.8	0	0	0	0	0	110.3
99	S	25.6	Very low	28.2	Very low	109 Å²	109	146 Å²	146	76%	0.762	82%	0.817	S	S	*	*			trans	-111.1	137.1	-172.7	57.6	0	0	0	0	113
100	I	31.9	Very low	27.7	Very low	183 Å²	183	145 Å²	145	94%	0.938	82%	0.819	S	S	*	*			trans	-148	155.3	161.5	-101.2	151.6	0	0	0	108.6
101	S	26.2	Very low	27.6	Very low	97 Å²	97	144.4 Å²	144.4	68%	0.678	82%	0.82	S	S	*	*			trans	-120.1	168.4	-160.6	60.8	0	0	0	0	115.2
102	S	29.1	Very low	27.5	Very low	97 Å²	97	143.3 Å²	143.3	68%	0.678	82%	0.821	S	S	*	*			trans	55.3	119.2	142	59.9	0	0	0	0	120.7
103	M	28.8	Very low	27.3	Very low	188 Å²	188	142.2 Å²	142.2	93%	0.926	82%	0.817	S	S	*	*				-169.1	175.1	101.9	-102.2	172	66.2	0	0	112
104	E	28	Very low	27.3	Very low	176 Å²	176	139.1 Å²	139.1	82%	0.822	82%	0.815	S	S	*	*			trans	-113	151.6	-157.1	-59.7	173.1	103.2	0	0	115.2
105	S	26.9	Very low	27.3	Very low	100 Å²	100	138.4 Å²	138.4	70%	0.699	81%	0.813	S	S	*	*			trans	52.1	138.6	143.2	68.2	0	0	0	0	122.4
106	I	27.6	Very low	27.2	Very low	155 Å²	155	141.7 Å²	141.7	80%	0.795	81%	0.808	S	S	*	*				-179.8	142.4	114.3	-94.1	159.4	0	0	0	113.4
107	S	26.6	Very low	27.2	Very low	95 Å²	95	138.3 Å²	138.3	66%	0.664	80%	0.795	S	S	*	*			trans	41.6	115.9	161.6	69.9	0	0	0	0	123.9
108	N	25.4	Very low	27.3	Very low	162 Å²	162	135.2 Å²	135.2	87%	0.866	79%	0.793	S	S	*	*				31.8	116.3	121.9	-58.1	-8.2	0	0	0	121.2
109	S	26.3	Very low	27.3	Very low	115 Å²	115	139.1 Å²	139.1	80%	0.804	79%	0.793	S	S	*	*			trans	-147.2	150.7	134.6	62.5	0	0	0	0	110.6
110	P	27	Very low	27.5	Very low	134 Å²	134	139.3 Å²	139.3	87%	0.87	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-91	122.3	-171.8	33.4	-32.7	0	0	0	113.2
111	S	27.4	Very low	27.3	Very low	114 Å²	114	139 Å²	139	80%	0.797	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-89.8	150.2	170.9	43.3	0	0	0	0	112.5
112	P	26	Very low	27.3	Very low	130 Å²	130	144.5 Å²	144.5	84%	0.844	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-80.8	170.3	-167.2	31.7	-36.8	0	0	0	115.5
113	R	24.5	Very low	27.1	Very low	234 Å²	234	141.8 Å²	141.8	88%	0.883	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-71.4	162.5	-172.7	-72.1	170.5	158.1	170.4	-8.3	115.3
114	T	26.1	Very low	27.3	Very low	134 Å²	134	137.5 Å²	137.5	82%	0.822	75%	0.752	S	S	*	*			trans	83.7	140.6	165.8	77	0	0	0	0	114.8
115	S	28.7	Very low	27.5	Very low	114 Å²	114	136 Å²	136	80%	0.797	75%	0.75	S	S	*	*			cis	-130.3	167.7	7.5	61.6	0	0	0	0	113.8
116	Y	24.6	Very low	28.1	Very low	204 Å²	204	135.9 Å²	135.9	80%	0.8	74%	0.741	S	S	*	*			trans	-68.2	139.8	-166	-72.9	-111.1	0	0	0	114.2
117	N	29.5	Very low	29.1	Very low	100 Å²	100	132.7 Å²	132.7	54%	0.535	74%	0.738	S	S	.	*	S	Bend	trans	-177.8	-11.9	136.4	-94.6	-9.9	0	0	0	114.2	F25	F25-N117 WeakPolarHBondContact CE2-OD1 3.39Å
118	S	29.6	Very low	30.3	Very low	113 Å²	113	136.4 Å²	136.4	79%	0.79	74%	0.743	S	S	*	*	S	Bend	trans	-96.5	20.7	-174.1	-46.8	0	0	0	0	116.2
119	L	27.4	Very low	31.8	Very low	167 Å²	167	132.7 Å²	132.7	87%	0.874	72%	0.723	S	S	*	*			trans	-129.6	35.1	-171.4	-82.5	174.5	0	0	0	115.2
120	L	29.8	Very low	33.7	Very low	113 Å²	113	130 Å²	130	59%	0.592	70%	0.698	S	S	*	*			trans	-119.1	35.8	159.7	-91.9	166.6	0	0	0	112.8	F25 W122	F25-L120 HydrophobicContact CD1-CD1 4.06Å; F25-L120 HydrophobicContact CE1-CD1 3.65Å; L120-W122 PolarHBondContact O-N 3.12Å
121	H	27.3	Very low	35.7	Very low	177 Å²	177	129.6 Å²	129.6	82%	0.819	68%	0.678	S	S	*	*			trans	-64.8	80.6	150.5	-101.9	-75.1	0	0	0	109.3	G123	H121-G123 VanDerWaalsContact C-N 3.29Å; H121-G123 PolarHBondContact O-N 3.24Å; H121-G123 VanDerWaalsContact O-N 3.14Å
122	W	26.2	Very low	37.6	Very low	212 Å²	212	131 Å²	131	80%	0.803	67%	0.673	S	S	*	*			trans	-65.6	102.5	142.1	-75.6	89.8	0	0	0	105.6	L120 I124	L120-W122 PolarHBondContact O-N 3.12Å; W122-I124 PolarHBondContact O-N 2.81Å; W122-I124 VanDerWaalsContact O-N 3.14Å
123	G	25.8	Very low	39.8	Very low	40 Å²	40	127.7 Å²	127.7	41%	0.412	64%	0.644	S	S	.	*			trans	-61.4	116.9	176.5	0	0	0	0	0	109	H121 N125	H121-G123 VanDerWaalsContact C-N 3.29Å; H121-G123 PolarHBondContact O-N 3.24Å; H121-G123 VanDerWaalsContact O-N 3.14Å; G123-N125 WeakPolarHBondContact CA-OD1 3.47Å; G123-N125 PolarHBondContact O-N 3.36Å
124	I	33.1	Very low	42.3	Very low	98 Å²	98	116.7 Å²	116.7	50%	0.503	60%	0.602	S	S	.	*			trans	-73.8	70.1	169.3	-52.3	178.8	0	0	0	106.8	W122 N126 D129 E130	W122-I124 PolarHBondContact O-N 2.81Å; W122-I124 VanDerWaalsContact O-N 3.14Å; I124-N126 PolarHBondContact O-N 2.65Å; I124-D129 HydrophobicContact CG2-CB 4.49Å; I124-E130 HydrophobicContact CG2-CB 4Å
125	N	31.6	Very low	44.6	Very low	146 Å²	146	114.1 Å²	114.1	78%	0.781	58%	0.583	S	S	*	*			trans	-84.1	8.5	-173.1	-64.7	-5.1	0	0	0	111.8	G123	G123-N125 WeakPolarHBondContact CA-OD1 3.47Å; G123-N125 PolarHBondContact O-N 3.36Å
126	N	39.6	Very low	46.7	Very low	96 Å²	96	112.3 Å²	112.3	51%	0.513	57%	0.565	S	S	.	*			trans	-128.5	123.6	177.6	-65.2	-43.3	0	0	0	110	I124 K128 D129	I124-N126 PolarHBondContact O-N 2.65Å; N126-K128 PolarHBondContact O-N 2.68Å; N126-K128 VanDerWaalsContact O-N 3.16Å; N126-D129 WeakPolarHBondContact CB-OD2 3.42Å; N126-D129 PolarHBondContact ND2-OD2 3.22Å; N126-D129 VanDerWaalsContact ND2-OD2 3.16Å; N126-D129 PolarHBondContact O-N 2.99Å
127	A	48.7	Very low	49	Very low	89 Å²	89	104.2 Å²	104.2	74%	0.736	53%	0.534	S	S	*	.	H	α-helix	trans	-65.5	-15	174.9	0	0	0	0	0	114.2	R131	A127-R131 PolarHBondContact O-N 3.43Å
128	K	51	Low	51.6	Low	173 Å²	173	100 Å²	100	75%	0.752	51%	0.51	S	S	*	.	H	α-helix	trans	-68.5	-50.3	176.7	-69.6	-174	176.3	-177.7	0	111.7	N126 E130 R131 E132	N126-K128 PolarHBondContact O-N 2.68Å; N126-K128 VanDerWaalsContact O-N 3.16Å; K128-E130 PolarHBondContact O-N 2.96Å; K128-R131 PolarHBondContact O-N 3.16Å; K128-R131 VanDerWaalsContact O-N 3.13Å; K128-E132 PolarHBondContact O-N 2.87Å
129	D	58.5	Low	53.7	Low	84 Å²	84	98.6 Å²	98.6	45%	0.449	50%	0.501	S	S	.	.	H	α-helix	trans	-64.2	-34.6	-175	-46.5	-11.7	0	0	0	110.5	I124 N126 Y133	I124-D129 HydrophobicContact CG2-CB 4.49Å; N126-D129 WeakPolarHBondContact CB-OD2 3.42Å; N126-D129 PolarHBondContact ND2-OD2 3.22Å; N126-D129 VanDerWaalsContact ND2-OD2 3.16Å; N126-D129 PolarHBondContact O-N 2.99Å; D129-Y133 WeakPolarHBondContact O-CB 3.26Å; D129-Y133 PolarHBondContact O-N 2.74Å
130	E	66.1	Low	56	Low	59 Å²	59	99.3 Å²	99.3	28%	0.276	50%	0.5	S	S	.	.	H	α-helix	trans	-69.3	-40.6	174.7	-160	178	-115.9	0	0	112.8	I124 K128 Y133 L134 R249	I124-E130 HydrophobicContact CG2-CB 4Å; K128-E130 PolarHBondContact O-N 2.96Å; E130-Y133 PolarHBondContact O-N 3.49Å; E130-L134 WeakPolarHBondContact O-CG 3.08Å; E130-L134 PolarHBondContact O-N 3.44Å; E130-R249 IonicContact OE1-CZ 2.82Å; E130-R249 IonicContact OE1-NE 2.68Å; E130-R249 IonicContact OE1-NH2 2.67Å; E130-R249 PolarHBondContact OE1-NH2 3.06Å; E130-R249 IonicContact OE2-CZ 3.67Å; E130-R249 IonicContact OE2-NE 2.64Å; E130-R249 PolarHBondContact OE2-NE 3.24Å; E130-R249 IonicContact OE2-NH2 3.87Å; E130-R249 PolarHBondContact OE2-NH2 2.91Å
131	R	68.2	Low	58.5	Low	124 Å²	124	95.5 Å²	95.5	47%	0.468	48%	0.479	S	S	.	.	H	α-helix	trans	-65.1	-41.3	175.8	-167.8	177.7	-171.8	177.7	4.9	111.5	A127 K128 L134 L135 E144	A127-R131 PolarHBondContact O-N 3.43Å; K128-R131 PolarHBondContact O-N 3.16Å; K128-R131 VanDerWaalsContact O-N 3.13Å; R131-L134 PolarHBondContact O-N 3.18Å; R131-L135 HydrophobicContact CG-CD1 4Å; R131-L135 HydrophobicContact CG-CG 4.42Å; R131-L135 WeakPolarHBondContact O-CB 3.27Å; R131-L135 VanDerWaalsContact O-CG 3.28Å; R131-L135 WeakPolarHBondContact O-CG 3.39Å; R131-L135 PolarHBondContact O-N 3.16Å; R131-E144 IonicContact CZ-OE1 2.71Å; R131-E144 IonicContact NH2-OE1 3.74Å; R131-E144 PolarHBondContact NH2-OE1 2.84Å
132	E	68.1	Low	61	Low	145 Å²	145	90.2 Å²	90.2	68%	0.678	46%	0.461	S	S	*	.	H	α-helix	trans	-64.4	-42.3	176.1	-169.5	177.3	162.1	0	0	111.6	K128 L134 L135 N136	K128-E132 PolarHBondContact O-N 2.87Å; E132-L134 PolarHBondContact O-N 3.34Å; E132-L135 PolarHBondContact O-N 3.32Å; E132-N136 WeakPolarHBondContact O-CB 3.45Å; E132-N136 PolarHBondContact O-N 2.87Å
133	Y	71.4	Confident	63.7	Low	60 Å²	60	82.4 Å²	82.4	24%	0.235	45%	0.446	C	S	.	.	H	α-helix	trans	-58.5	-46.9	173.8	169.7	-102.9	0	0	0	112.5	D129 E130 N136 K137 A738 T739	D129-Y133 WeakPolarHBondContact O-CB 3.26Å; D129-Y133 PolarHBondContact O-N 2.74Å; E130-Y133 PolarHBondContact O-N 3.49Å; Y133-N136 PolarHBondContact O-N 3.38Å; Y133-K137 HydrophobicContact CE1-CD 4.37Å; Y133-K137 WeakPolarHBondContact O-CB 3.39Å; Y133-K137 PolarHBondContact O-N 3.1Å; Y133-A738 HydrophobicContact CE2-CB 4.34Å; Y133-A738 PolarHBondContact OH-O 3.03Å; Y133-T739 HydrophobicContact CD2-CG2 3.77Å; Y133-T739 HydrophobicContact CE2-CG2 3.7Å
134	L	77.5	Confident	66.7	Low	3 Å²	3	85.3 Å²	85.3	2%	0.016	45%	0.449	C	S	.	.	H	α-helix	trans	-70.2	-39	-179.9	-71.8	177.9	0	0	0	113.1	E130 R131 E132 N136 K137 Y138 I145 T147 V251	E130-L134 WeakPolarHBondContact O-CG 3.08Å; E130-L134 PolarHBondContact O-N 3.44Å; R131-L134 PolarHBondContact O-N 3.18Å; E132-L134 PolarHBondContact O-N 3.34Å; L134-N136 VanDerWaalsContact C-N 3.31Å; L134-N136 PolarHBondContact O-N 2.92Å; L134-K137 PolarHBondContact O-N 2.89Å; L134-Y138 HydrophobicContact CD2-CD2 4.42Å; L134-Y138 HydrophobicContact CD2-CE2 4.17Å; L134-Y138 PolarHBondContact O-N 2.95Å; L134-I145 HydrophobicContact CB-CG2 4.32Å; L134-T147 HydrophobicContact CD1-CG2 4.08Å; L134-T147 VanDerWaalsContact CD1-OG1 3.23Å; L134-T147 WeakPolarHBondContact CD1-OG1 3.15Å; L134-V251 HydrophobicContact CD1-CG1 4.01Å; L134-V251 HydrophobicContact CD1-CG2 3.69Å; L134-V251 HydrophobicContact CD2-CG1 4.34Å; L134-V251 HydrophobicContact CD2-CG2 4.31Å
135	L	74.3	Confident	69.4	Low	79 Å²	79	81 Å²	81	41%	0.414	43%	0.427	S	S	.	.	H	α-helix	trans	-61.5	-39.7	172.8	-75.9	168.3	0	0	0	111.6	R131 E132 S139 I145	R131-L135 HydrophobicContact CG-CD1 4Å; R131-L135 HydrophobicContact CG-CG 4.42Å; R131-L135 WeakPolarHBondContact O-CB 3.27Å; R131-L135 VanDerWaalsContact O-CG 3.28Å; R131-L135 WeakPolarHBondContact O-CG 3.39Å; R131-L135 PolarHBondContact O-N 3.16Å; E132-L135 PolarHBondContact O-N 3.32Å; L135-S139 VanDerWaalsContact O-CA 3.3Å; L135-S139 WeakPolarHBondContact O-CA 3.31Å; L135-S139 VanDerWaalsContact O-CB 3.3Å; L135-S139 WeakPolarHBondContact O-CB 3.41Å; L135-S139 PolarHBondContact O-N 2.77Å; L135-S139 VanDerWaalsContact O-N 3.15Å; L135-I145 HydrophobicContact CD2-CB 4.02Å; L135-I145 HydrophobicContact CD2-CG1 4.02Å
136	N	71.4	Confident	72.1	Confident	77 Å²	77	75.6 Å²	75.6	41%	0.412	40%	0.398	S	S	.	.	H	α-helix	trans	-70.4	-39.1	174.8	-173.2	100.3	0	0	0	111.7	E132 Y133 L134 S139 T739	E132-N136 WeakPolarHBondContact O-CB 3.45Å; E132-N136 PolarHBondContact O-N 2.87Å; Y133-N136 PolarHBondContact O-N 3.38Å; L134-N136 VanDerWaalsContact C-N 3.31Å; L134-N136 PolarHBondContact O-N 2.92Å; N136-S139 WeakPolarHBondContact O-CB 3.49Å; N136-S139 PolarHBondContact O-OG 3.04Å; N136-T739 VanDerWaalsContact ND2-CB 3.34Å; N136-T739 WeakPolarHBondContact ND2-CB 3.37Å; N136-T739 WeakPolarHBondContact ND2-CG2 3.33Å
137	K	73.1	Confident	74.4	Confident	34 Å²	34	73.4 Å²	73.4	15%	0.148	39%	0.388	C	S	.	.	H	α-helix	trans	-66.7	-38.9	179.9	-176.4	-176.3	173.2	-166.8	0	113.3	Y133 L134 E207 T739	Y133-K137 HydrophobicContact CE1-CD 4.37Å; Y133-K137 WeakPolarHBondContact O-CB 3.39Å; Y133-K137 PolarHBondContact O-N 3.1Å; L134-K137 PolarHBondContact O-N 2.89Å; K137-E207 IonicContact NZ-OE1 3.63Å; K137-E207 PolarHBondContact NZ-OE1 3.42Å; K137-T739 WeakPolarHBondContact CA-O 3.23Å
138	Y	83.9	Confident	76.3	Confident	10 Å²	10	70 Å²	70	4%	0.039	36%	0.356	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.9	24.9	-179.4	-66.4	-72.6	0	0	0	112.7	L134 E140 L141 L206 E207 Y214 V251	L134-Y138 HydrophobicContact CD2-CD2 4.42Å; L134-Y138 HydrophobicContact CD2-CE2 4.17Å; L134-Y138 PolarHBondContact O-N 2.95Å; Y138-E140 PolarHBondContact O-N 3.3Å; Y138-L141 HydrophobicContact CD1-CD1 3.91Å; Y138-L141 HydrophobicContact CG-CD1 4.49Å; Y138-L141 WeakPolarHBondContact O-CB 3.47Å; Y138-L141 PolarHBondContact O-N 3.2Å; Y138-L206 HydrophobicContact CD1-CD1 3.81Å; Y138-L206 HydrophobicContact CD1-CD2 4.34Å; Y138-L206 HydrophobicContact CD2-CD1 3.98Å; Y138-L206 HydrophobicContact CE1-CB 4.13Å; Y138-L206 HydrophobicContact CE1-CD1 4.13Å; Y138-L206 HydrophobicContact CE1-CD2 4.27Å; Y138-L206 HydrophobicContact CE1-CG 4.43Å; Y138-L206 HydrophobicContact CE2-CB 4.3Å; Y138-L206 HydrophobicContact CE2-CD1 4.3Å; Y138-L206 HydrophobicContact CG-CD1 3.72Å; Y138-E207 HydrophobicContact CE2-CG 4.35Å; Y138-E207 WeakPolarHBondContact OH-CG 3.37Å; Y138-E207 PolarHBondContact OH-OE1 3.18Å; Y138-Y214 HydrophobicContact CE1-CD1 4.06Å; Y138-Y214 AromaticContact CE1-CG 3.92Å; Y138-Y214 HydrophobicContact CE1-CG 3.92Å; Y138-V251 HydrophobicContact CE2-CG1 4.44Å
139	S	73.9	Confident	77.9	Confident	85 Å²	85	68 Å²	68	59%	0.594	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-19.1	-174.6	50.9	0	0	0	0	115.3	L135 N136	L135-S139 VanDerWaalsContact O-CA 3.3Å; L135-S139 WeakPolarHBondContact O-CA 3.31Å; L135-S139 VanDerWaalsContact O-CB 3.3Å; L135-S139 WeakPolarHBondContact O-CB 3.41Å; L135-S139 PolarHBondContact O-N 2.77Å; L135-S139 VanDerWaalsContact O-N 3.15Å; N136-S139 WeakPolarHBondContact O-CB 3.49Å; N136-S139 PolarHBondContact O-OG 3.04Å
140	E	75.9	Confident	79.1	Confident	182 Å²	182	64.2 Å²	64.2	85%	0.85	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.1	-10.2	173.9	-64.6	-170.6	-154.3	0	0	113.4	Y138	Y138-E140 PolarHBondContact O-N 3.3Å
141	L	82.3	Confident	79.6	Confident	32 Å²	32	64.3 Å²	64.3	17%	0.168	34%	0.335	C	S	.	.	S	Bend	trans	-90.3	132.8	178.4	-59.3	-177.4	0	0	0	111.4	Y138 L206 Y214 Q253	Y138-L141 HydrophobicContact CD1-CD1 3.91Å; Y138-L141 HydrophobicContact CG-CD1 4.49Å; Y138-L141 WeakPolarHBondContact O-CB 3.47Å; Y138-L141 PolarHBondContact O-N 3.2Å; L141-L206 HydrophobicContact CD1-CD1 4.04Å; L141-L206 HydrophobicContact CD1-CD2 3.62Å; L141-L206 HydrophobicContact CD1-CG 4.5Å; L141-Y214 HydrophobicContact CD1-CD2 4.22Å; L141-Y214 HydrophobicContact CD1-CE2 3.93Å; L141-Y214 HydrophobicContact CD2-CE2 3.86Å; L141-Y214 HydrophobicContact CG-CE2 4.41Å; L141-Q253 HydrophobicContact CB-CG 4.13Å; L141-Q253 HydrophobicContact CD1-CB 4.38Å; L141-Q253 HydrophobicContact CD1-CG 4.39Å
142	P	80	Confident	79.8	Confident	67 Å²	67	58.8 Å²	58.8	44%	0.435	32%	0.315	S	S	.	.			trans	-73.7	150.1	175.8	31.9	-35.5	0	0	0	111.3	Q253 H255	P142-Q253 WeakPolarHBondContact O-CG 3.47Å; P142-Q253 PolarHBondContact O-NE2 3.29Å; P142-H255 WeakPolarHBondContact O-CB 3.37Å
143	G	84.1	Confident	79.2	Confident	48 Å²	48	55 Å²	55	50%	0.495	31%	0.305	S	S	.	.	S	Bend	trans	100.2	-162.6	176.2	0	0	0	0	0	114.5	R254	G143-R254 WeakPolarHBondContact CA-O 3.24Å
144	E	88.5	Confident	78.1	Confident	100 Å²	100	56.1 Å²	56.1	47%	0.467	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	129.6	-178.5	-172.9	167.5	-161.9	0	0	111.3	R131 I146 Q253 R254	R131-E144 IonicContact CZ-OE1 2.71Å; R131-E144 IonicContact NH2-OE1 3.74Å; R131-E144 PolarHBondContact NH2-OE1 2.84Å; E144-I146 HydrophobicContact CB-CG1 4.39Å; E144-I146 HydrophobicContact CG-CG1 3.91Å; E144-Q253 WeakPolarHBondContact O-CA 3.34Å; E144-R254 PolarHBondContact N-O 3.09Å; E144-R254 PolarHBondContact O-N 2.92Å
145	I	88.9	Confident	76.9	Confident	8 Å²	8	57.5 Å²	57.5	4%	0.041	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	111.8	167.4	-49.9	-56.1	0	0	0	108	L134 L135 L206 V251 I252 Q253	L134-I145 HydrophobicContact CB-CG2 4.32Å; L135-I145 HydrophobicContact CD2-CB 4.02Å; L135-I145 HydrophobicContact CD2-CG1 4.02Å; I145-L206 HydrophobicContact CD1-CD1 3.99Å; I145-V251 HydrophobicContact CG2-CG1 3.93Å; I145-I252 WeakPolarHBondContact CA-O 3.45Å; I145-Q253 HydrophobicContact CD1-CB 3.81Å; I145-Q253 HydrophobicContact CD1-CG 4.1Å
146	I	89.2	Confident	75.2	Confident	33 Å²	33	59.7 Å²	59.7	17%	0.169	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	144.7	179.6	-54.5	172.8	0	0	0	108.2	E144 F148 I252 R254	E144-I146 HydrophobicContact CB-CG1 4.39Å; E144-I146 HydrophobicContact CG-CG1 3.91Å; I146-F148 HydrophobicContact CG2-CD1 4.46Å; I146-I252 HydrophobicContact CB-CD1 4.16Å; I146-I252 HydrophobicContact CB-CG1 3.74Å; I146-I252 HydrophobicContact CG2-CD1 4.44Å; I146-I252 HydrophobicContact CG2-CG1 4.39Å; I146-I252 PolarHBondContact N-O 3.34Å; I146-I252 PolarHBondContact O-N 2.95Å; I146-R254 HydrophobicContact CD1-CB 3.87Å
147	T	88.4	Confident	73.8	Confident	49 Å²	49	59.4 Å²	59.4	30%	0.301	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	127.9	179.1	-61.9	0	0	0	0	108.8	L134 F250 V251	L134-T147 HydrophobicContact CD1-CG2 4.08Å; L134-T147 VanDerWaalsContact CD1-OG1 3.23Å; L134-T147 WeakPolarHBondContact CD1-OG1 3.15Å; T147-F250 WeakPolarHBondContact CA-O 3.43Å; T147-V251 HydrophobicContact CG2-CG2 4.14Å
148	F	87.8	Confident	72	Confident	18 Å²	18	65.4 Å²	65.4	8%	0.079	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	159.7	-177.8	66.8	-80.9	0	0	0	109.9	I146 L150 D196 H198 I199 R249 F250 I252	I146-F148 HydrophobicContact CG2-CD1 4.46Å; F148-L150 HydrophobicContact CE2-CB 4.38Å; F148-D196 WeakPolarHBondContact CE2-OD2 3.39Å; F148-H198 HydrophobicContact CD1-CB 3.81Å; F148-H198 HydrophobicContact CD2-CB 3.7Å; F148-H198 AromaticContact CD2-CG 3.82Å; F148-H198 AromaticContact CD2-ND1 3.75Å; F148-H198 HydrophobicContact CE1-CB 3.88Å; F148-H198 HydrophobicContact CE2-CB 3.76Å; F148-H198 HydrophobicContact CG-CB 3.74Å; F148-H198 AromaticContact CG-CG 3.88Å; F148-H198 HydrophobicContact CZ-CB 3.87Å; F148-I199 HydrophobicContact CE1-CG1 4.02Å; F148-I199 HydrophobicContact CE2-CG1 4.49Å; F148-I199 HydrophobicContact CZ-CD1 3.89Å; F148-I199 HydrophobicContact CZ-CG1 3.49Å; F148-I199 VanDerWaalsContact CZ-CG1 3.49Å; F148-R249 CarbonylContact O-C 3.56Å; F148-R249 WeakPolarHBondContact O-CA 3.5Å; F148-F250 HydrophobicContact CD1-CB 4.18Å; F148-F250 HydrophobicContact CE1-CB 3.53Å; F148-F250 HydrophobicContact CE1-CD2 4.47Å; F148-F250 HydrophobicContact CE1-CG 4.22Å; F148-F250 HydrophobicContact CE2-CB 4.24Å; F148-F250 AromaticContact CE2-CD2 3.76Å; F148-F250 HydrophobicContact CE2-CD2 3.76Å; F148-F250 HydrophobicContact CE2-CG 4.32Å; F148-F250 HydrophobicContact CZ-CB 3.54Å; F148-F250 AromaticContact CZ-CD2 3.61Å; F148-F250 HydrophobicContact CZ-CD2 3.61Å; F148-F250 HydrophobicContact CZ-CE2 4.46Å; F148-F250 AromaticContact CZ-CG 3.73Å; F148-F250 HydrophobicContact CZ-CG 3.73Å; F148-F250 PolarHBondContact N-O 2.76Å; F148-F250 PolarHBondContact O-N 3.23Å; F148-I252 HydrophobicContact CE1-CD1 4.12Å
149	E	85.1	Confident	69.7	Low	130 Å²	130	69.7 Å²	69.7	61%	0.607	41%	0.412	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.1	120.3	178	-179.1	172.9	-172.8	0	0	108.7	P151 A247	E149-P151 WeakPolarHBondContact O-CD 3.04Å; E149-A247 HydrophobicContact CG-CB 3.46Å; E149-A247 VanDerWaalsContact CG-CB 3.46Å; E149-A247 VanDerWaalsContact OE1-CB 3.32Å; E149-A247 WeakPolarHBondContact OE1-CB 3.39Å
150	L	83.8	Confident	67.8	Low	5 Å²	5	69.2 Å²	69.2	3%	0.026	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	99.2	-177.7	176.2	74.1	0	0	0	110.3	F148 L152 L167 I192 I193 D196 A247 L248 F250	F148-L150 HydrophobicContact CE2-CB 4.38Å; L150-L152 HydrophobicContact CD2-CD2 4.18Å; L150-L152 HydrophobicContact CG-CD2 4.4Å; L150-L152 PolarHBondContact O-N 3.25Å; L150-L152 VanDerWaalsContact O-N 3.11Å; L150-L167 HydrophobicContact CD2-CD1 4.1Å; L150-I192 HydrophobicContact CD1-CG2 3.85Å; L150-I192 HydrophobicContact CD2-CG2 3.84Å; L150-I192 HydrophobicContact CG-CG2 4.14Å; L150-I193 HydrophobicContact CD1-CD1 4.49Å; L150-I193 HydrophobicContact CD2-CD1 3.68Å; L150-D196 HydrophobicContact CD1-CB 3.39Å; L150-D196 WeakPolarHBondContact CD1-OD1 3.23Å; L150-A247 CarbonylContact O-C 3.56Å; L150-A247 WeakPolarHBondContact O-CA 3.42Å; L150-A247 VanDerWaalsContact O-CB 3.23Å; L150-A247 WeakPolarHBondContact O-CB 3.42Å; L150-L248 HydrophobicContact CB-CB 4.25Å; L150-L248 WeakPolarHBondContact CB-O 3.4Å; L150-L248 HydrophobicContact CD2-CB 4.3Å; L150-L248 HydrophobicContact CD2-CD1 4.26Å; L150-L248 HydrophobicContact CD2-CG 4.42Å; L150-L248 PolarHBondContact N-O 2.85Å; L150-L248 PolarHBondContact O-N 3.42Å; L150-F250 HydrophobicContact CD2-CE2 4.1Å
151	P	75.3	Confident	66	Low	61 Å²	61	68.4 Å²	68.4	40%	0.396	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	102.8	-176.7	30.4	-36.6	0	0	0	112.3	E149 S153 S154	E149-P151 WeakPolarHBondContact O-CD 3.04Å; P151-S153 PolarHBondContact O-N 2.97Å; P151-S154 PolarHBondContact O-N 3Å; P151-S154 PolarHBondContact O-OG 2.77Å
152	L	72.1	Confident	63.8	Low	8 Å²	8	75.6 Å²	75.6	4%	0.042	44%	0.437	C	S	.	.	G	3₁₀ helix	trans	-73.7	-5.6	174.4	-64.1	177.2	0	0	0	112.7	L150 S154 L155 I192 Y229 V232 I233 N246 L248	L150-L152 HydrophobicContact CD2-CD2 4.18Å; L150-L152 HydrophobicContact CG-CD2 4.4Å; L150-L152 PolarHBondContact O-N 3.25Å; L150-L152 VanDerWaalsContact O-N 3.11Å; L152-S154 VanDerWaalsContact C-N 3.28Å; L152-S154 PolarHBondContact O-N 3.18Å; L152-L155 HydrophobicContact CB-CD1 4.33Å; L152-L155 HydrophobicContact CD2-CD1 3.87Å; L152-L155 WeakPolarHBondContact O-CB 2.98Å; L152-L155 PolarHBondContact O-N 3.21Å; L152-I192 HydrophobicContact CD2-CD1 3.72Å; L152-I192 HydrophobicContact CD2-CG2 3.94Å; L152-Y229 HydrophobicContact CD1-CD2 4.31Å; L152-Y229 HydrophobicContact CD1-CE2 4.46Å; L152-V232 HydrophobicContact CB-CG1 4.03Å; L152-V232 HydrophobicContact CD1-CB 3.96Å; L152-V232 HydrophobicContact CD1-CG1 3.5Å; L152-V232 HydrophobicContact CG-CG1 4.26Å; L152-I233 HydrophobicContact CD1-CG1 4.02Å; L152-N246 PolarHBondContact N-O 3.08Å; L152-L248 HydrophobicContact CD1-CD1 4.3Å; L152-L248 HydrophobicContact CD1-CD2 4.1Å; L152-L248 HydrophobicContact CD1-CG 3.81Å
153	S	56.4	Low	62.2	Low	66 Å²	66	81.4 Å²	81.4	46%	0.462	46%	0.456	S	S	.	.	G	3₁₀ helix	trans	-68.8	-21	169.5	48.8	0	0	0	0	114.2	P151 L155 N246	P151-S153 PolarHBondContact O-N 2.97Å; S153-L155 PolarHBondContact O-N 2.71Å; S153-N246 PolarHBondContact N-O 3.27Å
154	S	48.9	Very low	60.8	Low	83 Å²	83	84.1 Å²	84.1	58%	0.58	46%	0.459	S	S	*	.	G	3₁₀ helix	trans	-74.4	-3.4	176.7	65.3	0	0	0	0	113.9	P151 L152 T156	P151-S154 PolarHBondContact O-N 3Å; P151-S154 PolarHBondContact O-OG 2.77Å; L152-S154 VanDerWaalsContact C-N 3.28Å; L152-S154 PolarHBondContact O-N 3.18Å; S154-T156 PolarHBondContact O-N 3.15Å
155	L	52	Low	59.5	Low	32 Å²	32	82.4 Å²	82.4	17%	0.168	46%	0.455	C	S	.	.			trans	-75.3	61.2	177.1	-69.9	169.2	0	0	0	112.7	L152 S153 V157 V165 I192 I233	L152-L155 HydrophobicContact CB-CD1 4.33Å; L152-L155 HydrophobicContact CD2-CD1 3.87Å; L152-L155 WeakPolarHBondContact O-CB 2.98Å; L152-L155 PolarHBondContact O-N 3.21Å; S153-L155 PolarHBondContact O-N 2.71Å; L155-V157 HydrophobicContact CD2-CG2 3.73Å; L155-V165 HydrophobicContact CD1-CG1 4.04Å; L155-V165 HydrophobicContact CD2-CG1 3.74Å; L155-I192 HydrophobicContact CD1-CD1 4.04Å; L155-I192 HydrophobicContact CD1-CG1 4.37Å; L155-I192 HydrophobicContact CD2-CG1 4.37Å; L155-I233 HydrophobicContact CD1-CD1 4.18Å
156	T	38.5	Very low	58.7	Low	125 Å²	125	83 Å²	83	77%	0.767	46%	0.458	S	S	*	.			trans	-101.9	57.5	150.3	54	0	0	0	0	108.1	S154	S154-T156 PolarHBondContact O-N 3.15Å
157	V	41.3	Very low	58.4	Low	71 Å²	71	81.4 Å²	81.4	43%	0.43	45%	0.45	S	S	.	.			trans	-65.8	137.4	174.2	178.2	0	0	0	0	108.5	L155	L155-V157 HydrophobicContact CD2-CG2 3.73Å
158	E	35.3	Very low	58.3	Low	160 Å²	160	79.1 Å²	79.1	75%	0.748	44%	0.436	S	S	*	.			trans	-53.2	137	-170.2	-62.8	165.3	158.9	0	0	112.3	S160	E158-S160 PolarHBondContact O-N 2.83Å
159	A	36.1	Very low	58.3	Low	101 Å²	101	78.2 Å²	78.2	84%	0.835	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.7	28.6	-167.6	0	0	0	0	0	114.8
160	S	33.3	Very low	58.6	Low	74 Å²	74	74.3 Å²	74.3	52%	0.517	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.5	-23.3	-173.3	52.9	0	0	0	0	114.2	E158	E158-S160 PolarHBondContact O-N 2.83Å
161	H	39.7	Very low	59	Low	165 Å²	165	74 Å²	74	76%	0.764	41%	0.412	S	S	*	.			trans	-131.5	101	-173.5	-70.5	-15.7	0	0	0	113.2	K163	H161-K163 PolarHBondContact O-N 2.67Å
162	H	34.7	Very low	59.7	Low	184 Å²	184	71.1 Å²	71.1	85%	0.852	39%	0.393	S	S	*	.			trans	-73.6	79.2	179.4	-57.5	-67.2	0	0	0	113.1
163	K	47.6	Very low	60.5	Low	189 Å²	189	71 Å²	71	82%	0.822	39%	0.393	S	S	*	.			trans	-134	142.7	165.2	-71.5	-175	178.2	175.8	0	110.6	H161 V165	H161-K163 PolarHBondContact O-N 2.67Å; K163-V165 PolarHBondContact O-N 2.9Å
164	N	53.5	Low	61.8	Low	104 Å²	104	68.4 Å²	68.4	56%	0.556	38%	0.375	S	S	*	.			trans	-57.4	133.3	-177.3	-67.4	-0.5	0	0	0	110.7	S87 N166	S87-N164 PolarHBondContact O-ND2 3.45Å; N164-N166 PolarHBondContact O-N 3.22Å
165	V	61.7	Low	63.5	Low	64 Å²	64	73.3 Å²	73.3	39%	0.388	38%	0.381	S	S	.	.			trans	-73.8	111	174.6	-173.9	0	0	0	0	108	L155 K163 I192 Y229	L155-V165 HydrophobicContact CD1-CG1 4.04Å; L155-V165 HydrophobicContact CD2-CG1 3.74Å; K163-V165 PolarHBondContact O-N 2.9Å; V165-I192 HydrophobicContact CG1-CD1 3.58Å; V165-I192 HydrophobicContact CG1-CG1 3.47Å; V165-I192 VanDerWaalsContact CG1-CG1 3.47Å; V165-Y229 PolarHBondContact O-OH 3.44Å
166	N	71.9	Confident	64.9	Low	20 Å²	20	74.6 Å²	74.6	11%	0.107	39%	0.388	C	S	.	.			trans	-100.9	149	177	-69.8	-9.4	0	0	0	111	S87 N164 G168 Q188 I192 Y229	S87-N166 PolarHBondContact N-OD1 2.83Å; S87-N166 PolarHBondContact OG-OD1 2.84Å; N164-N166 PolarHBondContact O-N 3.22Å; N166-G168 VanDerWaalsContact C-N 3.31Å; N166-G168 PolarHBondContact O-N 3.29Å; N166-Q188 PolarHBondContact ND2-OE1 2.76Å; N166-I192 PolarHBondContact O-N 2.85Å; N166-I192 VanDerWaalsContact O-N 3.16Å; N166-Y229 VanDerWaalsContact C-OH 3.23Å; N166-Y229 WeakPolarHBondContact CA-OH 3.33Å
167	L	83.8	Confident	66.6	Low	1 Å²	1	76.6 Å²	76.6	1%	0.005	39%	0.393	C	S	.	.			trans	-63	-40.4	171.3	-172	64.5	0	0	0	110.9	L150 L169 I193 I225 Y229 L248	L150-L167 HydrophobicContact CD2-CD1 4.1Å; L167-L169 HydrophobicContact CD2-CD1 3.95Å; L167-L169 HydrophobicContact CD2-CG 4.44Å; L167-L169 HydrophobicContact CG-CD1 4.34Å; L167-L169 HydrophobicContact CG-CG 4.38Å; L167-I193 HydrophobicContact CD1-CD1 4.01Å; L167-I193 HydrophobicContact CD1-CG1 3.78Å; L167-I193 HydrophobicContact CG-CG1 4.04Å; L167-I193 WeakPolarHBondContact O-CB 3.41Å; L167-I193 VanDerWaalsContact O-CG1 3.28Å; L167-I193 WeakPolarHBondContact O-CG1 3.41Å; L167-I193 PolarHBondContact O-N 3.06Å; L167-I225 HydrophobicContact CD2-CG2 3.79Å; L167-Y229 HydrophobicContact CB-CD1 4.24Å; L167-Y229 HydrophobicContact CB-CD2 3.99Å; L167-Y229 HydrophobicContact CB-CE1 4.04Å; L167-Y229 HydrophobicContact CB-CE2 3.74Å; L167-Y229 HydrophobicContact CB-CG 4.22Å; L167-Y229 HydrophobicContact CD1-CD2 3.96Å; L167-Y229 HydrophobicContact CD1-CE2 3.97Å; L167-Y229 HydrophobicContact CD2-CD2 4.3Å; L167-Y229 HydrophobicContact CD2-CG 4.34Å; L167-Y229 HydrophobicContact CG-CD2 4.31Å; L167-Y229 HydrophobicContact CG-CE2 4.37Å; L167-Y229 PolarHBondContact N-OH 3.35Å; L167-Y229 VanDerWaalsContact N-OH 3.09Å; L167-L248 HydrophobicContact CD1-CD1 3.82Å; L167-L248 HydrophobicContact CD2-CD1 4.39Å
168	G	84.5	Confident	68.1	Low	0 Å²	0	80 Å²	80	0%	0	41%	0.409	C	S	.	.			trans	88.2	3.8	170	0	0	0	0	0	116.6	N166 I187 Q188	N166-G168 VanDerWaalsContact C-N 3.31Å; N166-G168 PolarHBondContact O-N 3.29Å; G168-I187 CarbonylContact O-C 3.55Å; G168-I187 WeakPolarHBondContact O-CA 3.23Å; G168-Q188 PolarHBondContact O-N 3.34Å
169	L	88.9	Confident	69.9	Low	0 Å²	0	77.6 Å²	77.6	0%	0	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	132.3	175.5	-68.3	174	0	0	0	111.8	L85 L167 L171 V184 I193 I199 F250	L85-L169 HydrophobicContact CD1-CB 4.46Å; L85-L169 PolarHBondContact N-O 2.82Å; L167-L169 HydrophobicContact CD2-CD1 3.95Å; L167-L169 HydrophobicContact CD2-CG 4.44Å; L167-L169 HydrophobicContact CG-CD1 4.34Å; L167-L169 HydrophobicContact CG-CG 4.38Å; L169-L171 HydrophobicContact CB-CD2 4.22Å; L169-V184 HydrophobicContact CD2-CG1 3.96Å; L169-V184 HydrophobicContact CD2-CG2 4.07Å; L169-I193 HydrophobicContact CD2-CB 4.47Å; L169-I193 HydrophobicContact CD2-CG1 4.23Å; L169-I193 HydrophobicContact CD2-CG2 3.98Å; L169-I193 HydrophobicContact CG-CG1 4.11Å; L169-I199 HydrophobicContact CD1-CD1 4.41Å; L169-I199 HydrophobicContact CD2-CD1 4.02Å; L169-I199 HydrophobicContact CD2-CG2 4.17Å; L169-F250 HydrophobicContact CD1-CE1 4.22Å; L169-F250 HydrophobicContact CD1-CZ 4.32Å
170	K	90.5	Very high	72.1	Confident	47 Å²	47	78.3 Å²	78.3	20%	0.204	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	132.9	157.9	-49.8	-174.5	-165.9	170.2	0	109.4	I83 I84 C185 G186 T267	I83-K170 VanDerWaalsContact O-CA 3.29Å; I83-K170 WeakPolarHBondContact O-CA 3.48Å; I84-K170 HydrophobicContact CG1-CD 4.38Å; I84-K170 HydrophobicContact CG1-CG 4.24Å; I84-K170 HydrophobicContact CG2-CG 4.49Å; K170-C185 PolarHBondContact O-N 3.22Å; K170-G186 WeakPolarHBondContact CB-O 3.49Å; K170-G186 PolarHBondContact N-O 3.47Å; K170-T267 PolarHBondContact NZ-OG1 3.08Å
171	L	92.3	Very high	74.6	Confident	0 Å²	0	75.2 Å²	75.2	0%	0	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	139.9	-173.4	-56.8	177.1	0	0	0	112.1	S82 I83 L85 L169 V182 F183 V184 L205 H218 A222 I225	S82-L171 WeakPolarHBondContact CA-O 3.42Å; I83-L171 PolarHBondContact N-O 2.87Å; I83-L171 VanDerWaalsContact N-O 3.09Å; I83-L171 PolarHBondContact O-N 2.82Å; L85-L171 HydrophobicContact CD1-CD1 4.16Å; L169-L171 HydrophobicContact CB-CD2 4.22Å; L171-V182 HydrophobicContact CB-CG1 4.46Å; L171-V182 HydrophobicContact CD1-CG1 4.3Å; L171-V182 HydrophobicContact CD2-CG1 4.2Å; L171-F183 WeakPolarHBondContact CA-O 3.3Å; L171-V184 HydrophobicContact CD2-CG2 4.3Å; L171-L205 HydrophobicContact CD2-CD1 3.72Å; L171-H218 HydrophobicContact CB-CB 4.36Å; L171-A222 HydrophobicContact CD1-CB 4.09Å; L171-I225 HydrophobicContact CD1-CD1 3.54Å
172	A	89.9	Confident	77.1	Confident	0 Å²	0	67.4 Å²	67.4	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	155.4	173.1	0	0	0	0	0	111	F183 C185 A264	A172-F183 PolarHBondContact N-O 2.8Å; A172-F183 PolarHBondContact O-N 3.47Å; A172-C185 HydrophobicContact CB-CB 3.76Å; A172-A264 HydrophobicContact CB-CB 3.8Å
173	G	88.9	Confident	79.9	Confident	5 Å²	5	58.7 Å²	58.7	5%	0.052	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	179.7	173.5	0	0	0	0	0	113	S181 H218 A263	G173-S181 WeakPolarHBondContact CA-O 3.47Å; G173-H218 WeakPolarHBondContact CA-ND1 3.45Å; G173-H218 VanDerWaalsContact N-CG 3.31Å; G173-H218 PolarHBondContact N-ND1 3.36Å; G173-H218 VanDerWaalsContact N-ND1 3.2Å; G173-A263 WeakPolarHBondContact O-CB 3.41Å; G173-A263 PolarHBondContact O-N 3.11Å
174	S	85.4	Confident	82.1	Confident	11 Å²	11	49.7 Å²	49.7	8%	0.077	25%	0.248	C	C	.	.	B	Isolated β-bridge	trans	-60.6	145.6	162.7	-169.7	0	0	0	0	111.8	D176 Q179 S181 L261	S174-D176 VanDerWaalsContact C-N 3.27Å; S174-D176 WeakPolarHBondContact CB-O 3.28Å; S174-D176 PolarHBondContact OG-N 2.88Å; S174-D176 PolarHBondContact OG-O 3.13Å; S174-Q179 WeakPolarHBondContact CB-O 3.44Å; S174-S181 WeakPolarHBondContact CB-OG 3.03Å; S174-L261 CarbonylContact C-O 3.46Å; S174-L261 WeakPolarHBondContact CA-O 2.87Å
175	R	83.4	Confident	83.9	Confident	187 Å²	187	44.9 Å²	44.9	71%	0.706	22%	0.222	S	C	*	.	S	Bend	trans	-69.9	-24.4	169.4	-170.5	174.4	-179.2	172.3	3.1	112.4	L261	R175-L261 WeakPolarHBondContact CB-O 3.43Å; R175-L261 PolarHBondContact N-O 2.76Å
176	D	82	Confident	85.2	Confident	58 Å²	58	41.8 Å²	41.8	31%	0.31	20%	0.203	S	C	.	.	S	Bend	trans	-88.1	112.1	165.9	-180	5.6	0	0	0	109.2	S174 N178 Q179	S174-D176 VanDerWaalsContact C-N 3.27Å; S174-D176 WeakPolarHBondContact CB-O 3.28Å; S174-D176 PolarHBondContact OG-N 2.88Å; S174-D176 PolarHBondContact OG-O 3.13Å; D176-N178 PolarHBondContact O-N 3Å; D176-N178 VanDerWaalsContact O-N 3.1Å; D176-N178 WeakPolarHBondContact OD1-CB 3.3Å; D176-N178 PolarHBondContact OD1-N 3.3Å; D176-N178 PolarHBondContact OD1-ND2 3.03Å; D176-Q179 HydrophobicContact CB-CB 4.29Å; D176-Q179 HydrophobicContact CB-CG 4.22Å; D176-Q179 PolarHBondContact O-N 3.24Å; D176-Q179 WeakPolarHBondContact OD2-CG 3.38Å; D176-Q179 PolarHBondContact OD2-NE2 2.89Å
177	L	74.4	Confident	86.1	Confident	168 Å²	168	42.1 Å²	42.1	88%	0.88	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-14.6	180	-65.2	171.8	0	0	0	113.4
178	N	73.5	Confident	86.1	Confident	143 Å²	143	45 Å²	45	77%	0.765	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.1	-11.1	173.6	-53.5	-65.5	0	0	0	113.1	D176	D176-N178 PolarHBondContact O-N 3Å; D176-N178 VanDerWaalsContact O-N 3.1Å; D176-N178 WeakPolarHBondContact OD1-CB 3.3Å; D176-N178 PolarHBondContact OD1-N 3.3Å; D176-N178 PolarHBondContact OD1-ND2 3.03Å
179	Q	72.2	Confident	85.9	Confident	108 Å²	108	50 Å²	50	51%	0.505	25%	0.251	S	S	.	.	S	Bend	trans	-108.1	117.3	-177.6	-69.5	179.1	47.8	0	0	111	S174 D176 S181	S174-Q179 WeakPolarHBondContact CB-O 3.44Å; D176-Q179 HydrophobicContact CB-CB 4.29Å; D176-Q179 HydrophobicContact CB-CG 4.22Å; D176-Q179 PolarHBondContact O-N 3.24Å; D176-Q179 WeakPolarHBondContact OD2-CG 3.38Å; D176-Q179 PolarHBondContact OD2-NE2 2.89Å; Q179-S181 PolarHBondContact O-N 3.2Å
180	M	82.4	Confident	85.3	Confident	117 Å²	117	52 Å²	52	58%	0.576	27%	0.272	S	S	*	.			trans	-89.5	94.4	179.2	-62.8	-170.6	-175.4	0	0	110.6	G215 L216	M180-G215 VanDerWaalsContact CB-C 3.47Å; M180-G215 WeakPolarHBondContact CB-O 3.44Å; M180-G215 CarbonylContact O-C 3.59Å; M180-G215 WeakPolarHBondContact O-CA 3.48Å; M180-G215 PolarHBondContact O-N 3.04Å; M180-L216 CarbonylContact C-O 3.53Å; M180-L216 VanDerWaalsContact C-O 3.24Å
181	S	85.5	Confident	84.9	Confident	9 Å²	9	50.1 Å²	50.1	6%	0.063	26%	0.264	C	S	.	.			trans	-134	164	171.2	67.7	0	0	0	0	112	G173 S174 Q179 F183 L216	G173-S181 WeakPolarHBondContact CA-O 3.47Å; S174-S181 WeakPolarHBondContact CB-OG 3.03Å; Q179-S181 PolarHBondContact O-N 3.2Å; S181-F183 WeakPolarHBondContact OG-CE2 3.44Å; S181-F183 WeakPolarHBondContact OG-CZ 3.4Å; S181-L216 CarbonylContact C-O 3.5Å; S181-L216 PolarHBondContact N-O 3.47Å
182	V	91.7	Very high	84.5	Confident	1 Å²	1	50.7 Å²	50.7	1%	0.006	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	113.4	-177.9	-171.7	0	0	0	0	108	L171 Q204 L205 L216 H218 A221	L171-V182 HydrophobicContact CB-CG1 4.46Å; L171-V182 HydrophobicContact CD1-CG1 4.3Å; L171-V182 HydrophobicContact CD2-CG1 4.2Å; V182-Q204 CarbonylContact O-C 3.46Å; V182-Q204 WeakPolarHBondContact O-CA 3.48Å; V182-Q204 WeakPolarHBondContact O-CG 3.35Å; V182-L205 HydrophobicContact CB-CB 4.41Å; V182-L205 HydrophobicContact CG1-CB 4.44Å; V182-L205 HydrophobicContact CG1-CD1 4.16Å; V182-L205 HydrophobicContact CG1-CG 4.47Å; V182-L205 PolarHBondContact O-N 2.85Å; V182-L216 WeakPolarHBondContact CG2-O 3.26Å; V182-H218 HydrophobicContact CG1-CB 4.39Å; V182-A221 HydrophobicContact CB-CB 4.43Å; V182-A221 HydrophobicContact CG1-CB 4.08Å; V182-A221 HydrophobicContact CG2-CB 3.53Å
183	F	93.8	Very high	84.4	Confident	1 Å²	1	50.7 Å²	50.7	0%	0.004	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	148.7	178.1	-59.8	-72.7	0	0	0	111.2	L171 A172 S181 C185 D203 Q204 N258 L261 M262	L171-F183 WeakPolarHBondContact CA-O 3.3Å; A172-F183 PolarHBondContact N-O 2.8Å; A172-F183 PolarHBondContact O-N 3.47Å; S181-F183 WeakPolarHBondContact OG-CE2 3.44Å; S181-F183 WeakPolarHBondContact OG-CZ 3.4Å; F183-C185 PolarHBondContact O-N 2.82Å; F183-D203 WeakPolarHBondContact CA-O 3.43Å; F183-Q204 HydrophobicContact CD1-CB 3.7Å; F183-Q204 HydrophobicContact CD1-CG 3.8Å; F183-Q204 HydrophobicContact CE1-CB 3.69Å; F183-Q204 HydrophobicContact CE1-CG 3.65Å; F183-Q204 HydrophobicContact CZ-CG 4.41Å; F183-N258 HydrophobicContact CD1-CB 4.06Å; F183-N258 HydrophobicContact CE1-CB 3.76Å; F183-L261 HydrophobicContact CE2-CB 3.84Å; F183-L261 HydrophobicContact CZ-CB 3.7Å; F183-L261 HydrophobicContact CZ-CD1 4.2Å; F183-M262 HydrophobicContact CB-CG 3.58Å; F183-M262 HydrophobicContact CB-SD 3.58Å; F183-M262 VanDerWaalsContact CB-SD 3.58Å; F183-M262 HydrophobicContact CD2-CG 3.9Å; F183-M262 HydrophobicContact CG-CG 3.79Å; F183-M262 HydrophobicContact CG-SD 4.4Å
184	V	93.7	Very high	84.2	Confident	0 Å²	0	55 Å²	55	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	110	172.2	-178.8	0	0	0	0	109	L169 L171 I187 I199 V201 G202 D203 L205	L169-V184 HydrophobicContact CD2-CG1 3.96Å; L169-V184 HydrophobicContact CD2-CG2 4.07Å; L171-V184 HydrophobicContact CD2-CG2 4.3Å; V184-I187 HydrophobicContact CG1-CG1 4.04Å; V184-I199 HydrophobicContact CB-CG2 4.26Å; V184-I199 HydrophobicContact CG1-CG2 4.08Å; V184-I199 HydrophobicContact CG2-CG2 3.8Å; V184-V201 HydrophobicContact CG1-CG2 4.43Å; V184-V201 CarbonylContact O-C 3.58Å; V184-V201 WeakPolarHBondContact O-CA 3.43Å; V184-V201 WeakPolarHBondContact O-CG1 3.39Å; V184-G202 PolarHBondContact O-N 3.24Å; V184-D203 PolarHBondContact N-O 2.75Å; V184-L205 HydrophobicContact CG2-CD1 4.38Å; V184-L205 HydrophobicContact CG2-CD2 3.84Å; V184-L205 HydrophobicContact CG2-CG 4.11Å
185	C	92	Very high	84	Confident	2 Å²	2	62.5 Å²	62.5	1%	0.014	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	-11.1	-178.5	62.7	0	0	0	0	113.9	K170 A172 F183 V201 M262 A264 A266 T267	K170-C185 PolarHBondContact O-N 3.22Å; A172-C185 HydrophobicContact CB-CB 3.76Å; F183-C185 PolarHBondContact O-N 2.82Å; C185-V201 WeakPolarHBondContact O-CG1 3.43Å; C185-M262 HydrophobicContact CB-CE 4.49Å; C185-M262 HydrophobicContact CB-SD 4.04Å; C185-A264 HydrophobicContact CB-CB 4.3Å; C185-A266 WeakPolarHBondContact O-CA 3.27Å; C185-T267 PolarHBondContact O-N 2.78Å
186	G	89.4	Confident	84.1	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-173.2	155.3	177.9	0	0	0	0	0	111.4	K170	K170-G186 WeakPolarHBondContact CB-O 3.49Å; K170-G186 PolarHBondContact N-O 3.47Å
187	I	90	Very high	84.3	Confident	26 Å²	26	54.9 Å²	54.9	13%	0.133	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	141.9	175	-59.4	171.2	0	0	0	107.5	G168 V184 I193 E194 I199 V201	G168-I187 CarbonylContact O-C 3.55Å; G168-I187 WeakPolarHBondContact O-CA 3.23Å; V184-I187 HydrophobicContact CG1-CG1 4.04Å; I187-I193 HydrophobicContact CD1-CG2 4.24Å; I187-I193 HydrophobicContact CG2-CG2 4.2Å; I187-E194 HydrophobicContact CG2-CB 3.89Å; I187-I199 HydrophobicContact CD1-CG2 4.44Å; I187-I199 WeakPolarHBondContact CD1-O 3.39Å; I187-V201 HydrophobicContact CD1-CG2 4.41Å; I187-V201 HydrophobicContact CG1-CG2 4.17Å
188	Q	84.4	Confident	85	Confident	63 Å²	63	51.2 Å²	51.2	29%	0.294	28%	0.275	S	S	.	.			trans	-86	129.1	-178.4	-174.1	176.4	10.5	0	0	111.2	N166 G168 S191	N166-Q188 PolarHBondContact ND2-OE1 2.76Å; G168-Q188 PolarHBondContact O-N 3.34Å; Q188-S191 WeakPolarHBondContact O-CB 3.49Å; Q188-S191 PolarHBondContact O-N 2.86Å; Q188-S191 PolarHBondContact O-OG 2.87Å
189	P	79.4	Confident	85.9	Confident	104 Å²	104	44.6 Å²	44.6	68%	0.675	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.6	137.8	173.7	-29.3	37.3	0	0	0	114.4	S191 E194	P189-S191 VanDerWaalsContact C-N 3.29Å; P189-S191 PolarHBondContact O-N 3.41Å; P189-E194 WeakPolarHBondContact CA-OE1 3.35Å; P189-E194 WeakPolarHBondContact CA-OE2 3.27Å
190	G	75.9	Confident	86.8	Confident	43 Å²	43	44.1 Å²	44.1	44%	0.443	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	80	-3.6	-177.9	0	0	0	0	0	115.7	E194 R195	G190-E194 PolarHBondContact N-OE2 2.96Å; G190-R195 PolarHBondContact O-NE 2.67Å; G190-R195 PolarHBondContact O-NH2 3.35Å
191	S	83.3	Confident	87.2	Confident	6 Å²	6	39.7 Å²	39.7	4%	0.042	22%	0.217	C	C	.	.	S	Bend	trans	-74.4	171.7	-173.6	68.8	0	0	0	0	114.6	Q188 P189 E194 R195	Q188-S191 WeakPolarHBondContact O-CB 3.49Å; Q188-S191 PolarHBondContact O-N 2.86Å; Q188-S191 PolarHBondContact O-OG 2.87Å; P189-S191 VanDerWaalsContact C-N 3.29Å; P189-S191 PolarHBondContact O-N 3.41Å; S191-E194 PolarHBondContact OG-N 2.82Å; S191-R195 WeakPolarHBondContact O-CD 3.4Å; S191-R195 VanDerWaalsContact O-CG 3.24Å; S191-R195 WeakPolarHBondContact O-CG 3.47Å; S191-R195 PolarHBondContact O-N 3.12Å
192	I	83.4	Confident	87.5	Confident	13 Å²	13	39.5 Å²	39.5	7%	0.067	22%	0.216	C	C	.	.	H	α-helix	trans	-62.5	-47.3	176.4	-58.2	159	0	0	0	111.1	L150 L152 L155 V165 N166 E194 R195 D196 Y229 I233	L150-I192 HydrophobicContact CD1-CG2 3.85Å; L150-I192 HydrophobicContact CD2-CG2 3.84Å; L150-I192 HydrophobicContact CG-CG2 4.14Å; L152-I192 HydrophobicContact CD2-CD1 3.72Å; L152-I192 HydrophobicContact CD2-CG2 3.94Å; L155-I192 HydrophobicContact CD1-CD1 4.04Å; L155-I192 HydrophobicContact CD1-CG1 4.37Å; L155-I192 HydrophobicContact CD2-CG1 4.37Å; V165-I192 HydrophobicContact CG1-CD1 3.58Å; V165-I192 HydrophobicContact CG1-CG1 3.47Å; V165-I192 VanDerWaalsContact CG1-CG1 3.47Å; N166-I192 PolarHBondContact O-N 2.85Å; N166-I192 VanDerWaalsContact O-N 3.16Å; I192-E194 PolarHBondContact O-N 2.88Å; I192-R195 PolarHBondContact O-N 3.21Å; I192-D196 WeakPolarHBondContact O-CB 3.47Å; I192-D196 PolarHBondContact O-N 3.22Å; I192-Y229 HydrophobicContact CD1-CE2 3.62Å; I192-Y229 VanDerWaalsContact CD1-OH 3.26Å; I192-Y229 WeakPolarHBondContact CD1-OH 3.37Å; I192-I233 HydrophobicContact CD1-CD1 4.29Å
193	I	87.5	Confident	87.7	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-67.1	-35.5	-176.3	-69.4	-58.4	0	0	0	112.1	L150 L167 L169 I187 R195 D196 G197 I199 F250	L150-I193 HydrophobicContact CD1-CD1 4.49Å; L150-I193 HydrophobicContact CD2-CD1 3.68Å; L167-I193 HydrophobicContact CD1-CD1 4.01Å; L167-I193 HydrophobicContact CD1-CG1 3.78Å; L167-I193 HydrophobicContact CG-CG1 4.04Å; L167-I193 WeakPolarHBondContact O-CB 3.41Å; L167-I193 VanDerWaalsContact O-CG1 3.28Å; L167-I193 WeakPolarHBondContact O-CG1 3.41Å; L167-I193 PolarHBondContact O-N 3.06Å; L169-I193 HydrophobicContact CD2-CB 4.47Å; L169-I193 HydrophobicContact CD2-CG1 4.23Å; L169-I193 HydrophobicContact CD2-CG2 3.98Å; L169-I193 HydrophobicContact CG-CG1 4.11Å; I187-I193 HydrophobicContact CD1-CG2 4.24Å; I187-I193 HydrophobicContact CG2-CG2 4.2Å; I193-R195 VanDerWaalsContact C-N 3.34Å; I193-R195 PolarHBondContact O-N 3.45Å; I193-D196 PolarHBondContact O-N 3.49Å; I193-G197 PolarHBondContact O-N 3.27Å; I193-I199 HydrophobicContact CD1-CD1 3.81Å; I193-I199 HydrophobicContact CD1-CG1 4.49Å; I193-I199 HydrophobicContact CG1-CD1 4.35Å; I193-I199 HydrophobicContact CG2-CB 3.73Å; I193-I199 HydrophobicContact CG2-CD1 4.02Å; I193-I199 HydrophobicContact CG2-CG1 4.11Å; I193-I199 HydrophobicContact CG2-CG2 4.4Å; I193-F250 HydrophobicContact CD1-CE2 4.13Å; I193-F250 HydrophobicContact CD1-CZ 4.3Å
194	E	84.9	Confident	87.7	Confident	96 Å²	96	40.2 Å²	40.2	45%	0.449	22%	0.219	S	C	.	.	H	α-helix	trans	-64.4	-39.2	174.1	-169.5	-174.8	-116.5	0	0	112.2	I187 P189 G190 S191 I192 D196	I187-E194 HydrophobicContact CG2-CB 3.89Å; P189-E194 WeakPolarHBondContact CA-OE1 3.35Å; P189-E194 WeakPolarHBondContact CA-OE2 3.27Å; G190-E194 PolarHBondContact N-OE2 2.96Å; S191-E194 PolarHBondContact OG-N 2.82Å; I192-E194 PolarHBondContact O-N 2.88Å; E194-D196 VanDerWaalsContact C-N 3.33Å
195	R	81.9	Confident	87.7	Confident	167 Å²	167	40.2 Å²	40.2	63%	0.63	22%	0.219	S	C	*	.	H	α-helix	trans	-70.9	-27.8	178.2	-67.7	169.3	-170.1	-132.8	0.8	113.6	G190 S191 I192 I193	G190-R195 PolarHBondContact O-NE 2.67Å; G190-R195 PolarHBondContact O-NH2 3.35Å; S191-R195 WeakPolarHBondContact O-CD 3.4Å; S191-R195 VanDerWaalsContact O-CG 3.24Å; S191-R195 WeakPolarHBondContact O-CG 3.47Å; S191-R195 PolarHBondContact O-N 3.12Å; I192-R195 PolarHBondContact O-N 3.21Å; I193-R195 VanDerWaalsContact C-N 3.34Å; I193-R195 PolarHBondContact O-N 3.45Å
196	D	84.9	Confident	87.6	Confident	41 Å²	41	40.1 Å²	40.1	22%	0.219	22%	0.219	C	C	.	.	H	α-helix	trans	-84.1	-35.7	178.4	176	75.3	0	0	0	112.3	F148 L150 I192 I193 E194 H198	F148-D196 WeakPolarHBondContact CE2-OD2 3.39Å; L150-D196 HydrophobicContact CD1-CB 3.39Å; L150-D196 WeakPolarHBondContact CD1-OD1 3.23Å; I192-D196 WeakPolarHBondContact O-CB 3.47Å; I192-D196 PolarHBondContact O-N 3.22Å; I193-D196 PolarHBondContact O-N 3.49Å; E194-D196 VanDerWaalsContact C-N 3.33Å; D196-H198 PolarHBondContact O-N 3.22Å; D196-H198 VanDerWaalsContact O-N 3.12Å; D196-H198 PolarHBondContact O-ND1 3Å; D196-H198 IonicContact OD1-CE1 3.25Å; D196-H198 IonicContact OD1-ND1 2.72Å; D196-H198 PolarHBondContact OD1-ND1 2.89Å; D196-H198 VanDerWaalsContact OD1-ND1 3.07Å; D196-H198 WeakPolarHBondContact OD2-CB 3.38Å; D196-H198 IonicContact OD2-CE1 2.7Å; D196-H198 IonicContact OD2-CG 3.43Å; D196-H198 IonicContact OD2-ND1 3.5Å; D196-H198 PolarHBondContact OD2-ND1 2.9Å
197	G	86.6	Confident	87.7	Confident	45 Å²	45	40.7 Å²	40.7	46%	0.464	22%	0.221	S	C	.	.			trans	73.5	-4.2	168.8	0	0	0	0	0	116.4	I193 I199	I193-G197 PolarHBondContact O-N 3.27Å; G197-I199 VanDerWaalsContact C-N 3.34Å; G197-I199 PolarHBondContact O-N 2.95Å
198	H	88.8	Confident	87.7	Confident	91 Å²	91	39.5 Å²	39.5	42%	0.421	22%	0.215	S	C	.	.			trans	-72.2	-23.7	179.9	-65.4	104.7	0	0	0	113.9	F148 D196 R254	F148-H198 HydrophobicContact CD1-CB 3.81Å; F148-H198 HydrophobicContact CD2-CB 3.7Å; F148-H198 AromaticContact CD2-CG 3.82Å; F148-H198 AromaticContact CD2-ND1 3.75Å; F148-H198 HydrophobicContact CE1-CB 3.88Å; F148-H198 HydrophobicContact CE2-CB 3.76Å; F148-H198 HydrophobicContact CG-CB 3.74Å; F148-H198 AromaticContact CG-CG 3.88Å; F148-H198 HydrophobicContact CZ-CB 3.87Å; D196-H198 PolarHBondContact O-N 3.22Å; D196-H198 VanDerWaalsContact O-N 3.12Å; D196-H198 PolarHBondContact O-ND1 3Å; D196-H198 IonicContact OD1-CE1 3.25Å; D196-H198 IonicContact OD1-ND1 2.72Å; D196-H198 PolarHBondContact OD1-ND1 2.89Å; D196-H198 VanDerWaalsContact OD1-ND1 3.07Å; D196-H198 WeakPolarHBondContact OD2-CB 3.38Å; D196-H198 IonicContact OD2-CE1 2.7Å; D196-H198 IonicContact OD2-CG 3.43Å; D196-H198 IonicContact OD2-ND1 3.5Å; D196-H198 PolarHBondContact OD2-ND1 2.9Å; H198-R254 PolarHBondContact O-NH2 2.97Å
199	I	91.4	Very high	87.5	Confident	4 Å²	4	37.8 Å²	37.8	2%	0.021	21%	0.208	C	C	.	.			trans	-97.8	134.7	177.4	-55.7	-174.6	0	0	0	110.3	F148 L169 V184 I187 I193 G197 D203 F250	F148-I199 HydrophobicContact CE1-CG1 4.02Å; F148-I199 HydrophobicContact CE2-CG1 4.49Å; F148-I199 HydrophobicContact CZ-CD1 3.89Å; F148-I199 HydrophobicContact CZ-CG1 3.49Å; F148-I199 VanDerWaalsContact CZ-CG1 3.49Å; L169-I199 HydrophobicContact CD1-CD1 4.41Å; L169-I199 HydrophobicContact CD2-CD1 4.02Å; L169-I199 HydrophobicContact CD2-CG2 4.17Å; V184-I199 HydrophobicContact CB-CG2 4.26Å; V184-I199 HydrophobicContact CG1-CG2 4.08Å; V184-I199 HydrophobicContact CG2-CG2 3.8Å; I187-I199 HydrophobicContact CD1-CG2 4.44Å; I187-I199 WeakPolarHBondContact CD1-O 3.39Å; I193-I199 HydrophobicContact CD1-CD1 3.81Å; I193-I199 HydrophobicContact CD1-CG1 4.49Å; I193-I199 HydrophobicContact CG1-CD1 4.35Å; I193-I199 HydrophobicContact CG2-CB 3.73Å; I193-I199 HydrophobicContact CG2-CD1 4.02Å; I193-I199 HydrophobicContact CG2-CG1 4.11Å; I193-I199 HydrophobicContact CG2-CG2 4.4Å; G197-I199 VanDerWaalsContact C-N 3.34Å; G197-I199 PolarHBondContact O-N 2.95Å; I199-D203 HydrophobicContact CG2-CB 4.46Å; I199-F250 HydrophobicContact CD1-CD1 4.25Å; I199-F250 HydrophobicContact CD1-CE1 4.13Å; I199-F250 HydrophobicContact CD1-CZ 4.3Å
200	E	91.3	Very high	87.3	Confident	98 Å²	98	38 Å²	38	46%	0.458	20%	0.204	S	C	.	.			trans	-118.3	162.2	173.7	-73.7	167.8	-147.3	0	0	111.3	G202 D203 R254	E200-G202 PolarHBondContact O-N 3.43Å; E200-D203 PolarHBondContact N-OD2 2.9Å; E200-D203 WeakPolarHBondContact O-CB 3.49Å; E200-D203 PolarHBondContact O-N 2.81Å; E200-R254 IonicContact OE1-CZ 2.71Å; E200-R254 VanDerWaalsContact OE1-CZ 3.31Å; E200-R254 IonicContact OE1-NH1 3.22Å; E200-R254 PolarHBondContact OE1-NH1 2.72Å; E200-R254 IonicContact OE1-NH2 3.31Å; E200-R254 IonicContact OE2-CZ 3.92Å; E200-R254 IonicContact OE2-NE 3.74Å; E200-R254 IonicContact OE2-NH1 3.38Å
201	V	91.9	Very high	87.5	Confident	24 Å²	24	39.7 Å²	39.7	15%	0.145	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.9	124	177	171.3	0	0	0	0	110.1	V184 C185 I187 M262 A266 N268	V184-V201 HydrophobicContact CG1-CG2 4.43Å; V184-V201 CarbonylContact O-C 3.58Å; V184-V201 WeakPolarHBondContact O-CA 3.43Å; V184-V201 WeakPolarHBondContact O-CG1 3.39Å; C185-V201 WeakPolarHBondContact O-CG1 3.43Å; I187-V201 HydrophobicContact CD1-CG2 4.41Å; I187-V201 HydrophobicContact CG1-CG2 4.17Å; V201-M262 HydrophobicContact CG1-CE 4.09Å; V201-A266 HydrophobicContact CG1-CB 3.49Å; V201-A266 VanDerWaalsContact CG1-CB 3.49Å; V201-N268 VanDerWaalsContact CG2-ND2 3.35Å; V201-N268 WeakPolarHBondContact CG2-ND2 3.41Å; V201-N268 WeakPolarHBondContact CG2-OD1 3.41Å
202	G	91.7	Very high	87.6	Confident	5 Å²	5	42.4 Å²	42.4	5%	0.052	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	106.1	-10.9	-167.5	0	0	0	0	0	114	V184 E200 N258	V184-G202 PolarHBondContact O-N 3.24Å; E200-G202 PolarHBondContact O-N 3.43Å; G202-N258 WeakPolarHBondContact O-CB 3.49Å; G202-N258 PolarHBondContact O-ND2 2.82Å; G202-N258 VanDerWaalsContact O-ND2 3.12Å
203	D	94.7	Very high	87.8	Confident	3 Å²	3	41.8 Å²	41.8	2%	0.016	21%	0.213	C	C	.	.	P	Polyproline II helix	trans	-65.7	137	172.7	-73.4	-27	0	0	0	111.3	F183 V184 I199 E200 I252 R254	F183-D203 WeakPolarHBondContact CA-O 3.43Å; V184-D203 PolarHBondContact N-O 2.75Å; I199-D203 HydrophobicContact CG2-CB 4.46Å; E200-D203 PolarHBondContact N-OD2 2.9Å; E200-D203 WeakPolarHBondContact O-CB 3.49Å; E200-D203 PolarHBondContact O-N 2.81Å; D203-I252 HydrophobicContact CB-CD1 4.23Å; D203-I252 WeakPolarHBondContact OD2-CD1 3.22Å; D203-R254 VanDerWaalsContact OD1-CB 3.26Å; D203-R254 WeakPolarHBondContact OD1-CB 3.48Å; D203-R254 VanDerWaalsContact OD1-CG 3.29Å; D203-R254 WeakPolarHBondContact OD1-CG 3.38Å; D203-R254 IonicContact OD1-CZ 2.7Å; D203-R254 IonicContact OD1-NE 3.93Å; D203-R254 PolarHBondContact OD1-NE 2.93Å; D203-R254 IonicContact OD1-NH2 3.69Å; D203-R254 IonicContact OD2-CZ 3.73Å; D203-R254 IonicContact OD2-NE 3.1Å; D203-R254 PolarHBondContact OD2-NE 2.67Å; D203-R254 IonicContact OD2-NH2 3.33Å; D203-R254 PolarHBondContact OD2-NH2 2.64Å
204	Q	93.9	Very high	87.8	Confident	13 Å²	13	46.8 Å²	46.8	6%	0.061	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	129.6	171.6	-162.4	-179.8	-66.8	0	0	110	V182 F183 L206 I252 Q253	V182-Q204 CarbonylContact O-C 3.46Å; V182-Q204 WeakPolarHBondContact O-CA 3.48Å; V182-Q204 WeakPolarHBondContact O-CG 3.35Å; F183-Q204 HydrophobicContact CD1-CB 3.7Å; F183-Q204 HydrophobicContact CD1-CG 3.8Å; F183-Q204 HydrophobicContact CE1-CB 3.69Å; F183-Q204 HydrophobicContact CE1-CG 3.65Å; F183-Q204 HydrophobicContact CZ-CG 4.41Å; Q204-L206 HydrophobicContact CG-CD2 4.4Å; Q204-I252 CarbonylContact O-C 3.56Å; Q204-I252 WeakPolarHBondContact O-CA 3.19Å; Q204-I252 WeakPolarHBondContact O-CB 3.39Å; Q204-Q253 HydrophobicContact CB-CB 4.48Å; Q204-Q253 PolarHBondContact N-O 2.9Å; Q204-Q253 PolarHBondContact O-N 2.94Å
205	L	93.8	Very high	87.6	Confident	0 Å²	0	44 Å²	44	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	125.6	176.6	-53.7	-175.3	0	0	0	110.1	L171 V182 V184 L213 I225 I252	L171-L205 HydrophobicContact CD2-CD1 3.72Å; V182-L205 HydrophobicContact CB-CB 4.41Å; V182-L205 HydrophobicContact CG1-CB 4.44Å; V182-L205 HydrophobicContact CG1-CD1 4.16Å; V182-L205 HydrophobicContact CG1-CG 4.47Å; V182-L205 PolarHBondContact O-N 2.85Å; V184-L205 HydrophobicContact CG2-CD1 4.38Å; V184-L205 HydrophobicContact CG2-CD2 3.84Å; V184-L205 HydrophobicContact CG2-CG 4.11Å; L205-L213 HydrophobicContact CB-CB 4.41Å; L205-L213 HydrophobicContact CB-CD1 3.76Å; L205-L213 HydrophobicContact CD1-CD1 4.29Å; L205-I225 HydrophobicContact CD1-CD1 3.82Å; L205-I252 HydrophobicContact CD2-CG2 3.65Å
206	L	90.7	Very high	87.7	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	-42.7	-176.4	-58.5	-178	0	0	0	113	Y138 L141 I145 Q204 L213 Y214 V251 Q253	Y138-L206 HydrophobicContact CD1-CD1 3.81Å; Y138-L206 HydrophobicContact CD1-CD2 4.34Å; Y138-L206 HydrophobicContact CD2-CD1 3.98Å; Y138-L206 HydrophobicContact CE1-CB 4.13Å; Y138-L206 HydrophobicContact CE1-CD1 4.13Å; Y138-L206 HydrophobicContact CE1-CD2 4.27Å; Y138-L206 HydrophobicContact CE1-CG 4.43Å; Y138-L206 HydrophobicContact CE2-CB 4.3Å; Y138-L206 HydrophobicContact CE2-CD1 4.3Å; Y138-L206 HydrophobicContact CG-CD1 3.72Å; L141-L206 HydrophobicContact CD1-CD1 4.04Å; L141-L206 HydrophobicContact CD1-CD2 3.62Å; L141-L206 HydrophobicContact CD1-CG 4.5Å; I145-L206 HydrophobicContact CD1-CD1 3.99Å; Q204-L206 HydrophobicContact CG-CD2 4.4Å; L206-L213 PolarHBondContact O-N 2.91Å; L206-Y214 HydrophobicContact CD2-CD2 3.7Å; L206-Y214 HydrophobicContact CD2-CG 4.24Å; L206-Y214 PolarHBondContact O-N 2.91Å; L206-Y214 VanDerWaalsContact O-N 3.08Å; L206-V251 WeakPolarHBondContact CA-O 3.49Å; L206-V251 HydrophobicContact CB-CB 4.42Å; L206-V251 HydrophobicContact CB-CG1 4.19Å; L206-V251 WeakPolarHBondContact CB-O 3.5Å; L206-V251 HydrophobicContact CD1-CG1 4.32Å; L206-V251 PolarHBondContact N-O 3.19Å; L206-Q253 HydrophobicContact CD1-CB 3.71Å; L206-Q253 HydrophobicContact CD2-CB 4.39Å; L206-Q253 HydrophobicContact CG-CB 4.16Å
207	E	91	Very high	87.7	Confident	13 Å²	13	37.5 Å²	37.5	6%	0.061	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	154.9	173.6	-50.4	-175.9	173.4	0	0	111.7	K137 Y138 Q211 V212 R249 V251	K137-E207 IonicContact NZ-OE1 3.63Å; K137-E207 PolarHBondContact NZ-OE1 3.42Å; Y138-E207 HydrophobicContact CE2-CG 4.35Å; Y138-E207 WeakPolarHBondContact OH-CG 3.37Å; Y138-E207 PolarHBondContact OH-OE1 3.18Å; E207-Q211 CarbonylContact C-O 3.48Å; E207-Q211 WeakPolarHBondContact CA-O 3.38Å; E207-V212 HydrophobicContact CG-CG2 4.43Å; E207-R249 IonicContact OE2-NH1 3.69Å; E207-V251 HydrophobicContact CB-CB 3.84Å; E207-V251 HydrophobicContact CB-CG2 3.88Å; E207-V251 HydrophobicContact CG-CB 4.08Å; E207-V251 HydrophobicContact CG-CG2 4.17Å; E207-V251 PolarHBondContact N-O 3.11Å; E207-V251 VanDerWaalsContact N-O 3.09Å; E207-V251 PolarHBondContact O-N 2.92Å
208	L	89.4	Confident	87.7	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	121.1	168.7	-159.8	172.5	0	0	0	109	N210 Q211 L213 I225 I228 L248 R249 F250	L208-N210 VanDerWaalsContact C-N 3.27Å; L208-N210 PolarHBondContact O-N 2.88Å; L208-Q211 PolarHBondContact N-O 3.31Å; L208-Q211 PolarHBondContact O-N 2.86Å; L208-L213 HydrophobicContact CB-CD1 3.91Å; L208-I225 HydrophobicContact CD1-CB 4.18Å; L208-I225 HydrophobicContact CD1-CG1 3.83Å; L208-I225 HydrophobicContact CD1-CG2 3.82Å; L208-I228 HydrophobicContact CD2-CB 4.23Å; L208-I228 HydrophobicContact CD2-CD1 3.91Å; L208-I228 HydrophobicContact CD2-CG2 3.8Å; L208-L248 HydrophobicContact CD2-CB 4.21Å; L208-L248 HydrophobicContact CD2-CD2 4.12Å; L208-R249 WeakPolarHBondContact CA-O 3.16Å; L208-F250 HydrophobicContact CD1-CD1 4.07Å; L208-F250 HydrophobicContact CD1-CE1 3.44Å; L208-F250 VanDerWaalsContact CD1-CE1 3.44Å; L208-F250 HydrophobicContact CD1-CZ 3.79Å; L208-F250 HydrophobicContact CG-CD1 3.99Å; L208-F250 HydrophobicContact CG-CE1 3.84Å; L208-F250 HydrophobicContact CG-CG 4.49Å; L208-F250 HydrophobicContact CG-CZ 4.2Å
209	N	81.7	Confident	87.5	Confident	27 Å²	27	37.1 Å²	37.1	14%	0.144	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	47.6	43.9	-178.2	-78.1	-9.2	0	0	0	114.3	Q211 I228 C245 A247 R249	N209-Q211 VanDerWaalsContact C-N 3.28Å; N209-Q211 PolarHBondContact O-N 2.73Å; N209-I228 HydrophobicContact CB-CG2 3.97Å; N209-I228 WeakPolarHBondContact ND2-CG2 3.24Å; N209-C245 PolarHBondContact ND2-SG 2.92Å; N209-A247 PolarHBondContact ND2-O 3.26Å; N209-A247 VanDerWaalsContact ND2-O 3.09Å; N209-R249 PolarHBondContact N-O 2.71Å; N209-R249 PolarHBondContact OD1-N 3.47Å
210	N	74	Confident	87.2	Confident	109 Å²	109	41 Å²	41	58%	0.583	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	72.9	1.2	-176.8	-42.7	-95.7	0	0	0	115.9	L208	L208-N210 VanDerWaalsContact C-N 3.27Å; L208-N210 PolarHBondContact O-N 2.88Å
211	Q	80.8	Confident	87	Confident	79 Å²	79	36.3 Å²	36.3	37%	0.369	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	131.9	169.2	-60.9	-170.1	8.4	0	0	109.9	E207 L208 N209 I228	E207-Q211 CarbonylContact C-O 3.48Å; E207-Q211 WeakPolarHBondContact CA-O 3.38Å; L208-Q211 PolarHBondContact N-O 3.31Å; L208-Q211 PolarHBondContact O-N 2.86Å; N209-Q211 VanDerWaalsContact C-N 3.28Å; N209-Q211 PolarHBondContact O-N 2.73Å; Q211-I228 HydrophobicContact CB-CD1 4.31Å; Q211-I228 HydrophobicContact CG-CD1 4.13Å
212	V	85.2	Confident	86.8	Confident	62 Å²	62	35.3 Å²	35.3	38%	0.376	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	123.9	-177.9	-178.2	0	0	0	0	109.9	E207	E207-V212 HydrophobicContact CG-CG2 4.43Å
213	L	87.6	Confident	86.4	Confident	1 Å²	1	38.9 Å²	38.9	1%	0.005	21%	0.213	C	C	.	.			trans	-97.9	-21.7	174.4	-57.9	178.4	0	0	0	112	L205 L206 L208 G215 L216 A221 L224 I225	L205-L213 HydrophobicContact CB-CB 4.41Å; L205-L213 HydrophobicContact CB-CD1 3.76Å; L205-L213 HydrophobicContact CD1-CD1 4.29Å; L206-L213 PolarHBondContact O-N 2.91Å; L208-L213 HydrophobicContact CB-CD1 3.91Å; L213-G215 PolarHBondContact O-N 3.02Å; L213-L216 HydrophobicContact CD2-CD1 4.34Å; L213-L216 WeakPolarHBondContact O-CB 3.21Å; L213-L216 PolarHBondContact O-N 3.47Å; L213-L216 VanDerWaalsContact O-N 3.11Å; L213-A221 HydrophobicContact CD2-CB 4.12Å; L213-L224 HydrophobicContact CD2-CD2 3.97Å; L213-I225 HydrophobicContact CD1-CD1 3.97Å; L213-I225 HydrophobicContact CD1-CG1 4Å; L213-I225 HydrophobicContact CD2-CG1 4.22Å
214	Y	87	Confident	85.9	Confident	105 Å²	105	41.3 Å²	41.3	41%	0.412	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.7	131.8	170.8	-176.3	-109.9	0	0	0	111.3	Y138 L141 L206 L216	Y138-Y214 HydrophobicContact CE1-CD1 4.06Å; Y138-Y214 AromaticContact CE1-CG 3.92Å; Y138-Y214 HydrophobicContact CE1-CG 3.92Å; L141-Y214 HydrophobicContact CD1-CD2 4.22Å; L141-Y214 HydrophobicContact CD1-CE2 3.93Å; L141-Y214 HydrophobicContact CD2-CE2 3.86Å; L141-Y214 HydrophobicContact CG-CE2 4.41Å; L206-Y214 HydrophobicContact CD2-CD2 3.7Å; L206-Y214 HydrophobicContact CD2-CG 4.24Å; L206-Y214 PolarHBondContact O-N 2.91Å; L206-Y214 VanDerWaalsContact O-N 3.08Å; Y214-L216 VanDerWaalsContact C-N 3.31Å
215	G	81.5	Confident	85.7	Confident	36 Å²	36	40.8 Å²	40.8	37%	0.371	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	80.9	4.4	-174.8	0	0	0	0	0	114.7	M180 L213	M180-G215 VanDerWaalsContact CB-C 3.47Å; M180-G215 WeakPolarHBondContact CB-O 3.44Å; M180-G215 CarbonylContact O-C 3.59Å; M180-G215 WeakPolarHBondContact O-CA 3.48Å; M180-G215 PolarHBondContact O-N 3.04Å; L213-G215 PolarHBondContact O-N 3.02Å
216	L	83.6	Confident	85.2	Confident	45 Å²	45	44.9 Å²	44.9	24%	0.236	24%	0.239	C	C	.	.			trans	-100.2	154	170.2	-57.4	-173.6	0	0	0	111.6	M180 S181 V182 L213 Y214 N220 A221 L224	M180-L216 CarbonylContact C-O 3.53Å; M180-L216 VanDerWaalsContact C-O 3.24Å; S181-L216 CarbonylContact C-O 3.5Å; S181-L216 PolarHBondContact N-O 3.47Å; V182-L216 WeakPolarHBondContact CG2-O 3.26Å; L213-L216 HydrophobicContact CD2-CD1 4.34Å; L213-L216 WeakPolarHBondContact O-CB 3.21Å; L213-L216 PolarHBondContact O-N 3.47Å; L213-L216 VanDerWaalsContact O-N 3.11Å; Y214-L216 VanDerWaalsContact C-N 3.31Å; L216-N220 HydrophobicContact CB-CB 4.41Å; L216-A221 HydrophobicContact CB-CB 4.42Å; L216-L224 HydrophobicContact CD1-CD2 4Å
217	S	85.6	Confident	84.7	Confident	28 Å²	28	48.5 Å²	48.5	20%	0.196	26%	0.264	C	S	.	.			trans	-76.9	154.4	164.4	77.1	0	0	0	0	110.3	L219 N220 A221	S217-L219 PolarHBondContact O-N 2.93Å; S217-L219 PolarHBondContact OG-N 3.39Å; S217-N220 PolarHBondContact O-N 3.49Å; S217-N220 VanDerWaalsContact OG-CG 3.29Å; S217-N220 PolarHBondContact OG-N 2.95Å; S217-N220 VanDerWaalsContact OG-N 3.15Å; S217-N220 PolarHBondContact OG-OD1 3.01Å; S217-N220 VanDerWaalsContact OG-OD1 3.1Å; S217-A221 WeakPolarHBondContact O-CB 3.42Å; S217-A221 PolarHBondContact O-N 2.88Å
218	H	85.2	Confident	84.3	Confident	23 Å²	23	48.2 Å²	48.2	11%	0.106	26%	0.263	C	S	.	.	H	α-helix	trans	-55.7	-30.2	171.2	70.9	-68.7	0	0	0	113.6	L171 G173 V182 A222	L171-H218 HydrophobicContact CB-CB 4.36Å; G173-H218 WeakPolarHBondContact CA-ND1 3.45Å; G173-H218 VanDerWaalsContact N-CG 3.31Å; G173-H218 PolarHBondContact N-ND1 3.36Å; G173-H218 VanDerWaalsContact N-ND1 3.2Å; V182-H218 HydrophobicContact CG1-CB 4.39Å; H218-A222 VanDerWaalsContact O-CB 3.24Å; H218-A222 WeakPolarHBondContact O-CB 3.29Å; H218-A222 PolarHBondContact O-N 3.48Å
219	L	86.5	Confident	83.9	Confident	104 Å²	104	48.6 Å²	48.6	55%	0.545	27%	0.265	S	S	.	.	H	α-helix	trans	-66.4	-37	175.1	-55.1	-178	0	0	0	112.1	I83 S217 P223	I83-L219 HydrophobicContact CD1-CD2 3.78Å; S217-L219 PolarHBondContact O-N 2.93Å; S217-L219 PolarHBondContact OG-N 3.39Å; L219-P223 WeakPolarHBondContact O-CD 3.43Å
220	N	83.4	Confident	83.6	Confident	86 Å²	86	51 Å²	51	46%	0.46	28%	0.276	S	S	.	.	H	α-helix	trans	-81.3	-35.5	178.5	-63.7	13.5	0	0	0	111.4	L216 S217	L216-N220 HydrophobicContact CB-CB 4.41Å; S217-N220 PolarHBondContact O-N 3.49Å; S217-N220 VanDerWaalsContact OG-CG 3.29Å; S217-N220 PolarHBondContact OG-N 2.95Å; S217-N220 VanDerWaalsContact OG-N 3.15Å; S217-N220 PolarHBondContact OG-OD1 3.01Å; S217-N220 VanDerWaalsContact OG-OD1 3.1Å
221	A	87.2	Confident	83.5	Confident	0 Å²	0	52 Å²	52	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-76.4	-34.3	-178.3	0	0	0	0	0	113.5	V182 L213 L216 S217 L224 I225	V182-A221 HydrophobicContact CB-CB 4.43Å; V182-A221 HydrophobicContact CG1-CB 4.08Å; V182-A221 HydrophobicContact CG2-CB 3.53Å; L213-A221 HydrophobicContact CD2-CB 4.12Å; L216-A221 HydrophobicContact CB-CB 4.42Å; S217-A221 WeakPolarHBondContact O-CB 3.42Å; S217-A221 PolarHBondContact O-N 2.88Å; A221-L224 WeakPolarHBondContact O-CB 3.46Å; A221-L224 PolarHBondContact O-N 3.41Å; A221-L224 VanDerWaalsContact O-N 3.12Å; A221-I225 HydrophobicContact CB-CD1 4.26Å; A221-I225 WeakPolarHBondContact O-CD1 3.3Å; A221-I225 VanDerWaalsContact O-CG1 3.26Å; A221-I225 WeakPolarHBondContact O-CG1 3.12Å; A221-I225 PolarHBondContact O-N 2.66Å
222	A	87.6	Confident	83.1	Confident	3 Å²	3	49.4 Å²	49.4	3%	0.025	27%	0.267	C	S	.	.	H	α-helix	trans	-60.9	-45.7	-177.6	0	0	0	0	0	113.8	I83 L85 L171 H218 L224 R226	I83-A222 HydrophobicContact CB-CB 4.24Å; I83-A222 HydrophobicContact CD1-CB 3.76Å; I83-A222 HydrophobicContact CG2-CB 3.84Å; L85-A222 HydrophobicContact CD2-CB 4.12Å; L171-A222 HydrophobicContact CD1-CB 4.09Å; H218-A222 VanDerWaalsContact O-CB 3.24Å; H218-A222 WeakPolarHBondContact O-CB 3.29Å; H218-A222 PolarHBondContact O-N 3.48Å; A222-L224 VanDerWaalsContact C-N 3.29Å; A222-L224 PolarHBondContact O-N 3.49Å; A222-R226 WeakPolarHBondContact O-CB 3.4Å; A222-R226 PolarHBondContact O-N 2.82Å
223	P	83.8	Confident	82.3	Confident	79 Å²	79	49 Å²	49	51%	0.513	26%	0.262	S	S	.	.	H	α-helix	trans	-61.1	-36.4	171.3	-23.7	34.3	0	0	0	113.1	L219 R226 S227	L219-P223 WeakPolarHBondContact O-CD 3.43Å; P223-R226 WeakPolarHBondContact O-CB 3.38Å; P223-R226 PolarHBondContact O-N 3.21Å; P223-S227 WeakPolarHBondContact O-CB 3.41Å; P223-S227 PolarHBondContact O-N 2.83Å
224	L	85.3	Confident	80.9	Confident	55 Å²	55	51.5 Å²	51.5	29%	0.288	29%	0.288	S	S	.	.	H	α-helix	trans	-68.5	-48.1	-177.3	-160	67.2	0	0	0	111.6	L213 L216 A221 A222 R226 S227 I228	L213-L224 HydrophobicContact CD2-CD2 3.97Å; L216-L224 HydrophobicContact CD1-CD2 4Å; A221-L224 WeakPolarHBondContact O-CB 3.46Å; A221-L224 PolarHBondContact O-N 3.41Å; A221-L224 VanDerWaalsContact O-N 3.12Å; A222-L224 VanDerWaalsContact C-N 3.29Å; A222-L224 PolarHBondContact O-N 3.49Å; L224-R226 VanDerWaalsContact C-N 3.32Å; L224-R226 PolarHBondContact O-N 3.45Å; L224-S227 WeakPolarHBondContact O-CB 3.47Å; L224-S227 PolarHBondContact O-N 2.93Å; L224-I228 PolarHBondContact O-N 3.17Å; L224-I228 VanDerWaalsContact O-N 3.14Å
225	I	88.2	Confident	79	Confident	1 Å²	1	55.1 Å²	55.1	1%	0.005	30%	0.301	C	S	.	.	H	α-helix	trans	-59.7	-43.6	173.4	-65.4	161.7	0	0	0	110.2	L85 L167 L171 L205 L208 L213 A221 S227 Y229	L85-I225 HydrophobicContact CD1-CB 4.21Å; L85-I225 HydrophobicContact CD1-CG2 3.68Å; L167-I225 HydrophobicContact CD2-CG2 3.79Å; L171-I225 HydrophobicContact CD1-CD1 3.54Å; L205-I225 HydrophobicContact CD1-CD1 3.82Å; L208-I225 HydrophobicContact CD1-CB 4.18Å; L208-I225 HydrophobicContact CD1-CG1 3.83Å; L208-I225 HydrophobicContact CD1-CG2 3.82Å; L213-I225 HydrophobicContact CD1-CD1 3.97Å; L213-I225 HydrophobicContact CD1-CG1 4Å; L213-I225 HydrophobicContact CD2-CG1 4.22Å; A221-I225 HydrophobicContact CB-CD1 4.26Å; A221-I225 WeakPolarHBondContact O-CD1 3.3Å; A221-I225 VanDerWaalsContact O-CG1 3.26Å; A221-I225 WeakPolarHBondContact O-CG1 3.12Å; A221-I225 PolarHBondContact O-N 2.66Å; I225-S227 VanDerWaalsContact C-N 3.35Å; I225-S227 PolarHBondContact O-N 3.42Å; I225-Y229 WeakPolarHBondContact O-CB 3.17Å; I225-Y229 PolarHBondContact O-N 3.13Å
226	R	84.5	Confident	76.9	Confident	87 Å²	87	58.8 Å²	58.8	33%	0.328	32%	0.321	S	S	.	.	H	α-helix	trans	-60	-42.2	175.1	-170.1	-173	-172.4	87.1	0.2	111.9	L85 T86 A222 P223 L224 Y229 M230	L85-R226 HydrophobicContact CD2-CB 4.28Å; T86-R226 VanDerWaalsContact O-CZ 3.23Å; T86-R226 PolarHBondContact O-NH1 2.91Å; T86-R226 PolarHBondContact O-NH2 2.96Å; A222-R226 WeakPolarHBondContact O-CB 3.4Å; A222-R226 PolarHBondContact O-N 2.82Å; P223-R226 WeakPolarHBondContact O-CB 3.38Å; P223-R226 PolarHBondContact O-N 3.21Å; L224-R226 VanDerWaalsContact C-N 3.32Å; L224-R226 PolarHBondContact O-N 3.45Å; R226-Y229 PolarHBondContact O-N 3.36Å; R226-M230 WeakPolarHBondContact O-CB 3.4Å; R226-M230 VanDerWaalsContact O-CG 3.28Å; R226-M230 WeakPolarHBondContact O-CG 3.28Å; R226-M230 PolarHBondContact O-N 2.83Å
227	S	79.1	Confident	74.9	Confident	76 Å²	76	61.2 Å²	61.2	53%	0.531	34%	0.341	S	S	.	.	H	α-helix	trans	-63.6	-49.7	-179.2	-168.2	0	0	0	0	111.7	P223 L224 I225 Y229 M230 E231	P223-S227 WeakPolarHBondContact O-CB 3.41Å; P223-S227 PolarHBondContact O-N 2.83Å; L224-S227 WeakPolarHBondContact O-CB 3.47Å; L224-S227 PolarHBondContact O-N 2.93Å; I225-S227 VanDerWaalsContact C-N 3.35Å; I225-S227 PolarHBondContact O-N 3.42Å; S227-Y229 VanDerWaalsContact C-N 3.33Å; S227-Y229 PolarHBondContact O-N 2.9Å; S227-M230 PolarHBondContact O-N 3.36Å; S227-E231 PolarHBondContact O-N 3.5Å
228	I	82.3	Confident	72.4	Confident	6 Å²	6	67.1 Å²	67.1	3%	0.031	37%	0.371	C	S	.	.	H	α-helix	trans	-65.4	-39.7	178.9	-57.9	167.9	0	0	0	110.5	L208 N209 Q211 L224 M230 E231 V232 L248	L208-I228 HydrophobicContact CD2-CB 4.23Å; L208-I228 HydrophobicContact CD2-CD1 3.91Å; L208-I228 HydrophobicContact CD2-CG2 3.8Å; N209-I228 HydrophobicContact CB-CG2 3.97Å; N209-I228 WeakPolarHBondContact ND2-CG2 3.24Å; Q211-I228 HydrophobicContact CB-CD1 4.31Å; Q211-I228 HydrophobicContact CG-CD1 4.13Å; L224-I228 PolarHBondContact O-N 3.17Å; L224-I228 VanDerWaalsContact O-N 3.14Å; I228-M230 VanDerWaalsContact C-N 3.32Å; I228-M230 PolarHBondContact O-N 2.68Å; I228-E231 WeakPolarHBondContact O-CB 3.37Å; I228-E231 PolarHBondContact O-N 2.88Å; I228-V232 PolarHBondContact O-N 3.44Å; I228-L248 HydrophobicContact CG2-CD2 3.95Å
229	Y	82.6	Confident	70.6	Confident	8 Å²	8	72.8 Å²	72.8	3%	0.031	40%	0.4	C	S	.	.	H	α-helix	trans	-59.8	-42.1	176.4	177.1	-117.6	0	0	0	112.3	L152 V165 N166 L167 I192 I225 R226 S227 I233 L248	L152-Y229 HydrophobicContact CD1-CD2 4.31Å; L152-Y229 HydrophobicContact CD1-CE2 4.46Å; V165-Y229 PolarHBondContact O-OH 3.44Å; N166-Y229 VanDerWaalsContact C-OH 3.23Å; N166-Y229 WeakPolarHBondContact CA-OH 3.33Å; L167-Y229 HydrophobicContact CB-CD1 4.24Å; L167-Y229 HydrophobicContact CB-CD2 3.99Å; L167-Y229 HydrophobicContact CB-CE1 4.04Å; L167-Y229 HydrophobicContact CB-CE2 3.74Å; L167-Y229 HydrophobicContact CB-CG 4.22Å; L167-Y229 HydrophobicContact CD1-CD2 3.96Å; L167-Y229 HydrophobicContact CD1-CE2 3.97Å; L167-Y229 HydrophobicContact CD2-CD2 4.3Å; L167-Y229 HydrophobicContact CD2-CG 4.34Å; L167-Y229 HydrophobicContact CG-CD2 4.31Å; L167-Y229 HydrophobicContact CG-CE2 4.37Å; L167-Y229 PolarHBondContact N-OH 3.35Å; L167-Y229 VanDerWaalsContact N-OH 3.09Å; I192-Y229 HydrophobicContact CD1-CE2 3.62Å; I192-Y229 VanDerWaalsContact CD1-OH 3.26Å; I192-Y229 WeakPolarHBondContact CD1-OH 3.37Å; I225-Y229 WeakPolarHBondContact O-CB 3.17Å; I225-Y229 PolarHBondContact O-N 3.13Å; R226-Y229 PolarHBondContact O-N 3.36Å; S227-Y229 VanDerWaalsContact C-N 3.33Å; S227-Y229 PolarHBondContact O-N 2.9Å; Y229-I233 HydrophobicContact CD2-CD1 4.18Å; Y229-I233 HydrophobicContact CD2-CG1 4.38Å; Y229-I233 HydrophobicContact CE1-CD1 4.31Å; Y229-I233 HydrophobicContact CE2-CD1 3.35Å; Y229-I233 HydrophobicContact CE2-CG1 4.01Å; Y229-I233 VanDerWaalsContact CZ-CD1 3.41Å; Y229-I233 WeakPolarHBondContact O-CB 3.28Å; Y229-I233 PolarHBondContact O-N 3.09Å; Y229-I233 VanDerWaalsContact OH-CD1 3.3Å; Y229-I233 WeakPolarHBondContact OH-CD1 3.33Å; Y229-L248 HydrophobicContact CD2-CD1 4.17Å
230	M	74.2	Confident	68.4	Low	79 Å²	79	75.7 Å²	75.7	39%	0.389	41%	0.409	S	S	.	.	H	α-helix	trans	-70	-34.4	174.2	-68.9	-69.5	98.4	0	0	112.9	R226 S227 I228 G234	R226-M230 WeakPolarHBondContact O-CB 3.4Å; R226-M230 VanDerWaalsContact O-CG 3.28Å; R226-M230 WeakPolarHBondContact O-CG 3.28Å; R226-M230 PolarHBondContact O-N 2.83Å; S227-M230 PolarHBondContact O-N 3.36Å; I228-M230 VanDerWaalsContact C-N 3.32Å; I228-M230 PolarHBondContact O-N 2.68Å; M230-G234 WeakPolarHBondContact O-CA 3.13Å; M230-G234 PolarHBondContact O-N 2.89Å
231	E	72	Confident	65.9	Low	130 Å²	130	82.7 Å²	82.7	61%	0.607	43%	0.429	S	S	*	.	H	α-helix	trans	-60.2	-44.6	173.7	-170.9	-177.7	170	0	0	111.6	S227 I228	S227-E231 PolarHBondContact O-N 3.5Å; I228-E231 WeakPolarHBondContact O-CB 3.37Å; I228-E231 PolarHBondContact O-N 2.88Å
232	V	72.3	Confident	63.6	Low	24 Å²	24	88.3 Å²	88.3	15%	0.145	45%	0.45	C	S	.	.	H	α-helix	trans	-79.3	-31.7	-177.6	179.6	0	0	0	0	113.2	L152 I228 C245 L248	L152-V232 HydrophobicContact CB-CG1 4.03Å; L152-V232 HydrophobicContact CD1-CB 3.96Å; L152-V232 HydrophobicContact CD1-CG1 3.5Å; L152-V232 HydrophobicContact CG-CG1 4.26Å; I228-V232 PolarHBondContact O-N 3.44Å; V232-C245 WeakPolarHBondContact CG1-O 3.35Å; V232-C245 HydrophobicContact CG2-CB 4.3Å; V232-L248 HydrophobicContact CB-CD2 4.24Å; V232-L248 HydrophobicContact CG2-CD2 3.9Å
233	I	68.6	Low	61.7	Low	53 Å²	53	92 Å²	92	27%	0.272	48%	0.476	S	S	.	.	H	α-helix	trans	-82.4	-18.9	174.7	-69.8	-158.2	0	0	0	113	L152 L155 I192 Y229 R235	L152-I233 HydrophobicContact CD1-CG1 4.02Å; L155-I233 HydrophobicContact CD1-CD1 4.18Å; I192-I233 HydrophobicContact CD1-CD1 4.29Å; Y229-I233 HydrophobicContact CD2-CD1 4.18Å; Y229-I233 HydrophobicContact CD2-CG1 4.38Å; Y229-I233 HydrophobicContact CE1-CD1 4.31Å; Y229-I233 HydrophobicContact CE2-CD1 3.35Å; Y229-I233 HydrophobicContact CE2-CG1 4.01Å; Y229-I233 VanDerWaalsContact CZ-CD1 3.41Å; Y229-I233 WeakPolarHBondContact O-CB 3.28Å; Y229-I233 PolarHBondContact O-N 3.09Å; Y229-I233 VanDerWaalsContact OH-CD1 3.3Å; Y229-I233 WeakPolarHBondContact OH-CD1 3.33Å; I233-R235 VanDerWaalsContact C-N 3.29Å; I233-R235 PolarHBondContact O-N 3.4Å
234	G	59.2	Low	60.1	Low	54 Å²	54	98.1 Å²	98.1	56%	0.557	50%	0.495	S	S	*	.			trans	-65.2	65.5	-171.4	0	0	0	0	0	116.7	M230 S236	M230-G234 WeakPolarHBondContact O-CA 3.13Å; M230-G234 PolarHBondContact O-N 2.89Å; G234-S236 PolarHBondContact O-N 3.42Å
235	R	47.2	Very low	58.5	Low	180 Å²	180	97.5 Å²	97.5	68%	0.679	50%	0.495	S	S	*	.			trans	-69.9	35.9	178	-66.6	179.1	176.9	158	0.7	114.3	I233	I233-R235 VanDerWaalsContact C-N 3.29Å; I233-R235 PolarHBondContact O-N 3.4Å
236	S	37.3	Very low	57.3	Low	113 Å²	113	102.1 Å²	102.1	79%	0.79	52%	0.519	S	S	*	.			trans	-160.8	87.1	175.7	-82.9	0	0	0	0	115.6	G234	G234-S236 PolarHBondContact O-N 3.42Å
237	S	40.2	Very low	57	Low	96 Å²	96	98.2 Å²	98.2	67%	0.671	51%	0.506	S	S	*	.				-170.3	135.8	126.3	55	0	0	0	0	110.1	I239	S237-I239 PolarHBondContact O-N 3.18Å
238	N	34.4	Very low	57.3	Low	153 Å²	153	94.6 Å²	94.6	82%	0.818	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.6	28	-163.8	-75.3	-32.1	0	0	0	115.3
239	I	46.3	Very low	57.6	Low	141 Å²	141	95.9 Å²	95.9	72%	0.723	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116	-23.6	-172.8	-60.9	179.3	0	0	0	113.2	S237	S237-I239 PolarHBondContact O-N 3.18Å
240	F	40.1	Very low	58	Low	165 Å²	165	95.5 Å²	95.5	72%	0.724	48%	0.483	S	S	*	.			trans	-121.9	45.2	-168.2	-123.2	-100.2	0	0	0	115.9	R242	F240-R242 PolarHBondContact O-N 2.9Å
241	R	30.9	Very low	58.8	Low	233 Å²	233	91.7 Å²	91.7	88%	0.879	47%	0.465	S	S	*	.			trans	-74.3	77.4	175.7	-75.6	-168.1	177.5	-169	1.9	112.8
242	R	39.5	Very low	59.8	Low	118 Å²	118	85.5 Å²	85.5	45%	0.445	44%	0.436	S	S	.	.			trans	-128.6	8.5	-178.1	-88.4	179	178.1	-132.7	9.2	118.3	F240 R805	F240-R242 PolarHBondContact O-N 2.9Å; R242-R805 VanDerWaalsContact CZ-OXT 3.31Å; R242-R805 PolarHBondContact NE-OXT 2.85Å; R242-R805 PolarHBondContact NH2-OXT 3.03Å
243	S	47.7	Very low	60.8	Low	82 Å²	82	84.5 Å²	84.5	57%	0.573	43%	0.429	S	S	*	.			trans	-148.2	149.5	156.1	82.4	0	0	0	0	111.8	C245	S243-C245 VanDerWaalsContact C-N 3.27Å; S243-C245 PolarHBondContact O-N 3.32Å
244	K	49.5	Very low	61.9	Low	206 Å²	206	84.9 Å²	84.9	90%	0.896	43%	0.427	S	S	*	.			trans	-92.9	51.6	170	-87.4	-170.8	172.5	-176.8	0	110.3	N246	K244-N246 PolarHBondContact O-N 2.77Å
245	C	52	Low	63.5	Low	43 Å²	43	85.1 Å²	85.1	29%	0.291	41%	0.414	S	S	.	.			trans	-83.2	94	171.9	-166.8	0	0	0	0	108.7	N209 V232 S243 A247	N209-C245 PolarHBondContact ND2-SG 2.92Å; V232-C245 WeakPolarHBondContact CG1-O 3.35Å; V232-C245 HydrophobicContact CG2-CB 4.3Å; S243-C245 VanDerWaalsContact C-N 3.27Å; S243-C245 PolarHBondContact O-N 3.32Å; C245-A247 PolarHBondContact SG-O 2.81Å
246	N	64.3	Low	65.4	Low	98 Å²	98	81.4 Å²	81.4	52%	0.524	42%	0.415	S	S	.	.			trans	-98.3	11.2	177.6	-76.8	20.4	0	0	0	112.4	L152 S153 K244	L152-N246 PolarHBondContact N-O 3.08Å; S153-N246 PolarHBondContact N-O 3.27Å; K244-N246 PolarHBondContact O-N 2.77Å
247	A	76.9	Confident	67.8	Low	5 Å²	5	78 Å²	78	4%	0.041	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	162.8	-168.1	0	0	0	0	0	112.5	E149 L150 N209 C245	E149-A247 HydrophobicContact CG-CB 3.46Å; E149-A247 VanDerWaalsContact CG-CB 3.46Å; E149-A247 VanDerWaalsContact OE1-CB 3.32Å; E149-A247 WeakPolarHBondContact OE1-CB 3.39Å; L150-A247 CarbonylContact O-C 3.56Å; L150-A247 WeakPolarHBondContact O-CA 3.42Å; L150-A247 VanDerWaalsContact O-CB 3.23Å; L150-A247 WeakPolarHBondContact O-CB 3.42Å; N209-A247 PolarHBondContact ND2-O 3.26Å; N209-A247 VanDerWaalsContact ND2-O 3.09Å; C245-A247 PolarHBondContact SG-O 2.81Å
248	L	85.6	Confident	70.1	Confident	0 Å²	0	73.5 Å²	73.5	0%	0	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	108.6	168.3	-53.5	-173.4	0	0	0	109.9	L150 L152 L167 L208 I228 Y229 V232 F250	L150-L248 HydrophobicContact CB-CB 4.25Å; L150-L248 WeakPolarHBondContact CB-O 3.4Å; L150-L248 HydrophobicContact CD2-CB 4.3Å; L150-L248 HydrophobicContact CD2-CD1 4.26Å; L150-L248 HydrophobicContact CD2-CG 4.42Å; L150-L248 PolarHBondContact N-O 2.85Å; L150-L248 PolarHBondContact O-N 3.42Å; L152-L248 HydrophobicContact CD1-CD1 4.3Å; L152-L248 HydrophobicContact CD1-CD2 4.1Å; L152-L248 HydrophobicContact CD1-CG 3.81Å; L167-L248 HydrophobicContact CD1-CD1 3.82Å; L167-L248 HydrophobicContact CD2-CD1 4.39Å; L208-L248 HydrophobicContact CD2-CB 4.21Å; L208-L248 HydrophobicContact CD2-CD2 4.12Å; I228-L248 HydrophobicContact CG2-CD2 3.95Å; Y229-L248 HydrophobicContact CD2-CD1 4.17Å; V232-L248 HydrophobicContact CB-CD2 4.24Å; V232-L248 HydrophobicContact CG2-CD2 3.9Å; L248-F250 HydrophobicContact CB-CD2 4.01Å; L248-F250 HydrophobicContact CB-CE2 3.56Å; L248-F250 HydrophobicContact CB-CZ 4.33Å; L248-F250 HydrophobicContact CD1-CE2 3.95Å; L248-F250 HydrophobicContact CD1-CZ 4.04Å; L248-F250 HydrophobicContact CG-CE2 4.42Å; L248-F250 WeakPolarHBondContact O-CD2 3.44Å; L248-F250 PolarHBondContact O-N 2.61Å
249	R	88.3	Confident	72.6	Confident	32 Å²	32	69.2 Å²	69.2	12%	0.121	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	108.3	169.8	-175.8	179.6	168.3	-71.7	-3.8	109.4	E130 F148 E207 L208 N209	E130-R249 IonicContact OE1-CZ 2.82Å; E130-R249 IonicContact OE1-NE 2.68Å; E130-R249 IonicContact OE1-NH2 2.67Å; E130-R249 PolarHBondContact OE1-NH2 3.06Å; E130-R249 IonicContact OE2-CZ 3.67Å; E130-R249 IonicContact OE2-NE 2.64Å; E130-R249 PolarHBondContact OE2-NE 3.24Å; E130-R249 IonicContact OE2-NH2 3.87Å; E130-R249 PolarHBondContact OE2-NH2 2.91Å; F148-R249 CarbonylContact O-C 3.56Å; F148-R249 WeakPolarHBondContact O-CA 3.5Å; E207-R249 IonicContact OE2-NH1 3.69Å; L208-R249 WeakPolarHBondContact CA-O 3.16Å; N209-R249 PolarHBondContact N-O 2.71Å; N209-R249 PolarHBondContact OD1-N 3.47Å
250	F	91.5	Very high	74.5	Confident	0 Å²	0	68 Å²	68	0%	0	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	144.7	176.3	-74.4	-92.9	0	0	0	110.9	T147 F148 L150 L169 I193 I199 L208 L248 I252	T147-F250 WeakPolarHBondContact CA-O 3.43Å; F148-F250 HydrophobicContact CD1-CB 4.18Å; F148-F250 HydrophobicContact CE1-CB 3.53Å; F148-F250 HydrophobicContact CE1-CD2 4.47Å; F148-F250 HydrophobicContact CE1-CG 4.22Å; F148-F250 HydrophobicContact CE2-CB 4.24Å; F148-F250 AromaticContact CE2-CD2 3.76Å; F148-F250 HydrophobicContact CE2-CD2 3.76Å; F148-F250 HydrophobicContact CE2-CG 4.32Å; F148-F250 HydrophobicContact CZ-CB 3.54Å; F148-F250 AromaticContact CZ-CD2 3.61Å; F148-F250 HydrophobicContact CZ-CD2 3.61Å; F148-F250 HydrophobicContact CZ-CE2 4.46Å; F148-F250 AromaticContact CZ-CG 3.73Å; F148-F250 HydrophobicContact CZ-CG 3.73Å; F148-F250 PolarHBondContact N-O 2.76Å; F148-F250 PolarHBondContact O-N 3.23Å; L150-F250 HydrophobicContact CD2-CE2 4.1Å; L169-F250 HydrophobicContact CD1-CE1 4.22Å; L169-F250 HydrophobicContact CD1-CZ 4.32Å; I193-F250 HydrophobicContact CD1-CE2 4.13Å; I193-F250 HydrophobicContact CD1-CZ 4.3Å; I199-F250 HydrophobicContact CD1-CD1 4.25Å; I199-F250 HydrophobicContact CD1-CE1 4.13Å; I199-F250 HydrophobicContact CD1-CZ 4.3Å; L208-F250 HydrophobicContact CD1-CD1 4.07Å; L208-F250 HydrophobicContact CD1-CE1 3.44Å; L208-F250 VanDerWaalsContact CD1-CE1 3.44Å; L208-F250 HydrophobicContact CD1-CZ 3.79Å; L208-F250 HydrophobicContact CG-CD1 3.99Å; L208-F250 HydrophobicContact CG-CE1 3.84Å; L208-F250 HydrophobicContact CG-CG 4.49Å; L208-F250 HydrophobicContact CG-CZ 4.2Å; L248-F250 HydrophobicContact CB-CD2 4.01Å; L248-F250 HydrophobicContact CB-CE2 3.56Å; L248-F250 HydrophobicContact CB-CZ 4.33Å; L248-F250 HydrophobicContact CD1-CE2 3.95Å; L248-F250 HydrophobicContact CD1-CZ 4.04Å; L248-F250 HydrophobicContact CG-CE2 4.42Å; L248-F250 WeakPolarHBondContact O-CD2 3.44Å; L248-F250 PolarHBondContact O-N 2.61Å; F250-I252 HydrophobicContact CB-CG2 4.38Å
251	V	91	Very high	76.6	Confident	0 Å²	0	63.3 Å²	63.3	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	126.4	160.6	-176.3	0	0	0	0	107.3	L134 Y138 I145 T147 L206 E207	L134-V251 HydrophobicContact CD1-CG1 4.01Å; L134-V251 HydrophobicContact CD1-CG2 3.69Å; L134-V251 HydrophobicContact CD2-CG1 4.34Å; L134-V251 HydrophobicContact CD2-CG2 4.31Å; Y138-V251 HydrophobicContact CE2-CG1 4.44Å; I145-V251 HydrophobicContact CG2-CG1 3.93Å; T147-V251 HydrophobicContact CG2-CG2 4.14Å; L206-V251 WeakPolarHBondContact CA-O 3.49Å; L206-V251 HydrophobicContact CB-CB 4.42Å; L206-V251 HydrophobicContact CB-CG1 4.19Å; L206-V251 WeakPolarHBondContact CB-O 3.5Å; L206-V251 HydrophobicContact CD1-CG1 4.32Å; L206-V251 PolarHBondContact N-O 3.19Å; E207-V251 HydrophobicContact CB-CB 3.84Å; E207-V251 HydrophobicContact CB-CG2 3.88Å; E207-V251 HydrophobicContact CG-CB 4.08Å; E207-V251 HydrophobicContact CG-CG2 4.17Å; E207-V251 PolarHBondContact N-O 3.11Å; E207-V251 VanDerWaalsContact N-O 3.09Å; E207-V251 PolarHBondContact O-N 2.92Å
252	I	93.7	Very high	79.1	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	156.1	-176.8	66.3	176.3	0	0	0	110.9	I145 I146 F148 D203 Q204 L205 F250	I145-I252 WeakPolarHBondContact CA-O 3.45Å; I146-I252 HydrophobicContact CB-CD1 4.16Å; I146-I252 HydrophobicContact CB-CG1 3.74Å; I146-I252 HydrophobicContact CG2-CD1 4.44Å; I146-I252 HydrophobicContact CG2-CG1 4.39Å; I146-I252 PolarHBondContact N-O 3.34Å; I146-I252 PolarHBondContact O-N 2.95Å; F148-I252 HydrophobicContact CE1-CD1 4.12Å; D203-I252 HydrophobicContact CB-CD1 4.23Å; D203-I252 WeakPolarHBondContact OD2-CD1 3.22Å; Q204-I252 CarbonylContact O-C 3.56Å; Q204-I252 WeakPolarHBondContact O-CA 3.19Å; Q204-I252 WeakPolarHBondContact O-CB 3.39Å; L205-I252 HydrophobicContact CD2-CG2 3.65Å; F250-I252 HydrophobicContact CB-CG2 4.38Å
253	Q	93.1	Very high	81.1	Confident	2 Å²	2	48.9 Å²	48.9	1%	0.009	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	121.3	169.1	166.1	-98.8	1.2	0	0	109.6	L141 P142 E144 I145 Q204 L206 N258	L141-Q253 HydrophobicContact CB-CG 4.13Å; L141-Q253 HydrophobicContact CD1-CB 4.38Å; L141-Q253 HydrophobicContact CD1-CG 4.39Å; P142-Q253 WeakPolarHBondContact O-CG 3.47Å; P142-Q253 PolarHBondContact O-NE2 3.29Å; E144-Q253 WeakPolarHBondContact O-CA 3.34Å; I145-Q253 HydrophobicContact CD1-CB 3.81Å; I145-Q253 HydrophobicContact CD1-CG 4.1Å; Q204-Q253 HydrophobicContact CB-CB 4.48Å; Q204-Q253 PolarHBondContact N-O 2.9Å; Q204-Q253 PolarHBondContact O-N 2.94Å; L206-Q253 HydrophobicContact CD1-CB 3.71Å; L206-Q253 HydrophobicContact CD2-CB 4.39Å; L206-Q253 HydrophobicContact CG-CB 4.16Å; Q253-N258 PolarHBondContact NE2-OD1 2.98Å; Q253-N258 PolarHBondContact O-ND2 3.01Å; Q253-N258 PolarHBondContact OE1-ND2 3.18Å
254	R	91.9	Very high	82.5	Confident	61 Å²	61	45.1 Å²	45.1	23%	0.23	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	116	178.1	-177	165.3	-65.3	173.8	1.8	109.9	G143 E144 I146 H198 E200 D203	G143-R254 WeakPolarHBondContact CA-O 3.24Å; E144-R254 PolarHBondContact N-O 3.09Å; E144-R254 PolarHBondContact O-N 2.92Å; I146-R254 HydrophobicContact CD1-CB 3.87Å; H198-R254 PolarHBondContact O-NH2 2.97Å; E200-R254 IonicContact OE1-CZ 2.71Å; E200-R254 VanDerWaalsContact OE1-CZ 3.31Å; E200-R254 IonicContact OE1-NH1 3.22Å; E200-R254 PolarHBondContact OE1-NH1 2.72Å; E200-R254 IonicContact OE1-NH2 3.31Å; E200-R254 IonicContact OE2-CZ 3.92Å; E200-R254 IonicContact OE2-NE 3.74Å; E200-R254 IonicContact OE2-NH1 3.38Å; D203-R254 VanDerWaalsContact OD1-CB 3.26Å; D203-R254 WeakPolarHBondContact OD1-CB 3.48Å; D203-R254 VanDerWaalsContact OD1-CG 3.29Å; D203-R254 WeakPolarHBondContact OD1-CG 3.38Å; D203-R254 IonicContact OD1-CZ 2.7Å; D203-R254 IonicContact OD1-NE 3.93Å; D203-R254 PolarHBondContact OD1-NE 2.93Å; D203-R254 IonicContact OD1-NH2 3.69Å; D203-R254 IonicContact OD2-CZ 3.73Å; D203-R254 IonicContact OD2-NE 3.1Å; D203-R254 PolarHBondContact OD2-NE 2.67Å; D203-R254 IonicContact OD2-NH2 3.33Å; D203-R254 PolarHBondContact OD2-NH2 2.64Å
255	H	91.7	Very high	83.6	Confident	59 Å²	59	41.9 Å²	41.9	27%	0.273	24%	0.237	S	C	.	.			trans	-148.2	139.4	176.3	-169.1	-116.8	0	0	0	111.9	P142 S257 N258	P142-H255 WeakPolarHBondContact O-CB 3.37Å; H255-S257 PolarHBondContact CE1-OG 3.15Å; H255-S257 PolarHBondContact ND1-OG 3.1Å; H255-S257 PolarHBondContact O-N 2.88Å; H255-S257 VanDerWaalsContact O-N 3.12Å; H255-N258 WeakPolarHBondContact O-CB 3.27Å; H255-N258 PolarHBondContact O-N 3.42Å
256	S	87.7	Confident	84.1	Confident	102 Å²	102	42.5 Å²	42.5	71%	0.713	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-19.5	-174.5	56.4	0	0	0	0	114.3	T259	S256-T259 PolarHBondContact O-OG1 2.91Å
257	S	87.3	Confident	83.9	Confident	41 Å²	41	40.9 Å²	40.9	29%	0.287	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.6	-19.4	174.8	74.9	0	0	0	0	114.1	H255 T259 N260 L261	H255-S257 PolarHBondContact CE1-OG 3.15Å; H255-S257 PolarHBondContact ND1-OG 3.1Å; H255-S257 PolarHBondContact O-N 2.88Å; H255-S257 VanDerWaalsContact O-N 3.12Å; S257-T259 PolarHBondContact O-N 3.4Å; S257-N260 WeakPolarHBondContact O-CB 3.1Å; S257-N260 PolarHBondContact O-N 2.78Å; S257-L261 PolarHBondContact O-N 3.12Å
258	N	88.8	Confident	82.3	Confident	2 Å²	2	45.3 Å²	45.3	1%	0.011	26%	0.262	C	S	.	.	H	α-helix	trans	-60.6	-34.9	-171.2	-73.1	1.9	0	0	0	112.4	F183 G202 Q253 H255 N260 L261 M262	F183-N258 HydrophobicContact CD1-CB 4.06Å; F183-N258 HydrophobicContact CE1-CB 3.76Å; G202-N258 WeakPolarHBondContact O-CB 3.49Å; G202-N258 PolarHBondContact O-ND2 2.82Å; G202-N258 VanDerWaalsContact O-ND2 3.12Å; Q253-N258 PolarHBondContact NE2-OD1 2.98Å; Q253-N258 PolarHBondContact O-ND2 3.01Å; Q253-N258 PolarHBondContact OE1-ND2 3.18Å; H255-N258 WeakPolarHBondContact O-CB 3.27Å; H255-N258 PolarHBondContact O-N 3.42Å; N258-N260 PolarHBondContact O-N 3.46Å; N258-L261 CarbonylContact O-C 3.49Å; N258-L261 WeakPolarHBondContact O-CA 3.45Å; N258-L261 WeakPolarHBondContact O-CB 3.18Å; N258-L261 PolarHBondContact O-N 2.88Å; N258-M262 WeakPolarHBondContact O-CG 3.5Å; N258-M262 PolarHBondContact O-N 2.85Å; N258-M262 VanDerWaalsContact O-N 3.16Å
259	T	87.2	Confident	80.1	Confident	64 Å²	64	54 Å²	54	39%	0.393	30%	0.303	S	S	.	.	H	α-helix	trans	-57.1	-33.3	175.2	52.5	0	0	0	0	113	S256 S257 M262	S256-T259 PolarHBondContact O-OG1 2.91Å; S257-T259 PolarHBondContact O-N 3.4Å; T259-M262 HydrophobicContact CG2-CE 4.44Å
260	N	85.3	Confident	77.7	Confident	114 Å²	114	61 Å²	61	61%	0.61	34%	0.336	S	S	*	.	H	α-helix	trans	-78.9	-21.1	175.7	-60.3	-61.5	0	0	0	113	S257 N258	S257-N260 WeakPolarHBondContact O-CB 3.1Å; S257-N260 PolarHBondContact O-N 2.78Å; N258-N260 PolarHBondContact O-N 3.46Å
261	L	84.1	Confident	74.8	Confident	68 Å²	68	65.1 Å²	65.1	36%	0.356	37%	0.37	S	S	.	.	H	α-helix	trans	-85.5	-12.3	176.6	-58.5	178.1	0	0	0	112.7	S174 R175 F183 S257 N258	S174-L261 CarbonylContact C-O 3.46Å; S174-L261 WeakPolarHBondContact CA-O 2.87Å; R175-L261 WeakPolarHBondContact CB-O 3.43Å; R175-L261 PolarHBondContact N-O 2.76Å; F183-L261 HydrophobicContact CE2-CB 3.84Å; F183-L261 HydrophobicContact CZ-CB 3.7Å; F183-L261 HydrophobicContact CZ-CD1 4.2Å; S257-L261 PolarHBondContact O-N 3.12Å; N258-L261 CarbonylContact O-C 3.49Å; N258-L261 WeakPolarHBondContact O-CA 3.45Å; N258-L261 WeakPolarHBondContact O-CB 3.18Å; N258-L261 PolarHBondContact O-N 2.88Å
262	M	84.9	Confident	71.8	Confident	8 Å²	8	72.6 Å²	72.6	4%	0.039	41%	0.41	C	S	.	.	B	Isolated β-bridge	trans	-70.4	139.1	178.1	-61.5	-156	-75.4	0	0	112.5	F183 C185 V201 N258 T259 A264 A266	F183-M262 HydrophobicContact CB-CG 3.58Å; F183-M262 HydrophobicContact CB-SD 3.58Å; F183-M262 VanDerWaalsContact CB-SD 3.58Å; F183-M262 HydrophobicContact CD2-CG 3.9Å; F183-M262 HydrophobicContact CG-CG 3.79Å; F183-M262 HydrophobicContact CG-SD 4.4Å; C185-M262 HydrophobicContact CB-CE 4.49Å; C185-M262 HydrophobicContact CB-SD 4.04Å; V201-M262 HydrophobicContact CG1-CE 4.09Å; N258-M262 WeakPolarHBondContact O-CG 3.5Å; N258-M262 PolarHBondContact O-N 2.85Å; N258-M262 VanDerWaalsContact O-N 3.16Å; T259-M262 HydrophobicContact CG2-CE 4.44Å; M262-A264 VanDerWaalsContact C-N 3.32Å; M262-A264 VanDerWaalsContact CB-O 3.31Å; M262-A264 WeakPolarHBondContact CB-O 3.46Å; M262-A266 HydrophobicContact CE-CB 4.12Å
263	A	81.9	Confident	68.9	Low	39 Å²	39	78.6 Å²	78.6	32%	0.322	45%	0.452	S	S	.	.	S	Bend	trans	-73.3	-21.8	172	0	0	0	0	0	113.8	G173	G173-A263 WeakPolarHBondContact O-CB 3.41Å; G173-A263 PolarHBondContact O-N 3.11Å
264	A	76.7	Confident	66	Low	4 Å²	4	83.7 Å²	83.7	3%	0.033	49%	0.488	C	S	.	.	S	Bend	trans	-116.3	148.9	176.2	0	0	0	0	0	110.5	A172 C185 M262	A172-A264 HydrophobicContact CB-CB 3.8Å; C185-A264 HydrophobicContact CB-CB 4.3Å; M262-A264 VanDerWaalsContact C-N 3.32Å; M262-A264 VanDerWaalsContact CB-O 3.31Å; M262-A264 WeakPolarHBondContact CB-O 3.46Å
265	L	72.7	Confident	63.2	Low	137 Å²	137	85.8 Å²	85.8	72%	0.717	51%	0.512	S	S	*	.			trans	-69.7	150.4	176.9	-63.5	174.6	0	0	0	111.3	T267	L265-T267 PolarHBondContact O-N 3.47Å
266	A	62.1	Low	60.4	Low	56 Å²	56	90 Å²	90	46%	0.463	54%	0.536	S	S	.	.			trans	-67	110.5	176.5	0	0	0	0	0	111.5	C185 V201 M262 N268	C185-A266 WeakPolarHBondContact O-CA 3.27Å; V201-A266 HydrophobicContact CG1-CB 3.49Å; V201-A266 VanDerWaalsContact CG1-CB 3.49Å; M262-A266 HydrophobicContact CE-CB 4.12Å; A266-N268 PolarHBondContact O-N 2.8Å
267	T	59.8	Low	57.6	Low	65 Å²	65	96.7 Å²	96.7	40%	0.399	55%	0.546	S	S	.	.			trans	-92.5	80.4	-179	73.1	0	0	0	0	111.6	K170 C185 L265	K170-T267 PolarHBondContact NZ-OG1 3.08Å; C185-T267 PolarHBondContact O-N 2.78Å; L265-T267 PolarHBondContact O-N 3.47Å
268	N	43.8	Very low	55	Low	98 Å²	98	99.1 Å²	99.1	52%	0.524	56%	0.563	S	S	.	*			trans	-131	51.7	-177.2	-92.1	9.9	0	0	0	113	V201 A266	V201-N268 VanDerWaalsContact CG2-ND2 3.35Å; V201-N268 WeakPolarHBondContact CG2-ND2 3.41Å; V201-N268 WeakPolarHBondContact CG2-OD1 3.41Å; A266-N268 PolarHBondContact O-N 2.8Å
269	Q	38.6	Very low	52.2	Low	183 Å²	183	103.1 Å²	103.1	86%	0.855	59%	0.591	S	S	*	*			trans	-139.3	130.2	172.4	-71.1	-169	-7	0	0	112.9
270	H	37.6	Very low	49.5	Very low	179 Å²	179	111 Å²	111	83%	0.829	61%	0.614	S	S	*	*			trans	39.4	118.3	158.8	-68.1	-83.1	0	0	0	120.5
271	A	30.3	Very low	46.8	Very low	86 Å²	86	114.7 Å²	114.7	71%	0.711	63%	0.627	S	S	*	*			trans	-71.3	138.8	143.5	0	0	0	0	0	109.4
272	D	28.1	Very low	44.4	Very low	157 Å²	157	116 Å²	116	84%	0.84	64%	0.64	S	S	*	*			trans	177.6	73.5	142.7	-91.8	-17.7	0	0	0	109.6
273	S	33.3	Very low	41.9	Very low	125 Å²	125	121.1 Å²	121.1	87%	0.874	68%	0.676	S	S	*	*			trans	-162.3	116.3	164	-78.7	0	0	0	0	109.6
274	S	32.5	Very low	39.7	Very low	109 Å²	109	125 Å²	125	76%	0.762	70%	0.696	S	S	*	*			trans	-86.9	166.2	164.1	49.6	0	0	0	0	110
275	S	33	Very low	37.5	Very low	105 Å²	105	130.6 Å²	130.6	73%	0.734	73%	0.725	S	S	*	*			trans	71.4	155.6	-173.6	89.2	0	0	0	0	114.2
276	D	32.7	Very low	35.7	Very low	148 Å²	148	131.3 Å²	131.3	79%	0.791	74%	0.735	S	S	*	*			cis	-150.4	176.4	-7.2	-139.5	-31.5	0	0	0	113.5
277	R	29.7	Very low	34.4	Very low	242 Å²	242	133.3 Å²	133.3	91%	0.913	74%	0.742	S	S	*	*			trans	-83.1	104	174.7	-68.7	170.9	166.4	171.8	-3.8	112.4
278	S	32.1	Very low	33.1	Very low	93 Å²	93	136 Å²	136	65%	0.65	76%	0.758	S	S	*	*			trans	-146.3	122.3	162.3	-149.9	0	0	0	0	109.4
279	S	29.7	Very low	32.6	Very low	85 Å²	85	136.8 Å²	136.8	59%	0.594	77%	0.771	S	S	*	*				67.9	110.1	66.3	109.6	0	0	0	0	112.2
280	R	30.6	Very low	32.5	Very low	230 Å²	230	132.7 Å²	132.7	87%	0.868	77%	0.768	S	S	*	*				52.1	96.4	97.3	-81.7	-169.2	-81.2	163.5	-5.2	113.2
281	H	29.2	Very low	32.1	Very low	191 Å²	191	132.1 Å²	132.1	88%	0.884	77%	0.771	S	S	*	*				-165	159.7	127.3	-101.8	-69.8	0	0	0	110.8
282	P	33.2	Very low	32.3	Very low	97 Å²	97	132.9 Å²	132.9	63%	0.63	77%	0.767	S	S	*	*			trans	-112	173	-174.2	41.2	-33	0	0	0	114
283	S	31.5	Very low	32.5	Very low	114 Å²	114	128.9 Å²	128.9	80%	0.797	75%	0.751	S	S	*	*			trans	71.1	155.2	164.1	86.6	0	0	0	0	115
284	V	37.3	Very low	32.5	Very low	122 Å²	122	129.6 Å²	129.6	74%	0.739	75%	0.752	S	S	*	*			cis	-156.5	-178.9	-4.9	100.9	0	0	0	0	109.5
285	D	30	Very low	32.6	Very low	121 Å²	121	129.1 Å²	129.1	65%	0.647	75%	0.745	S	S	*	*			trans	67.1	103.2	169.4	-70.6	-33.1	0	0	0	119.7	T287	D285-T287 WeakPolarHBondContact OD1-CG2 3.42Å
286	T	33.8	Very low	32.9	Very low	151 Å²	151	129.8 Å²	129.8	93%	0.926	74%	0.735	S	S	*	*				-136.8	113.9	128.3	-72.3	0	0	0	0	107.6
287	T	36.8	Very low	33.2	Very low	99 Å²	99	129 Å²	129	61%	0.607	73%	0.73	S	S	*	*			trans	-106.1	154.1	-165.8	54.7	0	0	0	0	112.4	D285	D285-T287 WeakPolarHBondContact OD1-CG2 3.42Å
288	T	32.3	Very low	33.9	Very low	122 Å²	122	123.2 Å²	123.2	75%	0.748	72%	0.717	S	S	*	*			trans	64.7	112.7	164.4	-13.4	0	0	0	0	115
289	S	32.8	Very low	34.2	Very low	114 Å²	114	123 Å²	123	80%	0.797	71%	0.708	S	S	*	*				-166.8	173.6	72.7	-68.9	0	0	0	0	113.7
290	A	35.6	Very low	34.9	Very low	96 Å²	96	126.1 Å²	126.1	79%	0.793	71%	0.711	S	S	*	*			trans	74.5	78	174.5	0	0	0	0	0	117.2
291	L	30.8	Very low	35.6	Very low	168 Å²	168	117.7 Å²	117.7	88%	0.88	69%	0.69	S	S	*	*			trans	-69.1	128.1	169.9	-57.5	81.2	0	0	0	111.7
292	T	32.7	Very low	36.4	Very low	102 Å²	102	114.9 Å²	114.9	63%	0.626	68%	0.676	S	S	*	*			trans	-141.9	103.4	149	57.7	0	0	0	0	113.2	K296	T292-K296 PolarHBondContact OG1-NZ 3.09Å; T292-K296 VanDerWaalsContact OG1-NZ 3.07Å
293	S	33.2	Very low	37.1	Very low	72 Å²	72	115.5 Å²	115.5	50%	0.503	67%	0.67	S	S	.	*			trans	47.6	120.9	156.5	61.5	0	0	0	0	119.6	V295	S293-V295 PolarHBondContact O-N 2.88Å
294	P	32.2	Very low	37.9	Very low	140 Å²	140	113 Å²	113	91%	0.909	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.7	35.1	-175.3	35.2	-39	0	0	0	115.2
295	V	36.7	Very low	38.7	Very low	100 Å²	100	109.6 Å²	109.6	61%	0.606	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.9	-19.1	-176	-175.1	0	0	0	0	112.4	S293 N297	S293-V295 PolarHBondContact O-N 2.88Å; V295-N297 PolarHBondContact O-N 2.91Å
296	K	39.2	Very low	39.6	Very low	118 Å²	118	109.3 Å²	109.3	51%	0.513	63%	0.625	S	S	.	*	S	Bend	trans	-78	-20.2	-169.9	-66.2	174.4	-177.4	168.1	0	115.1	T292 N299	T292-K296 PolarHBondContact OG1-NZ 3.09Å; T292-K296 VanDerWaalsContact OG1-NZ 3.07Å; K296-N299 WeakPolarHBondContact O-CB 3.36Å; K296-N299 PolarHBondContact O-N 2.99Å
297	N	38.2	Very low	40.4	Very low	132 Å²	132	109.7 Å²	109.7	71%	0.706	61%	0.614	S	S	*	*	H	α-helix	trans	-73.1	-30.7	-173.6	-74.3	2.3	0	0	0	113.9	V295 N299 K300 A301	V295-N297 PolarHBondContact O-N 2.91Å; N297-N299 PolarHBondContact O-N 3.38Å; N297-K300 PolarHBondContact O-N 3.27Å; N297-K300 VanDerWaalsContact O-N 3.16Å; N297-A301 PolarHBondContact O-N 2.62Å
298	I	43.8	Very low	40.8	Very low	121 Å²	121	108.4 Å²	108.4	62%	0.621	60%	0.601	S	S	*	*	H	α-helix	trans	-58.6	-33.1	173.1	-61.7	174.2	0	0	0	110.6	K302	I298-K302 PolarHBondContact O-N 3.21Å
299	N	39.8	Very low	41.4	Very low	89 Å²	89	105.9 Å²	105.9	48%	0.476	58%	0.583	S	S	.	*	H	α-helix	trans	-73.5	-27.8	-178.7	-65.5	-8.6	0	0	0	112.9	K296 N297 K302 Q303	K296-N299 WeakPolarHBondContact O-CB 3.36Å; K296-N299 PolarHBondContact O-N 2.99Å; N297-N299 PolarHBondContact O-N 3.38Å; N299-K302 PolarHBondContact O-N 3.11Å; N299-Q303 WeakPolarHBondContact O-CB 3.36Å; N299-Q303 VanDerWaalsContact O-CG 3.27Å; N299-Q303 WeakPolarHBondContact O-CG 3.48Å; N299-Q303 PolarHBondContact O-N 3.27Å
300	K	43.2	Very low	42.3	Very low	149 Å²	149	107 Å²	107	65%	0.648	58%	0.58	S	S	*	*	H	α-helix	trans	-72.1	-41.1	174.1	-76	-169.7	174.2	-174	0	112.1	N297 K302 Q303 S304	N297-K300 PolarHBondContact O-N 3.27Å; N297-K300 VanDerWaalsContact O-N 3.16Å; K300-K302 VanDerWaalsContact C-N 3.34Å; K300-Q303 PolarHBondContact O-N 3.03Å; K300-S304 PolarHBondContact O-N 2.75Å; K300-S304 PolarHBondContact O-OG 3.34Å
301	A	44.6	Very low	42.6	Very low	53 Å²	53	104 Å²	104	44%	0.438	56%	0.556	S	S	.	*	H	α-helix	trans	-65	-37.9	171.8	0	0	0	0	0	111.6	N297 S304 I305	N297-A301 PolarHBondContact O-N 2.62Å; A301-S304 PolarHBondContact O-OG 3.47Å; A301-I305 WeakPolarHBondContact O-CB 3.24Å; A301-I305 WeakPolarHBondContact O-CD1 3.46Å; A301-I305 VanDerWaalsContact O-CG1 3.23Å; A301-I305 WeakPolarHBondContact O-CG1 3.1Å; A301-I305 PolarHBondContact O-N 3.01Å
302	K	46.4	Very low	43.1	Very low	133 Å²	133	98.8 Å²	98.8	58%	0.578	53%	0.526	S	S	*	.	H	α-helix	trans	-61	-41.2	168.9	-93	-170.3	169	-170.6	0	112.7	I298 N299 K300 I305 E306	I298-K302 PolarHBondContact O-N 3.21Å; N299-K302 PolarHBondContact O-N 3.11Å; K300-K302 VanDerWaalsContact C-N 3.34Å; K302-I305 CarbonylContact O-C 3.55Å; K302-I305 PolarHBondContact O-N 2.82Å; K302-E306 WeakPolarHBondContact O-CB 3.47Å; K302-E306 PolarHBondContact O-N 2.99Å
303	Q	48.4	Very low	43.3	Very low	110 Å²	110	95.5 Å²	95.5	51%	0.514	51%	0.512	S	S	.	.	H	α-helix	trans	-69.9	-36.6	179.7	-79.7	172.7	-20.3	0	0	112.9	N299 K300 E306 F307	N299-Q303 WeakPolarHBondContact O-CB 3.36Å; N299-Q303 VanDerWaalsContact O-CG 3.27Å; N299-Q303 WeakPolarHBondContact O-CG 3.48Å; N299-Q303 PolarHBondContact O-N 3.27Å; K300-Q303 PolarHBondContact O-N 3.03Å; Q303-E306 PolarHBondContact O-N 2.71Å; Q303-F307 WeakPolarHBondContact O-CB 3.29Å; Q303-F307 WeakPolarHBondContact O-CD2 3.17Å; Q303-F307 PolarHBondContact O-N 2.84Å
304	S	48.9	Very low	43.8	Very low	62 Å²	62	98.2 Å²	98.2	43%	0.434	53%	0.531	S	S	.	.	H	α-helix	trans	-67.6	-38.2	170.9	58.8	0	0	0	0	111.6	K300 A301 F307 M308	K300-S304 PolarHBondContact O-N 2.75Å; K300-S304 PolarHBondContact O-OG 3.34Å; A301-S304 PolarHBondContact O-OG 3.47Å; S304-F307 PolarHBondContact O-N 3.05Å; S304-M308 WeakPolarHBondContact O-CG 3.5Å; S304-M308 PolarHBondContact O-N 3.33Å
305	I	52.8	Low	44.5	Very low	49 Å²	49	96.4 Å²	96.4	25%	0.251	52%	0.522	S	S	.	.	H	α-helix	trans	-65.1	-38.8	171.7	-69.5	166.4	0	0	0	111.6	A301 K302 M308 N309 L319 W407	A301-I305 WeakPolarHBondContact O-CB 3.24Å; A301-I305 WeakPolarHBondContact O-CD1 3.46Å; A301-I305 VanDerWaalsContact O-CG1 3.23Å; A301-I305 WeakPolarHBondContact O-CG1 3.1Å; A301-I305 PolarHBondContact O-N 3.01Å; K302-I305 CarbonylContact O-C 3.55Å; K302-I305 PolarHBondContact O-N 2.82Å; I305-M308 PolarHBondContact O-N 3.16Å; I305-N309 WeakPolarHBondContact O-CB 3.46Å; I305-N309 PolarHBondContact O-N 3Å; I305-N309 PolarHBondContact O-ND2 2.84Å; I305-N309 PolarHBondContact O-OD1 3.38Å; I305-L319 HydrophobicContact CG2-CD1 4.46Å; I305-W407 HydrophobicContact CD1-CH2 4.3Å
306	E	50.1	Low	44.9	Very low	116 Å²	116	94.3 Å²	94.3	54%	0.542	51%	0.505	S	S	.	.	H	α-helix	trans	-63.3	-44.3	172.2	-95.6	173.8	157.1	0	0	111.4	K302 Q303 M308 N309 L310	K302-E306 WeakPolarHBondContact O-CB 3.47Å; K302-E306 PolarHBondContact O-N 2.99Å; Q303-E306 PolarHBondContact O-N 2.71Å; E306-M308 VanDerWaalsContact C-N 3.34Å; E306-M308 PolarHBondContact O-N 3.44Å; E306-N309 PolarHBondContact O-N 2.84Å; E306-L310 WeakPolarHBondContact O-CB 3.44Å; E306-L310 VanDerWaalsContact O-CD1 3.23Å; E306-L310 WeakPolarHBondContact O-CD1 3.43Å; E306-L310 PolarHBondContact O-N 3.4Å
307	F	50.7	Low	45.4	Very low	158 Å²	158	90.1 Å²	90.1	69%	0.693	50%	0.496	S	S	*	.	H	α-helix	trans	-62.3	-39	173.6	-99.1	-94.5	0	0	0	112.4	Q303 S304 L310 A311	Q303-F307 WeakPolarHBondContact O-CB 3.29Å; Q303-F307 WeakPolarHBondContact O-CD2 3.17Å; Q303-F307 PolarHBondContact O-N 2.84Å; S304-F307 PolarHBondContact O-N 3.05Å; F307-L310 PolarHBondContact O-N 3.13Å; F307-A311 VanDerWaalsContact O-CB 3.27Å; F307-A311 WeakPolarHBondContact O-CB 3.37Å; F307-A311 PolarHBondContact O-N 3.29Å
308	M	44.1	Very low	46	Very low	72 Å²	72	88.5 Å²	88.5	36%	0.355	49%	0.492	S	S	.	.	H	α-helix	trans	-67.5	-39	172.9	-70.3	-152.8	-63.1	0	0	112	S304 I305 E306 L310 A311 F312 L319	S304-M308 WeakPolarHBondContact O-CG 3.5Å; S304-M308 PolarHBondContact O-N 3.33Å; I305-M308 PolarHBondContact O-N 3.16Å; E306-M308 VanDerWaalsContact C-N 3.34Å; E306-M308 PolarHBondContact O-N 3.44Å; M308-L310 VanDerWaalsContact C-N 3.35Å; M308-L310 PolarHBondContact O-N 2.9Å; M308-A311 PolarHBondContact O-N 3.24Å; M308-F312 HydrophobicContact CB-CD2 3.97Å; M308-F312 HydrophobicContact CB-CE2 3.89Å; M308-F312 HydrophobicContact CG-CE2 4.04Å; M308-F312 WeakPolarHBondContact O-CB 3.36Å; M308-F312 WeakPolarHBondContact O-CD2 3.24Å; M308-F312 WeakPolarHBondContact O-CG 3.44Å; M308-F312 PolarHBondContact O-N 3.19Å; M308-F312 HydrophobicContact SD-CE2 3.93Å; M308-L319 HydrophobicContact CB-CD1 4.32Å; M308-L319 HydrophobicContact CE-CD1 3.98Å
309	N	45.8	Very low	46.2	Very low	69 Å²	69	84.2 Å²	84.2	37%	0.369	47%	0.47	S	S	.	.	H	α-helix	trans	-66	-35.9	174.4	-66.9	-22	0	0	0	112.1	I305 E306 G313	I305-N309 WeakPolarHBondContact O-CB 3.46Å; I305-N309 PolarHBondContact O-N 3Å; I305-N309 PolarHBondContact O-ND2 2.84Å; I305-N309 PolarHBondContact O-OD1 3.38Å; E306-N309 PolarHBondContact O-N 2.84Å; N309-G313 WeakPolarHBondContact O-CA 3.47Å; N309-G313 PolarHBondContact O-N 2.86Å
310	L	51.8	Low	47.5	Very low	137 Å²	137	82 Å²	82	72%	0.717	46%	0.46	S	S	*	.	H	α-helix	trans	-71.6	-30.4	172.2	-95	74.1	0	0	0	112.7	E306 F307 M308	E306-L310 WeakPolarHBondContact O-CB 3.44Å; E306-L310 VanDerWaalsContact O-CD1 3.23Å; E306-L310 WeakPolarHBondContact O-CD1 3.43Å; E306-L310 PolarHBondContact O-N 3.4Å; F307-L310 PolarHBondContact O-N 3.13Å; M308-L310 VanDerWaalsContact C-N 3.35Å; M308-L310 PolarHBondContact O-N 2.9Å
311	A	41.2	Very low	48.9	Very low	35 Å²	35	79.2 Å²	79.2	29%	0.289	45%	0.449	S	S	.	.	H	α-helix	trans	-78.2	-43	178.2	0	0	0	0	0	112.6	F307 M308	F307-A311 VanDerWaalsContact O-CB 3.27Å; F307-A311 WeakPolarHBondContact O-CB 3.37Å; F307-A311 PolarHBondContact O-N 3.29Å; M308-A311 PolarHBondContact O-N 3.24Å
312	F	41.9	Very low	50.5	Low	58 Å²	58	79.2 Å²	79.2	25%	0.254	44%	0.44	S	S	.	.	H	α-helix	trans	-95.2	-9	-175.4	-55.9	-51.5	0	0	0	114.2	M308 H316 F409 A573	M308-F312 HydrophobicContact CB-CD2 3.97Å; M308-F312 HydrophobicContact CB-CE2 3.89Å; M308-F312 HydrophobicContact CG-CE2 4.04Å; M308-F312 WeakPolarHBondContact O-CB 3.36Å; M308-F312 WeakPolarHBondContact O-CD2 3.24Å; M308-F312 WeakPolarHBondContact O-CG 3.44Å; M308-F312 PolarHBondContact O-N 3.19Å; M308-F312 HydrophobicContact SD-CE2 3.93Å; F312-H316 PolarHBondContact O-CD2 3.4Å; F312-H316 PolarHBondContact O-NE2 3.32Å; F312-F409 HydrophobicContact CB-CZ 4.07Å; F312-F409 AromaticContact CD2-CZ 3.91Å; F312-F409 HydrophobicContact CD2-CZ 3.91Å; F312-F409 HydrophobicContact CG-CZ 4.19Å; F312-A573 HydrophobicContact CD1-CB 4.22Å
313	G	36.9	Very low	52.5	Low	32 Å²	32	78.3 Å²	78.3	33%	0.33	44%	0.441	S	S	.	.			trans	78.5	160.5	173.6	0	0	0	0	0	114.8	N309 S315	N309-G313 WeakPolarHBondContact O-CA 3.47Å; N309-G313 PolarHBondContact O-N 2.86Å; G313-S315 PolarHBondContact O-N 2.63Å
314	S	43.2	Very low	54.5	Low	130 Å²	130	76.6 Å²	76.6	91%	0.909	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.9	13	-175.1	-42.7	0	0	0	0	115.6
315	S	47	Very low	56.5	Low	102 Å²	102	76.7 Å²	76.7	71%	0.713	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90	0.5	-171.3	-55.2	0	0	0	0	114	G313	G313-S315 PolarHBondContact O-N 2.63Å
316	H	45.5	Very low	58.3	Low	56 Å²	56	74.7 Å²	74.7	26%	0.259	42%	0.421	S	S	.	.	S	Bend	trans	-117.5	150.8	-174	-60.2	-76.6	0	0	0	111.6	F312 F409 A573	F312-H316 PolarHBondContact O-CD2 3.4Å; F312-H316 PolarHBondContact O-NE2 3.32Å; H316-F409 HydrophobicContact CB-CB 4.16Å; H316-F409 HydrophobicContact CB-CD1 3.37Å; H316-F409 HydrophobicContact CB-CD2 4.5Å; H316-F409 HydrophobicContact CB-CE1 3.74Å; H316-F409 HydrophobicContact CB-CG 3.78Å; H316-F409 HydrophobicContact CB-CZ 4.46Å; H316-F409 AromaticContact CG-CD1 3.89Å; H316-F409 AromaticContact CG-CE1 3.99Å; H316-A573 PolarHBondContact NE2-O 3.13Å; H316-A573 VanDerWaalsContact NE2-O 3.16Å
317	G	48.3	Very low	60.3	Low	30 Å²	30	71.6 Å²	71.6	31%	0.309	41%	0.41	S	S	.	.			trans	-62.8	167.5	167	0	0	0	0	0	111.6	L319 F409	G317-L319 PolarHBondContact O-N 3.42Å; G317-F409 WeakPolarHBondContact O-CD1 3.43Å
318	P	50.8	Low	62.3	Low	98 Å²	98	64.1 Å²	64.1	64%	0.636	38%	0.377	S	S	*	.			trans	-54.4	138.9	-178.5	23.7	-34	0	0	0	111.4	T320 N410	P318-T320 PolarHBondContact O-N 3.18Å; P318-N410 PolarHBondContact O-N 3.45Å
319	L	49.1	Very low	64.5	Low	30 Å²	30	68.4 Å²	68.4	16%	0.157	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.8	110	169	-83.3	168	0	0	0	108.9	I305 M308 G317 W407 F409	I305-L319 HydrophobicContact CG2-CD1 4.46Å; M308-L319 HydrophobicContact CB-CD1 4.32Å; M308-L319 HydrophobicContact CE-CD1 3.98Å; G317-L319 PolarHBondContact O-N 3.42Å; L319-W407 HydrophobicContact CB-CE3 4.31Å; L319-W407 HydrophobicContact CB-CZ3 4.47Å; L319-F409 HydrophobicContact CD1-CE1 4.18Å; L319-F409 HydrophobicContact CD2-CD1 3.6Å; L319-F409 HydrophobicContact CD2-CD2 4.45Å; L319-F409 HydrophobicContact CD2-CE1 3.44Å; L319-F409 VanDerWaalsContact CD2-CE1 3.44Å; L319-F409 HydrophobicContact CD2-CE2 4.3Å; L319-F409 HydrophobicContact CD2-CG 4.13Å; L319-F409 HydrophobicContact CD2-CZ 3.82Å; L319-F409 HydrophobicContact CG-CD1 3.8Å; L319-F409 HydrophobicContact CG-CE1 3.55Å; L319-F409 HydrophobicContact CG-CZ 4.31Å
320	T	66.3	Low	66.5	Low	42 Å²	42	70.5 Å²	70.5	26%	0.258	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	140	179.2	52	0	0	0	0	110.1	P318 Q322 G408 N410	P318-T320 PolarHBondContact O-N 3.18Å; T320-Q322 PolarHBondContact O-N 2.92Å; T320-Q322 PolarHBondContact OG1-NE2 3.29Å; T320-G408 PolarHBondContact N-O 3.08Å; T320-G408 PolarHBondContact O-N 2.97Å; T320-G408 PolarHBondContact OG1-O 3.04Å; T320-N410 HydrophobicContact CG2-CB 4.14Å
321	Q	74	Confident	68.2	Low	92 Å²	92	65.4 Å²	65.4	43%	0.43	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	107.1	167.5	-135.3	-171.4	-2.2	0	0	107.7	T405 W407	Q321-T405 HydrophobicContact CB-CG2 4.14Å; Q321-T405 VanDerWaalsContact CD-CG2 3.47Å; Q321-T405 HydrophobicContact CG-CG2 3.56Å; Q321-W407 HydrophobicContact CG-CD2 4.3Å; Q321-W407 HydrophobicContact CG-CZ2 4.38Å
322	Q	78.5	Confident	70.1	Confident	53 Å²	53	70.1 Å²	70.1	25%	0.248	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	132.7	-177.1	-67.9	-178.1	-4.8	0	0	109.8	T320 Y324 T405 R406	T320-Q322 PolarHBondContact O-N 2.92Å; T320-Q322 PolarHBondContact OG1-NE2 3.29Å; Q322-Y324 HydrophobicContact CB-CE2 3.74Å; Q322-Y324 WeakPolarHBondContact O-CD2 3.42Å; Q322-Y324 PolarHBondContact OE1-OH 3.25Å; Q322-T405 WeakPolarHBondContact O-CA 3.3Å; Q322-R406 PolarHBondContact N-O 3.28Å; Q322-R406 PolarHBondContact O-N 2.81Å
323	I	87.7	Confident	71.9	Confident	114 Å²	114	76.3 Å²	76.3	59%	0.585	43%	0.431	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.2	117.6	-178.6	-59.3	174.1	0	0	0	109.3	I374 V404 T405	I323-I374 HydrophobicContact CB-CD1 4.36Å; I323-I374 HydrophobicContact CD1-CD1 4.34Å; I323-I374 HydrophobicContact CG1-CD1 3.93Å; I323-I374 HydrophobicContact CG2-CD1 3.77Å; I323-V404 CarbonylContact C-O 2.92Å; I323-V404 WeakPolarHBondContact CA-O 3.47Å; I323-T405 HydrophobicContact CG1-CG2 4.01Å
324	Y	89.7	Confident	74.3	Confident	73 Å²	73	75.2 Å²	75.2	29%	0.286	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	156.6	172.3	-63.6	-96.8	0	0	0	109.9	Q322 I366 Q403 V404 R406	Q322-Y324 HydrophobicContact CB-CE2 3.74Å; Q322-Y324 WeakPolarHBondContact O-CD2 3.42Å; Q322-Y324 PolarHBondContact OE1-OH 3.25Å; Y324-I366 HydrophobicContact CD1-CG2 4.3Å; Y324-Q403 WeakPolarHBondContact O-CA 3.17Å; Y324-V404 PolarHBondContact N-O 3.45Å; Y324-V404 PolarHBondContact O-N 2.9Å; Y324-R406 HydrophobicContact CD2-CB 4.06Å; Y324-R406 HydrophobicContact CE2-CB 3.77Å
325	S	90.7	Very high	76.6	Confident	64 Å²	64	69.5 Å²	69.5	45%	0.448	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	126	-179.7	-64.6	0	0	0	0	110.4	V402 Q403	S325-V402 WeakPolarHBondContact CA-O 3.35Å; S325-Q403 WeakPolarHBondContact OG-CG 3.24Å; S325-Q403 PolarHBondContact OG-NE2 3.41Å
326	T	91.7	Very high	78.7	Confident	8 Å²	8	64.9 Å²	64.9	5%	0.049	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	162.4	-177.6	176.2	0	0	0	0	111.2	L328 D364 L367 H401 V402	T326-L328 HydrophobicContact CG2-CD2 4.44Å; T326-L328 HydrophobicContact CG2-CG 4.26Å; T326-L328 WeakPolarHBondContact OG1-CD2 3.33Å; T326-D364 WeakPolarHBondContact CB-OD2 3.39Å; T326-D364 PolarHBondContact OG1-OD1 3.42Å; T326-D364 PolarHBondContact OG1-OD2 2.86Å; T326-L367 HydrophobicContact CG2-CD1 4.33Å; T326-L367 HydrophobicContact CG2-CD2 3.78Å; T326-L367 HydrophobicContact CG2-CG 3.92Å; T326-H401 WeakPolarHBondContact O-CA 3.41Å; T326-V402 HydrophobicContact CG2-CB 3.94Å; T326-V402 HydrophobicContact CG2-CG2 4.49Å; T326-V402 PolarHBondContact N-O 2.88Å; T326-V402 PolarHBondContact O-N 3.14Å
327	T	92.2	Very high	80.9	Confident	50 Å²	50	63.7 Å²	63.7	31%	0.307	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	92.2	175	-61.3	0	0	0	0	109.3	Y329 V399 H401	T327-Y329 HydrophobicContact CG2-CE2 4.42Å; T327-Y329 WeakPolarHBondContact O-CE2 3.42Å; T327-V399 HydrophobicContact CG2-CG1 3.5Å; T327-V399 VanDerWaalsContact CG2-CG1 3.5Å; T327-H401 VanDerWaalsContact CG2-CE1 3.46Å; T327-H401 WeakPolarHBondContact CG2-CE1 3.48Å; T327-H401 WeakPolarHBondContact CG2-ND1 3.17Å; T327-H401 PolarHBondContact OG1-ND1 3.02Å
328	L	91.1	Very high	82.9	Confident	2 Å²	2	64 Å²	64	1%	0.01	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	136.8	-177.7	-58.8	-177.5	0	0	0	111.6	T326 F335 F337 A361 D364 L367 V399 L400	T326-L328 HydrophobicContact CG2-CD2 4.44Å; T326-L328 HydrophobicContact CG2-CG 4.26Å; T326-L328 WeakPolarHBondContact OG1-CD2 3.33Å; L328-F335 HydrophobicContact CB-CD1 3.97Å; L328-F335 HydrophobicContact CD1-CB 4.39Å; L328-F337 HydrophobicContact CD1-CD1 3.85Å; L328-F337 HydrophobicContact CD1-CE1 3.77Å; L328-A361 HydrophobicContact CD1-CB 3.88Å; L328-A361 HydrophobicContact CD2-CB 4.48Å; L328-D364 HydrophobicContact CD2-CB 3.5Å; L328-L367 HydrophobicContact CD1-CD1 3.86Å; L328-V399 WeakPolarHBondContact O-CA 3.15Å; L328-L400 PolarHBondContact N-O 3.39Å; L328-L400 PolarHBondContact O-N 2.83Å
329	Y	91.5	Very high	84.9	Confident	161 Å²	161	60.2 Å²	60.2	63%	0.631	32%	0.316	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97	141.4	173.4	-62.5	-88.9	0	0	0	110.2	T327 G331 P360 H398 V399	T327-Y329 HydrophobicContact CG2-CE2 4.42Å; T327-Y329 WeakPolarHBondContact O-CE2 3.42Å; Y329-G331 PolarHBondContact O-N 2.78Å; Y329-P360 WeakPolarHBondContact O-CB 3.43Å; Y329-P360 WeakPolarHBondContact O-CG 3.37Å; Y329-H398 CarbonylContact C-O 3.55Å; Y329-H398 WeakPolarHBondContact CA-O 3.45Å; Y329-V399 HydrophobicContact CD1-CG2 3.95Å; Y329-V399 HydrophobicContact CE1-CG2 3.92Å
330	R	88.6	Confident	86.8	Confident	114 Å²	114	62.1 Å²	62.1	43%	0.43	33%	0.325	S	S	.	.	P	Polyproline II helix	trans	-75.1	116.6	-173.9	-162.5	178.9	-174.6	103.1	4.6	111.5	F335 A396 K397 H398	R330-F335 HydrophobicContact CB-CD1 4.16Å; R330-F335 HydrophobicContact CB-CE1 3.59Å; R330-F335 HydrophobicContact CB-CZ 3.84Å; R330-F335 HydrophobicContact CG-CD1 4.44Å; R330-F335 HydrophobicContact CG-CE1 4.11Å; R330-F335 HydrophobicContact CG-CE2 4.34Å; R330-F335 HydrophobicContact CG-CZ 4.04Å; R330-A396 PolarHBondContact NH1-O 3.36Å; R330-A396 VanDerWaalsContact NH1-O 3.14Å; R330-K397 WeakPolarHBondContact CD-O 3.44Å; R330-H398 PolarHBondContact N-O 3.18Å
331	G	86	Confident	87.8	Confident	30 Å²	30	65.8 Å²	65.8	31%	0.309	34%	0.339	S	S	.	.	B	Isolated β-bridge	trans	-88.9	-178.2	173.4	0	0	0	0	0	113.2	Y329 K333 G334	Y329-G331 PolarHBondContact O-N 2.78Å; G331-K333 VanDerWaalsContact C-N 3.29Å; G331-K333 PolarHBondContact O-N 3.45Å; G331-G334 WeakPolarHBondContact CA-O 3.42Å; G331-G334 PolarHBondContact N-O 3.01Å; G331-G334 PolarHBondContact O-N 3.06Å
332	S	80.8	Confident	88	Confident	133 Å²	133	66 Å²	66	93%	0.93	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-36.3	-179	52.4	0	0	0	0	113.8
333	K	80.6	Confident	87.8	Confident	188 Å²	188	64.8 Å²	64.8	82%	0.817	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98	27.3	173.9	-61.2	-173	179.5	-177.5	0	113	G331	G331-K333 VanDerWaalsContact C-N 3.29Å; G331-K333 PolarHBondContact O-N 3.45Å
334	G	87.8	Confident	86.7	Confident	10 Å²	10	64.6 Å²	64.6	10%	0.103	35%	0.349	C	S	.	.	B	Isolated β-bridge	trans	81.7	-147.9	-175.4	0	0	0	0	0	112.9	G331 P360	G331-G334 WeakPolarHBondContact CA-O 3.42Å; G331-G334 PolarHBondContact N-O 3.01Å; G331-G334 PolarHBondContact O-N 3.06Å; G334-P360 WeakPolarHBondContact O-CG 3.12Å
335	F	91.2	Very high	85.7	Confident	9 Å²	9	65.5 Å²	65.5	4%	0.039	36%	0.362	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85	-7.6	-176.8	-62.7	-71.7	0	0	0	114.7	L328 R330 F337 P360 A361 I393 A396 L400	L328-F335 HydrophobicContact CB-CD1 3.97Å; L328-F335 HydrophobicContact CD1-CB 4.39Å; R330-F335 HydrophobicContact CB-CD1 4.16Å; R330-F335 HydrophobicContact CB-CE1 3.59Å; R330-F335 HydrophobicContact CB-CZ 3.84Å; R330-F335 HydrophobicContact CG-CD1 4.44Å; R330-F335 HydrophobicContact CG-CE1 4.11Å; R330-F335 HydrophobicContact CG-CE2 4.34Å; R330-F335 HydrophobicContact CG-CZ 4.04Å; F335-F337 HydrophobicContact CB-CD1 3.94Å; F335-F337 HydrophobicContact CB-CE1 3.63Å; F335-P360 WeakPolarHBondContact O-CD 3.41Å; F335-A361 PolarHBondContact O-N 2.62Å; F335-I393 HydrophobicContact CD2-CG2 4.01Å; F335-I393 HydrophobicContact CE2-CG2 4.39Å; F335-A396 HydrophobicContact CE2-CB 3.84Å; F335-A396 WeakPolarHBondContact CE2-O 3.21Å; F335-A396 HydrophobicContact CZ-CB 3.76Å; F335-A396 VanDerWaalsContact CZ-O 3.29Å; F335-A396 WeakPolarHBondContact CZ-O 3.11Å; F335-L400 HydrophobicContact CB-CD2 4.43Å; F335-L400 HydrophobicContact CD1-CB 3.9Å; F335-L400 HydrophobicContact CD1-CD2 4.43Å; F335-L400 HydrophobicContact CD2-CB 4.3Å; F335-L400 HydrophobicContact CD2-CD2 3.94Å; F335-L400 HydrophobicContact CE1-CB 3.55Å; F335-L400 HydrophobicContact CE2-CB 3.99Å; F335-L400 HydrophobicContact CE2-CD2 4.29Å; F335-L400 HydrophobicContact CG-CB 4.27Å; F335-L400 HydrophobicContact CG-CD2 4.02Å; F335-L400 HydrophobicContact CZ-CB 3.62Å
336	G	90.2	Very high	84.8	Confident	6 Å²	6	67.7 Å²	67.7	6%	0.062	37%	0.369	C	S	.	.	S	Bend	trans	79.4	28.5	171.1	0	0	0	0	0	116	V356	G336-V356 PolarHBondContact O-N 3.36Å
337	F	92	Very high	84	Confident	30 Å²	30	71.7 Å²	71.7	13%	0.132	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	160.1	171.6	69.3	-88	0	0	0	111.2	L328 F335 I339 I352 Q354 I355 A361 L367 I393 L400	L328-F337 HydrophobicContact CD1-CD1 3.85Å; L328-F337 HydrophobicContact CD1-CE1 3.77Å; F335-F337 HydrophobicContact CB-CD1 3.94Å; F335-F337 HydrophobicContact CB-CE1 3.63Å; F337-I339 HydrophobicContact CD2-CG2 4Å; F337-I339 HydrophobicContact CE2-CG2 3.83Å; F337-I352 HydrophobicContact CB-CD1 4.5Å; F337-I352 HydrophobicContact CD2-CD1 3.44Å; F337-I352 VanDerWaalsContact CD2-CD1 3.44Å; F337-I352 HydrophobicContact CE2-CD1 3.87Å; F337-I352 HydrophobicContact CG-CD1 4.13Å; F337-Q354 CarbonylContact C-O 3.58Å; F337-Q354 WeakPolarHBondContact CA-O 3.23Å; F337-I355 HydrophobicContact CB-CG1 4.37Å; F337-A361 HydrophobicContact CB-CB 4.07Å; F337-A361 HydrophobicContact CD1-CB 4.14Å; F337-L367 HydrophobicContact CD1-CD1 4.31Å; F337-L367 HydrophobicContact CG-CD1 4.46Å; F337-I393 HydrophobicContact CE2-CD1 4.14Å; F337-I393 HydrophobicContact CZ-CD1 4.14Å; F337-I393 HydrophobicContact CZ-CG2 4.45Å; F337-L400 HydrophobicContact CE1-CD2 3.64Å; F337-L400 HydrophobicContact CZ-CD2 3.65Å
338	A	90.8	Very high	83.4	Confident	38 Å²	38	76.2 Å²	76.2	31%	0.314	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	155.9	175.5	0	0	0	0	0	110.9	I352 K353 Q354	A338-I352 CarbonylContact O-C 3.55Å; A338-I352 WeakPolarHBondContact O-CA 3.47Å; A338-K353 HydrophobicContact CB-CB 4.42Å; A338-K353 PolarHBondContact O-N 3.29Å; A338-Q354 HydrophobicContact CB-CB 4.49Å; A338-Q354 PolarHBondContact N-O 2.99Å
339	I	91.7	Very high	83.1	Confident	17 Å²	17	77.2 Å²	77.2	9%	0.087	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	162.7	-178	52.1	161.7	0	0	0	113	F337 I350 Y351 I352 L373 Y386 V389 V390 I393	F337-I339 HydrophobicContact CD2-CG2 4Å; F337-I339 HydrophobicContact CE2-CG2 3.83Å; I339-I350 HydrophobicContact CB-CG2 3.91Å; I339-I350 HydrophobicContact CD1-CG2 3.78Å; I339-I350 HydrophobicContact CG1-CG2 4.44Å; I339-I350 HydrophobicContact CG2-CG2 4.16Å; I339-Y351 CarbonylContact C-O 3.54Å; I339-Y351 WeakPolarHBondContact CA-O 3.25Å; I339-I352 HydrophobicContact CG2-CD1 4.1Å; I339-L373 HydrophobicContact CG2-CD1 4.47Å; I339-L373 HydrophobicContact CG2-CD2 4.37Å; I339-Y386 HydrophobicContact CD1-CD2 4.16Å; I339-Y386 HydrophobicContact CD1-CE2 3.83Å; I339-Y386 HydrophobicContact CG1-CE2 3.79Å; I339-V389 HydrophobicContact CD1-CG1 4.18Å; I339-V390 HydrophobicContact CD1-CG2 3.83Å; I339-I393 HydrophobicContact CD1-CD1 3.96Å
340	M	89.7	Confident	83	Confident	71 Å²	71	69.9 Å²	69.9	35%	0.35	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	158.8	177.4	60.9	-168.3	-68.3	0	0	112	R342 I350 Y351 K353	M340-R342 WeakPolarHBondContact CE-O 3.42Å; M340-I350 CarbonylContact O-C 3.49Å; M340-I350 WeakPolarHBondContact O-CA 3.49Å; M340-Y351 PolarHBondContact N-O 2.91Å; M340-Y351 PolarHBondContact O-N 3.42Å; M340-K353 HydrophobicContact CB-CB 4.28Å; M340-K353 HydrophobicContact CG-CB 4.04Å; M340-K353 HydrophobicContact SD-CB 3.78Å; M340-K353 HydrophobicContact SD-CD 4.38Å; M340-K353 HydrophobicContact SD-CG 3.78Å
341	E	86.4	Confident	83.1	Confident	119 Å²	119	65.1 Å²	65.1	56%	0.556	37%	0.369	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.8	-3.9	-172.4	-72.1	-169.1	125.1	0	0	116.6	G349 Y386	E341-G349 CarbonylContact C-O 3.53Å; E341-G349 PolarHBondContact O-N 2.9Å; E341-Y386 HydrophobicContact CG-CD2 3.65Å; E341-Y386 HydrophobicContact CG-CG 3.8Å; E341-Y386 WeakPolarHBondContact OE1-CB 3.49Å
342	R	78.3	Confident	83.3	Confident	97 Å²	97	63.8 Å²	63.8	37%	0.366	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	153.9	-178	-64.6	-168.4	175.4	-97.2	-12.1	112	M340 N346 E347 E348 G349	M340-R342 WeakPolarHBondContact CE-O 3.42Å; R342-N346 WeakPolarHBondContact CD-OD1 3.37Å; R342-N346 PolarHBondContact NH1-O 3.47Å; R342-E347 CarbonylContact C-O 3.59Å; R342-E347 WeakPolarHBondContact CA-O 3.45Å; R342-E347 WeakPolarHBondContact CB-O 3.1Å; R342-E348 IonicContact CZ-OE1 3.63Å; R342-E348 VanDerWaalsContact NH1-CG 3.26Å; R342-E348 IonicContact NH1-OE1 3.74Å; R342-E348 PolarHBondContact NH1-OE1 3.37Å; R342-E348 IonicContact NH2-OE1 3.43Å; R342-E348 PolarHBondContact NH2-OE1 2.89Å; R342-G349 PolarHBondContact N-O 3.27Å
343	S	74.4	Confident	83.6	Confident	26 Å²	26	63.6 Å²	63.6	18%	0.182	34%	0.337	C	S	.	.			trans	-67.1	162.9	169.7	-178.9	0	0	0	0	111.1	T345 N346 E347	S343-T345 VanDerWaalsContact CB-OG1 3.27Å; S343-T345 WeakPolarHBondContact CB-OG1 3.49Å; S343-T345 PolarHBondContact O-N 3.22Å; S343-T345 PolarHBondContact OG-N 3.32Å; S343-T345 VanDerWaalsContact OG-N 3.11Å; S343-T345 PolarHBondContact OG-OG1 3.36Å; S343-N346 WeakPolarHBondContact O-CA 3.18Å; S343-N346 PolarHBondContact O-N 2.67Å; S343-E347 PolarHBondContact N-O 2.83Å
344	A	65.2	Low	84.1	Confident	111 Å²	111	60.2 Å²	60.2	92%	0.917	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-23.4	161.8	0	0	0	0	0	112.6	N346	A344-N346 VanDerWaalsContact C-N 3.32Å
345	T	69.5	Low	84.1	Confident	91 Å²	91	61 Å²	61	56%	0.558	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.5	8.4	172.6	53.3	0	0	0	0	114.1	S343 E347	S343-T345 VanDerWaalsContact CB-OG1 3.27Å; S343-T345 WeakPolarHBondContact CB-OG1 3.49Å; S343-T345 PolarHBondContact O-N 3.22Å; S343-T345 PolarHBondContact OG-N 3.32Å; S343-T345 VanDerWaalsContact OG-N 3.11Å; S343-T345 PolarHBondContact OG-OG1 3.36Å; T345-E347 WeakPolarHBondContact CB-OE1 3.44Å; T345-E347 PolarHBondContact O-N 3.26Å; T345-E347 WeakPolarHBondContact OG1-CG 3.44Å; T345-E347 PolarHBondContact OG1-OE1 2.73Å
346	N	72	Confident	83.9	Confident	111 Å²	111	63.7 Å²	63.7	59%	0.594	34%	0.343	S	S	*	.			trans	65.9	8	-177	-157.3	26.3	0	0	0	115.6	R342 S343 A344	R342-N346 WeakPolarHBondContact CD-OD1 3.37Å; R342-N346 PolarHBondContact NH1-O 3.47Å; S343-N346 WeakPolarHBondContact O-CA 3.18Å; S343-N346 PolarHBondContact O-N 2.67Å; A344-N346 VanDerWaalsContact C-N 3.32Å
347	E	73.4	Confident	83.7	Confident	92 Å²	92	71.9 Å²	71.9	43%	0.43	38%	0.38	S	S	.	.			trans	-61.2	149.7	170	-68.9	161.1	-138.9	0	0	112.1	R342 S343 T345	R342-E347 CarbonylContact C-O 3.59Å; R342-E347 WeakPolarHBondContact CA-O 3.45Å; R342-E347 WeakPolarHBondContact CB-O 3.1Å; S343-E347 PolarHBondContact N-O 2.83Å; T345-E347 WeakPolarHBondContact CB-OE1 3.44Å; T345-E347 PolarHBondContact O-N 3.26Å; T345-E347 WeakPolarHBondContact OG1-CG 3.44Å; T345-E347 PolarHBondContact OG1-OE1 2.73Å
348	E	79.1	Confident	83.4	Confident	144 Å²	144	72.5 Å²	72.5	67%	0.673	39%	0.394	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90	135.8	-176.9	-65.9	-178.5	167.3	0	0	112.3	R342	R342-E348 IonicContact CZ-OE1 3.63Å; R342-E348 VanDerWaalsContact NH1-CG 3.26Å; R342-E348 IonicContact NH1-OE1 3.74Å; R342-E348 PolarHBondContact NH1-OE1 3.37Å; R342-E348 IonicContact NH2-OE1 3.43Å; R342-E348 PolarHBondContact NH2-OE1 2.89Å
349	G	85.6	Confident	83.3	Confident	23 Å²	23	71.2 Å²	71.2	24%	0.237	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	147.3	168.7	-177.9	0	0	0	0	0	110.3	E341 R342 Y351	E341-G349 CarbonylContact C-O 3.53Å; E341-G349 PolarHBondContact O-N 2.9Å; R342-G349 PolarHBondContact N-O 3.27Å; G349-Y351 VanDerWaalsContact C-CE2 3.47Å; G349-Y351 WeakPolarHBondContact O-CD2 3.33Å; G349-Y351 WeakPolarHBondContact O-CE2 3.4Å
350	I	90.4	Very high	83.3	Confident	8 Å²	8	71.8 Å²	71.8	4%	0.041	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	126.7	179.3	-64.4	176.8	0	0	0	109.2	I339 M340 Q372 L373 V381 V389	I339-I350 HydrophobicContact CB-CG2 3.91Å; I339-I350 HydrophobicContact CD1-CG2 3.78Å; I339-I350 HydrophobicContact CG1-CG2 4.44Å; I339-I350 HydrophobicContact CG2-CG2 4.16Å; M340-I350 CarbonylContact O-C 3.49Å; M340-I350 WeakPolarHBondContact O-CA 3.49Å; I350-Q372 CarbonylContact O-C 3.59Å; I350-L373 HydrophobicContact CB-CB 4.42Å; I350-L373 HydrophobicContact CG2-CB 4.36Å; I350-L373 HydrophobicContact CG2-CD2 4.17Å; I350-L373 PolarHBondContact O-N 3.29Å; I350-V381 HydrophobicContact CB-CG1 4.15Å; I350-V381 HydrophobicContact CD1-CG1 4.05Å; I350-V381 HydrophobicContact CG1-CG1 4.49Å; I350-V389 HydrophobicContact CD1-CB 3.55Å; I350-V389 HydrophobicContact CD1-CG1 3.59Å; I350-V389 HydrophobicContact CD1-CG2 3.67Å; I350-V389 HydrophobicContact CG2-CG1 4.38Å
351	Y	91	Very high	83.3	Confident	13 Å²	13	68.4 Å²	68.4	5%	0.051	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	149.1	-176.6	-60.1	-100.5	0	0	0	111.2	I339 M340 G349 K353 D371 Q372	I339-Y351 CarbonylContact C-O 3.54Å; I339-Y351 WeakPolarHBondContact CA-O 3.25Å; M340-Y351 PolarHBondContact N-O 2.91Å; M340-Y351 PolarHBondContact O-N 3.42Å; G349-Y351 VanDerWaalsContact C-CE2 3.47Å; G349-Y351 WeakPolarHBondContact O-CD2 3.33Å; G349-Y351 WeakPolarHBondContact O-CE2 3.4Å; Y351-K353 PolarHBondContact O-N 3.07Å; Y351-D371 CarbonylContact C-O 3.58Å; Y351-D371 VanDerWaalsContact CA-O 3.23Å; Y351-D371 WeakPolarHBondContact CA-O 3.04Å; Y351-Q372 HydrophobicContact CD1-CB 3.73Å; Y351-Q372 HydrophobicContact CD1-CG 4.11Å; Y351-Q372 HydrophobicContact CE1-CB 3.6Å; Y351-Q372 HydrophobicContact CE1-CG 3.72Å; Y351-Q372 HydrophobicContact CE2-CG 4.5Å; Y351-Q372 PolarHBondContact OH-NE2 2.81Å
352	I	90	Very high	83.5	Confident	2 Å²	2	66.3 Å²	66.3	1%	0.01	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	116.3	168.4	-59.3	-67.6	0	0	0	108.3	F337 A338 I339 I355 L367 C368 P369 G370 D371 L373	F337-I352 HydrophobicContact CB-CD1 4.5Å; F337-I352 HydrophobicContact CD2-CD1 3.44Å; F337-I352 VanDerWaalsContact CD2-CD1 3.44Å; F337-I352 HydrophobicContact CE2-CD1 3.87Å; F337-I352 HydrophobicContact CG-CD1 4.13Å; A338-I352 CarbonylContact O-C 3.55Å; A338-I352 WeakPolarHBondContact O-CA 3.47Å; I339-I352 HydrophobicContact CG2-CD1 4.1Å; I352-I355 HydrophobicContact CG2-CG1 4.11Å; I352-L367 HydrophobicContact CD1-CD1 4.16Å; I352-C368 WeakPolarHBondContact CB-O 3.38Å; I352-P369 WeakPolarHBondContact O-CA 3.47Å; I352-G370 PolarHBondContact O-N 3.46Å; I352-D371 HydrophobicContact CB-CB 4.23Å; I352-D371 HydrophobicContact CG1-CB 3.79Å; I352-D371 PolarHBondContact N-O 3.5Å; I352-L373 HydrophobicContact CD1-CD1 3.56Å; I352-L373 HydrophobicContact CG1-CD1 3.86Å
353	K	86.9	Confident	84	Confident	130 Å²	130	69.6 Å²	69.6	57%	0.565	38%	0.383	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.2	-44.3	177.3	-178.4	-179.1	177.7	-172.7	0	111.8	A338 M340 Y351	A338-K353 HydrophobicContact CB-CB 4.42Å; A338-K353 PolarHBondContact O-N 3.29Å; M340-K353 HydrophobicContact CB-CB 4.28Å; M340-K353 HydrophobicContact CG-CB 4.04Å; M340-K353 HydrophobicContact SD-CB 3.78Å; M340-K353 HydrophobicContact SD-CD 4.38Å; M340-K353 HydrophobicContact SD-CG 3.78Å; Y351-K353 PolarHBondContact O-N 3.07Å
354	Q	89.6	Confident	84.7	Confident	116 Å²	116	71.2 Å²	71.2	54%	0.542	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.9	152.5	-171.5	-174.8	176	6.3	0	0	109.9	F337 A338	F337-Q354 CarbonylContact C-O 3.58Å; F337-Q354 WeakPolarHBondContact CA-O 3.23Å; A338-Q354 HydrophobicContact CB-CB 4.49Å; A338-Q354 PolarHBondContact N-O 2.99Å
355	I	88.4	Confident	85.7	Confident	28 Å²	28	68.4 Å²	68.4	14%	0.144	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	142.4	169.7	-66.2	178.5	0	0	0	108.3	F337 I352 A361 D362 L367	F337-I355 HydrophobicContact CB-CG1 4.37Å; I352-I355 HydrophobicContact CG2-CG1 4.11Å; I355-A361 HydrophobicContact CG2-CB 4.14Å; I355-D362 HydrophobicContact CG2-CB 3.74Å; I355-L367 VanDerWaalsContact CD1-C 3.44Å; I355-L367 HydrophobicContact CD1-CB 3.82Å; I355-L367 WeakPolarHBondContact CD1-O 3.5Å
356	V	88.2	Confident	86.6	Confident	64 Å²	64	67 Å²	67	39%	0.388	36%	0.359	S	S	.	.			trans	-95.8	116.8	-176.7	-178.2	0	0	0	0	109	G336 G359 D362	G336-V356 PolarHBondContact O-N 3.36Å; V356-G359 WeakPolarHBondContact O-CA 3.49Å; V356-G359 PolarHBondContact O-N 3.23Å; V356-D362 WeakPolarHBondContact O-CB 3.38Å
357	E	85.6	Confident	87.5	Confident	179 Å²	179	61.9 Å²	61.9	84%	0.836	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.4	135	178.9	-62	179.5	-176.8	0	0	112.5	G359	E357-G359 PolarHBondContact O-N 3.5Å; E357-G359 VanDerWaalsContact O-N 3.12Å
358	G	85.8	Confident	88.1	Confident	42 Å²	42	59.7 Å²	59.7	43%	0.433	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	69	-1.9	-174.6	0	0	0	0	0	115	D362 K363	G358-D362 PolarHBondContact N-OD2 3.26Å; G358-K363 WeakPolarHBondContact O-CE 3.16Å; G358-K363 PolarHBondContact O-NZ 2.89Å
359	G	88.4	Confident	88.5	Confident	12 Å²	12	56.9 Å²	56.9	12%	0.124	32%	0.32	C	S	.	.	S	Bend	trans	-74.1	171.3	176	0	0	0	0	0	113.4	V356 E357 A361 D362 K363	V356-G359 WeakPolarHBondContact O-CA 3.49Å; V356-G359 PolarHBondContact O-N 3.23Å; E357-G359 PolarHBondContact O-N 3.5Å; E357-G359 VanDerWaalsContact O-N 3.12Å; G359-A361 PolarHBondContact O-N 3.49Å; G359-D362 PolarHBondContact O-N 3.33Å; G359-K363 WeakPolarHBondContact O-CG 3.3Å; G359-K363 PolarHBondContact O-N 3.39Å
360	P	90.8	Very high	88.5	Confident	28 Å²	28	58.3 Å²	58.3	18%	0.182	34%	0.336	C	S	.	.	H	α-helix	trans	-62.3	-39.7	179.3	-26.2	34.9	0	0	0	114.9	Y329 G334 F335 K363 D364	Y329-P360 WeakPolarHBondContact O-CB 3.43Å; Y329-P360 WeakPolarHBondContact O-CG 3.37Å; G334-P360 WeakPolarHBondContact O-CG 3.12Å; F335-P360 WeakPolarHBondContact O-CD 3.41Å; P360-K363 PolarHBondContact O-N 3.46Å; P360-D364 WeakPolarHBondContact O-CB 3.06Å; P360-D364 PolarHBondContact O-N 3.12Å
361	A	90.9	Very high	88.5	Confident	0 Å²	0	58 Å²	58	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-64.5	-39.5	176.4	0	0	0	0	0	113	L328 F335 F337 I355 G359 D364 G365 L367	L328-A361 HydrophobicContact CD1-CB 3.88Å; L328-A361 HydrophobicContact CD2-CB 4.48Å; F335-A361 PolarHBondContact O-N 2.62Å; F337-A361 HydrophobicContact CB-CB 4.07Å; F337-A361 HydrophobicContact CD1-CB 4.14Å; I355-A361 HydrophobicContact CG2-CB 4.14Å; G359-A361 PolarHBondContact O-N 3.49Å; A361-D364 PolarHBondContact O-N 2.93Å; A361-G365 PolarHBondContact O-N 3.29Å; A361-L367 HydrophobicContact CB-CD1 4.27Å
362	D	90.2	Very high	88.5	Confident	76 Å²	76	59.5 Å²	59.5	41%	0.406	34%	0.341	S	S	.	.	H	α-helix	trans	-62.5	-46.1	174.5	-178.9	51.5	0	0	0	111.5	I355 V356 G358 G359 D364 G365	I355-D362 HydrophobicContact CG2-CB 3.74Å; V356-D362 WeakPolarHBondContact O-CB 3.38Å; G358-D362 PolarHBondContact N-OD2 3.26Å; G359-D362 PolarHBondContact O-N 3.33Å; D362-D364 VanDerWaalsContact C-N 3.3Å; D362-D364 PolarHBondContact O-N 2.93Å; D362-G365 PolarHBondContact O-N 3.39Å
363	K	87.9	Confident	88.6	Confident	166 Å²	166	59.6 Å²	59.6	72%	0.722	34%	0.342	S	S	*	.	H	α-helix	trans	-68.4	-24.1	177.8	-75.3	168.7	172.3	156.5	0	114.7	G358 G359 P360	G358-K363 WeakPolarHBondContact O-CE 3.16Å; G358-K363 PolarHBondContact O-NZ 2.89Å; G359-K363 WeakPolarHBondContact O-CG 3.3Å; G359-K363 PolarHBondContact O-N 3.39Å; P360-K363 PolarHBondContact O-N 3.46Å
364	D	89.6	Confident	88.9	Confident	60 Å²	60	55 Å²	55	32%	0.321	32%	0.323	S	S	.	.	H	α-helix	trans	-82.8	-35.8	173.6	179.6	82.8	0	0	0	111.5	T326 L328 P360 A361 D362 I366	T326-D364 WeakPolarHBondContact CB-OD2 3.39Å; T326-D364 PolarHBondContact OG1-OD1 3.42Å; T326-D364 PolarHBondContact OG1-OD2 2.86Å; L328-D364 HydrophobicContact CD2-CB 3.5Å; P360-D364 WeakPolarHBondContact O-CB 3.06Å; P360-D364 PolarHBondContact O-N 3.12Å; A361-D364 PolarHBondContact O-N 2.93Å; D362-D364 VanDerWaalsContact C-N 3.3Å; D362-D364 PolarHBondContact O-N 2.93Å; D364-I366 PolarHBondContact O-N 3.05Å; D364-I366 VanDerWaalsContact OD2-CB 3.3Å; D364-I366 WeakPolarHBondContact OD2-CB 3.41Å; D364-I366 WeakPolarHBondContact OD2-CG1 3.12Å
365	G	86	Confident	89	Confident	52 Å²	52	52.6 Å²	52.6	54%	0.536	31%	0.311	S	S	.	.			trans	69.3	-0.1	171.4	0	0	0	0	0	116	A361 D362	A361-G365 PolarHBondContact O-N 3.29Å; D362-G365 PolarHBondContact O-N 3.39Å
366	I	89	Confident	89.2	Confident	60 Å²	60	51.3 Å²	51.3	31%	0.308	30%	0.304	S	S	.	.			trans	-78.4	-41.1	179.2	-60	175.7	0	0	0	110.9	Y324 D364 R406	Y324-I366 HydrophobicContact CD1-CG2 4.3Å; D364-I366 PolarHBondContact O-N 3.05Å; D364-I366 VanDerWaalsContact OD2-CB 3.3Å; D364-I366 WeakPolarHBondContact OD2-CB 3.41Å; D364-I366 WeakPolarHBondContact OD2-CG1 3.12Å; I366-R406 PolarHBondContact O-NH2 2.97Å
367	L	90.1	Very high	89.3	Confident	5 Å²	5	50.7 Å²	50.7	3%	0.026	30%	0.299	C	S	.	.			trans	-73.7	150.1	177.2	-61.4	-176.2	0	0	0	111.3	T326 L328 F337 I352 I355 A361 D371 V404	T326-L367 HydrophobicContact CG2-CD1 4.33Å; T326-L367 HydrophobicContact CG2-CD2 3.78Å; T326-L367 HydrophobicContact CG2-CG 3.92Å; L328-L367 HydrophobicContact CD1-CD1 3.86Å; F337-L367 HydrophobicContact CD1-CD1 4.31Å; F337-L367 HydrophobicContact CG-CD1 4.46Å; I352-L367 HydrophobicContact CD1-CD1 4.16Å; I355-L367 VanDerWaalsContact CD1-C 3.44Å; I355-L367 HydrophobicContact CD1-CB 3.82Å; I355-L367 WeakPolarHBondContact CD1-O 3.5Å; A361-L367 HydrophobicContact CB-CD1 4.27Å; L367-D371 WeakPolarHBondContact CA-OD2 3.26Å; L367-V404 HydrophobicContact CD2-CB 4.5Å; L367-V404 HydrophobicContact CD2-CG1 3.72Å; L367-V404 HydrophobicContact CD2-CG2 3.9Å
368	C	87.3	Confident	89.3	Confident	45 Å²	45	51 Å²	51	30%	0.304	30%	0.297	S	S	.	.			trans	-138.7	155.5	170.4	-66.3	0	0	0	0	110.8	I352 D371 R406	I352-C368 WeakPolarHBondContact CB-O 3.38Å; C368-D371 PolarHBondContact N-OD2 3.01Å; C368-D371 VanDerWaalsContact O-CB 3.3Å; C368-D371 WeakPolarHBondContact O-CB 3.38Å; C368-D371 VanDerWaalsContact O-CG 3.23Å; C368-D371 PolarHBondContact O-N 3.16Å; C368-R406 VanDerWaalsContact SG-CZ 3.55Å; C368-R406 PolarHBondContact SG-NH1 2.91Å; C368-R406 PolarHBondContact SG-NH2 2.82Å; C368-R406 VanDerWaalsContact SG-NH2 3.44Å
369	P	88	Confident	89.5	Confident	85 Å²	85	53.7 Å²	53.7	55%	0.552	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.8	139	165.2	-23.5	35	0	0	0	111.5	I352	I352-P369 WeakPolarHBondContact O-CA 3.47Å
370	G	83.6	Confident	89.6	Confident	54 Å²	54	57 Å²	57	56%	0.557	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.3	-9.4	-175	0	0	0	0	0	115.4	I352 Q372	I352-G370 PolarHBondContact O-N 3.46Å; G370-Q372 PolarHBondContact O-N 3.1Å
371	D	90.8	Very high	89.5	Confident	1 Å²	1	55.9 Å²	55.9	1%	0.005	30%	0.304	C	S	.	.	P	Polyproline II helix	trans	-63.7	128.6	173.9	-80	-12.1	0	0	0	112	Y351 I352 L367 C368 V404 R406	Y351-D371 CarbonylContact C-O 3.58Å; Y351-D371 VanDerWaalsContact CA-O 3.23Å; Y351-D371 WeakPolarHBondContact CA-O 3.04Å; I352-D371 HydrophobicContact CB-CB 4.23Å; I352-D371 HydrophobicContact CG1-CB 3.79Å; I352-D371 PolarHBondContact N-O 3.5Å; L367-D371 WeakPolarHBondContact CA-OD2 3.26Å; C368-D371 PolarHBondContact N-OD2 3.01Å; C368-D371 VanDerWaalsContact O-CB 3.3Å; C368-D371 WeakPolarHBondContact O-CB 3.38Å; C368-D371 VanDerWaalsContact O-CG 3.23Å; C368-D371 PolarHBondContact O-N 3.16Å; D371-V404 HydrophobicContact CB-CB 3.98Å; D371-V404 HydrophobicContact CB-CG1 4.3Å; D371-V404 HydrophobicContact CB-CG2 3.99Å; D371-R406 VanDerWaalsContact CG-NH2 3.32Å; D371-R406 WeakPolarHBondContact OD1-CB 3.46Å; D371-R406 IonicContact OD1-CZ 2.59Å; D371-R406 IonicContact OD1-NE 2.96Å; D371-R406 PolarHBondContact OD1-NE 3.45Å; D371-R406 IonicContact OD1-NH2 2.67Å; D371-R406 PolarHBondContact OD1-NH2 3.05Å; D371-R406 VanDerWaalsContact OD1-NH2 3.1Å; D371-R406 IonicContact OD2-CZ 3.71Å; D371-R406 IonicContact OD2-NE 2.86Å; D371-R406 IonicContact OD2-NH2 3.26Å; D371-R406 PolarHBondContact OD2-NH2 3.5Å
372	Q	91.2	Very high	89.2	Confident	45 Å²	45	59.1 Å²	59.1	21%	0.21	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	125.8	176	-171.3	-174.6	36.6	0	0	110.5	I350 Y351 G370 I374 V404 T405	I350-Q372 CarbonylContact O-C 3.59Å; Y351-Q372 HydrophobicContact CD1-CB 3.73Å; Y351-Q372 HydrophobicContact CD1-CG 4.11Å; Y351-Q372 HydrophobicContact CE1-CB 3.6Å; Y351-Q372 HydrophobicContact CE1-CG 3.72Å; Y351-Q372 HydrophobicContact CE2-CG 4.5Å; Y351-Q372 PolarHBondContact OH-NE2 2.81Å; G370-Q372 PolarHBondContact O-N 3.1Å; Q372-I374 PolarHBondContact O-N 2.89Å; Q372-V404 CarbonylContact O-C 3.52Å; Q372-V404 WeakPolarHBondContact O-CA 3.43Å; Q372-V404 WeakPolarHBondContact O-CB 3.4Å; Q372-T405 PolarHBondContact N-O 2.75Å; Q372-T405 PolarHBondContact O-N 2.89Å; Q372-T405 PolarHBondContact O-OG1 2.79Å; Q372-T405 PolarHBondContact OE1-OG1 3.07Å
373	L	92.4	Very high	88.9	Confident	3 Å²	3	64.5 Å²	64.5	2%	0.016	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	122.9	175.3	-98	65.1	0	0	0	111.8	I339 I350 I352 I376 V381 V389 V402 V404	I339-L373 HydrophobicContact CG2-CD1 4.47Å; I339-L373 HydrophobicContact CG2-CD2 4.37Å; I350-L373 HydrophobicContact CB-CB 4.42Å; I350-L373 HydrophobicContact CG2-CB 4.36Å; I350-L373 HydrophobicContact CG2-CD2 4.17Å; I350-L373 PolarHBondContact O-N 3.29Å; I352-L373 HydrophobicContact CD1-CD1 3.56Å; I352-L373 HydrophobicContact CG1-CD1 3.86Å; L373-I376 HydrophobicContact CD2-CD1 3.54Å; L373-I376 HydrophobicContact CD2-CG1 4.11Å; L373-V381 HydrophobicContact CB-CB 4.4Å; L373-V381 HydrophobicContact CB-CG1 3.83Å; L373-V389 HydrophobicContact CD2-CG1 4.45Å; L373-V402 HydrophobicContact CD1-CG1 4.31Å; L373-V402 HydrophobicContact CG-CG1 4.05Å; L373-V404 HydrophobicContact CD1-CG1 3.79Å; L373-V404 HydrophobicContact CG-CG1 4.28Å
374	I	92.6	Very high	88.7	Confident	33 Å²	33	57.7 Å²	57.7	17%	0.169	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	-38.6	172.5	-34.2	165.9	0	0	0	110.7	I323 Q372 V381 T382 Q403 T405	I323-I374 HydrophobicContact CB-CD1 4.36Å; I323-I374 HydrophobicContact CD1-CD1 4.34Å; I323-I374 HydrophobicContact CG1-CD1 3.93Å; I323-I374 HydrophobicContact CG2-CD1 3.77Å; Q372-I374 PolarHBondContact O-N 2.89Å; I374-V381 PolarHBondContact O-N 3.45Å; I374-T382 HydrophobicContact CG2-CG2 3.75Å; I374-Q403 PolarHBondContact N-O 3.49Å; I374-T405 HydrophobicContact CD1-CG2 3.81Å; I374-T405 HydrophobicContact CG1-CG2 4.27Å; I374-T405 WeakPolarHBondContact CG1-OG1 3.34Å
375	K	93.1	Very high	88.6	Confident	67 Å²	67	58 Å²	58	29%	0.291	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	139.1	-168.4	-140.6	170.2	-162.3	150	0	113.2	K378 K379 V402 Q403	K375-K378 WeakPolarHBondContact CE-O 3.47Å; K375-K379 VanDerWaalsContact CA-O 3.32Å; K375-K379 WeakPolarHBondContact CA-O 3.26Å; K375-K379 WeakPolarHBondContact CG-O 3.25Å; K375-V402 CarbonylContact O-C 3.56Å; K375-V402 WeakPolarHBondContact O-CA 3.48Å; K375-Q403 HydrophobicContact CB-CB 3.79Å; K375-Q403 HydrophobicContact CB-CG 3.94Å; K375-Q403 PolarHBondContact N-O 2.97Å; K375-Q403 VanDerWaalsContact N-O 3.14Å; K375-Q403 PolarHBondContact O-N 3.14Å
376	I	92.8	Very high	88.8	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	126.1	171.6	-76.5	157.6	0	0	0	109.5	L373 K378 K379 V381 V389 W392 I393 L400 H401	L373-I376 HydrophobicContact CD2-CD1 3.54Å; L373-I376 HydrophobicContact CD2-CG1 4.11Å; I376-K378 PolarHBondContact O-N 3.44Å; I376-K378 VanDerWaalsContact O-N 3.08Å; I376-K379 PolarHBondContact N-O 2.94Å; I376-K379 WeakPolarHBondContact O-CB 3.41Å; I376-K379 PolarHBondContact O-N 2.88Å; I376-V381 HydrophobicContact CB-CG2 4.17Å; I376-V381 HydrophobicContact CD1-CG2 3.88Å; I376-V381 HydrophobicContact CG1-CG2 4.05Å; I376-V389 HydrophobicContact CD1-CG1 3.63Å; I376-W392 HydrophobicContact CG2-CB 4.04Å; I376-I393 HydrophobicContact CD1-CD1 3.92Å; I376-I393 HydrophobicContact CD1-CG1 3.66Å; I376-I393 HydrophobicContact CG1-CG1 4.49Å; I376-L400 HydrophobicContact CG2-CD1 3.67Å; I376-H401 CarbonylContact C-O 3.56Å; I376-H401 WeakPolarHBondContact CA-O 3.18Å
377	N	89.5	Confident	88.9	Confident	51 Å²	51	61.4 Å²	61.4	27%	0.273	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	45.2	46.7	173.8	-79.6	-16.4	0	0	0	113.2	K379 A396 V399 H401	N377-K379 VanDerWaalsContact C-N 3.28Å; N377-K379 PolarHBondContact O-N 3.25Å; N377-A396 WeakPolarHBondContact ND2-CB 3.49Å; N377-V399 PolarHBondContact ND2-O 2.9Å; N377-H401 PolarHBondContact N-O 3.06Å; N377-H401 PolarHBondContact OD1-CD2 2.91Å; N377-H401 PolarHBondContact OD1-N 2.8Å
378	K	85.9	Confident	89	Confident	186 Å²	186	63.7 Å²	63.7	81%	0.809	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.2	-7.3	-176.9	-49.2	174.9	-176.6	176.8	0	116.6	K375 I376	K375-K378 WeakPolarHBondContact CE-O 3.47Å; I376-K378 PolarHBondContact O-N 3.44Å; I376-K378 VanDerWaalsContact O-N 3.08Å
379	K	89.6	Confident	89.2	Confident	99 Å²	99	61.6 Å²	61.6	43%	0.43	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	138.3	174.5	-56.6	-176.7	-178.5	-176.1	0	111.5	K375 I376 N377 W392	K375-K379 VanDerWaalsContact CA-O 3.32Å; K375-K379 WeakPolarHBondContact CA-O 3.26Å; K375-K379 WeakPolarHBondContact CG-O 3.25Å; I376-K379 PolarHBondContact N-O 2.94Å; I376-K379 WeakPolarHBondContact O-CB 3.41Å; I376-K379 PolarHBondContact O-N 2.88Å; N377-K379 VanDerWaalsContact C-N 3.28Å; N377-K379 PolarHBondContact O-N 3.25Å; K379-W392 HydrophobicContact CB-CD2 4.15Å; K379-W392 HydrophobicContact CB-CE3 3.68Å; K379-W392 HydrophobicContact CB-CH2 3.82Å; K379-W392 HydrophobicContact CB-CZ2 4.27Å; K379-W392 HydrophobicContact CB-CZ3 3.51Å; K379-W392 HydrophobicContact CD-CD2 3.4Å; K379-W392 VanDerWaalsContact CD-CD2 3.4Å; K379-W392 HydrophobicContact CD-CE3 3.84Å; K379-W392 HydrophobicContact CD-CG 3.81Å; K379-W392 HydrophobicContact CD-CH2 4.15Å; K379-W392 HydrophobicContact CD-CZ2 3.75Å; K379-W392 HydrophobicContact CD-CZ3 4.2Å; K379-W392 HydrophobicContact CG-CD2 4.44Å; K379-W392 HydrophobicContact CG-CE3 4.44Å; K379-W392 VanDerWaalsContact NZ-NE1 3.11Å
380	D	90.2	Very high	89.4	Confident	82 Å²	82	58.5 Å²	58.5	44%	0.439	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	132.8	178.8	-155.6	-50.3	0	0	0	111.5	T382 W392	D380-T382 WeakPolarHBondContact OD1-CB 3.42Å; D380-T382 WeakPolarHBondContact OD1-CG2 3.35Å; D380-T382 PolarHBondContact OD1-N 3.19Å; D380-T382 PolarHBondContact OD1-OG1 2.71Å; D380-W392 VanDerWaalsContact O-CH2 3.24Å; D380-W392 WeakPolarHBondContact O-CH2 3.27Å; D380-W392 WeakPolarHBondContact O-CZ3 3.19Å
381	V	90.1	Very high	89.8	Confident	3 Å²	3	59.5 Å²	59.5	2%	0.018	30%	0.302	C	S	.	.			trans	-101.8	-19.2	-175.1	176.9	0	0	0	0	111.9	I350 L373 I374 I376 H383 A384 V389 W392	I350-V381 HydrophobicContact CB-CG1 4.15Å; I350-V381 HydrophobicContact CD1-CG1 4.05Å; I350-V381 HydrophobicContact CG1-CG1 4.49Å; L373-V381 HydrophobicContact CB-CB 4.4Å; L373-V381 HydrophobicContact CB-CG1 3.83Å; I374-V381 PolarHBondContact O-N 3.45Å; I376-V381 HydrophobicContact CB-CG2 4.17Å; I376-V381 HydrophobicContact CD1-CG2 3.88Å; I376-V381 HydrophobicContact CG1-CG2 4.05Å; V381-H383 PolarHBondContact O-N 3.31Å; V381-A384 PolarHBondContact O-N 3.22Å; V381-V389 HydrophobicContact CB-CG2 4.46Å; V381-V389 HydrophobicContact CG1-CG1 4.11Å; V381-V389 HydrophobicContact CG1-CG2 3.81Å; V381-V389 HydrophobicContact CG2-CG2 4.31Å; V381-W392 HydrophobicContact CG2-CE3 4.38Å; V381-W392 HydrophobicContact CG2-CZ3 4.11Å
382	T	84.5	Confident	89.9	Confident	68 Å²	68	61.7 Å²	61.7	42%	0.417	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-22.7	-171	57.8	0	0	0	0	114.9	I374 D380	I374-T382 HydrophobicContact CG2-CG2 3.75Å; D380-T382 WeakPolarHBondContact OD1-CB 3.42Å; D380-T382 WeakPolarHBondContact OD1-CG2 3.35Å; D380-T382 PolarHBondContact OD1-N 3.19Å; D380-T382 PolarHBondContact OD1-OG1 2.71Å
383	H	82	Confident	89.9	Confident	189 Å²	189	60.8 Å²	60.8	88%	0.875	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-128.9	20.6	178.1	-59.1	-37	0	0	0	112.9	V381	V381-H383 PolarHBondContact O-N 3.31Å
384	A	85.6	Confident	89.7	Confident	23 Å²	23	68 Å²	68	19%	0.19	33%	0.333	C	S	.	.			trans	-102.4	141.4	-179.9	0	0	0	0	0	111.3	V381 V389 W392	V381-A384 PolarHBondContact O-N 3.22Å; A384-V389 HydrophobicContact CB-CG2 3.51Å; A384-W392 HydrophobicContact CB-CH2 3.66Å; A384-W392 HydrophobicContact CB-CZ2 4.43Å; A384-W392 HydrophobicContact CB-CZ3 3.97Å
385	S	87.5	Confident	89.6	Confident	66 Å²	66	70.6 Å²	70.6	46%	0.462	35%	0.354	S	S	.	.			trans	-68.9	155.6	176.6	68.1	0	0	0	0	112.1	D387 T388 V389	S385-D387 PolarHBondContact O-N 3.46Å; S385-T388 WeakPolarHBondContact O-CB 3.09Å; S385-T388 PolarHBondContact O-N 3Å; S385-T388 WeakPolarHBondContact OG-CB 3.5Å; S385-T388 PolarHBondContact OG-OG1 2.97Å; S385-V389 WeakPolarHBondContact O-CG2 3.28Å; S385-V389 PolarHBondContact O-N 2.84Å
386	Y	89.5	Confident	89.3	Confident	76 Å²	76	67.6 Å²	67.6	30%	0.298	34%	0.342	S	S	.	.	H	α-helix	trans	-52.7	-51.1	179	-178.8	-98.2	0	0	0	113.1	I339 E341 T388 V389 V390	I339-Y386 HydrophobicContact CD1-CD2 4.16Å; I339-Y386 HydrophobicContact CD1-CE2 3.83Å; I339-Y386 HydrophobicContact CG1-CE2 3.79Å; E341-Y386 HydrophobicContact CG-CD2 3.65Å; E341-Y386 HydrophobicContact CG-CG 3.8Å; E341-Y386 WeakPolarHBondContact OE1-CB 3.49Å; Y386-T388 VanDerWaalsContact C-N 3.33Å; Y386-T388 PolarHBondContact O-N 3.02Å; Y386-V389 PolarHBondContact O-N 2.81Å; Y386-V390 HydrophobicContact CD1-CG2 3.9Å; Y386-V390 HydrophobicContact CD2-CG2 4.35Å; Y386-V390 HydrophobicContact CE1-CG2 3.65Å; Y386-V390 HydrophobicContact CE2-CG2 4.12Å; Y386-V390 HydrophobicContact CG-CG2 4.25Å; Y386-V390 VanDerWaalsContact O-CG2 3.3Å; Y386-V390 WeakPolarHBondContact O-CG2 3.29Å; Y386-V390 PolarHBondContact O-N 3.33Å
387	D	90.9	Very high	88.6	Confident	108 Å²	108	75.3 Å²	75.3	58%	0.578	38%	0.376	S	S	*	.	H	α-helix	trans	-58.7	-44.3	179.2	-64.3	-54.7	0	0	0	112.1	S385 V389 V390 D391	S385-D387 PolarHBondContact O-N 3.46Å; D387-V389 PolarHBondContact O-N 3.42Å; D387-V390 PolarHBondContact O-N 2.75Å; D387-D391 WeakPolarHBondContact O-CB 3.49Å; D387-D391 PolarHBondContact O-N 2.73Å
388	T	91.8	Very high	88.5	Confident	54 Å²	54	79.6 Å²	79.6	33%	0.331	39%	0.394	S	S	.	.	H	α-helix	trans	-56.9	-40.5	176	-58.8	0	0	0	0	111.4	S385 Y386 W392	S385-T388 WeakPolarHBondContact O-CB 3.09Å; S385-T388 PolarHBondContact O-N 3Å; S385-T388 WeakPolarHBondContact OG-CB 3.5Å; S385-T388 PolarHBondContact OG-OG1 2.97Å; Y386-T388 VanDerWaalsContact C-N 3.33Å; Y386-T388 PolarHBondContact O-N 3.02Å; T388-W392 HydrophobicContact CG2-CD2 4.37Å; T388-W392 VanDerWaalsContact CG2-CE2 3.48Å; T388-W392 HydrophobicContact CG2-CH2 4.24Å; T388-W392 HydrophobicContact CG2-CZ2 3.42Å; T388-W392 VanDerWaalsContact CG2-CZ2 3.42Å; T388-W392 PolarHBondContact O-N 2.96Å; T388-W392 PolarHBondContact O-NE1 2.8Å
389	V	92.3	Very high	88.7	Confident	0 Å²	0	73.1 Å²	73.1	0%	0	37%	0.37	C	S	.	.	H	α-helix	trans	-79.5	-40.7	-176	164.3	0	0	0	0	112	I339 I350 L373 I376 V381 A384 S385 Y386 D387 D391 W392 I393	I339-V389 HydrophobicContact CD1-CG1 4.18Å; I350-V389 HydrophobicContact CD1-CB 3.55Å; I350-V389 HydrophobicContact CD1-CG1 3.59Å; I350-V389 HydrophobicContact CD1-CG2 3.67Å; I350-V389 HydrophobicContact CG2-CG1 4.38Å; L373-V389 HydrophobicContact CD2-CG1 4.45Å; I376-V389 HydrophobicContact CD1-CG1 3.63Å; V381-V389 HydrophobicContact CB-CG2 4.46Å; V381-V389 HydrophobicContact CG1-CG1 4.11Å; V381-V389 HydrophobicContact CG1-CG2 3.81Å; V381-V389 HydrophobicContact CG2-CG2 4.31Å; A384-V389 HydrophobicContact CB-CG2 3.51Å; S385-V389 WeakPolarHBondContact O-CG2 3.28Å; S385-V389 PolarHBondContact O-N 2.84Å; Y386-V389 PolarHBondContact O-N 2.81Å; D387-V389 PolarHBondContact O-N 3.42Å; V389-D391 PolarHBondContact O-N 2.91Å; V389-W392 HydrophobicContact CG2-CE3 4.08Å; V389-W392 HydrophobicContact CG2-CZ3 4.08Å; V389-W392 PolarHBondContact O-N 3.3Å; V389-W392 VanDerWaalsContact O-N 3.16Å; V389-I393 HydrophobicContact CG1-CD1 4.42Å; V389-I393 WeakPolarHBondContact O-CG1 3.49Å; V389-I393 PolarHBondContact O-N 2.86Å
390	V	91.7	Very high	88.9	Confident	21 Å²	21	68.4 Å²	68.4	13%	0.127	35%	0.349	C	S	.	.	H	α-helix	trans	-58.4	-41	168.9	178	0	0	0	0	109.8	I339 Y386 D387 W392 I393 R394	I339-V390 HydrophobicContact CD1-CG2 3.83Å; Y386-V390 HydrophobicContact CD1-CG2 3.9Å; Y386-V390 HydrophobicContact CD2-CG2 4.35Å; Y386-V390 HydrophobicContact CE1-CG2 3.65Å; Y386-V390 HydrophobicContact CE2-CG2 4.12Å; Y386-V390 HydrophobicContact CG-CG2 4.25Å; Y386-V390 VanDerWaalsContact O-CG2 3.3Å; Y386-V390 WeakPolarHBondContact O-CG2 3.29Å; Y386-V390 PolarHBondContact O-N 3.33Å; D387-V390 PolarHBondContact O-N 2.75Å; V390-W392 PolarHBondContact O-N 2.95Å; V390-I393 CarbonylContact O-C 3.47Å; V390-I393 PolarHBondContact O-N 3.12Å; V390-R394 HydrophobicContact CG1-CG 4.35Å; V390-R394 WeakPolarHBondContact O-CG 3.49Å; V390-R394 PolarHBondContact O-N 2.86Å
391	D	91.7	Very high	89	Confident	75 Å²	75	68.7 Å²	68.7	40%	0.401	35%	0.348	S	S	.	.	H	α-helix	trans	-69.4	-29.5	176.9	-79.3	-8.9	0	0	0	113.3	D387 V389 R394 S395	D387-D391 WeakPolarHBondContact O-CB 3.49Å; D387-D391 PolarHBondContact O-N 2.73Å; V389-D391 PolarHBondContact O-N 2.91Å; D391-R394 PolarHBondContact O-N 3.34Å; D391-R394 WeakPolarHBondContact OD1-CD 3.37Å; D391-R394 IonicContact OD1-CZ 3.4Å; D391-R394 IonicContact OD1-NE 3.72Å; D391-R394 IonicContact OD1-NH1 2.7Å; D391-R394 PolarHBondContact OD1-NH1 3.16Å; D391-S395 VanDerWaalsContact O-CB 3.24Å; D391-S395 WeakPolarHBondContact O-CB 3.48Å; D391-S395 PolarHBondContact O-N 2.58Å; D391-S395 PolarHBondContact O-OG 3.43Å
392	W	92.7	Very high	89.2	Confident	47 Å²	47	68.6 Å²	68.6	18%	0.178	35%	0.347	C	S	.	.	H	α-helix	trans	-68.7	-36.3	169.1	-61.7	-5	0	0	0	112.3	I376 K379 D380 V381 A384 T388 V389 V390 A396	I376-W392 HydrophobicContact CG2-CB 4.04Å; K379-W392 HydrophobicContact CB-CD2 4.15Å; K379-W392 HydrophobicContact CB-CE3 3.68Å; K379-W392 HydrophobicContact CB-CH2 3.82Å; K379-W392 HydrophobicContact CB-CZ2 4.27Å; K379-W392 HydrophobicContact CB-CZ3 3.51Å; K379-W392 HydrophobicContact CD-CD2 3.4Å; K379-W392 VanDerWaalsContact CD-CD2 3.4Å; K379-W392 HydrophobicContact CD-CE3 3.84Å; K379-W392 HydrophobicContact CD-CG 3.81Å; K379-W392 HydrophobicContact CD-CH2 4.15Å; K379-W392 HydrophobicContact CD-CZ2 3.75Å; K379-W392 HydrophobicContact CD-CZ3 4.2Å; K379-W392 HydrophobicContact CG-CD2 4.44Å; K379-W392 HydrophobicContact CG-CE3 4.44Å; K379-W392 VanDerWaalsContact NZ-NE1 3.11Å; D380-W392 VanDerWaalsContact O-CH2 3.24Å; D380-W392 WeakPolarHBondContact O-CH2 3.27Å; D380-W392 WeakPolarHBondContact O-CZ3 3.19Å; V381-W392 HydrophobicContact CG2-CE3 4.38Å; V381-W392 HydrophobicContact CG2-CZ3 4.11Å; A384-W392 HydrophobicContact CB-CH2 3.66Å; A384-W392 HydrophobicContact CB-CZ2 4.43Å; A384-W392 HydrophobicContact CB-CZ3 3.97Å; T388-W392 HydrophobicContact CG2-CD2 4.37Å; T388-W392 VanDerWaalsContact CG2-CE2 3.48Å; T388-W392 HydrophobicContact CG2-CH2 4.24Å; T388-W392 HydrophobicContact CG2-CZ2 3.42Å; T388-W392 VanDerWaalsContact CG2-CZ2 3.42Å; T388-W392 PolarHBondContact O-N 2.96Å; T388-W392 PolarHBondContact O-NE1 2.8Å; V389-W392 HydrophobicContact CG2-CE3 4.08Å; V389-W392 HydrophobicContact CG2-CZ3 4.08Å; V389-W392 PolarHBondContact O-N 3.3Å; V389-W392 VanDerWaalsContact O-N 3.16Å; V390-W392 PolarHBondContact O-N 2.95Å; W392-A396 PolarHBondContact O-N 3.03Å
393	I	91.2	Very high	89.6	Confident	25 Å²	25	68.6 Å²	68.6	13%	0.128	34%	0.342	C	S	.	.	H	α-helix	trans	-69.1	-39.7	172.8	-61.8	164.8	0	0	0	110.9	F335 F337 I339 I376 V389 V390 A396 L400	F335-I393 HydrophobicContact CD2-CG2 4.01Å; F335-I393 HydrophobicContact CE2-CG2 4.39Å; F337-I393 HydrophobicContact CE2-CD1 4.14Å; F337-I393 HydrophobicContact CZ-CD1 4.14Å; F337-I393 HydrophobicContact CZ-CG2 4.45Å; I339-I393 HydrophobicContact CD1-CD1 3.96Å; I376-I393 HydrophobicContact CD1-CD1 3.92Å; I376-I393 HydrophobicContact CD1-CG1 3.66Å; I376-I393 HydrophobicContact CG1-CG1 4.49Å; V389-I393 HydrophobicContact CG1-CD1 4.42Å; V389-I393 WeakPolarHBondContact O-CG1 3.49Å; V389-I393 PolarHBondContact O-N 2.86Å; V390-I393 CarbonylContact O-C 3.47Å; V390-I393 PolarHBondContact O-N 3.12Å; I393-A396 WeakPolarHBondContact O-CB 3.35Å; I393-A396 PolarHBondContact O-N 2.84Å; I393-L400 HydrophobicContact CG1-CD1 4.33Å; I393-L400 HydrophobicContact CG2-CD2 4.28Å
394	R	88.9	Confident	90.1	Very high	155 Å²	155	59.6 Å²	59.6	59%	0.585	30%	0.301	S	S	*	.	H	α-helix	trans	-65.4	-39.4	174.4	-71.6	168.7	179	146.8	0.5	111.8	V390 D391 A396	V390-R394 HydrophobicContact CG1-CG 4.35Å; V390-R394 WeakPolarHBondContact O-CG 3.49Å; V390-R394 PolarHBondContact O-N 2.86Å; D391-R394 PolarHBondContact O-N 3.34Å; D391-R394 WeakPolarHBondContact OD1-CD 3.37Å; D391-R394 IonicContact OD1-CZ 3.4Å; D391-R394 IonicContact OD1-NE 3.72Å; D391-R394 IonicContact OD1-NH1 2.7Å; D391-R394 PolarHBondContact OD1-NH1 3.16Å; R394-A396 PolarHBondContact O-N 2.78Å
395	S	89.2	Confident	90.3	Very high	87 Å²	87	59 Å²	59	61%	0.608	30%	0.295	S	S	*	.	H	α-helix	trans	-64.5	-21.3	176.9	-63	0	0	0	0	113.5	D391 K397	D391-S395 VanDerWaalsContact O-CB 3.24Å; D391-S395 WeakPolarHBondContact O-CB 3.48Å; D391-S395 PolarHBondContact O-N 2.58Å; D391-S395 PolarHBondContact O-OG 3.43Å; S395-K397 PolarHBondContact O-N 3.37Å
396	A	88	Confident	90.2	Very high	4 Å²	4	59 Å²	59	3%	0.033	29%	0.285	C	S	.	.			trans	-73.4	93.9	175.8	0	0	0	0	0	111.1	R330 F335 N377 W392 I393 R394 L400	R330-A396 PolarHBondContact NH1-O 3.36Å; R330-A396 VanDerWaalsContact NH1-O 3.14Å; F335-A396 HydrophobicContact CE2-CB 3.84Å; F335-A396 WeakPolarHBondContact CE2-O 3.21Å; F335-A396 HydrophobicContact CZ-CB 3.76Å; F335-A396 VanDerWaalsContact CZ-O 3.29Å; F335-A396 WeakPolarHBondContact CZ-O 3.11Å; N377-A396 WeakPolarHBondContact ND2-CB 3.49Å; W392-A396 PolarHBondContact O-N 3.03Å; I393-A396 WeakPolarHBondContact O-CB 3.35Å; I393-A396 PolarHBondContact O-N 2.84Å; R394-A396 PolarHBondContact O-N 2.78Å; A396-L400 HydrophobicContact CB-CB 4.19Å; A396-L400 HydrophobicContact CB-CD1 3.56Å; A396-L400 HydrophobicContact CB-CG 4.5Å
397	K	78.3	Confident	89.5	Confident	163 Å²	163	61.4 Å²	61.4	71%	0.709	29%	0.293	S	S	*	.	S	Bend	trans	-60.6	-48.3	-176.7	-69.3	-171.5	175.1	-175.1	0	113.9	R330 S395	R330-K397 WeakPolarHBondContact CD-O 3.44Å; S395-K397 PolarHBondContact O-N 3.37Å
398	H	86.3	Confident	88.2	Confident	140 Å²	140	57 Å²	57	65%	0.648	27%	0.273	S	S	*	.	S	Bend	trans	-133.9	-29.4	-173.2	-58.1	-64.8	0	0	0	114.3	Y329 R330	Y329-H398 CarbonylContact C-O 3.55Å; Y329-H398 WeakPolarHBondContact CA-O 3.45Å; R330-H398 PolarHBondContact N-O 3.18Å
399	V	91	Very high	86.4	Confident	51 Å²	51	56.3 Å²	56.3	31%	0.309	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	134.1	-175.4	-175.8	0	0	0	0	109.7	T327 L328 Y329 N377	T327-V399 HydrophobicContact CG2-CG1 3.5Å; T327-V399 VanDerWaalsContact CG2-CG1 3.5Å; L328-V399 WeakPolarHBondContact O-CA 3.15Å; Y329-V399 HydrophobicContact CD1-CG2 3.95Å; Y329-V399 HydrophobicContact CE1-CG2 3.92Å; N377-V399 PolarHBondContact ND2-O 2.9Å
400	L	93.1	Very high	84.2	Confident	0 Å²	0	59 Å²	59	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	104.7	177.3	-174.8	81.5	0	0	0	109.4	L328 F335 F337 I376 I393 A396 V402	L328-L400 PolarHBondContact N-O 3.39Å; L328-L400 PolarHBondContact O-N 2.83Å; F335-L400 HydrophobicContact CB-CD2 4.43Å; F335-L400 HydrophobicContact CD1-CB 3.9Å; F335-L400 HydrophobicContact CD1-CD2 4.43Å; F335-L400 HydrophobicContact CD2-CB 4.3Å; F335-L400 HydrophobicContact CD2-CD2 3.94Å; F335-L400 HydrophobicContact CE1-CB 3.55Å; F335-L400 HydrophobicContact CE2-CB 3.99Å; F335-L400 HydrophobicContact CE2-CD2 4.29Å; F335-L400 HydrophobicContact CG-CB 4.27Å; F335-L400 HydrophobicContact CG-CD2 4.02Å; F335-L400 HydrophobicContact CZ-CB 3.62Å; F337-L400 HydrophobicContact CE1-CD2 3.64Å; F337-L400 HydrophobicContact CZ-CD2 3.65Å; I376-L400 HydrophobicContact CG2-CD1 3.67Å; I393-L400 HydrophobicContact CG1-CD1 4.33Å; I393-L400 HydrophobicContact CG2-CD2 4.28Å; A396-L400 HydrophobicContact CB-CB 4.19Å; A396-L400 HydrophobicContact CB-CD1 3.56Å; A396-L400 HydrophobicContact CB-CG 4.5Å; L400-V402 HydrophobicContact CD2-CG2 3.51Å; L400-V402 HydrophobicContact CG-CG2 3.68Å
401	H	93.2	Very high	81.9	Confident	87 Å²	87	64.5 Å²	64.5	40%	0.403	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	121.8	167.3	-54	-73.7	0	0	0	108.9	T326 T327 I376 N377	T326-H401 WeakPolarHBondContact O-CA 3.41Å; T327-H401 VanDerWaalsContact CG2-CE1 3.46Å; T327-H401 WeakPolarHBondContact CG2-CE1 3.48Å; T327-H401 WeakPolarHBondContact CG2-ND1 3.17Å; T327-H401 PolarHBondContact OG1-ND1 3.02Å; I376-H401 CarbonylContact C-O 3.56Å; I376-H401 WeakPolarHBondContact CA-O 3.18Å; N377-H401 PolarHBondContact N-O 3.06Å; N377-H401 PolarHBondContact OD1-CD2 2.91Å; N377-H401 PolarHBondContact OD1-N 2.8Å
402	V	93.2	Very high	79.6	Confident	1 Å²	1	68.3 Å²	68.3	1%	0.006	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	134.2	178.1	-167	0	0	0	0	108.8	S325 T326 L373 K375 L400 V404	S325-V402 WeakPolarHBondContact CA-O 3.35Å; T326-V402 HydrophobicContact CG2-CB 3.94Å; T326-V402 HydrophobicContact CG2-CG2 4.49Å; T326-V402 PolarHBondContact N-O 2.88Å; T326-V402 PolarHBondContact O-N 3.14Å; L373-V402 HydrophobicContact CD1-CG1 4.31Å; L373-V402 HydrophobicContact CG-CG1 4.05Å; K375-V402 CarbonylContact O-C 3.56Å; K375-V402 WeakPolarHBondContact O-CA 3.48Å; L400-V402 HydrophobicContact CD2-CG2 3.51Å; L400-V402 HydrophobicContact CG-CG2 3.68Å; V402-V404 HydrophobicContact CG1-CG1 3.74Å
403	Q	93.6	Very high	76.8	Confident	68 Å²	68	70.7 Å²	70.7	32%	0.318	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	131.7	166.3	-51.2	-165.2	-87.6	0	0	109.2	Y324 S325 I374 K375	Y324-Q403 WeakPolarHBondContact O-CA 3.17Å; S325-Q403 WeakPolarHBondContact OG-CG 3.24Å; S325-Q403 PolarHBondContact OG-NE2 3.41Å; I374-Q403 PolarHBondContact N-O 3.49Å; K375-Q403 HydrophobicContact CB-CB 3.79Å; K375-Q403 HydrophobicContact CB-CG 3.94Å; K375-Q403 PolarHBondContact N-O 2.97Å; K375-Q403 VanDerWaalsContact N-O 3.14Å; K375-Q403 PolarHBondContact O-N 3.14Å
404	V	92.9	Very high	74	Confident	1 Å²	1	75.2 Å²	75.2	1%	0.006	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	150.8	-176.6	-56.5	0	0	0	0	111.9	I323 Y324 L367 D371 Q372 L373 V402	I323-V404 CarbonylContact C-O 2.92Å; I323-V404 WeakPolarHBondContact CA-O 3.47Å; Y324-V404 PolarHBondContact N-O 3.45Å; Y324-V404 PolarHBondContact O-N 2.9Å; L367-V404 HydrophobicContact CD2-CB 4.5Å; L367-V404 HydrophobicContact CD2-CG1 3.72Å; L367-V404 HydrophobicContact CD2-CG2 3.9Å; D371-V404 HydrophobicContact CB-CB 3.98Å; D371-V404 HydrophobicContact CB-CG1 4.3Å; D371-V404 HydrophobicContact CB-CG2 3.99Å; Q372-V404 CarbonylContact O-C 3.52Å; Q372-V404 WeakPolarHBondContact O-CA 3.43Å; Q372-V404 WeakPolarHBondContact O-CB 3.4Å; L373-V404 HydrophobicContact CD1-CG1 3.79Å; L373-V404 HydrophobicContact CG-CG1 4.28Å; V402-V404 HydrophobicContact CG1-CG1 3.74Å
405	T	90.3	Very high	71.1	Confident	11 Å²	11	72.5 Å²	72.5	7%	0.067	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	131.2	169.3	15.4	0	0	0	0	110.2	Q321 Q322 I323 Q372 I374	Q321-T405 HydrophobicContact CB-CG2 4.14Å; Q321-T405 VanDerWaalsContact CD-CG2 3.47Å; Q321-T405 HydrophobicContact CG-CG2 3.56Å; Q322-T405 WeakPolarHBondContact O-CA 3.3Å; I323-T405 HydrophobicContact CG1-CG2 4.01Å; Q372-T405 PolarHBondContact N-O 2.75Å; Q372-T405 PolarHBondContact O-N 2.89Å; Q372-T405 PolarHBondContact O-OG1 2.79Å; Q372-T405 PolarHBondContact OE1-OG1 3.07Å; I374-T405 HydrophobicContact CD1-CG2 3.81Å; I374-T405 HydrophobicContact CG1-CG2 4.27Å; I374-T405 WeakPolarHBondContact CG1-OG1 3.34Å
406	R	84.5	Confident	68.5	Low	66 Å²	66	77 Å²	77	25%	0.249	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	145.1	168.7	-169.8	-178.5	-60.8	157.8	13.5	108.9	Q322 Y324 I366 C368 D371	Q322-R406 PolarHBondContact N-O 3.28Å; Q322-R406 PolarHBondContact O-N 2.81Å; Y324-R406 HydrophobicContact CD2-CB 4.06Å; Y324-R406 HydrophobicContact CE2-CB 3.77Å; I366-R406 PolarHBondContact O-NH2 2.97Å; C368-R406 VanDerWaalsContact SG-CZ 3.55Å; C368-R406 PolarHBondContact SG-NH1 2.91Å; C368-R406 PolarHBondContact SG-NH2 2.82Å; C368-R406 VanDerWaalsContact SG-NH2 3.44Å; D371-R406 VanDerWaalsContact CG-NH2 3.32Å; D371-R406 WeakPolarHBondContact OD1-CB 3.46Å; D371-R406 IonicContact OD1-CZ 2.59Å; D371-R406 IonicContact OD1-NE 2.96Å; D371-R406 PolarHBondContact OD1-NE 3.45Å; D371-R406 IonicContact OD1-NH2 2.67Å; D371-R406 PolarHBondContact OD1-NH2 3.05Å; D371-R406 VanDerWaalsContact OD1-NH2 3.1Å; D371-R406 IonicContact OD2-CZ 3.71Å; D371-R406 IonicContact OD2-NE 2.86Å; D371-R406 IonicContact OD2-NH2 3.26Å; D371-R406 PolarHBondContact OD2-NH2 3.5Å
407	W	75.6	Confident	65.8	Low	126 Å²	126	83.6 Å²	83.6	48%	0.477	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	125.4	170.5	-73.2	97.9	0	0	0	109.9	I305 L319 Q321	I305-W407 HydrophobicContact CD1-CH2 4.3Å; L319-W407 HydrophobicContact CB-CE3 4.31Å; L319-W407 HydrophobicContact CB-CZ3 4.47Å; Q321-W407 HydrophobicContact CG-CD2 4.3Å; Q321-W407 HydrophobicContact CG-CZ2 4.38Å
408	G	62.8	Low	63.6	Low	14 Å²	14	85.2 Å²	85.2	14%	0.144	46%	0.462	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	136.9	-179.2	0	0	0	0	0	112	T320 N410	T320-G408 PolarHBondContact N-O 3.08Å; T320-G408 PolarHBondContact O-N 2.97Å; T320-G408 PolarHBondContact OG1-O 3.04Å; G408-N410 PolarHBondContact O-N 3.1Å
409	F	54.4	Low	60.9	Low	41 Å²	41	84.6 Å²	84.6	18%	0.18	47%	0.47	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	123	168.4	-59.7	-74.7	0	0	0	109.1	F312 H316 G317 L319 T411	F312-F409 HydrophobicContact CB-CZ 4.07Å; F312-F409 AromaticContact CD2-CZ 3.91Å; F312-F409 HydrophobicContact CD2-CZ 3.91Å; F312-F409 HydrophobicContact CG-CZ 4.19Å; H316-F409 HydrophobicContact CB-CB 4.16Å; H316-F409 HydrophobicContact CB-CD1 3.37Å; H316-F409 HydrophobicContact CB-CD2 4.5Å; H316-F409 HydrophobicContact CB-CE1 3.74Å; H316-F409 HydrophobicContact CB-CG 3.78Å; H316-F409 HydrophobicContact CB-CZ 4.46Å; H316-F409 AromaticContact CG-CD1 3.89Å; H316-F409 AromaticContact CG-CE1 3.99Å; G317-F409 WeakPolarHBondContact O-CD1 3.43Å; L319-F409 HydrophobicContact CD1-CE1 4.18Å; L319-F409 HydrophobicContact CD2-CD1 3.6Å; L319-F409 HydrophobicContact CD2-CD2 4.45Å; L319-F409 HydrophobicContact CD2-CE1 3.44Å; L319-F409 VanDerWaalsContact CD2-CE1 3.44Å; L319-F409 HydrophobicContact CD2-CE2 4.3Å; L319-F409 HydrophobicContact CD2-CG 4.13Å; L319-F409 HydrophobicContact CD2-CZ 3.82Å; L319-F409 HydrophobicContact CG-CD1 3.8Å; L319-F409 HydrophobicContact CG-CE1 3.55Å; L319-F409 HydrophobicContact CG-CZ 4.31Å; F409-T411 PolarHBondContact O-N 3.25Å
410	N	45.1	Very low	58	Low	56 Å²	56	87.5 Å²	87.5	30%	0.299	49%	0.493	S	S	.	.			trans	-75.2	113	178.2	-170.8	4.4	0	0	0	110.7	P318 T320 G408 Q412	P318-N410 PolarHBondContact O-N 3.45Å; T320-N410 HydrophobicContact CG2-CB 4.14Å; G408-N410 PolarHBondContact O-N 3.1Å; N410-Q412 WeakPolarHBondContact OD1-CB 3.44Å; N410-Q412 PolarHBondContact OD1-N 2.7Å
411	T	43.6	Very low	55.2	Low	137 Å²	137	92.9 Å²	92.9	84%	0.84	53%	0.526	S	S	*	.			trans	-89.3	0.6	176.6	46.7	0	0	0	0	113.9	F409 A413	F409-T411 PolarHBondContact O-N 3.25Å; T411-A413 PolarHBondContact O-N 2.59Å
412	Q	44.3	Very low	52.2	Low	155 Å²	155	97.1 Å²	97.1	72%	0.724	54%	0.543	S	S	*	.	S	Bend	trans	-77	110.5	171.4	-62	-169.4	7.1	0	0	110.6	N410 S414	N410-Q412 WeakPolarHBondContact OD1-CB 3.44Å; N410-Q412 PolarHBondContact OD1-N 2.7Å; Q412-S414 PolarHBondContact O-N 2.86Å
413	A	32.8	Very low	49.2	Very low	97 Å²	97	106.4 Å²	106.4	80%	0.802	58%	0.578	S	S	*	*			trans	-57.6	124.8	169	0	0	0	0	0	109.8	T411 A415	T411-A413 PolarHBondContact O-N 2.59Å; A413-A415 PolarHBondContact O-N 3.39Å
414	S	33.2	Very low	46.4	Very low	119 Å²	119	112 Å²	112	83%	0.832	60%	0.601	S	S	*	*			trans	-75	89.1	-164.1	47.3	0	0	0	0	113.8	Q412 E416	Q412-S414 PolarHBondContact O-N 2.86Å; S414-E416 VanDerWaalsContact C-N 3.31Å; S414-E416 PolarHBondContact O-N 3.45Å
415	A	28.9	Very low	43.6	Very low	99 Å²	99	116.4 Å²	116.4	82%	0.818	63%	0.632	S	S	*	*			trans	-92.9	32.6	169.4	0	0	0	0	0	113.2	A413	A413-A415 PolarHBondContact O-N 3.39Å
416	E	34	Very low	40.8	Very low	182 Å²	182	123.2 Å²	123.2	85%	0.85	67%	0.668	S	S	*	*			trans	-97.7	113.5	178.9	-69	-160.8	141.4	0	0	112.5	S414 K418	S414-E416 VanDerWaalsContact C-N 3.31Å; S414-E416 PolarHBondContact O-N 3.45Å; E416-K418 PolarHBondContact O-N 2.81Å
417	T	30.9	Very low	38.6	Very low	142 Å²	142	125.3 Å²	125.3	87%	0.871	69%	0.691	S	S	*	*			trans	-73.7	108.7	178.9	3.2	0	0	0	0	111.5	P419	T417-P419 WeakPolarHBondContact O-CD 3.1Å
418	K	32.3	Very low	36.7	Very low	197 Å²	197	124.7 Å²	124.7	86%	0.857	71%	0.705	S	S	*	*			trans	-59.3	124.9	173.9	-73.3	-179.4	176.4	176.1	0	111.9	E416 S420	E416-K418 PolarHBondContact O-N 2.81Å; K418-S420 PolarHBondContact O-N 3.17Å
419	P	29.7	Very low	35.5	Very low	126 Å²	126	129.9 Å²	129.9	82%	0.818	73%	0.734	S	S	*	*			trans	-73.2	115.4	163.2	29.7	-31.5	0	0	0	109.4	T417	T417-P419 WeakPolarHBondContact O-CD 3.1Å
420	S	29.9	Very low	34.5	Very low	113 Å²	113	134.8 Å²	134.8	79%	0.79	76%	0.762	S	S	*	*			trans	-84.2	132.6	179.5	57	0	0	0	0	111.5	K418	K418-S420 PolarHBondContact O-N 3.17Å
421	T	33.4	Very low	34	Very low	112 Å²	112	137.9 Å²	137.9	69%	0.687	78%	0.778	S	S	*	*			trans	-155.3	96.9	169.6	-68.3	0	0	0	0	112.1
422	K	31	Very low	33.6	Very low	176 Å²	176	135.9 Å²	135.9	77%	0.765	77%	0.766	S	S	*	*			trans	66.7	152.3	146.4	-58.3	169.5	-166.4	161.2	0	116.4
423	R	29.9	Very low	33	Very low	197 Å²	197	136.9 Å²	136.9	74%	0.743	77%	0.768	S	S	*	*			cis	-167.2	150.1	-9.6	-115.5	178.3	179	177.1	-2.9	108.4
424	F	34.2	Very low	32.9	Very low	184 Å²	184	137.8 Å²	137.8	81%	0.807	76%	0.764	S	S	*	*			trans	66.9	150.5	159	-73.1	-136.6	0	0	0	115.7
425	S	34	Very low	32.9	Very low	94 Å²	94	137 Å²	137	66%	0.657	76%	0.758	S	S	*	*			cis	-166.3	127.2	-17.1	47.4	0	0	0	0	110.8
426	D	31.8	Very low	33.2	Very low	154 Å²	154	138.3 Å²	138.3	82%	0.824	76%	0.756	S	S	*	*				31.8	155.4	121.1	-75.2	18.1	0	0	0	122.4
427	P	38.7	Very low	33.1	Very low	111 Å²	111	136.8 Å²	136.8	72%	0.721	75%	0.753	S	S	*	*			cis	-142	-155.5	-10.9	37.2	-14.7	0	0	0	114.5
428	S	36.9	Very low	33.4	Very low	112 Å²	112	137 Å²	137	78%	0.783	75%	0.748	S	S	*	*			trans	87.1	142.3	169.7	82.8	0	0	0	0	115.5
429	V	36.1	Very low	33.5	Very low	124 Å²	124	130.8 Å²	130.8	75%	0.752	74%	0.739	S	S	*	*			cis	-135.2	147.6	15.5	175.2	0	0	0	0	111.6
430	L	33.2	Very low	34	Very low	144 Å²	144	132.6 Å²	132.6	75%	0.754	74%	0.735	S	S	*	*			trans	1.9	153.5	153.6	-94.2	67.6	0	0	0	121.1
431	N	35	Very low	34.3	Very low	121 Å²	121	132.2 Å²	132.2	65%	0.647	72%	0.723	S	S	*	*			cis	-166.7	173.6	7.3	-144.3	-6.8	0	0	0	114.3
432	T	34.8	Very low	34.6	Very low	94 Å²	94	132.8 Å²	132.8	58%	0.577	72%	0.722	S	S	*	*			trans	61.7	142.4	152.3	44.8	0	0	0	0	120.4
433	F	31.8	Very low	34.9	Very low	176 Å²	176	131.3 Å²	131.3	77%	0.772	72%	0.718	S	S	*	*			cis	-142.8	133.6	0	-102	-61.1	0	0	0	111
434	T	31.4	Very low	35.1	Very low	116 Å²	116	127.4 Å²	127.4	71%	0.712	71%	0.711	S	S	*	*			trans	17.8	148.6	132	58.9	0	0	0	0	120.7
435	S	33.9	Very low	35.3	Very low	102 Å²	102	127.6 Å²	127.6	71%	0.713	71%	0.711	S	S	*	*			cis	-176.1	-169	10.6	36.5	0	0	0	0	110.8
436	V	34	Very low	35.2	Very low	128 Å²	128	128.7 Å²	128.7	78%	0.776	71%	0.71	S	S	*	*			trans	83.9	119.9	166.2	-179.3	0	0	0	0	114.6
437	L	32.6	Very low	35.3	Very low	150 Å²	150	130.1 Å²	130.1	79%	0.785	71%	0.709	S	S	*	*			cis	-147.5	178.1	-6.5	-145.7	94.9	0	0	0	111.9
438	L	36.3	Very low	35	Very low	146 Å²	146	132.3 Å²	132.3	76%	0.764	71%	0.714	S	S	*	*			trans	-55.1	160.3	-174.2	-73.3	66.8	0	0	0	115.7
439	G	35.9	Very low	34.6	Very low	66 Å²	66	131.7 Å²	131.7	68%	0.68	71%	0.71	S	S	*	*			cis	147.4	-176.1	-3.7	0	0	0	0	0	113.9
440	K	38.5	Very low	34.7	Very low	165 Å²	165	131 Å²	131	72%	0.717	71%	0.707	S	S	*	*			trans	72.1	147.4	163.6	-62.3	-169.1	140.2	-83.5	0	118.2
441	D	37.9	Very low	34.6	Very low	104 Å²	104	130.3 Å²	130.3	56%	0.556	71%	0.709	S	S	*	*			cis	-160.6	151.7	-10.2	-92.5	-19.4	0	0	0	110.2
442	N	38.5	Very low	34.6	Very low	124 Å²	124	131.6 Å²	131.6	66%	0.663	72%	0.716	S	S	*	*			trans	62	155.3	142.2	-65.7	24.1	0	0	0	122.9
443	E	36.8	Very low	34.4	Very low	145 Å²	145	132.3 Å²	132.3	68%	0.678	72%	0.72	S	S	*	*			cis	-166.2	143	-15.4	-109.4	-177.9	144.9	0	0	115.5
444	I	35.8	Very low	34.4	Very low	116 Å²	116	129.4 Å²	129.4	60%	0.595	72%	0.721	S	S	*	*			trans	52.1	140.5	147	-29	151	0	0	0	123.6
445	K	36.8	Very low	34.3	Very low	187 Å²	187	134.6 Å²	134.6	81%	0.813	73%	0.727	S	S	*	*			trans	110.7	148	145.5	-59.2	174.1	-170.4	168.7	0	116.9
446	N	32.6	Very low	34.1	Very low	117 Å²	117	136.8 Å²	136.8	63%	0.626	73%	0.726	S	S	*	*				-178.2	154.4	-59.2	-100.6	-1.6	0	0	0	109.2
447	F	33.2	Very low	34	Very low	185 Å²	185	137.1 Å²	137.1	81%	0.811	72%	0.723	S	S	*	*			trans	66.1	162.5	170.7	-49.1	-64.6	0	0	0	117.1
448	L	32.2	Very low	33.8	Very low	156 Å²	156	136.7 Å²	136.7	82%	0.817	72%	0.72	S	S	*	*			cis	-157.4	-178.3	-46.1	-110.4	175.4	0	0	0	108.1
449	S	30.1	Very low	33.6	Very low	99 Å²	99	137.2 Å²	137.2	69%	0.692	72%	0.723	S	S	*	*			trans	-90.4	-169.7	-177.4	58.4	0	0	0	0	113.5
450	P	37	Very low	33.3	Very low	109 Å²	109	139.7 Å²	139.7	71%	0.708	73%	0.725	S	S	*	*			cis	-142.7	172.4	-0	40.6	-19.9	0	0	0	119.3
451	V	32	Very low	33.2	Very low	131 Å²	131	140.8 Å²	140.8	79%	0.794	73%	0.73	S	S	*	*			trans	45	122	143.7	176.6	0	0	0	0	123.5
452	D	35.1	Very low	32.8	Very low	148 Å²	148	141.1 Å²	141.1	79%	0.791	74%	0.736	S	S	*	*			trans	-176.6	-168.8	133	-119.5	6.1	0	0	0	111.8
453	T	30.6	Very low	32.5	Very low	108 Å²	108	142.1 Å²	142.1	66%	0.663	74%	0.741	S	S	*	*				-163.1	171.4	-73	-81.4	0	0	0	0	111.7
454	C	30.7	Very low	32.2	Very low	115 Å²	115	142 Å²	142	78%	0.777	75%	0.745	S	S	*	*			trans	70.7	145	-178.8	-67.6	0	0	0	0	117.1
455	R	29.2	Very low	32	Very low	225 Å²	225	142.6 Å²	142.6	85%	0.849	75%	0.754	S	S	*	*			cis	75.6	140.5	32.3	-73.8	-168.6	175.4	132.8	0.2	114.2
456	E	29.4	Very low	31.7	Very low	149 Å²	149	141 Å²	141	70%	0.696	75%	0.753	S	S	*	*			cis	-164.1	-179.4	21.9	-145.4	166.8	-132.4	0	0	114.9
457	L	32.2	Very low	31.7	Very low	135 Å²	135	139.9 Å²	139.9	71%	0.707	76%	0.755	S	S	*	*			trans	65.8	138.2	162.6	-57.5	166.4	0	0	0	118.7
458	I	29.2	Very low	31.4	Very low	141 Å²	141	136.1 Å²	136.1	72%	0.723	75%	0.751	S	S	*	*			cis	95.4	113.5	22.6	-61.4	174.7	0	0	0	115.9
459	N	31.2	Very low	31.4	Very low	156 Å²	156	136.4 Å²	136.4	83%	0.834	75%	0.752	S	S	*	*			trans	-171.9	170	138.1	-109.1	-50.9	0	0	0	114.3
460	T	31	Very low	31.4	Very low	118 Å²	118	139.6 Å²	139.6	72%	0.724	76%	0.756	S	S	*	*			trans	-137.9	-177.7	-171.9	60.7	0	0	0	0	113.5
461	K	34.9	Very low	31.1	Very low	188 Å²	188	140.1 Å²	140.1	82%	0.817	76%	0.762	S	S	*	*			trans	105.9	154.2	170.7	-63.2	173.6	179.2	176.9	0	116
462	T	29.8	Very low	31	Very low	111 Å²	111	137.6 Å²	137.6	68%	0.681	76%	0.762	S	S	*	*			cis	-173.3	174.7	-33.5	37	0	0	0	0	108.9
463	L	33.3	Very low	30.8	Very low	145 Å²	145	135.4 Å²	135.4	76%	0.759	77%	0.765	S	S	*	*			trans	76.4	159.2	165.8	-57.1	170.4	0	0	0	115.7
464	N	29.1	Very low	30.7	Very low	142 Å²	142	135.6 Å²	135.6	76%	0.759	77%	0.771	S	S	*	*			cis	175.1	160	-38.6	-100.9	10.6	0	0	0	106.3
465	V	31.9	Very low	30.6	Very low	130 Å²	130	141.3 Å²	141.3	79%	0.788	78%	0.776	S	S	*	*			trans	148.1	123.3	143.8	159.1	0	0	0	0	113.7
466	L	30.8	Very low	30.6	Very low	152 Å²	152	137.1 Å²	137.1	80%	0.796	77%	0.77	S	S	*	*			trans	44.5	121.2	153.3	-85.7	64.3	0	0	0	120.5
467	S	32	Very low	30.5	Very low	95 Å²	95	136.3 Å²	136.3	66%	0.664	78%	0.775	S	S	*	*				80.4	139.8	68.7	82.9	0	0	0	0	114
468	S	28.4	Very low	30.5	Very low	105 Å²	105	135 Å²	135	73%	0.734	77%	0.774	S	S	*	*			cis	-169.8	-179.7	-5.9	-94.7	0	0	0	0	108.8
469	I	32.1	Very low	30.5	Very low	162 Å²	162	138.3 Å²	138.3	83%	0.831	78%	0.778	S	S	*	*			trans	77.3	142.2	167.8	-48.5	171.1	0	0	0	115
470	E	29.9	Very low	30.5	Very low	166 Å²	166	138 Å²	138	78%	0.776	77%	0.771	S	S	*	*			cis	-165.7	151.3	-39.3	-166.8	153.7	-136.3	0	0	108.5
471	S	31.2	Very low	30.5	Very low	121 Å²	121	139.2 Å²	139.2	85%	0.846	77%	0.772	S	S	*	*			trans	37.6	120	163	-65.8	0	0	0	0	121.6
472	G	29.4	Very low	30.3	Very low	77 Å²	77	136.4 Å²	136.4	79%	0.794	77%	0.77	S	S	*	*			trans	169.4	43.7	163.7	0	0	0	0	0	122.9
473	A	30.2	Very low	30.4	Very low	102 Å²	102	134.9 Å²	134.9	84%	0.843	76%	0.764	S	S	*	*			trans	63.1	157.4	161.3	0	0	0	0	0	121.1
474	S	29.2	Very low	30.5	Very low	112 Å²	112	138 Å²	138	78%	0.783	77%	0.766	S	S	*	*			trans	58.8	99.9	163.1	-149	0	0	0	0	119.9
475	W	29	Very low	30.6	Very low	235 Å²	235	139.4 Å²	139.4	89%	0.89	76%	0.761	S	S	*	*			trans	-90.5	125.4	159.5	-68.9	78	0	0	0	108.4
476	L	28.4	Very low	30.6	Very low	137 Å²	137	142.9 Å²	142.9	72%	0.717	76%	0.76	S	S	*	*				95.3	130.7	50.6	-79.1	174.7	0	0	0	114.3
477	V	26.9	Very low	30.5	Very low	132 Å²	132	146.9 Å²	146.9	80%	0.8	77%	0.765	S	S	*	*			trans	-155.9	150.1	-172.8	166.5	0	0	0	0	104.6
478	P	32.9	Very low	30.4	Very low	107 Å²	107	146.6 Å²	146.6	70%	0.695	77%	0.768	S	S	*	*			cis	-132.5	-179.3	-0.6	38.8	-20.5	0	0	0	116.6
479	R	29.2	Very low	30.5	Very low	211 Å²	211	145.9 Å²	145.9	80%	0.796	76%	0.763	S	S	*	*			trans	67.7	143.2	136.1	-97.1	-173	172.9	-157	2.3	125.4
480	Q	31.6	Very low	30.5	Very low	149 Å²	149	147.6 Å²	147.6	70%	0.696	77%	0.765	S	S	*	*			trans	72.2	142.4	147.4	-70.5	176.5	-2.2	0	0	120.5
481	I	30.1	Very low	30.8	Very low	145 Å²	145	145 Å²	145	74%	0.744	76%	0.762	S	S	*	*				167.3	119.4	110.5	-90	-176.4	0	0	0	112.6
482	V	31.3	Very low	30.6	Very low	128 Å²	128	146.5 Å²	146.5	78%	0.776	76%	0.761	S	S	*	*			trans	66.8	140.6	141	160.2	0	0	0	0	119.3
483	S	32.5	Very low	30.7	Very low	79 Å²	79	150.6 Å²	150.6	55%	0.552	76%	0.763	S	S	*	*			cis	-172.9	-179.1	-1.4	49.7	0	0	0	0	109.5
484	R	33.6	Very low	30.6	Very low	211 Å²	211	148.9 Å²	148.9	80%	0.796	76%	0.755	S	S	*	*				-166.6	139.1	50.8	-73.6	-170	178.1	176.6	1.9	116.6
485	Y	31.9	Very low	30.7	Very low	171 Å²	171	154.6 Å²	154.6	67%	0.671	76%	0.761	S	S	*	*				78.6	113.8	128.5	-79.2	-135.6	0	0	0	124.1
486	R	31.7	Very low	30.6	Very low	204 Å²	204	151.4 Å²	151.4	77%	0.77	75%	0.753	S	S	*	*				61.6	152.7	124.9	-60.1	-173.5	-167.6	-164.2	4.8	121.4
487	R	28.9	Very low	30.8	Very low	235 Å²	235	156.4 Å²	156.4	89%	0.887	76%	0.763	S	S	*	*			cis	-175.2	160.2	-27.1	-164.9	179.8	-167.2	-142.8	5.9	108
488	A	30.5	Very low	31.1	Very low	89 Å²	89	155.5 Å²	155.5	74%	0.736	75%	0.75	S	S	*	*			trans	90.6	148.2	154.6	0	0	0	0	0	119.5
489	S	29.7	Very low	31.1	Very low	90 Å²	90	158.4 Å²	158.4	63%	0.629	75%	0.754	S	S	*	*			cis	-178.8	133.8	-37.8	49.1	0	0	0	0	113.7
490	F	31.5	Very low	31.4	Very low	199 Å²	199	156.2 Å²	156.2	87%	0.873	76%	0.756	S	S	*	*			trans	63.3	166.6	151.2	-60.6	-47	0	0	0	120.1
491	P	37	Very low	31.2	Very low	110 Å²	110	154 Å²	154	71%	0.714	75%	0.754	S	S	*	*			cis	-133	175.2	-25.8	29	-7.7	0	0	0	116
492	N	28	Very low	31.5	Very low	153 Å²	153	153.5 Å²	153.5	82%	0.818	76%	0.758	S	S	*	*			trans	0.9	138.7	155.4	-62.7	-7.1	0	0	0	122.1
493	I	31.3	Very low	31.5	Very low	164 Å²	164	153.1 Å²	153.1	84%	0.841	76%	0.757	S	S	*	*				-164.4	152.2	110.9	-96	153.9	0	0	0	108.4	Y495	I493-Y495 HydrophobicContact CG2-CE2 4.49Å
494	G	27.1	Very low	31.4	Very low	65 Å²	65	155.3 Å²	155.3	67%	0.67	77%	0.767	S	S	*	*			trans	-145.9	164.7	-179.9	0	0	0	0	0	113.5
495	Y	31.7	Very low	31.4	Very low	233 Å²	233	153 Å²	153	91%	0.914	77%	0.769	S	S	*	*			trans	-141.1	159.4	178.8	-91.7	-81.5	0	0	0	112.9	I493	I493-Y495 HydrophobicContact CG2-CE2 4.49Å
496	K	27.7	Very low	31.5	Very low	167 Å²	167	153.5 Å²	153.5	73%	0.726	78%	0.777	S	S	*	*			trans	-97.9	159.2	-164.9	-66.2	168.8	149.8	-165.1	0	115.5	E498	K496-E498 WeakPolarHBondContact CD-OE1 3.33Å; K496-E498 WeakPolarHBondContact CE-OE1 3.23Å; K496-E498 IonicContact NZ-OE1 3.88Å; K496-E498 PolarHBondContact NZ-OE1 2.74Å
497	R	32.5	Very low	31.6	Very low	242 Å²	242	148.9 Å²	148.9	91%	0.913	77%	0.774	S	S	*	*				-150.3	130.2	129.9	-102.7	173.5	178.1	156.5	-0.4	106.3
498	E	31.4	Very low	31.8	Very low	113 Å²	113	144.7 Å²	144.7	53%	0.528	77%	0.768	S	S	.	*			cis	63.7	123	37.2	-65.8	-179.3	-171.5	0	0	112.9	K496	K496-E498 WeakPolarHBondContact CD-OE1 3.33Å; K496-E498 WeakPolarHBondContact CE-OE1 3.23Å; K496-E498 IonicContact NZ-OE1 3.88Å; K496-E498 PolarHBondContact NZ-OE1 2.74Å
499	H	32.9	Very low	31.8	Very low	168 Å²	168	145.9 Å²	145.9	78%	0.778	77%	0.769	S	S	*	*			cis	-161.8	140.7	3.4	-103.6	-66.8	0	0	0	110.5
500	I	35.6	Very low	31.9	Very low	166 Å²	166	147.8 Å²	147.8	85%	0.851	77%	0.772	S	S	*	*			trans	-159.5	132	135.7	-51.9	-171.8	0	0	0	108.6
501	P	29.1	Very low	32.1	Very low	101 Å²	101	148.1 Å²	148.1	66%	0.656	77%	0.769	S	S	*	*			trans	-125.4	144.1	174.7	38.2	-25.5	0	0	0	115.9
502	T	34.9	Very low	31.8	Very low	135 Å²	135	147.8 Å²	147.8	83%	0.828	77%	0.769	S	S	*	*			trans	-140.4	88.1	163.8	-50.2	0	0	0	0	112.9
503	T	32.4	Very low	31.8	Very low	120 Å²	120	147.1 Å²	147.1	74%	0.736	77%	0.77	S	S	*	*			trans	47.6	98.1	130.7	-43.9	0	0	0	0	121.9
504	V	30.9	Very low	31.8	Very low	126 Å²	126	146.2 Å²	146.2	76%	0.764	77%	0.773	S	S	*	*			trans	62.4	114	131.7	-175.8	0	0	0	0	120.8
505	L	32.1	Very low	32.1	Very low	163 Å²	163	148.1 Å²	148.1	85%	0.853	78%	0.776	S	S	*	*				-167.5	139.3	111.2	-100.2	178.1	0	0	0	113.3
506	Q	34	Very low	32.3	Very low	180 Å²	180	144.5 Å²	144.5	84%	0.841	77%	0.771	S	S	*	*			trans	-160.2	166.3	170.6	-98.5	-168.5	-3.6	0	0	106
507	P	34.9	Very low	32.4	Very low	107 Å²	107	143.1 Å²	143.1	70%	0.695	77%	0.771	S	S	*	*			cis	-125.1	-152.7	26.3	28.6	-2.2	0	0	0	111.5
508	L	31.8	Very low	32.6	Very low	147 Å²	147	139.3 Å²	139.3	77%	0.77	77%	0.768	S	S	*	*			cis	-141.7	159.4	11.2	-65.3	84.8	0	0	0	112.2
509	P	31.2	Very low	32.6	Very low	115 Å²	115	142.7 Å²	142.7	75%	0.747	78%	0.784	S	S	*	*			trans	-97.5	154.6	168.1	38.1	-33.3	0	0	0	114.4
510	N	32.2	Very low	32.7	Very low	129 Å²	129	138.2 Å²	138.2	69%	0.69	78%	0.783	S	S	*	*			trans	-160.3	153.2	159.8	-81.3	-50.8	0	0	0	106.4
511	Y	34.6	Very low	32.7	Very low	207 Å²	207	137.3 Å²	137.3	81%	0.812	78%	0.78	S	S	*	*			cis	-137.9	137.1	23.2	-77.5	-91.7	0	0	0	113.9
512	S	31.4	Very low	33	Very low	103 Å²	103	138.4 Å²	138.4	72%	0.72	79%	0.785	S	S	*	*				52.7	107	123.3	-46.4	0	0	0	0	122.6
513	T	27.3	Very low	32.8	Very low	138 Å²	138	138.3 Å²	138.3	85%	0.847	78%	0.78	S	S	*	*			trans	-90.7	137.3	157.4	51.6	0	0	0	0	112.1
514	T	32.6	Very low	32.7	Very low	146 Å²	146	140.9 Å²	140.9	90%	0.896	78%	0.781	S	S	*	*			trans	-100.7	111.9	168.1	37.2	0	0	0	0	111.4
515	S	33.6	Very low	32.7	Very low	105 Å²	105	141.7 Å²	141.7	73%	0.734	78%	0.781	S	S	*	*			trans	-97	138.3	171.4	48.2	0	0	0	0	111.1
516	I	35.5	Very low	32.8	Very low	156 Å²	156	143.5 Å²	143.5	80%	0.8	78%	0.782	S	S	*	*			trans	-111.5	115.9	171.8	-56.4	176.9	0	0	0	107.5	L518	I516-L518 HydrophobicContact CG2-CD1 4.23Å
517	N	30.5	Very low	32.6	Very low	138 Å²	138	141.7 Å²	141.7	74%	0.738	78%	0.777	S	S	*	*			trans	-81	134.3	174.3	-71.5	-26.5	0	0	0	110.4
518	L	35.4	Very low	32.5	Very low	162 Å²	162	142.8 Å²	142.8	85%	0.848	79%	0.787	S	S	*	*			trans	-122.1	124.8	150.3	-86.8	89.1	0	0	0	109.3	I516	I516-L518 HydrophobicContact CG2-CD1 4.23Å
519	Q	32.9	Very low	32.7	Very low	185 Å²	185	141.6 Å²	141.6	86%	0.864	78%	0.78	S	S	*	*			trans	-74.3	138.7	166.3	-129.4	93.8	-9.8	0	0	108.6
520	G	33.2	Very low	32.8	Very low	74 Å²	74	142.4 Å²	142.4	76%	0.763	78%	0.777	S	S	*	*			trans	176.5	92.1	-179.8	0	0	0	0	0	114
521	D	35.6	Very low	32.8	Very low	147 Å²	147	143.8 Å²	143.8	79%	0.786	78%	0.783	S	S	*	*			trans	-59.3	158.7	-168.5	-58.2	-55.1	0	0	0	118.4
522	T	35.5	Very low	32.7	Very low	124 Å²	124	141.2 Å²	141.2	76%	0.761	78%	0.783	S	S	*	*			trans	86.4	127.2	153.1	69.2	0	0	0	0	122.1
523	N	32.2	Very low	33.1	Very low	132 Å²	132	142.7 Å²	142.7	71%	0.706	78%	0.783	S	S	*	*			trans	70	92.9	142.2	-66.2	-10.5	0	0	0	122.2
524	F	30.1	Very low	33.9	Very low	175 Å²	175	143.6 Å²	143.6	77%	0.768	78%	0.778	S	S	*	*				68	129.9	128.7	-70.4	-77.5	0	0	0	122
525	D	29.6	Very low	34.5	Very low	142 Å²	142	141.6 Å²	141.6	76%	0.759	77%	0.767	S	S	*	*			trans	66.3	125.8	155.6	-62	-8.9	0	0	0	119.6
526	K	34.7	Very low	35.7	Very low	202 Å²	202	145.3 Å²	145.3	88%	0.878	77%	0.773	S	S	*	*			trans	71.6	90.4	-174	-50.1	166.5	-174.9	167	0	114.5
527	I	30.5	Very low	37.3	Very low	142 Å²	142	141.3 Å²	141.3	73%	0.728	75%	0.753	S	S	*	*				-166	126.2	125.5	-96.2	147.4	0	0	0	107.7	I529	I527-I529 HydrophobicContact CG1-CD1 4.09Å; I527-I529 HydrophobicContact CG2-CD1 4.17Å; I527-I529 HydrophobicContact CG2-CG1 4.24Å
528	S	32.1	Very low	39.6	Very low	129 Å²	129	140.9 Å²	140.9	90%	0.902	75%	0.746	S	S	*	*			trans	-149.8	73.3	172.7	-61.9	0	0	0	0	106.6
529	I	35.6	Very low	41.6	Very low	122 Å²	122	134 Å²	134	63%	0.626	71%	0.712	S	S	*	*			trans	-93	128	-170.3	-70.2	172.8	0	0	0	109.3	I527	I527-I529 HydrophobicContact CG1-CD1 4.09Å; I527-I529 HydrophobicContact CG2-CD1 4.17Å; I527-I529 HydrophobicContact CG2-CG1 4.24Å
530	L	32.8	Very low	43.9	Very low	133 Å²	133	127.1 Å²	127.1	70%	0.696	68%	0.683	S	S	*	*			trans	29.1	103.7	152.9	-55.2	170.8	0	0	0	118.1
531	I	33	Very low	46.3	Very low	157 Å²	157	129.4 Å²	129.4	81%	0.805	68%	0.676	S	S	*	*			trans	-138.3	141.4	144.5	-50.2	-178.6	0	0	0	107.2
532	N	33.1	Very low	48.6	Very low	153 Å²	153	125 Å²	125	82%	0.818	65%	0.649	S	S	*	*			trans	94.3	28.7	-177.8	-55.4	-10.1	0	0	0	118.1
533	D	38.6	Very low	50.9	Low	135 Å²	135	122.4 Å²	122.4	72%	0.722	63%	0.634	S	S	*	*			trans	-87.6	100.9	150.5	-73.9	-49.2	0	0	0	108.3
534	E	45	Very low	53.6	Low	156 Å²	156	116.7 Å²	116.7	73%	0.729	60%	0.603	S	S	*	*			trans	-64.5	139.6	164.9	-83	-108.5	115.1	0	0	109.2	E536	E534-E536 PolarHBondContact O-N 2.88Å
535	P	46.1	Very low	56.2	Low	105 Å²	105	114.2 Å²	114.2	68%	0.682	59%	0.592	S	S	*	*			trans	-60.8	130.9	179.5	25.5	-33.6	0	0	0	110.7	I537	P535-I537 VanDerWaalsContact C-N 3.34Å; P535-I537 PolarHBondContact O-N 3.5Å
536	E	58.5	Low	58.9	Low	183 Å²	183	111.1 Å²	111.1	86%	0.855	58%	0.58	S	S	*	*			trans	-73.1	84.1	-172.8	-170.2	167.6	-148.2	0	0	111.3	E534 E538	E534-E536 PolarHBondContact O-N 2.88Å; E536-E538 PolarHBondContact O-N 3.27Å
537	I	68.8	Low	61.2	Low	72 Å²	72	103.2 Å²	103.2	37%	0.369	56%	0.556	S	S	.	*			trans	-50.4	125.5	-177.7	-56.3	177.4	0	0	0	110.5	P535 I541 R542	P535-I537 VanDerWaalsContact C-N 3.34Å; P535-I537 PolarHBondContact O-N 3.5Å; I537-I541 HydrophobicContact CG2-CD1 3.98Å; I537-I541 HydrophobicContact CG2-CG1 3.77Å; I537-R542 HydrophobicContact CG2-CB 4.24Å; I537-R542 VanDerWaalsContact O-CZ 3.24Å; I537-R542 PolarHBondContact O-NE 3.23Å; I537-R542 PolarHBondContact O-NH2 3.43Å
538	E	78	Confident	64	Low	129 Å²	129	98.6 Å²	98.6	60%	0.603	54%	0.536	S	S	*	.			trans	-56.5	141.8	-179.2	-63.4	-175.4	-179.1	0	0	112.6	E536 T540 I541 R542	E536-E538 PolarHBondContact O-N 3.27Å; E538-T540 WeakPolarHBondContact CB-OG1 3.42Å; E538-T540 PolarHBondContact O-N 3.16Å; E538-T540 PolarHBondContact OE2-OG1 3.03Å; E538-I541 HydrophobicContact CB-CG1 4.24Å; E538-I541 PolarHBondContact O-N 3.25Å; E538-R542 VanDerWaalsContact O-CB 3.32Å; E538-R542 WeakPolarHBondContact O-CB 3.39Å; E538-R542 PolarHBondContact O-N 2.98Å
539	A	78.7	Confident	66.7	Low	16 Å²	16	97.3 Å²	97.3	13%	0.132	52%	0.516	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-21.8	179.6	0	0	0	0	0	113.6	I552 S553 R593	A539-I552 CarbonylContact O-C 3.58Å; A539-I552 WeakPolarHBondContact O-CA 3.08Å; A539-S553 WeakPolarHBondContact CB-OG 3.18Å; A539-S553 PolarHBondContact O-N 3.09Å; A539-R593 PolarHBondContact O-NH1 3.35Å
540	T	79.7	Confident	69.4	Low	42 Å²	42	92 Å²	92	26%	0.258	49%	0.489	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-41.6	171.8	48.8	0	0	0	0	112.8	E538 R593 Y651	E538-T540 WeakPolarHBondContact CB-OG1 3.42Å; E538-T540 PolarHBondContact O-N 3.16Å; E538-T540 PolarHBondContact OE2-OG1 3.03Å; T540-R593 PolarHBondContact O-NH1 3.08Å; T540-R593 PolarHBondContact O-NH2 3.48Å; T540-Y651 HydrophobicContact CG2-CD1 4.37Å; T540-Y651 HydrophobicContact CG2-CE1 3.82Å
541	I	83.5	Confident	72.2	Confident	121 Å²	121	89.4 Å²	89.4	62%	0.621	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.7	-9.6	-175.6	54.9	165.8	0	0	0	114	I537 E538	I537-I541 HydrophobicContact CG2-CD1 3.98Å; I537-I541 HydrophobicContact CG2-CG1 3.77Å; E538-I541 HydrophobicContact CB-CG1 4.24Å; E538-I541 PolarHBondContact O-N 3.25Å
542	R	84.6	Confident	75	Confident	56 Å²	56	81.9 Å²	81.9	21%	0.211	44%	0.435	C	S	.	.			trans	-53.8	125.2	-175.6	-167.4	178.4	-63.1	158.9	-13.4	112.6	I537 E538 T550 E551 R593	I537-R542 HydrophobicContact CG2-CB 4.24Å; I537-R542 VanDerWaalsContact O-CZ 3.24Å; I537-R542 PolarHBondContact O-NE 3.23Å; I537-R542 PolarHBondContact O-NH2 3.43Å; E538-R542 VanDerWaalsContact O-CB 3.32Å; E538-R542 WeakPolarHBondContact O-CB 3.39Å; E538-R542 PolarHBondContact O-N 2.98Å; R542-T550 HydrophobicContact CG-CG2 3.86Å; R542-E551 WeakPolarHBondContact CD-O 3.49Å; R542-E551 PolarHBondContact NH1-O 3.12Å; R542-R593 WeakPolarHBondContact O-CD 3.48Å; R542-R593 PolarHBondContact O-NH1 3.16Å
543	P	84.3	Confident	77.7	Confident	68 Å²	68	75.1 Å²	75.1	44%	0.442	40%	0.4	S	S	.	.			trans	-79.1	141.1	177.2	31.2	-34.5	0	0	0	111.7	K545	P543-K545 PolarHBondContact O-N 3.41Å
544	I	88	Confident	80.1	Confident	12 Å²	12	68.8 Å²	68.8	6%	0.062	37%	0.365	C	S	.	.			trans	-75.5	110.2	179.7	-60.9	163.4	0	0	0	110.3	T550 I552 R593 L594 I656 R658	I544-T550 HydrophobicContact CG1-CG2 4.47Å; I544-I552 HydrophobicContact CD1-CD1 4.18Å; I544-I552 HydrophobicContact CG1-CG2 3.92Å; I544-R593 HydrophobicContact CD1-CB 4.14Å; I544-L594 HydrophobicContact CD1-CD2 3.92Å; I544-I656 HydrophobicContact CD1-CB 4.31Å; I544-I656 HydrophobicContact CD1-CG1 4.46Å; I544-I656 HydrophobicContact CD1-CG2 4.01Å; I544-I656 HydrophobicContact CG2-CG2 4.12Å; I544-R658 HydrophobicContact CG2-CB 3.66Å; I544-R658 PolarHBondContact O-NH1 2.87Å
545	K	85.4	Confident	81.9	Confident	123 Å²	123	63 Å²	63	54%	0.535	34%	0.344	S	S	.	.			trans	-84.6	117.9	-178.3	-70.8	179.6	179.8	-179.2	0	110.9	P543 S548 T550	P543-K545 PolarHBondContact O-N 3.41Å; K545-S548 VanDerWaalsContact CB-OG 3.32Å; K545-S548 WeakPolarHBondContact CB-OG 3.3Å; K545-S548 PolarHBondContact O-N 3.18Å; K545-S548 PolarHBondContact O-OG 3.46Å; K545-T550 PolarHBondContact N-OG1 3.23Å
546	P	85.4	Confident	83.4	Confident	77 Å²	77	58.2 Å²	58.2	50%	0.5	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.6	141.5	177.3	-23.9	33.2	0	0	0	112.9	S548 R658 T660	P546-S548 VanDerWaalsContact C-N 3.31Å; P546-R658 CarbonylContact C-O 3.51Å; P546-R658 WeakPolarHBondContact CA-O 3.39Å; P546-R658 HydrophobicContact CB-CG 4.28Å; P546-R658 HydrophobicContact CG-CG 4.29Å; P546-T660 HydrophobicContact CB-CG2 4.28Å
547	G	84.3	Confident	83.8	Confident	37 Å²	37	52.5 Å²	52.5	38%	0.381	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	80	3.7	-178.7	0	0	0	0	0	115.1	R658	G547-R658 PolarHBondContact N-O 3.47Å
548	S	88.1	Confident	83.6	Confident	44 Å²	44	51.4 Å²	51.4	31%	0.308	28%	0.283	S	S	.	.	S	Bend	trans	-137.5	148.7	-178.3	63.5	0	0	0	0	112.5	K545 P546 T550	K545-S548 VanDerWaalsContact CB-OG 3.32Å; K545-S548 WeakPolarHBondContact CB-OG 3.3Å; K545-S548 PolarHBondContact O-N 3.18Å; K545-S548 PolarHBondContact O-OG 3.46Å; P546-S548 VanDerWaalsContact C-N 3.31Å; S548-T550 PolarHBondContact O-N 3.03Å
549	E	89.1	Confident	82.9	Confident	103 Å²	103	48.7 Å²	48.7	48%	0.481	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	122.5	167	-71.1	-157.3	124.6	0	0	109.6	S601 K602 T655	E549-S601 WeakPolarHBondContact OE1-CB 3.36Å; E549-S601 PolarHBondContact OE1-OG 3.01Å; E549-K602 IonicContact OE1-NZ 3.03Å; E549-K602 PolarHBondContact OE1-NZ 3.42Å; E549-K602 IonicContact OE2-NZ 2.62Å; E549-K602 PolarHBondContact OE2-NZ 2.92Å; E549-T655 HydrophobicContact CB-CG2 3.83Å; E549-T655 HydrophobicContact CG-CG2 4.2Å
550	T	91.8	Very high	82.2	Confident	9 Å²	9	48.7 Å²	48.7	6%	0.055	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	121.7	172.3	-51.5	0	0	0	0	109.2	R542 I544 K545 S548 I552 I656	R542-T550 HydrophobicContact CG-CG2 3.86Å; I544-T550 HydrophobicContact CG1-CG2 4.47Å; K545-T550 PolarHBondContact N-OG1 3.23Å; S548-T550 PolarHBondContact O-N 3.03Å; T550-I552 HydrophobicContact CG2-CG2 3.99Å; T550-I656 PolarHBondContact N-O 3.33Å; T550-I656 PolarHBondContact O-N 3.3Å
551	E	91.9	Very high	81.7	Confident	79 Å²	79	46.9 Å²	46.9	37%	0.369	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	124.6	166.3	-175.6	-179.9	-159.8	0	0	110	R542 N653 L654	R542-E551 WeakPolarHBondContact CD-O 3.49Å; R542-E551 PolarHBondContact NH1-O 3.12Å; E551-N653 PolarHBondContact OE1-ND2 2.8Å; E551-L654 WeakPolarHBondContact CA-O 3.5Å
552	I	92.2	Very high	81.6	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	154.6	175.3	63.6	165.7	0	0	0	110.8	A539 I544 T550 I554 L594 N653 L654 I656	A539-I552 CarbonylContact O-C 3.58Å; A539-I552 WeakPolarHBondContact O-CA 3.08Å; I544-I552 HydrophobicContact CD1-CD1 4.18Å; I544-I552 HydrophobicContact CG1-CG2 3.92Å; T550-I552 HydrophobicContact CG2-CG2 3.99Å; I552-I554 HydrophobicContact CD1-CD1 3.91Å; I552-I554 HydrophobicContact CD1-CG1 3.96Å; I552-L594 HydrophobicContact CD1-CD2 3.9Å; I552-L594 HydrophobicContact CD1-CG 4.19Å; I552-N653 CarbonylContact O-C 3.58Å; I552-N653 WeakPolarHBondContact O-CA 3.36Å; I552-L654 HydrophobicContact CG1-CB 4.06Å; I552-L654 PolarHBondContact N-O 3.37Å; I552-L654 PolarHBondContact O-N 3.47Å; I552-I656 HydrophobicContact CD1-CG1 3.96Å; I552-I656 HydrophobicContact CG1-CG1 4.05Å
553	S	90.3	Very high	81.2	Confident	11 Å²	11	38.5 Å²	38.5	8%	0.077	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	113.5	174.5	-66.4	0	0	0	0	108.8	A539 R593 L652 N653	A539-S553 WeakPolarHBondContact CB-OG 3.18Å; A539-S553 PolarHBondContact O-N 3.09Å; S553-R593 PolarHBondContact O-NH2 3.41Å; S553-L652 WeakPolarHBondContact CA-O 3.32Å; S553-N653 PolarHBondContact OG-OD1 2.85Å
554	I	87.6	Confident	81	Confident	1 Å²	1	35.6 Å²	35.6	1%	0.005	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	129.4	178.5	-60.2	-177.9	0	0	0	108.8	I552 I556 L562 A587 D591 L594 Y651 L652 L654	I552-I554 HydrophobicContact CD1-CD1 3.91Å; I552-I554 HydrophobicContact CD1-CG1 3.96Å; I554-I556 PolarHBondContact O-N 3.32Å; I554-L562 HydrophobicContact CB-CD1 4.37Å; I554-L562 HydrophobicContact CD1-CD1 4.1Å; I554-L562 HydrophobicContact CG2-CD1 3.99Å; I554-A587 HydrophobicContact CG2-CB 4.14Å; I554-D591 HydrophobicContact CG2-CB 4.24Å; I554-L594 HydrophobicContact CD1-CD1 3.47Å; I554-L594 VanDerWaalsContact CD1-CD1 3.47Å; I554-L594 HydrophobicContact CD1-CG 4.11Å; I554-Y651 CarbonylContact O-C 3.6Å; I554-Y651 WeakPolarHBondContact O-CA 3.45Å; I554-L652 PolarHBondContact N-O 2.68Å; I554-L652 PolarHBondContact O-N 3.47Å; I554-L654 HydrophobicContact CD1-CD1 3.87Å
555	A	82.8	Confident	80.6	Confident	34 Å²	34	35.4 Å²	35.4	28%	0.281	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66	123.5	179.7	0	0	0	0	0	111.2	Y651	A555-Y651 HydrophobicContact CB-CD1 4.13Å; A555-Y651 HydrophobicContact CB-CE1 3.86Å
556	I	78.4	Confident	80.5	Confident	6 Å²	6	30.6 Å²	30.6	3%	0.031	19%	0.192	C	C	.	.	P	Polyproline II helix	trans	-78.5	140.9	176	-68.7	168.6	0	0	0	108.7	I554 Y624 K627 S650 L652	I554-I556 PolarHBondContact O-N 3.32Å; I556-Y624 HydrophobicContact CB-CE2 4.31Å; I556-Y624 HydrophobicContact CD1-CD2 4.47Å; I556-Y624 HydrophobicContact CG1-CD2 4.12Å; I556-Y624 HydrophobicContact CG1-CE2 3.81Å; I556-Y624 HydrophobicContact CG2-CE1 4.26Å; I556-Y624 HydrophobicContact CG2-CE2 4.07Å; I556-K627 HydrophobicContact CD1-CB 3.24Å; I556-K627 HydrophobicContact CD1-CG 4.13Å; I556-S650 WeakPolarHBondContact CB-O 3.28Å; I556-S650 PolarHBondContact N-O 2.87Å; I556-L652 HydrophobicContact CD1-CB 3.98Å; I556-L652 HydrophobicContact CG1-CB 4.07Å
557	N	67.2	Low	80.3	Confident	63 Å²	63	27 Å²	27	34%	0.337	17%	0.168	S	C	.	.	B	Isolated β-bridge	trans	-132.1	130.7	-179.9	-168.3	-39.2	0	0	0	109.7	S559 Y624	N557-S559 PolarHBondContact O-N 3.14Å; N557-S559 WeakPolarHBondContact OD1-CB 3.42Å; N557-S559 PolarHBondContact OD1-N 2.96Å; N557-S559 PolarHBondContact OD1-OG 2.89Å; N557-Y624 PolarHBondContact N-OH 2.86Å; N557-Y624 PolarHBondContact O-OH 2.85Å
558	N	64.7	Low	80.2	Confident	48 Å²	48	25.3 Å²	25.3	26%	0.257	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.5	1.2	-178.8	-70.7	-11.9	0	0	0	113.4	S628 P800	N558-S628 PolarHBondContact OD1-OG 2.74Å; N558-P800 WeakPolarHBondContact O-CB 3.09Å
559	S	63.1	Low	79.9	Confident	72 Å²	72	23.2 Å²	23.2	50%	0.503	14%	0.135	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.8	-15.9	175.7	67.5	0	0	0	0	114.7	N557	N557-S559 PolarHBondContact O-N 3.14Å; N557-S559 WeakPolarHBondContact OD1-CB 3.42Å; N557-S559 PolarHBondContact OD1-N 2.96Å; N557-S559 PolarHBondContact OD1-OG 2.89Å
560	C	64.7	Low	79.7	Confident	16 Å²	16	20.6 Å²	20.6	11%	0.108	13%	0.128	C	C	.	.	B	Isolated β-bridge	trans	-153.8	140.5	178.2	62.3	0	0	0	0	109.6	K590 Y624	C560-K590 PolarHBondContact SG-NZ 3.11Å; C560-Y624 PolarHBondContact O-OH 2.86Å
561	G	69.3	Low	79.1	Confident	5 Å²	5	22.4 Å²	22.4	5%	0.052	14%	0.136	C	C	.	.			trans	-76.7	-174.2	176.2	0	0	0	0	0	113.9	G563 G586 A587 Y624 F797	G561-G563 PolarHBondContact O-N 3.45Å; G561-G586 WeakPolarHBondContact O-CA 3.44Å; G561-A587 PolarHBondContact O-N 3.14Å; G561-Y624 WeakPolarHBondContact CA-OH 3.44Å; G561-F797 WeakPolarHBondContact CA-O 3.46Å; G561-F797 PolarHBondContact N-O 3.5Å
562	L	79.9	Confident	78.4	Confident	1 Å²	1	18.8 Å²	18.8	1%	0.005	12%	0.119	C	C	.	.			trans	-55	-41.4	-179	-168.4	61.9	0	0	0	114.2	I554 I564 A587 A588 Y624 L652 F797	I554-L562 HydrophobicContact CB-CD1 4.37Å; I554-L562 HydrophobicContact CD1-CD1 4.1Å; I554-L562 HydrophobicContact CG2-CD1 3.99Å; L562-I564 HydrophobicContact CD2-CD1 3.55Å; L562-I564 HydrophobicContact CD2-CG1 3.89Å; L562-I564 HydrophobicContact CG-CD1 4.2Å; L562-I564 HydrophobicContact CG-CG1 4.18Å; L562-A587 PolarHBondContact O-N 3.35Å; L562-A588 WeakPolarHBondContact O-CB 3.31Å; L562-A588 PolarHBondContact O-N 3.07Å; L562-Y624 HydrophobicContact CB-CD2 4.04Å; L562-Y624 HydrophobicContact CB-CE2 4.05Å; L562-L652 HydrophobicContact CD1-CD2 3.8Å; L562-L652 HydrophobicContact CD2-CD2 3.55Å; L562-L652 HydrophobicContact CG-CD2 4.29Å; L562-F797 HydrophobicContact CB-CD1 3.48Å; L562-F797 VanDerWaalsContact CB-CD1 3.48Å; L562-F797 HydrophobicContact CB-CD2 4Å; L562-F797 HydrophobicContact CB-CE1 3.38Å; L562-F797 HydrophobicContact CB-CE2 3.9Å; L562-F797 HydrophobicContact CB-CG 3.8Å; L562-F797 HydrophobicContact CB-CZ 3.59Å; L562-F797 HydrophobicContact CD2-CE1 4.35Å; L562-F797 HydrophobicContact CD2-CE2 4.32Å; L562-F797 HydrophobicContact CD2-CZ 3.89Å; L562-F797 HydrophobicContact CG-CZ 4.35Å
563	G	76.8	Confident	77.8	Confident	0 Å²	0	19.4 Å²	19.4	0%	0	12%	0.124	C	C	.	.			trans	83.4	37	170.5	0	0	0	0	0	114.7	G561 I582 Y583 F797	G561-G563 PolarHBondContact O-N 3.45Å; G563-I582 CarbonylContact O-C 3.59Å; G563-I582 WeakPolarHBondContact O-CA 3.23Å; G563-Y583 PolarHBondContact O-N 3.41Å; G563-F797 VanDerWaalsContact N-CD2 3.35Å
564	I	80.8	Confident	77.4	Confident	6 Å²	6	19.8 Å²	19.8	3%	0.031	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	135.1	176	61.7	179	0	0	0	111	L562 I579 I582 A588 L594 I600 F797	L562-I564 HydrophobicContact CD2-CD1 3.55Å; L562-I564 HydrophobicContact CD2-CG1 3.89Å; L562-I564 HydrophobicContact CG-CD1 4.2Å; L562-I564 HydrophobicContact CG-CG1 4.18Å; I564-I579 HydrophobicContact CD1-CD1 4.36Å; I564-I579 HydrophobicContact CD1-CG1 4.39Å; I564-I579 HydrophobicContact CG2-CD1 4.36Å; I564-I582 HydrophobicContact CG2-CG1 4.39Å; I564-A588 HydrophobicContact CG2-CB 3.59Å; I564-L594 HydrophobicContact CG2-CD1 4.2Å; I564-I600 HydrophobicContact CD1-CD1 3.87Å; I564-F797 HydrophobicContact CG1-CD2 4.41Å; I564-F797 HydrophobicContact CG1-CE2 3.83Å
565	G	79.2	Confident	77.2	Confident	9 Å²	9	22.5 Å²	22.5	9%	0.093	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	133.4	161.8	0	0	0	0	0	109	H580 E581	G565-H580 PolarHBondContact O-N 3.14Å; G565-E581 PolarHBondContact N-O 2.87Å; G565-E581 PolarHBondContact O-N 2.8Å
566	C	83.7	Confident	77.4	Confident	22 Å²	22	22.2 Å²	22.2	15%	0.149	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	163.6	-179.7	-64.3	0	0	0	0	111.6	V578 F613 M617	C566-V578 CarbonylContact C-O 3.58Å; C566-V578 VanDerWaalsContact CA-O 3.31Å; C566-V578 WeakPolarHBondContact CA-O 3.38Å; C566-F613 HydrophobicContact CB-CE2 4.14Å; C566-F613 HydrophobicContact CB-CZ 4.35Å; C566-F613 WeakPolarHBondContact O-CZ 3.24Å; C566-M617 HydrophobicContact CB-CE 3.77Å; C566-M617 HydrophobicContact CB-SD 3.81Å
567	I	81	Confident	77.9	Confident	2 Å²	2	21.9 Å²	21.9	1%	0.01	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	175.9	167	56.4	167.6	0	0	0	108.7	L574 P577 V578 H580 W666 L783	I567-L574 HydrophobicContact CD1-CD1 3.66Å; I567-L574 HydrophobicContact CG1-CD1 3.87Å; I567-P577 CarbonylContact O-C 3.57Å; I567-P577 VanDerWaalsContact O-CA 3.32Å; I567-P577 WeakPolarHBondContact O-CA 3.23Å; I567-V578 HydrophobicContact CG1-CB 4.3Å; I567-V578 PolarHBondContact N-O 2.81Å; I567-V578 PolarHBondContact O-N 3.17Å; I567-H580 HydrophobicContact CD1-CB 4.49Å; I567-H580 HydrophobicContact CG1-CB 4.08Å; I567-H580 HydrophobicContact CG2-CB 3.92Å; I567-W666 HydrophobicContact CD1-CB 3.9Å; I567-W666 HydrophobicContact CD1-CD2 3.55Å; I567-W666 HydrophobicContact CD1-CE3 3.21Å; I567-W666 HydrophobicContact CD1-CG 3.85Å; I567-W666 HydrophobicContact CD1-CZ3 3.94Å; I567-L783 HydrophobicContact CD1-CD2 4.43Å
568	G	82.2	Confident	78.8	Confident	0 Å²	0	19.2 Å²	19.2	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	104.7	-138	172.4	0	0	0	0	0	113	T572 F613	G568-T572 VanDerWaalsContact C-OG1 3.23Å; G568-T572 VanDerWaalsContact CA-OG1 3.26Å; G568-T572 WeakPolarHBondContact CA-OG1 3.41Å; G568-T572 VanDerWaalsContact O-CG2 3.25Å; G568-T572 WeakPolarHBondContact O-CG2 3.3Å; G568-F613 VanDerWaalsContact O-CB 3.27Å; G568-F613 WeakPolarHBondContact O-CB 3.4Å; G568-F613 VanDerWaalsContact O-CD2 3.23Å; G568-F613 WeakPolarHBondContact O-CD2 3.49Å; G568-F613 VanDerWaalsContact O-CG 3.27Å; G568-F613 WeakPolarHBondContact O-CG 3.46Å
569	G	80.8	Confident	79.8	Confident	0 Å²	0	17 Å²	17	0%	0	11%	0.106	C	C	.	.			trans	91.8	166.5	-170.6	0	0	0	0	0	113.2	E571 T572 N575 I576	G569-E571 WeakPolarHBondContact CA-OE2 3.48Å; G569-E571 PolarHBondContact O-N 3.19Å; G569-T572 PolarHBondContact O-N 2.86Å; G569-T572 VanDerWaalsContact O-N 3.1Å; G569-T572 PolarHBondContact O-OG1 3.26Å; G569-N575 CarbonylContact O-C 3.6Å; G569-N575 VanDerWaalsContact O-CA 3.28Å; G569-N575 WeakPolarHBondContact O-CA 3.35Å; G569-N575 PolarHBondContact O-N 2.8Å; G569-I576 PolarHBondContact N-O 2.83Å
570	C	85.6	Confident	80.5	Confident	49 Å²	49	13.7 Å²	13.7	33%	0.331	8%	0.082	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-19.3	-172.1	75.1	0	0	0	0	114.9	T572 V611 P612	C570-T572 VanDerWaalsContact C-N 3.26Å; C570-T572 PolarHBondContact O-N 2.79Å; C570-V611 PolarHBondContact N-O 2.89Å; C570-V611 VanDerWaalsContact N-O 3.12Å; C570-V611 VanDerWaalsContact SG-C 3.54Å; C570-P612 VanDerWaalsContact SG-CA 3.58Å; C570-P612 VanDerWaalsContact SG-N 3.38Å
571	E	78.8	Confident	81	Confident	46 Å²	46	14.5 Å²	14.5	22%	0.215	9%	0.085	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-12.5	175.2	62.2	-86.8	-114.1	0	0	113.4	G569 P612 F613 N785 I787	G569-E571 WeakPolarHBondContact CA-OE2 3.48Å; G569-E571 PolarHBondContact O-N 3.19Å; E571-P612 WeakPolarHBondContact OE2-CA 3.36Å; E571-F613 VanDerWaalsContact CD-N 3.27Å; E571-F613 VanDerWaalsContact OE1-CB 3.3Å; E571-F613 WeakPolarHBondContact OE1-CB 3.21Å; E571-F613 PolarHBondContact OE1-N 3.25Å; E571-F613 PolarHBondContact OE2-N 3.09Å; E571-N785 HydrophobicContact CB-CB 4.47Å; E571-N785 WeakPolarHBondContact O-CB 3.32Å; E571-N785 PolarHBondContact O-ND2 2.78Å; E571-I787 WeakPolarHBondContact OE1-CD1 3.28Å
572	T	77.5	Confident	81.4	Confident	4 Å²	4	15.3 Å²	15.3	3%	0.025	9%	0.088	C	C	.	.	S	Bend	trans	-112.5	163.8	-176.3	74.4	0	0	0	0	112.8	G568 G569 C570 L574 N575 L783	G568-T572 VanDerWaalsContact C-OG1 3.23Å; G568-T572 VanDerWaalsContact CA-OG1 3.26Å; G568-T572 WeakPolarHBondContact CA-OG1 3.41Å; G568-T572 VanDerWaalsContact O-CG2 3.25Å; G568-T572 WeakPolarHBondContact O-CG2 3.3Å; G569-T572 PolarHBondContact O-N 2.86Å; G569-T572 VanDerWaalsContact O-N 3.1Å; G569-T572 PolarHBondContact O-OG1 3.26Å; C570-T572 VanDerWaalsContact C-N 3.26Å; C570-T572 PolarHBondContact O-N 2.79Å; T572-L574 PolarHBondContact O-N 2.82Å; T572-L574 PolarHBondContact OG1-N 3.31Å; T572-N575 PolarHBondContact O-N 2.9Å; T572-L783 HydrophobicContact CG2-CD2 3.9Å; T572-L783 HydrophobicContact CG2-CG 4.05Å
573	A	79.7	Confident	81.1	Confident	12 Å²	12	17.1 Å²	17.1	10%	0.099	9%	0.094	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-13.9	173.4	0	0	0	0	0	115.5	F312 H316 D668 L783	F312-A573 HydrophobicContact CD1-CB 4.22Å; H316-A573 PolarHBondContact NE2-O 3.13Å; H316-A573 VanDerWaalsContact NE2-O 3.16Å; A573-D668 HydrophobicContact CB-CB 3.91Å; A573-D668 WeakPolarHBondContact CB-OD2 3.49Å; A573-L783 HydrophobicContact CB-CD1 4.17Å
574	L	81.9	Confident	80.7	Confident	19 Å²	19	20.2 Å²	20.2	10%	0.099	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-24.3	176.2	-60.5	-179.2	0	0	0	113.1	I567 T572 I576 V578 W666 L783	I567-L574 HydrophobicContact CD1-CD1 3.66Å; I567-L574 HydrophobicContact CG1-CD1 3.87Å; T572-L574 PolarHBondContact O-N 2.82Å; T572-L574 PolarHBondContact OG1-N 3.31Å; L574-I576 PolarHBondContact O-N 3.1Å; L574-V578 HydrophobicContact CB-CG2 4.14Å; L574-V578 HydrophobicContact CD1-CB 4.12Å; L574-V578 HydrophobicContact CD1-CG2 3.84Å; L574-V578 HydrophobicContact CD2-CG2 4.46Å; L574-V578 HydrophobicContact CG-CG2 4.38Å; L574-W666 HydrophobicContact CD1-CB 4.4Å; L574-W666 HydrophobicContact CD2-CB 4.45Å; L574-L783 HydrophobicContact CD1-CD2 3.57Å; L574-L783 HydrophobicContact CG-CD1 4.3Å; L574-L783 HydrophobicContact CG-CD2 3.93Å
575	N	83.1	Confident	80.2	Confident	59 Å²	59	25.8 Å²	25.8	32%	0.316	15%	0.145	S	C	.	.			trans	58.5	-17.1	-179.4	-163.9	16.2	0	0	0	116.9	G569 T572	G569-N575 CarbonylContact O-C 3.6Å; G569-N575 VanDerWaalsContact O-CA 3.28Å; G569-N575 WeakPolarHBondContact O-CA 3.35Å; G569-N575 PolarHBondContact O-N 2.8Å; T572-N575 PolarHBondContact O-N 2.9Å
576	I	87.8	Confident	79.9	Confident	27 Å²	27	25.4 Å²	25.4	14%	0.138	14%	0.14	C	C	.	.	S	Bend	trans	-135.3	160	176.2	50.9	179.6	0	0	0	110.6	G569 L574 V578 R599 A609	G569-I576 PolarHBondContact N-O 2.83Å; L574-I576 PolarHBondContact O-N 3.1Å; I576-V578 PolarHBondContact O-N 3.44Å; I576-R599 HydrophobicContact CD1-CB 3.59Å; I576-R599 HydrophobicContact CD1-CG 4.35Å; I576-R599 HydrophobicContact CG1-CB 4.21Å; I576-A609 HydrophobicContact CG2-CB 3.97Å
577	P	88.2	Confident	79.8	Confident	0 Å²	0	24.6 Å²	24.6	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.8	132.5	171.5	-24	36.3	0	0	0	112	I567 I600 L608 A616 M617	I567-P577 CarbonylContact O-C 3.57Å; I567-P577 VanDerWaalsContact O-CA 3.32Å; I567-P577 WeakPolarHBondContact O-CA 3.23Å; P577-I600 HydrophobicContact CB-CB 4.49Å; P577-I600 PolarHBondContact O-N 2.86Å; P577-L608 HydrophobicContact CG-CB 4.23Å; P577-L608 HydrophobicContact CG-CD1 3.88Å; P577-A616 HydrophobicContact CG-CB 3.65Å; P577-M617 HydrophobicContact CB-CE 3.74Å; P577-M617 HydrophobicContact CG-CE 3.92Å
578	V	86.7	Confident	79.9	Confident	6 Å²	6	24.6 Å²	24.6	4%	0.036	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	133.5	176.2	-175.9	0	0	0	0	108.2	C566 I567 L574 I576 H580 D598 R599	C566-V578 CarbonylContact C-O 3.58Å; C566-V578 VanDerWaalsContact CA-O 3.31Å; C566-V578 WeakPolarHBondContact CA-O 3.38Å; I567-V578 HydrophobicContact CG1-CB 4.3Å; I567-V578 PolarHBondContact N-O 2.81Å; I567-V578 PolarHBondContact O-N 3.17Å; L574-V578 HydrophobicContact CB-CG2 4.14Å; L574-V578 HydrophobicContact CD1-CB 4.12Å; L574-V578 HydrophobicContact CD1-CG2 3.84Å; L574-V578 HydrophobicContact CD2-CG2 4.46Å; L574-V578 HydrophobicContact CG-CG2 4.38Å; I576-V578 PolarHBondContact O-N 3.44Å; V578-H580 PolarHBondContact O-N 3.42Å; V578-D598 WeakPolarHBondContact CA-O 3.08Å; V578-R599 HydrophobicContact CG1-CG 4.37Å; V578-R599 HydrophobicContact CG2-CB 4.25Å; V578-R599 HydrophobicContact CG2-CG 3.87Å
579	I	85.8	Confident	79.8	Confident	1 Å²	1	26.1 Å²	26.1	1%	0.005	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	123.4	176.8	-63.4	175.3	0	0	0	108.2	I564 I582 L594 P596 G597 D598 I600	I564-I579 HydrophobicContact CD1-CD1 4.36Å; I564-I579 HydrophobicContact CD1-CG1 4.39Å; I564-I579 HydrophobicContact CG2-CD1 4.36Å; I579-I582 HydrophobicContact CG2-CD1 4.13Å; I579-I582 HydrophobicContact CG2-CG1 3.71Å; I579-L594 HydrophobicContact CD1-CB 4.23Å; I579-L594 HydrophobicContact CD1-CD1 3.88Å; I579-L594 HydrophobicContact CD1-CD2 3.77Å; I579-L594 HydrophobicContact CD1-CG 4.19Å; I579-P596 CarbonylContact O-C 3.57Å; I579-P596 WeakPolarHBondContact O-CA 3.3Å; I579-G597 PolarHBondContact O-N 2.86Å; I579-D598 HydrophobicContact CD1-CB 4.22Å; I579-D598 PolarHBondContact N-O 2.92Å; I579-I600 HydrophobicContact CD1-CD1 4.35Å; I579-I600 HydrophobicContact CD1-CG1 4.37Å; I579-I600 HydrophobicContact CG1-CD1 4.01Å; I579-I600 HydrophobicContact CG1-CG1 4.17Å
580	H	76.9	Confident	79.8	Confident	3 Å²	3	31.1 Å²	31.1	1%	0.014	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	-40.6	-179	-169.7	82.1	0	0	0	111.5	G565 I567 V578 W666 I727	G565-H580 PolarHBondContact O-N 3.14Å; I567-H580 HydrophobicContact CD1-CB 4.49Å; I567-H580 HydrophobicContact CG1-CB 4.08Å; I567-H580 HydrophobicContact CG2-CB 3.92Å; V578-H580 PolarHBondContact O-N 3.42Å; H580-W666 AromaticContact CE1-CE2 3.78Å; H580-W666 AromaticContact CE1-CH2 4Å; H580-W666 AromaticContact CE1-CZ2 3.62Å; H580-I727 WeakPolarHBondContact NE2-CD1 3.15Å
581	E	75.1	Confident	79.8	Confident	34 Å²	34	30.8 Å²	30.8	16%	0.159	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	149.5	-174.2	-172.1	174.8	-163.1	0	0	109.4	G565 Y583	G565-E581 PolarHBondContact N-O 2.87Å; G565-E581 PolarHBondContact O-N 2.8Å; E581-Y583 HydrophobicContact CG-CD1 4.32Å; E581-Y583 HydrophobicContact CG-CE1 3.87Å; E581-Y583 WeakPolarHBondContact OE1-CE1 3.27Å; E581-Y583 WeakPolarHBondContact OE2-CE1 3.32Å; E581-Y583 PolarHBondContact OE2-OH 3.14Å
582	I	78.1	Confident	80	Confident	22 Å²	22	30 Å²	30	11%	0.113	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	115.4	173.3	-58.2	-176.7	0	0	0	107.5	G563 I564 I579 A588 A589 L594	G563-I582 CarbonylContact O-C 3.59Å; G563-I582 WeakPolarHBondContact O-CA 3.23Å; I564-I582 HydrophobicContact CG2-CG1 4.39Å; I579-I582 HydrophobicContact CG2-CD1 4.13Å; I579-I582 HydrophobicContact CG2-CG1 3.71Å; I582-A588 HydrophobicContact CG2-CB 4.23Å; I582-A589 HydrophobicContact CG2-CB 4.08Å; I582-L594 VanDerWaalsContact CD1-C 3.44Å; I582-L594 HydrophobicContact CD1-CB 3.88Å; I582-L594 VanDerWaalsContact CD1-O 3.27Å; I582-L594 WeakPolarHBondContact CD1-O 3.31Å
583	Y	73.9	Confident	80.5	Confident	38 Å²	38	31.5 Å²	31.5	15%	0.149	17%	0.174	C	C	.	.			trans	-77.1	133.6	-174.3	-64.8	-61.1	0	0	0	111.5	G563 E581 G586 A589	G563-Y583 PolarHBondContact O-N 3.41Å; E581-Y583 HydrophobicContact CG-CD1 4.32Å; E581-Y583 HydrophobicContact CG-CE1 3.87Å; E581-Y583 WeakPolarHBondContact OE1-CE1 3.27Å; E581-Y583 WeakPolarHBondContact OE2-CE1 3.32Å; E581-Y583 PolarHBondContact OE2-OH 3.14Å; Y583-G586 PolarHBondContact O-N 2.88Å; Y583-A589 VanDerWaalsContact O-CB 3.31Å; Y583-A589 WeakPolarHBondContact O-CB 3.27Å
584	P	67.5	Low	80.9	Confident	65 Å²	65	31 Å²	31	42%	0.422	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.1	148.6	173.4	26.3	-34.2	0	0	0	110.6	G586	P584-G586 PolarHBondContact O-N 2.95Å
585	N	70.5	Confident	80.9	Confident	124 Å²	124	33.9 Å²	33.9	66%	0.663	18%	0.18	S	C	*	.	T	Hydrogen-bonded Turn	trans	71.3	-11.8	-176.7	-46.6	-61.8	0	0	0	117.1	K590	N585-K590 WeakPolarHBondContact O-CE 3.34Å; N585-K590 PolarHBondContact O-NZ 2.84Å
586	G	73.3	Confident	80.8	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	17%	0.166	C	C	.	.	S	Bend	trans	-69.9	164.9	171.6	0	0	0	0	0	113.7	G561 Y583 P584 A588 A589 K590	G561-G586 WeakPolarHBondContact O-CA 3.44Å; Y583-G586 PolarHBondContact O-N 2.88Å; P584-G586 PolarHBondContact O-N 2.95Å; G586-A588 PolarHBondContact O-N 3.3Å; G586-A589 PolarHBondContact O-N 2.71Å; G586-K590 WeakPolarHBondContact O-CG 3.46Å; G586-K590 PolarHBondContact O-N 3.45Å
587	A	81.1	Confident	80.5	Confident	6 Å²	6	31.4 Å²	31.4	5%	0.05	17%	0.174	C	C	.	.	H	α-helix	trans	-63.8	-36.2	-175.3	0	0	0	0	0	113.4	I554 G561 L562 K590 D591	I554-A587 HydrophobicContact CG2-CB 4.14Å; G561-A587 PolarHBondContact O-N 3.14Å; L562-A587 PolarHBondContact O-N 3.35Å; A587-K590 WeakPolarHBondContact O-CB 3.48Å; A587-K590 PolarHBondContact O-N 3.17Å; A587-D591 VanDerWaalsContact O-CB 3.26Å; A587-D591 WeakPolarHBondContact O-CB 3.4Å; A587-D591 PolarHBondContact O-N 3.04Å
588	A	84.2	Confident	80.5	Confident	1 Å²	1	31.5 Å²	31.5	1%	0.008	17%	0.174	C	C	.	.	H	α-helix	trans	-65.7	-36.1	174.1	0	0	0	0	0	112.7	L562 I564 I582 G586 K590 G592 L594	L562-A588 WeakPolarHBondContact O-CB 3.31Å; L562-A588 PolarHBondContact O-N 3.07Å; I564-A588 HydrophobicContact CG2-CB 3.59Å; I582-A588 HydrophobicContact CG2-CB 4.23Å; G586-A588 PolarHBondContact O-N 3.3Å; A588-K590 VanDerWaalsContact C-N 3.35Å; A588-G592 PolarHBondContact O-N 2.87Å; A588-L594 HydrophobicContact CB-CD1 3.83Å
589	A	80.2	Confident	80.7	Confident	32 Å²	32	35 Å²	35	26%	0.264	19%	0.187	S	C	.	.	H	α-helix	trans	-72.6	-29.3	172.7	0	0	0	0	0	112.3	I582 Y583 G586	I582-A589 HydrophobicContact CG2-CB 4.08Å; Y583-A589 VanDerWaalsContact O-CB 3.31Å; Y583-A589 WeakPolarHBondContact O-CB 3.27Å; G586-A589 PolarHBondContact O-N 2.71Å
590	K	80.2	Confident	81	Confident	106 Å²	106	35 Å²	35	46%	0.461	19%	0.186	S	C	.	.	H	α-helix	trans	-74.2	-34.7	173.1	-73.8	164.3	170.5	156.7	0	112.5	C560 N585 G586 A587 A588	C560-K590 PolarHBondContact SG-NZ 3.11Å; N585-K590 WeakPolarHBondContact O-CE 3.34Å; N585-K590 PolarHBondContact O-NZ 2.84Å; G586-K590 WeakPolarHBondContact O-CG 3.46Å; G586-K590 PolarHBondContact O-N 3.45Å; A587-K590 WeakPolarHBondContact O-CB 3.48Å; A587-K590 PolarHBondContact O-N 3.17Å; A588-K590 VanDerWaalsContact C-N 3.35Å
591	D	85.5	Confident	81.7	Confident	42 Å²	42	35.4 Å²	35.4	23%	0.225	19%	0.19	C	C	.	.	H	α-helix	trans	-74.2	-39.7	175.1	-179.9	-79	0	0	0	112.6	I554 A587 R593	I554-D591 HydrophobicContact CG2-CB 4.24Å; A587-D591 VanDerWaalsContact O-CB 3.26Å; A587-D591 WeakPolarHBondContact O-CB 3.4Å; A587-D591 PolarHBondContact O-N 3.04Å; D591-R593 PolarHBondContact O-N 3.41Å; D591-R593 VanDerWaalsContact O-N 3.12Å; D591-R593 VanDerWaalsContact OD1-CB 3.25Å; D591-R593 WeakPolarHBondContact OD1-CB 3.36Å; D591-R593 WeakPolarHBondContact OD1-CG 3.36Å; D591-R593 IonicContact OD1-CZ 2.81Å; D591-R593 PolarHBondContact OD1-N 3.28Å; D591-R593 IonicContact OD1-NE 3.54Å; D591-R593 PolarHBondContact OD1-NE 2.93Å; D591-R593 IonicContact OD1-NH2 3.5Å; D591-R593 IonicContact OD2-CZ 2.71Å; D591-R593 IonicContact OD2-NE 3.96Å; D591-R593 PolarHBondContact OD2-NE 2.83Å; D591-R593 IonicContact OD2-NH2 3.07Å; D591-R593 PolarHBondContact OD2-NH2 3Å
592	G	83.9	Confident	82.6	Confident	30 Å²	30	36.8 Å²	36.8	31%	0.309	20%	0.196	S	C	.	.			trans	74.1	-6.9	171	0	0	0	0	0	116.3	A588	A588-G592 PolarHBondContact O-N 2.87Å
593	R	87.5	Confident	83.2	Confident	34 Å²	34	35.9 Å²	35.9	13%	0.128	19%	0.191	C	C	.	.			trans	-77.4	-35.6	-177.9	-62.1	178.3	-71	178.5	-12.2	113.2	A539 T540 R542 I544 S553 D591 R658	A539-R593 PolarHBondContact O-NH1 3.35Å; T540-R593 PolarHBondContact O-NH1 3.08Å; T540-R593 PolarHBondContact O-NH2 3.48Å; R542-R593 WeakPolarHBondContact O-CD 3.48Å; R542-R593 PolarHBondContact O-NH1 3.16Å; I544-R593 HydrophobicContact CD1-CB 4.14Å; S553-R593 PolarHBondContact O-NH2 3.41Å; D591-R593 PolarHBondContact O-N 3.41Å; D591-R593 VanDerWaalsContact O-N 3.12Å; D591-R593 VanDerWaalsContact OD1-CB 3.25Å; D591-R593 WeakPolarHBondContact OD1-CB 3.36Å; D591-R593 WeakPolarHBondContact OD1-CG 3.36Å; D591-R593 IonicContact OD1-CZ 2.81Å; D591-R593 PolarHBondContact OD1-N 3.28Å; D591-R593 IonicContact OD1-NE 3.54Å; D591-R593 PolarHBondContact OD1-NE 2.93Å; D591-R593 IonicContact OD1-NH2 3.5Å; D591-R593 IonicContact OD2-CZ 2.71Å; D591-R593 IonicContact OD2-NE 3.96Å; D591-R593 PolarHBondContact OD2-NE 2.83Å; D591-R593 IonicContact OD2-NH2 3.07Å; D591-R593 PolarHBondContact OD2-NH2 3Å; R593-R658 PolarHBondContact O-NH2 2.88Å
594	L	87.9	Confident	83.7	Confident	1 Å²	1	36.2 Å²	36.2	1%	0.005	20%	0.195	C	C	.	.			trans	-71.1	150.5	-179.4	-70.7	178.2	0	0	0	112.6	I544 I552 I554 I564 I579 I582 A588 D598 L654 I656	I544-L594 HydrophobicContact CD1-CD2 3.92Å; I552-L594 HydrophobicContact CD1-CD2 3.9Å; I552-L594 HydrophobicContact CD1-CG 4.19Å; I554-L594 HydrophobicContact CD1-CD1 3.47Å; I554-L594 VanDerWaalsContact CD1-CD1 3.47Å; I554-L594 HydrophobicContact CD1-CG 4.11Å; I564-L594 HydrophobicContact CG2-CD1 4.2Å; I579-L594 HydrophobicContact CD1-CB 4.23Å; I579-L594 HydrophobicContact CD1-CD1 3.88Å; I579-L594 HydrophobicContact CD1-CD2 3.77Å; I579-L594 HydrophobicContact CD1-CG 4.19Å; I582-L594 VanDerWaalsContact CD1-C 3.44Å; I582-L594 HydrophobicContact CD1-CB 3.88Å; I582-L594 VanDerWaalsContact CD1-O 3.27Å; I582-L594 WeakPolarHBondContact CD1-O 3.31Å; A588-L594 HydrophobicContact CB-CD1 3.83Å; L594-D598 WeakPolarHBondContact CA-OD2 3.36Å; L594-L654 HydrophobicContact CD1-CD1 4.36Å; L594-I656 HydrophobicContact CD2-CD1 3.74Å; L594-I656 HydrophobicContact CD2-CG1 3.77Å; L594-I656 HydrophobicContact CD2-CG2 4.29Å
595	R	82.6	Confident	84.4	Confident	81 Å²	81	44.1 Å²	44.1	31%	0.306	22%	0.217	S	C	.	.			trans	-143.7	152.2	179.2	-59.2	-175.6	-178.7	-176.1	-1.4	111.9	G597 D598 V692	R595-G597 PolarHBondContact O-N 2.89Å; R595-D598 PolarHBondContact N-OD2 2.83Å; R595-D598 VanDerWaalsContact O-CB 3.22Å; R595-D598 WeakPolarHBondContact O-CB 3.27Å; R595-D598 VanDerWaalsContact O-CG 3.3Å; R595-D598 PolarHBondContact O-N 3.03Å; R595-D598 VanDerWaalsContact O-N 3.1Å; R595-V692 HydrophobicContact CB-CG2 3.87Å; R595-V692 HydrophobicContact CG-CG1 4.29Å; R595-V692 HydrophobicContact CG-CG2 3.77Å
596	P	79.5	Confident	85.2	Confident	5 Å²	5	42.1 Å²	42.1	3%	0.032	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52	135.5	165.2	-26.7	36.6	0	0	0	111.9	I579 V692 Y724	I579-P596 CarbonylContact O-C 3.57Å; I579-P596 WeakPolarHBondContact O-CA 3.3Å; P596-V692 VanDerWaalsContact CD-CG2 3.48Å; P596-Y724 HydrophobicContact CB-CG 4.48Å
597	G	81	Confident	86	Confident	29 Å²	29	44.9 Å²	44.9	30%	0.299	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	91.4	-12.5	-173.3	0	0	0	0	0	115.2	I579 R595 P659	I579-G597 PolarHBondContact O-N 2.86Å; R595-G597 PolarHBondContact O-N 2.89Å; G597-P659 WeakPolarHBondContact O-CD 3.22Å
598	D	89.1	Confident	86.4	Confident	2 Å²	2	44.6 Å²	44.6	1%	0.011	22%	0.222	C	C	.	.			trans	-65.4	134.5	168.8	-75.1	-17.6	0	0	0	110.6	V578 I579 L594 R595 I656 R658	V578-D598 WeakPolarHBondContact CA-O 3.08Å; I579-D598 HydrophobicContact CD1-CB 4.22Å; I579-D598 PolarHBondContact N-O 2.92Å; L594-D598 WeakPolarHBondContact CA-OD2 3.36Å; R595-D598 PolarHBondContact N-OD2 2.83Å; R595-D598 VanDerWaalsContact O-CB 3.22Å; R595-D598 WeakPolarHBondContact O-CB 3.27Å; R595-D598 VanDerWaalsContact O-CG 3.3Å; R595-D598 PolarHBondContact O-N 3.03Å; R595-D598 VanDerWaalsContact O-N 3.1Å; D598-I656 HydrophobicContact CB-CG2 3.74Å; D598-R658 WeakPolarHBondContact OD1-CB 3.47Å; D598-R658 WeakPolarHBondContact OD1-CG 3.47Å; D598-R658 IonicContact OD1-CZ 2.71Å; D598-R658 IonicContact OD1-NE 3.73Å; D598-R658 PolarHBondContact OD1-NE 2.84Å; D598-R658 IonicContact OD1-NH2 3.93Å; D598-R658 PolarHBondContact OD1-NH2 3.43Å; D598-R658 IonicContact OD2-CZ 3.4Å; D598-R658 IonicContact OD2-NE 3.24Å; D598-R658 IonicContact OD2-NH2 3.32Å; D598-R658 PolarHBondContact OD2-NH2 3Å
599	R	90.8	Very high	86.5	Confident	79 Å²	79	47.3 Å²	47.3	30%	0.298	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	131.8	-178.2	-42.4	-167.7	-179.3	175.6	-1.5	110.9	I576 V578 I656 F657	I576-R599 HydrophobicContact CD1-CB 3.59Å; I576-R599 HydrophobicContact CD1-CG 4.35Å; I576-R599 HydrophobicContact CG1-CB 4.21Å; V578-R599 HydrophobicContact CG1-CG 4.37Å; V578-R599 HydrophobicContact CG2-CB 4.25Å; V578-R599 HydrophobicContact CG2-CG 3.87Å; R599-I656 CarbonylContact O-C 3.58Å; R599-I656 WeakPolarHBondContact O-CA 3.32Å; R599-F657 HydrophobicContact CB-CB 4.5Å; R599-F657 HydrophobicContact CG-CD1 4.45Å; R599-F657 PolarHBondContact N-O 2.87Å; R599-F657 PolarHBondContact O-N 3.18Å
600	I	92.5	Very high	86.5	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	104.8	-179.2	-50.1	174.6	0	0	0	108.4	I564 P577 I579 V603 L608 L620 L654 I656	I564-I600 HydrophobicContact CD1-CD1 3.87Å; P577-I600 HydrophobicContact CB-CB 4.49Å; P577-I600 PolarHBondContact O-N 2.86Å; I579-I600 HydrophobicContact CD1-CD1 4.35Å; I579-I600 HydrophobicContact CD1-CG1 4.37Å; I579-I600 HydrophobicContact CG1-CD1 4.01Å; I579-I600 HydrophobicContact CG1-CG1 4.17Å; I600-V603 HydrophobicContact CG2-CG2 3.81Å; I600-L608 HydrophobicContact CB-CD1 4.46Å; I600-L608 HydrophobicContact CG2-CD1 3.92Å; I600-L620 HydrophobicContact CD1-CD1 4.1Å; I600-L620 HydrophobicContact CD1-CD2 4.45Å; I600-L654 HydrophobicContact CG2-CD2 4.37Å; I600-I656 HydrophobicContact CB-CD1 4.43Å; I600-I656 HydrophobicContact CG1-CD1 3.94Å; I600-I656 HydrophobicContact CG2-CD1 4.46Å
601	S	91.6	Very high	86.8	Confident	12 Å²	12	43.7 Å²	43.7	8%	0.084	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	-31.8	-179.7	65	0	0	0	0	113.1	E549 L608 T655	E549-S601 WeakPolarHBondContact OE1-CB 3.36Å; E549-S601 PolarHBondContact OE1-OG 3.01Å; S601-L608 PolarHBondContact O-N 2.75Å; S601-T655 PolarHBondContact N-O 2.8Å; S601-T655 WeakPolarHBondContact OG-CB 3.32Å; S601-T655 WeakPolarHBondContact OG-CG2 3.39Å; S601-T655 PolarHBondContact OG-O 2.8Å
602	K	92.8	Very high	86.7	Confident	64 Å²	64	44.1 Å²	44.1	28%	0.278	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	152.5	-179.3	-43.2	179.3	-171.6	76.6	0	112.4	E549 I606 L654 T655	E549-K602 IonicContact OE1-NZ 3.03Å; E549-K602 PolarHBondContact OE1-NZ 3.42Å; E549-K602 IonicContact OE2-NZ 2.62Å; E549-K602 PolarHBondContact OE2-NZ 2.92Å; K602-I606 CarbonylContact C-O 3.41Å; K602-I606 WeakPolarHBondContact CA-O 3.44Å; K602-I606 WeakPolarHBondContact CB-O 3.39Å; K602-L654 WeakPolarHBondContact O-CA 3.15Å; K602-T655 PolarHBondContact O-N 3.34Å
603	V	90.9	Very high	86.7	Confident	2 Å²	2	42.9 Å²	42.9	1%	0.012	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	123.3	178.3	-177	0	0	0	0	109.6	I600 R605 I606 L608 L620 A623 L652 N653 L654	I600-V603 HydrophobicContact CG2-CG2 3.81Å; V603-R605 PolarHBondContact O-N 3.44Å; V603-I606 PolarHBondContact N-O 2.71Å; V603-I606 WeakPolarHBondContact O-CB 3.32Å; V603-I606 PolarHBondContact O-N 2.77Å; V603-L608 HydrophobicContact CG2-CD1 3.62Å; V603-L608 HydrophobicContact CG2-CD2 4.38Å; V603-L608 HydrophobicContact CG2-CG 4.02Å; V603-L620 HydrophobicContact CB-CD2 4.46Å; V603-L620 HydrophobicContact CG1-CD2 4.1Å; V603-L620 HydrophobicContact CG2-CD2 3.51Å; V603-L620 HydrophobicContact CG2-CG 3.91Å; V603-A623 HydrophobicContact CG1-CB 3.43Å; V603-A623 VanDerWaalsContact CG1-CB 3.43Å; V603-L652 HydrophobicContact CG1-CD1 4.02Å; V603-N653 CarbonylContact C-O 3.6Å; V603-N653 WeakPolarHBondContact CA-O 3.04Å; V603-L654 HydrophobicContact CB-CD2 4.29Å; V603-L654 HydrophobicContact CG1-CD2 4.01Å; V603-L654 HydrophobicContact CG2-CD2 3.78Å
604	N	84.7	Confident	86.3	Confident	46 Å²	46	45.5 Å²	45.5	25%	0.246	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	44.9	40.3	-177.9	-71.6	-5.9	0	0	0	113.2	I606 A623 N653	N604-I606 VanDerWaalsContact C-N 3.34Å; N604-I606 PolarHBondContact O-N 3.5Å; N604-A623 HydrophobicContact CB-CB 4.42Å; N604-A623 PolarHBondContact ND2-O 2.9Å; N604-N653 PolarHBondContact N-O 3.32Å; N604-N653 PolarHBondContact OD1-N 3.21Å
605	R	83.2	Confident	86	Confident	230 Å²	230	49.6 Å²	49.6	87%	0.868	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.9	-10.3	-174.7	-48.3	165.7	-174	-112.2	-3.4	116.8	V603	V603-R605 PolarHBondContact O-N 3.44Å
606	I	87	Confident	86.2	Confident	83 Å²	83	45.7 Å²	45.7	43%	0.426	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	130.9	174.6	-54.1	177.3	0	0	0	109.4	K602 V603 N604 K619	K602-I606 CarbonylContact C-O 3.41Å; K602-I606 WeakPolarHBondContact CA-O 3.44Å; K602-I606 WeakPolarHBondContact CB-O 3.39Å; V603-I606 PolarHBondContact N-O 2.71Å; V603-I606 WeakPolarHBondContact O-CB 3.32Å; V603-I606 PolarHBondContact O-N 2.77Å; N604-I606 VanDerWaalsContact C-N 3.34Å; N604-I606 PolarHBondContact O-N 3.5Å; I606-K619 HydrophobicContact CG2-CD 4.15Å
607	S	89.2	Confident	86.4	Confident	57 Å²	57	46 Å²	46	40%	0.399	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	138	172.1	-176.5	0	0	0	0	111.3	A609	S607-A609 PolarHBondContact OG-N 2.97Å; S607-A609 VanDerWaalsContact OG-N 3.17Å
608	L	89.2	Confident	86.4	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	26%	0.255	C	S	.	.			trans	-101.4	-0.8	167.6	-54.5	-169.3	0	0	0	112.7	P577 I600 S601 V603 G610 V611 A616 K619 L620	P577-L608 HydrophobicContact CG-CB 4.23Å; P577-L608 HydrophobicContact CG-CD1 3.88Å; I600-L608 HydrophobicContact CB-CD1 4.46Å; I600-L608 HydrophobicContact CG2-CD1 3.92Å; S601-L608 PolarHBondContact O-N 2.75Å; V603-L608 HydrophobicContact CG2-CD1 3.62Å; V603-L608 HydrophobicContact CG2-CD2 4.38Å; V603-L608 HydrophobicContact CG2-CG 4.02Å; L608-G610 PolarHBondContact O-N 3.43Å; L608-V611 PolarHBondContact O-N 3.45Å; L608-A616 HydrophobicContact CB-CB 4.48Å; L608-A616 HydrophobicContact CD1-CB 4.33Å; L608-A616 HydrophobicContact CD2-CB 4.29Å; L608-K619 HydrophobicContact CD2-CB 3.95Å; L608-K619 HydrophobicContact CD2-CD 4.13Å; L608-L620 HydrophobicContact CD1-CD1 4.1Å; L608-L620 HydrophobicContact CD1-CG 4.17Å
609	A	86.4	Confident	86.2	Confident	59 Å²	59	51 Å²	51	49%	0.488	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.7	123.8	176	0	0	0	0	0	112	I576 S607 V611	I576-A609 HydrophobicContact CG2-CB 3.97Å; S607-A609 PolarHBondContact OG-N 2.97Å; S607-A609 VanDerWaalsContact OG-N 3.17Å; A609-V611 VanDerWaalsContact C-N 3.3Å
610	G	82	Confident	85.9	Confident	48 Å²	48	47.3 Å²	47.3	50%	0.495	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.8	15	-176.5	0	0	0	0	0	114.4	L608	L608-G610 PolarHBondContact O-N 3.43Å
611	V	84.6	Confident	85.3	Confident	14 Å²	14	50.2 Å²	50.2	9%	0.085	27%	0.267	C	S	.	.			trans	-98.2	136.2	178	-177.7	0	0	0	0	109.9	C570 L608 A609 E615 A616 K619	C570-V611 PolarHBondContact N-O 2.89Å; C570-V611 VanDerWaalsContact N-O 3.12Å; C570-V611 VanDerWaalsContact SG-C 3.54Å; L608-V611 PolarHBondContact O-N 3.45Å; A609-V611 VanDerWaalsContact C-N 3.3Å; V611-E615 HydrophobicContact CG1-CB 3.83Å; V611-E615 HydrophobicContact CG1-CG 4.01Å; V611-A616 HydrophobicContact CB-CB 4.3Å; V611-A616 HydrophobicContact CG1-CB 3.96Å; V611-K619 HydrophobicContact CG1-CD 4.2Å
612	P	83.6	Confident	84.6	Confident	51 Å²	51	54.7 Å²	54.7	33%	0.331	29%	0.288	S	S	.	.			trans	-57.3	146.3	173.5	-25.2	34.2	0	0	0	112.1	C570 E571 L614 E615 A616	C570-P612 VanDerWaalsContact SG-CA 3.58Å; C570-P612 VanDerWaalsContact SG-N 3.38Å; E571-P612 WeakPolarHBondContact OE2-CA 3.36Å; P612-L614 PolarHBondContact O-N 3.29Å; P612-E615 HydrophobicContact CB-CB 4.37Å; P612-E615 PolarHBondContact O-N 3.44Å; P612-E615 VanDerWaalsContact O-N 3.07Å; P612-A616 WeakPolarHBondContact O-CB 3.41Å; P612-A616 PolarHBondContact O-N 3.06Å
613	F	83.5	Confident	84.1	Confident	4 Å²	4	52.1 Å²	52.1	2%	0.018	28%	0.278	C	S	.	.	H	α-helix	trans	-56	-47.5	-170.4	-174.1	-125.6	0	0	0	113.1	C566 G568 E571 E615 A616 M617 I789	C566-F613 HydrophobicContact CB-CE2 4.14Å; C566-F613 HydrophobicContact CB-CZ 4.35Å; C566-F613 WeakPolarHBondContact O-CZ 3.24Å; G568-F613 VanDerWaalsContact O-CB 3.27Å; G568-F613 WeakPolarHBondContact O-CB 3.4Å; G568-F613 VanDerWaalsContact O-CD2 3.23Å; G568-F613 WeakPolarHBondContact O-CD2 3.49Å; G568-F613 VanDerWaalsContact O-CG 3.27Å; G568-F613 WeakPolarHBondContact O-CG 3.46Å; E571-F613 VanDerWaalsContact CD-N 3.27Å; E571-F613 VanDerWaalsContact OE1-CB 3.3Å; E571-F613 WeakPolarHBondContact OE1-CB 3.21Å; E571-F613 PolarHBondContact OE1-N 3.25Å; E571-F613 PolarHBondContact OE2-N 3.09Å; F613-E615 VanDerWaalsContact C-N 3.35Å; F613-E615 PolarHBondContact O-N 3.17Å; F613-A616 PolarHBondContact O-N 3.46Å; F613-M617 HydrophobicContact CD2-CE 4.14Å; F613-M617 HydrophobicContact CD2-CG 4.45Å; F613-M617 HydrophobicContact CE1-CG 4.44Å; F613-M617 HydrophobicContact CE2-CE 3.66Å; F613-M617 HydrophobicContact CE2-CG 4.09Å; F613-M617 HydrophobicContact CE2-SD 4.09Å; F613-M617 HydrophobicContact CZ-CE 4.37Å; F613-M617 HydrophobicContact CZ-CG 4.06Å; F613-M617 HydrophobicContact CZ-SD 4.21Å; F613-M617 WeakPolarHBondContact O-CG 3.34Å; F613-M617 PolarHBondContact O-N 2.81Å; F613-I789 HydrophobicContact CD1-CD1 3.79Å; F613-I789 HydrophobicContact CD1-CG1 4.19Å; F613-I789 HydrophobicContact CE1-CD1 3.22Å; F613-I789 HydrophobicContact CE1-CG1 3.76Å; F613-I789 HydrophobicContact CZ-CD1 3.95Å
614	L	79.7	Confident	83.6	Confident	89 Å²	89	52.4 Å²	52.4	47%	0.466	28%	0.279	S	S	.	.	H	α-helix	trans	-62.7	-40.7	178.8	-178.2	61	0	0	0	112	P612 M617 N618	P612-L614 PolarHBondContact O-N 3.29Å; L614-M617 PolarHBondContact O-N 2.93Å; L614-N618 WeakPolarHBondContact O-CB 3.37Å; L614-N618 PolarHBondContact O-N 3.05Å; L614-N618 PolarHBondContact O-ND2 3.38Å
615	E	82.6	Confident	83.2	Confident	86 Å²	86	52.6 Å²	52.6	40%	0.402	28%	0.28	S	S	.	.	H	α-helix	trans	-69.9	-36.7	177.9	-165.7	-160.4	133.1	0	0	111.5	V611 P612 F613 N618 K619	V611-E615 HydrophobicContact CG1-CB 3.83Å; V611-E615 HydrophobicContact CG1-CG 4.01Å; P612-E615 HydrophobicContact CB-CB 4.37Å; P612-E615 PolarHBondContact O-N 3.44Å; P612-E615 VanDerWaalsContact O-N 3.07Å; F613-E615 VanDerWaalsContact C-N 3.35Å; F613-E615 PolarHBondContact O-N 3.17Å; E615-N618 PolarHBondContact O-N 3.35Å; E615-K619 WeakPolarHBondContact O-CB 3.49Å; E615-K619 WeakPolarHBondContact O-CG 3.42Å; E615-K619 PolarHBondContact O-N 3.07Å; E615-K619 WeakPolarHBondContact OE1-CE 3.43Å; E615-K619 IonicContact OE1-NZ 2.75Å; E615-K619 PolarHBondContact OE1-NZ 3.48Å
616	A	85.7	Confident	82.7	Confident	0 Å²	0	45 Å²	45	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-66.6	-38.4	174.2	0	0	0	0	0	112.1	P577 L608 V611 P612 F613 K619 L620	P577-A616 HydrophobicContact CG-CB 3.65Å; L608-A616 HydrophobicContact CB-CB 4.48Å; L608-A616 HydrophobicContact CD1-CB 4.33Å; L608-A616 HydrophobicContact CD2-CB 4.29Å; V611-A616 HydrophobicContact CB-CB 4.3Å; V611-A616 HydrophobicContact CG1-CB 3.96Å; P612-A616 WeakPolarHBondContact O-CB 3.41Å; P612-A616 PolarHBondContact O-N 3.06Å; F613-A616 PolarHBondContact O-N 3.46Å; A616-K619 PolarHBondContact O-N 2.85Å; A616-L620 PolarHBondContact O-N 3.28Å
617	M	84.3	Confident	81.9	Confident	12 Å²	12	44.5 Å²	44.5	6%	0.059	26%	0.257	C	S	.	.	H	α-helix	trans	-66.4	-41.7	172	-68.4	-53	100.7	0	0	111.5	C566 P577 F613 L614 K619 L620 Q621 I789	C566-M617 HydrophobicContact CB-CE 3.77Å; C566-M617 HydrophobicContact CB-SD 3.81Å; P577-M617 HydrophobicContact CB-CE 3.74Å; P577-M617 HydrophobicContact CG-CE 3.92Å; F613-M617 HydrophobicContact CD2-CE 4.14Å; F613-M617 HydrophobicContact CD2-CG 4.45Å; F613-M617 HydrophobicContact CE1-CG 4.44Å; F613-M617 HydrophobicContact CE2-CE 3.66Å; F613-M617 HydrophobicContact CE2-CG 4.09Å; F613-M617 HydrophobicContact CE2-SD 4.09Å; F613-M617 HydrophobicContact CZ-CE 4.37Å; F613-M617 HydrophobicContact CZ-CG 4.06Å; F613-M617 HydrophobicContact CZ-SD 4.21Å; F613-M617 WeakPolarHBondContact O-CG 3.34Å; F613-M617 PolarHBondContact O-N 2.81Å; L614-M617 PolarHBondContact O-N 2.93Å; M617-K619 VanDerWaalsContact C-N 3.34Å; M617-K619 PolarHBondContact O-N 2.94Å; M617-L620 HydrophobicContact CE-CD1 3.54Å; M617-L620 WeakPolarHBondContact O-CB 3.41Å; M617-L620 PolarHBondContact O-N 3.2Å; M617-L620 HydrophobicContact SD-CD1 4.15Å; M617-Q621 WeakPolarHBondContact O-CB 3.39Å; M617-Q621 PolarHBondContact O-N 3.47Å; M617-I789 HydrophobicContact CG-CD1 3.99Å
618	N	79.9	Confident	80.7	Confident	75 Å²	75	42.8 Å²	42.8	40%	0.401	25%	0.245	S	C	.	.	H	α-helix	trans	-61.2	-41.6	173.8	-70.4	-16.5	0	0	0	111.6	L614 E615 Q621 M622	L614-N618 WeakPolarHBondContact O-CB 3.37Å; L614-N618 PolarHBondContact O-N 3.05Å; L614-N618 PolarHBondContact O-ND2 3.38Å; E615-N618 PolarHBondContact O-N 3.35Å; N618-Q621 PolarHBondContact O-N 3.26Å; N618-M622 WeakPolarHBondContact O-CG 3.26Å; N618-M622 PolarHBondContact O-N 2.9Å
619	K	85.3	Confident	79.1	Confident	59 Å²	59	46.2 Å²	46.2	26%	0.257	27%	0.269	S	S	.	.	H	α-helix	trans	-61.8	-42	174.3	-78.7	165.2	169.3	171.8	0	112.3	I606 L608 V611 E615 A616 M617 A623	I606-K619 HydrophobicContact CG2-CD 4.15Å; L608-K619 HydrophobicContact CD2-CB 3.95Å; L608-K619 HydrophobicContact CD2-CD 4.13Å; V611-K619 HydrophobicContact CG1-CD 4.2Å; E615-K619 WeakPolarHBondContact O-CB 3.49Å; E615-K619 WeakPolarHBondContact O-CG 3.42Å; E615-K619 PolarHBondContact O-N 3.07Å; E615-K619 WeakPolarHBondContact OE1-CE 3.43Å; E615-K619 IonicContact OE1-NZ 2.75Å; E615-K619 PolarHBondContact OE1-NZ 3.48Å; A616-K619 PolarHBondContact O-N 2.85Å; M617-K619 VanDerWaalsContact C-N 3.34Å; M617-K619 PolarHBondContact O-N 2.94Å; K619-A623 WeakPolarHBondContact O-CB 3.28Å; K619-A623 PolarHBondContact O-N 3.25Å
620	L	85.1	Confident	77.3	Confident	2 Å²	2	49.7 Å²	49.7	1%	0.01	28%	0.276	C	S	.	.	H	α-helix	trans	-60.8	-45.8	171.3	-87	159.8	0	0	0	112.3	I600 V603 L608 A616 M617 A623 Y624 L654	I600-L620 HydrophobicContact CD1-CD1 4.1Å; I600-L620 HydrophobicContact CD1-CD2 4.45Å; V603-L620 HydrophobicContact CB-CD2 4.46Å; V603-L620 HydrophobicContact CG1-CD2 4.1Å; V603-L620 HydrophobicContact CG2-CD2 3.51Å; V603-L620 HydrophobicContact CG2-CG 3.91Å; L608-L620 HydrophobicContact CD1-CD1 4.1Å; L608-L620 HydrophobicContact CD1-CG 4.17Å; A616-L620 PolarHBondContact O-N 3.28Å; M617-L620 HydrophobicContact CE-CD1 3.54Å; M617-L620 WeakPolarHBondContact O-CB 3.41Å; M617-L620 PolarHBondContact O-N 3.2Å; M617-L620 HydrophobicContact SD-CD1 4.15Å; L620-A623 PolarHBondContact O-N 2.86Å; L620-Y624 PolarHBondContact O-N 3.34Å; L620-L654 HydrophobicContact CD2-CD2 4Å
621	Q	78.9	Confident	75.7	Confident	61 Å²	61	51 Å²	51	29%	0.285	27%	0.272	S	S	.	.	H	α-helix	trans	-62.7	-50.8	179.4	-175.5	177.8	16.3	0	0	111.8	M617 N618 A623 Y624 I625 L796	M617-Q621 WeakPolarHBondContact O-CB 3.39Å; M617-Q621 PolarHBondContact O-N 3.47Å; N618-Q621 PolarHBondContact O-N 3.26Å; Q621-A623 VanDerWaalsContact C-N 3.29Å; Q621-A623 PolarHBondContact O-N 3.31Å; Q621-Y624 PolarHBondContact O-N 2.89Å; Q621-Y624 VanDerWaalsContact O-N 3.12Å; Q621-I625 HydrophobicContact CG-CD1 3.67Å; Q621-I625 HydrophobicContact CG-CG1 4.28Å; Q621-I625 WeakPolarHBondContact O-CG1 3.3Å; Q621-I625 PolarHBondContact O-N 2.95Å; Q621-L796 HydrophobicContact CB-CD2 3.58Å; Q621-L796 HydrophobicContact CG-CD2 3.38Å
622	M	78.1	Confident	73.6	Confident	107 Å²	107	57 Å²	57	53%	0.527	30%	0.297	S	S	.	.	H	α-helix	trans	-63.9	-36.4	-179.8	-65.2	-54.7	127.1	0	0	111.5	N618 Y624 I625 S626	N618-M622 WeakPolarHBondContact O-CG 3.26Å; N618-M622 PolarHBondContact O-N 2.9Å; M622-Y624 VanDerWaalsContact C-N 3.34Å; M622-Y624 PolarHBondContact O-N 3.21Å; M622-I625 HydrophobicContact CE-CD1 4.47Å; M622-S626 WeakPolarHBondContact O-CB 3.49Å; M622-S626 PolarHBondContact O-N 3.03Å
623	A	82.9	Confident	71.5	Confident	9 Å²	9	61.7 Å²	61.7	7%	0.074	32%	0.318	C	S	.	.	H	α-helix	trans	-63.9	-34.9	173.6	0	0	0	0	0	113.4	V603 N604 K619 L620 Q621 L652	V603-A623 HydrophobicContact CG1-CB 3.43Å; V603-A623 VanDerWaalsContact CG1-CB 3.43Å; N604-A623 HydrophobicContact CB-CB 4.42Å; N604-A623 PolarHBondContact ND2-O 2.9Å; K619-A623 WeakPolarHBondContact O-CB 3.28Å; K619-A623 PolarHBondContact O-N 3.25Å; L620-A623 PolarHBondContact O-N 2.86Å; Q621-A623 VanDerWaalsContact C-N 3.29Å; Q621-A623 PolarHBondContact O-N 3.31Å; A623-L652 HydrophobicContact CB-CD1 3.76Å
624	Y	79.5	Confident	69.3	Low	8 Å²	8	69.4 Å²	69.4	3%	0.031	36%	0.359	C	S	.	.	H	α-helix	trans	-72.9	-51.4	173.5	-168.1	-89.7	0	0	0	111.7	I556 N557 C560 G561 L562 L620 Q621 M622 K627 S628 L652 F797	I556-Y624 HydrophobicContact CB-CE2 4.31Å; I556-Y624 HydrophobicContact CD1-CD2 4.47Å; I556-Y624 HydrophobicContact CG1-CD2 4.12Å; I556-Y624 HydrophobicContact CG1-CE2 3.81Å; I556-Y624 HydrophobicContact CG2-CE1 4.26Å; I556-Y624 HydrophobicContact CG2-CE2 4.07Å; N557-Y624 PolarHBondContact N-OH 2.86Å; N557-Y624 PolarHBondContact O-OH 2.85Å; C560-Y624 PolarHBondContact O-OH 2.86Å; G561-Y624 WeakPolarHBondContact CA-OH 3.44Å; L562-Y624 HydrophobicContact CB-CD2 4.04Å; L562-Y624 HydrophobicContact CB-CE2 4.05Å; L620-Y624 PolarHBondContact O-N 3.34Å; Q621-Y624 PolarHBondContact O-N 2.89Å; Q621-Y624 VanDerWaalsContact O-N 3.12Å; M622-Y624 VanDerWaalsContact C-N 3.34Å; M622-Y624 PolarHBondContact O-N 3.21Å; Y624-K627 PolarHBondContact O-N 3.39Å; Y624-S628 PolarHBondContact O-N 2.88Å; Y624-L652 HydrophobicContact CD2-CD2 4.38Å; Y624-F797 HydrophobicContact CD2-CE1 4.39Å; Y624-F797 HydrophobicContact CG-CE1 4.23Å
625	I	75.7	Confident	67.4	Low	51 Å²	51	70.3 Å²	70.3	26%	0.262	37%	0.373	S	S	.	.	H	α-helix	trans	-62.4	-47.3	-177.1	-66.9	178	0	0	0	110.9	Q621 M622 K627 S628 S629 V803	Q621-I625 HydrophobicContact CG-CD1 3.67Å; Q621-I625 HydrophobicContact CG-CG1 4.28Å; Q621-I625 WeakPolarHBondContact O-CG1 3.3Å; Q621-I625 PolarHBondContact O-N 2.95Å; M622-I625 HydrophobicContact CE-CD1 4.47Å; I625-K627 PolarHBondContact O-N 2.73Å; I625-K627 VanDerWaalsContact O-N 3.08Å; I625-S628 PolarHBondContact O-N 3.24Å; I625-S629 PolarHBondContact O-N 3.41Å; I625-S629 PolarHBondContact O-OG 2.7Å; I625-S629 VanDerWaalsContact O-OG 3.11Å; I625-V803 HydrophobicContact CD1-CG1 4.34Å; I625-V803 HydrophobicContact CG1-CG1 4.02Å
626	S	72.8	Confident	65.6	Low	69 Å²	69	74.2 Å²	74.2	48%	0.483	40%	0.397	S	S	.	.	H	α-helix	trans	-58	-24.5	179.9	177.3	0	0	0	0	113.7	M622 M630	M622-S626 WeakPolarHBondContact O-CB 3.49Å; M622-S626 PolarHBondContact O-N 3.03Å; S626-M630 WeakPolarHBondContact O-CG 3.49Å
627	K	71.1	Confident	63.6	Low	73 Å²	73	81.6 Å²	81.6	32%	0.317	44%	0.436	S	S	.	.	H	α-helix	trans	-96.7	-25.2	176.9	-78.4	-65.1	-167	-179.4	0	113.1	I556 Y624 I625 M630 S650	I556-K627 HydrophobicContact CD1-CB 3.24Å; I556-K627 HydrophobicContact CD1-CG 4.13Å; Y624-K627 PolarHBondContact O-N 3.39Å; I625-K627 PolarHBondContact O-N 2.73Å; I625-K627 VanDerWaalsContact O-N 3.08Å; K627-M630 HydrophobicContact CD-SD 4.47Å; K627-S650 WeakPolarHBondContact O-CB 3.47Å; K627-S650 PolarHBondContact O-OG 3.33Å
628	S	62.9	Low	61.6	Low	22 Å²	22	90.2 Å²	90.2	15%	0.154	48%	0.477	C	S	.	.	H	α-helix	trans	-71.7	-36.7	170.2	177.7	0	0	0	0	112.4	N558 Y624 I625	N558-S628 PolarHBondContact OD1-OG 2.74Å; Y624-S628 PolarHBondContact O-N 2.88Å; I625-S628 PolarHBondContact O-N 3.24Å
629	S	55.6	Low	59.6	Low	72 Å²	72	93.6 Å²	93.6	50%	0.503	50%	0.495	S	S	.	.	G	3₁₀ helix	trans	-76.6	-21.4	-177.1	59.8	0	0	0	0	114.9	I625 I631 K632	I625-S629 PolarHBondContact O-N 3.41Å; I625-S629 PolarHBondContact O-OG 2.7Å; I625-S629 VanDerWaalsContact O-OG 3.11Å; S629-I631 PolarHBondContact O-N 2.75Å; S629-K632 PolarHBondContact O-N 2.8Å
630	M	48.3	Very low	57.2	Low	131 Å²	131	99.9 Å²	99.9	65%	0.645	53%	0.525	S	S	*	.	G	3₁₀ helix	trans	-65.5	-14.7	174.1	-72.4	-173.5	75.3	0	0	113.6	S626 K627 K632	S626-M630 WeakPolarHBondContact O-CG 3.49Å; K627-M630 HydrophobicContact CD-SD 4.47Å; M630-K632 PolarHBondContact O-N 3.25Å
631	I	48.9	Very low	54.7	Low	77 Å²	77	106.6 Å²	106.6	40%	0.395	56%	0.561	S	S	.	*	G	3₁₀ helix	trans	-89.6	24.7	-177.2	-40.7	173.6	0	0	0	110.9	S629	S629-I631 PolarHBondContact O-N 2.75Å
632	K	40.4	Very low	52.6	Low	140 Å²	140	111.3 Å²	111.3	61%	0.609	59%	0.586	S	S	*	*			trans	-149.4	34.5	-166.8	-114.4	-171.9	170.5	-63.3	0	116.7	S629 M630	S629-K632 PolarHBondContact O-N 2.8Å; M630-K632 PolarHBondContact O-N 3.25Å
633	L	39.6	Very low	50.5	Low	149 Å²	149	112 Å²	112	78%	0.78	60%	0.602	S	S	*	*			trans	-114	164.9	158	-71.1	158.8	0	0	0	108
634	D	37.6	Very low	48.3	Very low	165 Å²	165	119.9 Å²	119.9	88%	0.882	64%	0.642	S	S	*	*			trans	68.8	70.1	178.2	-48.9	-14.8	0	0	0	115.9
635	S	40.6	Very low	46	Very low	109 Å²	109	126.7 Å²	126.7	76%	0.762	68%	0.678	S	S	*	*			trans	-156.8	47	165.3	78.4	0	0	0	0	115.5
636	D	43.4	Very low	44	Very low	168 Å²	168	131.3 Å²	131.3	90%	0.898	70%	0.703	S	S	*	*			trans	-119.5	-5	175	-77.4	-43.4	0	0	0	114.3
637	D	45.3	Very low	42.4	Very low	155 Å²	155	137.6 Å²	137.6	83%	0.829	73%	0.725	S	S	*	*			trans	-95.8	120.4	179.4	-80.2	-54.5	0	0	0	112.7	N639	D637-N639 PolarHBondContact O-N 2.85Å
638	E	42.1	Very low	41.6	Very low	193 Å²	193	142.3 Å²	142.3	90%	0.902	75%	0.748	S	S	*	*			trans	-73.6	91.4	172.5	-69.3	-170.4	170.5	0	0	111.5
639	N	37.5	Very low	41.5	Very low	146 Å²	146	146.7 Å²	146.7	78%	0.781	77%	0.766	S	S	*	*			trans	-139.5	98.7	163.3	-86.9	-77.2	0	0	0	111.6	D637 N641	D637-N639 PolarHBondContact O-N 2.85Å; N639-N641 PolarHBondContact O-N 2.98Å
640	E	35.8	Very low	42.5	Very low	191 Å²	191	144.1 Å²	144.1	89%	0.893	75%	0.748	S	S	*	*			trans	-67	99	163.7	-66.7	-169.9	147.6	0	0	109.6
641	N	32.2	Very low	44.2	Very low	143 Å²	143	141.8 Å²	141.8	77%	0.765	73%	0.732	S	S	*	*	S	Bend	trans	167.7	144.8	135.2	-95	-71.1	0	0	0	112.5	N639	N639-N641 PolarHBondContact O-N 2.98Å
642	I	34.2	Very low	46	Very low	160 Å²	160	138.1 Å²	138.1	82%	0.821	71%	0.714	S	S	*	*			trans	61.9	79.6	168.7	-48.7	160.5	0	0	0	115
643	S	35	Very low	48.4	Very low	121 Å²	121	133.6 Å²	133.6	85%	0.846	70%	0.696	S	S	*	*			trans	-156.3	61.8	158.9	-82.2	0	0	0	0	111.7
644	L	36.8	Very low	50.9	Low	175 Å²	175	126.5 Å²	126.5	92%	0.916	66%	0.659	S	S	*	*			trans	-109.9	17.9	-178.7	-93.6	169.1	0	0	0	114
645	L	30.5	Very low	53.6	Low	150 Å²	150	119.5 Å²	119.5	79%	0.785	62%	0.622	S	S	*	*	S	Bend	trans	-123.1	146.1	172.6	-78.5	79.7	0	0	0	109.6
646	N	32.5	Very low	56.1	Low	149 Å²	149	114.3 Å²	114.3	80%	0.797	59%	0.586	S	S	*	*			trans	67.7	52.7	170.6	-55.8	-0.4	0	0	0	117.7	E648	N646-E648 PolarHBondContact O-N 2.83Å
647	Q	40.9	Very low	58.4	Low	200 Å²	200	109.3 Å²	109.3	94%	0.935	56%	0.556	S	S	*	*			trans	-75.7	96.7	147.5	-76.9	-170.4	-10.5	0	0	109	Q649	Q647-Q649 PolarHBondContact O-N 2.65Å; Q647-Q649 VanDerWaalsContact O-N 3.09Å
648	E	54.4	Low	60.4	Low	172 Å²	172	103.3 Å²	103.3	80%	0.804	52%	0.522	S	S	*	.			trans	-65.8	107.8	176.9	-71.2	-165.2	168	0	0	111	N646 S650	N646-E648 PolarHBondContact O-N 2.83Å; E648-S650 PolarHBondContact O-N 2.98Å
649	Q	61	Low	62.4	Low	114 Å²	114	96 Å²	96	53%	0.533	49%	0.491	S	S	.	.			trans	-67.3	118.4	176.3	-172.2	156.4	14.6	0	0	109.9	Q647 Y651	Q647-Q649 PolarHBondContact O-N 2.65Å; Q647-Q649 VanDerWaalsContact O-N 3.09Å; Q649-Y651 HydrophobicContact CB-CE2 4.43Å; Q649-Y651 WeakPolarHBondContact O-CD2 3.39Å; Q649-Y651 WeakPolarHBondContact O-CE2 3.2Å
650	S	74.9	Confident	64.2	Low	18 Å²	18	94.1 Å²	94.1	13%	0.126	49%	0.485	C	S	.	.			trans	-75.9	140.6	-179.2	-77.4	0	0	0	0	112	I556 K627 E648	I556-S650 WeakPolarHBondContact CB-O 3.28Å; I556-S650 PolarHBondContact N-O 2.87Å; K627-S650 WeakPolarHBondContact O-CB 3.47Å; K627-S650 PolarHBondContact O-OG 3.33Å; E648-S650 PolarHBondContact O-N 2.98Å
651	Y	84.2	Confident	65.5	Low	82 Å²	82	92.1 Å²	92.1	32%	0.322	48%	0.476	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	147.6	178.4	-64.5	-91.8	0	0	0	111.6	T540 I554 A555 Q649	T540-Y651 HydrophobicContact CG2-CD1 4.37Å; T540-Y651 HydrophobicContact CG2-CE1 3.82Å; I554-Y651 CarbonylContact O-C 3.6Å; I554-Y651 WeakPolarHBondContact O-CA 3.45Å; A555-Y651 HydrophobicContact CB-CD1 4.13Å; A555-Y651 HydrophobicContact CB-CE1 3.86Å; Q649-Y651 HydrophobicContact CB-CE2 4.43Å; Q649-Y651 WeakPolarHBondContact O-CD2 3.39Å; Q649-Y651 WeakPolarHBondContact O-CE2 3.2Å
652	L	87.5	Confident	66.6	Low	0 Å²	0	94 Å²	94	0%	0	48%	0.48	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	120.2	164	-175.2	69.9	0	0	0	108.6	S553 I554 I556 L562 V603 A623 Y624 L654	S553-L652 WeakPolarHBondContact CA-O 3.32Å; I554-L652 PolarHBondContact N-O 2.68Å; I554-L652 PolarHBondContact O-N 3.47Å; I556-L652 HydrophobicContact CD1-CB 3.98Å; I556-L652 HydrophobicContact CG1-CB 4.07Å; L562-L652 HydrophobicContact CD1-CD2 3.8Å; L562-L652 HydrophobicContact CD2-CD2 3.55Å; L562-L652 HydrophobicContact CG-CD2 4.29Å; V603-L652 HydrophobicContact CG1-CD1 4.02Å; A623-L652 HydrophobicContact CB-CD1 3.76Å; Y624-L652 HydrophobicContact CD2-CD2 4.38Å; L652-L654 HydrophobicContact CD2-CD1 4.34Å; L652-L654 HydrophobicContact CD2-CD2 3.85Å; L652-L654 HydrophobicContact CD2-CG 4.17Å; L652-L654 HydrophobicContact CG-CD2 4.03Å; L652-L654 HydrophobicContact CG-CG 4.25Å
653	N	90.8	Very high	67.5	Low	46 Å²	46	90.2 Å²	90.2	25%	0.246	47%	0.468	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	124.1	175.3	-77.9	26	0	0	0	110.1	E551 I552 S553 V603 N604	E551-N653 PolarHBondContact OE1-ND2 2.8Å; I552-N653 CarbonylContact O-C 3.58Å; I552-N653 WeakPolarHBondContact O-CA 3.36Å; S553-N653 PolarHBondContact OG-OD1 2.85Å; V603-N653 CarbonylContact C-O 3.6Å; V603-N653 WeakPolarHBondContact CA-O 3.04Å; N604-N653 PolarHBondContact N-O 3.32Å; N604-N653 PolarHBondContact OD1-N 3.21Å
654	L	92.5	Very high	68.7	Low	0 Å²	0	87.1 Å²	87.1	0%	0	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	134.8	176.8	-58.9	177.4	0	0	0	109.5	E551 I552 I554 L594 I600 K602 V603 L620 L652 I656	E551-L654 WeakPolarHBondContact CA-O 3.5Å; I552-L654 HydrophobicContact CG1-CB 4.06Å; I552-L654 PolarHBondContact N-O 3.37Å; I552-L654 PolarHBondContact O-N 3.47Å; I554-L654 HydrophobicContact CD1-CD1 3.87Å; L594-L654 HydrophobicContact CD1-CD1 4.36Å; I600-L654 HydrophobicContact CG2-CD2 4.37Å; K602-L654 WeakPolarHBondContact O-CA 3.15Å; V603-L654 HydrophobicContact CB-CD2 4.29Å; V603-L654 HydrophobicContact CG1-CD2 4.01Å; V603-L654 HydrophobicContact CG2-CD2 3.78Å; L620-L654 HydrophobicContact CD2-CD2 4Å; L652-L654 HydrophobicContact CD2-CD1 4.34Å; L652-L654 HydrophobicContact CD2-CD2 3.85Å; L652-L654 HydrophobicContact CD2-CG 4.17Å; L652-L654 HydrophobicContact CG-CD2 4.03Å; L652-L654 HydrophobicContact CG-CG 4.25Å; L654-I656 HydrophobicContact CB-CD1 3.87Å; L654-I656 HydrophobicContact CB-CG1 4.1Å; L654-I656 HydrophobicContact CD1-CD1 4.3Å
655	T	93.4	Very high	70.4	Confident	17 Å²	17	83.5 Å²	83.5	10%	0.104	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	118.7	162.7	-51.1	0	0	0	0	108.6	E549 S601 K602	E549-T655 HydrophobicContact CB-CG2 3.83Å; E549-T655 HydrophobicContact CG-CG2 4.2Å; S601-T655 PolarHBondContact N-O 2.8Å; S601-T655 WeakPolarHBondContact OG-CB 3.32Å; S601-T655 WeakPolarHBondContact OG-CG2 3.39Å; S601-T655 PolarHBondContact OG-O 2.8Å; K602-T655 PolarHBondContact O-N 3.34Å
656	I	93.1	Very high	72.5	Confident	0 Å²	0	77.2 Å²	77.2	0%	0	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	129.4	-173.7	-56.5	-62.8	0	0	0	109.7	I544 T550 I552 L594 D598 R599 I600 L654	I544-I656 HydrophobicContact CD1-CB 4.31Å; I544-I656 HydrophobicContact CD1-CG1 4.46Å; I544-I656 HydrophobicContact CD1-CG2 4.01Å; I544-I656 HydrophobicContact CG2-CG2 4.12Å; T550-I656 PolarHBondContact N-O 3.33Å; T550-I656 PolarHBondContact O-N 3.3Å; I552-I656 HydrophobicContact CD1-CG1 3.96Å; I552-I656 HydrophobicContact CG1-CG1 4.05Å; L594-I656 HydrophobicContact CD2-CD1 3.74Å; L594-I656 HydrophobicContact CD2-CG1 3.77Å; L594-I656 HydrophobicContact CD2-CG2 4.29Å; D598-I656 HydrophobicContact CB-CG2 3.74Å; R599-I656 CarbonylContact O-C 3.58Å; R599-I656 WeakPolarHBondContact O-CA 3.32Å; I600-I656 HydrophobicContact CB-CD1 4.43Å; I600-I656 HydrophobicContact CG1-CD1 3.94Å; I600-I656 HydrophobicContact CG2-CD1 4.46Å; L654-I656 HydrophobicContact CB-CD1 3.87Å; L654-I656 HydrophobicContact CB-CG1 4.1Å; L654-I656 HydrophobicContact CD1-CD1 4.3Å
657	F	91.6	Very high	74.9	Confident	63 Å²	63	71.7 Å²	71.7	28%	0.276	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	116.8	166.5	178.4	-91.2	0	0	0	109.6	R599 P659	R599-F657 HydrophobicContact CB-CB 4.5Å; R599-F657 HydrophobicContact CG-CD1 4.45Å; R599-F657 PolarHBondContact N-O 2.87Å; R599-F657 PolarHBondContact O-N 3.18Å; F657-P659 HydrophobicContact CE1-CB 4.49Å; F657-P659 HydrophobicContact CE1-CG 4.28Å
658	R	88.7	Confident	76.9	Confident	30 Å²	30	63.6 Å²	63.6	11%	0.113	31%	0.314	C	S	.	.			trans	-95.6	121.5	171.4	176.7	167.3	-67.6	158.9	2.6	109.4	I544 P546 G547 R593 D598	I544-R658 HydrophobicContact CG2-CB 3.66Å; I544-R658 PolarHBondContact O-NH1 2.87Å; P546-R658 CarbonylContact C-O 3.51Å; P546-R658 WeakPolarHBondContact CA-O 3.39Å; P546-R658 HydrophobicContact CB-CG 4.28Å; P546-R658 HydrophobicContact CG-CG 4.29Å; G547-R658 PolarHBondContact N-O 3.47Å; R593-R658 PolarHBondContact O-NH2 2.88Å; D598-R658 WeakPolarHBondContact OD1-CB 3.47Å; D598-R658 WeakPolarHBondContact OD1-CG 3.47Å; D598-R658 IonicContact OD1-CZ 2.71Å; D598-R658 IonicContact OD1-NE 3.73Å; D598-R658 PolarHBondContact OD1-NE 2.84Å; D598-R658 IonicContact OD1-NH2 3.93Å; D598-R658 PolarHBondContact OD1-NH2 3.43Å; D598-R658 IonicContact OD2-CZ 3.4Å; D598-R658 IonicContact OD2-NE 3.24Å; D598-R658 IonicContact OD2-NH2 3.32Å; D598-R658 PolarHBondContact OD2-NH2 3Å
659	P	83	Confident	78.3	Confident	39 Å²	39	58.5 Å²	58.5	25%	0.253	29%	0.29	S	S	.	.			trans	-56.4	145.5	173.5	-25.6	35.5	0	0	0	112.8	G597 F657	G597-P659 WeakPolarHBondContact O-CD 3.22Å; F657-P659 HydrophobicContact CE1-CB 4.49Å; F657-P659 HydrophobicContact CE1-CG 4.28Å
660	T	75.1	Confident	79.8	Confident	107 Å²	107	57.1 Å²	57.1	66%	0.656	28%	0.284	S	S	*	.	S	Bend	trans	-72.6	-41.9	172.7	20.5	0	0	0	0	112.3	P546	P546-T660 HydrophobicContact CB-CG2 4.28Å
661	E	63.9	Low	80.5	Confident	149 Å²	149	58.1 Å²	58.1	70%	0.696	29%	0.288	S	S	*	.	S	Bend	trans	-82.8	140	178	-64.8	177.6	-176.4	0	0	110.2	S663	E661-S663 PolarHBondContact O-N 3.19Å
662	Q	55.2	Low	80.9	Confident	181 Å²	181	60 Å²	60	85%	0.846	30%	0.302	S	S	*	.			trans	-73.6	37.5	172	-64.6	-176.9	-10.1	0	0	112.2	Q664	Q662-Q664 PolarHBondContact O-N 2.59Å
663	S	52.6	Low	81.1	Confident	81 Å²	81	60.1 Å²	60.1	57%	0.566	30%	0.302	S	S	*	.			trans	-72.5	80.7	176.1	-168	0	0	0	0	109.5	E661 K665	E661-S663 PolarHBondContact O-N 3.19Å; S663-K665 PolarHBondContact O-N 2.98Å; S663-K665 VanDerWaalsContact O-N 3.11Å
664	Q	59.8	Low	81.2	Confident	56 Å²	56	62.2 Å²	62.2	26%	0.262	31%	0.311	S	S	.	.			trans	-70.4	3.3	-179.9	-71.4	170.7	-18.5	0	0	113.1	Q662 W666 R690 Y724	Q662-Q664 PolarHBondContact O-N 2.59Å; Q664-W666 VanDerWaalsContact O-CD1 3.27Å; Q664-W666 PolarHBondContact O-N 2.83Å; Q664-R690 PolarHBondContact O-NH2 3.41Å; Q664-Y724 HydrophobicContact CG-CD1 4.05Å
665	K	73.2	Confident	81	Confident	100 Å²	100	62.3 Å²	62.3	44%	0.435	31%	0.311	S	S	.	.			trans	-79	94.5	174.3	179.8	158.2	-179.9	169.2	0	110.4	S663 Y667 E670	S663-K665 PolarHBondContact O-N 2.98Å; S663-K665 VanDerWaalsContact O-N 3.11Å; K665-Y667 HydrophobicContact CB-CE1 4.1Å; K665-Y667 HydrophobicContact CD-CD2 4.17Å; K665-Y667 HydrophobicContact CD-CE1 4.41Å; K665-Y667 HydrophobicContact CD-CE2 3.57Å; K665-Y667 WeakPolarHBondContact CE-O 3.46Å; K665-Y667 HydrophobicContact CG-CD1 4.12Å; K665-Y667 HydrophobicContact CG-CD2 4.05Å; K665-Y667 HydrophobicContact CG-CE1 3.84Å; K665-Y667 HydrophobicContact CG-CE2 3.77Å; K665-Y667 HydrophobicContact CG-CG 4.19Å; K665-Y667 WeakPolarHBondContact CG-O 3.27Å; K665-E670 IonicContact NZ-OE1 2.75Å; K665-E670 PolarHBondContact NZ-OE1 3.07Å
666	W	74.7	Confident	80.7	Confident	18 Å²	18	67.3 Å²	67.3	7%	0.068	34%	0.337	C	S	.	.			trans	-92.4	-8.9	172.1	60.2	-85.7	0	0	0	112.9	I567 L574 H580 Q664 N746 Q748 L783	I567-W666 HydrophobicContact CD1-CB 3.9Å; I567-W666 HydrophobicContact CD1-CD2 3.55Å; I567-W666 HydrophobicContact CD1-CE3 3.21Å; I567-W666 HydrophobicContact CD1-CG 3.85Å; I567-W666 HydrophobicContact CD1-CZ3 3.94Å; L574-W666 HydrophobicContact CD1-CB 4.4Å; L574-W666 HydrophobicContact CD2-CB 4.45Å; H580-W666 AromaticContact CE1-CE2 3.78Å; H580-W666 AromaticContact CE1-CH2 4Å; H580-W666 AromaticContact CE1-CZ2 3.62Å; Q664-W666 VanDerWaalsContact O-CD1 3.27Å; Q664-W666 PolarHBondContact O-N 2.83Å; W666-N746 WeakPolarHBondContact CH2-O 3.48Å; W666-N746 VanDerWaalsContact CZ2-O 3.29Å; W666-N746 WeakPolarHBondContact CZ2-O 3.08Å; W666-Q748 HydrophobicContact CZ2-CB 3.76Å; W666-L783 HydrophobicContact CE3-CB 3.85Å; W666-L783 HydrophobicContact CE3-CD2 4.37Å; W666-L783 HydrophobicContact CZ3-CB 3.54Å
667	Y	81.8	Confident	80.3	Confident	33 Å²	33	69 Å²	69	13%	0.129	34%	0.344	C	S	.	.			trans	-99	143.7	-175.1	55.2	-91.1	0	0	0	111.6	K665 E670 L750 R782	K665-Y667 HydrophobicContact CB-CE1 4.1Å; K665-Y667 HydrophobicContact CD-CD2 4.17Å; K665-Y667 HydrophobicContact CD-CE1 4.41Å; K665-Y667 HydrophobicContact CD-CE2 3.57Å; K665-Y667 WeakPolarHBondContact CE-O 3.46Å; K665-Y667 HydrophobicContact CG-CD1 4.12Å; K665-Y667 HydrophobicContact CG-CD2 4.05Å; K665-Y667 HydrophobicContact CG-CE1 3.84Å; K665-Y667 HydrophobicContact CG-CE2 3.77Å; K665-Y667 HydrophobicContact CG-CG 4.19Å; K665-Y667 WeakPolarHBondContact CG-O 3.27Å; Y667-E670 HydrophobicContact CD2-CG 4.07Å; Y667-E670 HydrophobicContact CE2-CG 3.68Å; Y667-L750 HydrophobicContact CD2-CD1 4.42Å; Y667-L750 HydrophobicContact CE1-CD1 4.33Å; Y667-L750 HydrophobicContact CE1-CD2 3.64Å; Y667-L750 HydrophobicContact CE2-CD1 3.61Å; Y667-L750 HydrophobicContact CE2-CD2 4.42Å; Y667-L750 WeakPolarHBondContact OH-CD2 3.45Å; Y667-R782 WeakPolarHBondContact CB-O 3.4Å
668	D	82.8	Confident	79.7	Confident	30 Å²	30	72.1 Å²	72.1	16%	0.16	36%	0.358	C	S	.	.	S	Bend	trans	-110.7	0.3	179.6	62.7	12.8	0	0	0	112.8	A573 R782 L783 K784	A573-D668 HydrophobicContact CB-CB 3.91Å; A573-D668 WeakPolarHBondContact CB-OD2 3.49Å; D668-R782 PolarHBondContact N-O 3.34Å; D668-L783 HydrophobicContact CB-CD1 4.5Å; D668-K784 PolarHBondContact O-NZ 3.05Å; D668-K784 WeakPolarHBondContact OD1-CB 3.11Å; D668-K784 WeakPolarHBondContact OD1-CD 3.17Å; D668-K784 VanDerWaalsContact OD1-CG 3.24Å; D668-K784 WeakPolarHBondContact OD1-CG 3.36Å; D668-K784 PolarHBondContact OD1-N 3.41Å
669	Q	85.7	Confident	78.9	Confident	64 Å²	64	75.4 Å²	75.4	30%	0.299	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	136.1	174.7	-165	168	6.7	0	0	110.2	L671 G781 R782 K784	Q669-L671 HydrophobicContact CG-CD2 4.14Å; Q669-L671 HydrophobicContact CG-CG 4.21Å; Q669-G781 WeakPolarHBondContact O-CA 3.24Å; Q669-R782 WeakPolarHBondContact CB-O 3.46Å; Q669-R782 PolarHBondContact N-O 2.95Å; Q669-R782 PolarHBondContact O-N 2.83Å; Q669-K784 HydrophobicContact CB-CD 4.5Å; Q669-K784 HydrophobicContact CB-CG 4.16Å
670	E	90.8	Very high	78.3	Confident	85 Å²	85	77.9 Å²	77.9	40%	0.397	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	131.6	167.1	-72	172.8	-138.4	0	0	107.9	K665 Y667 L750 K779 V780	K665-E670 IonicContact NZ-OE1 2.75Å; K665-E670 PolarHBondContact NZ-OE1 3.07Å; Y667-E670 HydrophobicContact CD2-CG 4.07Å; Y667-E670 HydrophobicContact CE2-CG 3.68Å; E670-L750 HydrophobicContact CG-CD1 3.9Å; E670-K779 WeakPolarHBondContact OE2-CE 3.08Å; E670-K779 IonicContact OE2-NZ 3.21Å; E670-K779 PolarHBondContact OE2-NZ 2.82Å; E670-V780 WeakPolarHBondContact CA-O 3.47Å
671	L	90.2	Very high	78.2	Confident	40 Å²	40	79.7 Å²	79.7	21%	0.209	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	138.7	-180	-65.4	173.1	0	0	0	109.2	Q669 I673 K779 V780	Q669-L671 HydrophobicContact CG-CD2 4.14Å; Q669-L671 HydrophobicContact CG-CG 4.21Å; L671-I673 HydrophobicContact CB-CD1 4.26Å; L671-I673 HydrophobicContact CB-CG1 4.42Å; L671-K779 CarbonylContact O-C 3.51Å; L671-K779 VanDerWaalsContact O-CA 3.3Å; L671-K779 WeakPolarHBondContact O-CA 3.4Å; L671-V780 HydrophobicContact CB-CG2 3.86Å; L671-V780 PolarHBondContact N-O 2.59Å; L671-V780 PolarHBondContact O-N 3.03Å
672	I	93	Very high	79	Confident	120 Å²	120	75.3 Å²	75.3	62%	0.615	41%	0.411	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.8	121.4	171.2	-60	173.6	0	0	0	107.5	V777 L778 K779	I672-V777 HydrophobicContact CG2-CG1 3.78Å; I672-L778 WeakPolarHBondContact CA-O 3.33Å; I672-K779 HydrophobicContact CG1-CG 4.22Å
673	I	91.8	Very high	80.5	Confident	3 Å²	3	67.1 Å²	67.1	2%	0.015	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	125	-171.8	-67.1	167	0	0	0	108.3	L671 L675 R742 L743 L778 V780	L671-I673 HydrophobicContact CB-CD1 4.26Å; L671-I673 HydrophobicContact CB-CG1 4.42Å; I673-L675 HydrophobicContact CG2-CD2 3.91Å; I673-L675 HydrophobicContact CG2-CG 4.14Å; I673-R742 HydrophobicContact CD1-CB 3.75Å; I673-R742 HydrophobicContact CG1-CB 3.92Å; I673-R742 HydrophobicContact CG2-CB 4.36Å; I673-L743 HydrophobicContact CD1-CD2 3.5Å; I673-L743 HydrophobicContact CD1-CG 3.93Å; I673-L743 HydrophobicContact CG2-CD2 4.49Å; I673-L743 HydrophobicContact CG2-CG 4.25Å; I673-L778 PolarHBondContact N-O 2.89Å; I673-L778 PolarHBondContact O-N 3.24Å; I673-V780 HydrophobicContact CD1-CG2 3.96Å
674	E	91.9	Very high	82.1	Confident	91 Å²	91	64 Å²	64	43%	0.425	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	110.7	-179.3	-54.1	-158	134.1	0	0	110.5	R742 K775 V777	E674-R742 PolarHBondContact O-NH2 2.83Å; E674-K775 WeakPolarHBondContact OE1-CE 3.48Å; E674-K775 IonicContact OE1-NZ 2.68Å; E674-K775 PolarHBondContact OE1-NZ 3.33Å; E674-K775 VanDerWaalsContact OE2-CE 3.26Å; E674-K775 WeakPolarHBondContact OE2-CE 3.47Å; E674-K775 IonicContact OE2-NZ 2.65Å; E674-K775 PolarHBondContact OE2-NZ 2.86Å; E674-V777 HydrophobicContact CG-CG1 4.43Å; E674-V777 HydrophobicContact CG-CG2 4.15Å
675	L	89.9	Confident	83.5	Confident	1 Å²	1	62.5 Å²	62.5	1%	0.005	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	138	178.8	-59.8	-175.6	0	0	0	111.7	I673 L683 I736 A737 D740 L743 V776 L778	I673-L675 HydrophobicContact CG2-CD2 3.91Å; I673-L675 HydrophobicContact CG2-CG 4.14Å; L675-L683 HydrophobicContact CB-CD2 3.93Å; L675-L683 HydrophobicContact CD1-CB 4.35Å; L675-L683 HydrophobicContact CD1-CD1 4.23Å; L675-L683 HydrophobicContact CD1-CD2 3.98Å; L675-L683 HydrophobicContact CD1-CG 4.41Å; L675-I736 HydrophobicContact CB-CG2 4.36Å; L675-A737 HydrophobicContact CD1-CB 4.39Å; L675-D740 HydrophobicContact CD2-CB 3.53Å; L675-D740 VanDerWaalsContact CD2-OD1 3.28Å; L675-D740 WeakPolarHBondContact CD2-OD1 3.31Å; L675-L743 HydrophobicContact CD1-CD1 3.84Å; L675-V776 PolarHBondContact N-O 2.87Å; L675-V776 PolarHBondContact O-N 2.74Å; L675-L778 HydrophobicContact CD1-CD1 4.19Å
676	L	87.2	Confident	84.1	Confident	122 Å²	122	59.1 Å²	59.1	64%	0.639	34%	0.336	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.6	102.5	175	-63.8	177.2	0	0	0	110.5	K678 Y774 K775	L676-K678 PolarHBondContact O-N 2.73Å; L676-Y774 CarbonylContact C-O 3.52Å; L676-Y774 WeakPolarHBondContact CA-O 3.26Å; L676-K775 HydrophobicContact CD2-CB 4.31Å
677	K	84.3	Confident	84.8	Confident	36 Å²	36	60.1 Å²	60.1	16%	0.157	34%	0.342	C	S	.	.			trans	-77	109	-176.4	179.9	177.6	170.2	-174.1	0	110.8	L683 L769 K770 A772 Y774 V776	K677-L683 HydrophobicContact CB-CD2 4.1Å; K677-L683 HydrophobicContact CG-CD2 4.44Å; K677-L769 PolarHBondContact NZ-O 2.78Å; K677-K770 PolarHBondContact NZ-O 3.29Å; K677-A772 PolarHBondContact NZ-O 3.38Å; K677-Y774 PolarHBondContact N-O 2.87Å; K677-V776 HydrophobicContact CB-CG2 4.02Å; K677-V776 HydrophobicContact CD-CG2 4.05Å
678	K	79.6	Confident	84.7	Confident	129 Å²	129	59.7 Å²	59.7	56%	0.561	35%	0.345	S	S	*	.			trans	-69.3	138.5	175.4	-61.4	-179.2	-178.9	178.8	0	110	L676 G680 K681 I736	L676-K678 PolarHBondContact O-N 2.73Å; K678-G680 PolarHBondContact O-N 3.48Å; K678-K681 HydrophobicContact CB-CB 4.43Å; K678-K681 PolarHBondContact O-N 2.67Å; K678-K681 VanDerWaalsContact O-N 3.08Å; K678-I736 HydrophobicContact CB-CD1 4.23Å; K678-I736 HydrophobicContact CG-CD1 4.13Å
679	S	70.7	Confident	84.5	Confident	98 Å²	98	59.3 Å²	59.3	69%	0.685	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	133.2	179.7	46.9	0	0	0	0	111.7	K681	S679-K681 PolarHBondContact O-N 2.96Å
680	G	69.5	Low	83.9	Confident	92 Å²	92	56.7 Å²	56.7	95%	0.948	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.6	-1.9	-177.9	0	0	0	0	0	115.7	K678	K678-G680 PolarHBondContact O-N 3.48Å
681	K	74.8	Confident	82.5	Confident	144 Å²	144	53.4 Å²	53.4	63%	0.626	32%	0.317	S	S	*	.			trans	-114.9	140.4	177	-63.9	-166.1	175	-169.2	0	111.7	K678 S679	K678-K681 HydrophobicContact CB-CB 4.43Å; K678-K681 PolarHBondContact O-N 2.67Å; K678-K681 VanDerWaalsContact O-N 3.08Å; S679-K681 PolarHBondContact O-N 2.96Å
682	G	79.5	Confident	80.8	Confident	57 Å²	57	51.9 Å²	51.9	59%	0.588	31%	0.309	S	S	*	.			trans	-72	167.2	168.5	0	0	0	0	0	111.9	G684	G682-G684 PolarHBondContact O-N 2.89Å
683	L	86.7	Confident	78.7	Confident	10 Å²	10	50.9 Å²	50.9	5%	0.052	30%	0.302	C	S	.	.			trans	-65.9	-29.6	172.5	-60.8	174.6	0	0	0	111.9	L675 K677 I685 S735 I736 A737 L769 V776	L675-L683 HydrophobicContact CB-CD2 3.93Å; L675-L683 HydrophobicContact CD1-CB 4.35Å; L675-L683 HydrophobicContact CD1-CD1 4.23Å; L675-L683 HydrophobicContact CD1-CD2 3.98Å; L675-L683 HydrophobicContact CD1-CG 4.41Å; K677-L683 HydrophobicContact CB-CD2 4.1Å; K677-L683 HydrophobicContact CG-CD2 4.44Å; L683-I685 HydrophobicContact CB-CG1 4.5Å; L683-S735 WeakPolarHBondContact O-CB 3.37Å; L683-S735 PolarHBondContact O-OG 3.22Å; L683-I736 PolarHBondContact O-N 3.04Å; L683-A737 WeakPolarHBondContact O-CB 3.49Å; L683-A737 PolarHBondContact O-N 3.27Å; L683-L769 HydrophobicContact CD1-CD2 3.98Å; L683-V776 HydrophobicContact CD1-CB 4.39Å; L683-V776 HydrophobicContact CD1-CG1 4.24Å; L683-V776 HydrophobicContact CD1-CG2 4.33Å; L683-V776 HydrophobicContact CD2-CG2 4.09Å
684	G	87.2	Confident	76.4	Confident	14 Å²	14	54.6 Å²	54.6	14%	0.144	32%	0.321	C	S	.	.			trans	83.9	35.8	-178.9	0	0	0	0	0	114.5	G682 I732 S735	G682-G684 PolarHBondContact O-N 2.89Å; G684-I732 WeakPolarHBondContact O-CB 3.39Å; G684-I732 PolarHBondContact O-N 2.84Å; G684-S735 PolarHBondContact O-OG 3.28Å
685	I	89.3	Confident	74	Confident	26 Å²	26	58 Å²	58	13%	0.133	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	135.5	166.7	57.7	179.4	0	0	0	109	L683 I687 I728 I731 A737 L743 I749 L769	L683-I685 HydrophobicContact CB-CG1 4.5Å; I685-I687 HydrophobicContact CD1-CG2 4.13Å; I685-I687 HydrophobicContact CG1-CG2 4.21Å; I685-I728 HydrophobicContact CB-CD1 4.48Å; I685-I728 HydrophobicContact CB-CG2 4.19Å; I685-I728 HydrophobicContact CD1-CD1 4.12Å; I685-I728 HydrophobicContact CD1-CG1 4.33Å; I685-I728 HydrophobicContact CG2-CD1 4.19Å; I685-I728 HydrophobicContact CG2-CG2 4.3Å; I685-I731 HydrophobicContact CG2-CG1 4.37Å; I685-A737 HydrophobicContact CG2-CB 3.52Å; I685-L743 HydrophobicContact CG2-CD1 3.96Å; I685-I749 HydrophobicContact CD1-CD1 4.33Å; I685-L769 HydrophobicContact CD1-CD1 4.18Å
686	C	85.5	Confident	71.4	Confident	28 Å²	28	63.2 Å²	63.2	19%	0.189	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	135.1	163.9	-59.7	0	0	0	0	107.5	I728 T729 E730	C686-I728 CarbonylContact O-C 3.6Å; C686-I728 WeakPolarHBondContact O-CA 3.49Å; C686-T729 PolarHBondContact O-N 3.12Å; C686-T729 PolarHBondContact O-OG1 2.87Å; C686-E730 HydrophobicContact CB-CB 3.87Å; C686-E730 PolarHBondContact N-O 3.19Å
687	I	88.2	Confident	69	Low	40 Å²	40	64.4 Å²	64.4	21%	0.205	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	148.1	-179.4	58.2	169.8	0	0	0	111.1	I685 V726 I727 I728 I749 S762 V765 L769	I685-I687 HydrophobicContact CD1-CG2 4.13Å; I685-I687 HydrophobicContact CG1-CG2 4.21Å; I687-V726 HydrophobicContact CB-CG1 3.8Å; I687-V726 HydrophobicContact CD1-CG1 4.11Å; I687-V726 HydrophobicContact CG1-CG1 4.41Å; I687-V726 HydrophobicContact CG2-CG1 4.32Å; I687-I727 CarbonylContact C-O 3.55Å; I687-I727 WeakPolarHBondContact CA-O 3.4Å; I687-I728 HydrophobicContact CG2-CG1 4.31Å; I687-I749 HydrophobicContact CG2-CD1 3.78Å; I687-S762 WeakPolarHBondContact CD1-O 3.37Å; I687-V765 HydrophobicContact CD1-CB 4.48Å; I687-V765 HydrophobicContact CD1-CG1 4.31Å; I687-L769 HydrophobicContact CD1-CD1 4.27Å
688	A	79.6	Confident	66.7	Low	23 Å²	23	71.3 Å²	71.3	19%	0.19	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	155.4	176.1	0	0	0	0	0	111.8	V726 I727 T729	A688-V726 WeakPolarHBondContact O-CA 3.46Å; A688-I727 PolarHBondContact N-O 3.19Å; A688-I727 WeakPolarHBondContact O-CG1 3.49Å; A688-I727 PolarHBondContact O-N 2.84Å; A688-T729 HydrophobicContact CB-CG2 3.51Å
689	D	79	Confident	64.2	Low	23 Å²	23	72 Å²	72	12%	0.123	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	126.9	171.7	-82.9	-57.2	0	0	0	111.7	C691 T761 S762	D689-C691 HydrophobicContact CB-CB 4.03Å; D689-C691 PolarHBondContact O-N 3.42Å; D689-T761 WeakPolarHBondContact OD1-CA 3.3Å; D689-S762 PolarHBondContact OD1-N 2.87Å; D689-S762 WeakPolarHBondContact OD2-CB 3.36Å; D689-S762 PolarHBondContact OD2-N 2.84Å; D689-S762 PolarHBondContact OD2-OG 3.35Å
690	R	73.1	Confident	62.6	Low	8 Å²	8	75.2 Å²	75.2	3%	0.03	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	78.9	160.6	-59.3	-162.1	-55.9	164	-2.3	108.7	Q664 Y724 G725 I727 Q748	Q664-R690 PolarHBondContact O-NH2 3.41Å; R690-Y724 VanDerWaalsContact CZ-O 3.25Å; R690-Y724 PolarHBondContact NE-O 3.08Å; R690-Y724 PolarHBondContact NH2-O 3.26Å; R690-Y724 WeakPolarHBondContact O-CA 3.09Å; R690-Y724 VanDerWaalsContact O-CB 3.28Å; R690-Y724 WeakPolarHBondContact O-CB 3.2Å; R690-Y724 VanDerWaalsContact O-CD2 3.27Å; R690-Y724 WeakPolarHBondContact O-CD2 3.32Å; R690-Y724 PolarHBondContact O-N 2.88Å; R690-G725 WeakPolarHBondContact CB-O 3.16Å; R690-G725 WeakPolarHBondContact CG-O 3.38Å; R690-G725 PolarHBondContact N-O 3.01Å; R690-I727 HydrophobicContact CG-CB 4.47Å; R690-I727 HydrophobicContact CG-CD1 3.95Å; R690-I727 HydrophobicContact CG-CG1 3.97Å; R690-I727 HydrophobicContact CG-CG2 3.76Å; R690-Q748 VanDerWaalsContact NH2-OE1 3.15Å
691	C	61.1	Low	60.9	Low	17 Å²	17	75.5 Å²	75.5	12%	0.115	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	159.9	-176.6	61.7	0	0	0	0	112.3	D689 Q721	D689-C691 HydrophobicContact CB-CB 4.03Å; D689-C691 PolarHBondContact O-N 3.42Å; C691-Q721 HydrophobicContact CB-CG 3.88Å; C691-Q721 PolarHBondContact SG-NE2 2.53Å; C691-Q721 VanDerWaalsContact SG-NE2 3.41Å
692	V	54.7	Low	58.8	Low	8 Å²	8	77.7 Å²	77.7	5%	0.048	43%	0.427	C	S	.	.			trans	-110.2	117.9	168.2	-175.6	0	0	0	0	107.6	R595 P596 L694 Y724	R595-V692 HydrophobicContact CB-CG2 3.87Å; R595-V692 HydrophobicContact CG-CG1 4.29Å; R595-V692 HydrophobicContact CG-CG2 3.77Å; P596-V692 VanDerWaalsContact CD-CG2 3.48Å; V692-L694 VanDerWaalsContact C-N 3.28Å; V692-L694 HydrophobicContact CB-CG 4.49Å; V692-L694 HydrophobicContact CG1-CD2 3.71Å; V692-L694 HydrophobicContact CG1-CG 3.96Å; V692-L694 PolarHBondContact O-N 3.29Å; V692-Y724 HydrophobicContact CG2-CE2 3.87Å
693	H	48.4	Very low	56.6	Low	99 Å²	99	82.2 Å²	82.2	46%	0.458	44%	0.437	S	S	.	.			trans	-75.7	84.3	168.9	-73.7	73.8	0	0	0	108.7	K695	H693-K695 PolarHBondContact O-N 2.88Å
694	L	44.6	Very low	54	Low	80 Å²	80	89.9 Å²	89.9	42%	0.419	47%	0.473	S	S	.	.	P	Polyproline II helix	trans	-71.5	122	168.9	-63.4	173.4	0	0	0	108.2	V692	V692-L694 VanDerWaalsContact C-N 3.28Å; V692-L694 HydrophobicContact CB-CG 4.49Å; V692-L694 HydrophobicContact CG1-CD2 3.71Å; V692-L694 HydrophobicContact CG1-CG 3.96Å; V692-L694 PolarHBondContact O-N 3.29Å
695	K	41.5	Very low	51.4	Low	164 Å²	164	95.8 Å²	95.8	71%	0.713	50%	0.501	S	S	*	.	P	Polyproline II helix	trans	-64.3	141.3	165.5	-66.8	-175.5	-173.7	178.7	0	108.8	H693	H693-K695 PolarHBondContact O-N 2.88Å
696	P	35.4	Very low	48.7	Very low	110 Å²	110	100.2 Å²	100.2	71%	0.714	53%	0.53	S	S	*	.	P	Polyproline II helix	trans	-65	146.1	161.3	30.4	-33.7	0	0	0	109.3	E698	P696-E698 PolarHBondContact O-N 3Å; P696-E698 VanDerWaalsContact O-N 3.1Å
697	D	35.9	Very low	46.4	Very low	147 Å²	147	106.3 Å²	106.3	79%	0.786	56%	0.56	S	S	*	*			trans	-69.4	105.4	177.7	-70.6	-60.7	0	0	0	110.7	N699	D697-N699 PolarHBondContact O-N 3.42Å
698	E	35.9	Very low	43.7	Very low	181 Å²	181	114.3 Å²	114.3	85%	0.846	59%	0.593	S	S	*	*	S	Bend	trans	-73.1	53.4	171.2	-65.9	-175.1	142.8	0	0	111.4	P696	P696-E698 PolarHBondContact O-N 3Å; P696-E698 VanDerWaalsContact O-N 3.1Å
699	N	28.8	Very low	41.7	Very low	144 Å²	144	119.4 Å²	119.4	77%	0.77	62%	0.622	S	S	*	*			trans	-144.5	45.8	-178.7	-84.3	-66.7	0	0	0	112.5	D697	D697-N699 PolarHBondContact O-N 3.42Å
700	L	36.9	Very low	39.4	Very low	164 Å²	164	126.6 Å²	126.6	86%	0.859	65%	0.654	S	S	*	*	S	Bend	trans	-118.1	93.1	166.2	-76.5	176	0	0	0	110.8
701	S	32.8	Very low	37.6	Very low	99 Å²	99	133.7 Å²	133.7	69%	0.692	69%	0.693	S	S	*	*			trans	3.8	126.2	166.8	59.2	0	0	0	0	118.9	N703	S701-N703 PolarHBondContact O-N 3.45Å
702	E	30.4	Very low	36.1	Very low	189 Å²	189	140 Å²	140	88%	0.883	73%	0.726	S	S	*	*			trans	-43.1	124	149.4	-56.8	171.8	150.4	0	0	110.8
703	N	34.2	Very low	35	Very low	152 Å²	152	145.2 Å²	145.2	81%	0.813	76%	0.762	S	S	*	*			trans	-168.3	106.5	151.7	-101.2	-54.6	0	0	0	109.2	S701	S701-N703 PolarHBondContact O-N 3.45Å
704	E	32.5	Very low	34.2	Very low	171 Å²	171	151.2 Å²	151.2	80%	0.799	78%	0.782	S	S	*	*			trans	-68	135.5	167.2	-59	-177.7	136.8	0	0	109.8
705	N	31.8	Very low	33.5	Very low	138 Å²	138	152.5 Å²	152.5	74%	0.738	79%	0.794	S	S	*	*				156.3	149.7	116	-86.8	-71	0	0	0	113.9
706	T	33.5	Very low	32.8	Very low	120 Å²	120	152.4 Å²	152.4	74%	0.736	80%	0.801	S	S	*	*			trans	53.1	105.1	161.6	-9.3	0	0	0	0	118.6
707	L	37.3	Very low	32.5	Very low	156 Å²	156	153.4 Å²	153.4	82%	0.817	81%	0.805	S	S	*	*				-172.1	133.1	93.4	-96.3	162.6	0	0	0	111.2
708	K	29.5	Very low	32.4	Very low	207 Å²	207	151.1 Å²	151.1	90%	0.9	80%	0.801	S	S	*	*			trans	-93.1	115.6	171.3	-66.1	177.4	-178.4	176	0	108.7
709	V	37.6	Very low	32.4	Very low	131 Å²	131	150.9 Å²	150.9	79%	0.794	80%	0.8	S	S	*	*			trans	-131.5	137.5	160.7	-177	0	0	0	0	107.5
710	Q	30.8	Very low	33.1	Very low	173 Å²	173	151.7 Å²	151.7	81%	0.808	80%	0.801	S	S	*	*			trans	-85.2	131.8	179.1	-63.2	147.5	-82.9	0	0	109.1
711	D	35.7	Very low	33.8	Very low	157 Å²	157	147.9 Å²	147.9	84%	0.84	78%	0.778	S	S	*	*				-172.7	163.5	120.8	-99.4	-28.7	0	0	0	112.8	S713	D711-S713 PolarHBondContact O-N 2.94Å
712	N	29.1	Very low	35.1	Very low	151 Å²	151	146.2 Å²	146.2	81%	0.807	76%	0.764	S	S	*	*			trans	-83.8	111.6	-163.8	-66.8	-72.8	0	0	0	114
713	S	33.6	Very low	36.8	Very low	116 Å²	116	138.2 Å²	138.2	81%	0.811	73%	0.729	S	S	*	*			trans	-145.8	135.3	145.7	59.1	0	0	0	0	109.7	D711	D711-S713 PolarHBondContact O-N 2.94Å
714	Y	31.6	Very low	38.5	Very low	225 Å²	225	132.8 Å²	132.8	88%	0.882	70%	0.697	S	S	*	*			trans	-86.3	123.2	-169.9	-111.9	-102	0	0	0	112.3
715	V	28.3	Very low	40.8	Very low	108 Å²	108	124.7 Å²	124.7	66%	0.655	66%	0.659	S	S	*	*			trans	-33.3	133.8	170	179.3	0	0	0	0	114.5
716	N	27.6	Very low	43.4	Very low	162 Å²	162	118.1 Å²	118.1	87%	0.866	62%	0.624	S	S	*	*			trans	-146.5	109	139.2	-103.9	-15.6	0	0	0	108.7	S718	N716-S718 PolarHBondContact O-N 2.86Å; N716-S718 VanDerWaalsContact O-N 3.07Å
717	T	28.4	Very low	45.9	Very low	130 Å²	130	112.4 Å²	112.4	80%	0.798	59%	0.589	S	S	*	*			trans	-74.9	95.9	177.8	-24.9	0	0	0	0	108.3	E719	T717-E719 PolarHBondContact O-N 3.24Å; T717-E719 VanDerWaalsContact O-N 3.17Å
718	S	33.6	Very low	48.2	Very low	100 Å²	100	105 Å²	105	70%	0.699	55%	0.55	S	S	*	*			trans	-69.4	110.5	-170.8	58.4	0	0	0	0	112.6	N716 M720	N716-S718 PolarHBondContact O-N 2.86Å; N716-S718 VanDerWaalsContact O-N 3.07Å; S718-M720 PolarHBondContact O-N 3.41Å
719	E	37.2	Very low	50.7	Low	176 Å²	176	97 Å²	97	82%	0.822	52%	0.519	S	S	*	.			trans	-56.9	124.8	163.1	-61.7	177	160	0	0	108.7	T717 Q721	T717-E719 PolarHBondContact O-N 3.24Å; T717-E719 VanDerWaalsContact O-N 3.17Å; E719-Q721 PolarHBondContact O-N 3.42Å
720	M	42.8	Very low	52.7	Low	161 Å²	161	95 Å²	95	79%	0.793	50%	0.501	S	S	*	.			trans	-78.8	61.9	178.8	-77.2	-157.6	172.5	0	0	111.7	S718 T722	S718-M720 PolarHBondContact O-N 3.41Å; M720-T722 PolarHBondContact O-N 2.83Å
721	Q	52.2	Low	55.1	Low	84 Å²	84	88.4 Å²	88.4	39%	0.393	47%	0.471	S	S	.	.			trans	-70.2	90.6	174	-168.7	-177	18.7	0	0	109.8	C691 E719 S723	C691-Q721 HydrophobicContact CB-CG 3.88Å; C691-Q721 PolarHBondContact SG-NE2 2.53Å; C691-Q721 VanDerWaalsContact SG-NE2 3.41Å; E719-Q721 PolarHBondContact O-N 3.42Å; Q721-S723 PolarHBondContact O-N 3.22Å; Q721-S723 VanDerWaalsContact O-N 3.12Å
722	T	59.2	Low	57.3	Low	64 Å²	64	84.1 Å²	84.1	39%	0.393	45%	0.448	S	S	.	.			trans	-67.6	109.3	171.4	46.1	0	0	0	0	109.7	M720 Y724	M720-T722 PolarHBondContact O-N 2.83Å; T722-Y724 VanDerWaalsContact O-CD2 3.3Å; T722-Y724 WeakPolarHBondContact O-CD2 3.47Å; T722-Y724 VanDerWaalsContact O-CE2 3.31Å; T722-Y724 WeakPolarHBondContact O-CE2 3.44Å
723	S	66.2	Low	59.6	Low	20 Å²	20	84.2 Å²	84.2	14%	0.14	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	139.1	168.5	-178.9	0	0	0	0	110.2	Q721 G725 L760	Q721-S723 PolarHBondContact O-N 3.22Å; Q721-S723 VanDerWaalsContact O-N 3.12Å; S723-G725 PolarHBondContact OG-N 3.33Å; S723-L760 PolarHBondContact OG-O 3.26Å
724	Y	70.8	Confident	61.6	Low	39 Å²	39	81.5 Å²	81.5	15%	0.153	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	23.7	171.6	-59.1	-120.2	0	0	0	109.2	P596 Q664 R690 V692 T722	P596-Y724 HydrophobicContact CB-CG 4.48Å; Q664-Y724 HydrophobicContact CG-CD1 4.05Å; R690-Y724 VanDerWaalsContact CZ-O 3.25Å; R690-Y724 PolarHBondContact NE-O 3.08Å; R690-Y724 PolarHBondContact NH2-O 3.26Å; R690-Y724 WeakPolarHBondContact O-CA 3.09Å; R690-Y724 VanDerWaalsContact O-CB 3.28Å; R690-Y724 WeakPolarHBondContact O-CB 3.2Å; R690-Y724 VanDerWaalsContact O-CD2 3.27Å; R690-Y724 WeakPolarHBondContact O-CD2 3.32Å; R690-Y724 PolarHBondContact O-N 2.88Å; V692-Y724 HydrophobicContact CG2-CE2 3.87Å; T722-Y724 VanDerWaalsContact O-CD2 3.3Å; T722-Y724 WeakPolarHBondContact O-CD2 3.47Å; T722-Y724 VanDerWaalsContact O-CE2 3.31Å; T722-Y724 WeakPolarHBondContact O-CE2 3.44Å
725	G	79.8	Confident	64.1	Low	0 Å²	0	71.6 Å²	71.6	0%	0	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	88.4	171.4	-178.3	0	0	0	0	0	114.3	R690 S723 S758	R690-G725 WeakPolarHBondContact CB-O 3.16Å; R690-G725 WeakPolarHBondContact CG-O 3.38Å; R690-G725 PolarHBondContact N-O 3.01Å; S723-G725 PolarHBondContact OG-N 3.33Å; G725-S758 WeakPolarHBondContact CA-O 3.21Å; G725-S758 PolarHBondContact N-O 2.93Å
726	V	86	Confident	66.9	Low	0 Å²	0	67.5 Å²	67.5	0%	0	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	137.4	-170.4	-178.6	0	0	0	0	111.4	I687 A688 Q748 I749 V765	I687-V726 HydrophobicContact CB-CG1 3.8Å; I687-V726 HydrophobicContact CD1-CG1 4.11Å; I687-V726 HydrophobicContact CG1-CG1 4.41Å; I687-V726 HydrophobicContact CG2-CG1 4.32Å; A688-V726 WeakPolarHBondContact O-CA 3.46Å; V726-Q748 CarbonylContact O-C 3.56Å; V726-Q748 WeakPolarHBondContact O-CA 3.4Å; V726-Q748 WeakPolarHBondContact O-CG 3.17Å; V726-I749 HydrophobicContact CG1-CD1 4.39Å; V726-I749 PolarHBondContact O-N 3.26Å; V726-V765 HydrophobicContact CB-CB 4.42Å; V726-V765 HydrophobicContact CB-CG1 4.5Å; V726-V765 HydrophobicContact CB-CG2 4.17Å; V726-V765 HydrophobicContact CG1-CB 4.34Å; V726-V765 HydrophobicContact CG1-CG1 4.25Å; V726-V765 HydrophobicContact CG2-CB 4.04Å; V726-V765 HydrophobicContact CG2-CG2 3.6Å
727	I	86	Confident	69.7	Low	1 Å²	1	59.8 Å²	59.8	1%	0.005	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	153.4	178.7	53.2	169.1	0	0	0	112.1	H580 I687 A688 R690 T729 D747 Q748	H580-I727 WeakPolarHBondContact NE2-CD1 3.15Å; I687-I727 CarbonylContact C-O 3.55Å; I687-I727 WeakPolarHBondContact CA-O 3.4Å; A688-I727 PolarHBondContact N-O 3.19Å; A688-I727 WeakPolarHBondContact O-CG1 3.49Å; A688-I727 PolarHBondContact O-N 2.84Å; R690-I727 HydrophobicContact CG-CB 4.47Å; R690-I727 HydrophobicContact CG-CD1 3.95Å; R690-I727 HydrophobicContact CG-CG1 3.97Å; R690-I727 HydrophobicContact CG-CG2 3.76Å; I727-T729 HydrophobicContact CD1-CG2 4.25Å; I727-T729 HydrophobicContact CG1-CG2 4.34Å; I727-D747 CarbonylContact C-O 3.44Å; I727-D747 WeakPolarHBondContact CA-O 3.49Å; I727-Q748 HydrophobicContact CG2-CB 4.08Å; I727-Q748 HydrophobicContact CG2-CG 4.43Å
728	I	86.7	Confident	72.3	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	115.6	169.1	-61.4	178.1	0	0	0	108.6	I685 C686 I687 I731 L743 A745 N746 D747 I749	I685-I728 HydrophobicContact CB-CD1 4.48Å; I685-I728 HydrophobicContact CB-CG2 4.19Å; I685-I728 HydrophobicContact CD1-CD1 4.12Å; I685-I728 HydrophobicContact CD1-CG1 4.33Å; I685-I728 HydrophobicContact CG2-CD1 4.19Å; I685-I728 HydrophobicContact CG2-CG2 4.3Å; C686-I728 CarbonylContact O-C 3.6Å; C686-I728 WeakPolarHBondContact O-CA 3.49Å; I687-I728 HydrophobicContact CG2-CG1 4.31Å; I728-I731 HydrophobicContact CG2-CD1 4.42Å; I728-I731 HydrophobicContact CG2-CG1 3.86Å; I728-L743 HydrophobicContact CD1-CB 4.43Å; I728-L743 HydrophobicContact CD1-CD1 4.16Å; I728-L743 HydrophobicContact CD1-CD2 3.84Å; I728-L743 HydrophobicContact CD1-CG 4.38Å; I728-A745 CarbonylContact O-C 3.6Å; I728-A745 WeakPolarHBondContact O-CA 3.39Å; I728-N746 WeakPolarHBondContact O-CA 3.44Å; I728-N746 PolarHBondContact O-N 2.82Å; I728-D747 HydrophobicContact CB-CB 4.39Å; I728-D747 HydrophobicContact CD1-CB 4.09Å; I728-D747 HydrophobicContact CG1-CB 4.4Å; I728-D747 PolarHBondContact N-O 3.06Å; I728-I749 HydrophobicContact CD1-CG1 4.5Å; I728-I749 HydrophobicContact CG1-CD1 4.13Å; I728-I749 HydrophobicContact CG1-CG1 4.14Å
729	T	81	Confident	74.4	Confident	40 Å²	40	50.7 Å²	50.7	25%	0.245	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	-29.2	-179.3	49.3	0	0	0	0	113.3	C686 A688 I727	C686-T729 PolarHBondContact O-N 3.12Å; C686-T729 PolarHBondContact O-OG1 2.87Å; A688-T729 HydrophobicContact CB-CG2 3.51Å; I727-T729 HydrophobicContact CD1-CG2 4.25Å; I727-T729 HydrophobicContact CG1-CG2 4.34Å
730	E	79.8	Confident	76.8	Confident	87 Å²	87	44.4 Å²	44.4	41%	0.407	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	152.6	179.1	-177.8	179.2	-167.1	0	0	110.2	C686	C686-E730 HydrophobicContact CB-CB 3.87Å; C686-E730 PolarHBondContact N-O 3.19Å
731	I	81.7	Confident	78.6	Confident	36 Å²	36	38.6 Å²	38.6	19%	0.185	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	116.9	171	-56.8	-177.3	0	0	0	108.2	I685 I728 K733 A737 A738 L743	I685-I731 HydrophobicContact CG2-CG1 4.37Å; I728-I731 HydrophobicContact CG2-CD1 4.42Å; I728-I731 HydrophobicContact CG2-CG1 3.86Å; I731-K733 PolarHBondContact O-N 3.38Å; I731-A737 HydrophobicContact CG2-CB 3.84Å; I731-A738 HydrophobicContact CG2-CB 3.96Å; I731-L743 HydrophobicContact CD1-CB 3.7Å; I731-L743 WeakPolarHBondContact CD1-O 3.46Å
732	I	82.1	Confident	80.2	Confident	67 Å²	67	39.6 Å²	39.6	34%	0.344	22%	0.222	S	C	.	.			trans	-70.8	120.5	-172.3	-59.4	177.1	0	0	0	109.2	G684 S735 A738	G684-I732 WeakPolarHBondContact O-CB 3.39Å; G684-I732 PolarHBondContact O-N 2.84Å; I732-S735 WeakPolarHBondContact O-CB 3.43Å; I732-S735 PolarHBondContact O-N 2.83Å; I732-S735 VanDerWaalsContact O-N 3.13Å; I732-S735 PolarHBondContact O-OG 3.1Å; I732-A738 VanDerWaalsContact O-CB 3.25Å; I732-A738 WeakPolarHBondContact O-CB 3.48Å
733	K	76.1	Confident	81.5	Confident	153 Å²	153	36.8 Å²	36.8	67%	0.665	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.9	140.2	179	-64.2	-171.8	177.8	-169.9	0	111.4	I731 S735	I731-K733 PolarHBondContact O-N 3.38Å; K733-S735 PolarHBondContact O-N 3.46Å
734	G	76.9	Confident	82.3	Confident	58 Å²	58	39.9 Å²	39.9	60%	0.598	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	74.4	1.8	-177.1	0	0	0	0	0	115.6
735	S	84.8	Confident	82.8	Confident	17 Å²	17	40 Å²	40	12%	0.119	23%	0.227	C	C	.	.	S	Bend	trans	-83.5	172	174.3	73.7	0	0	0	0	113.7	L683 G684 I732 K733 A737 A738 T739	L683-S735 WeakPolarHBondContact O-CB 3.37Å; L683-S735 PolarHBondContact O-OG 3.22Å; G684-S735 PolarHBondContact O-OG 3.28Å; I732-S735 WeakPolarHBondContact O-CB 3.43Å; I732-S735 PolarHBondContact O-N 2.83Å; I732-S735 VanDerWaalsContact O-N 3.13Å; I732-S735 PolarHBondContact O-OG 3.1Å; K733-S735 PolarHBondContact O-N 3.46Å; S735-A737 VanDerWaalsContact C-N 3.32Å; S735-A737 PolarHBondContact O-N 2.89Å; S735-A738 PolarHBondContact O-N 2.86Å; S735-A738 PolarHBondContact OG-N 2.98Å; S735-T739 PolarHBondContact O-N 2.9Å; S735-T739 PolarHBondContact O-OG1 3.02Å; S735-T739 VanDerWaalsContact O-OG1 3.09Å
736	I	85.3	Confident	82.7	Confident	22 Å²	22	42.5 Å²	42.5	11%	0.113	24%	0.241	C	C	.	.	H	α-helix	trans	-58.7	-44.5	177.5	-61.3	165.6	0	0	0	110.5	L675 K678 L683 T739 D740	L675-I736 HydrophobicContact CB-CG2 4.36Å; K678-I736 HydrophobicContact CB-CD1 4.23Å; K678-I736 HydrophobicContact CG-CD1 4.13Å; L683-I736 PolarHBondContact O-N 3.04Å; I736-T739 WeakPolarHBondContact CA-OG1 3.25Å; I736-T739 PolarHBondContact O-N 3.14Å; I736-T739 PolarHBondContact O-OG1 3.38Å; I736-D740 VanDerWaalsContact O-CB 3.28Å; I736-D740 WeakPolarHBondContact O-CB 3.09Å; I736-D740 PolarHBondContact O-N 3.41Å
737	A	86.2	Confident	82.8	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-67.1	-36.9	177	0	0	0	0	0	112.9	L675 L683 I685 I731 S735 D740 G741 L743	L675-A737 HydrophobicContact CD1-CB 4.39Å; L683-A737 WeakPolarHBondContact O-CB 3.49Å; L683-A737 PolarHBondContact O-N 3.27Å; I685-A737 HydrophobicContact CG2-CB 3.52Å; I731-A737 HydrophobicContact CG2-CB 3.84Å; S735-A737 VanDerWaalsContact C-N 3.32Å; S735-A737 PolarHBondContact O-N 2.89Å; A737-D740 PolarHBondContact O-N 3.05Å; A737-G741 PolarHBondContact O-N 3.39Å; A737-L743 HydrophobicContact CB-CD1 4.03Å
738	A	83.1	Confident	82.9	Confident	11 Å²	11	42.7 Å²	42.7	9%	0.091	24%	0.241	C	C	.	.	H	α-helix	trans	-68.9	-37.3	175.7	0	0	0	0	0	112.8	Y133 I731 I732 S735	Y133-A738 HydrophobicContact CE2-CB 4.34Å; Y133-A738 PolarHBondContact OH-O 3.03Å; I731-A738 HydrophobicContact CG2-CB 3.96Å; I732-A738 VanDerWaalsContact O-CB 3.25Å; I732-A738 WeakPolarHBondContact O-CB 3.48Å; S735-A738 PolarHBondContact O-N 2.86Å; S735-A738 PolarHBondContact OG-N 2.98Å
739	T	79.3	Confident	83.1	Confident	28 Å²	28	42.7 Å²	42.7	17%	0.172	24%	0.241	C	C	.	.	H	α-helix	trans	-74	-30.4	174.7	52.4	0	0	0	0	113.1	Y133 N136 K137 S735 I736	Y133-T739 HydrophobicContact CD2-CG2 3.77Å; Y133-T739 HydrophobicContact CE2-CG2 3.7Å; N136-T739 VanDerWaalsContact ND2-CB 3.34Å; N136-T739 WeakPolarHBondContact ND2-CB 3.37Å; N136-T739 WeakPolarHBondContact ND2-CG2 3.33Å; K137-T739 WeakPolarHBondContact CA-O 3.23Å; S735-T739 PolarHBondContact O-N 2.9Å; S735-T739 PolarHBondContact O-OG1 3.02Å; S735-T739 VanDerWaalsContact O-OG1 3.09Å; I736-T739 WeakPolarHBondContact CA-OG1 3.25Å; I736-T739 PolarHBondContact O-N 3.14Å; I736-T739 PolarHBondContact O-OG1 3.38Å
740	D	85.9	Confident	83.6	Confident	45 Å²	45	41.1 Å²	41.1	24%	0.241	23%	0.232	C	C	.	.	H	α-helix	trans	-71.8	-37.5	175	-176.4	94.7	0	0	0	111.7	L675 I736 A737 R742	L675-D740 HydrophobicContact CD2-CB 3.53Å; L675-D740 VanDerWaalsContact CD2-OD1 3.28Å; L675-D740 WeakPolarHBondContact CD2-OD1 3.31Å; I736-D740 VanDerWaalsContact O-CB 3.28Å; I736-D740 WeakPolarHBondContact O-CB 3.09Å; I736-D740 PolarHBondContact O-N 3.41Å; A737-D740 PolarHBondContact O-N 3.05Å; D740-R742 PolarHBondContact O-N 3.49Å; D740-R742 IonicContact OD1-CZ 3.32Å; D740-R742 IonicContact OD1-NE 3.22Å; D740-R742 PolarHBondContact OD1-NE 2.75Å; D740-R742 IonicContact OD1-NH2 2.67Å; D740-R742 PolarHBondContact OD1-NH2 3.49Å; D740-R742 VanDerWaalsContact OD2-CB 3.24Å; D740-R742 WeakPolarHBondContact OD2-CB 3.29Å; D740-R742 WeakPolarHBondContact OD2-CG 3.48Å; D740-R742 IonicContact OD2-CZ 3.67Å; D740-R742 PolarHBondContact OD2-N 3.12Å; D740-R742 IonicContact OD2-NE 2.85Å; D740-R742 PolarHBondContact OD2-NE 3.27Å; D740-R742 IonicContact OD2-NH2 3.6Å
741	G	82.1	Confident	84.3	Confident	39 Å²	39	40 Å²	40	40%	0.402	23%	0.226	S	C	.	.			trans	68.3	-8.5	171.8	0	0	0	0	0	116	A737	A737-G741 PolarHBondContact O-N 3.39Å
742	R	84.9	Confident	84.8	Confident	105 Å²	105	38.4 Å²	38.4	40%	0.396	22%	0.218	S	C	.	.			trans	-76.1	-29.3	179.2	-59.4	177.3	-70.5	-176.5	-5.3	112.5	I673 E674 D740 R782	I673-R742 HydrophobicContact CD1-CB 3.75Å; I673-R742 HydrophobicContact CG1-CB 3.92Å; I673-R742 HydrophobicContact CG2-CB 4.36Å; E674-R742 PolarHBondContact O-NH2 2.83Å; D740-R742 PolarHBondContact O-N 3.49Å; D740-R742 IonicContact OD1-CZ 3.32Å; D740-R742 IonicContact OD1-NE 3.22Å; D740-R742 PolarHBondContact OD1-NE 2.75Å; D740-R742 IonicContact OD1-NH2 2.67Å; D740-R742 PolarHBondContact OD1-NH2 3.49Å; D740-R742 VanDerWaalsContact OD2-CB 3.24Å; D740-R742 WeakPolarHBondContact OD2-CB 3.29Å; D740-R742 WeakPolarHBondContact OD2-CG 3.48Å; D740-R742 IonicContact OD2-CZ 3.67Å; D740-R742 PolarHBondContact OD2-N 3.12Å; D740-R742 IonicContact OD2-NE 2.85Å; D740-R742 PolarHBondContact OD2-NE 3.27Å; D740-R742 IonicContact OD2-NH2 3.6Å; R742-R782 PolarHBondContact O-NH1 3.34Å; R742-R782 PolarHBondContact O-NH2 2.91Å
743	L	87.2	Confident	85.3	Confident	5 Å²	5	38.3 Å²	38.3	3%	0.026	22%	0.218	C	C	.	.			trans	-76.7	149	171.6	-68.1	173	0	0	0	111.1	I673 L675 I685 I728 I731 A737 D747 L778 V780	I673-L743 HydrophobicContact CD1-CD2 3.5Å; I673-L743 HydrophobicContact CD1-CG 3.93Å; I673-L743 HydrophobicContact CG2-CD2 4.49Å; I673-L743 HydrophobicContact CG2-CG 4.25Å; L675-L743 HydrophobicContact CD1-CD1 3.84Å; I685-L743 HydrophobicContact CG2-CD1 3.96Å; I728-L743 HydrophobicContact CD1-CB 4.43Å; I728-L743 HydrophobicContact CD1-CD1 4.16Å; I728-L743 HydrophobicContact CD1-CD2 3.84Å; I728-L743 HydrophobicContact CD1-CG 4.38Å; I731-L743 HydrophobicContact CD1-CB 3.7Å; I731-L743 WeakPolarHBondContact CD1-O 3.46Å; A737-L743 HydrophobicContact CB-CD1 4.03Å; L743-D747 WeakPolarHBondContact CA-OD2 3.49Å; L743-L778 HydrophobicContact CD1-CD1 4.02Å; L743-L778 HydrophobicContact CD2-CD1 4.43Å; L743-V780 HydrophobicContact CD2-CG1 3.87Å; L743-V780 HydrophobicContact CD2-CG2 4.21Å
744	M	83	Confident	85.8	Confident	84 Å²	84	34.1 Å²	34.1	41%	0.414	22%	0.219	S	C	.	.			trans	-135.9	161.8	175.7	-65.7	-177.5	74.2	0	0	111.1	D747 R782	M744-D747 PolarHBondContact N-OD2 3.39Å; M744-D747 WeakPolarHBondContact O-CB 3.49Å; M744-D747 VanDerWaalsContact O-CG 3.25Å; M744-D747 PolarHBondContact O-N 3.05Å; M744-R782 PolarHBondContact SD-NH1 2.92Å; M744-R782 VanDerWaalsContact SD-NH1 3.38Å
745	A	80.3	Confident	86.4	Confident	42 Å²	42	37.5 Å²	37.5	35%	0.347	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.9	149.7	167.8	0	0	0	0	0	110.8	I728 D747	I728-A745 CarbonylContact O-C 3.6Å; I728-A745 WeakPolarHBondContact O-CA 3.39Å; A745-D747 VanDerWaalsContact C-N 3.27Å; A745-D747 PolarHBondContact O-N 2.84Å
746	N	78.6	Confident	86.6	Confident	53 Å²	53	41.3 Å²	41.3	28%	0.283	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	71	-2.7	-169.4	-47.4	-66.5	0	0	0	116.3	W666 I728 Q748	W666-N746 WeakPolarHBondContact CH2-O 3.48Å; W666-N746 VanDerWaalsContact CZ2-O 3.29Å; W666-N746 WeakPolarHBondContact CZ2-O 3.08Å; I728-N746 WeakPolarHBondContact O-CA 3.44Å; I728-N746 PolarHBondContact O-N 2.82Å; N746-Q748 PolarHBondContact O-N 2.87Å
747	D	87.3	Confident	86.7	Confident	1 Å²	1	40.2 Å²	40.2	1%	0.005	23%	0.23	C	C	.	.			trans	-56.7	124.8	172	-80.2	-13.5	0	0	0	111	I727 I728 L743 M744 A745 V780 R782	I727-D747 CarbonylContact C-O 3.44Å; I727-D747 WeakPolarHBondContact CA-O 3.49Å; I728-D747 HydrophobicContact CB-CB 4.39Å; I728-D747 HydrophobicContact CD1-CB 4.09Å; I728-D747 HydrophobicContact CG1-CB 4.4Å; I728-D747 PolarHBondContact N-O 3.06Å; L743-D747 WeakPolarHBondContact CA-OD2 3.49Å; M744-D747 PolarHBondContact N-OD2 3.39Å; M744-D747 WeakPolarHBondContact O-CB 3.49Å; M744-D747 VanDerWaalsContact O-CG 3.25Å; M744-D747 PolarHBondContact O-N 3.05Å; A745-D747 VanDerWaalsContact C-N 3.27Å; A745-D747 PolarHBondContact O-N 2.84Å; D747-V780 HydrophobicContact CB-CB 4.18Å; D747-V780 HydrophobicContact CB-CG2 4.43Å; D747-R782 VanDerWaalsContact CG-NH2 3.27Å; D747-R782 IonicContact OD1-CZ 3.5Å; D747-R782 IonicContact OD1-NE 3.31Å; D747-R782 PolarHBondContact OD1-NE 2.87Å; D747-R782 IonicContact OD1-NH2 2.74Å; D747-R782 PolarHBondContact OD1-NH2 3.45Å; D747-R782 IonicContact OD2-CZ 3.6Å; D747-R782 IonicContact OD2-NE 3.82Å; D747-R782 IonicContact OD2-NH2 2.67Å; D747-R782 PolarHBondContact OD2-NH2 3.04Å
748	Q	88.4	Confident	86.3	Confident	4 Å²	4	41.6 Å²	41.6	2%	0.019	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	129.5	170.5	-177.8	177.4	-7.6	0	0	110.1	W666 R690 V726 I727 N746 L750 V780 G781	W666-Q748 HydrophobicContact CZ2-CB 3.76Å; R690-Q748 VanDerWaalsContact NH2-OE1 3.15Å; V726-Q748 CarbonylContact O-C 3.56Å; V726-Q748 WeakPolarHBondContact O-CA 3.4Å; V726-Q748 WeakPolarHBondContact O-CG 3.17Å; I727-Q748 HydrophobicContact CG2-CB 4.08Å; I727-Q748 HydrophobicContact CG2-CG 4.43Å; N746-Q748 PolarHBondContact O-N 2.87Å; Q748-L750 HydrophobicContact CB-CD2 4.34Å; Q748-L750 HydrophobicContact CG-CD2 3.9Å; Q748-L750 PolarHBondContact O-N 2.83Å; Q748-V780 CarbonylContact O-C 3.57Å; Q748-V780 WeakPolarHBondContact O-CA 3.21Å; Q748-V780 WeakPolarHBondContact O-CB 3.08Å; Q748-G781 PolarHBondContact N-O 3.07Å; Q748-G781 PolarHBondContact O-N 2.92Å
749	I	92	Very high	86	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	112.9	174.5	-51.3	-179.3	0	0	0	108.7	I685 I687 V726 I728 V752 T757 V765	I685-I749 HydrophobicContact CD1-CD1 4.33Å; I687-I749 HydrophobicContact CG2-CD1 3.78Å; V726-I749 HydrophobicContact CG1-CD1 4.39Å; V726-I749 PolarHBondContact O-N 3.26Å; I728-I749 HydrophobicContact CD1-CG1 4.5Å; I728-I749 HydrophobicContact CG1-CD1 4.13Å; I728-I749 HydrophobicContact CG1-CG1 4.14Å; I749-V752 HydrophobicContact CG2-CG2 3.59Å; I749-T757 PolarHBondContact O-OG1 2.92Å; I749-V765 HydrophobicContact CD1-CG1 4.07Å; I749-V765 HydrophobicContact CG2-CG1 4.32Å
750	L	91.2	Very high	86.2	Confident	7 Å²	7	46.4 Å²	46.4	4%	0.037	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	-44	-177.1	-54.2	179.2	0	0	0	111.8	Y667 E670 Q748 T757 S758 K779	Y667-L750 HydrophobicContact CD2-CD1 4.42Å; Y667-L750 HydrophobicContact CE1-CD1 4.33Å; Y667-L750 HydrophobicContact CE1-CD2 3.64Å; Y667-L750 HydrophobicContact CE2-CD1 3.61Å; Y667-L750 HydrophobicContact CE2-CD2 4.42Å; Y667-L750 WeakPolarHBondContact OH-CD2 3.45Å; E670-L750 HydrophobicContact CG-CD1 3.9Å; Q748-L750 HydrophobicContact CB-CD2 4.34Å; Q748-L750 HydrophobicContact CG-CD2 3.9Å; Q748-L750 PolarHBondContact O-N 2.83Å; L750-T757 PolarHBondContact O-N 2.87Å; L750-T757 PolarHBondContact O-OG1 2.87Å; L750-T757 VanDerWaalsContact O-OG1 3.13Å; L750-S758 PolarHBondContact O-N 2.93Å; L750-K779 WeakPolarHBondContact CA-O 3.11Å; L750-K779 HydrophobicContact CB-CG 4.42Å; L750-K779 WeakPolarHBondContact CB-O 3.43Å; L750-K779 PolarHBondContact N-O 2.91Å
751	E	93.1	Very high	86.2	Confident	63 Å²	63	45.8 Å²	45.8	29%	0.294	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	144.3	176.2	-56.5	165.7	-149.9	0	0	111.1	K755 T757 L778 K779	E751-K755 CarbonylContact C-O 3.24Å; E751-K755 WeakPolarHBondContact CA-O 3.38Å; E751-K755 WeakPolarHBondContact CB-O 3.49Å; E751-T757 PolarHBondContact N-OG1 3.07Å; E751-L778 WeakPolarHBondContact O-CA 3.46Å; E751-K779 HydrophobicContact CB-CB 3.81Å; E751-K779 HydrophobicContact CB-CD 4.38Å; E751-K779 HydrophobicContact CG-CB 4.25Å; E751-K779 HydrophobicContact CG-CD 3.92Å; E751-K779 PolarHBondContact N-O 2.86Å; E751-K779 VanDerWaalsContact N-O 3.17Å; E751-K779 PolarHBondContact O-N 2.78Å; E751-K779 WeakPolarHBondContact OE1-CD 3.18Å; E751-K779 WeakPolarHBondContact OE1-CE 3.39Å; E751-K779 IonicContact OE1-NZ 2.71Å; E751-K779 PolarHBondContact OE1-NZ 3.26Å
752	V	93.2	Very high	86.4	Confident	3 Å²	3	45 Å²	45	2%	0.018	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	114.6	172.3	178.6	0	0	0	0	108.9	I749 G754 K755 T757 V765 L768 L769 V776 L778	I749-V752 HydrophobicContact CG2-CG2 3.59Å; V752-G754 PolarHBondContact O-N 3.35Å; V752-K755 PolarHBondContact N-O 3.2Å; V752-K755 WeakPolarHBondContact O-CB 3.4Å; V752-K755 PolarHBondContact O-N 2.97Å; V752-T757 HydrophobicContact CB-CG2 4.03Å; V752-T757 HydrophobicContact CG2-CG2 3.75Å; V752-V765 HydrophobicContact CG2-CG1 4.28Å; V752-L768 HydrophobicContact CG1-CB 4.22Å; V752-L769 HydrophobicContact CG1-CD2 3.83Å; V752-L769 HydrophobicContact CG1-CG 4.46Å; V752-L769 HydrophobicContact CG2-CD2 4.09Å; V752-V776 HydrophobicContact CG1-CG1 4.37Å; V752-L778 HydrophobicContact CB-CD2 4.46Å; V752-L778 HydrophobicContact CG1-CD2 4.25Å; V752-L778 HydrophobicContact CG2-CD2 3.9Å
753	N	91.5	Very high	86.4	Confident	65 Å²	65	46.2 Å²	46.2	35%	0.348	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.3	41.8	-175.1	-69.4	-28.2	0	0	0	113.2	K755 A772 V776 V777	N753-K755 VanDerWaalsContact C-N 3.26Å; N753-K755 PolarHBondContact O-N 2.8Å; N753-A772 WeakPolarHBondContact ND2-CB 3.44Å; N753-V776 WeakPolarHBondContact OD1-CA 3.36Å; N753-V777 PolarHBondContact N-O 2.99Å; N753-V777 PolarHBondContact OD1-N 3.12Å
754	G	87.7	Confident	86.4	Confident	65 Å²	65	49.8 Å²	49.8	67%	0.67	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.8	8.6	-179.9	0	0	0	0	0	115.2	V752	V752-G754 PolarHBondContact O-N 3.35Å
755	K	89.8	Confident	86.7	Confident	129 Å²	129	45.8 Å²	45.8	56%	0.561	26%	0.261	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.8	127.6	164.3	-64.3	-178.1	176.8	-175.3	0	109.1	E751 V752 N753 T757 L768	E751-K755 CarbonylContact C-O 3.24Å; E751-K755 WeakPolarHBondContact CA-O 3.38Å; E751-K755 WeakPolarHBondContact CB-O 3.49Å; V752-K755 PolarHBondContact N-O 3.2Å; V752-K755 WeakPolarHBondContact O-CB 3.4Å; V752-K755 PolarHBondContact O-N 2.97Å; N753-K755 VanDerWaalsContact C-N 3.26Å; N753-K755 PolarHBondContact O-N 2.8Å; K755-T757 PolarHBondContact O-N 2.84Å; K755-L768 HydrophobicContact CD-CD2 3.82Å
756	D	88.7	Confident	87.1	Confident	96 Å²	96	44.9 Å²	44.9	51%	0.513	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.8	133.6	169.5	-178.1	12.3	0	0	0	110.6	S758	D756-S758 VanDerWaalsContact CG-OG 3.31Å; D756-S758 WeakPolarHBondContact OD1-CB 3.42Å; D756-S758 PolarHBondContact OD1-N 2.85Å; D756-S758 PolarHBondContact OD1-OG 2.7Å; D756-S758 PolarHBondContact OD2-OG 3.03Å
757	T	86.9	Confident	87.5	Confident	0 Å²	0	45 Å²	45	0%	0	27%	0.265	C	S	.	.			trans	-125.4	2.7	177.8	58.9	0	0	0	0	112.9	I749 L750 E751 V752 K755 T759 L760 V765 L768	I749-T757 PolarHBondContact O-OG1 2.92Å; L750-T757 PolarHBondContact O-N 2.87Å; L750-T757 PolarHBondContact O-OG1 2.87Å; L750-T757 VanDerWaalsContact O-OG1 3.13Å; E751-T757 PolarHBondContact N-OG1 3.07Å; V752-T757 HydrophobicContact CB-CG2 4.03Å; V752-T757 HydrophobicContact CG2-CG2 3.75Å; K755-T757 PolarHBondContact O-N 2.84Å; T757-T759 PolarHBondContact O-N 3.2Å; T757-T759 VanDerWaalsContact O-N 3.08Å; T757-L760 HydrophobicContact CG2-CD1 4.13Å; T757-L760 PolarHBondContact O-N 3.07Å; T757-V765 HydrophobicContact CG2-CG2 3.91Å; T757-L768 HydrophobicContact CG2-CD1 3.91Å
758	S	78.6	Confident	87.5	Confident	29 Å²	29	46.7 Å²	46.7	20%	0.203	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-26.7	-173.6	61.7	0	0	0	0	114.9	G725 L750 D756	G725-S758 WeakPolarHBondContact CA-O 3.21Å; G725-S758 PolarHBondContact N-O 2.93Å; L750-S758 PolarHBondContact O-N 2.93Å; D756-S758 VanDerWaalsContact CG-OG 3.31Å; D756-S758 WeakPolarHBondContact OD1-CB 3.42Å; D756-S758 PolarHBondContact OD1-N 2.85Å; D756-S758 PolarHBondContact OD1-OG 2.7Å; D756-S758 PolarHBondContact OD2-OG 3.03Å
759	T	76.7	Confident	87.6	Confident	91 Å²	91	47.4 Å²	47.4	56%	0.558	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.2	1.1	-177.1	50.3	0	0	0	0	113.9	T757	T757-T759 PolarHBondContact O-N 3.2Å; T757-T759 VanDerWaalsContact O-N 3.08Å
760	L	83.9	Confident	87.2	Confident	48 Å²	48	54.2 Å²	54.2	25%	0.251	31%	0.307	S	S	.	.	S	Bend	trans	-84	169	-176.7	-60.8	-177.1	0	0	0	112.1	S723 T757 I764 V765 L768	S723-L760 PolarHBondContact OG-O 3.26Å; T757-L760 HydrophobicContact CG2-CD1 4.13Å; T757-L760 PolarHBondContact O-N 3.07Å; L760-I764 HydrophobicContact CB-CB 4.43Å; L760-I764 HydrophobicContact CB-CG2 4.47Å; L760-I764 HydrophobicContact CD1-CG2 3.88Å; L760-V765 HydrophobicContact CB-CG2 4.01Å; L760-L768 HydrophobicContact CD1-CD1 4.19Å
761	T	86.1	Confident	86.9	Confident	32 Å²	32	58 Å²	58	20%	0.196	34%	0.339	C	S	.	.			trans	-88.5	157.9	172.1	60.8	0	0	0	0	112.4	D689 E763 I764 V765	D689-T761 WeakPolarHBondContact OD1-CA 3.3Å; T761-E763 PolarHBondContact O-N 2.86Å; T761-I764 PolarHBondContact O-N 3.4Å; T761-I764 WeakPolarHBondContact OG1-CD1 3.42Å; T761-I764 WeakPolarHBondContact OG1-CG1 3.33Å; T761-V765 WeakPolarHBondContact O-CG2 3.4Å; T761-V765 PolarHBondContact O-N 3.21Å
762	S	85.8	Confident	86.4	Confident	24 Å²	24	55.4 Å²	55.4	17%	0.168	33%	0.329	C	S	.	.	H	α-helix	trans	-60.2	-29.1	177.6	64.9	0	0	0	0	112.7	I687 D689 G766	I687-S762 WeakPolarHBondContact CD1-O 3.37Å; D689-S762 PolarHBondContact OD1-N 2.87Å; D689-S762 WeakPolarHBondContact OD2-CB 3.36Å; D689-S762 PolarHBondContact OD2-N 2.84Å; D689-S762 PolarHBondContact OD2-OG 3.35Å; S762-G766 WeakPolarHBondContact O-CA 3.38Å; S762-G766 PolarHBondContact O-N 3.22Å
763	E	84.5	Confident	85.6	Confident	129 Å²	129	59.2 Å²	59.2	60%	0.603	35%	0.353	S	S	*	.	H	α-helix	trans	-62.1	-48.9	170.4	-58.9	-173.6	155.8	0	0	111.9	T761 G766 A767	T761-E763 PolarHBondContact O-N 2.86Å; E763-G766 PolarHBondContact O-N 2.83Å; E763-A767 WeakPolarHBondContact O-CB 3.42Å; E763-A767 PolarHBondContact O-N 3Å
764	I	87.3	Confident	85.1	Confident	80 Å²	80	64.3 Å²	64.3	41%	0.41	37%	0.369	S	S	.	.	H	α-helix	trans	-70.1	-41.9	-178.6	-59.8	168.3	0	0	0	110.1	L760 T761 A767 L768	L760-I764 HydrophobicContact CB-CB 4.43Å; L760-I764 HydrophobicContact CB-CG2 4.47Å; L760-I764 HydrophobicContact CD1-CG2 3.88Å; T761-I764 PolarHBondContact O-N 3.4Å; T761-I764 WeakPolarHBondContact OG1-CD1 3.42Å; T761-I764 WeakPolarHBondContact OG1-CG1 3.33Å; I764-A767 PolarHBondContact O-N 2.73Å; I764-L768 WeakPolarHBondContact O-CG 3.35Å; I764-L768 PolarHBondContact O-N 2.83Å
765	V	90.1	Very high	85.1	Confident	0 Å²	0	65.4 Å²	65.4	0%	0	36%	0.355	C	S	.	.	H	α-helix	trans	-65.3	-42.7	175.5	177.1	0	0	0	0	110.8	I687 V726 I749 V752 T757 L760 T761 A767 L768 L769	I687-V765 HydrophobicContact CD1-CB 4.48Å; I687-V765 HydrophobicContact CD1-CG1 4.31Å; V726-V765 HydrophobicContact CB-CB 4.42Å; V726-V765 HydrophobicContact CB-CG1 4.5Å; V726-V765 HydrophobicContact CB-CG2 4.17Å; V726-V765 HydrophobicContact CG1-CB 4.34Å; V726-V765 HydrophobicContact CG1-CG1 4.25Å; V726-V765 HydrophobicContact CG2-CB 4.04Å; V726-V765 HydrophobicContact CG2-CG2 3.6Å; I749-V765 HydrophobicContact CD1-CG1 4.07Å; I749-V765 HydrophobicContact CG2-CG1 4.32Å; V752-V765 HydrophobicContact CG2-CG1 4.28Å; T757-V765 HydrophobicContact CG2-CG2 3.91Å; L760-V765 HydrophobicContact CB-CG2 4.01Å; T761-V765 WeakPolarHBondContact O-CG2 3.4Å; T761-V765 PolarHBondContact O-N 3.21Å; V765-A767 VanDerWaalsContact C-N 3.33Å; V765-A767 PolarHBondContact O-N 2.79Å; V765-L768 WeakPolarHBondContact O-CB 3.39Å; V765-L768 PolarHBondContact O-N 3.29Å; V765-L769 HydrophobicContact CG1-CD1 4.04Å; V765-L769 HydrophobicContact CG1-CG 4.42Å; V765-L769 VanDerWaalsContact O-CG 3.24Å; V765-L769 WeakPolarHBondContact O-CG 3.32Å; V765-L769 PolarHBondContact O-N 3.3Å
766	G	88.1	Confident	85.2	Confident	23 Å²	23	59.2 Å²	59.2	24%	0.237	33%	0.329	C	S	.	.	H	α-helix	trans	-58.8	-41.6	172.3	0	0	0	0	0	112.6	S762 E763 L769 K770	S762-G766 WeakPolarHBondContact O-CA 3.38Å; S762-G766 PolarHBondContact O-N 3.22Å; E763-G766 PolarHBondContact O-N 2.83Å; G766-L769 PolarHBondContact O-N 3.3Å; G766-K770 VanDerWaalsContact O-CB 3.3Å; G766-K770 WeakPolarHBondContact O-CB 3.4Å; G766-K770 PolarHBondContact O-N 3.02Å
767	A	86.5	Confident	85.4	Confident	57 Å²	57	56.5 Å²	56.5	47%	0.471	32%	0.315	S	S	.	.	H	α-helix	trans	-64.4	-41.4	173.9	0	0	0	0	0	112.4	E763 I764 V765 K770 A771	E763-A767 WeakPolarHBondContact O-CB 3.42Å; E763-A767 PolarHBondContact O-N 3Å; I764-A767 PolarHBondContact O-N 2.73Å; V765-A767 VanDerWaalsContact C-N 3.33Å; V765-A767 PolarHBondContact O-N 2.79Å; A767-K770 PolarHBondContact O-N 3.04Å; A767-A771 VanDerWaalsContact O-CB 3.27Å; A767-A771 WeakPolarHBondContact O-CB 3.2Å; A767-A771 PolarHBondContact O-N 2.81Å
768	L	88.3	Confident	85.8	Confident	36 Å²	36	56.5 Å²	56.5	19%	0.188	32%	0.315	C	S	.	.	H	α-helix	trans	-62.4	-44.1	174	-72	173.5	0	0	0	111.8	V752 K755 T757 L760 I764 V765 A771 A772	V752-L768 HydrophobicContact CG1-CB 4.22Å; K755-L768 HydrophobicContact CD-CD2 3.82Å; T757-L768 HydrophobicContact CG2-CD1 3.91Å; L760-L768 HydrophobicContact CD1-CD1 4.19Å; I764-L768 WeakPolarHBondContact O-CG 3.35Å; I764-L768 PolarHBondContact O-N 2.83Å; V765-L768 WeakPolarHBondContact O-CB 3.39Å; V765-L768 PolarHBondContact O-N 3.29Å; L768-A771 PolarHBondContact O-N 2.88Å; L768-A772 WeakPolarHBondContact O-CB 3.43Å; L768-A772 PolarHBondContact O-N 2.95Å
769	L	89	Confident	86.5	Confident	19 Å²	19	57.4 Å²	57.4	10%	0.099	32%	0.315	C	S	.	.	H	α-helix	trans	-65.8	-36	175.8	-64.8	169	0	0	0	112.1	K677 L683 I685 I687 V752 V765 G766 V776 L778	K677-L769 PolarHBondContact NZ-O 2.78Å; L683-L769 HydrophobicContact CD1-CD2 3.98Å; I685-L769 HydrophobicContact CD1-CD1 4.18Å; I687-L769 HydrophobicContact CD1-CD1 4.27Å; V752-L769 HydrophobicContact CG1-CD2 3.83Å; V752-L769 HydrophobicContact CG1-CG 4.46Å; V752-L769 HydrophobicContact CG2-CD2 4.09Å; V765-L769 HydrophobicContact CG1-CD1 4.04Å; V765-L769 HydrophobicContact CG1-CG 4.42Å; V765-L769 VanDerWaalsContact O-CG 3.24Å; V765-L769 WeakPolarHBondContact O-CG 3.32Å; V765-L769 PolarHBondContact O-N 3.3Å; G766-L769 PolarHBondContact O-N 3.3Å; L769-V776 HydrophobicContact CD2-CG1 4.01Å; L769-L778 HydrophobicContact CD2-CD2 3.57Å
770	K	84.5	Confident	87.2	Confident	142 Å²	142	53 Å²	53	62%	0.617	29%	0.289	S	S	*	.	H	α-helix	trans	-69.8	-41.1	175.5	-168	168.7	-175.3	171.9	0	111.8	K677 G766 A767	K677-K770 PolarHBondContact NZ-O 3.29Å; G766-K770 VanDerWaalsContact O-CB 3.3Å; G766-K770 WeakPolarHBondContact O-CB 3.4Å; G766-K770 PolarHBondContact O-N 3.02Å; A767-K770 PolarHBondContact O-N 3.04Å
771	A	84.9	Confident	87.5	Confident	86 Å²	86	50.8 Å²	50.8	71%	0.711	28%	0.277	S	S	*	.	H	α-helix	trans	-76.9	-18	176.7	0	0	0	0	0	114.4	A767 L768	A767-A771 VanDerWaalsContact O-CB 3.27Å; A767-A771 WeakPolarHBondContact O-CB 3.2Å; A767-A771 PolarHBondContact O-N 2.81Å; L768-A771 PolarHBondContact O-N 2.88Å
772	A	81.9	Confident	87.5	Confident	10 Å²	10	51.2 Å²	51.2	8%	0.083	28%	0.275	C	S	.	.			trans	-59	142.8	179	0	0	0	0	0	112.4	K677 N753 L768 V776	K677-A772 PolarHBondContact NZ-O 3.38Å; N753-A772 WeakPolarHBondContact ND2-CB 3.44Å; L768-A772 WeakPolarHBondContact O-CB 3.43Å; L768-A772 PolarHBondContact O-N 2.95Å; A772-V776 HydrophobicContact CB-CB 4.48Å; A772-V776 HydrophobicContact CB-CG1 4.12Å; A772-V776 HydrophobicContact CB-CG2 3.75Å
773	P	76	Confident	87.3	Confident	82 Å²	82	50.3 Å²	50.3	53%	0.532	27%	0.268	S	S	.	.			trans	-74.1	-167.8	-179.5	33.4	-36.8	0	0	0	112	K775	P773-K775 PolarHBondContact O-N 3.47Å
774	Y	81.9	Confident	86.9	Confident	173 Å²	173	47.4 Å²	47.4	68%	0.678	25%	0.254	S	S	*	.	S	Bend	trans	-53.3	-20.2	178.1	-64	-76.8	0	0	0	115.3	L676 K677	L676-Y774 CarbonylContact C-O 3.52Å; L676-Y774 WeakPolarHBondContact CA-O 3.26Å; K677-Y774 PolarHBondContact N-O 2.87Å
775	K	88.3	Confident	86	Confident	87 Å²	87	48.6 Å²	48.6	38%	0.378	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	132.2	171.1	178.2	169.7	168.3	167.7	0	109.5	E674 L676 P773 V777	E674-K775 WeakPolarHBondContact OE1-CE 3.48Å; E674-K775 IonicContact OE1-NZ 2.68Å; E674-K775 PolarHBondContact OE1-NZ 3.33Å; E674-K775 VanDerWaalsContact OE2-CE 3.26Å; E674-K775 WeakPolarHBondContact OE2-CE 3.47Å; E674-K775 IonicContact OE2-NZ 2.65Å; E674-K775 PolarHBondContact OE2-NZ 2.86Å; L676-K775 HydrophobicContact CD2-CB 4.31Å; P773-K775 PolarHBondContact O-N 3.47Å; K775-V777 HydrophobicContact CG-CG2 4.36Å
776	V	91.8	Very high	85.2	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	115.7	173.8	-164.8	0	0	0	0	108.2	L675 K677 L683 V752 N753 L769 A772 L778	L675-V776 PolarHBondContact N-O 2.87Å; L675-V776 PolarHBondContact O-N 2.74Å; K677-V776 HydrophobicContact CB-CG2 4.02Å; K677-V776 HydrophobicContact CD-CG2 4.05Å; L683-V776 HydrophobicContact CD1-CB 4.39Å; L683-V776 HydrophobicContact CD1-CG1 4.24Å; L683-V776 HydrophobicContact CD1-CG2 4.33Å; L683-V776 HydrophobicContact CD2-CG2 4.09Å; V752-V776 HydrophobicContact CG1-CG1 4.37Å; N753-V776 WeakPolarHBondContact OD1-CA 3.36Å; L769-V776 HydrophobicContact CD2-CG1 4.01Å; A772-V776 HydrophobicContact CB-CB 4.48Å; A772-V776 HydrophobicContact CB-CG1 4.12Å; A772-V776 HydrophobicContact CB-CG2 3.75Å; V776-L778 HydrophobicContact CG1-CD2 3.74Å; V776-L778 HydrophobicContact CG1-CG 4.23Å
777	V	92.9	Very high	84	Confident	38 Å²	38	52.7 Å²	52.7	23%	0.23	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	120.3	171.9	-175.6	0	0	0	0	107.7	I672 E674 N753 K775	I672-V777 HydrophobicContact CG2-CG1 3.78Å; E674-V777 HydrophobicContact CG-CG1 4.43Å; E674-V777 HydrophobicContact CG-CG2 4.15Å; N753-V777 PolarHBondContact N-O 2.99Å; N753-V777 PolarHBondContact OD1-N 3.12Å; K775-V777 HydrophobicContact CG-CG2 4.36Å
778	L	93.8	Very high	82.6	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	131.1	176.6	-57	178.5	0	0	0	108.6	I672 I673 L675 L743 E751 V752 L769 V776 V780	I672-L778 WeakPolarHBondContact CA-O 3.33Å; I673-L778 PolarHBondContact N-O 2.89Å; I673-L778 PolarHBondContact O-N 3.24Å; L675-L778 HydrophobicContact CD1-CD1 4.19Å; L743-L778 HydrophobicContact CD1-CD1 4.02Å; L743-L778 HydrophobicContact CD2-CD1 4.43Å; E751-L778 WeakPolarHBondContact O-CA 3.46Å; V752-L778 HydrophobicContact CB-CD2 4.46Å; V752-L778 HydrophobicContact CG1-CD2 4.25Å; V752-L778 HydrophobicContact CG2-CD2 3.9Å; L769-L778 HydrophobicContact CD2-CD2 3.57Å; V776-L778 HydrophobicContact CG1-CD2 3.74Å; V776-L778 HydrophobicContact CG1-CG 4.23Å; L778-V780 HydrophobicContact CB-CG1 4.32Å
779	K	93.9	Very high	80.9	Confident	48 Å²	48	53.2 Å²	53.2	21%	0.209	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	123.8	162.6	-170.7	-174.2	174.4	-176.7	0	107.8	E670 L671 I672 L750 E751	E670-K779 WeakPolarHBondContact OE2-CE 3.08Å; E670-K779 IonicContact OE2-NZ 3.21Å; E670-K779 PolarHBondContact OE2-NZ 2.82Å; L671-K779 CarbonylContact O-C 3.51Å; L671-K779 VanDerWaalsContact O-CA 3.3Å; L671-K779 WeakPolarHBondContact O-CA 3.4Å; I672-K779 HydrophobicContact CG1-CG 4.22Å; L750-K779 WeakPolarHBondContact CA-O 3.11Å; L750-K779 HydrophobicContact CB-CG 4.42Å; L750-K779 WeakPolarHBondContact CB-O 3.43Å; L750-K779 PolarHBondContact N-O 2.91Å; E751-K779 HydrophobicContact CB-CB 3.81Å; E751-K779 HydrophobicContact CB-CD 4.38Å; E751-K779 HydrophobicContact CG-CB 4.25Å; E751-K779 HydrophobicContact CG-CD 3.92Å; E751-K779 PolarHBondContact N-O 2.86Å; E751-K779 VanDerWaalsContact N-O 3.17Å; E751-K779 PolarHBondContact O-N 2.78Å; E751-K779 WeakPolarHBondContact OE1-CD 3.18Å; E751-K779 WeakPolarHBondContact OE1-CE 3.39Å; E751-K779 IonicContact OE1-NZ 2.71Å; E751-K779 PolarHBondContact OE1-NZ 3.26Å
780	V	92.3	Very high	78.7	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	145.6	-177.6	-58.4	0	0	0	0	112.2	E670 L671 I673 L743 D747 Q748 L778	E670-V780 WeakPolarHBondContact CA-O 3.47Å; L671-V780 HydrophobicContact CB-CG2 3.86Å; L671-V780 PolarHBondContact N-O 2.59Å; L671-V780 PolarHBondContact O-N 3.03Å; I673-V780 HydrophobicContact CD1-CG2 3.96Å; L743-V780 HydrophobicContact CD2-CG1 3.87Å; L743-V780 HydrophobicContact CD2-CG2 4.21Å; D747-V780 HydrophobicContact CB-CB 4.18Å; D747-V780 HydrophobicContact CB-CG2 4.43Å; Q748-V780 CarbonylContact O-C 3.57Å; Q748-V780 WeakPolarHBondContact O-CA 3.21Å; Q748-V780 WeakPolarHBondContact O-CB 3.08Å; L778-V780 HydrophobicContact CB-CG1 4.32Å
781	G	89.3	Confident	76.5	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	124.4	173	0	0	0	0	0	110.7	Q669 Q748	Q669-G781 WeakPolarHBondContact O-CA 3.24Å; Q748-G781 PolarHBondContact N-O 3.07Å; Q748-G781 PolarHBondContact O-N 2.92Å
782	R	86.6	Confident	74	Confident	42 Å²	42	53.7 Å²	53.7	16%	0.158	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	146.9	177	-175.3	174.6	-61.4	158.2	12.1	111	Y667 D668 Q669 R742 M744 D747	Y667-R782 WeakPolarHBondContact CB-O 3.4Å; D668-R782 PolarHBondContact N-O 3.34Å; Q669-R782 WeakPolarHBondContact CB-O 3.46Å; Q669-R782 PolarHBondContact N-O 2.95Å; Q669-R782 PolarHBondContact O-N 2.83Å; R742-R782 PolarHBondContact O-NH1 3.34Å; R742-R782 PolarHBondContact O-NH2 2.91Å; M744-R782 PolarHBondContact SD-NH1 2.92Å; M744-R782 VanDerWaalsContact SD-NH1 3.38Å; D747-R782 VanDerWaalsContact CG-NH2 3.27Å; D747-R782 IonicContact OD1-CZ 3.5Å; D747-R782 IonicContact OD1-NE 3.31Å; D747-R782 PolarHBondContact OD1-NE 2.87Å; D747-R782 IonicContact OD1-NH2 2.74Å; D747-R782 PolarHBondContact OD1-NH2 3.45Å; D747-R782 IonicContact OD2-CZ 3.6Å; D747-R782 IonicContact OD2-NE 3.82Å; D747-R782 IonicContact OD2-NH2 2.67Å; D747-R782 PolarHBondContact OD2-NH2 3.04Å
783	L	81.3	Confident	71.8	Confident	4 Å²	4	55 Å²	55	2%	0.021	30%	0.299	C	S	.	.			trans	-93.6	119.6	169.6	-177.6	59.6	0	0	0	109.5	I567 T572 A573 L574 W666 D668 Q786	I567-L783 HydrophobicContact CD1-CD2 4.43Å; T572-L783 HydrophobicContact CG2-CD2 3.9Å; T572-L783 HydrophobicContact CG2-CG 4.05Å; A573-L783 HydrophobicContact CB-CD1 4.17Å; L574-L783 HydrophobicContact CD1-CD2 3.57Å; L574-L783 HydrophobicContact CG-CD1 4.3Å; L574-L783 HydrophobicContact CG-CD2 3.93Å; W666-L783 HydrophobicContact CE3-CB 3.85Å; W666-L783 HydrophobicContact CE3-CD2 4.37Å; W666-L783 HydrophobicContact CZ3-CB 3.54Å; D668-L783 HydrophobicContact CB-CD1 4.5Å; L783-Q786 HydrophobicContact CB-CB 4.11Å; L783-Q786 HydrophobicContact CD2-CB 4.37Å; L783-Q786 HydrophobicContact CG-CB 4.2Å; L783-Q786 VanDerWaalsContact O-CB 3.27Å; L783-Q786 WeakPolarHBondContact O-CB 3.35Å; L783-Q786 PolarHBondContact O-N 2.92Å
784	K	76.9	Confident	70	Confident	69 Å²	69	52.5 Å²	52.5	30%	0.3	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	151.9	174	-69.4	159.4	-175.9	134.4	0	110.3	D668 Q669 Q786	D668-K784 PolarHBondContact O-NZ 3.05Å; D668-K784 WeakPolarHBondContact OD1-CB 3.11Å; D668-K784 WeakPolarHBondContact OD1-CD 3.17Å; D668-K784 VanDerWaalsContact OD1-CG 3.24Å; D668-K784 WeakPolarHBondContact OD1-CG 3.36Å; D668-K784 PolarHBondContact OD1-N 3.41Å; Q669-K784 HydrophobicContact CB-CD 4.5Å; Q669-K784 HydrophobicContact CB-CG 4.16Å; K784-Q786 PolarHBondContact O-N 2.83Å
785	N	68.4	Low	68	Low	104 Å²	104	49 Å²	49	56%	0.556	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.2	2.8	-178.5	-50.9	-20.1	0	0	0	115.2	E571 I787	E571-N785 HydrophobicContact CB-CB 4.47Å; E571-N785 WeakPolarHBondContact O-CB 3.32Å; E571-N785 PolarHBondContact O-ND2 2.78Å; N785-I787 PolarHBondContact O-N 3.23Å
786	Q	72.4	Confident	65.9	Low	34 Å²	34	45.8 Å²	45.8	16%	0.159	26%	0.261	C	S	.	.			trans	-60.2	109.3	173.9	177.1	55.4	71.8	0	0	108.7	L783 K784 A788	L783-Q786 HydrophobicContact CB-CB 4.11Å; L783-Q786 HydrophobicContact CD2-CB 4.37Å; L783-Q786 HydrophobicContact CG-CB 4.2Å; L783-Q786 VanDerWaalsContact O-CB 3.27Å; L783-Q786 WeakPolarHBondContact O-CB 3.35Å; L783-Q786 PolarHBondContact O-N 2.92Å; K784-Q786 PolarHBondContact O-N 2.83Å; Q786-A788 PolarHBondContact O-N 3.4Å; Q786-A788 VanDerWaalsContact O-N 3.14Å
787	I	64.1	Low	63.8	Low	76 Å²	76	46 Å²	46	39%	0.39	26%	0.262	S	S	.	.			trans	-59	122	174.5	-59.8	176.5	0	0	0	107.3	E571 N785 I789	E571-I787 WeakPolarHBondContact OE1-CD1 3.28Å; N785-I787 PolarHBondContact O-N 3.23Å; I787-I789 PolarHBondContact O-N 3.05Å
788	A	56	Low	61.1	Low	68 Å²	68	47.8 Å²	47.8	56%	0.562	27%	0.27	S	S	*	.			trans	-71.8	84.2	172.8	0	0	0	0	0	108.6	Q786 P790	Q786-A788 PolarHBondContact O-N 3.4Å; Q786-A788 VanDerWaalsContact O-N 3.14Å; A788-P790 WeakPolarHBondContact O-CD 3.37Å
789	I	53	Low	58.6	Low	35 Å²	35	50.5 Å²	50.5	18%	0.179	29%	0.285	C	S	.	.			trans	-60.4	121.6	172	-61.2	-170.9	0	0	0	107.3	F613 M617 I787 A793	F613-I789 HydrophobicContact CD1-CD1 3.79Å; F613-I789 HydrophobicContact CD1-CG1 4.19Å; F613-I789 HydrophobicContact CE1-CD1 3.22Å; F613-I789 HydrophobicContact CE1-CG1 3.76Å; F613-I789 HydrophobicContact CZ-CD1 3.95Å; M617-I789 HydrophobicContact CG-CD1 3.99Å; I787-I789 PolarHBondContact O-N 3.05Å; I789-A793 HydrophobicContact CG2-CB 3.37Å
790	P	42.1	Very low	55.8	Low	88 Å²	88	50.1 Å²	50.1	57%	0.571	29%	0.287	S	S	*	.			trans	-59.8	144.9	171	25.4	-33.1	0	0	0	109.1	A788 S792 A793	A788-P790 WeakPolarHBondContact O-CD 3.37Å; P790-S792 PolarHBondContact O-N 3.08Å; P790-S792 PolarHBondContact O-OG 3.11Å; P790-A793 PolarHBondContact O-N 2.9Å
791	N	39.6	Very low	53.1	Low	82 Å²	82	58 Å²	58	44%	0.439	32%	0.318	S	S	.	.	G	3₁₀ helix	trans	-51.5	-21.1	-168.6	-64.8	4.2	0	0	0	114.3	A793 A794 F795	N791-A793 PolarHBondContact O-N 2.68Å; N791-A793 VanDerWaalsContact O-N 3.08Å; N791-A794 CarbonylContact O-C 3.58Å; N791-A794 WeakPolarHBondContact O-CA 3.36Å; N791-A794 WeakPolarHBondContact O-CB 3.46Å; N791-A794 PolarHBondContact O-N 2.65Å; N791-F795 HydrophobicContact CB-CD2 4.31Å; N791-F795 HydrophobicContact CB-CE2 4.17Å; N791-F795 WeakPolarHBondContact O-CD2 3.44Å; N791-F795 PolarHBondContact O-N 3.19Å
792	S	31.9	Very low	50.7	Low	88 Å²	88	61.8 Å²	61.8	62%	0.615	34%	0.336	S	S	*	.	G	3₁₀ helix	trans	-47.3	-24.5	168.6	44.8	0	0	0	0	116.7	P790	P790-S792 PolarHBondContact O-N 3.08Å; P790-S792 PolarHBondContact O-OG 3.11Å
793	A	34.4	Very low	48.3	Very low	36 Å²	36	62.6 Å²	62.6	30%	0.298	35%	0.345	S	S	.	.	G	3₁₀ helix	trans	-110.3	-2.7	171.5	0	0	0	0	0	115.1	I789 P790 N791 F795 L796	I789-A793 HydrophobicContact CG2-CB 3.37Å; P790-A793 PolarHBondContact O-N 2.9Å; N791-A793 PolarHBondContact O-N 2.68Å; N791-A793 VanDerWaalsContact O-N 3.08Å; A793-F795 VanDerWaalsContact C-N 3.3Å; A793-L796 WeakPolarHBondContact O-CD1 3.08Å; A793-L796 VanDerWaalsContact O-CG 3.23Å; A793-L796 WeakPolarHBondContact O-CG 3.47Å
794	A	39.5	Very low	45.9	Very low	31 Å²	31	69.7 Å²	69.7	26%	0.256	37%	0.372	S	S	.	.	G	3₁₀ helix	trans	-72.4	-31.6	150.6	0	0	0	0	0	110.4	N791 L796	N791-A794 CarbonylContact O-C 3.58Å; N791-A794 WeakPolarHBondContact O-CA 3.36Å; N791-A794 WeakPolarHBondContact O-CB 3.46Å; N791-A794 PolarHBondContact O-N 2.65Å; A794-L796 PolarHBondContact O-N 3.2Å
795	F	39.8	Very low	43.5	Very low	98 Å²	98	76.6 Å²	76.6	43%	0.43	40%	0.396	S	S	.	.	G	3₁₀ helix	trans	-67	10.9	170.8	-79.2	-61.2	0	0	0	115.2	N791 A793 F797	N791-F795 HydrophobicContact CB-CD2 4.31Å; N791-F795 HydrophobicContact CB-CE2 4.17Å; N791-F795 WeakPolarHBondContact O-CD2 3.44Å; N791-F795 PolarHBondContact O-N 3.19Å; A793-F795 VanDerWaalsContact C-N 3.3Å; F795-F797 PolarHBondContact O-N 3.28Å
796	L	42.9	Very low	42.3	Very low	20 Å²	20	75.2 Å²	75.2	11%	0.105	39%	0.388	C	S	.	.	G	3₁₀ helix	trans	-47.4	-23.8	172	-88.5	172.1	0	0	0	113.6	Q621 A793 A794	Q621-L796 HydrophobicContact CB-CD2 3.58Å; Q621-L796 HydrophobicContact CG-CD2 3.38Å; A793-L796 WeakPolarHBondContact O-CD1 3.08Å; A793-L796 VanDerWaalsContact O-CG 3.23Å; A793-L796 WeakPolarHBondContact O-CG 3.47Å; A794-L796 PolarHBondContact O-N 3.2Å
797	F	48.1	Very low	40.7	Very low	6 Å²	6	77.4 Å²	77.4	3%	0.026	40%	0.4	C	S	.	.	G	3₁₀ helix	trans	-137.6	1.9	-160.7	-55.9	-52.6	0	0	0	119	G561 L562 G563 I564 Y624 F795	G561-F797 WeakPolarHBondContact CA-O 3.46Å; G561-F797 PolarHBondContact N-O 3.5Å; L562-F797 HydrophobicContact CB-CD1 3.48Å; L562-F797 VanDerWaalsContact CB-CD1 3.48Å; L562-F797 HydrophobicContact CB-CD2 4Å; L562-F797 HydrophobicContact CB-CE1 3.38Å; L562-F797 HydrophobicContact CB-CE2 3.9Å; L562-F797 HydrophobicContact CB-CG 3.8Å; L562-F797 HydrophobicContact CB-CZ 3.59Å; L562-F797 HydrophobicContact CD2-CE1 4.35Å; L562-F797 HydrophobicContact CD2-CE2 4.32Å; L562-F797 HydrophobicContact CD2-CZ 3.89Å; L562-F797 HydrophobicContact CG-CZ 4.35Å; G563-F797 VanDerWaalsContact N-CD2 3.35Å; I564-F797 HydrophobicContact CG1-CD2 4.41Å; I564-F797 HydrophobicContact CG1-CE2 3.83Å; Y624-F797 HydrophobicContact CD2-CE1 4.39Å; Y624-F797 HydrophobicContact CG-CE1 4.23Å; F795-F797 PolarHBondContact O-N 3.28Å
798	N	36.7	Very low	39.4	Very low	75 Å²	75	77.4 Å²	77.4	40%	0.401	40%	0.4	S	S	.	.	S	Bend	trans	-106.5	-0.9	-174	-84.3	-10.1	0	0	0	116.5
799	D	40.3	Very low	38.4	Very low	56 Å²	56	78 Å²	78	30%	0.299	39%	0.391	S	S	.	.			trans	-146	114.5	177	-175.5	-4.1	0	0	0	112.9	Y801 Q802	D799-Y801 PolarHBondContact O-N 3.09Å; D799-Y801 WeakPolarHBondContact OD1-CB 3.43Å; D799-Y801 PolarHBondContact OD1-N 3.06Å; D799-Q802 HydrophobicContact CB-CB 4.31Å; D799-Q802 HydrophobicContact CB-CG 4.06Å; D799-Q802 PolarHBondContact O-N 3.25Å
800	P	36	Very low	37.5	Very low	40 Å²	40	80.7 Å²	80.7	26%	0.26	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66	-15.2	177.5	29.6	-36.1	0	0	0	114	N558	N558-P800 WeakPolarHBondContact O-CB 3.09Å
801	Y	36.1	Very low	37.2	Very low	165 Å²	165	80.2 Å²	80.2	65%	0.647	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.8	-13.5	172.9	-66.3	-83.5	0	0	0	113.5	D799	D799-Y801 PolarHBondContact O-N 3.09Å; D799-Y801 WeakPolarHBondContact OD1-CB 3.43Å; D799-Y801 PolarHBondContact OD1-N 3.06Å
802	Q	38.3	Very low	37.1	Very low	80 Å²	80	80.1 Å²	80.1	37%	0.374	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.9	-11.8	172	-62.1	-160.9	75.7	0	0	113.6	D799 R804	D799-Q802 HydrophobicContact CB-CB 4.31Å; D799-Q802 HydrophobicContact CB-CG 4.06Å; D799-Q802 PolarHBondContact O-N 3.25Å; Q802-R804 VanDerWaalsContact C-N 3.27Å
803	V	36.3	Very low	37.5	Very low	59 Å²	59	79.5 Å²	79.5	36%	0.358	37%	0.372	S	S	.	.	S	Bend	trans	-84.3	-5.9	168	-170.9	0	0	0	0	111.5	I625	I625-V803 HydrophobicContact CD1-CG1 4.34Å; I625-V803 HydrophobicContact CG1-CG1 4.02Å
804	R	30.6	Very low	37.7	Very low	153 Å²	153	83.1 Å²	83.1	58%	0.577	38%	0.378	S	S	*	.			trans	-120.6	12.3	-178.1	-63.5	-176.5	-177	171.2	6.2	114.4	Q802	Q802-R804 VanDerWaalsContact C-N 3.27Å
805	R	27.9	Very low	37.5	Very low	214 Å²	214	87.8 Å²	87.8	81%	0.808	39%	0.39	S	S	*	.			trans	-153.4	0	-175.9	-80.3	-173.8	174.1	-177.6	0.6	112.3	R242	R242-R805 VanDerWaalsContact CZ-OXT 3.31Å; R242-R805 PolarHBondContact NE-OXT 2.85Å; R242-R805 PolarHBondContact NH2-OXT 3.03Å

Retrieved 805 of 805 residues in 139.3 ms (Link to these results)

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