A0A087YCX1_POEFO Loading...

Tetratricopeptide repeat, ankyrin repeat and coiled-coil containing 1a

AlphaFold DB , UniProt , Accession A0A087YCX1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,040 aa.

						>A0A087YCX1_POEFO|A0A087YCX1
MFRAVFGNKKEGGGKKGDKKSQKNAGVEVHMPCIQQRGSGQRATHHHGHNGSHLNRKRLTKGVSISLPSSPLLPRQGDIVSSQSCVKFQGRARKPEYVDGSSSTREALIFASCRGKPDHRDLHVEPHLGSSLSTQELMTRLCFLLGEATGSTASSPMEDRREKKGDTSAQGGSPSSTLTCSTTSPCTESPTSTLSTSAGGQSLPQPLPLSSPHRGSSSSPCGTLCSPAHSPTPCSTSGLISVSSPGPPTQSPTSTLESKDSGIIATITSSSENEERSTSSDVLTKEEAPGGSGGVMGRAGDDRHPGQTRDNLTAPQPDALPRSEIMEPRTPPAPKRPLPQHHIQGLSSLAMPRPNSVAATSSTRLEDLSYLDNQRASGHRGSVRKHNTAGRTSDDSKGRLVPFKQTDIMLKPLLFEVPGVTAETPFVGRDWLFARLEEVLRKTSTCEGRGAVIVGNAGSGKTAIIWRLVTLSCHGMRTPQGAASDPHSPKASPKSGDKQGKAASNQSSAAGTSDNAGQRKEAVRCLAAKVVAYHFCQADNTYTCLVPEFVHSVAALLARAPQLAPYRELLAQEPHLQNQLSLRSCVQDPIAAFRKGVLEPLASLRKERRLPEEDYIILVDSLNEAEFHKPDYGDTVATFITKIISKFPHWLKLVVTVRTGLVEITTLLPFAGISLDILPDSSDLGADLSDYIHHRVSGSSQIATNVTTPTGSAPDPLLLSKFSSNLSTRSHGSILYLQLTLDLFHKGQLALKGGNYLVVPVSLSEVYLLMCRVSFPDKDVFERVLPVLNVALASLHPLTDEQMFRALNAGSVKGELEWNDFQQRLDSLAGFMVRRRDGTRMLCHPSFREWLVWRADGESTDFLCDPRSGHALLAFMFSRQEGKLNRQQTMELGHHILKAHIFKGLSKKTGVSSSVLQAMWVNCSTDSLSAALGSLRNLYTPNIKVSRLLMHGGASVTWCTEVIGHAPILAVHAHLGHVEMVALLLEMGAPVDGTTGSGMTPLCLAAAAGHADIVSLLCKKGAKVSVVSVECTTDQSKYSC
					

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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	30.2	Very low	29.9	Very low	235 Å²	235	178.5 Å²	178.5	100%	1.158	89%	0.888	S	S	*	*				0	125	0	-76.1	-178.7	-89.9	0	0	108.5
2	F	26.5	Very low	30	Very low	221 Å²	221	170 Å²	170	97%	0.969	88%	0.881	S	S	*	*			trans	178.7	137	140.3	-106	-70.9	0	0	0	108.2
3	R	23.9	Very low	29.9	Very low	243 Å²	243	163.7 Å²	163.7	92%	0.917	88%	0.883	S	S	*	*			trans	-156.6	160.8	178	-160.1	-179.7	-173.1	-165.2	3.2	108.4
4	A	31.6	Very low	30	Very low	92 Å²	92	157.2 Å²	157.2	76%	0.76	87%	0.873	S	S	*	*			trans	72.6	151.3	-172	0	0	0	0	0	113.3
5	V	30.3	Very low	30.1	Very low	127 Å²	127	160.3 Å²	160.3	77%	0.77	87%	0.874	S	S	*	*			cis	-125.7	137.3	6.9	178.4	0	0	0	0	110.5
6	F	30.2	Very low	30.4	Very low	206 Å²	206	163.6 Å²	163.6	90%	0.904	88%	0.877	S	S	*	*			trans	-132.8	130.7	153.6	-94.5	-73.9	0	0	0	108.5
7	G	26.9	Very low	30.4	Very low	71 Å²	71	158.7 Å²	158.7	73%	0.732	88%	0.875	S	S	*	*			trans	-138.4	95	177.6	0	0	0	0	0	109.9
8	N	32.1	Very low	30.6	Very low	159 Å²	159	157 Å²	157	85%	0.85	86%	0.864	S	S	*	*			trans	-79.5	138	174.2	-77.9	-22.5	0	0	0	110.4
9	K	31.1	Very low	30.7	Very low	209 Å²	209	157.7 Å²	157.7	91%	0.909	86%	0.858	S	S	*	*			trans	-116.1	143.4	154.1	-108.7	-173	174.2	-172.9	0	109.1
10	K	34.9	Very low	30.8	Very low	200 Å²	200	159.7 Å²	159.7	87%	0.87	86%	0.858	S	S	*	*			trans	-107.8	-177.3	-179.2	-126.1	179.4	-178.2	-177.7	0	109.4
11	E	31.3	Very low	30.9	Very low	200 Å²	200	156.1 Å²	156.1	94%	0.935	85%	0.845	S	S	*	*			trans	76.7	144.6	-179.3	-54.1	174	-173.8	0	0	114.7
12	G	30.6	Very low	31	Very low	77 Å²	77	152.6 Å²	152.6	79%	0.794	83%	0.826	S	S	*	*			cis	170.8	84.6	-7	0	0	0	0	0	116.3
13	G	29.6	Very low	31.4	Very low	88 Å²	88	150.8 Å²	150.8	91%	0.907	82%	0.818	S	S	*	*			trans	74.7	149.3	155.3	0	0	0	0	0	119.6
14	G	30.6	Very low	31.9	Very low	73 Å²	73	145.8 Å²	145.8	75%	0.753	81%	0.809	S	S	*	*			trans	118.9	97.7	146.5	0	0	0	0	0	119.9
15	K	32.1	Very low	32	Very low	204 Å²	204	146.4 Å²	146.4	89%	0.887	81%	0.814	S	S	*	*			trans	62.8	123.4	142.6	-62.7	176.4	179.3	173.2	0	121.4
16	K	34.2	Very low	32	Very low	212 Å²	212	143.8 Å²	143.8	92%	0.922	81%	0.813	S	S	*	*			trans	35.5	131.1	135.6	-63	-174.5	174.2	-173	0	120.3
17	G	30.4	Very low	32.1	Very low	81 Å²	81	139.9 Å²	139.9	84%	0.835	81%	0.806	S	S	*	*			trans	169.1	87.9	153.3	0	0	0	0	0	118.1
18	D	34	Very low	32.5	Very low	128 Å²	128	144.3 Å²	144.3	68%	0.684	81%	0.807	S	S	*	*			trans	-41.3	156.4	170.6	-136	4.5	0	0	0	119.2
19	K	32.6	Very low	32.3	Very low	170 Å²	170	143 Å²	143	74%	0.739	80%	0.804	S	S	*	*			trans	76.8	111.1	145	-77.8	161.7	-176.9	138.1	0	124.6
20	K	33.3	Very low	32.2	Very low	197 Å²	197	140 Å²	140	86%	0.857	79%	0.793	S	S	*	*				66.2	116	114.3	-97.1	-173.2	177.1	-174.1	0	123
21	S	31.9	Very low	32.2	Very low	86 Å²	86	137.5 Å²	137.5	60%	0.601	79%	0.787	S	S	*	*				114.1	141.7	111.1	-145.6	0	0	0	0	121.1
22	Q	33.8	Very low	33	Very low	161 Å²	161	132.8 Å²	132.8	75%	0.752	77%	0.774	S	S	*	*			trans	65.6	125.4	155.9	-79	152.5	-75.1	0	0	118.6
23	K	34.8	Very low	32.8	Very low	183 Å²	183	134.9 Å²	134.9	80%	0.796	78%	0.775	S	S	*	*				68.4	141.2	79.8	-74.8	-169	171.9	-171	0	112.7
24	N	32.9	Very low	32.7	Very low	138 Å²	138	137.7 Å²	137.7	74%	0.738	77%	0.767	S	S	*	*			cis	-164.8	162.8	24.4	-137.1	27.3	0	0	0	112.6
25	A	34.7	Very low	32.6	Very low	104 Å²	104	141 Å²	141	86%	0.86	76%	0.763	S	S	*	*			trans	60.2	164.9	164.6	0	0	0	0	0	117.5
26	G	30	Very low	32.5	Very low	72 Å²	72	138.3 Å²	138.3	74%	0.742	75%	0.754	S	S	*	*			cis	152.2	146.3	2.1	0	0	0	0	0	107.4
27	V	32.6	Very low	32.2	Very low	125 Å²	125	139.3 Å²	139.3	76%	0.758	75%	0.752	S	S	*	*			cis	-174.8	139.8	46.3	148.2	0	0	0	0	109.7
28	E	34.1	Very low	32	Very low	164 Å²	164	138.6 Å²	138.6	77%	0.766	74%	0.744	S	S	*	*			trans	50.2	166.9	151.7	-62.6	-173.6	117.9	0	0	121.3
29	V	29.5	Very low	31.8	Very low	130 Å²	130	138.7 Å²	138.7	79%	0.788	76%	0.755	S	S	*	*			cis	-150.5	147.8	38.4	169.2	0	0	0	0	114.1
30	H	29	Very low	31.6	Very low	147 Å²	147	133.9 Å²	133.9	68%	0.681	75%	0.753	S	S	*	*			trans	-0.4	164.4	157.9	-80.7	31.6	0	0	0	122.8
31	M	33.5	Very low	31.5	Very low	147 Å²	147	133.4 Å²	133.4	72%	0.724	75%	0.754	S	S	*	*			cis	-175.9	-161.4	-6.9	-104.3	-68.1	-160.9	0	0	107.8
32	P	48.8	Very low	31.4	Very low	102 Å²	102	139.9 Å²	139.9	66%	0.662	77%	0.766	S	S	*	*				-127.3	147.7	-53.6	34.4	-18.2	0	0	0	116.1
33	C	26.2	Very low	31.2	Very low	121 Å²	121	136.1 Å²	136.1	82%	0.818	76%	0.762	S	S	*	*				48.1	164.7	125.9	-140.6	0	0	0	0	126
34	I	28.2	Very low	31	Very low	146 Å²	146	133.1 Å²	133.1	75%	0.749	76%	0.759	S	S	*	*			trans	80.8	147.1	159.7	-61.4	176.6	0	0	0	118.7
35	Q	29	Very low	30.8	Very low	142 Å²	142	133.3 Å²	133.3	66%	0.664	76%	0.755	S	S	*	*			cis	-175.8	137.4	-34.3	-170.2	163.7	-19.4	0	0	112.4
36	Q	28.4	Very low	30.5	Very low	148 Å²	148	135.1 Å²	135.1	69%	0.692	75%	0.745	S	S	*	*			trans	65.2	154	153	-84	180	25.7	0	0	125.7
37	R	28.7	Very low	30.3	Very low	234 Å²	234	140.2 Å²	140.2	88%	0.883	75%	0.749	S	S	*	*			trans	96.4	148.3	140.6	-92.3	175.7	179.9	-148.6	-1.4	122.4
38	G	26.3	Very low	29.9	Very low	65 Å²	65	137.5 Å²	137.5	67%	0.67	75%	0.747	S	S	*	*			trans	97.3	125.2	177.9	0	0	0	0	0	113.1
39	S	29.7	Very low	29.5	Very low	130 Å²	130	138 Å²	138	91%	0.909	75%	0.749	S	S	*	*			cis	57.6	125.5	25.4	81.1	0	0	0	0	115.2
40	G	27.3	Very low	29.3	Very low	69 Å²	69	138.6 Å²	138.6	71%	0.711	75%	0.748	S	S	*	*			cis	152.6	162.8	-1.9	0	0	0	0	0	111.5
41	Q	31.8	Very low	29	Very low	187 Å²	187	134.5 Å²	134.5	87%	0.874	75%	0.746	S	S	*	*			trans	68.7	160.5	-179.3	-60.4	-166.2	34.2	0	0	116.3
42	R	30.8	Very low	28.6	Very low	223 Å²	223	132.5 Å²	132.5	84%	0.842	75%	0.746	S	S	*	*			cis	-171.9	178.6	-32.2	-169.2	169.8	-171.4	-172.6	2.9	107.8
43	A	29.7	Very low	27.6	Very low	81 Å²	81	135.3 Å²	135.3	67%	0.669	75%	0.75	S	S	*	*			trans	83.9	151.1	157.4	0	0	0	0	0	117.2
44	T	29.4	Very low	27.6	Very low	120 Å²	120	136 Å²	136	74%	0.736	75%	0.745	S	S	*	*			cis	-175.3	161	-17.5	30.8	0	0	0	0	107.3
45	H	29.6	Very low	27.4	Very low	142 Å²	142	135.2 Å²	135.2	66%	0.657	74%	0.742	S	S	*	*			cis	-164.3	153.9	-11.7	-124.7	-59.8	0	0	0	108.2
46	H	26.9	Very low	27.2	Very low	142 Å²	142	138.2 Å²	138.2	66%	0.657	75%	0.747	S	S	*	*			trans	63	166.6	151.1	-69.4	-46.8	0	0	0	119.1
47	H	27.3	Very low	27	Very low	179 Å²	179	139.8 Å²	139.8	83%	0.829	75%	0.752	S	S	*	*			cis	-159.4	167.8	-33.9	-122.3	-2.9	0	0	0	108.2
48	G	24.2	Very low	26.8	Very low	69 Å²	69	138.6 Å²	138.6	71%	0.711	75%	0.748	S	S	*	*			trans	106.2	106.9	148.8	0	0	0	0	0	120.3
49	H	25.4	Very low	26.8	Very low	173 Å²	173	142 Å²	142	80%	0.801	75%	0.749	S	S	*	*			trans	39.5	132.5	130.3	-85.6	-0.8	0	0	0	125.9
50	N	24.6	Very low	26.6	Very low	143 Å²	143	140.8 Å²	140.8	77%	0.765	74%	0.737	S	S	*	*			trans	69.6	154.4	130.2	-65.1	-6.9	0	0	0	123
51	G	23.6	Very low	26.4	Very low	62 Å²	62	147.3 Å²	147.3	64%	0.639	75%	0.746	S	S	*	*			trans	92.2	114.8	175.3	0	0	0	0	0	112.5
52	S	25	Very low	26.1	Very low	104 Å²	104	141.5 Å²	141.5	73%	0.727	74%	0.736	S	S	*	*			cis	44.9	125.7	45.8	85	0	0	0	0	111.9
53	H	27.4	Very low	25.8	Very low	162 Å²	162	137.6 Å²	137.6	75%	0.75	74%	0.737	S	S	*	*			cis	-168.7	173.6	48.5	-117.8	-70.6	0	0	0	112.6
54	L	25.2	Very low	25.6	Very low	134 Å²	134	138.7 Å²	138.7	70%	0.702	74%	0.74	S	S	*	*			trans	66.2	100.6	141.7	-72.6	163.4	0	0	0	122.3
55	N	24.1	Very low	25.5	Very low	130 Å²	130	141.5 Å²	141.5	70%	0.695	75%	0.748	S	S	*	*				100.6	149.8	100.4	-150.2	2.3	0	0	0	121.1
56	R	24.7	Very low	25.3	Very low	205 Å²	205	139.9 Å²	139.9	77%	0.774	75%	0.753	S	S	*	*			trans	85.8	101	141.1	-155.5	167.6	177.4	156.4	-4.3	120.2
57	K	24.8	Very low	25.5	Very low	181 Å²	181	140.8 Å²	140.8	79%	0.787	76%	0.762	S	S	*	*				33.3	136.4	116.6	-58	174.1	-178.3	175.4	0	116.5
58	R	25.3	Very low	25.8	Very low	210 Å²	210	137.8 Å²	137.8	79%	0.792	76%	0.758	S	S	*	*			cis	176.6	155.5	47.3	-140.7	177.5	176.3	-155.3	4.1	111.2
59	L	26.4	Very low	25.8	Very low	135 Å²	135	140 Å²	140	71%	0.707	76%	0.763	S	S	*	*			trans	64.4	166.7	156.6	-68.9	154.1	0	0	0	116.6
60	T	24.3	Very low	26	Very low	106 Å²	106	137.2 Å²	137.2	65%	0.65	76%	0.762	S	S	*	*			cis	-149.7	172.2	10.3	-18.9	0	0	0	0	112.5
61	K	24.7	Very low	26.5	Very low	205 Å²	205	135.9 Å²	135.9	89%	0.891	76%	0.762	S	S	*	*			trans	3.4	147	153.2	-60.2	164.5	-174.5	-179.9	0	119.4
62	G	24.7	Very low	26.7	Very low	66 Å²	66	141 Å²	141	68%	0.68	77%	0.773	S	S	*	*			cis	151.3	-177.9	4.2	0	0	0	0	0	111.8
63	V	24.6	Very low	27.1	Very low	141 Å²	141	143.7 Å²	143.7	86%	0.855	78%	0.779	S	S	*	*			trans	69	105.5	176.1	-169	0	0	0	0	113.7
64	S	26.3	Very low	27.3	Very low	104 Å²	104	141.9 Å²	141.9	73%	0.727	78%	0.782	S	S	*	*				79.2	118.6	57.5	-58.3	0	0	0	0	115.2
65	I	26.9	Very low	27.6	Very low	178 Å²	178	147.1 Å²	147.1	91%	0.913	79%	0.792	S	S	*	*			trans	-161.9	161.1	151.8	-98.2	147.1	0	0	0	108
66	S	25.1	Very low	28	Very low	108 Å²	108	150.5 Å²	150.5	76%	0.755	80%	0.804	S	S	*	*			trans	-98.8	170	-156.6	53.7	0	0	0	0	117.4
67	L	30.1	Very low	28.3	Very low	162 Å²	162	143.8 Å²	143.8	85%	0.848	80%	0.798	S	S	*	*			trans	-57.7	167.7	168.1	-55.7	167.8	0	0	0	112.4
68	P	34.1	Very low	28.2	Very low	116 Å²	116	142 Å²	142	75%	0.753	80%	0.797	S	S	*	*				-149.1	173.2	93.8	42.3	-27.4	0	0	0	117.1
69	S	24.7	Very low	28.3	Very low	116 Å²	116	139.1 Å²	139.1	81%	0.811	80%	0.796	S	S	*	*			trans	76.6	133.6	149.2	-61.2	0	0	0	0	122.2
70	S	29.9	Very low	28.2	Very low	113 Å²	113	138.9 Å²	138.9	79%	0.79	80%	0.8	S	S	*	*			trans	-121.1	141.3	156.9	-50.9	0	0	0	0	109.7
71	P	35.8	Very low	28.2	Very low	116 Å²	116	138.7 Å²	138.7	75%	0.753	80%	0.803	S	S	*	*			trans	-99.4	123.6	156.6	33.1	-25.2	0	0	0	109.5
72	L	26.3	Very low	28.2	Very low	168 Å²	168	133.7 Å²	133.7	88%	0.88	79%	0.794	S	S	*	*				79.8	120.9	72.1	-74.8	172.5	0	0	0	114.5
73	L	33	Very low	28.2	Very low	161 Å²	161	139.7 Å²	139.7	84%	0.843	80%	0.804	S	S	*	*			trans	-92.1	152.1	167.4	-68.6	163.6	0	0	0	110.1
74	P	33	Very low	28.3	Very low	125 Å²	125	138.3 Å²	138.3	81%	0.812	80%	0.8	S	S	*	*			trans	-82.7	140	159	33.4	-31.1	0	0	0	111.4
75	R	31.9	Very low	28.1	Very low	244 Å²	244	138.6 Å²	138.6	92%	0.921	80%	0.801	S	S	*	*			trans	-158.6	135.6	174.2	-138.6	-174.3	-170.5	-171.1	3.1	110.2
76	Q	30.9	Very low	28	Very low	201 Å²	201	136.9 Å²	136.9	94%	0.939	80%	0.799	S	S	*	*			trans	-167.7	148.5	168.6	-107.2	172.6	-3.1	0	0	107.3
77	G	31.2	Very low	27.8	Very low	63 Å²	63	140.3 Å²	140.3	65%	0.649	80%	0.8	S	S	*	*			cis	-134.1	177.1	-18	0	0	0	0	0	108.1
78	D	23.2	Very low	27.4	Very low	143 Å²	143	142.3 Å²	142.3	77%	0.765	80%	0.802	S	S	*	*			cis	-152.5	139.3	17.8	-84.9	-34.4	0	0	0	109.7
79	I	27.8	Very low	26.8	Very low	150 Å²	150	145.6 Å²	145.6	77%	0.769	81%	0.808	S	S	*	*				75.1	128.8	107.2	-62.5	174.3	0	0	0	113.8
80	V	23.8	Very low	26.7	Very low	130 Å²	130	143.8 Å²	143.8	79%	0.788	81%	0.808	S	S	*	*			cis	-141.6	-176.4	15.3	86.5	0	0	0	0	114.8
81	S	24.9	Very low	26.4	Very low	102 Å²	102	150.5 Å²	150.5	71%	0.713	82%	0.816	S	S	*	*			trans	-62.4	176.2	-170.7	62.9	0	0	0	0	117.5
82	S	24.5	Very low	25.9	Very low	100 Å²	100	149.5 Å²	149.5	70%	0.699	82%	0.817	S	S	*	*			cis	-161.4	147.2	29.1	57.3	0	0	0	0	118.7
83	Q	25.2	Very low	25.7	Very low	193 Å²	193	153.6 Å²	153.6	90%	0.902	82%	0.821	S	S	*	*			trans	61.4	165.3	137.2	-70.1	-171.6	-3.8	0	0	125.7
84	S	25.4	Very low	25.1	Very low	111 Å²	111	155.4 Å²	155.4	78%	0.776	82%	0.822	S	S	*	*			trans	-112.7	-177.8	-160.7	50.6	0	0	0	0	112.5
85	C	23.5	Very low	25.5	Very low	110 Å²	110	154.6 Å²	154.6	74%	0.743	82%	0.817	S	S	*	*			cis	176.1	143.1	-25.6	173.8	0	0	0	0	107.7
86	V	23.3	Very low	25	Very low	143 Å²	143	152.4 Å²	152.4	87%	0.867	82%	0.817	S	S	*	*			trans	-140.1	153.8	171.2	-174.7	0	0	0	0	110.9
87	K	22.4	Very low	24.6	Very low	179 Å²	179	152.1 Å²	152.1	78%	0.778	81%	0.809	S	S	*	*			trans	-114	162.3	-175.8	-55	170.2	-178.4	170	0	112.2
88	F	21	Very low	24.1	Very low	204 Å²	204	155.5 Å²	155.5	90%	0.895	82%	0.816	S	S	*	*				-160.2	-174.2	121	-118.2	-80.1	0	0	0	112
89	Q	21.6	Very low	24	Very low	185 Å²	185	155.3 Å²	155.3	86%	0.864	82%	0.815	S	S	*	*			trans	-136.7	158.3	-158.5	-66.1	-177.2	-29.4	0	0	115.8
90	G	22.3	Very low	23.8	Very low	79 Å²	79	151.2 Å²	151.2	81%	0.814	81%	0.81	S	S	*	*			trans	126.7	158.1	150.8	0	0	0	0	0	115.3
91	R	22.8	Very low	23.8	Very low	253 Å²	253	150.7 Å²	150.7	96%	0.955	81%	0.813	S	S	*	*			cis	-160.3	150.3	-22.7	-168.1	178.3	-176.2	-169.3	2.3	107.8
92	A	25.6	Very low	23.7	Very low	95 Å²	95	151 Å²	151	79%	0.785	81%	0.814	S	S	*	*			trans	-87	158.6	-172.7	0	0	0	0	0	115.6
93	R	22.1	Very low	23.7	Very low	254 Å²	254	152 Å²	152	96%	0.958	82%	0.822	S	S	*	*			trans	-155.2	159.2	160	-108.9	174.1	-177.2	175.5	-0.7	111.8
94	K	21.6	Very low	23.7	Very low	199 Å²	199	149.2 Å²	149.2	87%	0.865	82%	0.818	S	S	*	*			trans	-167	174.7	-177.2	-145.3	-171.1	-179	-176.5	0	108.7
95	P	39.8	Very low	23.8	Very low	109 Å²	109	152.1 Å²	152.1	71%	0.708	81%	0.812	S	S	*	*				-106.8	-174.5	-90.4	41.1	-28.1	0	0	0	113
96	E	21	Very low	23.7	Very low	198 Å²	198	156 Å²	156	93%	0.925	82%	0.819	S	S	*	*			trans	-150	169.7	165.8	-142.2	148.2	-135	0	0	111.9
97	Y	22.8	Very low	23.8	Very low	194 Å²	194	153.3 Å²	153.3	76%	0.761	81%	0.812	S	S	*	*			trans	-150.6	143.9	-166.5	-176	-82.8	0	0	0	110.8
98	V	21.9	Very low	23.9	Very low	134 Å²	134	152.8 Å²	152.8	81%	0.812	82%	0.816	S	S	*	*			trans	-145.9	142.5	177.6	-175.3	0	0	0	0	110.9
99	D	21.5	Very low	24	Very low	139 Å²	139	150.8 Å²	150.8	74%	0.743	81%	0.814	S	S	*	*			trans	-86.8	170.2	-179.3	-61.8	-73.5	0	0	0	114.8
100	G	23.3	Very low	24	Very low	64 Å²	64	151 Å²	151	66%	0.66	81%	0.812	S	S	*	*			trans	151.8	107.6	143.4	0	0	0	0	0	119.4
101	S	22.6	Very low	24	Very low	120 Å²	120	151.1 Å²	151.1	84%	0.839	81%	0.805	S	S	*	*			trans	56.9	170.2	146.5	58.9	0	0	0	0	121.6
102	S	23.6	Very low	24	Very low	107 Å²	107	143.9 Å²	143.9	75%	0.748	79%	0.793	S	S	*	*				-173	130.2	-57.3	56.7	0	0	0	0	111.4
103	S	24.6	Very low	23.8	Very low	122 Å²	122	144.2 Å²	144.2	85%	0.853	79%	0.789	S	S	*	*			trans	-176.7	143.3	146.7	47.3	0	0	0	0	113.3
104	T	24.7	Very low	23.9	Very low	134 Å²	134	143.6 Å²	143.6	82%	0.822	79%	0.786	S	S	*	*			trans	-117.9	178.9	167.3	58.6	0	0	0	0	107.4
105	R	26.9	Very low	23.9	Very low	173 Å²	173	137.5 Å²	137.5	65%	0.653	78%	0.78	S	S	*	*			cis	-164.9	168.7	-1.5	-140.7	175.6	-177.1	175.3	0.7	106.7
106	E	23.3	Very low	23	Very low	192 Å²	192	140.1 Å²	140.1	90%	0.897	78%	0.78	S	S	*	*				178.1	162.9	120.1	-100.5	-176.5	179.8	0	0	113.7
107	A	24	Very low	23.8	Very low	86 Å²	86	136.1 Å²	136.1	71%	0.711	77%	0.771	S	S	*	*			trans	-169.2	-180	-176.4	0	0	0	0	0	111.6
108	L	24.5	Very low	23.9	Very low	167 Å²	167	131.3 Å²	131.3	87%	0.874	76%	0.759	S	S	*	*			trans	78.7	164.4	176.8	-44.5	170.5	0	0	0	113.3
109	I	22.5	Very low	24	Very low	163 Å²	163	131.9 Å²	131.9	84%	0.836	75%	0.752	S	S	*	*			cis	-134.8	-147.8	9.9	-157.8	151.8	0	0	0	113.9
110	F	21.9	Very low	24.2	Very low	190 Å²	190	135.2 Å²	135.2	83%	0.833	76%	0.755	S	S	*	*			trans	-154.8	169.1	-131.8	-173.3	-116.5	0	0	0	118
111	A	22.4	Very low	24.2	Very low	80 Å²	80	139.7 Å²	139.7	66%	0.661	76%	0.763	S	S	*	*			trans	72.8	168	164.2	0	0	0	0	0	119.3
112	S	23.2	Very low	24.3	Very low	102 Å²	102	142.4 Å²	142.4	71%	0.713	77%	0.768	S	S	*	*			cis	-179.9	174	-33.7	-172.2	0	0	0	0	110.9
113	C	22.2	Very low	24.3	Very low	102 Å²	102	144.8 Å²	144.8	69%	0.689	77%	0.766	S	S	*	*			trans	71.3	156.1	156.8	-75.1	0	0	0	0	119.4
114	R	23.3	Very low	24.4	Very low	241 Å²	241	145.4 Å²	145.4	91%	0.909	77%	0.765	S	S	*	*			cis	-162.1	160.3	-18.4	-125.2	-179	-175.4	-152.5	3.4	110.6
115	G	21.2	Very low	24.4	Very low	71 Å²	71	146 Å²	146	73%	0.732	76%	0.758	S	S	*	*			trans	-165.5	132.8	165.5	0	0	0	0	0	112.5
116	K	22.5	Very low	24.4	Very low	163 Å²	163	143 Å²	143	71%	0.709	76%	0.761	S	S	*	*			trans	-168	174.1	-178.7	-111.5	-153.6	172	-159.3	0	107.6	D118	K116-D118 IonicContact NZ-OD1 3.47Å; K116-D118 PolarHBondContact NZ-OD1 2.77Å
117	P	37.6	Very low	24.5	Very low	114 Å²	114	142.8 Å²	142.8	74%	0.74	76%	0.76	S	S	*	*			cis	-129.5	176.6	15.7	49.9	-36	0	0	0	112.9
118	D	23.5	Very low	24.7	Very low	94 Å²	94	147 Å²	147	50%	0.503	77%	0.77	S	S	.	*			cis	-135.7	-106.1	-0	-157.9	22.5	0	0	0	114.2	K116	K116-D118 IonicContact NZ-OD1 3.47Å; K116-D118 PolarHBondContact NZ-OD1 2.77Å
119	H	25.2	Very low	24.8	Very low	145 Å²	145	142.8 Å²	142.8	67%	0.671	77%	0.766	S	S	*	*			cis	-137.2	-164.7	-21.7	-153.1	39.2	0	0	0	113.9	D121	H119-D121 PolarHBondContact O-N 3.32Å
120	R	25.4	Very low	25.1	Very low	210 Å²	210	139.4 Å²	139.4	79%	0.792	76%	0.757	S	S	*	*			trans	-80.2	104.4	-161.9	-70.3	174.9	177.7	-177.6	0.2	114.2
121	D	23.5	Very low	25.7	Very low	158 Å²	158	133.6 Å²	133.6	85%	0.845	74%	0.74	S	S	*	*			trans	-123	146.3	135.9	-95.7	-51.4	0	0	0	108.5	H119 H123	H119-D121 PolarHBondContact O-N 3.32Å; D121-H123 PolarHBondContact O-N 3.46Å
122	L	25.1	Very low	26.3	Very low	177 Å²	177	136.4 Å²	136.4	93%	0.927	74%	0.743	S	S	*	*			trans	-98.5	82.2	-179.4	-85.9	169.3	0	0	0	110.9
123	H	23.8	Very low	27.1	Very low	156 Å²	156	135.3 Å²	135.3	72%	0.722	74%	0.735	S	S	*	*			trans	-82.9	131.2	172.4	-158.1	-88.2	0	0	0	110.6	D121	D121-H123 PolarHBondContact O-N 3.46Å
124	V	26.2	Very low	27.9	Very low	136 Å²	136	134 Å²	134	82%	0.824	73%	0.725	S	S	*	*			trans	-106	109.7	170.6	178.4	0	0	0	0	108.1
125	E	24.4	Very low	28.6	Very low	146 Å²	146	128.6 Å²	128.6	68%	0.682	71%	0.71	S	S	*	*	P	Polyproline II helix	trans	-74	150.1	173	-91.4	-94	102.5	0	0	111.6
126	P	27.5	Very low	29.5	Very low	109 Å²	109	131.1 Å²	131.1	71%	0.708	70%	0.702	S	S	*	*	P	Polyproline II helix	trans	-77.5	133.1	-177.8	31.3	-33.8	0	0	0	112.5	L128	P126-L128 PolarHBondContact O-N 3.41Å
127	H	23.7	Very low	30.1	Very low	189 Å²	189	129.4 Å²	129.4	88%	0.875	70%	0.7	S	S	*	*	P	Polyproline II helix	trans	-70.9	123.8	171.5	-80	-81.1	0	0	0	111.5	G129	H127-G129 PolarHBondContact O-N 3.37Å
128	L	29.6	Very low	30.1	Very low	175 Å²	175	129.2 Å²	129.2	92%	0.916	69%	0.691	S	S	*	*			trans	-75	87.2	176.4	-161.2	78.4	0	0	0	111	P126 S130	P126-L128 PolarHBondContact O-N 3.41Å; L128-S130 PolarHBondContact O-N 3.06Å
129	G	26.1	Very low	30.8	Very low	78 Å²	78	129.2 Å²	129.2	80%	0.804	69%	0.694	S	S	*	*			trans	-73.7	89.1	-179.4	0	0	0	0	0	113.6	H127	H127-G129 PolarHBondContact O-N 3.37Å
130	S	29.6	Very low	31.2	Very low	92 Å²	92	130.9 Å²	130.9	64%	0.643	69%	0.694	S	S	*	*			trans	-66.2	131.8	174	58.3	0	0	0	0	112.3	L128	L128-S130 PolarHBondContact O-N 3.06Å
131	S	33.6	Very low	31.7	Very low	68 Å²	68	126.4 Å²	126.4	48%	0.476	69%	0.686	S	S	.	*			trans	-72.3	151.4	178.3	50.6	0	0	0	0	113.1	S133 T134	S131-S133 PolarHBondContact O-N 2.99Å; S131-S133 VanDerWaalsContact O-N 3.07Å; S131-S133 PolarHBondContact OG-OG 3.08Å; S131-T134 PolarHBondContact O-N 3.08Å; S131-T134 PolarHBondContact O-OG1 3.37Å
132	L	35.4	Very low	32	Very low	139 Å²	139	123.5 Å²	123.5	73%	0.728	68%	0.677	S	S	*	*	H	α-helix	trans	-57.7	-26.5	-177.2	-82.1	76.4	0	0	0	113.6	T134 Q135 E136	L132-T134 VanDerWaalsContact C-N 3.26Å; L132-T134 PolarHBondContact O-N 2.97Å; L132-Q135 WeakPolarHBondContact O-CB 3.43Å; L132-Q135 PolarHBondContact O-N 3.26Å; L132-E136 PolarHBondContact O-N 3.16Å; L132-E136 VanDerWaalsContact O-N 3.11Å
133	S	39.7	Very low	32.3	Very low	78 Å²	78	124.1 Å²	124.1	55%	0.545	67%	0.673	S	S	.	*	H	α-helix	trans	-61.2	-31.9	176.8	50.1	0	0	0	0	113.4	S131 Q135	S131-S133 PolarHBondContact O-N 2.99Å; S131-S133 VanDerWaalsContact O-N 3.07Å; S131-S133 PolarHBondContact OG-OG 3.08Å; S133-Q135 VanDerWaalsContact C-N 3.34Å
134	T	38.2	Very low	32.7	Very low	76 Å²	76	123.4 Å²	123.4	47%	0.466	67%	0.673	S	S	.	*	H	α-helix	trans	-71	-33.4	174	-45.9	0	0	0	0	111.4	S131 L132 M138	S131-T134 PolarHBondContact O-N 3.08Å; S131-T134 PolarHBondContact O-OG1 3.37Å; L132-T134 VanDerWaalsContact C-N 3.26Å; L132-T134 PolarHBondContact O-N 2.97Å; T134-M138 WeakPolarHBondContact O-CG 3.41Å; T134-M138 PolarHBondContact O-N 3.07Å; T134-M138 VanDerWaalsContact O-N 3.14Å
135	Q	39	Very low	33	Very low	127 Å²	127	124.5 Å²	124.5	59%	0.593	67%	0.673	S	S	*	*	H	α-helix	trans	-74.5	-36.5	-176.5	-150.8	168.2	12.9	0	0	112	L132 S133 T139	L132-Q135 WeakPolarHBondContact O-CB 3.43Å; L132-Q135 PolarHBondContact O-N 3.26Å; S133-Q135 VanDerWaalsContact C-N 3.34Å; Q135-T139 WeakPolarHBondContact O-CB 3.4Å; Q135-T139 PolarHBondContact O-N 3.5Å; Q135-T139 PolarHBondContact O-OG1 3.01Å
136	E	39.2	Very low	33.2	Very low	123 Å²	123	120.7 Å²	120.7	58%	0.575	67%	0.673	S	S	*	*	H	α-helix	trans	-72.1	-30.3	176.9	-163.1	169.4	178.1	0	0	112.8	L132 R140	L132-E136 PolarHBondContact O-N 3.16Å; L132-E136 VanDerWaalsContact O-N 3.11Å; E136-R140 PolarHBondContact O-N 3.38Å; E136-R140 IonicContact OE1-NH2 2.64Å
137	L	36.9	Very low	33.3	Very low	128 Å²	128	124.1 Å²	124.1	67%	0.67	68%	0.68	S	S	*	*	H	α-helix	trans	-69.2	-48.4	170.8	-98.3	162.8	0	0	0	112.3	T139 R140 L141	L137-T139 VanDerWaalsContact C-N 3.29Å; L137-T139 PolarHBondContact O-N 2.71Å; L137-R140 PolarHBondContact O-N 3.11Å; L137-R140 VanDerWaalsContact O-N 3.16Å; L137-L141 PolarHBondContact O-N 2.64Å
138	M	37.4	Very low	33.5	Very low	110 Å²	110	118 Å²	118	54%	0.542	66%	0.662	S	S	.	*	H	α-helix	trans	-61.4	-37.6	176.9	-73.2	-66.1	-73.2	0	0	112.2	T134 R140 L141 C142	T134-M138 WeakPolarHBondContact O-CG 3.41Å; T134-M138 PolarHBondContact O-N 3.07Å; T134-M138 VanDerWaalsContact O-N 3.14Å; M138-R140 PolarHBondContact O-N 3.05Å; M138-L141 PolarHBondContact O-N 3.16Å; M138-C142 PolarHBondContact O-N 3.14Å; M138-C142 PolarHBondContact O-SG 3.33Å; M138-C142 VanDerWaalsContact O-SG 3.37Å
139	T	38.2	Very low	33.3	Very low	93 Å²	93	116.5 Å²	116.5	57%	0.571	66%	0.661	S	S	*	*	H	α-helix	trans	-63.6	-27.4	178.2	-56	0	0	0	0	112.7	Q135 L137	Q135-T139 WeakPolarHBondContact O-CB 3.4Å; Q135-T139 PolarHBondContact O-N 3.5Å; Q135-T139 PolarHBondContact O-OG1 3.01Å; L137-T139 VanDerWaalsContact C-N 3.29Å; L137-T139 PolarHBondContact O-N 2.71Å
140	R	33.6	Very low	33.4	Very low	180 Å²	180	116.3 Å²	116.3	68%	0.679	66%	0.658	S	S	*	*	H	α-helix	trans	-81.4	-21.4	174.2	-67.7	-175	-174.2	-161.7	4.5	113.8	E136 L137 M138	E136-R140 PolarHBondContact O-N 3.38Å; E136-R140 IonicContact OE1-NH2 2.64Å; L137-R140 PolarHBondContact O-N 3.11Å; L137-R140 VanDerWaalsContact O-N 3.16Å; M138-R140 PolarHBondContact O-N 3.05Å
141	L	34.3	Very low	33.1	Very low	116 Å²	116	116.8 Å²	116.8	61%	0.607	66%	0.662	S	S	*	*	H	α-helix	trans	-78.6	-38.3	169.5	-87.6	155.6	0	0	0	111.8	L137 M138 F143 L144	L137-L141 PolarHBondContact O-N 2.64Å; M138-L141 PolarHBondContact O-N 3.16Å; L141-F143 PolarHBondContact O-N 3.49Å; L141-F143 VanDerWaalsContact O-N 3.08Å; L141-L144 PolarHBondContact O-N 3.05Å; L141-L144 VanDerWaalsContact O-N 3.08Å
142	C	31.4	Very low	32.8	Very low	98 Å²	98	119.8 Å²	119.8	66%	0.662	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.9	-5.1	178	-66.5	0	0	0	0	115.1	M138	M138-C142 PolarHBondContact O-N 3.14Å; M138-C142 PolarHBondContact O-SG 3.33Å; M138-C142 VanDerWaalsContact O-SG 3.37Å
143	F	31.3	Very low	32.4	Very low	190 Å²	190	117 Å²	117	83%	0.833	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.6	-6.4	172	-158.3	-97.9	0	0	0	113.6	L141	L141-F143 PolarHBondContact O-N 3.49Å; L141-F143 VanDerWaalsContact O-N 3.08Å
144	L	31.1	Very low	31.8	Very low	141 Å²	141	119 Å²	119	74%	0.738	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.8	-15.9	-174.2	-97.9	163.7	0	0	0	115.4	L141	L141-L144 PolarHBondContact O-N 3.05Å; L141-L144 VanDerWaalsContact O-N 3.08Å
145	L	32.7	Very low	31.5	Very low	158 Å²	158	120.5 Å²	120.5	83%	0.827	70%	0.702	S	S	*	*			trans	-138.3	91.4	-177.8	-70.1	175.1	0	0	0	111.9
146	G	29	Very low	32	Very low	66 Å²	66	119.9 Å²	119.9	68%	0.68	71%	0.709	S	S	*	*			trans	-81.2	172	172.2	0	0	0	0	0	114.3
147	E	29	Very low	31.3	Very low	182 Å²	182	121.6 Å²	121.6	85%	0.85	72%	0.719	S	S	*	*			trans	-90.3	-176.3	-175.9	-53.2	176.2	121.9	0	0	111.2
148	A	27.8	Very low	30.9	Very low	60 Å²	60	122.8 Å²	122.8	50%	0.496	72%	0.721	S	S	.	*			cis	-163	174.4	16.5	0	0	0	0	0	111.9
149	T	27	Very low	30.6	Very low	144 Å²	144	122.1 Å²	122.1	88%	0.883	72%	0.72	S	S	*	*			trans	49.8	141.8	151.5	53.1	0	0	0	0	121.7
150	G	26.6	Very low	30.3	Very low	73 Å²	73	126.8 Å²	126.8	75%	0.753	73%	0.727	S	S	*	*			cis	150.7	167.1	-4.4	0	0	0	0	0	112.7
151	S	24.9	Very low	30.3	Very low	103 Å²	103	127.3 Å²	127.3	72%	0.72	73%	0.729	S	S	*	*			trans	134.2	133	150.6	-169	0	0	0	0	117.5
152	T	27.3	Very low	30.3	Very low	131 Å²	131	127.1 Å²	127.1	80%	0.804	73%	0.725	S	S	*	*			trans	58.5	144.5	149.8	45.8	0	0	0	0	121.3
153	A	26.9	Very low	30.4	Very low	80 Å²	80	130.3 Å²	130.3	66%	0.661	73%	0.727	S	S	*	*			cis	-170.8	162.3	-12.8	0	0	0	0	0	112.4
154	S	27.2	Very low	30.5	Very low	119 Å²	119	129.8 Å²	129.8	83%	0.832	73%	0.725	S	S	*	*			trans	68.4	160.2	164.3	80.3	0	0	0	0	117.6
155	S	31.4	Very low	30.3	Very low	109 Å²	109	126.6 Å²	126.6	76%	0.762	73%	0.725	S	S	*	*			cis	-162.4	175.9	-28.9	58.8	0	0	0	0	109.1
156	P	48.2	Very low	30	Very low	114 Å²	114	125.1 Å²	125.1	74%	0.74	72%	0.718	S	S	*	*			trans	-119.4	-160.1	-144.3	43.7	-34.9	0	0	0	118.4
157	M	25.4	Very low	30.1	Very low	159 Å²	159	127.8 Å²	127.8	78%	0.783	72%	0.722	S	S	*	*			trans	85.5	153.4	170.4	-61	180	105.2	0	0	116.6
158	E	29.2	Very low	30.2	Very low	153 Å²	153	124.2 Å²	124.2	72%	0.715	72%	0.717	S	S	*	*			cis	-164.3	173	-16.1	-110.9	-157.7	130.8	0	0	106.6
159	D	30.8	Very low	30.4	Very low	96 Å²	96	125.4 Å²	125.4	51%	0.513	73%	0.727	S	S	.	*			cis	-165.3	-179.9	-19.7	173.2	37.7	0	0	0	106.2
160	R	31.3	Very low	30.6	Very low	190 Å²	190	127.9 Å²	127.9	72%	0.717	73%	0.728	S	S	*	*			trans	81.4	121.9	164.2	-59.8	-166.2	149	66.9	-18.3	115.9
161	R	34.4	Very low	30.6	Very low	192 Å²	192	128.5 Å²	128.5	73%	0.725	74%	0.735	S	S	*	*				70.1	150.3	64.4	-66.3	172.4	-177.5	-102	7.7	112.4
162	E	33.7	Very low	30.6	Very low	112 Å²	112	127.4 Å²	127.4	52%	0.523	74%	0.74	S	S	.	*			cis	-169.2	164.3	-12.7	-100.9	176.3	100.9	0	0	105.5
163	K	34.1	Very low	30.8	Very low	165 Å²	165	127 Å²	127	72%	0.717	74%	0.742	S	S	*	*			cis	-160.9	145.5	7	-133.4	168.5	178.8	140.9	0	111.3
164	K	32.3	Very low	31.8	Very low	179 Å²	179	128.9 Å²	128.9	78%	0.778	75%	0.748	S	S	*	*				28.6	132.8	129	-169.2	-175.3	-178.7	-175.3	0	120.7
165	G	26.7	Very low	31.7	Very low	73 Å²	73	128.2 Å²	128.2	75%	0.753	74%	0.743	S	S	*	*			trans	177	78.9	166.7	0	0	0	0	0	117.4
166	D	27.9	Very low	31.7	Very low	127 Å²	127	127.9 Å²	127.9	68%	0.679	74%	0.741	S	S	*	*			trans	-52.1	163.4	162.6	-44.1	-73.4	0	0	0	113
167	T	30.1	Very low	30.7	Very low	123 Å²	123	128.5 Å²	128.5	76%	0.755	74%	0.743	S	S	*	*			cis	-166.5	165.6	15.8	-12.5	0	0	0	0	113.2
168	S	30.8	Very low	30.8	Very low	106 Å²	106	128 Å²	128	74%	0.741	74%	0.742	S	S	*	*			trans	67.5	122.1	139.1	69.8	0	0	0	0	124.6
169	A	32.7	Very low	30.6	Very low	86 Å²	86	126.9 Å²	126.9	71%	0.711	75%	0.746	S	S	*	*				108.3	120.6	120.3	0	0	0	0	0	122.6
170	Q	30	Very low	30.4	Very low	195 Å²	195	127.6 Å²	127.6	91%	0.911	76%	0.758	S	S	*	*			trans	60.3	100.8	139.7	-66.4	-178.3	-23.4	0	0	121.7
171	G	26.6	Very low	30.3	Very low	86 Å²	86	122.8 Å²	122.8	89%	0.887	75%	0.753	S	S	*	*				102.5	104.4	92.5	0	0	0	0	0	118.8
172	G	26.4	Very low	30	Very low	80 Å²	80	120 Å²	120	83%	0.825	76%	0.757	S	S	*	*			trans	-179.8	127.1	166.5	0	0	0	0	0	113.9
173	S	30.4	Very low	29.8	Very low	122 Å²	122	121 Å²	121	85%	0.853	77%	0.771	S	S	*	*			trans	-129.3	166.3	172	-58.7	0	0	0	0	107.9
174	P	47.6	Very low	29.5	Very low	120 Å²	120	118.5 Å²	118.5	78%	0.779	78%	0.775	S	S	*	*			cis	-138	-160.2	14.2	42.6	-22.1	0	0	0	115.5
175	S	26	Very low	30.1	Very low	106 Å²	106	115.4 Å²	115.4	74%	0.741	77%	0.773	S	S	*	*			trans	-34	165.1	173.6	-37.8	0	0	0	0	118.8
176	S	30.5	Very low	30.1	Very low	102 Å²	102	117.3 Å²	117.3	71%	0.713	77%	0.773	S	S	*	*			cis	-164.9	147.3	24.1	-18.6	0	0	0	0	115.8
177	T	27	Very low	30.1	Very low	127 Å²	127	117 Å²	117	78%	0.779	78%	0.777	S	S	*	*			trans	56.9	140	138.7	-14.4	0	0	0	0	126
178	L	27.5	Very low	29.9	Very low	148 Å²	148	119.9 Å²	119.9	78%	0.775	78%	0.781	S	S	*	*			trans	106.4	149.7	145.3	-68.7	-176.6	0	0	0	122.2
179	T	26.8	Very low	29.9	Very low	130 Å²	130	120 Å²	120	80%	0.798	78%	0.782	S	S	*	*			trans	73.6	153.7	171.7	71.8	0	0	0	0	116.6
180	C	26.1	Very low	30.2	Very low	111 Å²	111	121.3 Å²	121.3	75%	0.75	78%	0.783	S	S	*	*			cis	-172.9	172.3	-14.8	-101.1	0	0	0	0	107.8
181	S	29.5	Very low	29.9	Very low	89 Å²	89	117.9 Å²	117.9	62%	0.622	78%	0.776	S	S	*	*			cis	-170.9	159.8	-11.8	-109.2	0	0	0	0	111.4
182	T	28.6	Very low	29.9	Very low	133 Å²	133	118.5 Å²	118.5	82%	0.816	77%	0.767	S	S	*	*			trans	64.2	157.3	157.1	57.7	0	0	0	0	118.4
183	T	27.8	Very low	29.9	Very low	133 Å²	133	120.2 Å²	120.2	82%	0.816	76%	0.761	S	S	*	*			cis	-153.3	165.5	32.3	44.2	0	0	0	0	114.2
184	S	29.4	Very low	29.7	Very low	113 Å²	113	122 Å²	122	79%	0.79	76%	0.761	S	S	*	*			trans	-109.9	169.3	167	-47.5	0	0	0	0	111.9
185	P	44	Very low	28.7	Very low	113 Å²	113	120.6 Å²	120.6	73%	0.734	75%	0.754	S	S	*	*				-147.1	150.9	89.9	37.8	-18.6	0	0	0	115
186	C	26.8	Very low	28.8	Very low	113 Å²	113	122 Å²	122	76%	0.764	76%	0.758	S	S	*	*				65.8	143	94.8	-46.8	0	0	0	0	115.8
187	T	28	Very low	28.6	Very low	122 Å²	122	122.1 Å²	122.1	75%	0.748	76%	0.759	S	S	*	*			cis	-162.6	174.2	3.8	-1.6	0	0	0	0	113.2
188	E	25.1	Very low	28.7	Very low	182 Å²	182	121 Å²	121	85%	0.85	76%	0.762	S	S	*	*			trans	83.7	159.2	154	-82	171.6	-138.1	0	0	122.4
189	S	31.2	Very low	28.7	Very low	110 Å²	110	117.9 Å²	117.9	77%	0.769	77%	0.766	S	S	*	*			trans	-149.8	155.7	-171.9	-49.2	0	0	0	0	108.3
190	P	39.3	Very low	28.7	Very low	112 Å²	112	115.1 Å²	115.1	73%	0.727	76%	0.763	S	S	*	*				-159.9	170.7	103.4	39.6	-20.1	0	0	0	118.2
191	T	23.7	Very low	28.8	Very low	123 Å²	123	119.1 Å²	119.1	76%	0.755	77%	0.771	S	S	*	*			trans	57.1	130.1	145.1	48.5	0	0	0	0	124.3
192	S	26.4	Very low	28.6	Very low	100 Å²	100	120.2 Å²	120.2	70%	0.699	78%	0.778	S	S	*	*			trans	15.2	155.3	137.5	62	0	0	0	0	122.1
193	T	26.5	Very low	28.5	Very low	116 Å²	116	121.5 Å²	121.5	71%	0.712	78%	0.779	S	S	*	*				-175.5	167.9	50.4	-27.5	0	0	0	0	113
194	L	26.3	Very low	29.1	Very low	159 Å²	159	120.9 Å²	120.9	83%	0.832	78%	0.778	S	S	*	*			trans	73.8	155.5	154.4	-78	164.8	0	0	0	118.6
195	S	26.3	Very low	29.1	Very low	91 Å²	91	123.1 Å²	123.1	64%	0.636	78%	0.776	S	S	*	*			cis	-151.1	149.2	9.1	49.5	0	0	0	0	116.4
196	T	27.5	Very low	28.9	Very low	134 Å²	134	122.9 Å²	122.9	82%	0.822	77%	0.774	S	S	*	*			trans	66.2	147.4	147.6	45.8	0	0	0	0	121.1
197	S	27.8	Very low	29	Very low	106 Å²	106	124.7 Å²	124.7	74%	0.741	78%	0.775	S	S	*	*			cis	-153	145	6.5	50.3	0	0	0	0	114.5
198	A	28.3	Very low	30.5	Very low	103 Å²	103	123.8 Å²	123.8	85%	0.851	77%	0.771	S	S	*	*			trans	44.6	130.6	155.3	0	0	0	0	0	121
199	G	26.6	Very low	30.5	Very low	83 Å²	83	122.5 Å²	122.5	86%	0.856	77%	0.77	S	S	*	*			cis	95.5	131.5	2.9	0	0	0	0	0	114.2
200	G	27.1	Very low	30.2	Very low	71 Å²	71	122.4 Å²	122.4	73%	0.732	77%	0.769	S	S	*	*			cis	176.4	-163.7	-0.6	0	0	0	0	0	112.4
201	Q	28.4	Very low	29.6	Very low	196 Å²	196	122 Å²	122	92%	0.916	77%	0.769	S	S	*	*			trans	72.9	153.7	178.7	-56.8	-176.8	6.5	0	0	116.4
202	S	24.6	Very low	30.7	Very low	111 Å²	111	121.1 Å²	121.1	78%	0.776	77%	0.765	S	S	*	*			cis	-163	173.9	-19.8	52.3	0	0	0	0	112.6
203	L	26.5	Very low	30.8	Very low	160 Å²	160	124.5 Å²	124.5	84%	0.838	77%	0.769	S	S	*	*			trans	-63.6	176.7	173.2	-71.9	159.1	0	0	0	114.1
204	P	41.1	Very low	30.9	Very low	120 Å²	120	130.1 Å²	130.1	78%	0.779	78%	0.778	S	S	*	*			cis	-144.1	-164.1	17.9	42.8	-20.3	0	0	0	118.6
205	Q	29.3	Very low	30.9	Very low	161 Å²	161	126 Å²	126	75%	0.752	77%	0.774	S	S	*	*			trans	-61.5	-174.2	166.7	-68.2	-173.9	-12.3	0	0	113.8
206	P	40.6	Very low	31	Very low	108 Å²	108	126.9 Å²	126.9	70%	0.701	78%	0.78	S	S	*	*			cis	-158.9	154.4	27.1	42.5	-17.5	0	0	0	124.7
207	L	28.9	Very low	31	Very low	150 Å²	150	126 Å²	126	79%	0.785	78%	0.779	S	S	*	*			trans	65.7	-171.1	134.2	-55.7	172.2	0	0	0	119.8
208	P	58.3	Low	31	Very low	103 Å²	103	126.4 Å²	126.4	67%	0.669	78%	0.782	S	S	*	*				-140.9	-138.6	-102.8	46.2	-23.6	0	0	0	115.3
209	L	25.4	Very low	31	Very low	156 Å²	156	126.8 Å²	126.8	82%	0.817	78%	0.778	S	S	*	*			trans	89.7	143.5	175.8	-53	165.1	0	0	0	114.7
210	S	24.4	Very low	31.9	Very low	108 Å²	108	128.4 Å²	128.4	76%	0.755	77%	0.774	S	S	*	*			cis	-157.1	171.3	-6	-116.6	0	0	0	0	113.1
211	S	27.5	Very low	32	Very low	104 Å²	104	131.4 Å²	131.4	73%	0.727	78%	0.782	S	S	*	*			trans	-85.7	-172	172.9	68.4	0	0	0	0	111.2
212	P	46	Very low	31.9	Very low	103 Å²	103	125.6 Å²	125.6	67%	0.669	78%	0.775	S	S	*	*			cis	-151.6	173	29.4	45.3	-23.6	0	0	0	120.7
213	H	28.8	Very low	32.1	Very low	171 Å²	171	126.3 Å²	126.3	79%	0.792	78%	0.775	S	S	*	*			trans	43	159.6	137.3	-63.5	-37.7	0	0	0	123.9
214	R	28.4	Very low	32.2	Very low	235 Å²	235	126.1 Å²	126.1	89%	0.887	77%	0.774	S	S	*	*			cis	-163.9	149.4	11.8	-138.8	173.8	-172.6	-152.6	3	114.6
215	G	26.5	Very low	31.5	Very low	72 Å²	72	125.3 Å²	125.3	74%	0.742	77%	0.77	S	S	*	*			trans	78.3	158	142.5	0	0	0	0	0	120.7
216	S	28.9	Very low	31.6	Very low	110 Å²	110	122.9 Å²	122.9	77%	0.769	77%	0.77	S	S	*	*			cis	-172.8	161.6	-13.1	48	0	0	0	0	113.1
217	S	27.8	Very low	32.1	Very low	114 Å²	114	124 Å²	124	80%	0.797	78%	0.777	S	S	*	*			trans	65	153.4	164.4	33.4	0	0	0	0	118.7
218	S	27.6	Very low	32.3	Very low	115 Å²	115	120.7 Å²	120.7	80%	0.804	77%	0.772	S	S	*	*			cis	-160.9	165.3	-6.2	43.8	0	0	0	0	112.1
219	S	28.9	Very low	31	Very low	111 Å²	111	125.4 Å²	125.4	78%	0.776	79%	0.785	S	S	*	*			trans	-80.8	176.9	174.3	-35.1	0	0	0	0	112.9
220	P	45.8	Very low	31.4	Very low	118 Å²	118	122.7 Å²	122.7	77%	0.766	78%	0.779	S	S	*	*				-153.8	158.7	61.3	41.2	-19.7	0	0	0	120.8
221	C	27.4	Very low	32.6	Very low	133 Å²	133	123.6 Å²	123.6	90%	0.899	78%	0.783	S	S	*	*			trans	36.1	142.2	135.8	-151.6	0	0	0	0	125.1
222	G	27.1	Very low	32.9	Very low	75 Å²	75	124.5 Å²	124.5	77%	0.773	78%	0.784	S	S	*	*			trans	-170.8	136.7	161.5	0	0	0	0	0	114.5
223	T	29.7	Very low	33.3	Very low	125 Å²	125	125.4 Å²	125.4	77%	0.767	79%	0.789	S	S	*	*			trans	-96.5	161.7	-168.8	48.9	0	0	0	0	114.4
224	L	28.3	Very low	33.3	Very low	156 Å²	156	122.6 Å²	122.6	82%	0.817	79%	0.788	S	S	*	*			cis	-155.6	-152.5	-2.2	-113.9	166.2	0	0	0	107
225	C	26.1	Very low	33.4	Very low	103 Å²	103	116.2 Å²	116.2	70%	0.696	78%	0.779	S	S	*	*			cis	-161.6	-174.6	10.2	-149.8	0	0	0	0	112.1
226	S	30.9	Very low	33.5	Very low	110 Å²	110	119 Å²	119	77%	0.769	78%	0.782	S	S	*	*			trans	-157.8	167.2	165.8	-65.2	0	0	0	0	109.7
227	P	52.3	Low	33.4	Very low	131 Å²	131	119.2 Å²	119.2	85%	0.851	78%	0.784	S	S	*	*				-154	-153.2	86.3	40.3	-19.1	0	0	0	113.2
228	A	31.7	Very low	33.4	Very low	82 Å²	82	117.1 Å²	117.1	68%	0.678	78%	0.78	S	S	*	*				-172.8	161.3	-76.6	0	0	0	0	0	108.9
229	H	30.9	Very low	33.3	Very low	201 Å²	201	119.1 Å²	119.1	93%	0.931	78%	0.781	S	S	*	*			trans	170	144.3	138.6	-95.9	-63.5	0	0	0	114.3
230	S	34.1	Very low	33.2	Very low	100 Å²	100	121.3 Å²	121.3	70%	0.699	78%	0.782	S	S	*	*			trans	-161.3	167.9	163.8	60.3	0	0	0	0	109.2
231	P	50.9	Low	32.2	Very low	127 Å²	127	121 Å²	121	83%	0.825	78%	0.783	S	S	*	*			trans	-130.6	155.3	159.6	36.2	-22.8	0	0	0	114.3
232	T	33.7	Very low	32.1	Very low	122 Å²	122	121.2 Å²	121.2	75%	0.748	78%	0.78	S	S	*	*			trans	-126.1	-169.3	179.3	63.4	0	0	0	0	111.8
233	P	53.9	Low	31.9	Very low	122 Å²	122	123.1 Å²	123.1	79%	0.792	78%	0.781	S	S	*	*				-131.1	-114.5	120.6	38	-28.2	0	0	0	114
234	C	29.3	Very low	31.9	Very low	113 Å²	113	122.5 Å²	122.5	76%	0.764	78%	0.782	S	S	*	*			trans	-138.9	-175.8	-156.9	-60.7	0	0	0	0	110.6
235	S	28.9	Very low	32.2	Very low	100 Å²	100	121.3 Å²	121.3	70%	0.699	78%	0.784	S	S	*	*			cis	-152.6	134.1	19.1	-54	0	0	0	0	114.8
236	T	29	Very low	32.1	Very low	130 Å²	130	119.8 Å²	119.8	80%	0.798	79%	0.785	S	S	*	*			trans	39.3	138.8	139.8	59.7	0	0	0	0	122.3
237	S	27.8	Very low	32.4	Very low	116 Å²	116	120.7 Å²	120.7	81%	0.811	79%	0.788	S	S	*	*			cis	-174	167	-7.2	-84.8	0	0	0	0	108.6
238	G	26.5	Very low	31.4	Very low	70 Å²	70	119.5 Å²	119.5	72%	0.722	78%	0.781	S	S	*	*			cis	137.6	78.5	-8.5	0	0	0	0	0	115.7
239	L	26.2	Very low	31.1	Very low	157 Å²	157	121 Å²	121	82%	0.822	78%	0.782	S	S	*	*			trans	-142.4	116.8	171.4	-81.3	175.7	0	0	0	114.2
240	I	27.6	Very low	30.8	Very low	157 Å²	157	120.3 Å²	120.3	81%	0.805	78%	0.779	S	S	*	*				44.6	134	129.5	-55.3	178.6	0	0	0	118.9
241	S	23.6	Very low	30.3	Very low	110 Å²	110	120.4 Å²	120.4	77%	0.769	78%	0.78	S	S	*	*			cis	-143.1	-179.9	18.3	57.1	0	0	0	0	114.4
242	V	24.6	Very low	29.2	Very low	139 Å²	139	120.5 Å²	120.5	84%	0.842	78%	0.78	S	S	*	*			trans	-133.7	141.2	-178.4	173.4	0	0	0	0	111.1
243	S	24.8	Very low	28.8	Very low	114 Å²	114	121.1 Å²	121.1	80%	0.797	78%	0.784	S	S	*	*			trans	-165.6	111.4	154.5	53.4	0	0	0	0	115.1
244	S	29.2	Very low	27.4	Very low	112 Å²	112	121.1 Å²	121.1	78%	0.783	79%	0.787	S	S	*	*			trans	-92.9	174	145.4	-50.4	0	0	0	0	107.8
245	P	33.8	Very low	27.3	Very low	132 Å²	132	121.9 Å²	121.9	86%	0.857	79%	0.788	S	S	*	*			cis	-150	-172.3	29.7	44.7	-23.7	0	0	0	117.7
246	G	24.4	Very low	27.1	Very low	71 Å²	71	125.6 Å²	125.6	73%	0.732	80%	0.799	S	S	*	*			trans	124.2	126.1	147	0	0	0	0	0	118
247	P	36.9	Very low	27	Very low	128 Å²	128	125.2 Å²	125.2	83%	0.831	79%	0.788	S	S	*	*			trans	-107.5	-175.7	172.5	47.2	-38.1	0	0	0	110.6
248	P	32.5	Very low	27	Very low	106 Å²	106	124.1 Å²	124.1	69%	0.688	78%	0.781	S	S	*	*				-153.2	164	66.3	41.7	-20.2	0	0	0	119.3
249	T	24.1	Very low	27	Very low	114 Å²	114	130 Å²	130	70%	0.699	79%	0.787	S	S	*	*			trans	69.8	134.1	142.5	43.2	0	0	0	0	125.2
250	Q	24.3	Very low	26.9	Very low	186 Å²	186	130.1 Å²	130.1	87%	0.869	79%	0.788	S	S	*	*			trans	97.6	152.7	137.9	-81	174.6	60.2	0	0	120.9
251	S	24.8	Very low	26.9	Very low	103 Å²	103	128.4 Å²	128.4	72%	0.72	79%	0.79	S	S	*	*			trans	-141.2	147	-152.3	53.8	0	0	0	0	111.8
252	P	28.2	Very low	26.9	Very low	128 Å²	128	126.3 Å²	126.3	83%	0.831	79%	0.786	S	S	*	*			trans	-98.7	130.4	165.1	34.4	-27.8	0	0	0	112.1
253	T	24.6	Very low	26.8	Very low	135 Å²	135	128 Å²	128	83%	0.828	79%	0.789	S	S	*	*			trans	-82	147.9	162.7	45	0	0	0	0	110.8
254	S	25.1	Very low	26.8	Very low	122 Å²	122	129.7 Å²	129.7	85%	0.853	79%	0.787	S	S	*	*			trans	-125.6	135.7	161.5	61.4	0	0	0	0	111.1
255	T	26.8	Very low	26.8	Very low	130 Å²	130	128.9 Å²	128.9	80%	0.798	79%	0.787	S	S	*	*			trans	-143.1	138.5	175.7	47.8	0	0	0	0	108.7
256	L	24	Very low	26.3	Very low	178 Å²	178	128.8 Å²	128.8	93%	0.932	78%	0.784	S	S	*	*			trans	-153.3	150.1	147.6	-141.9	77.4	0	0	0	110.6
257	E	27.2	Very low	26.4	Very low	121 Å²	121	132.3 Å²	132.3	57%	0.565	78%	0.784	S	S	*	*			trans	-95.6	162.9	172.2	-47	175	97.5	0	0	109.8	K907	E257-K907 VanDerWaalsContact OE1-CE 3.24Å; E257-K907 WeakPolarHBondContact OE1-CE 3.25Å; E257-K907 IonicContact OE1-NZ 3.85Å; E257-K907 PolarHBondContact OE1-NZ 3.26Å; E257-K907 IonicContact OE2-NZ 2.68Å; E257-K907 PolarHBondContact OE2-NZ 3.07Å
258	S	28.8	Very low	26	Very low	93 Å²	93	132.3 Å²	132.3	65%	0.65	78%	0.782	S	S	*	*				-175.3	164	99.2	69.7	0	0	0	0	112.9
259	K	25.2	Very low	25.5	Very low	194 Å²	194	133.1 Å²	133.1	84%	0.843	79%	0.791	S	S	*	*			trans	45	115.8	153.5	-63.4	160.2	-174.9	172.1	0	118
260	D	25.3	Very low	25.6	Very low	159 Å²	159	133.3 Å²	133.3	85%	0.85	80%	0.796	S	S	*	*				-149.8	167.8	95	-136.8	-27.3	0	0	0	113.1
261	S	27.6	Very low	25.7	Very low	121 Å²	121	130.3 Å²	130.3	85%	0.846	80%	0.796	S	S	*	*			trans	-150.7	89.3	179.4	-76.5	0	0	0	0	112.1
262	G	22.2	Very low	25.6	Very low	66 Å²	66	134.4 Å²	134.4	68%	0.68	80%	0.804	S	S	*	*			trans	-169.4	155.6	173.1	0	0	0	0	0	115.4
263	I	23.6	Very low	25.4	Very low	176 Å²	176	135.2 Å²	135.2	90%	0.903	80%	0.801	S	S	*	*			trans	76.4	148.8	152.6	-56.5	179	0	0	0	117.5
264	I	25	Very low	25.4	Very low	149 Å²	149	137 Å²	137	76%	0.764	80%	0.8	S	S	*	*			trans	-96.8	163.7	-172.1	-67.6	163.8	0	0	0	109	T266	I264-T266 PolarHBondContact O-N 3.35Å
265	A	29	Very low	25.5	Very low	94 Å²	94	137.4 Å²	137.4	78%	0.777	79%	0.788	S	S	*	*			trans	-67.2	119	-174.4	0	0	0	0	0	114.3
266	T	23.1	Very low	25.4	Very low	131 Å²	131	141.2 Å²	141.2	80%	0.804	79%	0.788	S	S	*	*			trans	-147.9	121	150.5	-63.3	0	0	0	0	111.6	I264	I264-T266 PolarHBondContact O-N 3.35Å
267	I	26.2	Very low	25.3	Very low	144 Å²	144	136.8 Å²	136.8	74%	0.738	77%	0.772	S	S	*	*			trans	12.5	115.8	149.9	-41	-176.5	0	0	0	121.3
268	T	28.6	Very low	25.1	Very low	128 Å²	128	137.1 Å²	137.1	79%	0.785	78%	0.783	S	S	*	*			trans	67.8	150.9	146.9	60.7	0	0	0	0	126
269	S	23	Very low	24.8	Very low	124 Å²	124	137.4 Å²	137.4	87%	0.867	79%	0.785	S	S	*	*			trans	102.7	159.4	154.2	78.2	0	0	0	0	118.2
270	S	25.5	Very low	24.7	Very low	117 Å²	117	132.8 Å²	132.8	82%	0.818	78%	0.777	S	S	*	*			trans	-152.1	138	-154	55.1	0	0	0	0	114.1
271	S	25	Very low	24.6	Very low	124 Å²	124	132.6 Å²	132.6	87%	0.867	78%	0.776	S	S	*	*			trans	-165.2	178.6	161.5	55	0	0	0	0	111
272	E	23.7	Very low	24.5	Very low	189 Å²	189	132.1 Å²	132.1	88%	0.883	77%	0.767	S	S	*	*			trans	-118.1	164.1	-151.6	-57	165.1	107.4	0	0	115.8
273	N	24.3	Very low	24.6	Very low	144 Å²	144	136 Å²	136	77%	0.77	77%	0.772	S	S	*	*			trans	48.3	130.1	146.1	-118.4	45.9	0	0	0	123.4
274	E	25	Very low	24.7	Very low	174 Å²	174	133.5 Å²	133.5	81%	0.813	77%	0.765	S	S	*	*				-176.6	179.4	104.8	-86.8	-117.7	115.8	0	0	111.8
275	E	25.5	Very low	24.7	Very low	129 Å²	129	133.7 Å²	133.7	60%	0.603	76%	0.76	S	S	*	*			trans	-99.3	176.7	-154	-43.1	-178.2	124.3	0	0	118.5
276	R	24.7	Very low	24.5	Very low	211 Å²	211	135.2 Å²	135.2	80%	0.796	75%	0.751	S	S	*	*			trans	73	153	146.5	-80.5	170.6	163.2	138	-9.8	117.6
277	S	23.1	Very low	24.4	Very low	85 Å²	85	137.4 Å²	137.4	59%	0.594	75%	0.752	S	S	*	*			cis	-160.5	162	-2.1	-128.2	0	0	0	0	112.3
278	T	21.8	Very low	24.5	Very low	128 Å²	128	134.7 Å²	134.7	79%	0.785	75%	0.752	S	S	*	*			trans	60.3	151.3	151.6	51.4	0	0	0	0	120.6
279	S	23.3	Very low	24.9	Very low	99 Å²	99	135 Å²	135	69%	0.692	76%	0.755	S	S	*	*			cis	-173.2	-179.4	-18	53.9	0	0	0	0	110.3
280	S	23.5	Very low	25	Very low	97 Å²	97	132.7 Å²	132.7	68%	0.678	75%	0.752	S	S	*	*			trans	68.2	127.8	165.5	40	0	0	0	0	118.4
281	D	23.8	Very low	24.9	Very low	154 Å²	154	131.2 Å²	131.2	82%	0.824	76%	0.755	S	S	*	*			cis	96.1	147.7	43.2	-73.6	-44.8	0	0	0	112.1
282	V	24.5	Very low	25	Very low	111 Å²	111	131.4 Å²	131.4	67%	0.673	76%	0.756	S	S	*	*			cis	-162.5	148	11.5	103.2	0	0	0	0	112.7
283	L	24.9	Very low	25.1	Very low	149 Å²	149	126.4 Å²	126.4	78%	0.78	76%	0.755	S	S	*	*			trans	42.6	179	151.8	-55.8	164.9	0	0	0	121.2
284	T	24.4	Very low	25.3	Very low	122 Å²	122	123 Å²	123	75%	0.748	76%	0.755	S	S	*	*			cis	-167.7	171.9	5.8	4.1	0	0	0	0	106.7
285	K	26	Very low	25.5	Very low	153 Å²	153	121.8 Å²	121.8	67%	0.665	76%	0.758	S	S	*	*			cis	-175.7	177.6	-27.5	-163.2	-171.4	176	-81.3	0	107.5
286	E	23.7	Very low	25.8	Very low	126 Å²	126	124.6 Å²	124.6	59%	0.589	77%	0.774	S	S	*	*			trans	71.2	154	165.7	-41.9	-54.2	40.8	0	0	119
287	E	22.6	Very low	26	Very low	177 Å²	177	117.6 Å²	117.6	83%	0.827	77%	0.768	S	S	*	*			cis	-158.1	-175.3	-14.1	-119.7	-175.5	149.6	0	0	111.7
288	A	26.8	Very low	26.2	Very low	88 Å²	88	125.4 Å²	125.4	73%	0.727	78%	0.784	S	S	*	*			trans	-126.1	177	177.1	0	0	0	0	0	111.1
289	P	37.6	Very low	26.7	Very low	133 Å²	133	123.7 Å²	123.7	86%	0.864	78%	0.783	S	S	*	*			cis	-157.3	-175.8	49.3	43.5	-20.4	0	0	0	119.7
290	G	25.4	Very low	27	Very low	77 Å²	77	122 Å²	122	79%	0.794	78%	0.782	S	S	*	*			trans	112.2	96.6	131.3	0	0	0	0	0	125.7
291	G	24.1	Very low	27.4	Very low	85 Å²	85	125 Å²	125	88%	0.876	79%	0.79	S	S	*	*			trans	64.9	171.3	140.8	0	0	0	0	0	123.6
292	S	26.7	Very low	27.8	Very low	129 Å²	129	123 Å²	123	90%	0.902	78%	0.779	S	S	*	*			cis	-172.5	144.6	-30.1	-163.9	0	0	0	0	114.5
293	G	26	Very low	27.9	Very low	83 Å²	83	128 Å²	128	86%	0.856	79%	0.786	S	S	*	*			trans	81.1	155.3	161.2	0	0	0	0	0	120.2
294	G	27.6	Very low	28.1	Very low	74 Å²	74	129.7 Å²	129.7	76%	0.763	79%	0.789	S	S	*	*			cis	169.1	167.1	-12.4	0	0	0	0	0	116.6
295	V	29.8	Very low	29.7	Very low	147 Å²	147	130 Å²	130	89%	0.891	79%	0.794	S	S	*	*			trans	87.5	98.4	150.4	-170.7	0	0	0	0	124
296	M	30.8	Very low	29.7	Very low	189 Å²	189	126.2 Å²	126.2	93%	0.931	80%	0.798	S	S	*	*				68.5	133.4	116.7	-149.3	65.8	171.6	0	0	127.7
297	G	29.2	Very low	30	Very low	64 Å²	64	128.7 Å²	128.7	66%	0.66	81%	0.809	S	S	*	*			trans	165.5	159.6	155.2	0	0	0	0	0	113.9
298	R	27.5	Very low	30.3	Very low	248 Å²	248	125.9 Å²	125.9	94%	0.936	80%	0.804	S	S	*	*			cis	-152.1	-116.8	-16.6	-148.8	175.9	-161.6	-76.3	-3.5	114.1
299	A	33	Very low	30.6	Very low	92 Å²	92	131.3 Å²	131.3	76%	0.76	81%	0.806	S	S	*	*			trans	-157.3	168.9	-172.6	0	0	0	0	0	112.1
300	G	29.3	Very low	30.2	Very low	65 Å²	65	130.2 Å²	130.2	67%	0.67	79%	0.793	S	S	*	*			cis	-159.1	-142.2	7.1	0	0	0	0	0	109.6
301	D	32.3	Very low	30.3	Very low	158 Å²	158	132.2 Å²	132.2	85%	0.845	79%	0.786	S	S	*	*			cis	-178.6	167	-14.3	-77.9	-33	0	0	0	106.6
302	D	30.6	Very low	30.6	Very low	114 Å²	114	135.1 Å²	135.1	61%	0.61	78%	0.78	S	S	*	*			cis	-173.5	163.6	-25.6	178.5	28.5	0	0	0	111.4
303	R	27.6	Very low	30.5	Very low	216 Å²	216	135.2 Å²	135.2	82%	0.815	78%	0.775	S	S	*	*			trans	85.6	152.9	155.7	-113.5	164.6	-80.5	-160.5	-3.2	125.9
304	H	28.7	Very low	30.6	Very low	183 Å²	183	135.2 Å²	135.2	85%	0.847	77%	0.768	S	S	*	*			trans	-123.8	-151.7	-178.4	-56.8	-94.6	0	0	0	111.6
305	P	58.4	Low	31.7	Very low	130 Å²	130	136.9 Å²	136.9	84%	0.844	77%	0.765	S	S	*	*			cis	-138.4	177.1	-28	33	-11.4	0	0	0	117.2
306	G	25.8	Very low	31.7	Very low	73 Å²	73	138 Å²	138	75%	0.753	76%	0.761	S	S	*	*			trans	99.3	173	146.3	0	0	0	0	0	121.6
307	Q	30.8	Very low	32.5	Very low	177 Å²	177	133.4 Å²	133.4	83%	0.827	75%	0.745	S	S	*	*			cis	-171.2	119.9	-30.9	-156.5	179	-79.7	0	0	116.5
308	T	27.2	Very low	32.3	Very low	118 Å²	118	138.3 Å²	138.3	72%	0.724	76%	0.756	S	S	*	*			trans	60.1	148.3	155.1	51.2	0	0	0	0	125.7
309	R	34.3	Very low	32.3	Very low	202 Å²	202	131 Å²	131	76%	0.762	75%	0.748	S	S	*	*			trans	86.6	157.6	162	-48.9	-145.2	68.6	135.6	-1.6	116.6
310	D	28.9	Very low	32.1	Very low	110 Å²	110	134.8 Å²	134.8	59%	0.588	76%	0.755	S	S	*	*			cis	-171.1	175.3	-10.2	-114	45.6	0	0	0	109.2
311	N	28.4	Very low	32.1	Very low	120 Å²	120	137.1 Å²	137.1	64%	0.642	76%	0.758	S	S	*	*			cis	-167.3	-179.8	-18.9	-149.6	-42.2	0	0	0	110.5
312	L	28.6	Very low	31.9	Very low	146 Å²	146	141.1 Å²	141.1	76%	0.764	76%	0.761	S	S	*	*			trans	58	110.9	165.6	-59.9	171.3	0	0	0	119.1
313	T	26.5	Very low	31.8	Very low	130 Å²	130	139.7 Å²	139.7	80%	0.798	76%	0.76	S	S	*	*				78.8	131.7	62.4	-65.8	0	0	0	0	113.5
314	A	26.7	Very low	31.9	Very low	84 Å²	84	136.9 Å²	136.9	69%	0.694	76%	0.757	S	S	*	*			cis	-173.6	-159.4	-13.2	0	0	0	0	0	107.2
315	P	51.5	Low	32.5	Very low	109 Å²	109	134.9 Å²	134.9	71%	0.708	75%	0.751	S	S	*	*			cis	-139.9	-173.2	-11.1	45.4	-27	0	0	0	117.1
316	Q	29.2	Very low	31.2	Very low	171 Å²	171	137.3 Å²	137.3	80%	0.799	75%	0.753	S	S	*	*			trans	74.3	146.6	160.3	-62.6	-72.1	-67.7	0	0	119.9
317	P	48.1	Very low	31.4	Very low	91 Å²	91	140.7 Å²	140.7	59%	0.591	75%	0.749	S	S	*	*			cis	-136.9	175	-43.7	38.2	-21.8	0	0	0	115.2
318	D	25.7	Very low	32.2	Very low	168 Å²	168	136 Å²	136	90%	0.898	73%	0.734	S	S	*	*			trans	65.8	165.4	162.9	-60.5	-22.8	0	0	0	119.7
319	A	27.5	Very low	32.1	Very low	94 Å²	94	141.8 Å²	141.8	78%	0.777	74%	0.743	S	S	*	*			trans	-132.3	178.6	-147.1	0	0	0	0	0	114.7
320	L	27.9	Very low	31.6	Very low	171 Å²	171	138.3 Å²	138.3	90%	0.895	74%	0.744	S	S	*	*			trans	106.5	154.6	-179	-60.7	172.6	0	0	0	114.3
321	P	28.3	Very low	32.6	Very low	114 Å²	114	138.6 Å²	138.6	74%	0.74	75%	0.752	S	S	*	*			trans	-99.1	147.4	-145.3	36.3	-35.7	0	0	0	116.5
322	R	28.1	Very low	33.5	Very low	242 Å²	242	138.2 Å²	138.2	91%	0.913	76%	0.756	S	S	*	*			trans	-66.9	133	162.6	-80.4	180	177.6	173.1	-1.3	110.5
323	S	29.2	Very low	33.3	Very low	84 Å²	84	135.7 Å²	135.7	59%	0.587	76%	0.756	S	S	*	*			cis	70	142.7	13.7	129.8	0	0	0	0	114.7
324	E	30.1	Very low	33.9	Very low	158 Å²	158	134.9 Å²	134.9	74%	0.738	75%	0.753	S	S	*	*			cis	-159.8	148.1	-7.4	-111.1	160.6	144.5	0	0	108.4
325	I	41.6	Very low	33.9	Very low	140 Å²	140	140.5 Å²	140.5	72%	0.718	76%	0.762	S	S	*	*				54.4	126.3	91.6	-54.5	-176.2	0	0	0	116.3
326	M	31.3	Very low	32.6	Very low	181 Å²	181	147.1 Å²	147.1	89%	0.892	77%	0.773	S	S	*	*			trans	-155.6	155.5	146.7	-90.3	-163.6	75.3	0	0	108.9
327	E	30.1	Very low	32.7	Very low	145 Å²	145	145 Å²	145	68%	0.678	77%	0.774	S	S	*	*			cis	-165.1	-153.6	-37.6	-111.5	-75.2	76.4	0	0	106.2
328	P	48.1	Very low	32	Very low	79 Å²	79	148 Å²	148	51%	0.513	78%	0.784	S	S	.	*				-136.8	176.4	-120.1	37.7	-14.8	0	0	0	119.3
329	R	25.1	Very low	32	Very low	238 Å²	238	146 Å²	146	90%	0.898	78%	0.78	S	S	*	*				160.8	169.5	125	-84.7	168.5	-175.1	-171	1.2	114.3
330	T	22.9	Very low	32.1	Very low	130 Å²	130	150.2 Å²	150.2	80%	0.798	78%	0.784	S	S	*	*			trans	-130.6	-176.7	-156.2	51.3	0	0	0	0	112.5
331	P	49.7	Very low	32.2	Very low	116 Å²	116	151 Å²	151	75%	0.753	78%	0.782	S	S	*	*			cis	-121.5	-129.3	-7.3	34.2	-10.2	0	0	0	110
332	P	46.5	Very low	32.1	Very low	111 Å²	111	154.3 Å²	154.3	72%	0.721	79%	0.788	S	S	*	*			cis	-136.6	-176.4	-28.5	38.3	-18.8	0	0	0	116.8
333	A	24.7	Very low	32	Very low	93 Å²	93	150.6 Å²	150.6	77%	0.769	78%	0.784	S	S	*	*			trans	74.3	160.3	151.5	0	0	0	0	0	119.4
334	P	39.9	Very low	31.9	Very low	114 Å²	114	156 Å²	156	74%	0.74	80%	0.8	S	S	*	*				-136.6	152.8	-117.3	37.6	-17.4	0	0	0	121.3
335	K	26.2	Very low	31.7	Very low	201 Å²	201	151.9 Å²	151.9	87%	0.874	80%	0.8	S	S	*	*			trans	64.4	116.3	148.7	-69.1	176.8	179.3	179.3	0	122.2
336	R	23.9	Very low	31	Very low	249 Å²	249	154.1 Å²	154.1	94%	0.94	81%	0.813	S	S	*	*				-170.8	168.1	120.8	-103.9	179.8	178.8	-176.2	0.8	111.9
337	P	31.1	Very low	30.7	Very low	125 Å²	125	151.1 Å²	151.1	81%	0.812	81%	0.81	S	S	*	*			trans	-100	177.9	-150.4	39.4	-40.3	0	0	0	119
338	L	33.8	Very low	30.5	Very low	154 Å²	154	149.2 Å²	149.2	81%	0.806	81%	0.812	S	S	*	*			trans	-64.5	166.6	-171.1	-64.8	160.8	0	0	0	117.7
339	P	26.5	Very low	29.7	Very low	126 Å²	126	151.6 Å²	151.6	82%	0.818	82%	0.82	S	S	*	*				-119.5	174.9	114.4	36.8	-35.1	0	0	0	113.9
340	Q	28.3	Very low	29.7	Very low	184 Å²	184	144.6 Å²	144.6	86%	0.86	81%	0.813	S	S	*	*			trans	-104.4	163.9	-167.4	-65.9	167.9	-69.6	0	0	114.4
341	H	31.8	Very low	30	Very low	186 Å²	186	146.1 Å²	146.1	86%	0.861	81%	0.813	S	S	*	*			trans	-66.6	153.5	177.1	-67.8	-99.3	0	0	0	113.9
342	H	24.5	Very low	29.6	Very low	185 Å²	185	144.4 Å²	144.4	86%	0.856	80%	0.802	S	S	*	*			trans	-147.7	146.2	147.4	-122.8	-76.2	0	0	0	112.2
343	I	26	Very low	28.7	Very low	164 Å²	164	149.7 Å²	149.7	84%	0.841	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-78.2	135	179	-61.8	166.3	0	0	0	109.4
344	Q	28.2	Very low	28.9	Very low	197 Å²	197	151.2 Å²	151.2	92%	0.921	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-92.7	123.4	175.3	-70.7	178.7	-74.4	0	0	111.3
345	G	25.5	Very low	28.2	Very low	72 Å²	72	153.1 Å²	153.1	74%	0.742	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-102.8	143.8	166.3	0	0	0	0	0	111.1
346	L	27.8	Very low	28.5	Very low	187 Å²	187	147.5 Å²	147.5	98%	0.979	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-67.3	143.9	170.3	-69.6	160.1	0	0	0	110
347	S	24.9	Very low	29.1	Very low	118 Å²	118	138.5 Å²	138.5	83%	0.825	77%	0.772	S	S	*	*			trans	-141.5	150.9	177.6	-165.2	0	0	0	0	111.3
348	S	25.3	Very low	29	Very low	104 Å²	104	135 Å²	135	73%	0.727	75%	0.754	S	S	*	*			trans	-83.8	165	-162.3	51.8	0	0	0	0	114.9	A350	S348-A350 PolarHBondContact O-N 3.06Å
349	L	32	Very low	29	Very low	130 Å²	130	129.2 Å²	129.2	68%	0.681	73%	0.728	S	S	*	*			trans	-58.9	103.8	176.5	-73.6	164.8	0	0	0	112.2	E881	L349-E881 HydrophobicContact CD1-CB 4.11Å; L349-E881 WeakPolarHBondContact CD1-O 3.24Å
350	A	23.6	Very low	29.6	Very low	90 Å²	90	125.7 Å²	125.7	74%	0.744	70%	0.704	S	S	*	*			trans	-141.5	136.6	169.1	0	0	0	0	0	111.2	S348	S348-A350 PolarHBondContact O-N 3.06Å
351	M	29.7	Very low	30.1	Very low	163 Å²	163	118.2 Å²	118.2	80%	0.803	67%	0.673	S	S	*	*			trans	-153.4	161.4	-176.1	-92.8	-70.9	-159.5	0	0	110.5	R364	M351-R364 PolarHBondContact O-NH2 3.45Å
352	P	41.9	Very low	30.6	Very low	80 Å²	80	110 Å²	110	52%	0.519	64%	0.636	S	S	.	*			cis	-127.3	175.6	0.6	39.4	-24.1	0	0	0	115.7
353	R	26.2	Very low	31.4	Very low	222 Å²	222	104.7 Å²	104.7	84%	0.838	62%	0.617	S	S	*	*			trans	-78.6	163.5	160.9	-81	-179.8	175.2	164.3	-1.2	111.4	N355	R353-N355 PolarHBondContact O-N 3.07Å
354	P	29.2	Very low	32.5	Very low	125 Å²	125	102.8 Å²	102.8	81%	0.812	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.7	-18.4	-151.6	-28.8	37.2	0	0	0	119.9
355	N	26.1	Very low	33.6	Very low	153 Å²	153	94.3 Å²	94.3	82%	0.818	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108	12.8	-164.9	-67.8	1.5	0	0	0	115.2	R353	R353-N355 PolarHBondContact O-N 3.07Å
356	S	31.6	Very low	34.9	Very low	84 Å²	84	92.8 Å²	92.8	59%	0.587	53%	0.533	S	S	*	.			trans	-79.2	133.1	173.8	-175	0	0	0	0	111.1	A358	S356-A358 PolarHBondContact O-N 3.44Å
357	V	36.2	Very low	36	Very low	59 Å²	59	87.8 Å²	87.8	36%	0.358	51%	0.508	S	S	.	.			trans	-83.4	55	-170.1	-165.4	0	0	0	0	112.4	L414 D837	V357-L414 HydrophobicContact CG1-CB 3.88Å; V357-L414 HydrophobicContact CG1-CD1 3.84Å; V357-L414 HydrophobicContact CG1-CG 3.96Å; V357-L414 HydrophobicContact CG2-CD1 4Å; V357-D837 HydrophobicContact CB-CB 4.43Å; V357-D837 HydrophobicContact CG2-CB 3.91Å
358	A	29.2	Very low	36.7	Very low	53 Å²	53	85.6 Å²	85.6	44%	0.438	49%	0.486	S	S	.	.			trans	-94.2	88.4	161	0	0	0	0	0	108	S356 T360 S361	S356-A358 PolarHBondContact O-N 3.44Å; A358-T360 PolarHBondContact O-N 3.22Å; A358-S361 PolarHBondContact O-N 2.91Å
359	A	35	Very low	37.2	Very low	32 Å²	32	84.3 Å²	84.3	26%	0.264	48%	0.477	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.7	104.1	179.1	0	0	0	0	0	110	S361 L413	A359-S361 PolarHBondContact O-N 3.14Å; A359-S361 VanDerWaalsContact O-N 3.1Å; A359-L413 HydrophobicContact CB-CD2 4.03Å
360	T	39.5	Very low	37.4	Very low	51 Å²	51	85.4 Å²	85.4	31%	0.313	47%	0.473	S	S	.	.	T	Hydrogen-bonded Turn	trans	36.5	50.4	-166.8	50.6	0	0	0	0	112.9	A358 S362 K411	A358-T360 PolarHBondContact O-N 3.22Å; T360-S362 PolarHBondContact O-N 3.46Å; T360-K411 HydrophobicContact CG2-CB 4.29Å; T360-K411 HydrophobicContact CG2-CD 4.02Å; T360-K411 HydrophobicContact CG2-CG 4.18Å
361	S	37.9	Very low	38.1	Very low	28 Å²	28	85.2 Å²	85.2	20%	0.196	46%	0.46	C	S	.	.			trans	-1.4	103.9	-175	61.2	0	0	0	0	115.4	A358 A359 T363 R364	A358-S361 PolarHBondContact O-N 2.91Å; A359-S361 PolarHBondContact O-N 3.14Å; A359-S361 VanDerWaalsContact O-N 3.1Å; S361-T363 PolarHBondContact O-N 3.21Å; S361-R364 PolarHBondContact O-N 3.13Å; S361-R364 WeakPolarHBondContact OG-CG 3.37Å
362	S	43	Very low	38.2	Very low	14 Å²	14	81.4 Å²	81.4	10%	0.098	44%	0.442	C	S	.	.	G	3₁₀ helix	trans	-43.8	-33.8	179.6	175.2	0	0	0	0	114.4	T360 R364 L365 Q887 R936	T360-S362 PolarHBondContact O-N 3.46Å; S362-R364 PolarHBondContact O-N 2.85Å; S362-L365 VanDerWaalsContact O-CB 3.28Å; S362-L365 WeakPolarHBondContact O-CB 3.47Å; S362-L365 PolarHBondContact O-N 2.96Å; S362-Q887 VanDerWaalsContact C-OE1 3.3Å; S362-Q887 VanDerWaalsContact CB-OE1 3.26Å; S362-Q887 VanDerWaalsContact OG-CD 3.29Å; S362-Q887 PolarHBondContact OG-NE2 3.17Å; S362-Q887 PolarHBondContact OG-OE1 3.36Å; S362-R936 VanDerWaalsContact OG-CZ 3.29Å; S362-R936 PolarHBondContact OG-NE 3.07Å; S362-R936 PolarHBondContact OG-NH2 3.32Å
363	T	41.3	Very low	37.8	Very low	73 Å²	73	83.2 Å²	83.2	45%	0.448	45%	0.448	S	S	.	.	G	3₁₀ helix	trans	-61.7	-9.6	176	49.3	0	0	0	0	115.4	S361	S361-T363 PolarHBondContact O-N 3.21Å
364	R	47.4	Very low	38.5	Very low	123 Å²	123	76.9 Å²	76.9	46%	0.464	43%	0.428	S	S	.	.	G	3₁₀ helix	trans	-114.9	13.8	177.7	-58.7	-166.6	-175.6	-178.7	2	114.2	M351 S361 S362 E366 D367	M351-R364 PolarHBondContact O-NH2 3.45Å; S361-R364 PolarHBondContact O-N 3.13Å; S361-R364 WeakPolarHBondContact OG-CG 3.37Å; S362-R364 PolarHBondContact O-N 2.85Å; R364-E366 PolarHBondContact O-N 3.48Å; R364-D367 HydrophobicContact CB-CB 4.47Å; R364-D367 WeakPolarHBondContact CG-OD2 3.4Å; R364-D367 PolarHBondContact O-N 2.71Å
365	L	52.7	Low	39	Very low	20 Å²	20	80 Å²	80	11%	0.105	42%	0.423	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-15.3	177.5	-167.1	67.6	0	0	0	113.9	S362 L582 R583 V586 L935 R936	S362-L365 VanDerWaalsContact O-CB 3.28Å; S362-L365 WeakPolarHBondContact O-CB 3.47Å; S362-L365 PolarHBondContact O-N 2.96Å; L365-L582 HydrophobicContact CD1-CB 4.01Å; L365-L582 HydrophobicContact CD1-CD2 4.19Å; L365-L582 HydrophobicContact CD1-CG 3.83Å; L365-R583 HydrophobicContact CD1-CB 4.16Å; L365-R583 PolarHBondContact O-NH1 3.22Å; L365-V586 HydrophobicContact CD2-CG2 4.17Å; L365-L935 HydrophobicContact CD2-CB 4.33Å; L365-L935 HydrophobicContact CD2-CD2 3.86Å; L365-L935 HydrophobicContact CG-CD2 3.96Å; L365-R936 HydrophobicContact CD2-CG 4.14Å
366	E	52.4	Low	39.2	Very low	39 Å²	39	76.5 Å²	76.5	18%	0.182	42%	0.416	C	S	.	.	T	Hydrogen-bonded Turn	trans	-124	2.7	-170.8	-64.7	166.6	-154.3	0	0	113.1	R364 L368 R886 L935	R364-E366 PolarHBondContact O-N 3.48Å; E366-L368 VanDerWaalsContact C-N 3.33Å; E366-L368 PolarHBondContact O-N 3.05Å; E366-R886 WeakPolarHBondContact OE2-CD 3.31Å; E366-R886 IonicContact OE2-CZ 3.87Å; E366-R886 IonicContact OE2-NE 3.82Å; E366-R886 IonicContact OE2-NH1 3.3Å; E366-R886 PolarHBondContact OE2-NH1 2.99Å; E366-L935 HydrophobicContact CG-CB 4.17Å; E366-L935 WeakPolarHBondContact OE1-CB 3.29Å; E366-L935 PolarHBondContact OE1-N 3.18Å
367	D	49.9	Very low	39.3	Very low	82 Å²	82	77.4 Å²	77.4	44%	0.439	42%	0.422	S	S	.	.			trans	-78.4	73.3	178.2	-81	-31.9	0	0	0	112	R364 S369 Y370	R364-D367 HydrophobicContact CB-CB 4.47Å; R364-D367 WeakPolarHBondContact CG-OD2 3.4Å; R364-D367 PolarHBondContact O-N 2.71Å; D367-S369 PolarHBondContact O-N 3.03Å; D367-S369 VanDerWaalsContact O-N 3.14Å; D367-Y370 WeakPolarHBondContact O-CB 3.29Å; D367-Y370 PolarHBondContact O-N 2.9Å; D367-Y370 VanDerWaalsContact O-N 3.1Å
368	L	41.3	Very low	39.4	Very low	73 Å²	73	76.7 Å²	76.7	38%	0.382	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.4	-32.9	-179.7	-68.3	178.1	0	0	0	113.8	E366 Y370 L371 D372 E961	E366-L368 VanDerWaalsContact C-N 3.33Å; E366-L368 PolarHBondContact O-N 3.05Å; L368-Y370 PolarHBondContact O-N 3.26Å; L368-Y370 VanDerWaalsContact O-N 3.1Å; L368-L371 PolarHBondContact O-N 2.79Å; L368-D372 PolarHBondContact O-N 2.95Å; L368-E961 WeakPolarHBondContact CD1-OE2 3.29Å
369	S	35.2	Very low	39.5	Very low	77 Å²	77	83.4 Å²	83.4	54%	0.538	45%	0.449	S	S	.	.	H	α-helix	trans	-60.9	-20	179.7	62.4	0	0	0	0	113.9	D367 L371 N373	D367-S369 PolarHBondContact O-N 3.03Å; D367-S369 VanDerWaalsContact O-N 3.14Å; S369-L371 VanDerWaalsContact C-N 3.32Å; S369-N373 PolarHBondContact O-N 3.37Å; S369-N373 PolarHBondContact O-ND2 3.19Å
370	Y	35.6	Very low	39.3	Very low	152 Å²	152	93.8 Å²	93.8	60%	0.596	48%	0.481	S	S	*	.	H	α-helix	trans	-76	-19.4	175.3	-164.5	-104.2	0	0	0	113.3	D367 L368 Q374	D367-Y370 WeakPolarHBondContact O-CB 3.29Å; D367-Y370 PolarHBondContact O-N 2.9Å; D367-Y370 VanDerWaalsContact O-N 3.1Å; L368-Y370 PolarHBondContact O-N 3.26Å; L368-Y370 VanDerWaalsContact O-N 3.1Å; Y370-Q374 PolarHBondContact O-NE2 3.4Å; Y370-Q374 VanDerWaalsContact O-NE2 3.16Å
371	L	38.2	Very low	38.7	Very low	87 Å²	87	95.1 Å²	95.1	46%	0.455	51%	0.505	S	S	.	.	H	α-helix	trans	-91.6	-44.1	178.9	-61.6	176	0	0	0	111.9	L368 S369 N373 Q374 R375	L368-L371 PolarHBondContact O-N 2.79Å; S369-L371 VanDerWaalsContact C-N 3.32Å; L371-N373 PolarHBondContact O-N 3.44Å; L371-Q374 WeakPolarHBondContact O-CB 3.49Å; L371-Q374 PolarHBondContact O-N 3.25Å; L371-Q374 VanDerWaalsContact O-N 3.12Å; L371-R375 PolarHBondContact O-N 2.68Å
372	D	32.8	Very low	38.3	Very low	82 Å²	82	99.4 Å²	99.4	44%	0.439	54%	0.535	S	S	.	.	H	α-helix	trans	-68.3	-33.1	179.8	-78	-40.7	0	0	0	113.1	L368 Q374 R375 A376	L368-D372 PolarHBondContact O-N 2.95Å; D372-Q374 PolarHBondContact O-N 3.1Å; D372-R375 WeakPolarHBondContact O-CB 3.35Å; D372-R375 PolarHBondContact O-N 3.31Å; D372-R375 VanDerWaalsContact O-N 3.14Å; D372-R375 WeakPolarHBondContact OD1-CD 3.28Å; D372-R375 IonicContact OD1-CZ 2.67Å; D372-R375 IonicContact OD1-NE 3.29Å; D372-R375 IonicContact OD1-NH1 2.76Å; D372-R375 PolarHBondContact OD1-NH1 3.03Å; D372-A376 PolarHBondContact O-N 3.08Å
373	N	33.5	Very low	37.8	Very low	119 Å²	119	104.8 Å²	104.8	64%	0.636	57%	0.567	S	S	*	*	H	α-helix	trans	-63.5	-24	172.6	-82.5	-56.3	0	0	0	113.2	S369 L371	S369-N373 PolarHBondContact O-N 3.37Å; S369-N373 PolarHBondContact O-ND2 3.19Å; L371-N373 PolarHBondContact O-N 3.44Å
374	Q	40.1	Very low	37.3	Very low	89 Å²	89	113.1 Å²	113.1	42%	0.416	59%	0.59	S	S	.	*	H	α-helix	trans	-76.6	-41.1	172.8	-66	-178.2	45.6	0	0	111.1	Y370 L371 D372 A376 S377	Y370-Q374 PolarHBondContact O-NE2 3.4Å; Y370-Q374 VanDerWaalsContact O-NE2 3.16Å; L371-Q374 WeakPolarHBondContact O-CB 3.49Å; L371-Q374 PolarHBondContact O-N 3.25Å; L371-Q374 VanDerWaalsContact O-N 3.12Å; D372-Q374 PolarHBondContact O-N 3.1Å; Q374-A376 VanDerWaalsContact C-N 3.29Å; Q374-A376 PolarHBondContact O-N 3.29Å; Q374-S377 PolarHBondContact O-N 2.97Å; Q374-S377 PolarHBondContact O-OG 3.48Å
375	R	40.1	Very low	36.5	Very low	189 Å²	189	115.6 Å²	115.6	71%	0.713	61%	0.605	S	S	*	*	H	α-helix	trans	-57.9	-40.3	173.8	-65.2	174.7	174.9	157.5	-7.8	112.2	L371 D372 S377	L371-R375 PolarHBondContact O-N 2.68Å; D372-R375 WeakPolarHBondContact O-CB 3.35Å; D372-R375 PolarHBondContact O-N 3.31Å; D372-R375 VanDerWaalsContact O-N 3.14Å; D372-R375 WeakPolarHBondContact OD1-CD 3.28Å; D372-R375 IonicContact OD1-CZ 2.67Å; D372-R375 IonicContact OD1-NE 3.29Å; D372-R375 IonicContact OD1-NH1 2.76Å; D372-R375 PolarHBondContact OD1-NH1 3.03Å; R375-S377 VanDerWaalsContact C-N 3.25Å; R375-S377 PolarHBondContact O-N 2.73Å
376	A	31.1	Very low	35.4	Very low	81 Å²	81	124 Å²	124	67%	0.669	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.6	-11.4	-179.8	0	0	0	0	0	115	D372 Q374 G378	D372-A376 PolarHBondContact O-N 3.08Å; Q374-A376 VanDerWaalsContact C-N 3.29Å; Q374-A376 PolarHBondContact O-N 3.29Å; A376-G378 VanDerWaalsContact C-N 3.34Å; A376-G378 PolarHBondContact O-N 2.8Å
377	S	33.1	Very low	34.2	Very low	103 Å²	103	128.7 Å²	128.7	72%	0.72	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.8	-9.4	-175.7	71.1	0	0	0	0	114.8	Q374 R375	Q374-S377 PolarHBondContact O-N 2.97Å; Q374-S377 PolarHBondContact O-OG 3.48Å; R375-S377 VanDerWaalsContact C-N 3.25Å; R375-S377 PolarHBondContact O-N 2.73Å
378	G	37.8	Very low	33.2	Very low	44 Å²	44	132.1 Å²	132.1	45%	0.454	69%	0.694	S	S	.	*	S	Bend	trans	-96.5	129	177.6	0	0	0	0	0	113.3	A376	A376-G378 VanDerWaalsContact C-N 3.34Å; A376-G378 PolarHBondContact O-N 2.8Å
379	H	31.5	Very low	32.7	Very low	194 Å²	194	133.7 Å²	133.7	90%	0.898	72%	0.717	S	S	*	*			trans	76.3	92	170.1	-52.1	93	0	0	0	118.7
380	R	30.4	Very low	32.3	Very low	249 Å²	249	133.3 Å²	133.3	94%	0.94	73%	0.725	S	S	*	*			trans	-149.3	53.2	139.9	-126.8	178.5	-167.6	-140.8	2	114.6	S382	R380-S382 PolarHBondContact O-N 3.09Å
381	G	27.9	Very low	32.1	Very low	80 Å²	80	137.6 Å²	137.6	83%	0.825	74%	0.74	S	S	*	*			trans	-75.2	82.4	171.1	0	0	0	0	0	112.4
382	S	28.6	Very low	31.6	Very low	118 Å²	118	139.2 Å²	139.2	83%	0.825	75%	0.754	S	S	*	*			trans	-78.5	129.6	176	-169.2	0	0	0	0	111.5	R380	R380-S382 PolarHBondContact O-N 3.09Å
383	V	33.8	Very low	31.4	Very low	127 Å²	127	140.8 Å²	140.8	77%	0.77	77%	0.771	S	S	*	*			trans	-85.6	120.5	-177.2	176.9	0	0	0	0	111.1
384	R	29.9	Very low	31.3	Very low	247 Å²	247	141.7 Å²	141.7	93%	0.932	78%	0.776	S	S	*	*			trans	-145.2	125.9	151	-117.2	175.4	-177.7	174.7	0.5	110.8
385	K	30.9	Very low	30.8	Very low	176 Å²	176	144.6 Å²	144.6	77%	0.765	79%	0.794	S	S	*	*			trans	-79.1	151.4	174.8	-59.5	177.1	179.6	178.8	0	109.9
386	H	29.3	Very low	30.5	Very low	195 Å²	195	140.4 Å²	140.4	90%	0.903	79%	0.794	S	S	*	*			trans	-154.1	149.5	132	-117.6	-83.4	0	0	0	110.6
387	N	28	Very low	30.5	Very low	139 Å²	139	146.2 Å²	146.2	74%	0.743	80%	0.804	S	S	*	*			trans	-96.3	146.3	-174.4	-60.3	-14	0	0	0	112.1
388	T	29.3	Very low	30.5	Very low	154 Å²	154	145.4 Å²	145.4	95%	0.945	81%	0.812	S	S	*	*				-151.2	156.1	129.8	10.5	0	0	0	0	109.7
389	A	29.2	Very low	30	Very low	106 Å²	106	154.2 Å²	154.2	88%	0.876	83%	0.832	S	S	*	*			trans	-117.1	162.6	-164	0	0	0	0	0	113.5
390	G	27.2	Very low	30.1	Very low	68 Å²	68	152.9 Å²	152.9	70%	0.701	83%	0.83	S	S	*	*			trans	-179.6	55.7	178.2	0	0	0	0	0	120.9
391	R	31	Very low	30	Very low	242 Å²	242	147 Å²	147	91%	0.913	82%	0.822	S	S	*	*			trans	63.9	156.4	152.3	-61.3	-177	170.6	171.4	-4.4	118.4
392	T	29	Very low	30.3	Very low	121 Å²	121	148.3 Å²	148.3	74%	0.742	82%	0.816	S	S	*	*			cis	-163.4	152.4	-21.6	23.4	0	0	0	0	109.7
393	S	28.7	Very low	30.4	Very low	115 Å²	115	152.1 Å²	152.1	80%	0.804	82%	0.818	S	S	*	*			trans	76	146.7	159.3	-111.3	0	0	0	0	121.6
394	D	29.8	Very low	30.5	Very low	139 Å²	139	155.2 Å²	155.2	74%	0.743	82%	0.821	S	S	*	*			trans	-50.1	171	-179.3	-52.6	-68.1	0	0	0	116.7
395	D	29.7	Very low	31.3	Very low	150 Å²	150	149.7 Å²	149.7	80%	0.802	81%	0.805	S	S	*	*			cis	-151.7	178.3	27.6	-159.9	6.8	0	0	0	115.7
396	S	33.7	Very low	32.5	Very low	100 Å²	100	145.5 Å²	145.5	70%	0.699	80%	0.795	S	S	*	*			trans	-95.8	112.7	-152	-55.1	0	0	0	0	114
397	K	31.5	Very low	34.4	Very low	203 Å²	203	143.2 Å²	143.2	88%	0.883	79%	0.789	S	S	*	*			trans	-134	120.4	155	-76.1	-170.8	177.6	174.9	0	111.1	R399	K397-R399 PolarHBondContact O-N 3.33Å
398	G	32.7	Very low	36.9	Very low	86 Å²	86	138.1 Å²	138.1	89%	0.887	76%	0.762	S	S	*	*			trans	-65.1	95.9	-178	0	0	0	0	0	112.5	L400	G398-L400 PolarHBondContact O-N 2.82Å
399	R	28.8	Very low	39.4	Very low	230 Å²	230	135.8 Å²	135.8	87%	0.868	74%	0.741	S	S	*	*			trans	-79.2	97.1	170.1	-169.6	179.4	-167.5	179.9	5.2	108.9	K397 V401	K397-R399 PolarHBondContact O-N 3.33Å; R399-V401 PolarHBondContact O-N 3.45Å
400	L	32.6	Very low	42.1	Very low	165 Å²	165	131 Å²	131	86%	0.864	70%	0.701	S	S	*	*	P	Polyproline II helix	trans	-50.1	116.7	166.2	-75.9	168.2	0	0	0	108.7	G398 P402	G398-L400 PolarHBondContact O-N 2.82Å; L400-P402 WeakPolarHBondContact O-CD 3.39Å
401	V	28.7	Very low	45	Very low	126 Å²	126	133.3 Å²	133.3	76%	0.764	69%	0.692	S	S	*	*	P	Polyproline II helix	trans	-65.9	126.1	173.7	179.4	0	0	0	0	106.9	R399 F403	R399-V401 PolarHBondContact O-N 3.45Å; V401-F403 PolarHBondContact O-N 3.02Å
402	P	33.3	Very low	47.9	Very low	108 Å²	108	122.2 Å²	122.2	70%	0.701	65%	0.651	S	S	*	*	P	Polyproline II helix	trans	-57.3	118.4	175.9	-24.7	34.6	0	0	0	109.5	L400 K404	L400-P402 WeakPolarHBondContact O-CD 3.39Å; P402-K404 PolarHBondContact O-N 3.46Å
403	F	31.6	Very low	50.8	Low	198 Å²	198	117.5 Å²	117.5	87%	0.868	62%	0.621	S	S	*	*			trans	-59.6	112.9	175.6	-145.7	-84.6	0	0	0	107.2	V401 Q405	V401-F403 PolarHBondContact O-N 3.02Å; F403-Q405 PolarHBondContact O-N 2.87Å
404	K	36.4	Very low	53.5	Low	191 Å²	191	116.7 Å²	116.7	83%	0.83	61%	0.608	S	S	*	*			trans	-62.6	113.7	176.1	-74.8	-173.4	176.3	-176.5	0	107.1	P402 T406	P402-K404 PolarHBondContact O-N 3.46Å; K404-T406 PolarHBondContact O-N 2.96Å
405	Q	46.9	Very low	56.2	Low	131 Å²	131	110.8 Å²	110.8	61%	0.612	58%	0.575	S	S	*	*			trans	-59.1	132.4	170.1	-69.5	-173.4	-11	0	0	107.8	F403 D407	F403-Q405 PolarHBondContact O-N 2.87Å; Q405-D407 PolarHBondContact O-N 3.26Å
406	T	54.6	Low	58.7	Low	88 Å²	88	105.6 Å²	105.6	54%	0.54	55%	0.546	S	S	.	.			trans	-65.3	115.8	169.3	24.1	0	0	0	0	108.1	K404 I408 A571	K404-T406 PolarHBondContact O-N 2.96Å; T406-I408 PolarHBondContact O-N 3.5Å; T406-A571 PolarHBondContact OG1-O 2.8Å
407	D	70	Confident	60.8	Low	147 Å²	147	101.6 Å²	101.6	79%	0.786	52%	0.518	S	S	*	.			trans	-66.1	116.6	-178.6	-81.9	-44.5	0	0	0	110.2	Q405 M409	Q405-D407 PolarHBondContact O-N 3.26Å; D407-M409 PolarHBondContact O-N 3Å
408	I	80.2	Confident	62.6	Low	33 Å²	33	93 Å²	93	17%	0.169	48%	0.483	C	S	.	.			trans	-75.2	125.1	175.8	-66.3	167.9	0	0	0	108.4	T406 L410 R567 L570 A571	T406-I408 PolarHBondContact O-N 3.5Å; I408-L410 HydrophobicContact CG2-CB 4.05Å; I408-L410 HydrophobicContact CG2-CD1 4.18Å; I408-L410 HydrophobicContact CG2-CG 3.83Å; I408-L410 PolarHBondContact O-N 3.46Å; I408-R567 HydrophobicContact CD1-CB 4.42Å; I408-R567 HydrophobicContact CD1-CG 3.35Å; I408-R567 WeakPolarHBondContact CD1-O 3.28Å; I408-L570 HydrophobicContact CD1-CB 4.32Å; I408-A571 HydrophobicContact CD1-CB 4.21Å; I408-A571 HydrophobicContact CG1-CB 4.19Å
409	M	81.2	Confident	64.1	Low	104 Å²	104	91.6 Å²	91.6	51%	0.512	47%	0.468	S	S	.	.			trans	-75.4	-7.1	-170	-61.7	-174.8	71.9	0	0	114.1	D407	D407-M409 PolarHBondContact O-N 3Å
410	L	86.6	Confident	65.7	Low	6 Å²	6	82 Å²	82	3%	0.031	43%	0.434	C	S	.	.			trans	-73.7	132.1	-177.2	-50.8	-178.8	0	0	0	112.4	I408 H551 A554 A555 L570 L580	I408-L410 HydrophobicContact CG2-CB 4.05Å; I408-L410 HydrophobicContact CG2-CD1 4.18Å; I408-L410 HydrophobicContact CG2-CG 3.83Å; I408-L410 PolarHBondContact O-N 3.46Å; L410-H551 VanDerWaalsContact CD2-CE1 3.49Å; L410-H551 WeakPolarHBondContact CD2-CE1 3.39Å; L410-A554 HydrophobicContact CD1-CB 4.42Å; L410-A555 HydrophobicContact CB-CB 3.72Å; L410-L570 HydrophobicContact CD1-CD1 3.93Å; L410-L580 HydrophobicContact CD1-CB 4.22Å; L410-L580 HydrophobicContact CD1-CD1 3.94Å; L410-L580 HydrophobicContact CD2-CB 3.81Å
411	K	88.4	Confident	67	Low	116 Å²	116	77.5 Å²	77.5	50%	0.504	41%	0.414	S	S	.	.			trans	-127.6	119.4	-179.9	-63	-172.8	-177.4	-178.7	0	110.6	T360 H551	T360-K411 HydrophobicContact CG2-CB 4.29Å; T360-K411 HydrophobicContact CG2-CD 4.02Å; T360-K411 HydrophobicContact CG2-CG 4.18Å; K411-H551 PolarHBondContact N-NE2 3.35Å; K411-H551 VanDerWaalsContact N-NE2 3.16Å; K411-H551 PolarHBondContact O-CD2 3.18Å; K411-H551 VanDerWaalsContact O-CD2 3.26Å; K411-H551 PolarHBondContact O-NE2 3.19Å
412	P	90.6	Very high	68.2	Low	10 Å²	10	76 Å²	76	7%	0.065	42%	0.415	C	S	.	.			trans	-71.6	156.8	177.4	33.6	-35.7	0	0	0	110.8	A555 L556 R559	P412-A555 HydrophobicContact CB-CB 4.02Å; P412-A555 HydrophobicContact CG-CB 4.45Å; P412-L556 HydrophobicContact CB-CD2 3.67Å; P412-L556 HydrophobicContact CB-CG 3.76Å; P412-L556 HydrophobicContact CG-CD2 4.01Å; P412-R559 VanDerWaalsContact CD-NH2 3.34Å
413	L	89.9	Confident	68.9	Low	22 Å²	22	79.5 Å²	79.5	12%	0.115	42%	0.422	C	S	.	.			trans	-63.3	143.1	164.7	-66.6	170.7	0	0	0	109.5	A359 F415 T543 E548 S552	A359-L413 HydrophobicContact CB-CD2 4.03Å; L413-F415 HydrophobicContact CB-CD2 4.48Å; L413-F415 HydrophobicContact CB-CE1 4.02Å; L413-F415 HydrophobicContact CB-CE2 3.82Å; L413-F415 HydrophobicContact CB-CZ 3.55Å; L413-F415 HydrophobicContact CD1-CE1 4.04Å; L413-F415 HydrophobicContact CD1-CZ 3.79Å; L413-F415 HydrophobicContact CG-CZ 4.32Å; L413-T543 HydrophobicContact CD1-CG2 4.43Å; L413-E548 HydrophobicContact CD1-CB 4.3Å; L413-S552 PolarHBondContact N-OG 2.73Å
414	L	85.5	Confident	70.3	Confident	98 Å²	98	74 Å²	74	51%	0.513	41%	0.405	S	S	.	.			trans	-99.4	107.2	170.9	-58.8	-175.4	0	0	0	109.2	V357	V357-L414 HydrophobicContact CG1-CB 3.88Å; V357-L414 HydrophobicContact CG1-CD1 3.84Å; V357-L414 HydrophobicContact CG1-CG 3.96Å; V357-L414 HydrophobicContact CG2-CD1 4Å
415	F	87.9	Confident	71.8	Confident	15 Å²	15	68.2 Å²	68.2	7%	0.066	39%	0.387	C	S	.	.			trans	-86	140.3	177.4	-53.6	-80.8	0	0	0	110.6	L413 Y533 H534 F535 T543	L413-F415 HydrophobicContact CB-CD2 4.48Å; L413-F415 HydrophobicContact CB-CE1 4.02Å; L413-F415 HydrophobicContact CB-CE2 3.82Å; L413-F415 HydrophobicContact CB-CZ 3.55Å; L413-F415 HydrophobicContact CD1-CE1 4.04Å; L413-F415 HydrophobicContact CD1-CZ 3.79Å; L413-F415 HydrophobicContact CG-CZ 4.32Å; F415-Y533 HydrophobicContact CD2-CD2 4.11Å; F415-Y533 AromaticContact CD2-CE2 3.61Å; F415-Y533 HydrophobicContact CD2-CE2 3.61Å; F415-Y533 HydrophobicContact CE2-CD2 4.48Å; F415-Y533 HydrophobicContact CE2-CE2 4.27Å; F415-H534 HydrophobicContact CZ-CB 4.33Å; F415-H534 AromaticContact CZ-CE1 3.86Å; F415-H534 AromaticContact CZ-CG 3.8Å; F415-H534 AromaticContact CZ-ND1 3.46Å; F415-H534 WeakPolarHBondContact CZ-ND1 3.3Å; F415-F535 HydrophobicContact CB-CB 4.36Å; F415-F535 HydrophobicContact CB-CD2 3.69Å; F415-F535 HydrophobicContact CB-CE2 4.44Å; F415-F535 HydrophobicContact CB-CG 4.36Å; F415-F535 HydrophobicContact CD1-CB 3.7Å; F415-F535 HydrophobicContact CD1-CD2 4.24Å; F415-F535 HydrophobicContact CD1-CG 4.46Å; F415-F535 WeakPolarHBondContact CD1-O 3.23Å; F415-F535 HydrophobicContact CD2-CD2 4.14Å; F415-F535 HydrophobicContact CE1-CB 4.21Å; F415-F535 WeakPolarHBondContact CE1-O 3.41Å; F415-F535 HydrophobicContact CG-CB 4.11Å; F415-F535 AromaticContact CG-CD2 3.76Å; F415-F535 HydrophobicContact CG-CD2 3.76Å; F415-F535 HydrophobicContact CG-CG 4.4Å; F415-T543 HydrophobicContact CD1-CG2 4.21Å; F415-T543 HydrophobicContact CE1-CG2 3.87Å
416	E	81	Confident	73.4	Confident	40 Å²	40	64.3 Å²	64.3	19%	0.187	37%	0.368	C	S	.	.			trans	-133.1	126.1	171.1	-176	155.2	-147	0	0	107.8	P418 Q537 R835 R836	E416-P418 WeakPolarHBondContact O-CD 3.32Å; E416-Q537 PolarHBondContact O-NE2 3.03Å; E416-R835 HydrophobicContact CG-CG 4.44Å; E416-R835 VanDerWaalsContact OE2-CA 3.26Å; E416-R835 WeakPolarHBondContact OE2-CA 3.32Å; E416-R835 WeakPolarHBondContact OE2-CB 3.2Å; E416-R835 IonicContact OE2-NE 2.77Å; E416-R836 WeakPolarHBondContact OE1-CG 3.3Å; E416-R836 IonicContact OE1-NE 3.32Å; E416-R836 PolarHBondContact OE1-NE 2.97Å; E416-R836 PolarHBondContact OE2-N 3.31Å
417	V	77.6	Confident	74.7	Confident	17 Å²	17	63 Å²	63	10%	0.103	36%	0.36	C	S	.	.			trans	-102	110.8	-177.2	175.6	0	0	0	0	108.2	G419 V420 T462 W466 F535	V417-G419 PolarHBondContact O-N 2.88Å; V417-V420 HydrophobicContact CG1-CB 4.15Å; V417-V420 HydrophobicContact CG1-CG2 3.87Å; V417-V420 PolarHBondContact O-N 3.43Å; V417-T462 HydrophobicContact CG1-CG2 3.75Å; V417-T462 HydrophobicContact CG2-CG2 3.98Å; V417-W466 HydrophobicContact CB-CD2 4.24Å; V417-W466 HydrophobicContact CB-CE3 4.14Å; V417-W466 HydrophobicContact CG2-CD2 3.99Å; V417-W466 HydrophobicContact CG2-CE3 3.46Å; V417-W466 VanDerWaalsContact CG2-CE3 3.46Å; V417-W466 HydrophobicContact CG2-CG 4.49Å; V417-W466 HydrophobicContact CG2-CZ3 3.94Å; V417-F535 HydrophobicContact CG2-CD1 4.11Å; V417-F535 HydrophobicContact CG2-CE1 4.01Å; V417-F535 HydrophobicContact CG2-CZ 4.33Å
418	P	70.9	Confident	75.4	Confident	23 Å²	23	56.6 Å²	56.6	15%	0.149	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.5	138.6	175.3	-28	36.8	0	0	0	112.1	E416 V420 V833 M841	E416-P418 WeakPolarHBondContact O-CD 3.32Å; P418-V420 VanDerWaalsContact C-N 3.3Å; P418-V420 PolarHBondContact O-N 3.33Å; P418-V833 HydrophobicContact CB-CB 4.34Å; P418-V833 HydrophobicContact CB-CG2 4.06Å; P418-M841 HydrophobicContact CG-CB 4.36Å; P418-M841 HydrophobicContact CG-CE 4.14Å
419	G	63.3	Low	75.8	Confident	56 Å²	56	55 Å²	55	58%	0.577	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.9	-9.1	175.3	0	0	0	0	0	117	V417	V417-G419 PolarHBondContact O-N 2.88Å
420	V	62.7	Low	76.2	Confident	27 Å²	27	53.2 Å²	53.2	16%	0.164	31%	0.312	C	S	.	.			trans	-114.2	80.8	-179.8	-165.9	0	0	0	0	111.3	V417 P418 A463 W466	V417-V420 HydrophobicContact CG1-CB 4.15Å; V417-V420 HydrophobicContact CG1-CG2 3.87Å; V417-V420 PolarHBondContact O-N 3.43Å; P418-V420 VanDerWaalsContact C-N 3.3Å; P418-V420 PolarHBondContact O-N 3.33Å; V420-A463 HydrophobicContact CG2-CB 4.12Å; V420-W466 VanDerWaalsContact CG1-CD1 3.4Å; V420-W466 HydrophobicContact CG1-CG 4.22Å; V420-W466 PolarHBondContact O-NE1 3.13Å
421	T	59.8	Low	76.3	Confident	71 Å²	71	54.3 Å²	54.3	44%	0.436	32%	0.316	S	S	.	.			trans	-88.8	166.6	177.2	78.8	0	0	0	0	112.3	E423 T424	T421-E423 PolarHBondContact O-N 2.94Å; T421-E423 PolarHBondContact OG1-N 3.04Å; T421-T424 CarbonylContact O-C 3.35Å; T421-T424 PolarHBondContact OG1-N 3.47Å; T421-T424 PolarHBondContact OG1-OG1 3.07Å
422	A	53.8	Low	76.4	Confident	95 Å²	95	48.8 Å²	48.8	79%	0.785	29%	0.292	S	S	*	.	S	Bend	trans	-69.1	-22.9	171.5	0	0	0	0	0	113
423	E	47	Very low	76.6	Confident	182 Å²	182	48.6 Å²	48.6	85%	0.85	29%	0.29	S	S	*	.	S	Bend	trans	-84.5	-26.7	-179.3	-61.7	174.8	-168.7	0	0	112	T421 P425	T421-E423 PolarHBondContact O-N 2.94Å; T421-E423 PolarHBondContact OG1-N 3.04Å; E423-P425 VanDerWaalsContact C-CD 3.47Å; E423-P425 VanDerWaalsContact O-CD 3.29Å; E423-P425 WeakPolarHBondContact O-CD 3.44Å
424	T	62.7	Low	76.6	Confident	83 Å²	83	49.7 Å²	49.7	51%	0.509	30%	0.303	S	S	.	.	S	Bend	trans	-117	72.9	176.3	60.7	0	0	0	0	110.2	T421	T421-T424 CarbonylContact O-C 3.35Å; T421-T424 PolarHBondContact OG1-N 3.47Å; T421-T424 PolarHBondContact OG1-OG1 3.07Å
425	P	67.9	Low	76.8	Confident	69 Å²	69	50.5 Å²	50.5	45%	0.448	30%	0.299	S	S	.	.			trans	-61.7	139.9	-179.5	26.9	-35.1	0	0	0	111.1	E423	E423-P425 VanDerWaalsContact C-CD 3.47Å; E423-P425 VanDerWaalsContact O-CD 3.29Å; E423-P425 WeakPolarHBondContact O-CD 3.44Å
426	F	80.8	Confident	77	Confident	48 Å²	48	49.8 Å²	49.8	21%	0.211	30%	0.296	C	S	.	.			trans	-60.9	136.7	169.8	-178.6	-99.8	0	0	0	110.3	G428 R429 A463 I464 I734	F426-G428 WeakPolarHBondContact CE1-O 3.23Å; F426-R429 HydrophobicContact CE1-CB 4.21Å; F426-R429 HydrophobicContact CE1-CG 4.11Å; F426-R429 HydrophobicContact CZ-CG 4.2Å; F426-A463 HydrophobicContact CB-CB 3.98Å; F426-A463 HydrophobicContact CD1-CB 4.1Å; F426-A463 HydrophobicContact CD2-CB 3.47Å; F426-A463 VanDerWaalsContact CD2-CB 3.47Å; F426-A463 HydrophobicContact CE1-CB 4.45Å; F426-A463 HydrophobicContact CE2-CB 3.87Å; F426-A463 HydrophobicContact CG-CB 3.58Å; F426-A463 HydrophobicContact CZ-CB 4.34Å; F426-I464 HydrophobicContact CE1-CG1 4.33Å; F426-I734 HydrophobicContact CE2-CD1 4.33Å; F426-I734 HydrophobicContact CE2-CG2 3.97Å; F426-I734 HydrophobicContact CZ-CD1 3.71Å; F426-I734 HydrophobicContact CZ-CG2 4.43Å
427	V	81	Confident	77.5	Confident	62 Å²	62	50.2 Å²	50.2	38%	0.376	30%	0.298	S	S	.	.			trans	-122.6	134.3	-177.8	179.9	0	0	0	0	108.6	Y691	V427-Y691 HydrophobicContact CB-CD2 4.42Å; V427-Y691 WeakPolarHBondContact O-CD2 3.5Å
428	G	84.3	Confident	78	Confident	12 Å²	12	52.1 Å²	52.1	12%	0.124	31%	0.306	C	S	.	.	S	Bend	trans	103.2	174.5	-173.4	0	0	0	0	0	112.8	F426 D430 D687	F426-G428 WeakPolarHBondContact CE1-O 3.23Å; G428-D430 PolarHBondContact O-N 3.35Å; G428-D687 VanDerWaalsContact CA-OD1 3.25Å; G428-D687 WeakPolarHBondContact CA-OD1 3.46Å
429	R	89.7	Confident	78.9	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	30%	0.303	C	S	.	.			trans	59.7	18.1	-174.3	-53.2	-68	-172.4	147.9	0.1	115.2	F426 W431 L432 S459 I464 L675 L684 D687 G732 I734	F426-R429 HydrophobicContact CE1-CB 4.21Å; F426-R429 HydrophobicContact CE1-CG 4.11Å; F426-R429 HydrophobicContact CZ-CG 4.2Å; R429-W431 PolarHBondContact O-N 2.96Å; R429-W431 VanDerWaalsContact O-N 3.15Å; R429-L432 WeakPolarHBondContact O-CB 3.49Å; R429-L432 PolarHBondContact O-N 3.07Å; R429-S459 PolarHBondContact NE-O 3.28Å; R429-S459 PolarHBondContact NH2-O 3.39Å; R429-I464 HydrophobicContact CB-CD1 4.01Å; R429-I464 HydrophobicContact CB-CG1 4.16Å; R429-I464 HydrophobicContact CG-CD1 4.13Å; R429-L675 PolarHBondContact NH1-O 3.34Å; R429-L675 VanDerWaalsContact NH1-O 3.1Å; R429-L675 PolarHBondContact NH2-O 3.28Å; R429-L684 VanDerWaalsContact NH1-CD1 3.27Å; R429-D687 WeakPolarHBondContact CD-OD2 3.43Å; R429-D687 PolarHBondContact N-OD1 3.25Å; R429-D687 PolarHBondContact N-OD2 3.41Å; R429-D687 IonicContact NE-OD2 2.71Å; R429-G732 PolarHBondContact NH2-O 3.34Å; R429-I734 HydrophobicContact CG-CD1 3.76Å
430	D	88	Confident	80.1	Confident	65 Å²	65	49.7 Å²	49.7	35%	0.348	28%	0.279	S	S	.	.	H	α-helix	trans	-59.3	-27.9	179.5	-85.5	-36.8	0	0	0	113.4	G428 L432 F433 R519	G428-D430 PolarHBondContact O-N 3.35Å; D430-L432 PolarHBondContact O-N 3.11Å; D430-F433 PolarHBondContact O-N 3.38Å; D430-R519 HydrophobicContact CB-CB 4.42Å
431	W	89.1	Confident	81.2	Confident	29 Å²	29	57.2 Å²	57.2	11%	0.11	30%	0.304	C	S	.	.	H	α-helix	trans	-61.9	-29.6	174.2	63.5	-100.2	0	0	0	113.1	R429 F433 A434 R435 L675 D683 L684	R429-W431 PolarHBondContact O-N 2.96Å; R429-W431 VanDerWaalsContact O-N 3.15Å; W431-F433 VanDerWaalsContact C-N 3.3Å; W431-F433 PolarHBondContact O-N 3.31Å; W431-A434 PolarHBondContact O-N 2.82Å; W431-R435 HydrophobicContact CE3-CB 4.49Å; W431-R435 PolarHBondContact O-N 3.45Å; W431-L675 HydrophobicContact CH2-CD2 4.32Å; W431-D683 HydrophobicContact CB-CB 4.12Å; W431-D683 HydrophobicContact CD2-CB 3.97Å; W431-D683 HydrophobicContact CE3-CB 4.5Å; W431-D683 HydrophobicContact CG-CB 3.8Å; W431-L684 HydrophobicContact CZ2-CB 4.43Å
432	L	91.8	Very high	81.7	Confident	0 Å²	0	59.8 Å²	59.8	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-67.4	-30.4	-175.2	-176.7	63.4	0	0	0	112.2	R429 D430 R435 L436 I453 I464 I673 L675	R429-L432 WeakPolarHBondContact O-CB 3.49Å; R429-L432 PolarHBondContact O-N 3.07Å; D430-L432 PolarHBondContact O-N 3.11Å; L432-R435 PolarHBondContact O-N 3.41Å; L432-L436 WeakPolarHBondContact O-CB 3.32Å; L432-L436 PolarHBondContact O-N 3.43Å; L432-I453 HydrophobicContact CD2-CD1 4.49Å; L432-I453 HydrophobicContact CD2-CG2 4.45Å; L432-I464 HydrophobicContact CD2-CD1 3.39Å; L432-I464 HydrophobicContact CD2-CG1 4.1Å; L432-I464 HydrophobicContact CD2-CG2 3.94Å; L432-I673 HydrophobicContact CD1-CB 4.41Å; L432-I673 HydrophobicContact CD1-CD1 4.23Å; L432-I673 HydrophobicContact CD1-CG2 3.58Å; L432-L675 HydrophobicContact CD1-CD2 4.03Å; L432-L675 HydrophobicContact CD2-CD2 3.77Å
433	F	92.9	Very high	82	Confident	6 Å²	6	56.5 Å²	56.5	3%	0.026	28%	0.28	C	S	.	.	H	α-helix	trans	-66.1	-43.4	177.9	-58.7	-62.7	0	0	0	111.5	D430 W431 R435 L436 E437 I464 R467 L468 A522 V523 L526	D430-F433 PolarHBondContact O-N 3.38Å; W431-F433 VanDerWaalsContact C-N 3.3Å; W431-F433 PolarHBondContact O-N 3.31Å; F433-R435 PolarHBondContact O-N 2.9Å; F433-L436 PolarHBondContact O-N 3.39Å; F433-E437 PolarHBondContact O-N 2.99Å; F433-I464 HydrophobicContact CE1-CG2 3.8Å; F433-I464 HydrophobicContact CZ-CG2 4.2Å; F433-R467 HydrophobicContact CZ-CB 4.45Å; F433-R467 HydrophobicContact CZ-CG 4.21Å; F433-L468 HydrophobicContact CD1-CD2 4Å; F433-L468 HydrophobicContact CD1-CG 4.42Å; F433-L468 HydrophobicContact CE1-CD1 4.45Å; F433-L468 HydrophobicContact CE1-CD2 3.95Å; F433-L468 HydrophobicContact CE1-CG 3.97Å; F433-A522 HydrophobicContact CB-CB 4.34Å; F433-V523 HydrophobicContact CB-CB 4.03Å; F433-V523 HydrophobicContact CD1-CB 4.06Å; F433-V523 HydrophobicContact CD1-CG2 3.73Å; F433-V523 HydrophobicContact CD2-CB 3.68Å; F433-V523 HydrophobicContact CD2-CG2 3.8Å; F433-V523 HydrophobicContact CE1-CB 4.47Å; F433-V523 HydrophobicContact CE1-CG2 3.69Å; F433-V523 HydrophobicContact CE2-CB 4.13Å; F433-V523 HydrophobicContact CE2-CG2 3.77Å; F433-V523 HydrophobicContact CG-CB 3.64Å; F433-V523 HydrophobicContact CG-CG2 3.79Å; F433-V523 HydrophobicContact CZ-CG2 3.72Å; F433-L526 HydrophobicContact CB-CD1 4.15Å; F433-L526 HydrophobicContact CD1-CD1 4.35Å; F433-L526 VanDerWaalsContact O-CD1 3.28Å; F433-L526 WeakPolarHBondContact O-CD1 3.24Å
434	A	90.3	Very high	82.2	Confident	46 Å²	46	53.7 Å²	53.7	38%	0.38	28%	0.28	S	S	.	.	H	α-helix	trans	-63.1	-42.2	174.7	0	0	0	0	0	111.6	W431 E437 E438 A522	W431-A434 PolarHBondContact O-N 2.82Å; A434-E437 PolarHBondContact O-N 3.45Å; A434-E438 WeakPolarHBondContact O-CB 3.13Å; A434-E438 PolarHBondContact O-N 3.44Å; A434-A522 HydrophobicContact CB-CB 4.37Å
435	R	90.1	Very high	81.6	Confident	114 Å²	114	54 Å²	54	43%	0.43	28%	0.282	S	S	.	.	H	α-helix	trans	-67.9	-36.9	177.3	-175.6	54.7	172.3	-167.4	-5.9	113	W431 L432 F433 E438 V439 I673	W431-R435 HydrophobicContact CE3-CB 4.49Å; W431-R435 PolarHBondContact O-N 3.45Å; L432-R435 PolarHBondContact O-N 3.41Å; F433-R435 PolarHBondContact O-N 2.9Å; R435-E438 WeakPolarHBondContact CD-OE2 3.44Å; R435-E438 IonicContact CZ-OE2 3.16Å; R435-E438 IonicContact NE-OE2 3.63Å; R435-E438 VanDerWaalsContact NH1-CD 3.27Å; R435-E438 IonicContact NH1-OE1 2.86Å; R435-E438 PolarHBondContact NH1-OE1 2.91Å; R435-E438 VanDerWaalsContact NH1-OE1 3.16Å; R435-E438 IonicContact NH1-OE2 3.9Å; R435-E438 PolarHBondContact NH1-OE2 2.93Å; R435-E438 WeakPolarHBondContact O-CB 3.35Å; R435-E438 PolarHBondContact O-N 2.89Å; R435-V439 WeakPolarHBondContact O-CB 3.24Å; R435-V439 VanDerWaalsContact O-CG2 3.32Å; R435-V439 WeakPolarHBondContact O-CG2 3.44Å; R435-V439 PolarHBondContact O-N 2.82Å; R435-I673 HydrophobicContact CG-CD1 4.28Å
436	L	92.2	Very high	80.6	Confident	1 Å²	1	55.5 Å²	55.5	1%	0.005	29%	0.293	C	S	.	.	H	α-helix	trans	-68.3	-40.9	176.1	-179.9	59.7	0	0	0	111.4	L432 F433 V439 L440 A451 I453 L468 L526 V654 I673	L432-L436 WeakPolarHBondContact O-CB 3.32Å; L432-L436 PolarHBondContact O-N 3.43Å; F433-L436 PolarHBondContact O-N 3.39Å; L436-V439 PolarHBondContact O-N 2.8Å; L436-L440 HydrophobicContact CD1-CD1 4.07Å; L436-L440 HydrophobicContact CD1-CG 4.15Å; L436-L440 HydrophobicContact CG-CD1 4.08Å; L436-L440 WeakPolarHBondContact O-CB 3.46Å; L436-L440 VanDerWaalsContact O-CG 3.3Å; L436-L440 WeakPolarHBondContact O-CG 3.43Å; L436-L440 PolarHBondContact O-N 3.47Å; L436-A451 HydrophobicContact CD1-CB 3.77Å; L436-I453 HydrophobicContact CD2-CD1 4.43Å; L436-L468 HydrophobicContact CD2-CD1 4.37Å; L436-L526 HydrophobicContact CB-CD1 4.12Å; L436-L526 HydrophobicContact CD2-CD1 4.05Å; L436-L526 HydrophobicContact CG-CD1 4.14Å; L436-V654 HydrophobicContact CD1-CG1 4.17Å; L436-V654 HydrophobicContact CD1-CG2 4.1Å; L436-V654 HydrophobicContact CD2-CG1 4.2Å; L436-V654 HydrophobicContact CD2-CG2 4.44Å; L436-I673 HydrophobicContact CB-CD1 4.38Å; L436-I673 HydrophobicContact CD1-CD1 4.22Å
437	E	90.8	Very high	79.3	Confident	48 Å²	48	59.3 Å²	59.3	22%	0.224	31%	0.311	C	S	.	.	H	α-helix	trans	-65.1	-40.7	173	-176.7	157.2	-125.4	0	0	111.9	F433 A434 V439 L440 R441 L526 K529	F433-E437 PolarHBondContact O-N 2.99Å; A434-E437 PolarHBondContact O-N 3.45Å; E437-V439 VanDerWaalsContact C-N 3.35Å; E437-V439 PolarHBondContact O-N 3.39Å; E437-L440 PolarHBondContact O-N 2.96Å; E437-R441 WeakPolarHBondContact O-CB 3.34Å; E437-R441 PolarHBondContact O-N 3.5Å; E437-L526 HydrophobicContact CB-CD1 4.3Å; E437-L526 HydrophobicContact CB-CD2 4.02Å; E437-L526 HydrophobicContact CB-CG 4.13Å; E437-K529 IonicContact OE1-NZ 3.15Å; E437-K529 PolarHBondContact OE1-NZ 2.96Å
438	E	88.8	Confident	78.3	Confident	58 Å²	58	56.4 Å²	56.4	27%	0.271	29%	0.294	S	S	.	.	H	α-helix	trans	-57.5	-46.7	173.5	-168.6	-155.5	158.4	0	0	111.9	A434 R435 R441 K442	A434-E438 WeakPolarHBondContact O-CB 3.13Å; A434-E438 PolarHBondContact O-N 3.44Å; R435-E438 WeakPolarHBondContact CD-OE2 3.44Å; R435-E438 IonicContact CZ-OE2 3.16Å; R435-E438 IonicContact NE-OE2 3.63Å; R435-E438 VanDerWaalsContact NH1-CD 3.27Å; R435-E438 IonicContact NH1-OE1 2.86Å; R435-E438 PolarHBondContact NH1-OE1 2.91Å; R435-E438 VanDerWaalsContact NH1-OE1 3.16Å; R435-E438 IonicContact NH1-OE2 3.9Å; R435-E438 PolarHBondContact NH1-OE2 2.93Å; R435-E438 WeakPolarHBondContact O-CB 3.35Å; R435-E438 PolarHBondContact O-N 2.89Å; E438-R441 PolarHBondContact O-N 2.68Å; E438-K442 HydrophobicContact CG-CD 4.13Å; E438-K442 VanDerWaalsContact O-CB 3.3Å; E438-K442 WeakPolarHBondContact O-CB 3.37Å; E438-K442 WeakPolarHBondContact O-CG 3.26Å; E438-K442 PolarHBondContact O-N 3.21Å; E438-K442 VanDerWaalsContact OE1-CE 3.25Å; E438-K442 WeakPolarHBondContact OE1-CE 3.39Å; E438-K442 IonicContact OE1-NZ 2.77Å; E438-K442 PolarHBondContact OE1-NZ 3.05Å
439	V	89.6	Confident	78	Confident	16 Å²	16	58.5 Å²	58.5	10%	0.097	30%	0.298	C	S	.	.	H	α-helix	trans	-64	-48.1	178.3	163.7	0	0	0	0	111.8	R435 L436 E437 R441 K442 T443 A451 A671 I673	R435-V439 WeakPolarHBondContact O-CB 3.24Å; R435-V439 VanDerWaalsContact O-CG2 3.32Å; R435-V439 WeakPolarHBondContact O-CG2 3.44Å; R435-V439 PolarHBondContact O-N 2.82Å; L436-V439 PolarHBondContact O-N 2.8Å; E437-V439 VanDerWaalsContact C-N 3.35Å; E437-V439 PolarHBondContact O-N 3.39Å; V439-R441 VanDerWaalsContact C-N 3.3Å; V439-R441 PolarHBondContact O-N 3.37Å; V439-K442 PolarHBondContact O-N 3.47Å; V439-T443 WeakPolarHBondContact O-CG2 3.3Å; V439-T443 PolarHBondContact O-OG1 3.34Å; V439-A451 HydrophobicContact CG1-CB 3.96Å; V439-A671 HydrophobicContact CG1-CB 3.62Å; V439-I673 HydrophobicContact CG2-CD1 4.2Å; V439-I673 HydrophobicContact CG2-CG1 4.41Å
440	L	89.4	Confident	78	Confident	11 Å²	11	58.6 Å²	58.6	6%	0.058	30%	0.299	C	S	.	.	H	α-helix	trans	-67.5	-30.5	179.9	-68.1	175	0	0	0	112.5	L436 E437 T443 A451 L526 I616 K652 V654	L436-L440 HydrophobicContact CD1-CD1 4.07Å; L436-L440 HydrophobicContact CD1-CG 4.15Å; L436-L440 HydrophobicContact CG-CD1 4.08Å; L436-L440 WeakPolarHBondContact O-CB 3.46Å; L436-L440 VanDerWaalsContact O-CG 3.3Å; L436-L440 WeakPolarHBondContact O-CG 3.43Å; L436-L440 PolarHBondContact O-N 3.47Å; E437-L440 PolarHBondContact O-N 2.96Å; L440-T443 PolarHBondContact O-OG1 3.36Å; L440-A451 HydrophobicContact CD2-CB 4.34Å; L440-L526 HydrophobicContact CD1-CD2 3.97Å; L440-I616 HydrophobicContact CD1-CD1 3.86Å; L440-I616 HydrophobicContact CD1-CG1 4.48Å; L440-K652 HydrophobicContact CD2-CB 4.06Å; L440-K652 HydrophobicContact CD2-CG 4.28Å; L440-V654 HydrophobicContact CD1-CG2 3.99Å; L440-V654 HydrophobicContact CD2-CG2 4.35Å
441	R	84.3	Confident	78.4	Confident	185 Å²	185	55.5 Å²	55.5	70%	0.698	28%	0.282	S	S	*	.	H	α-helix	trans	-79.6	-33	177.2	-169	-168.7	67.6	76.1	-3.9	113.5	E437 E438 V439 T443	E437-R441 WeakPolarHBondContact O-CB 3.34Å; E437-R441 PolarHBondContact O-N 3.5Å; E438-R441 PolarHBondContact O-N 2.68Å; V439-R441 VanDerWaalsContact C-N 3.3Å; V439-R441 PolarHBondContact O-N 3.37Å; R441-T443 PolarHBondContact O-N 2.86Å
442	K	70.4	Confident	78.7	Confident	125 Å²	125	54.4 Å²	54.4	54%	0.543	28%	0.279	S	S	.	.	S	Bend	trans	-68.7	-12.6	-175.6	-91.1	-179.6	167	178.6	0	114.5	E438 V439	E438-K442 HydrophobicContact CG-CD 4.13Å; E438-K442 VanDerWaalsContact O-CB 3.3Å; E438-K442 WeakPolarHBondContact O-CB 3.37Å; E438-K442 WeakPolarHBondContact O-CG 3.26Å; E438-K442 PolarHBondContact O-N 3.21Å; E438-K442 VanDerWaalsContact OE1-CE 3.25Å; E438-K442 WeakPolarHBondContact OE1-CE 3.39Å; E438-K442 IonicContact OE1-NZ 2.77Å; E438-K442 PolarHBondContact OE1-NZ 3.05Å; V439-K442 PolarHBondContact O-N 3.47Å
443	T	60.3	Low	78.9	Confident	27 Å²	27	54.4 Å²	54.4	17%	0.166	28%	0.279	C	S	.	.			trans	-110.5	78.8	-161.1	54.4	0	0	0	0	112.4	V439 L440 R441 G448	V439-T443 WeakPolarHBondContact O-CG2 3.3Å; V439-T443 PolarHBondContact O-OG1 3.34Å; L440-T443 PolarHBondContact O-OG1 3.36Å; R441-T443 PolarHBondContact O-N 2.86Å; T443-G448 WeakPolarHBondContact O-CA 3.47Å; T443-G448 VanDerWaalsContact OG1-CA 3.25Å; T443-G448 WeakPolarHBondContact OG1-CA 3.43Å
444	S	51	Low	79	Confident	123 Å²	123	54.9 Å²	54.9	86%	0.86	28%	0.283	S	S	*	.			trans	-88.1	-9.7	172	51.6	0	0	0	0	113.8
445	T	51.5	Low	79.2	Confident	89 Å²	89	52.7 Å²	52.7	55%	0.546	26%	0.264	S	S	.	.	S	Bend	trans	-86.4	176.4	173.1	53.3	0	0	0	0	111.6	E447 G448	T445-E447 PolarHBondContact O-N 3.49Å; T445-E447 VanDerWaalsContact O-N 3.07Å; T445-G448 PolarHBondContact O-N 3.34Å
446	C	46.1	Very low	79.3	Confident	100 Å²	100	50.5 Å²	50.5	68%	0.676	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-20.2	-173	-62.4	0	0	0	0	115.3	G448 R449	C446-G448 PolarHBondContact O-N 2.96Å; C446-R449 PolarHBondContact O-NE 3.34Å
447	E	53.3	Low	79.2	Confident	128 Å²	128	51.8 Å²	51.8	60%	0.598	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.5	-5.4	174.1	-60.1	162.5	148.8	0	0	112.8	T445 R449 P669	T445-E447 PolarHBondContact O-N 3.49Å; T445-E447 VanDerWaalsContact O-N 3.07Å; E447-R449 VanDerWaalsContact C-N 3.27Å; E447-R449 PolarHBondContact O-N 3.47Å; E447-R449 VanDerWaalsContact O-N 3.11Å; E447-P669 CarbonylContact C-O 3.49Å
448	G	60.4	Low	79.2	Confident	2 Å²	2	50 Å²	50	2%	0.021	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.6	31.5	-173.3	0	0	0	0	0	117.6	T443 T445 C446 K652	T443-G448 WeakPolarHBondContact O-CA 3.47Å; T443-G448 VanDerWaalsContact OG1-CA 3.25Å; T443-G448 WeakPolarHBondContact OG1-CA 3.43Å; T445-G448 PolarHBondContact O-N 3.34Å; C446-G448 PolarHBondContact O-N 2.96Å; G448-K652 VanDerWaalsContact O-CD 3.28Å; G448-K652 WeakPolarHBondContact O-CD 3.25Å; G448-K652 PolarHBondContact O-NZ 3.18Å
449	R	77.5	Confident	79.4	Confident	56 Å²	56	47.2 Å²	47.2	21%	0.211	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.3	-7.1	-177	-57.4	-177.4	-160.5	-160.8	-2.9	113.3	C446 E447 I644 S645 K652 L653 F670	C446-R449 PolarHBondContact O-NE 3.34Å; E447-R449 VanDerWaalsContact C-N 3.27Å; E447-R449 PolarHBondContact O-N 3.47Å; E447-R449 VanDerWaalsContact O-N 3.11Å; R449-I644 HydrophobicContact CB-CD1 3.94Å; R449-I644 HydrophobicContact CB-CG1 4.09Å; R449-I644 WeakPolarHBondContact CD-O 3.45Å; R449-I644 PolarHBondContact NH1-O 3.45Å; R449-S645 PolarHBondContact NH1-O 3.01Å; R449-K652 WeakPolarHBondContact O-CA 3.44Å; R449-L653 PolarHBondContact O-N 3.45Å; R449-F670 VanDerWaalsContact C-CE1 3.46Å; R449-F670 HydrophobicContact CB-CE1 3.94Å
450	G	91.3	Very high	79.5	Confident	1 Å²	1	47 Å²	47	1%	0.01	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	174.1	-174.6	178.7	0	0	0	0	0	116.8	L653 F670 A671	G450-L653 CarbonylContact C-O 3.58Å; G450-L653 WeakPolarHBondContact CA-O 3.4Å; G450-F670 VanDerWaalsContact N-CD1 3.32Å; G450-A671 PolarHBondContact O-N 3.32Å
451	A	94.8	Very high	79.8	Confident	0 Å²	0	47 Å²	47	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	146.8	177.5	0	0	0	0	0	111.1	L436 V439 L440 L653 V655 A671	L436-A451 HydrophobicContact CD1-CB 3.77Å; V439-A451 HydrophobicContact CG1-CB 3.96Å; L440-A451 HydrophobicContact CD2-CB 4.34Å; A451-L653 PolarHBondContact N-O 3.3Å; A451-V655 PolarHBondContact O-N 3.15Å; A451-A671 CarbonylContact C-O 3.56Å; A451-A671 VanDerWaalsContact CA-O 3.29Å; A451-A671 WeakPolarHBondContact CA-O 3.19Å
452	V	95.6	Very high	80.2	Confident	7 Å²	7	40 Å²	40	4%	0.042	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	123.1	174.6	-174	0	0	0	0	109.5	V454 V655 V657 T665 F670 A671 G672 I673	V452-V454 HydrophobicContact CB-CG2 4.5Å; V452-V454 HydrophobicContact CG1-CG2 3.7Å; V452-V655 WeakPolarHBondContact CA-O 3.3Å; V452-V655 HydrophobicContact CB-CG2 4.18Å; V452-V655 HydrophobicContact CG1-CG2 4.16Å; V452-V655 HydrophobicContact CG2-CG2 3.79Å; V452-V657 HydrophobicContact CG1-CG1 3.72Å; V452-T665 HydrophobicContact CG1-CG2 4.09Å; V452-F670 HydrophobicContact CG2-CB 3.78Å; V452-F670 HydrophobicContact CG2-CD2 3.95Å; V452-F670 HydrophobicContact CG2-CG 4.41Å; V452-A671 PolarHBondContact N-O 3.05Å; V452-G672 CarbonylContact O-C 3.49Å; V452-G672 WeakPolarHBondContact O-CA 3.3Å; V452-I673 PolarHBondContact O-N 3.08Å
453	I	96.2	Very high	81.3	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	107.3	170.8	-52.7	177.6	0	0	0	108.6	L432 L436 K461 I465 V654 V655 T656 V657 I673 L675	L432-I453 HydrophobicContact CD2-CD1 4.49Å; L432-I453 HydrophobicContact CD2-CG2 4.45Å; L436-I453 HydrophobicContact CD2-CD1 4.43Å; I453-K461 HydrophobicContact CG2-CG 4.27Å; I453-I465 HydrophobicContact CD1-CD1 4.46Å; I453-V654 HydrophobicContact CD1-CG1 3.89Å; I453-V654 HydrophobicContact CG1-CG1 4.22Å; I453-V655 PolarHBondContact N-O 3.24Å; I453-T656 HydrophobicContact CB-CG2 4.12Å; I453-T656 HydrophobicContact CD1-CG2 4.44Å; I453-T656 WeakPolarHBondContact O-CA 3.17Å; I453-V657 PolarHBondContact O-N 3.32Å; I453-I673 WeakPolarHBondContact CA-O 3.12Å; I453-L675 HydrophobicContact CG2-CD1 3.74Å; I453-L675 HydrophobicContact CG2-CD2 4.16Å; I453-L675 HydrophobicContact CG2-CG 3.89Å
454	V	95.1	Very high	82.8	Confident	16 Å²	16	33.2 Å²	33.2	10%	0.097	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	138.4	-177.4	-172.4	0	0	0	0	109.6	V452 V657 T659 V662 I673 S674 L675	V452-V454 HydrophobicContact CB-CG2 4.5Å; V452-V454 HydrophobicContact CG1-CG2 3.7Å; V454-V657 HydrophobicContact CB-CG1 4.44Å; V454-V657 HydrophobicContact CG1-CG1 4.4Å; V454-V657 HydrophobicContact CG2-CG1 3.98Å; V454-T659 HydrophobicContact CG1-CG2 4.17Å; V454-V662 HydrophobicContact CG1-CB 4.25Å; V454-V662 HydrophobicContact CG1-CG2 3.99Å; V454-V662 HydrophobicContact CG2-CG2 3.82Å; V454-I673 PolarHBondContact N-O 3.3Å; V454-S674 CarbonylContact O-C 3.52Å; V454-S674 WeakPolarHBondContact O-CA 3.25Å; V454-L675 WeakPolarHBondContact O-CG 3.38Å; V454-L675 PolarHBondContact O-N 2.78Å
455	G	94.1	Very high	84.9	Confident	0 Å²	0	27.4 Å²	27.4	0%	0	16%	0.16	C	C	.	.			trans	177.5	163.3	169.3	0	0	0	0	0	115.1	K461 V657 R658 T659 D676	G455-K461 WeakPolarHBondContact O-CE 3.39Å; G455-K461 PolarHBondContact O-NZ 3.1Å; G455-V657 PolarHBondContact N-O 3.12Å; G455-V657 VanDerWaalsContact N-O 3.17Å; G455-R658 WeakPolarHBondContact O-CA 3.47Å; G455-T659 WeakPolarHBondContact CA-OG1 3.4Å; G455-T659 PolarHBondContact N-OG1 3.09Å; G455-T659 PolarHBondContact O-N 3.06Å; G455-D676 VanDerWaalsContact CA-OD1 3.24Å; G455-D676 WeakPolarHBondContact CA-OD1 3.34Å; G455-D676 WeakPolarHBondContact CA-OD2 3.39Å
456	N	92.4	Very high	86.9	Confident	68 Å²	68	25.1 Å²	25.1	36%	0.364	14%	0.142	S	C	.	.			trans	-70.4	179.7	-176.5	-81.9	-36.2	0	0	0	114.2	G458 S459 K461 T659 D676	N456-G458 PolarHBondContact O-N 3.17Å; N456-S459 PolarHBondContact O-N 2.58Å; N456-S459 PolarHBondContact O-OG 3.34Å; N456-K461 PolarHBondContact O-NZ 3.15Å; N456-T659 PolarHBondContact N-OG1 3.36Å; N456-D676 VanDerWaalsContact N-CG 3.27Å; N456-D676 PolarHBondContact N-OD1 3.44Å; N456-D676 PolarHBondContact N-OD2 2.83Å; N456-D676 PolarHBondContact ND2-OD2 3Å; N456-D676 VanDerWaalsContact ND2-OD2 3.08Å
457	A	91	Very high	89.1	Confident	28 Å²	28	24.9 Å²	24.9	23%	0.231	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58	125.5	175	0	0	0	0	0	111.1	S459 S733 L763	A457-S459 VanDerWaalsContact C-N 3.33Å; A457-S459 PolarHBondContact O-N 3.38Å; A457-S733 WeakPolarHBondContact O-CB 3.45Å; A457-S733 PolarHBondContact O-OG 2.93Å; A457-L763 HydrophobicContact CB-CD2 4.25Å
458	G	90.9	Very high	91	Very high	10 Å²	10	18.9 Å²	18.9	10%	0.103	10%	0.099	C	C	.	.	T	Hydrogen-bonded Turn	trans	75.8	10.2	178.1	0	0	0	0	0	116.3	N456 G460 I734 L735	N456-G458 PolarHBondContact O-N 3.17Å; G458-G460 PolarHBondContact O-N 2.86Å; G458-I734 PolarHBondContact O-N 3.08Å; G458-L735 PolarHBondContact O-N 3.39Å; G458-L735 VanDerWaalsContact O-N 3.11Å
459	S	92.8	Very high	92.6	Very high	0 Å²	0	19 Å²	19	0%	0	10%	0.099	C	C	.	.	S	Bend	trans	-69.3	-5.7	177.9	65.1	0	0	0	0	115.3	R429 N456 A457 K461	R429-S459 PolarHBondContact NE-O 3.28Å; R429-S459 PolarHBondContact NH2-O 3.39Å; N456-S459 PolarHBondContact O-N 2.58Å; N456-S459 PolarHBondContact O-OG 3.34Å; A457-S459 VanDerWaalsContact C-N 3.33Å; A457-S459 PolarHBondContact O-N 3.38Å; S459-K461 PolarHBondContact OG-NZ 3.28Å
460	G	92	Very high	93.2	Very high	10 Å²	10	18.9 Å²	18.9	10%	0.103	11%	0.105	C	C	.	.	S	Bend	trans	105.9	-8.5	174.1	0	0	0	0	0	116.1	G458 T462 A463 I464	G458-G460 PolarHBondContact O-N 2.86Å; G460-T462 PolarHBondContact O-N 2.82Å; G460-A463 WeakPolarHBondContact O-CA 3.29Å; G460-A463 WeakPolarHBondContact O-CB 3.48Å; G460-A463 PolarHBondContact O-N 3.21Å; G460-I464 PolarHBondContact O-N 2.91Å
461	K	94.1	Very high	93.3	Very high	13 Å²	13	22.3 Å²	22.3	6%	0.057	12%	0.122	C	C	.	.	H	α-helix	trans	-39	-61.6	-175.1	-63.2	-176.8	-56.8	-67.3	0	114.3	I453 G455 N456 S459 A463 I464 I465 T656 V657 L675	I453-K461 HydrophobicContact CG2-CG 4.27Å; G455-K461 WeakPolarHBondContact O-CE 3.39Å; G455-K461 PolarHBondContact O-NZ 3.1Å; N456-K461 PolarHBondContact O-NZ 3.15Å; S459-K461 PolarHBondContact OG-NZ 3.28Å; K461-A463 VanDerWaalsContact C-N 3.28Å; K461-A463 PolarHBondContact O-N 2.8Å; K461-I464 WeakPolarHBondContact O-CB 3.2Å; K461-I464 PolarHBondContact O-N 3.38Å; K461-I464 VanDerWaalsContact O-N 3.15Å; K461-I465 PolarHBondContact O-N 3.28Å; K461-T656 HydrophobicContact CB-CG2 4.43Å; K461-V657 VanDerWaalsContact CD-O 3.26Å; K461-V657 WeakPolarHBondContact CD-O 3.2Å; K461-V657 WeakPolarHBondContact CE-O 3.24Å; K461-L675 HydrophobicContact CG-CD1 3.74Å
462	T	94	Very high	93.2	Very high	37 Å²	37	23 Å²	23	23%	0.227	13%	0.127	C	C	.	.	H	α-helix	trans	-61.3	-34.1	-178.7	-48.1	0	0	0	0	112.9	V417 G460 W466 F535 D620	V417-T462 HydrophobicContact CG1-CG2 3.75Å; V417-T462 HydrophobicContact CG2-CG2 3.98Å; G460-T462 PolarHBondContact O-N 2.82Å; T462-W466 WeakPolarHBondContact O-CB 3.28Å; T462-W466 PolarHBondContact O-N 3.17Å; T462-F535 HydrophobicContact CG2-CD1 3.9Å; T462-F535 HydrophobicContact CG2-CE1 3.85Å; T462-D620 WeakPolarHBondContact CA-OD1 3.38Å; T462-D620 VanDerWaalsContact CB-OD2 3.3Å; T462-D620 WeakPolarHBondContact CB-OD2 3.34Å; T462-D620 VanDerWaalsContact CG2-OD2 3.31Å; T462-D620 WeakPolarHBondContact CG2-OD2 3.4Å; T462-D620 PolarHBondContact OG1-OD2 2.87Å
463	A	92.1	Very high	93.1	Very high	9 Å²	9	24.6 Å²	24.6	7%	0.074	14%	0.138	C	C	.	.	H	α-helix	trans	-72.9	-35.1	177.5	0	0	0	0	0	112.3	V420 F426 G460 K461 R467	V420-A463 HydrophobicContact CG2-CB 4.12Å; F426-A463 HydrophobicContact CB-CB 3.98Å; F426-A463 HydrophobicContact CD1-CB 4.1Å; F426-A463 HydrophobicContact CD2-CB 3.47Å; F426-A463 VanDerWaalsContact CD2-CB 3.47Å; F426-A463 HydrophobicContact CE1-CB 4.45Å; F426-A463 HydrophobicContact CE2-CB 3.87Å; F426-A463 HydrophobicContact CG-CB 3.58Å; F426-A463 HydrophobicContact CZ-CB 4.34Å; G460-A463 WeakPolarHBondContact O-CA 3.29Å; G460-A463 WeakPolarHBondContact O-CB 3.48Å; G460-A463 PolarHBondContact O-N 3.21Å; K461-A463 VanDerWaalsContact C-N 3.28Å; K461-A463 PolarHBondContact O-N 2.8Å; A463-R467 VanDerWaalsContact O-CB 3.27Å; A463-R467 WeakPolarHBondContact O-CB 3.46Å; A463-R467 PolarHBondContact O-N 3.36Å
464	I	92.7	Very high	92.9	Very high	1 Å²	1	26.3 Å²	26.3	1%	0.005	15%	0.146	C	C	.	.	H	α-helix	trans	-63.4	-48.3	171.6	-67.9	148.9	0	0	0	110.3	F426 R429 L432 F433 G460 K461 R467 L468 L675	F426-I464 HydrophobicContact CE1-CG1 4.33Å; R429-I464 HydrophobicContact CB-CD1 4.01Å; R429-I464 HydrophobicContact CB-CG1 4.16Å; R429-I464 HydrophobicContact CG-CD1 4.13Å; L432-I464 HydrophobicContact CD2-CD1 3.39Å; L432-I464 HydrophobicContact CD2-CG1 4.1Å; L432-I464 HydrophobicContact CD2-CG2 3.94Å; F433-I464 HydrophobicContact CE1-CG2 3.8Å; F433-I464 HydrophobicContact CZ-CG2 4.2Å; G460-I464 PolarHBondContact O-N 2.91Å; K461-I464 WeakPolarHBondContact O-CB 3.2Å; K461-I464 PolarHBondContact O-N 3.38Å; K461-I464 VanDerWaalsContact O-N 3.15Å; I464-R467 WeakPolarHBondContact O-CB 3.47Å; I464-R467 PolarHBondContact O-N 3.46Å; I464-L468 PolarHBondContact O-N 2.99Å; I464-L468 VanDerWaalsContact O-N 3.13Å; I464-L675 HydrophobicContact CD1-CD1 4.03Å
465	I	95.3	Very high	92.3	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-62.9	-46.5	176.8	-62.1	-60	0	0	0	110.8	I453 K461 R467 L468 V469 F535 L618 D620 V654 T656	I453-I465 HydrophobicContact CD1-CD1 4.46Å; K461-I465 PolarHBondContact O-N 3.28Å; I465-R467 VanDerWaalsContact C-N 3.26Å; I465-R467 PolarHBondContact O-N 3.01Å; I465-L468 PolarHBondContact O-N 3.44Å; I465-L468 VanDerWaalsContact O-N 3.16Å; I465-V469 HydrophobicContact CG2-CG2 4.47Å; I465-V469 WeakPolarHBondContact O-CG2 3.18Å; I465-V469 PolarHBondContact O-N 3.2Å; I465-F535 HydrophobicContact CB-CE1 4.18Å; I465-F535 HydrophobicContact CB-CZ 4.44Å; I465-F535 HydrophobicContact CG2-CE1 3.78Å; I465-F535 HydrophobicContact CG2-CZ 3.74Å; I465-L618 HydrophobicContact CD1-CD2 4.33Å; I465-L618 HydrophobicContact CG2-CB 3.96Å; I465-L618 HydrophobicContact CG2-CD1 4.08Å; I465-D620 HydrophobicContact CB-CB 4.39Å; I465-D620 HydrophobicContact CG1-CB 4.32Å; I465-D620 WeakPolarHBondContact CG1-OD1 3.32Å; I465-D620 HydrophobicContact CG2-CB 4.18Å; I465-V654 HydrophobicContact CD1-CG1 4.28Å; I465-T656 HydrophobicContact CD1-CG2 3.7Å; I465-T656 HydrophobicContact CG1-CG2 3.46Å; I465-T656 VanDerWaalsContact CG1-CG2 3.46Å
466	W	93.1	Very high	90.8	Very high	41 Å²	41	33.3 Å²	33.3	16%	0.155	18%	0.184	C	C	.	.	H	α-helix	trans	-61.4	-33.1	176.1	-174.4	-97.8	0	0	0	112.8	V417 V420 T462 V469 T470 F535	V417-W466 HydrophobicContact CB-CD2 4.24Å; V417-W466 HydrophobicContact CB-CE3 4.14Å; V417-W466 HydrophobicContact CG2-CD2 3.99Å; V417-W466 HydrophobicContact CG2-CE3 3.46Å; V417-W466 VanDerWaalsContact CG2-CE3 3.46Å; V417-W466 HydrophobicContact CG2-CG 4.49Å; V417-W466 HydrophobicContact CG2-CZ3 3.94Å; V420-W466 VanDerWaalsContact CG1-CD1 3.4Å; V420-W466 HydrophobicContact CG1-CG 4.22Å; V420-W466 PolarHBondContact O-NE1 3.13Å; T462-W466 WeakPolarHBondContact O-CB 3.28Å; T462-W466 PolarHBondContact O-N 3.17Å; W466-V469 PolarHBondContact O-N 2.73Å; W466-T470 PolarHBondContact NE1-OG1 3.15Å; W466-T470 VanDerWaalsContact O-CB 3.27Å; W466-T470 WeakPolarHBondContact O-CB 3.37Å; W466-T470 PolarHBondContact O-N 3.22Å; W466-T470 PolarHBondContact O-OG1 3.4Å; W466-F535 HydrophobicContact CB-CE1 4.48Å; W466-F535 HydrophobicContact CB-CZ 4.17Å; W466-F535 HydrophobicContact CE3-CE1 4.45Å; W466-F535 AromaticContact CE3-CE2 3.78Å; W466-F535 HydrophobicContact CE3-CE2 3.78Å; W466-F535 AromaticContact CE3-CZ 3.65Å; W466-F535 HydrophobicContact CE3-CZ 3.65Å; W466-F535 HydrophobicContact CZ3-CE2 4.18Å; W466-F535 HydrophobicContact CZ3-CZ 4.49Å
467	R	91.5	Very high	88.6	Confident	95 Å²	95	41.2 Å²	41.2	36%	0.358	21%	0.208	S	C	.	.	H	α-helix	trans	-65.3	-42.6	174.3	-173.9	56	165.5	178.3	-3.2	111.9	F433 A463 I464 I465 T470 L471 V523	F433-R467 HydrophobicContact CZ-CB 4.45Å; F433-R467 HydrophobicContact CZ-CG 4.21Å; A463-R467 VanDerWaalsContact O-CB 3.27Å; A463-R467 WeakPolarHBondContact O-CB 3.46Å; A463-R467 PolarHBondContact O-N 3.36Å; I464-R467 WeakPolarHBondContact O-CB 3.47Å; I464-R467 PolarHBondContact O-N 3.46Å; I465-R467 VanDerWaalsContact C-N 3.26Å; I465-R467 PolarHBondContact O-N 3.01Å; R467-T470 PolarHBondContact O-N 2.83Å; R467-L471 HydrophobicContact CG-CD1 4.22Å; R467-L471 WeakPolarHBondContact O-CG 3.5Å; R467-L471 PolarHBondContact O-N 3.37Å; R467-V523 HydrophobicContact CG-CG2 4.48Å
468	L	93.9	Very high	85.7	Confident	3 Å²	3	45.6 Å²	45.6	2%	0.016	23%	0.232	C	C	.	.	H	α-helix	trans	-63.6	-46.6	172.9	-68.8	172.4	0	0	0	111.4	F433 L436 I464 I465 T470 L471 S472 V523 L526 A527 V530 L618	F433-L468 HydrophobicContact CD1-CD2 4Å; F433-L468 HydrophobicContact CD1-CG 4.42Å; F433-L468 HydrophobicContact CE1-CD1 4.45Å; F433-L468 HydrophobicContact CE1-CD2 3.95Å; F433-L468 HydrophobicContact CE1-CG 3.97Å; L436-L468 HydrophobicContact CD2-CD1 4.37Å; I464-L468 PolarHBondContact O-N 2.99Å; I464-L468 VanDerWaalsContact O-N 3.13Å; I465-L468 PolarHBondContact O-N 3.44Å; I465-L468 VanDerWaalsContact O-N 3.16Å; L468-T470 VanDerWaalsContact C-N 3.35Å; L468-T470 PolarHBondContact O-N 2.85Å; L468-L471 PolarHBondContact O-N 2.87Å; L468-S472 WeakPolarHBondContact O-CB 3.36Å; L468-S472 PolarHBondContact O-N 3.45Å; L468-V523 HydrophobicContact CD2-CG2 4.1Å; L468-L526 HydrophobicContact CD2-CB 3.78Å; L468-A527 HydrophobicContact CD2-CB 4.24Å; L468-V530 HydrophobicContact CB-CG2 4.48Å; L468-L618 HydrophobicContact CB-CD1 3.78Å; L468-L618 HydrophobicContact CD1-CD1 4.37Å; L468-L618 HydrophobicContact CD1-CD2 4.22Å
469	V	93.9	Very high	83	Confident	5 Å²	5	51.5 Å²	51.5	3%	0.03	27%	0.269	C	S	.	.	H	α-helix	trans	-58.1	-46.2	176.2	174.7	0	0	0	0	111.4	I465 W466 L471 S472 G475 Y533 F535 L618	I465-V469 HydrophobicContact CG2-CG2 4.47Å; I465-V469 WeakPolarHBondContact O-CG2 3.18Å; I465-V469 PolarHBondContact O-N 3.2Å; W466-V469 PolarHBondContact O-N 2.73Å; V469-L471 VanDerWaalsContact C-N 3.26Å; V469-L471 PolarHBondContact O-N 2.87Å; V469-S472 WeakPolarHBondContact O-CB 3.11Å; V469-S472 PolarHBondContact O-N 3.49Å; V469-S472 VanDerWaalsContact O-N 3.13Å; V469-S472 PolarHBondContact O-OG 3.27Å; V469-G475 PolarHBondContact O-N 2.86Å; V469-Y533 HydrophobicContact CB-CG 4.46Å; V469-Y533 HydrophobicContact CG1-CD1 3.93Å; V469-Y533 HydrophobicContact CG1-CD2 3.93Å; V469-Y533 HydrophobicContact CG1-CE1 3.9Å; V469-Y533 HydrophobicContact CG1-CE2 3.84Å; V469-Y533 HydrophobicContact CG1-CG 3.96Å; V469-Y533 HydrophobicContact CG2-CD1 4.16Å; V469-Y533 HydrophobicContact CG2-CD2 3.78Å; V469-Y533 HydrophobicContact CG2-CE2 4.49Å; V469-Y533 HydrophobicContact CG2-CG 3.56Å; V469-F535 HydrophobicContact CG2-CE2 4.25Å; V469-F535 HydrophobicContact CG2-CZ 4.26Å; V469-L618 HydrophobicContact CG2-CD1 3.82Å
470	T	91.3	Very high	80	Confident	53 Å²	53	60.2 Å²	60.2	33%	0.325	31%	0.31	S	S	.	.	H	α-helix	trans	-63.3	-29.9	-179.2	-59.7	0	0	0	0	113	W466 R467 L468 G475	W466-T470 PolarHBondContact NE1-OG1 3.15Å; W466-T470 VanDerWaalsContact O-CB 3.27Å; W466-T470 WeakPolarHBondContact O-CB 3.37Å; W466-T470 PolarHBondContact O-N 3.22Å; W466-T470 PolarHBondContact O-OG1 3.4Å; R467-T470 PolarHBondContact O-N 2.83Å; L468-T470 VanDerWaalsContact C-N 3.35Å; L468-T470 PolarHBondContact O-N 2.85Å; T470-G475 WeakPolarHBondContact O-CA 3.49Å
471	L	91.7	Very high	76.9	Confident	73 Å²	73	63.4 Å²	63.4	38%	0.382	34%	0.343	S	S	.	.	H	α-helix	trans	-93.7	-7.6	177.9	-66.8	171.5	0	0	0	113.4	R467 L468 V469 V523 A527	R467-L471 HydrophobicContact CG-CD1 4.22Å; R467-L471 WeakPolarHBondContact O-CG 3.5Å; R467-L471 PolarHBondContact O-N 3.37Å; L468-L471 PolarHBondContact O-N 2.87Å; V469-L471 VanDerWaalsContact C-N 3.26Å; V469-L471 PolarHBondContact O-N 2.87Å; L471-V523 HydrophobicContact CD1-CG1 4.44Å; L471-V523 HydrophobicContact CD1-CG2 3.83Å; L471-A527 HydrophobicContact CB-CB 3.55Å
472	S	94.3	Very high	73.6	Confident	14 Å²	14	67.4 Å²	67.4	10%	0.098	38%	0.378	C	S	.	.	S	Bend	trans	-80.8	-178.8	179.6	77.3	0	0	0	0	113.1	L468 V469 H474 G475 A527	L468-S472 WeakPolarHBondContact O-CB 3.36Å; L468-S472 PolarHBondContact O-N 3.45Å; V469-S472 WeakPolarHBondContact O-CB 3.11Å; V469-S472 PolarHBondContact O-N 3.49Å; V469-S472 VanDerWaalsContact O-N 3.13Å; V469-S472 PolarHBondContact O-OG 3.27Å; S472-H474 PolarHBondContact O-N 2.92Å; S472-H474 VanDerWaalsContact O-N 3.11Å; S472-H474 PolarHBondContact OG-N 2.94Å; S472-H474 VanDerWaalsContact OG-N 3.08Å; S472-G475 PolarHBondContact O-N 3.27Å; S472-G475 VanDerWaalsContact O-N 3.1Å; S472-A527 WeakPolarHBondContact CA-O 3.46Å; S472-A527 VanDerWaalsContact CB-O 3.29Å; S472-A527 WeakPolarHBondContact CB-O 3.29Å
473	C	92	Very high	70.6	Confident	40 Å²	40	69.8 Å²	69.8	27%	0.27	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-17.5	169.9	62	0	0	0	0	114.6	V530 P561	C473-V530 PolarHBondContact SG-O 3.18Å; C473-V530 VanDerWaalsContact SG-O 3.37Å; C473-P561 HydrophobicContact CB-CG 3.86Å
474	H	91.8	Very high	67.4	Low	36 Å²	36	74.7 Å²	74.7	17%	0.167	44%	0.436	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.1	-4	177.9	-62.4	-69.2	0	0	0	114	S472 V531 Y533 L556	S472-H474 PolarHBondContact O-N 2.92Å; S472-H474 VanDerWaalsContact O-N 3.11Å; S472-H474 PolarHBondContact OG-N 2.94Å; S472-H474 VanDerWaalsContact OG-N 3.08Å; H474-V531 PolarHBondContact NE2-O 3.18Å; H474-Y533 HydrophobicContact CB-CD1 4.13Å; H474-Y533 HydrophobicContact CB-CE1 3.57Å; H474-Y533 AromaticContact CD2-CD1 3.96Å; H474-Y533 AromaticContact CG-CE1 3.69Å; H474-L556 PolarHBondContact CE1-O 3.09Å
475	G	83.9	Confident	64.2	Low	16 Å²	16	81.8 Å²	81.8	17%	0.165	47%	0.473	C	S	.	.	S	Bend	trans	-63.5	144.2	173.3	0	0	0	0	0	112	V469 T470 S472 R477	V469-G475 PolarHBondContact O-N 2.86Å; T470-G475 WeakPolarHBondContact O-CA 3.49Å; S472-G475 PolarHBondContact O-N 3.27Å; S472-G475 VanDerWaalsContact O-N 3.1Å; G475-R477 PolarHBondContact O-N 2.69Å
476	M	61.7	Low	61.2	Low	148 Å²	148	86.5 Å²	86.5	73%	0.729	50%	0.504	S	S	*	.			trans	-68.9	94.9	176.9	-63.7	-155.9	-42	0	0	110.8	T478 R836	M476-T478 PolarHBondContact O-N 3.13Å; M476-R836 PolarHBondContact SD-NH1 3.31Å
477	R	47	Very low	58.1	Low	233 Å²	233	93.3 Å²	93.3	88%	0.879	54%	0.537	S	S	*	.			trans	-61.6	123.7	165.1	-71	-173.9	175.5	-167.7	-2.3	109.4	G475	G475-R477 PolarHBondContact O-N 2.69Å
478	T	30.5	Very low	55	Low	120 Å²	120	94.4 Å²	94.4	74%	0.736	56%	0.56	S	S	*	*			trans	-61.9	131.3	161.3	36.9	0	0	0	0	108.9	M476 Q480	M476-T478 PolarHBondContact O-N 3.13Å; T478-Q480 VanDerWaalsContact C-N 3.3Å; T478-Q480 PolarHBondContact O-N 3.37Å
479	P	33.2	Very low	52.3	Low	134 Å²	134	99.8 Å²	99.8	87%	0.87	60%	0.595	S	S	*	*	S	Bend	trans	-80.8	73.3	-176.3	32.2	-35.6	0	0	0	111.5
480	Q	29.7	Very low	49.2	Very low	183 Å²	183	109.7 Å²	109.7	86%	0.855	64%	0.637	S	S	*	*			trans	-153.9	142.8	174.3	-107.1	177.5	6.6	0	0	112.1	T478	T478-Q480 VanDerWaalsContact C-N 3.3Å; T478-Q480 PolarHBondContact O-N 3.37Å
481	G	26.6	Very low	46.2	Very low	77 Å²	77	112 Å²	112	79%	0.794	66%	0.662	S	S	*	*			trans	98.3	124.7	166.7	0	0	0	0	0	114.9
482	A	25.2	Very low	43.2	Very low	97 Å²	97	114.2 Å²	114.2	80%	0.802	68%	0.683	S	S	*	*			trans	-51.2	154.6	-178	0	0	0	0	0	115.6
483	A	30.8	Very low	40.6	Very low	88 Å²	88	119.4 Å²	119.4	73%	0.727	72%	0.717	S	S	*	*			trans	-61.3	140.4	161.1	0	0	0	0	0	110.5
484	S	25.5	Very low	37.5	Very low	112 Å²	112	127.5 Å²	127.5	78%	0.783	75%	0.748	S	S	*	*			trans	-129.4	90.1	168.8	58	0	0	0	0	107.6
485	D	26	Very low	34.4	Very low	149 Å²	149	131.6 Å²	131.6	80%	0.797	78%	0.78	S	S	*	*			trans	-70.3	129	179.2	-60.4	-57	0	0	0	110.3
486	P	32.4	Very low	31.7	Very low	99 Å²	99	134.5 Å²	134.5	64%	0.643	81%	0.81	S	S	*	*			trans	-74.1	152.8	166.3	31.3	-32.4	0	0	0	110.7
487	H	27.4	Very low	30.1	Very low	185 Å²	185	134.8 Å²	134.8	86%	0.856	81%	0.814	S	S	*	*			trans	87.8	87.6	173.2	-48.3	-68.2	0	0	0	118.7
488	S	26.3	Very low	29.4	Very low	118 Å²	118	133.8 Å²	133.8	83%	0.825	82%	0.817	S	S	*	*				-149.7	135	129.8	59.4	0	0	0	0	111
489	P	37.9	Very low	29.4	Very low	116 Å²	116	137 Å²	137	75%	0.753	82%	0.823	S	S	*	*			trans	-111.2	130	177.3	35.9	-27.9	0	0	0	113.3
490	K	27.9	Very low	29.1	Very low	212 Å²	212	134.2 Å²	134.2	92%	0.922	82%	0.819	S	S	*	*			trans	148.3	116.6	147.5	-85.2	161.9	-178.5	178.2	0	112.4
491	A	27.6	Very low	29.1	Very low	103 Å²	103	135.1 Å²	135.1	85%	0.851	82%	0.82	S	S	*	*			trans	-178.5	148.3	135	0	0	0	0	0	110.7
492	S	30.1	Very low	29.2	Very low	118 Å²	118	136.2 Å²	136.2	83%	0.825	82%	0.821	S	S	*	*			trans	-87.8	163.2	-176.7	-56	0	0	0	0	112.6
493	P	38.7	Very low	29.4	Very low	124 Å²	124	136.5 Å²	136.5	81%	0.805	82%	0.824	S	S	*	*			trans	-86.4	166.8	-158.9	35	-37.4	0	0	0	114.9
494	K	27.9	Very low	29.2	Very low	210 Å²	210	137.6 Å²	137.6	91%	0.913	83%	0.826	S	S	*	*			trans	-130.1	145.9	157.5	-78.2	-168	174.4	-177.3	0	111.8
495	S	26.7	Very low	29.2	Very low	121 Å²	121	140.1 Å²	140.1	85%	0.846	83%	0.831	S	S	*	*			trans	-55.6	147.2	-175.8	50.1	0	0	0	0	115.5
496	G	27.7	Very low	29.4	Very low	77 Å²	77	142.3 Å²	142.3	79%	0.794	84%	0.836	S	S	*	*			trans	-166.8	84.1	167.9	0	0	0	0	0	111.5
497	D	27.6	Very low	29.1	Very low	154 Å²	154	143.1 Å²	143.1	82%	0.824	85%	0.845	S	S	*	*			trans	-62.6	133.7	178.7	-78.3	-69.9	0	0	0	113
498	K	32.2	Very low	29.3	Very low	213 Å²	213	140.3 Å²	140.3	93%	0.926	85%	0.845	S	S	*	*				-157.3	143.7	129.7	-109.9	152.1	-170.1	174	0	112.2
499	Q	29.1	Very low	29.3	Very low	187 Å²	187	139.5 Å²	139.5	87%	0.874	85%	0.846	S	S	*	*			trans	-107.3	131.8	-161.6	-159.9	174.7	54	0	0	110.4
500	G	28.1	Very low	29	Very low	76 Å²	76	139.1 Å²	139.1	78%	0.784	85%	0.852	S	S	*	*			trans	-149.4	100.9	177.8	0	0	0	0	0	110.9
501	K	30.5	Very low	29.2	Very low	202 Å²	202	132.6 Å²	132.6	88%	0.878	85%	0.846	S	S	*	*			trans	-80.9	130.2	178.9	-68.7	-179.2	178.3	178.6	0	110.8
502	A	26.7	Very low	29.7	Very low	99 Å²	99	133.9 Å²	133.9	82%	0.818	84%	0.843	S	S	*	*			trans	-139.2	145.7	155.6	0	0	0	0	0	108.7
503	A	29.6	Very low	30.3	Very low	104 Å²	104	132.7 Å²	132.7	86%	0.86	84%	0.835	S	S	*	*			trans	-68.8	145.8	-161.3	0	0	0	0	0	114.8
504	S	27.1	Very low	30.6	Very low	110 Å²	110	133.4 Å²	133.4	77%	0.769	83%	0.832	S	S	*	*			trans	-64.9	134.7	161.4	52.1	0	0	0	0	111
505	N	26.1	Very low	31.7	Very low	166 Å²	166	128.2 Å²	128.2	89%	0.888	81%	0.814	S	S	*	*			trans	-138.7	97.7	155.1	-124.1	-1.3	0	0	0	108.4	S507	N505-S507 PolarHBondContact O-N 3.17Å
506	Q	29.3	Very low	33	Very low	194 Å²	194	124.6 Å²	124.6	91%	0.907	79%	0.791	S	S	*	*			trans	-82.7	109.9	173.9	-72.2	178.6	-15.1	0	0	108.8
507	S	27.2	Very low	34.6	Very low	117 Å²	117	122.9 Å²	122.9	82%	0.818	77%	0.774	S	S	*	*			trans	-105.9	99.2	161.8	46.5	0	0	0	0	109.2	N505 A509	N505-S507 PolarHBondContact O-N 3.17Å; S507-A509 PolarHBondContact O-N 3.06Å; S507-A509 VanDerWaalsContact O-N 3.14Å
508	S	30	Very low	36.2	Very low	125 Å²	125	122.2 Å²	122.2	87%	0.874	77%	0.766	S	S	*	*			trans	-74.2	99.1	179.4	54.8	0	0	0	0	111.4
509	A	27.3	Very low	37.8	Very low	101 Å²	101	116.6 Å²	116.6	84%	0.835	74%	0.739	S	S	*	*			trans	-115.4	88.2	168.1	0	0	0	0	0	109.5	S507	S507-A509 PolarHBondContact O-N 3.06Å; S507-A509 VanDerWaalsContact O-N 3.14Å
510	A	30.7	Very low	39.8	Very low	108 Å²	108	113.1 Å²	113.1	89%	0.893	72%	0.721	S	S	*	*			trans	-83.5	153.3	175.6	0	0	0	0	0	111.3
511	G	34.1	Very low	42.4	Very low	76 Å²	76	113.9 Å²	113.9	78%	0.784	70%	0.704	S	S	*	*	S	Bend	trans	138.7	-8	158.8	0	0	0	0	0	119.5
512	T	36.6	Very low	45	Very low	130 Å²	130	104.7 Å²	104.7	80%	0.798	67%	0.666	S	S	*	*	S	Bend	trans	-138.1	-9.2	-172.9	49.8	0	0	0	0	117.6
513	S	43.2	Very low	48	Very low	93 Å²	93	100.5 Å²	100.5	65%	0.65	63%	0.63	S	S	*	*	H	α-helix	trans	-75.4	-34.9	-167.3	-165.2	0	0	0	0	115.3	A516 G517	S513-A516 PolarHBondContact O-N 3.43Å; S513-G517 PolarHBondContact O-N 2.71Å; S513-G517 VanDerWaalsContact O-N 3.17Å
514	D	45.6	Very low	51	Low	138 Å²	138	101.7 Å²	101.7	74%	0.738	61%	0.613	S	S	*	*	H	α-helix	trans	-71.5	-42.7	-164.4	-58.1	-36.9	0	0	0	112.9	A516 G517 Q518	D514-A516 PolarHBondContact O-N 2.93Å; D514-G517 WeakPolarHBondContact O-CA 3.33Å; D514-G517 PolarHBondContact O-N 3.02Å; D514-Q518 PolarHBondContact O-N 3.22Å
515	N	50.7	Low	54	Low	101 Å²	101	98.6 Å²	98.6	54%	0.54	59%	0.59	S	S	.	*	H	α-helix	trans	-58.7	-34.9	174.5	-76.8	-12.9	0	0	0	112.3	R519	N515-R519 WeakPolarHBondContact O-CB 3.43Å; N515-R519 VanDerWaalsContact O-CG 3.23Å; N515-R519 WeakPolarHBondContact O-CG 3.29Å; N515-R519 PolarHBondContact O-N 3.34Å
516	A	53.6	Low	57.3	Low	45 Å²	45	90.8 Å²	90.8	37%	0.372	55%	0.548	S	S	.	.	H	α-helix	trans	-73.2	-30.6	177.5	0	0	0	0	0	112.4	S513 D514 K520	S513-A516 PolarHBondContact O-N 3.43Å; D514-A516 PolarHBondContact O-N 2.93Å; A516-K520 WeakPolarHBondContact O-CB 3.14Å; A516-K520 WeakPolarHBondContact O-CD 3.4Å; A516-K520 VanDerWaalsContact O-CG 3.29Å; A516-K520 WeakPolarHBondContact O-CG 3.25Å; A516-K520 PolarHBondContact O-N 2.81Å
517	G	61.3	Low	60.4	Low	42 Å²	42	81.6 Å²	81.6	43%	0.433	51%	0.506	S	S	.	.	H	α-helix	trans	-66.9	-51.4	168.6	0	0	0	0	0	111.7	S513 D514 R519 K520 E521	S513-G517 PolarHBondContact O-N 2.71Å; S513-G517 VanDerWaalsContact O-N 3.17Å; D514-G517 WeakPolarHBondContact O-CA 3.33Å; D514-G517 PolarHBondContact O-N 3.02Å; G517-R519 PolarHBondContact O-N 2.78Å; G517-K520 PolarHBondContact O-N 3.01Å; G517-E521 PolarHBondContact O-N 3.47Å; G517-E521 VanDerWaalsContact O-N 3.08Å
518	Q	61.8	Low	63.7	Low	140 Å²	140	79 Å²	79	65%	0.654	49%	0.491	S	S	*	.	H	α-helix	trans	-61.8	-43.2	-176.7	-166.5	176.9	13.4	0	0	112.9	D514 K520 E521 A522	D514-Q518 PolarHBondContact O-N 3.22Å; Q518-K520 PolarHBondContact O-N 2.83Å; Q518-E521 PolarHBondContact O-N 3.42Å; Q518-E521 VanDerWaalsContact O-N 3.15Å; Q518-A522 PolarHBondContact O-N 2.79Å
519	R	66.2	Low	66.8	Low	94 Å²	94	76.1 Å²	76.1	36%	0.355	46%	0.463	S	S	.	.	H	α-helix	trans	-61.2	-41.5	174.5	-71.5	168.6	-177.2	-179.1	-2.4	112.4	D430 N515 G517 E521 A522 V523	D430-R519 HydrophobicContact CB-CB 4.42Å; N515-R519 WeakPolarHBondContact O-CB 3.43Å; N515-R519 VanDerWaalsContact O-CG 3.23Å; N515-R519 WeakPolarHBondContact O-CG 3.29Å; N515-R519 PolarHBondContact O-N 3.34Å; G517-R519 PolarHBondContact O-N 2.78Å; R519-E521 PolarHBondContact O-N 2.86Å; R519-A522 PolarHBondContact O-N 2.98Å; R519-V523 PolarHBondContact O-N 3.22Å
520	K	70.7	Confident	70.1	Confident	115 Å²	115	71.3 Å²	71.3	50%	0.5	42%	0.423	S	S	.	.	H	α-helix	trans	-68.9	-18.1	176.4	-75.6	175.2	-177.7	172	0	113.5	A516 G517 Q518 V523 R524	A516-K520 WeakPolarHBondContact O-CB 3.14Å; A516-K520 WeakPolarHBondContact O-CD 3.4Å; A516-K520 VanDerWaalsContact O-CG 3.29Å; A516-K520 WeakPolarHBondContact O-CG 3.25Å; A516-K520 PolarHBondContact O-N 2.81Å; G517-K520 PolarHBondContact O-N 3.01Å; Q518-K520 PolarHBondContact O-N 2.83Å; K520-V523 WeakPolarHBondContact O-CG1 3.31Å; K520-R524 PolarHBondContact O-NH1 3.34Å
521	E	81.3	Confident	73.3	Confident	91 Å²	91	66.2 Å²	66.2	43%	0.425	38%	0.381	S	S	.	.	H	α-helix	trans	-87.2	-44	173.9	-160.4	54.5	-151.4	0	0	111.9	G517 Q518 R519 V523 R524 C525	G517-E521 PolarHBondContact O-N 3.47Å; G517-E521 VanDerWaalsContact O-N 3.08Å; Q518-E521 PolarHBondContact O-N 3.42Å; Q518-E521 VanDerWaalsContact O-N 3.15Å; R519-E521 PolarHBondContact O-N 2.86Å; E521-V523 PolarHBondContact O-N 2.98Å; E521-V523 VanDerWaalsContact O-N 3.15Å; E521-R524 CarbonylContact O-C 3.54Å; E521-R524 WeakPolarHBondContact O-CA 3.49Å; E521-R524 WeakPolarHBondContact O-CB 3.39Å; E521-R524 PolarHBondContact O-N 3.33Å; E521-R524 IonicContact OE2-CZ 3.32Å; E521-R524 IonicContact OE2-NH1 2.68Å; E521-R524 PolarHBondContact OE2-NH1 2.88Å; E521-C525 PolarHBondContact O-N 3.05Å; E521-C525 PolarHBondContact O-SG 2.71Å; E521-C525 VanDerWaalsContact O-SG 3.33Å
522	A	85.9	Confident	76.3	Confident	10 Å²	10	62.6 Å²	62.6	8%	0.083	34%	0.344	C	S	.	.	H	α-helix	trans	-52.5	-40.2	176.9	0	0	0	0	0	113.2	F433 A434 Q518 R519 R524 C525 L526	F433-A522 HydrophobicContact CB-CB 4.34Å; A434-A522 HydrophobicContact CB-CB 4.37Å; Q518-A522 PolarHBondContact O-N 2.79Å; R519-A522 PolarHBondContact O-N 2.98Å; A522-R524 VanDerWaalsContact C-N 3.33Å; A522-R524 PolarHBondContact O-N 3.11Å; A522-C525 PolarHBondContact O-N 3.06Å; A522-L526 WeakPolarHBondContact O-CB 3.43Å; A522-L526 WeakPolarHBondContact O-CG 3.22Å; A522-L526 PolarHBondContact O-N 2.93Å
523	V	90.8	Very high	79.3	Confident	10 Å²	10	57.5 Å²	57.5	6%	0.061	31%	0.31	C	S	.	.	H	α-helix	trans	-65.9	-31.7	175.3	66.8	0	0	0	0	113.2	F433 R467 L468 L471 R519 K520 E521 A527	F433-V523 HydrophobicContact CB-CB 4.03Å; F433-V523 HydrophobicContact CD1-CB 4.06Å; F433-V523 HydrophobicContact CD1-CG2 3.73Å; F433-V523 HydrophobicContact CD2-CB 3.68Å; F433-V523 HydrophobicContact CD2-CG2 3.8Å; F433-V523 HydrophobicContact CE1-CB 4.47Å; F433-V523 HydrophobicContact CE1-CG2 3.69Å; F433-V523 HydrophobicContact CE2-CB 4.13Å; F433-V523 HydrophobicContact CE2-CG2 3.77Å; F433-V523 HydrophobicContact CG-CB 3.64Å; F433-V523 HydrophobicContact CG-CG2 3.79Å; F433-V523 HydrophobicContact CZ-CG2 3.72Å; R467-V523 HydrophobicContact CG-CG2 4.48Å; L468-V523 HydrophobicContact CD2-CG2 4.1Å; L471-V523 HydrophobicContact CD1-CG1 4.44Å; L471-V523 HydrophobicContact CD1-CG2 3.83Å; R519-V523 PolarHBondContact O-N 3.22Å; K520-V523 WeakPolarHBondContact O-CG1 3.31Å; E521-V523 PolarHBondContact O-N 2.98Å; E521-V523 VanDerWaalsContact O-N 3.15Å; V523-A527 WeakPolarHBondContact O-CB 3.5Å; V523-A527 PolarHBondContact O-N 3.34Å
524	R	91.3	Very high	81.9	Confident	130 Å²	130	53.1 Å²	53.1	49%	0.491	28%	0.279	S	S	.	.	H	α-helix	trans	-75	-44.7	173.4	-63.2	-178.7	-170.4	112.4	3.1	111.3	K520 E521 A522 L526 A527 A528	K520-R524 PolarHBondContact O-NH1 3.34Å; E521-R524 CarbonylContact O-C 3.54Å; E521-R524 WeakPolarHBondContact O-CA 3.49Å; E521-R524 WeakPolarHBondContact O-CB 3.39Å; E521-R524 PolarHBondContact O-N 3.33Å; E521-R524 IonicContact OE2-CZ 3.32Å; E521-R524 IonicContact OE2-NH1 2.68Å; E521-R524 PolarHBondContact OE2-NH1 2.88Å; A522-R524 VanDerWaalsContact C-N 3.33Å; A522-R524 PolarHBondContact O-N 3.11Å; R524-L526 VanDerWaalsContact C-N 3.26Å; R524-L526 PolarHBondContact O-N 2.85Å; R524-A527 PolarHBondContact O-N 3.41Å; R524-A528 WeakPolarHBondContact O-CB 3.21Å; R524-A528 PolarHBondContact O-N 2.87Å
525	C	91.6	Very high	84.3	Confident	44 Å²	44	46.6 Å²	46.6	30%	0.297	24%	0.244	S	C	.	.	H	α-helix	trans	-58.4	-38.1	177.1	-62.3	0	0	0	0	111.9	E521 A522 K529	E521-C525 PolarHBondContact O-N 3.05Å; E521-C525 PolarHBondContact O-SG 2.71Å; E521-C525 VanDerWaalsContact O-SG 3.33Å; A522-C525 PolarHBondContact O-N 3.06Å; C525-K529 VanDerWaalsContact O-CD 3.27Å; C525-K529 WeakPolarHBondContact O-CD 3.33Å; C525-K529 VanDerWaalsContact O-CE 3.24Å; C525-K529 WeakPolarHBondContact O-CE 3.46Å; C525-K529 WeakPolarHBondContact O-CG 3.26Å
526	L	94.3	Very high	86.5	Confident	2 Å²	2	42 Å²	42	1%	0.01	22%	0.22	C	C	.	.	H	α-helix	trans	-70.7	-50.5	170.7	-73.8	174.3	0	0	0	112.4	F433 L436 E437 L440 L468 A522 R524 A528 K529 V530 I616	F433-L526 HydrophobicContact CB-CD1 4.15Å; F433-L526 HydrophobicContact CD1-CD1 4.35Å; F433-L526 VanDerWaalsContact O-CD1 3.28Å; F433-L526 WeakPolarHBondContact O-CD1 3.24Å; L436-L526 HydrophobicContact CB-CD1 4.12Å; L436-L526 HydrophobicContact CD2-CD1 4.05Å; L436-L526 HydrophobicContact CG-CD1 4.14Å; E437-L526 HydrophobicContact CB-CD1 4.3Å; E437-L526 HydrophobicContact CB-CD2 4.02Å; E437-L526 HydrophobicContact CB-CG 4.13Å; L440-L526 HydrophobicContact CD1-CD2 3.97Å; L468-L526 HydrophobicContact CD2-CB 3.78Å; A522-L526 WeakPolarHBondContact O-CB 3.43Å; A522-L526 WeakPolarHBondContact O-CG 3.22Å; A522-L526 PolarHBondContact O-N 2.93Å; R524-L526 VanDerWaalsContact C-N 3.26Å; R524-L526 PolarHBondContact O-N 2.85Å; L526-A528 VanDerWaalsContact C-N 3.3Å; L526-A528 PolarHBondContact O-N 2.95Å; L526-K529 WeakPolarHBondContact O-CB 3.23Å; L526-K529 PolarHBondContact O-N 2.96Å; L526-V530 PolarHBondContact O-N 3.47Å; L526-I616 HydrophobicContact CD2-CD1 3.85Å
527	A	95.3	Very high	88.3	Confident	1 Å²	1	40.8 Å²	40.8	1%	0.008	21%	0.207	C	C	.	.	H	α-helix	trans	-63	-33.3	-175.9	0	0	0	0	0	113.5	L468 L471 S472 V523 R524 K529 V530	L468-A527 HydrophobicContact CD2-CB 4.24Å; L471-A527 HydrophobicContact CB-CB 3.55Å; S472-A527 WeakPolarHBondContact CA-O 3.46Å; S472-A527 VanDerWaalsContact CB-O 3.29Å; S472-A527 WeakPolarHBondContact CB-O 3.29Å; V523-A527 WeakPolarHBondContact O-CB 3.5Å; V523-A527 PolarHBondContact O-N 3.34Å; R524-A527 PolarHBondContact O-N 3.41Å; A527-K529 PolarHBondContact O-N 2.84Å; A527-V530 WeakPolarHBondContact O-CB 3.41Å; A527-V530 PolarHBondContact O-N 2.67Å; A527-V530 VanDerWaalsContact O-N 3.16Å
528	A	95	Very high	89.7	Confident	62 Å²	62	39 Å²	39	51%	0.512	19%	0.188	S	C	.	.	H	α-helix	trans	-62.4	-29.7	174.7	0	0	0	0	0	113.2	R524 L526 Q562	R524-A528 WeakPolarHBondContact O-CB 3.21Å; R524-A528 PolarHBondContact O-N 2.87Å; L526-A528 VanDerWaalsContact C-N 3.3Å; L526-A528 PolarHBondContact O-N 2.95Å; A528-Q562 PolarHBondContact O-NE2 3.44Å
529	K	95.6	Very high	91	Very high	65 Å²	65	33.2 Å²	33.2	28%	0.283	16%	0.161	S	C	.	.	H	α-helix	trans	-83.1	-11.9	177.9	-61.7	165.9	-170.3	165.2	0	112.9	E437 C525 L526 A527 V531 D614 Y615 I616	E437-K529 IonicContact OE1-NZ 3.15Å; E437-K529 PolarHBondContact OE1-NZ 2.96Å; C525-K529 VanDerWaalsContact O-CD 3.27Å; C525-K529 WeakPolarHBondContact O-CD 3.33Å; C525-K529 VanDerWaalsContact O-CE 3.24Å; C525-K529 WeakPolarHBondContact O-CE 3.46Å; C525-K529 WeakPolarHBondContact O-CG 3.26Å; L526-K529 WeakPolarHBondContact O-CB 3.23Å; L526-K529 PolarHBondContact O-N 2.96Å; A527-K529 PolarHBondContact O-N 2.84Å; K529-V531 PolarHBondContact O-N 3.15Å; K529-D614 WeakPolarHBondContact CB-O 3.48Å; K529-D614 WeakPolarHBondContact CG-O 3.4Å; K529-Y615 CarbonylContact O-C 3.42Å; K529-Y615 WeakPolarHBondContact O-CA 3.2Å; K529-I616 HydrophobicContact CB-CD1 3.9Å; K529-I616 HydrophobicContact CB-CG1 3.98Å; K529-I616 HydrophobicContact CD-CD1 4.47Å; K529-I616 PolarHBondContact O-N 3.39Å
530	V	97.6	Very high	92.2	Very high	1 Å²	1	29.7 Å²	29.7	1%	0.006	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	117.7	-178.7	174.2	0	0	0	0	110.3	L468 C473 L526 A527 I616 L618	L468-V530 HydrophobicContact CB-CG2 4.48Å; C473-V530 PolarHBondContact SG-O 3.18Å; C473-V530 VanDerWaalsContact SG-O 3.37Å; L526-V530 PolarHBondContact O-N 3.47Å; A527-V530 WeakPolarHBondContact O-CB 3.41Å; A527-V530 PolarHBondContact O-N 2.67Å; A527-V530 VanDerWaalsContact O-N 3.16Å; V530-I616 WeakPolarHBondContact CA-O 3.35Å; V530-I616 HydrophobicContact CG2-CB 4.22Å; V530-I616 HydrophobicContact CG2-CG2 4.33Å; V530-L618 HydrophobicContact CG1-CD1 3.77Å; V530-L618 HydrophobicContact CG1-CG 4.05Å; V530-L618 HydrophobicContact CG2-CD1 3.85Å; V530-L618 HydrophobicContact CG2-CD2 4.3Å; V530-L618 HydrophobicContact CG2-CG 4.13Å
531	V	97.1	Very high	93.2	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	-20.3	-177.9	-67.4	0	0	0	0	113.5	H474 K529 L557 A560 Q562 L563 Y615 I616 I617 L651	H474-V531 PolarHBondContact NE2-O 3.18Å; K529-V531 PolarHBondContact O-N 3.15Å; V531-L557 HydrophobicContact CB-CD2 3.96Å; V531-L557 HydrophobicContact CG2-CD2 3.51Å; V531-A560 HydrophobicContact CB-CB 4.04Å; V531-A560 HydrophobicContact CG1-CB 4.26Å; V531-Q562 HydrophobicContact CG1-CB 4.37Å; V531-L563 HydrophobicContact CB-CD1 3.93Å; V531-L563 HydrophobicContact CG1-CD1 4.14Å; V531-L563 HydrophobicContact CG1-CG 4.24Å; V531-L563 HydrophobicContact CG2-CD1 4.22Å; V531-Y615 HydrophobicContact CG1-CD1 3.86Å; V531-Y615 HydrophobicContact CG1-CD2 4.49Å; V531-Y615 HydrophobicContact CG1-CG 3.83Å; V531-I616 WeakPolarHBondContact CG2-O 3.41Å; V531-I616 PolarHBondContact N-O 2.89Å; V531-I617 HydrophobicContact CG2-CG1 4.35Å; V531-L651 HydrophobicContact CG2-CD1 4.4Å
532	A	97.8	Very high	93.7	Very high	0 Å²	0	24 Å²	24	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	162.1	171	0	0	0	0	0	111.5	V553 L556 L557 I617 L618	A532-V553 HydrophobicContact CB-CG1 4.1Å; A532-L556 HydrophobicContact CB-CB 3.82Å; A532-L556 HydrophobicContact CB-CD1 4.41Å; A532-L557 HydrophobicContact CB-CD2 3.85Å; A532-L557 HydrophobicContact CB-CG 3.94Å; A532-I617 HydrophobicContact CB-CG1 4.24Å; A532-I617 HydrophobicContact CB-CG2 4.27Å; A532-I617 WeakPolarHBondContact O-CA 3.49Å; A532-L618 PolarHBondContact O-N 2.93Å
533	Y	98	Very high	94.2	Very high	24 Å²	24	23.6 Å²	23.6	9%	0.094	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	155.4	-179	68.2	-81.8	0	0	0	111.5	F415 V469 H474 F535 L556 L618	F415-Y533 HydrophobicContact CD2-CD2 4.11Å; F415-Y533 AromaticContact CD2-CE2 3.61Å; F415-Y533 HydrophobicContact CD2-CE2 3.61Å; F415-Y533 HydrophobicContact CE2-CD2 4.48Å; F415-Y533 HydrophobicContact CE2-CE2 4.27Å; V469-Y533 HydrophobicContact CB-CG 4.46Å; V469-Y533 HydrophobicContact CG1-CD1 3.93Å; V469-Y533 HydrophobicContact CG1-CD2 3.93Å; V469-Y533 HydrophobicContact CG1-CE1 3.9Å; V469-Y533 HydrophobicContact CG1-CE2 3.84Å; V469-Y533 HydrophobicContact CG1-CG 3.96Å; V469-Y533 HydrophobicContact CG2-CD1 4.16Å; V469-Y533 HydrophobicContact CG2-CD2 3.78Å; V469-Y533 HydrophobicContact CG2-CE2 4.49Å; V469-Y533 HydrophobicContact CG2-CG 3.56Å; H474-Y533 HydrophobicContact CB-CD1 4.13Å; H474-Y533 HydrophobicContact CB-CE1 3.57Å; H474-Y533 AromaticContact CD2-CD1 3.96Å; H474-Y533 AromaticContact CG-CE1 3.69Å; Y533-F535 AromaticContact CD2-CD2 3.92Å; Y533-F535 HydrophobicContact CD2-CD2 3.92Å; Y533-F535 AromaticContact CD2-CE2 3.56Å; Y533-F535 HydrophobicContact CD2-CE2 3.56Å; Y533-F535 HydrophobicContact CE2-CD2 4.29Å; Y533-F535 AromaticContact CE2-CE2 3.98Å; Y533-F535 HydrophobicContact CE2-CE2 3.98Å; Y533-L556 HydrophobicContact CD1-CD1 3.7Å; Y533-L556 HydrophobicContact CD1-CD2 4.46Å; Y533-L556 HydrophobicContact CE1-CD1 3.75Å; Y533-L556 HydrophobicContact CE1-CD2 3.81Å; Y533-L556 HydrophobicContact CE1-CG 4.44Å; Y533-L556 HydrophobicContact CG-CD1 4.17Å; Y533-L556 WeakPolarHBondContact O-CD1 3.47Å; Y533-L618 CarbonylContact C-O 3.44Å; Y533-L618 VanDerWaalsContact CA-O 3.23Å; Y533-L618 WeakPolarHBondContact CA-O 3.43Å
534	H	98	Very high	94.4	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	140.5	177.2	-170.6	98	0	0	0	109.8	F415 T543 F549 L618 V619 D620	F415-H534 HydrophobicContact CZ-CB 4.33Å; F415-H534 AromaticContact CZ-CE1 3.86Å; F415-H534 AromaticContact CZ-CG 3.8Å; F415-H534 AromaticContact CZ-ND1 3.46Å; F415-H534 WeakPolarHBondContact CZ-ND1 3.3Å; H534-T543 PolarHBondContact NE2-O 3.32Å; H534-F549 HydrophobicContact CB-CD2 4.03Å; H534-F549 HydrophobicContact CB-CE2 4.07Å; H534-F549 AromaticContact CD2-CD2 3.8Å; H534-F549 AromaticContact CE1-CD2 3.88Å; H534-F549 AromaticContact CG-CD2 3.58Å; H534-F549 AromaticContact ND1-CD2 3.65Å; H534-F549 AromaticContact NE2-CD2 3.97Å; H534-L618 PolarHBondContact N-O 3.39Å; H534-V619 WeakPolarHBondContact O-CA 3.41Å; H534-D620 PolarHBondContact O-N 3.29Å
535	F	96.6	Very high	94.5	Very high	2 Å²	2	19.1 Å²	19.1	1%	0.009	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	118.4	174.4	-66.7	-94.7	0	0	0	109	F415 V417 T462 I465 W466 V469 Y533 Q537 T543 D620	F415-F535 HydrophobicContact CB-CB 4.36Å; F415-F535 HydrophobicContact CB-CD2 3.69Å; F415-F535 HydrophobicContact CB-CE2 4.44Å; F415-F535 HydrophobicContact CB-CG 4.36Å; F415-F535 HydrophobicContact CD1-CB 3.7Å; F415-F535 HydrophobicContact CD1-CD2 4.24Å; F415-F535 HydrophobicContact CD1-CG 4.46Å; F415-F535 WeakPolarHBondContact CD1-O 3.23Å; F415-F535 HydrophobicContact CD2-CD2 4.14Å; F415-F535 HydrophobicContact CE1-CB 4.21Å; F415-F535 WeakPolarHBondContact CE1-O 3.41Å; F415-F535 HydrophobicContact CG-CB 4.11Å; F415-F535 AromaticContact CG-CD2 3.76Å; F415-F535 HydrophobicContact CG-CD2 3.76Å; F415-F535 HydrophobicContact CG-CG 4.4Å; V417-F535 HydrophobicContact CG2-CD1 4.11Å; V417-F535 HydrophobicContact CG2-CE1 4.01Å; V417-F535 HydrophobicContact CG2-CZ 4.33Å; T462-F535 HydrophobicContact CG2-CD1 3.9Å; T462-F535 HydrophobicContact CG2-CE1 3.85Å; I465-F535 HydrophobicContact CB-CE1 4.18Å; I465-F535 HydrophobicContact CB-CZ 4.44Å; I465-F535 HydrophobicContact CG2-CE1 3.78Å; I465-F535 HydrophobicContact CG2-CZ 3.74Å; W466-F535 HydrophobicContact CB-CE1 4.48Å; W466-F535 HydrophobicContact CB-CZ 4.17Å; W466-F535 HydrophobicContact CE3-CE1 4.45Å; W466-F535 AromaticContact CE3-CE2 3.78Å; W466-F535 HydrophobicContact CE3-CE2 3.78Å; W466-F535 AromaticContact CE3-CZ 3.65Å; W466-F535 HydrophobicContact CE3-CZ 3.65Å; W466-F535 HydrophobicContact CZ3-CE2 4.18Å; W466-F535 HydrophobicContact CZ3-CZ 4.49Å; V469-F535 HydrophobicContact CG2-CE2 4.25Å; V469-F535 HydrophobicContact CG2-CZ 4.26Å; Y533-F535 AromaticContact CD2-CD2 3.92Å; Y533-F535 HydrophobicContact CD2-CD2 3.92Å; Y533-F535 AromaticContact CD2-CE2 3.56Å; Y533-F535 HydrophobicContact CD2-CE2 3.56Å; Y533-F535 HydrophobicContact CE2-CD2 4.29Å; Y533-F535 AromaticContact CE2-CE2 3.98Å; Y533-F535 HydrophobicContact CE2-CE2 3.98Å; F535-Q537 HydrophobicContact CB-CG 4.28Å; F535-T543 WeakPolarHBondContact O-CB 3.03Å; F535-D620 HydrophobicContact CD1-CB 3.42Å; F535-D620 VanDerWaalsContact CD1-CB 3.42Å; F535-D620 HydrophobicContact CE1-CB 3.84Å; F535-D620 HydrophobicContact CG-CB 4.2Å
536	C	95.9	Very high	94.8	Very high	4 Å²	4	17.3 Å²	17.3	3%	0.027	9%	0.094	C	C	.	.			trans	-79	128.2	170.1	-52.5	0	0	0	0	108.4	D620 S621 E624 A625	C536-D620 PolarHBondContact N-O 3.43Å; C536-S621 WeakPolarHBondContact CB-O 3.22Å; C536-E624 HydrophobicContact CB-CB 4.12Å; C536-A625 HydrophobicContact CB-CB 4.25Å
537	Q	93.1	Very high	94.8	Very high	20 Å²	20	17.9 Å²	17.9	9%	0.093	10%	0.098	C	C	.	.			trans	-132.7	114.2	-175.8	-51.9	-173.7	-85	0	0	108.7	E416 F535 D539 N540 T543	E416-Q537 PolarHBondContact O-NE2 3.03Å; F535-Q537 HydrophobicContact CB-CG 4.28Å; Q537-D539 PolarHBondContact O-N 2.93Å; Q537-D539 VanDerWaalsContact O-N 3.1Å; Q537-N540 HydrophobicContact CB-CB 4.46Å; Q537-N540 CarbonylContact O-C 3.44Å; Q537-N540 PolarHBondContact O-N 3.15Å; Q537-N540 VanDerWaalsContact O-O 3.11Å; Q537-T543 PolarHBondContact N-OG1 3.32Å; Q537-T543 PolarHBondContact O-OG1 3.18Å
538	A	90.1	Very high	94.8	Very high	5 Å²	5	18.3 Å²	18.3	4%	0.041	10%	0.1	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-21.7	-178.6	0	0	0	0	0	113.1	N540 E624 F627 H628 R848	A538-N540 PolarHBondContact O-N 3.24Å; A538-E624 HydrophobicContact CB-CB 4.38Å; A538-E624 WeakPolarHBondContact CB-OE2 3.42Å; A538-F627 HydrophobicContact CB-CB 4.43Å; A538-F627 HydrophobicContact CB-CD1 3.93Å; A538-F627 HydrophobicContact CB-CE1 4.49Å; A538-F627 HydrophobicContact CB-CG 4.25Å; A538-H628 PolarHBondContact O-NE2 2.76Å; A538-R848 PolarHBondContact O-NH1 3.07Å
539	D	88.9	Confident	95	Very high	17 Å²	17	15.6 Å²	15.6	9%	0.091	8%	0.076	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-10.9	172.7	-70.7	10	0	0	0	113.1	Q537 H796 P797 M841 L842 R848	Q537-D539 PolarHBondContact O-N 2.93Å; Q537-D539 VanDerWaalsContact O-N 3.1Å; D539-H796 CarbonylContact O-C 3.58Å; D539-H796 VanDerWaalsContact O-CA 3.3Å; D539-H796 WeakPolarHBondContact O-CA 3.49Å; D539-P797 VanDerWaalsContact O-CD 3.29Å; D539-P797 WeakPolarHBondContact O-CD 3.34Å; D539-M841 HydrophobicContact CB-CE 3.78Å; D539-M841 HydrophobicContact CB-CG 4.17Å; D539-M841 HydrophobicContact CB-SD 4.31Å; D539-L842 PolarHBondContact OD2-N 3.36Å; D539-R848 VanDerWaalsContact CA-NH1 3.31Å; D539-R848 VanDerWaalsContact N-NH1 3.16Å; D539-R848 WeakPolarHBondContact OD1-CD 3.41Å; D539-R848 IonicContact OD1-CZ 3.47Å; D539-R848 IonicContact OD1-NE 2.69Å; D539-R848 IonicContact OD1-NH1 3.61Å; D539-R848 PolarHBondContact OD1-NH1 2.95Å
540	N	92	Very high	95.1	Very high	21 Å²	21	12.5 Å²	12.5	11%	0.112	6%	0.063	C	C	.	.			trans	-141.4	88.3	-177.2	-170.6	-2.8	0	0	0	111.4	Q537 A538 Y542 T543 P797	Q537-N540 HydrophobicContact CB-CB 4.46Å; Q537-N540 CarbonylContact O-C 3.44Å; Q537-N540 PolarHBondContact O-N 3.15Å; Q537-N540 VanDerWaalsContact O-O 3.11Å; A538-N540 PolarHBondContact O-N 3.24Å; N540-Y542 PolarHBondContact O-N 3.03Å; N540-Y542 WeakPolarHBondContact OD1-CD2 3.49Å; N540-T543 HydrophobicContact CB-CG2 4Å; N540-T543 WeakPolarHBondContact O-CB 3.36Å; N540-T543 PolarHBondContact O-N 2.75Å; N540-T543 PolarHBondContact O-OG1 3.42Å; N540-P797 HydrophobicContact CB-CG 4.32Å
541	T	92.1	Very high	95	Very high	24 Å²	24	12.9 Å²	12.9	15%	0.147	7%	0.065	C	C	.	.	G	3₁₀ helix	trans	-50.6	-35.8	-175.8	-57.3	0	0	0	0	113.1	T543 C544 L545 H628 L795	T541-T543 PolarHBondContact O-N 3.09Å; T541-T543 VanDerWaalsContact O-N 3.12Å; T541-C544 WeakPolarHBondContact O-CA 3.28Å; T541-C544 WeakPolarHBondContact O-CB 3.32Å; T541-C544 PolarHBondContact O-N 3.11Å; T541-L545 HydrophobicContact CG2-CD1 4.47Å; T541-L545 HydrophobicContact CG2-CG 4.43Å; T541-L545 PolarHBondContact O-N 2.99Å; T541-H628 HydrophobicContact CG2-CB 4.3Å; T541-H628 PolarHBondContact OG1-CE1 2.75Å; T541-H628 PolarHBondContact OG1-ND1 3.17Å; T541-H628 PolarHBondContact OG1-NE2 2.95Å; T541-L795 WeakPolarHBondContact CB-O 3.28Å; T541-L795 PolarHBondContact N-O 3.47Å; T541-L795 PolarHBondContact OG1-O 3.47Å
542	Y	91.1	Very high	95	Very high	61 Å²	61	13 Å²	13	24%	0.239	7%	0.065	C	C	.	.	G	3₁₀ helix	trans	-58.3	-25.6	176.9	-61.1	-71.6	0	0	0	113.9	N540 C544 E548 H796 Q887	N540-Y542 PolarHBondContact O-N 3.03Å; N540-Y542 WeakPolarHBondContact OD1-CD2 3.49Å; Y542-C544 VanDerWaalsContact C-N 3.3Å; Y542-E548 WeakPolarHBondContact CD1-OE1 3.27Å; Y542-E548 WeakPolarHBondContact O-CB 2.87Å; Y542-H796 HydrophobicContact CD2-CB 4.34Å; Y542-H796 HydrophobicContact CE2-CB 4.21Å; Y542-Q887 PolarHBondContact OH-NE2 2.89Å
543	T	95	Very high	95	Very high	2 Å²	2	13 Å²	13	1%	0.012	7%	0.065	C	C	.	.	G	3₁₀ helix	trans	-78.7	-13.6	174.9	68.3	0	0	0	0	113.3	L413 F415 H534 F535 Q537 N540 T541	L413-T543 HydrophobicContact CD1-CG2 4.43Å; F415-T543 HydrophobicContact CD1-CG2 4.21Å; F415-T543 HydrophobicContact CE1-CG2 3.87Å; H534-T543 PolarHBondContact NE2-O 3.32Å; F535-T543 WeakPolarHBondContact O-CB 3.03Å; Q537-T543 PolarHBondContact N-OG1 3.32Å; Q537-T543 PolarHBondContact O-OG1 3.18Å; N540-T543 HydrophobicContact CB-CG2 4Å; N540-T543 WeakPolarHBondContact O-CB 3.36Å; N540-T543 PolarHBondContact O-N 2.75Å; N540-T543 PolarHBondContact O-OG1 3.42Å; T541-T543 PolarHBondContact O-N 3.09Å; T541-T543 VanDerWaalsContact O-N 3.12Å
544	C	95.1	Very high	95	Very high	4 Å²	4	11.8 Å²	11.8	3%	0.027	6%	0.06	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.1	-5	-177.5	-63.8	0	0	0	0	112.8	T541 Y542 E624 A625 H628	T541-C544 WeakPolarHBondContact O-CA 3.28Å; T541-C544 WeakPolarHBondContact O-CB 3.32Å; T541-C544 PolarHBondContact O-N 3.11Å; Y542-C544 VanDerWaalsContact C-N 3.3Å; C544-E624 PolarHBondContact SG-O 3.13Å; C544-E624 VanDerWaalsContact SG-O 3.36Å; C544-A625 HydrophobicContact CB-CB 4.2Å; C544-H628 HydrophobicContact CB-CB 3.99Å
545	L	94.2	Very high	94.9	Very high	42 Å²	42	11.8 Å²	11.8	22%	0.22	6%	0.06	C	C	.	.			trans	-93.1	136.9	-178	-64.9	177.8	0	0	0	111.8	T541 E548 F549	T541-L545 HydrophobicContact CG2-CD1 4.47Å; T541-L545 HydrophobicContact CG2-CG 4.43Å; T541-L545 PolarHBondContact O-N 2.99Å; L545-E548 VanDerWaalsContact CB-OE2 3.23Å; L545-E548 WeakPolarHBondContact CB-OE2 3.24Å; L545-F549 PolarHBondContact O-N 3.41Å
546	V	97.1	Very high	95	Very high	7 Å²	7	11.9 Å²	11.9	4%	0.042	6%	0.061	C	C	.	.	H	α-helix	trans	-63.3	-41.3	-177.2	177.9	0	0	0	0	113.7	E548 F549 V550 P589 D634 T635 F639	V546-E548 PolarHBondContact O-N 2.73Å; V546-F549 WeakPolarHBondContact O-CB 3.35Å; V546-F549 PolarHBondContact O-N 2.81Å; V546-V550 HydrophobicContact CG1-CG2 4.34Å; V546-V550 WeakPolarHBondContact O-CG2 3.43Å; V546-V550 PolarHBondContact O-N 2.94Å; V546-P589 HydrophobicContact CG1-CB 3.67Å; V546-P589 HydrophobicContact CG1-CG 3.93Å; V546-D634 HydrophobicContact CG2-CB 4.25Å; V546-D634 WeakPolarHBondContact CG2-O 3.45Å; V546-T635 WeakPolarHBondContact CG2-O 3.25Å; V546-F639 HydrophobicContact CG1-CB 3.9Å; V546-F639 HydrophobicContact CG1-CD1 3.93Å; V546-F639 HydrophobicContact CG1-CD2 3.4Å; V546-F639 VanDerWaalsContact CG1-CD2 3.4Å; V546-F639 HydrophobicContact CG1-CE1 4.31Å; V546-F639 HydrophobicContact CG1-CE2 3.81Å; V546-F639 HydrophobicContact CG1-CG 3.45Å; V546-F639 VanDerWaalsContact CG1-CG 3.45Å; V546-F639 HydrophobicContact CG1-CZ 4.25Å; V546-F639 HydrophobicContact CG2-CB 3.89Å; V546-F639 HydrophobicContact CG2-CG 4.36Å
547	P	95.6	Very high	95	Very high	14 Å²	14	11.7 Å²	11.7	9%	0.091	6%	0.06	C	C	.	.	H	α-helix	trans	-60.5	-42.8	178.7	-27.1	38.1	0	0	0	113.2	V550 H551 L582 C585 V586	P547-V550 PolarHBondContact O-N 3.46Å; P547-H551 WeakPolarHBondContact O-CB 3.48Å; P547-H551 PolarHBondContact O-N 3.31Å; P547-L582 HydrophobicContact CB-CD1 4.12Å; P547-C585 HydrophobicContact CB-CB 3.94Å; P547-C585 WeakPolarHBondContact CB-O 3.49Å; P547-C585 WeakPolarHBondContact CG-O 3.49Å; P547-C585 WeakPolarHBondContact O-CB 3.45Å; P547-V586 HydrophobicContact CB-CB 4.38Å; P547-V586 HydrophobicContact CB-CG2 3.55Å; P547-V586 HydrophobicContact CG-CB 4.36Å; P547-V586 HydrophobicContact CG-CG2 3.75Å
548	E	95.5	Very high	95.1	Very high	9 Å²	9	11 Å²	11	4%	0.042	6%	0.057	C	C	.	.	H	α-helix	trans	-67.5	-38.9	175.2	-72.8	88.6	152.4	0	0	112.4	L413 Y542 L545 V546 S552 L582 R936	L413-E548 HydrophobicContact CD1-CB 4.3Å; Y542-E548 WeakPolarHBondContact CD1-OE1 3.27Å; Y542-E548 WeakPolarHBondContact O-CB 2.87Å; L545-E548 VanDerWaalsContact CB-OE2 3.23Å; L545-E548 WeakPolarHBondContact CB-OE2 3.24Å; V546-E548 PolarHBondContact O-N 2.73Å; E548-S552 WeakPolarHBondContact O-CB 3.3Å; E548-S552 PolarHBondContact O-N 3.42Å; E548-L582 HydrophobicContact CG-CD1 4.08Å; E548-R936 IonicContact OE1-CZ 3.64Å; E548-R936 IonicContact OE1-NH1 3.44Å; E548-R936 PolarHBondContact OE1-NH1 3.28Å; E548-R936 IonicContact OE1-NH2 3.39Å; E548-R936 PolarHBondContact OE1-NH2 3.28Å; E548-R936 IonicContact OE2-NH1 2.61Å
549	F	97.4	Very high	95.3	Very high	5 Å²	5	17.4 Å²	17.4	2%	0.022	8%	0.08	C	C	.	.	H	α-helix	trans	-57.1	-51.2	170.5	170.3	-98.3	0	0	0	111.4	H534 L545 V546 S552 V553 V619 V636 F639 I640	H534-F549 HydrophobicContact CB-CD2 4.03Å; H534-F549 HydrophobicContact CB-CE2 4.07Å; H534-F549 AromaticContact CD2-CD2 3.8Å; H534-F549 AromaticContact CE1-CD2 3.88Å; H534-F549 AromaticContact CG-CD2 3.58Å; H534-F549 AromaticContact ND1-CD2 3.65Å; H534-F549 AromaticContact NE2-CD2 3.97Å; L545-F549 PolarHBondContact O-N 3.41Å; V546-F549 WeakPolarHBondContact O-CB 3.35Å; V546-F549 PolarHBondContact O-N 2.81Å; F549-S552 PolarHBondContact O-N 3.32Å; F549-V553 HydrophobicContact CD2-CG2 4.07Å; F549-V553 HydrophobicContact CE2-CG2 3.81Å; F549-V553 HydrophobicContact CZ-CG2 4.08Å; F549-V553 WeakPolarHBondContact O-CB 3.45Å; F549-V553 WeakPolarHBondContact O-CG2 3.37Å; F549-V553 PolarHBondContact O-N 2.92Å; F549-V619 HydrophobicContact CE2-CG1 4.18Å; F549-V619 HydrophobicContact CE2-CG2 3.84Å; F549-V619 HydrophobicContact CZ-CG2 4.21Å; F549-V636 HydrophobicContact CB-CG2 4.49Å; F549-V636 HydrophobicContact CD2-CG1 4.03Å; F549-V636 HydrophobicContact CE2-CG1 4.15Å; F549-V636 HydrophobicContact CG-CG1 4.29Å; F549-V636 HydrophobicContact CZ-CG1 4.5Å; F549-F639 HydrophobicContact CD1-CD1 4.14Å; F549-F639 HydrophobicContact CD1-CE1 4.06Å; F549-F639 HydrophobicContact CE1-CD1 4.02Å; F549-F639 AromaticContact CE1-CE1 3.88Å; F549-F639 HydrophobicContact CE1-CE1 3.88Å; F549-I640 HydrophobicContact CZ-CD1 4.39Å; F549-I640 HydrophobicContact CZ-CG1 4.44Å
550	V	97.9	Very high	95.6	Very high	0 Å²	0	16.7 Å²	16.7	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-60.1	-49.5	179.1	170	0	0	0	0	111.4	V546 P547 S552 A554 C585 P589 A592 F593 F639	V546-V550 HydrophobicContact CG1-CG2 4.34Å; V546-V550 WeakPolarHBondContact O-CG2 3.43Å; V546-V550 PolarHBondContact O-N 2.94Å; P547-V550 PolarHBondContact O-N 3.46Å; V550-S552 PolarHBondContact O-N 2.59Å; V550-A554 WeakPolarHBondContact O-CB 3.47Å; V550-A554 PolarHBondContact O-N 2.93Å; V550-A554 VanDerWaalsContact O-N 3.09Å; V550-C585 HydrophobicContact CG1-CB 4.4Å; V550-P589 HydrophobicContact CG2-CB 4.01Å; V550-A592 HydrophobicContact CG1-CB 4.08Å; V550-F593 HydrophobicContact CB-CD2 4.33Å; V550-F593 HydrophobicContact CG1-CB 3.92Å; V550-F593 HydrophobicContact CG1-CD2 4.07Å; V550-F593 HydrophobicContact CG2-CB 4.03Å; V550-F593 HydrophobicContact CG2-CD2 4.01Å; V550-F593 HydrophobicContact CG2-CG 4.44Å; V550-F639 HydrophobicContact CG2-CE1 3.87Å; V550-F639 HydrophobicContact CG2-CE2 4.32Å; V550-F639 HydrophobicContact CG2-CZ 3.56Å
551	H	96.9	Very high	95.7	Very high	10 Å²	10	20 Å²	20	5%	0.046	10%	0.099	C	C	.	.	H	α-helix	trans	-62.5	-43.9	178.5	-173	82.7	0	0	0	112	L410 K411 P547 A555 L580 L582	L410-H551 VanDerWaalsContact CD2-CE1 3.49Å; L410-H551 WeakPolarHBondContact CD2-CE1 3.39Å; K411-H551 PolarHBondContact N-NE2 3.35Å; K411-H551 VanDerWaalsContact N-NE2 3.16Å; K411-H551 PolarHBondContact O-CD2 3.18Å; K411-H551 VanDerWaalsContact O-CD2 3.26Å; K411-H551 PolarHBondContact O-NE2 3.19Å; P547-H551 WeakPolarHBondContact O-CB 3.48Å; P547-H551 PolarHBondContact O-N 3.31Å; H551-A555 VanDerWaalsContact O-CB 3.29Å; H551-A555 WeakPolarHBondContact O-CB 3.4Å; H551-A555 PolarHBondContact O-N 3.36Å; H551-L580 PolarHBondContact ND1-O 3.02Å; H551-L582 HydrophobicContact CB-CD1 4.3Å
552	S	97.1	Very high	95.7	Very high	1 Å²	1	20.8 Å²	20.8	1%	0.007	10%	0.102	C	C	.	.	H	α-helix	trans	-68	-45.9	-176.9	-172	0	0	0	0	112.2	L413 E548 F549 V550 A555 L556	L413-S552 PolarHBondContact N-OG 2.73Å; E548-S552 WeakPolarHBondContact O-CB 3.3Å; E548-S552 PolarHBondContact O-N 3.42Å; F549-S552 PolarHBondContact O-N 3.32Å; V550-S552 PolarHBondContact O-N 2.59Å; S552-A555 PolarHBondContact O-N 2.75Å; S552-L556 WeakPolarHBondContact O-CG 3.35Å; S552-L556 PolarHBondContact O-N 3.28Å
553	V	98	Very high	95.9	Very high	0 Å²	0	18 Å²	18	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-62.3	-45.1	176.6	171.3	0	0	0	0	110.5	A532 F549 A555 L556 L557 F593 I617	A532-V553 HydrophobicContact CB-CG1 4.1Å; F549-V553 HydrophobicContact CD2-CG2 4.07Å; F549-V553 HydrophobicContact CE2-CG2 3.81Å; F549-V553 HydrophobicContact CZ-CG2 4.08Å; F549-V553 WeakPolarHBondContact O-CB 3.45Å; F549-V553 WeakPolarHBondContact O-CG2 3.37Å; F549-V553 PolarHBondContact O-N 2.92Å; V553-A555 VanDerWaalsContact C-N 3.31Å; V553-A555 PolarHBondContact O-N 2.96Å; V553-L556 PolarHBondContact O-N 3.48Å; V553-L557 HydrophobicContact CG1-CD1 3.83Å; V553-L557 HydrophobicContact CG1-CG 4.3Å; V553-L557 VanDerWaalsContact O-CG 3.28Å; V553-L557 WeakPolarHBondContact O-CG 3.35Å; V553-L557 PolarHBondContact O-N 3.32Å; V553-F593 HydrophobicContact CB-CE2 4.32Å; V553-F593 HydrophobicContact CG1-CE2 3.87Å; V553-F593 HydrophobicContact CG1-CZ 4.36Å; V553-I617 HydrophobicContact CG1-CD1 4.06Å; V553-I617 HydrophobicContact CG1-CG2 4.46Å
554	A	97.6	Very high	95.9	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-60.3	-40.3	175.8	0	0	0	0	0	112.6	L410 V550 L557 A558 L580 V597	L410-A554 HydrophobicContact CD1-CB 4.42Å; V550-A554 WeakPolarHBondContact O-CB 3.47Å; V550-A554 PolarHBondContact O-N 2.93Å; V550-A554 VanDerWaalsContact O-N 3.09Å; A554-L557 PolarHBondContact O-N 3.21Å; A554-A558 WeakPolarHBondContact O-CB 3.34Å; A554-A558 PolarHBondContact O-N 3.07Å; A554-L580 HydrophobicContact CB-CD1 4.06Å; A554-L580 HydrophobicContact CB-CD2 3.75Å; A554-L580 HydrophobicContact CB-CG 4.4Å; A554-V597 HydrophobicContact CB-CG2 3.8Å
555	A	96.4	Very high	96	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-67.7	-30.9	176.6	0	0	0	0	0	113.6	L410 P412 H551 S552 V553 R559	L410-A555 HydrophobicContact CB-CB 3.72Å; P412-A555 HydrophobicContact CB-CB 4.02Å; P412-A555 HydrophobicContact CG-CB 4.45Å; H551-A555 VanDerWaalsContact O-CB 3.29Å; H551-A555 WeakPolarHBondContact O-CB 3.4Å; H551-A555 PolarHBondContact O-N 3.36Å; S552-A555 PolarHBondContact O-N 2.75Å; V553-A555 VanDerWaalsContact C-N 3.31Å; V553-A555 PolarHBondContact O-N 2.96Å; A555-R559 VanDerWaalsContact O-CD 3.28Å; A555-R559 WeakPolarHBondContact O-CD 3.34Å; A555-R559 VanDerWaalsContact O-CG 3.22Å; A555-R559 WeakPolarHBondContact O-CG 3.47Å
556	L	96.8	Very high	96.1	Very high	4 Å²	4	18.6 Å²	18.6	2%	0.021	10%	0.101	C	C	.	.	H	α-helix	trans	-76.3	-42.2	173.8	-70.6	174.4	0	0	0	112	P412 H474 A532 Y533 S552 V553 A558 R559 A560	P412-L556 HydrophobicContact CB-CD2 3.67Å; P412-L556 HydrophobicContact CB-CG 3.76Å; P412-L556 HydrophobicContact CG-CD2 4.01Å; H474-L556 PolarHBondContact CE1-O 3.09Å; A532-L556 HydrophobicContact CB-CB 3.82Å; A532-L556 HydrophobicContact CB-CD1 4.41Å; Y533-L556 HydrophobicContact CD1-CD1 3.7Å; Y533-L556 HydrophobicContact CD1-CD2 4.46Å; Y533-L556 HydrophobicContact CE1-CD1 3.75Å; Y533-L556 HydrophobicContact CE1-CD2 3.81Å; Y533-L556 HydrophobicContact CE1-CG 4.44Å; Y533-L556 HydrophobicContact CG-CD1 4.17Å; Y533-L556 WeakPolarHBondContact O-CD1 3.47Å; S552-L556 WeakPolarHBondContact O-CG 3.35Å; S552-L556 PolarHBondContact O-N 3.28Å; V553-L556 PolarHBondContact O-N 3.48Å; L556-A558 VanDerWaalsContact C-N 3.26Å; L556-A558 PolarHBondContact O-N 3.25Å; L556-R559 CarbonylContact O-C 3.52Å; L556-R559 WeakPolarHBondContact O-CA 3.26Å; L556-R559 WeakPolarHBondContact O-CB 3.4Å; L556-R559 PolarHBondContact O-N 3.47Å; L556-A560 PolarHBondContact O-N 3.05Å
557	L	96.8	Very high	96	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-59.9	-38.8	174.6	-66.7	168.2	0	0	0	111.2	V531 A532 V553 A554 R559 A560 L563 Y566 V597 L601 I617	V531-L557 HydrophobicContact CB-CD2 3.96Å; V531-L557 HydrophobicContact CG2-CD2 3.51Å; A532-L557 HydrophobicContact CB-CD2 3.85Å; A532-L557 HydrophobicContact CB-CG 3.94Å; V553-L557 HydrophobicContact CG1-CD1 3.83Å; V553-L557 HydrophobicContact CG1-CG 4.3Å; V553-L557 VanDerWaalsContact O-CG 3.28Å; V553-L557 WeakPolarHBondContact O-CG 3.35Å; V553-L557 PolarHBondContact O-N 3.32Å; A554-L557 PolarHBondContact O-N 3.21Å; L557-R559 PolarHBondContact O-N 3.02Å; L557-A560 PolarHBondContact O-N 3.37Å; L557-L563 HydrophobicContact CB-CD1 4.08Å; L557-L563 HydrophobicContact CD2-CD1 3.52Å; L557-L563 HydrophobicContact CG-CD1 4.39Å; L557-Y566 HydrophobicContact CB-CD1 4.2Å; L557-Y566 HydrophobicContact CB-CE1 3.8Å; L557-V597 HydrophobicContact CD1-CG1 3.35Å; L557-L601 HydrophobicContact CD1-CD1 4.31Å; L557-I617 HydrophobicContact CD1-CD1 4.4Å; L557-I617 HydrophobicContact CD2-CD1 4.38Å
558	A	95.7	Very high	96	Very high	5 Å²	5	26.8 Å²	26.8	4%	0.041	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-8.4	173.3	0	0	0	0	0	114.5	A554 L556 Y566 R567 L570	A554-A558 WeakPolarHBondContact O-CB 3.34Å; A554-A558 PolarHBondContact O-N 3.07Å; L556-A558 VanDerWaalsContact C-N 3.26Å; L556-A558 PolarHBondContact O-N 3.25Å; A558-Y566 HydrophobicContact CB-CD1 4.45Å; A558-Y566 HydrophobicContact CB-CE1 4.17Å; A558-R567 WeakPolarHBondContact O-CB 3.43Å; A558-R567 WeakPolarHBondContact O-CD 3.01Å; A558-R567 VanDerWaalsContact O-CG 3.23Å; A558-R567 WeakPolarHBondContact O-CG 3.49Å; A558-L570 HydrophobicContact CB-CD1 3.78Å
559	R	94.2	Very high	96	Very high	139 Å²	139	27.9 Å²	27.9	53%	0.525	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.9	-17	176.8	-70.9	169.8	-175.5	-140.6	-3.3	113.3	P412 A555 L556 L557 P561	P412-R559 VanDerWaalsContact CD-NH2 3.34Å; A555-R559 VanDerWaalsContact O-CD 3.28Å; A555-R559 WeakPolarHBondContact O-CD 3.34Å; A555-R559 VanDerWaalsContact O-CG 3.22Å; A555-R559 WeakPolarHBondContact O-CG 3.47Å; L556-R559 CarbonylContact O-C 3.52Å; L556-R559 WeakPolarHBondContact O-CA 3.26Å; L556-R559 WeakPolarHBondContact O-CB 3.4Å; L556-R559 PolarHBondContact O-N 3.47Å; L557-R559 PolarHBondContact O-N 3.02Å; R559-P561 WeakPolarHBondContact O-CD 3.47Å
560	A	95	Very high	95.9	Very high	2 Å²	2	27.7 Å²	27.7	2%	0.017	14%	0.138	C	C	.	.			trans	-66.5	120.8	176.5	0	0	0	0	0	110.2	V531 L556 L557 Q562 L563	V531-A560 HydrophobicContact CB-CB 4.04Å; V531-A560 HydrophobicContact CG1-CB 4.26Å; L556-A560 PolarHBondContact O-N 3.05Å; L557-A560 PolarHBondContact O-N 3.37Å; A560-Q562 PolarHBondContact O-N 2.86Å; A560-L563 HydrophobicContact CB-CB 4.34Å; A560-L563 HydrophobicContact CB-CD1 4.37Å; A560-L563 HydrophobicContact CB-CG 4.33Å; A560-L563 CarbonylContact O-C 3.41Å; A560-L563 PolarHBondContact O-N 3.28Å
561	P	93.8	Very high	95.7	Very high	90 Å²	90	28.9 Å²	28.9	58%	0.584	15%	0.148	S	C	*	.	G	3₁₀ helix	trans	-62.7	-28.1	-179.3	25	-34.1	0	0	0	112.9	C473 R559 L563 A564	C473-P561 HydrophobicContact CB-CG 3.86Å; R559-P561 WeakPolarHBondContact O-CD 3.47Å; P561-L563 PolarHBondContact O-N 3.13Å; P561-A564 PolarHBondContact O-N 3.09Å
562	Q	93.3	Very high	95.5	Very high	42 Å²	42	34.2 Å²	34.2	20%	0.196	17%	0.173	C	C	.	.	G	3₁₀ helix	trans	-61.5	-22.6	172.7	-51.5	91.7	-40.3	0	0	112.5	A528 V531 A560 Y615	A528-Q562 PolarHBondContact O-NE2 3.44Å; V531-Q562 HydrophobicContact CG1-CB 4.37Å; A560-Q562 PolarHBondContact O-N 2.86Å; Q562-Y615 HydrophobicContact CB-CE1 4.07Å; Q562-Y615 HydrophobicContact CG-CE1 4.32Å
563	L	95	Very high	95.3	Very high	2 Å²	2	38.8 Å²	38.8	1%	0.01	19%	0.194	C	C	.	.	G	3₁₀ helix	trans	-113.7	26.6	-177.7	-57.5	-179	0	0	0	112.3	V531 L557 A560 P561 P565 Y566 R567 L601 L610 Y615	V531-L563 HydrophobicContact CB-CD1 3.93Å; V531-L563 HydrophobicContact CG1-CD1 4.14Å; V531-L563 HydrophobicContact CG1-CG 4.24Å; V531-L563 HydrophobicContact CG2-CD1 4.22Å; L557-L563 HydrophobicContact CB-CD1 4.08Å; L557-L563 HydrophobicContact CD2-CD1 3.52Å; L557-L563 HydrophobicContact CG-CD1 4.39Å; A560-L563 HydrophobicContact CB-CB 4.34Å; A560-L563 HydrophobicContact CB-CD1 4.37Å; A560-L563 HydrophobicContact CB-CG 4.33Å; A560-L563 CarbonylContact O-C 3.41Å; A560-L563 PolarHBondContact O-N 3.28Å; P561-L563 PolarHBondContact O-N 3.13Å; L563-P565 VanDerWaalsContact C-N 3.28Å; L563-Y566 WeakPolarHBondContact O-CB 3.41Å; L563-Y566 PolarHBondContact O-N 2.92Å; L563-R567 PolarHBondContact O-N 3.46Å; L563-L601 HydrophobicContact CD1-CD2 4.35Å; L563-L601 HydrophobicContact CD2-CD2 4.21Å; L563-L610 HydrophobicContact CD2-CD1 4.2Å; L563-L610 HydrophobicContact CD2-CD2 3.92Å; L563-Y615 HydrophobicContact CD2-CD2 3.95Å; L563-Y615 HydrophobicContact CD2-CE2 3.88Å
564	A	94.9	Very high	95	Very high	40 Å²	40	42.5 Å²	42.5	33%	0.331	22%	0.218	S	C	.	.	H	α-helix	trans	-49.8	-37.9	175.8	0	0	0	0	0	114.5	P561 Y566 R567 E568	P561-A564 PolarHBondContact O-N 3.09Å; A564-Y566 VanDerWaalsContact C-N 3.28Å; A564-Y566 PolarHBondContact O-N 3.4Å; A564-R567 WeakPolarHBondContact O-CA 3.43Å; A564-R567 VanDerWaalsContact O-CB 3.31Å; A564-R567 WeakPolarHBondContact O-CB 3.31Å; A564-R567 PolarHBondContact O-N 3.2Å; A564-R567 VanDerWaalsContact O-N 3.11Å; A564-E568 WeakPolarHBondContact O-CG 3.45Å; A564-E568 PolarHBondContact O-N 3.05Å
565	P	96.4	Very high	94.7	Very high	21 Å²	21	48.5 Å²	48.5	14%	0.136	25%	0.246	C	C	.	.	H	α-helix	trans	-63.5	-28.1	174.6	-25.7	36.9	0	0	0	114.8	L563 L569 L604 R609 L610	L563-P565 VanDerWaalsContact C-N 3.28Å; P565-L569 WeakPolarHBondContact O-CB 3.24Å; P565-L569 PolarHBondContact O-N 3.22Å; P565-L604 HydrophobicContact CB-CD1 4.45Å; P565-L604 HydrophobicContact CB-CD2 4.23Å; P565-R609 HydrophobicContact CB-CB 4.22Å; P565-R609 HydrophobicContact CG-CB 4.45Å; P565-R609 WeakPolarHBondContact CG-O 3.43Å; P565-L610 HydrophobicContact CB-CD2 4.27Å; P565-L610 HydrophobicContact CG-CD2 4.06Å
566	Y	96.6	Very high	94.5	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-74.9	-37.6	172.7	170.8	-106.4	0	0	0	111.1	L557 A558 L563 A564 L569 L570 G596 P600 L601 L604	L557-Y566 HydrophobicContact CB-CD1 4.2Å; L557-Y566 HydrophobicContact CB-CE1 3.8Å; A558-Y566 HydrophobicContact CB-CD1 4.45Å; A558-Y566 HydrophobicContact CB-CE1 4.17Å; L563-Y566 WeakPolarHBondContact O-CB 3.41Å; L563-Y566 PolarHBondContact O-N 2.92Å; A564-Y566 VanDerWaalsContact C-N 3.28Å; A564-Y566 PolarHBondContact O-N 3.4Å; Y566-L569 PolarHBondContact O-N 3.04Å; Y566-L570 HydrophobicContact CD1-CD1 4.29Å; Y566-L570 HydrophobicContact CE1-CD1 3.71Å; Y566-L570 HydrophobicContact CE1-CG 4.46Å; Y566-L570 HydrophobicContact CE2-CD1 4.27Å; Y566-L570 HydrophobicContact CE2-CD2 4.36Å; Y566-L570 HydrophobicContact CE2-CG 4.23Å; Y566-L570 WeakPolarHBondContact O-CG 3.24Å; Y566-L570 PolarHBondContact O-N 3.27Å; Y566-G596 PolarHBondContact OH-O 3.2Å; Y566-P600 HydrophobicContact CD2-CB 4.25Å; Y566-P600 HydrophobicContact CE2-CB 4.2Å; Y566-L601 HydrophobicContact CD1-CD2 4.45Å; Y566-L601 HydrophobicContact CD2-CD2 3.94Å; Y566-L601 HydrophobicContact CD2-CG 4.13Å; Y566-L601 HydrophobicContact CE2-CG 4.43Å; Y566-L601 HydrophobicContact CG-CD2 3.82Å; Y566-L601 HydrophobicContact CG-CG 4.45Å; Y566-L604 HydrophobicContact CD2-CD1 4.45Å
567	R	95.6	Very high	94.3	Very high	98 Å²	98	50.8 Å²	50.8	37%	0.37	26%	0.257	S	S	.	.	H	α-helix	trans	-59.1	-46.2	169.3	-171.8	-171.5	169.7	-158.7	-9.5	111.3	I408 A558 L563 A564 L570 A571	I408-R567 HydrophobicContact CD1-CB 4.42Å; I408-R567 HydrophobicContact CD1-CG 3.35Å; I408-R567 WeakPolarHBondContact CD1-O 3.28Å; A558-R567 WeakPolarHBondContact O-CB 3.43Å; A558-R567 WeakPolarHBondContact O-CD 3.01Å; A558-R567 VanDerWaalsContact O-CG 3.23Å; A558-R567 WeakPolarHBondContact O-CG 3.49Å; L563-R567 PolarHBondContact O-N 3.46Å; A564-R567 WeakPolarHBondContact O-CA 3.43Å; A564-R567 VanDerWaalsContact O-CB 3.31Å; A564-R567 WeakPolarHBondContact O-CB 3.31Å; A564-R567 PolarHBondContact O-N 3.2Å; A564-R567 VanDerWaalsContact O-N 3.11Å; R567-L570 PolarHBondContact O-N 3.16Å; R567-A571 WeakPolarHBondContact O-CB 3.42Å; R567-A571 PolarHBondContact O-N 2.97Å
568	E	95.2	Very high	94.1	Very high	94 Å²	94	55.3 Å²	55.3	44%	0.439	28%	0.281	S	S	.	.	H	α-helix	trans	-59.3	-47.3	175.9	-71.7	167.1	-176.1	0	0	111.9	A564 L570 A571 Q572 R609	A564-E568 WeakPolarHBondContact O-CG 3.45Å; A564-E568 PolarHBondContact O-N 3.05Å; E568-L570 PolarHBondContact O-N 2.85Å; E568-A571 CarbonylContact O-C 3.31Å; E568-A571 WeakPolarHBondContact O-CA 3.5Å; E568-A571 WeakPolarHBondContact O-CB 3.47Å; E568-A571 PolarHBondContact O-N 2.99Å; E568-A571 VanDerWaalsContact O-N 3.1Å; E568-Q572 VanDerWaalsContact O-CG 3.29Å; E568-Q572 WeakPolarHBondContact O-CG 3.33Å; E568-Q572 PolarHBondContact O-N 3.33Å; E568-R609 IonicContact OE2-NH2 2.9Å; E568-R609 PolarHBondContact OE2-NH2 2.82Å
569	L	95.3	Very high	94	Very high	33 Å²	33	56.7 Å²	56.7	17%	0.173	29%	0.287	C	S	.	.	H	α-helix	trans	-60.6	-45.8	179.1	-179.4	59.6	0	0	0	111.8	P565 Y566 A571 Q572 E573 L576 P600 L604	P565-L569 WeakPolarHBondContact O-CB 3.24Å; P565-L569 PolarHBondContact O-N 3.22Å; Y566-L569 PolarHBondContact O-N 3.04Å; L569-A571 VanDerWaalsContact C-N 3.28Å; L569-A571 PolarHBondContact O-N 3.45Å; L569-Q572 PolarHBondContact O-N 3.32Å; L569-Q572 VanDerWaalsContact O-N 3.16Å; L569-E573 HydrophobicContact CD1-CG 4Å; L569-E573 WeakPolarHBondContact O-CB 3.41Å; L569-E573 PolarHBondContact O-N 3.08Å; L569-L576 HydrophobicContact CD2-CD1 4.34Å; L569-L576 HydrophobicContact CG-CD1 4.04Å; L569-P600 HydrophobicContact CD2-CB 3.89Å; L569-L604 HydrophobicContact CD2-CD1 3.98Å; L569-L604 HydrophobicContact CD2-CD2 4.34Å; L569-L604 HydrophobicContact CD2-CG 4.16Å
570	L	94.9	Very high	94	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-61.6	-35.4	173.5	-69.1	179.6	0	0	0	112.7	I408 L410 A558 Y566 R567 E568 Q572 L576 Q577 L580	I408-L570 HydrophobicContact CD1-CB 4.32Å; L410-L570 HydrophobicContact CD1-CD1 3.93Å; A558-L570 HydrophobicContact CB-CD1 3.78Å; Y566-L570 HydrophobicContact CD1-CD1 4.29Å; Y566-L570 HydrophobicContact CE1-CD1 3.71Å; Y566-L570 HydrophobicContact CE1-CG 4.46Å; Y566-L570 HydrophobicContact CE2-CD1 4.27Å; Y566-L570 HydrophobicContact CE2-CD2 4.36Å; Y566-L570 HydrophobicContact CE2-CG 4.23Å; Y566-L570 WeakPolarHBondContact O-CG 3.24Å; Y566-L570 PolarHBondContact O-N 3.27Å; R567-L570 PolarHBondContact O-N 3.16Å; E568-L570 PolarHBondContact O-N 2.85Å; L570-Q572 VanDerWaalsContact C-N 3.3Å; L570-L576 HydrophobicContact CD2-CB 3.61Å; L570-L576 HydrophobicContact CD2-CD1 4.33Å; L570-Q577 HydrophobicContact CB-CG 4.28Å; L570-Q577 WeakPolarHBondContact O-CG 3.16Å; L570-Q577 PolarHBondContact O-NE2 3.08Å; L570-L580 HydrophobicContact CD1-CD1 4.33Å; L570-L580 HydrophobicContact CD2-CD1 3.74Å
571	A	93.4	Very high	94	Very high	25 Å²	25	51.7 Å²	51.7	21%	0.207	27%	0.273	C	S	.	.	H	α-helix	trans	-74.4	-19	177.8	0	0	0	0	0	113.6	T406 I408 R567 E568 L569	T406-A571 PolarHBondContact OG1-O 2.8Å; I408-A571 HydrophobicContact CD1-CB 4.21Å; I408-A571 HydrophobicContact CG1-CB 4.19Å; R567-A571 WeakPolarHBondContact O-CB 3.42Å; R567-A571 PolarHBondContact O-N 2.97Å; E568-A571 CarbonylContact O-C 3.31Å; E568-A571 WeakPolarHBondContact O-CA 3.5Å; E568-A571 WeakPolarHBondContact O-CB 3.47Å; E568-A571 PolarHBondContact O-N 2.99Å; E568-A571 VanDerWaalsContact O-N 3.1Å; L569-A571 VanDerWaalsContact C-N 3.28Å; L569-A571 PolarHBondContact O-N 3.45Å
572	Q	93.8	Very high	93.9	Very high	123 Å²	123	48 Å²	48	58%	0.575	25%	0.249	S	C	*	.	H	α-helix	trans	-92.5	-31.4	174.8	-71.5	167.5	4.1	0	0	112.6	E568 L569 L570 P574	E568-Q572 VanDerWaalsContact O-CG 3.29Å; E568-Q572 WeakPolarHBondContact O-CG 3.33Å; E568-Q572 PolarHBondContact O-N 3.33Å; L569-Q572 PolarHBondContact O-N 3.32Å; L569-Q572 VanDerWaalsContact O-N 3.16Å; L570-Q572 VanDerWaalsContact C-N 3.3Å; Q572-P574 VanDerWaalsContact O-CD 3.26Å; Q572-P574 WeakPolarHBondContact O-CD 3.2Å
573	E	93.4	Very high	93.8	Very high	96 Å²	96	48.6 Å²	48.6	45%	0.449	25%	0.249	S	C	.	.			trans	-114.9	88.8	-173.6	-71.8	-62.6	158.7	0	0	113.1	L569 H575 L576	L569-E573 HydrophobicContact CD1-CG 4Å; L569-E573 WeakPolarHBondContact O-CB 3.41Å; L569-E573 PolarHBondContact O-N 3.08Å; E573-H575 PolarHBondContact O-N 3.14Å; E573-H575 VanDerWaalsContact O-N 3.1Å; E573-L576 HydrophobicContact CB-CB 4.42Å; E573-L576 HydrophobicContact CB-CD1 3.93Å; E573-L576 HydrophobicContact CB-CG 4.03Å; E573-L576 HydrophobicContact CG-CD1 4.47Å; E573-L576 PolarHBondContact O-N 3.33Å; E573-L576 VanDerWaalsContact O-N 3.08Å
574	P	90.1	Very high	93.7	Very high	79 Å²	79	50.1 Å²	50.1	51%	0.513	26%	0.26	S	S	.	.	H	α-helix	trans	-57.4	-25.1	177	-26.3	34.5	0	0	0	114.3	Q572 Q577 N578	Q572-P574 VanDerWaalsContact O-CD 3.26Å; Q572-P574 WeakPolarHBondContact O-CD 3.2Å; P574-Q577 PolarHBondContact O-N 2.77Å; P574-N578 VanDerWaalsContact O-CG 3.32Å; P574-N578 PolarHBondContact O-N 2.84Å; P574-N578 PolarHBondContact O-ND2 2.93Å
575	H	92.5	Very high	93.7	Very high	126 Å²	126	48.2 Å²	48.2	58%	0.583	24%	0.244	S	C	*	.	H	α-helix	trans	-63.3	-40.4	176.2	-173.8	81.7	0	0	0	112	E573 N578 Q579	E573-H575 PolarHBondContact O-N 3.14Å; E573-H575 VanDerWaalsContact O-N 3.1Å; H575-N578 PolarHBondContact O-N 3.18Å; H575-Q579 WeakPolarHBondContact O-CB 3.25Å; H575-Q579 PolarHBondContact O-N 3.05Å
576	L	92.8	Very high	93.5	Very high	26 Å²	26	47.6 Å²	47.6	14%	0.136	24%	0.24	C	C	.	.	H	α-helix	trans	-66.7	-39.2	176.5	-63.1	178.5	0	0	0	111.4	L569 L570 E573 N578 Q579 L580 P600	L569-L576 HydrophobicContact CD2-CD1 4.34Å; L569-L576 HydrophobicContact CG-CD1 4.04Å; L570-L576 HydrophobicContact CD2-CB 3.61Å; L570-L576 HydrophobicContact CD2-CD1 4.33Å; E573-L576 HydrophobicContact CB-CB 4.42Å; E573-L576 HydrophobicContact CB-CD1 3.93Å; E573-L576 HydrophobicContact CB-CG 4.03Å; E573-L576 HydrophobicContact CG-CD1 4.47Å; E573-L576 PolarHBondContact O-N 3.33Å; E573-L576 VanDerWaalsContact O-N 3.08Å; L576-N578 PolarHBondContact O-N 3.17Å; L576-Q579 PolarHBondContact O-N 3.06Å; L576-L580 WeakPolarHBondContact O-CB 3.25Å; L576-L580 WeakPolarHBondContact O-CG 3.45Å; L576-L580 PolarHBondContact O-N 2.8Å; L576-P600 HydrophobicContact CD1-CG 4.24Å; L576-P600 HydrophobicContact CD2-CG 4.32Å
577	Q	92.4	Very high	93.3	Very high	25 Å²	25	50.8 Å²	50.8	12%	0.117	26%	0.255	C	S	.	.	H	α-helix	trans	-63.7	-39	173.2	-69.4	-166.5	62.6	0	0	112.6	L570 P574 L580 S581	L570-Q577 HydrophobicContact CB-CG 4.28Å; L570-Q577 WeakPolarHBondContact O-CG 3.16Å; L570-Q577 PolarHBondContact O-NE2 3.08Å; P574-Q577 PolarHBondContact O-N 2.77Å; Q577-L580 CarbonylContact O-C 3.56Å; Q577-L580 PolarHBondContact O-N 3.13Å; Q577-S581 PolarHBondContact O-N 2.83Å
578	N	91.5	Very high	93.2	Very high	95 Å²	95	49.7 Å²	49.7	51%	0.508	26%	0.256	S	S	.	.	H	α-helix	trans	-65.4	-43.2	174.9	-73.5	-40.9	0	0	0	111.5	P574 H575 L576 L580 S581 S584	P574-N578 VanDerWaalsContact O-CG 3.32Å; P574-N578 PolarHBondContact O-N 2.84Å; P574-N578 PolarHBondContact O-ND2 2.93Å; H575-N578 PolarHBondContact O-N 3.18Å; L576-N578 PolarHBondContact O-N 3.17Å; N578-L580 VanDerWaalsContact C-N 3.26Å; N578-L580 PolarHBondContact O-N 3.39Å; N578-S581 WeakPolarHBondContact O-CB 3.48Å; N578-S581 PolarHBondContact O-N 2.8Å; N578-S581 PolarHBondContact O-OG 2.88Å; N578-S584 WeakPolarHBondContact O-CB 3.4Å; N578-S584 PolarHBondContact O-OG 2.9Å; N578-S584 VanDerWaalsContact O-OG 3.05Å
579	Q	93.9	Very high	93.2	Very high	35 Å²	35	46.4 Å²	46.4	16%	0.164	24%	0.243	C	C	.	.	H	α-helix	trans	-64.5	-29.2	176.4	-179.2	162.1	75.3	0	0	113.4	H575 L576 S584 A592	H575-Q579 WeakPolarHBondContact O-CB 3.25Å; H575-Q579 PolarHBondContact O-N 3.05Å; L576-Q579 PolarHBondContact O-N 3.06Å; Q579-S584 VanDerWaalsContact O-CB 3.24Å; Q579-S584 WeakPolarHBondContact O-CB 3.42Å; Q579-A592 WeakPolarHBondContact O-CB 3.47Å
580	L	95.3	Very high	93.3	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.8	3.6	172.2	-67.3	171.4	0	0	0	113.6	L410 H551 A554 L570 L576 Q577 N578 A592 V597	L410-L580 HydrophobicContact CD1-CB 4.22Å; L410-L580 HydrophobicContact CD1-CD1 3.94Å; L410-L580 HydrophobicContact CD2-CB 3.81Å; H551-L580 PolarHBondContact ND1-O 3.02Å; A554-L580 HydrophobicContact CB-CD1 4.06Å; A554-L580 HydrophobicContact CB-CD2 3.75Å; A554-L580 HydrophobicContact CB-CG 4.4Å; L570-L580 HydrophobicContact CD1-CD1 4.33Å; L570-L580 HydrophobicContact CD2-CD1 3.74Å; L576-L580 WeakPolarHBondContact O-CB 3.25Å; L576-L580 WeakPolarHBondContact O-CG 3.45Å; L576-L580 PolarHBondContact O-N 2.8Å; Q577-L580 CarbonylContact O-C 3.56Å; Q577-L580 PolarHBondContact O-N 3.13Å; N578-L580 VanDerWaalsContact C-N 3.26Å; N578-L580 PolarHBondContact O-N 3.39Å; L580-A592 WeakPolarHBondContact CD2-O 3.44Å; L580-V597 HydrophobicContact CD2-CG2 3.79Å
581	S	94.1	Very high	93.3	Very high	35 Å²	35	48.4 Å²	48.4	25%	0.245	26%	0.256	C	S	.	.	S	Bend	trans	-64.4	147	175.3	74.4	0	0	0	0	110.4	Q577 N578 R583 S584 C585	Q577-S581 PolarHBondContact O-N 2.83Å; N578-S581 WeakPolarHBondContact O-CB 3.48Å; N578-S581 PolarHBondContact O-N 2.8Å; N578-S581 PolarHBondContact O-OG 2.88Å; S581-R583 PolarHBondContact O-N 3.33Å; S581-R583 VanDerWaalsContact O-N 3.07Å; S581-S584 PolarHBondContact O-N 3.3Å; S581-S584 PolarHBondContact OG-N 3.47Å; S581-S584 PolarHBondContact OG-OG 2.87Å; S581-C585 PolarHBondContact O-N 3.46Å; S581-C585 PolarHBondContact O-SG 3.34Å
582	L	91.6	Very high	93.5	Very high	14 Å²	14	47.4 Å²	47.4	7%	0.073	25%	0.247	C	C	.	.	H	α-helix	trans	-57.8	-28.1	179.5	-173.9	61.3	0	0	0	112.2	L365 P547 E548 H551 V586	L365-L582 HydrophobicContact CD1-CB 4.01Å; L365-L582 HydrophobicContact CD1-CD2 4.19Å; L365-L582 HydrophobicContact CD1-CG 3.83Å; P547-L582 HydrophobicContact CB-CD1 4.12Å; E548-L582 HydrophobicContact CG-CD1 4.08Å; H551-L582 HydrophobicContact CB-CD1 4.3Å; L582-V586 VanDerWaalsContact O-CG2 3.32Å; L582-V586 WeakPolarHBondContact O-CG2 3.28Å; L582-V586 PolarHBondContact O-N 3.07Å; L582-V586 VanDerWaalsContact O-N 3.09Å
583	R	91.3	Very high	93.7	Very high	53 Å²	53	41.7 Å²	41.7	20%	0.2	22%	0.221	C	C	.	.	H	α-helix	trans	-61.1	-56.5	171.3	-174.2	173.4	-177.4	107.9	-10.8	110.5	L365 S581 C585 V586 Q587 L935 E961	L365-R583 HydrophobicContact CD1-CB 4.16Å; L365-R583 PolarHBondContact O-NH1 3.22Å; S581-R583 PolarHBondContact O-N 3.33Å; S581-R583 VanDerWaalsContact O-N 3.07Å; R583-C585 VanDerWaalsContact C-N 3.33Å; R583-C585 PolarHBondContact O-N 3.16Å; R583-V586 WeakPolarHBondContact O-CB 3.45Å; R583-V586 PolarHBondContact O-N 3.32Å; R583-V586 VanDerWaalsContact O-N 3.07Å; R583-Q587 WeakPolarHBondContact O-CG 3.46Å; R583-Q587 PolarHBondContact O-N 2.9Å; R583-Q587 VanDerWaalsContact O-N 3.13Å; R583-L935 HydrophobicContact CB-CD2 4.5Å; R583-L935 HydrophobicContact CG-CD2 3.71Å; R583-E961 IonicContact NH2-OE2 3.76Å
584	S	92.3	Very high	93.9	Very high	34 Å²	34	41.1 Å²	41.1	24%	0.238	21%	0.214	C	C	.	.	H	α-helix	trans	-62.8	-36.4	179.2	-63.6	0	0	0	0	113.1	N578 Q579 S581 V586 Q587 D588	N578-S584 WeakPolarHBondContact O-CB 3.4Å; N578-S584 PolarHBondContact O-OG 2.9Å; N578-S584 VanDerWaalsContact O-OG 3.05Å; Q579-S584 VanDerWaalsContact O-CB 3.24Å; Q579-S584 WeakPolarHBondContact O-CB 3.42Å; S581-S584 PolarHBondContact O-N 3.3Å; S581-S584 PolarHBondContact OG-N 3.47Å; S581-S584 PolarHBondContact OG-OG 2.87Å; S584-V586 VanDerWaalsContact C-N 3.27Å; S584-V586 PolarHBondContact O-N 3.33Å; S584-Q587 PolarHBondContact O-N 2.87Å; S584-Q587 VanDerWaalsContact O-N 3.1Å; S584-D588 PolarHBondContact O-N 2.86Å
585	C	95.1	Very high	94.2	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-63.6	-29	173.4	-60.6	0	0	0	0	113.3	P547 V550 S581 R583 P589	P547-C585 HydrophobicContact CB-CB 3.94Å; P547-C585 WeakPolarHBondContact CB-O 3.49Å; P547-C585 WeakPolarHBondContact CG-O 3.49Å; P547-C585 WeakPolarHBondContact O-CB 3.45Å; V550-C585 HydrophobicContact CG1-CB 4.4Å; S581-C585 PolarHBondContact O-N 3.46Å; S581-C585 PolarHBondContact O-SG 3.34Å; R583-C585 VanDerWaalsContact C-N 3.33Å; R583-C585 PolarHBondContact O-N 3.16Å; C585-P589 WeakPolarHBondContact O-CB 3.4Å; C585-P589 WeakPolarHBondContact O-CD 3.49Å
586	V	93.3	Very high	94.4	Very high	8 Å²	8	35.5 Å²	35.5	5%	0.048	18%	0.18	C	C	.	.	H	α-helix	trans	-76.7	-30.8	172.7	167.7	0	0	0	0	111.5	L365 P547 L582 R583 S584 L935 Y939	L365-V586 HydrophobicContact CD2-CG2 4.17Å; P547-V586 HydrophobicContact CB-CB 4.38Å; P547-V586 HydrophobicContact CB-CG2 3.55Å; P547-V586 HydrophobicContact CG-CB 4.36Å; P547-V586 HydrophobicContact CG-CG2 3.75Å; L582-V586 VanDerWaalsContact O-CG2 3.32Å; L582-V586 WeakPolarHBondContact O-CG2 3.28Å; L582-V586 PolarHBondContact O-N 3.07Å; L582-V586 VanDerWaalsContact O-N 3.09Å; R583-V586 WeakPolarHBondContact O-CB 3.45Å; R583-V586 PolarHBondContact O-N 3.32Å; R583-V586 VanDerWaalsContact O-N 3.07Å; S584-V586 VanDerWaalsContact C-N 3.27Å; S584-V586 PolarHBondContact O-N 3.33Å; V586-L935 HydrophobicContact CB-CD2 4.2Å; V586-L935 HydrophobicContact CG1-CD2 3.91Å; V586-L935 HydrophobicContact CG1-CG 4.06Å; V586-Y939 HydrophobicContact CG1-CD2 4.39Å; V586-Y939 VanDerWaalsContact O-CB 3.25Å; V586-Y939 WeakPolarHBondContact O-CB 3.14Å
587	Q	91.9	Very high	94.7	Very high	68 Å²	68	34.2 Å²	34.2	32%	0.318	17%	0.174	S	C	.	.	H	α-helix	trans	-77.8	-45.4	-179.5	-61.9	-174.4	-83.3	0	0	113.3	R583 S584 Y939	R583-Q587 WeakPolarHBondContact O-CG 3.46Å; R583-Q587 PolarHBondContact O-N 2.9Å; R583-Q587 VanDerWaalsContact O-N 3.13Å; S584-Q587 PolarHBondContact O-N 2.87Å; S584-Q587 VanDerWaalsContact O-N 3.1Å; Q587-Y939 HydrophobicContact CB-CD1 4.47Å; Q587-Y939 HydrophobicContact CB-CE1 3.94Å; Q587-Y939 HydrophobicContact CB-CE2 4.25Å; Q587-Y939 HydrophobicContact CG-CD2 4.31Å; Q587-Y939 HydrophobicContact CG-CE1 4.26Å; Q587-Y939 HydrophobicContact CG-CE2 3.67Å; Q587-Y939 PolarHBondContact NE2-OH 2.96Å; Q587-Y939 WeakPolarHBondContact O-CD1 3.46Å; Q587-Y939 WeakPolarHBondContact O-CE1 3.5Å
588	D	93.2	Very high	94.9	Very high	74 Å²	74	33.4 Å²	33.4	40%	0.396	17%	0.17	S	C	.	.			trans	-152	93.5	173.5	-177.7	-10.5	0	0	0	110	S584 I590 A591 A592	S584-D588 PolarHBondContact O-N 2.86Å; D588-I590 PolarHBondContact O-N 3.02Å; D588-I590 WeakPolarHBondContact OD1-CA 3.43Å; D588-I590 WeakPolarHBondContact OD1-CB 3.32Å; D588-I590 PolarHBondContact OD1-N 3.18Å; D588-A591 HydrophobicContact CB-CB 4.2Å; D588-A591 VanDerWaalsContact CG-CB 3.44Å; D588-A591 PolarHBondContact OD1-N 3.04Å; D588-A591 WeakPolarHBondContact OD2-CB 3.48Å; D588-A592 WeakPolarHBondContact O-CB 3.28Å; D588-A592 PolarHBondContact O-N 2.97Å
589	P	95.8	Very high	95.1	Very high	26 Å²	26	32.8 Å²	32.8	17%	0.169	16%	0.164	C	C	.	.	H	α-helix	trans	-67.4	-24.6	178.6	25.5	-32.5	0	0	0	113	V546 V550 C585 F593 F639	V546-P589 HydrophobicContact CG1-CB 3.67Å; V546-P589 HydrophobicContact CG1-CG 3.93Å; V550-P589 HydrophobicContact CG2-CB 4.01Å; C585-P589 WeakPolarHBondContact O-CB 3.4Å; C585-P589 WeakPolarHBondContact O-CD 3.49Å; P589-F593 WeakPolarHBondContact O-CB 3.44Å; P589-F593 PolarHBondContact O-N 3.26Å; P589-F639 HydrophobicContact CB-CE2 3.91Å; P589-F639 HydrophobicContact CB-CZ 4.5Å; P589-F639 HydrophobicContact CG-CE2 4.33Å
590	I	96.1	Very high	95.3	Very high	57 Å²	57	31.6 Å²	31.6	29%	0.292	16%	0.159	S	C	.	.	H	α-helix	trans	-74.8	-48.2	-178.6	-63.7	176.5	0	0	0	109.3	D588 R594 F639 K642 I643	D588-I590 PolarHBondContact O-N 3.02Å; D588-I590 WeakPolarHBondContact OD1-CA 3.43Å; D588-I590 WeakPolarHBondContact OD1-CB 3.32Å; D588-I590 PolarHBondContact OD1-N 3.18Å; I590-R594 WeakPolarHBondContact O-CB 3.35Å; I590-R594 PolarHBondContact O-N 3.01Å; I590-F639 HydrophobicContact CB-CE2 4.43Å; I590-F639 HydrophobicContact CG1-CD2 4Å; I590-F639 HydrophobicContact CG1-CE2 3.65Å; I590-K642 HydrophobicContact CD1-CD 4.19Å; I590-I643 HydrophobicContact CG2-CD1 4.46Å
591	A	96.3	Very high	95.4	Very high	18 Å²	18	31.6 Å²	31.6	15%	0.149	16%	0.16	C	C	.	.	H	α-helix	trans	-67.2	-39.6	173.1	0	0	0	0	0	112.1	D588 F593 R594 K595	D588-A591 HydrophobicContact CB-CB 4.2Å; D588-A591 VanDerWaalsContact CG-CB 3.44Å; D588-A591 PolarHBondContact OD1-N 3.04Å; D588-A591 WeakPolarHBondContact OD2-CB 3.48Å; A591-F593 PolarHBondContact O-N 2.88Å; A591-R594 PolarHBondContact O-N 3.04Å; A591-K595 VanDerWaalsContact O-CB 3.3Å; A591-K595 WeakPolarHBondContact O-CB 3.46Å; A591-K595 PolarHBondContact O-N 3.18Å
592	A	97.3	Very high	95.4	Very high	3 Å²	3	32 Å²	32	3%	0.025	17%	0.165	C	C	.	.	H	α-helix	trans	-58.3	-48.9	177	0	0	0	0	0	111.8	V550 Q579 L580 D588 G596	V550-A592 HydrophobicContact CG1-CB 4.08Å; Q579-A592 WeakPolarHBondContact O-CB 3.47Å; L580-A592 WeakPolarHBondContact CD2-O 3.44Å; D588-A592 WeakPolarHBondContact O-CB 3.28Å; D588-A592 PolarHBondContact O-N 2.97Å; A592-G596 VanDerWaalsContact O-CA 3.22Å; A592-G596 WeakPolarHBondContact O-CA 3.44Å; A592-G596 PolarHBondContact O-N 3.25Å
593	F	97.9	Very high	95.6	Very high	3 Å²	3	34 Å²	34	1%	0.013	18%	0.18	C	C	.	.	H	α-helix	trans	-70.9	-40.4	177.3	-164.2	-86.3	0	0	0	112.4	V550 V553 P589 A591 V597 L598 F639 I643 F647	V550-F593 HydrophobicContact CB-CD2 4.33Å; V550-F593 HydrophobicContact CG1-CB 3.92Å; V550-F593 HydrophobicContact CG1-CD2 4.07Å; V550-F593 HydrophobicContact CG2-CB 4.03Å; V550-F593 HydrophobicContact CG2-CD2 4.01Å; V550-F593 HydrophobicContact CG2-CG 4.44Å; V553-F593 HydrophobicContact CB-CE2 4.32Å; V553-F593 HydrophobicContact CG1-CE2 3.87Å; V553-F593 HydrophobicContact CG1-CZ 4.36Å; P589-F593 WeakPolarHBondContact O-CB 3.44Å; P589-F593 PolarHBondContact O-N 3.26Å; A591-F593 PolarHBondContact O-N 2.88Å; F593-V597 HydrophobicContact CD2-CG2 4.11Å; F593-V597 HydrophobicContact CE2-CG2 4.36Å; F593-V597 HydrophobicContact CG-CG2 4.38Å; F593-V597 HydrophobicContact CZ-CG1 4.39Å; F593-V597 WeakPolarHBondContact O-CA 3.47Å; F593-V597 WeakPolarHBondContact O-CB 3.35Å; F593-V597 PolarHBondContact O-N 2.62Å; F593-L598 HydrophobicContact CD1-CD1 3.89Å; F593-L598 HydrophobicContact CD1-CD2 4.48Å; F593-L598 HydrophobicContact CD1-CG 3.82Å; F593-L598 HydrophobicContact CE1-CD1 3.93Å; F593-L598 HydrophobicContact CE1-CD2 3.83Å; F593-L598 HydrophobicContact CE1-CG 3.68Å; F593-L598 PolarHBondContact O-N 3.39Å; F593-L598 VanDerWaalsContact O-N 3.09Å; F593-F639 HydrophobicContact CB-CZ 3.96Å; F593-F639 HydrophobicContact CG-CZ 4.33Å; F593-I643 HydrophobicContact CB-CD1 3.81Å; F593-I643 HydrophobicContact CD1-CD1 3.58Å; F593-I643 HydrophobicContact CD1-CG1 4.41Å; F593-I643 HydrophobicContact CG-CD1 4.04Å; F593-F647 HydrophobicContact CD1-CE2 4.39Å; F593-F647 AromaticContact CE1-CE2 3.55Å; F593-F647 HydrophobicContact CE1-CE2 3.55Å; F593-F647 AromaticContact CE1-CZ 3.57Å; F593-F647 HydrophobicContact CE1-CZ 3.57Å; F593-F647 HydrophobicContact CZ-CE2 4.24Å; F593-F647 AromaticContact CZ-CZ 3.79Å; F593-F647 HydrophobicContact CZ-CZ 3.79Å
594	R	97.4	Very high	95.9	Very high	84 Å²	84	31.6 Å²	31.6	32%	0.317	17%	0.171	S	C	.	.	I	π-helix	trans	-69.9	-51.5	-176.7	-159.7	-168.9	81.4	-144.5	4.4	112.4	I590 A591 L598 E599 I643	I590-R594 WeakPolarHBondContact O-CB 3.35Å; I590-R594 PolarHBondContact O-N 3.01Å; A591-R594 PolarHBondContact O-N 3.04Å; R594-L598 PolarHBondContact O-N 3.13Å; R594-E599 IonicContact CZ-OE1 3.73Å; R594-E599 IonicContact NE-OE1 3.39Å; R594-E599 PolarHBondContact NE-OE1 3.16Å; R594-E599 IonicContact NH2-OE1 2.67Å; R594-E599 PolarHBondContact NH2-OE1 3.49Å; R594-E599 VanDerWaalsContact NH2-OE1 3.12Å; R594-E599 WeakPolarHBondContact O-CB 3.29Å; R594-E599 WeakPolarHBondContact O-CG 3.26Å; R594-E599 PolarHBondContact O-N 2.98Å; R594-I643 HydrophobicContact CB-CD1 4.5Å
595	K	97	Very high	96	Very high	87 Å²	87	31.9 Å²	31.9	38%	0.378	17%	0.167	S	C	.	.	I	π-helix	trans	-81.2	-31.5	-178.5	-61.7	-178	173.1	-177.6	0	113.2	A591 P600	A591-K595 VanDerWaalsContact O-CB 3.3Å; A591-K595 WeakPolarHBondContact O-CB 3.46Å; A591-K595 PolarHBondContact O-N 3.18Å; K595-P600 WeakPolarHBondContact O-CD 3.43Å; K595-P600 VanDerWaalsContact O-CG 3.25Å; K595-P600 WeakPolarHBondContact O-CG 3.19Å
596	G	96.6	Very high	96	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.206	C	C	.	.	I	π-helix	trans	-84.8	-29.6	179.3	0	0	0	0	0	114.5	Y566 A592	Y566-G596 PolarHBondContact OH-O 3.2Å; A592-G596 VanDerWaalsContact O-CA 3.22Å; A592-G596 WeakPolarHBondContact O-CA 3.44Å; A592-G596 PolarHBondContact O-N 3.25Å
597	V	97.6	Very high	96.1	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	23%	0.229	C	C	.	.	I	π-helix	trans	-116.9	-59.2	-176.1	-169.1	0	0	0	0	112.7	A554 L557 L580 F593 L601	A554-V597 HydrophobicContact CB-CG2 3.8Å; L557-V597 HydrophobicContact CD1-CG1 3.35Å; L580-V597 HydrophobicContact CD2-CG2 3.79Å; F593-V597 HydrophobicContact CD2-CG2 4.11Å; F593-V597 HydrophobicContact CE2-CG2 4.36Å; F593-V597 HydrophobicContact CG-CG2 4.38Å; F593-V597 HydrophobicContact CZ-CG1 4.39Å; F593-V597 WeakPolarHBondContact O-CA 3.47Å; F593-V597 WeakPolarHBondContact O-CB 3.35Å; F593-V597 PolarHBondContact O-N 2.62Å; V597-L601 HydrophobicContact CG1-CD1 3.83Å; V597-L601 VanDerWaalsContact O-CB 3.31Å; V597-L601 WeakPolarHBondContact O-CB 3.31Å; V597-L601 VanDerWaalsContact O-CG 3.25Å; V597-L601 WeakPolarHBondContact O-CG 3.4Å; V597-L601 PolarHBondContact O-N 2.91Å; V597-L601 VanDerWaalsContact O-N 3.13Å
598	L	97.3	Very high	96.1	Very high	7 Å²	7	51.8 Å²	51.8	4%	0.037	25%	0.248	C	C	.	.	I	π-helix	trans	-71.8	-48.3	-169.1	-65.9	177.1	0	0	0	113.5	F593 R594 L601 A602 I643 K646 F647 L651	F593-L598 HydrophobicContact CD1-CD1 3.89Å; F593-L598 HydrophobicContact CD1-CD2 4.48Å; F593-L598 HydrophobicContact CD1-CG 3.82Å; F593-L598 HydrophobicContact CE1-CD1 3.93Å; F593-L598 HydrophobicContact CE1-CD2 3.83Å; F593-L598 HydrophobicContact CE1-CG 3.68Å; F593-L598 PolarHBondContact O-N 3.39Å; F593-L598 VanDerWaalsContact O-N 3.09Å; R594-L598 PolarHBondContact O-N 3.13Å; L598-L601 PolarHBondContact O-N 3.23Å; L598-A602 VanDerWaalsContact O-CB 3.31Å; L598-A602 WeakPolarHBondContact O-CB 3.49Å; L598-A602 PolarHBondContact O-N 3.15Å; L598-I643 HydrophobicContact CD1-CD1 4.41Å; L598-I643 HydrophobicContact CD1-CG1 4.14Å; L598-K646 HydrophobicContact CD1-CB 4.1Å; L598-F647 HydrophobicContact CD1-CD2 3.82Å; L598-F647 HydrophobicContact CD1-CE2 4Å; L598-F647 HydrophobicContact CD2-CD2 4.02Å; L598-F647 HydrophobicContact CD2-CE2 4.12Å; L598-F647 HydrophobicContact CD2-CG 4.23Å; L598-F647 HydrophobicContact CD2-CZ 4.44Å; L598-L651 HydrophobicContact CD2-CD2 4.02Å
599	E	96.9	Very high	96.2	Very high	82 Å²	82	52.8 Å²	52.8	38%	0.383	25%	0.246	S	C	.	.	H	α-helix	trans	-63.2	-43.3	-179.9	-69.8	167.6	-161.3	0	0	111.9	R594 S603	R594-E599 IonicContact CZ-OE1 3.73Å; R594-E599 IonicContact NE-OE1 3.39Å; R594-E599 PolarHBondContact NE-OE1 3.16Å; R594-E599 IonicContact NH2-OE1 2.67Å; R594-E599 PolarHBondContact NH2-OE1 3.49Å; R594-E599 VanDerWaalsContact NH2-OE1 3.12Å; R594-E599 WeakPolarHBondContact O-CB 3.29Å; R594-E599 WeakPolarHBondContact O-CG 3.26Å; R594-E599 PolarHBondContact O-N 2.98Å; E599-S603 WeakPolarHBondContact O-CB 3.39Å; E599-S603 PolarHBondContact O-N 3.29Å; E599-S603 PolarHBondContact O-OG 3.41Å
600	P	97.1	Very high	96	Very high	10 Å²	10	51.7 Å²	51.7	7%	0.065	24%	0.239	C	C	.	.	H	α-helix	trans	-63.7	-45	172.7	-27.9	38.2	0	0	0	114	Y566 L569 L576 K595 A602 S603 L604	Y566-P600 HydrophobicContact CD2-CB 4.25Å; Y566-P600 HydrophobicContact CE2-CB 4.2Å; L569-P600 HydrophobicContact CD2-CB 3.89Å; L576-P600 HydrophobicContact CD1-CG 4.24Å; L576-P600 HydrophobicContact CD2-CG 4.32Å; K595-P600 WeakPolarHBondContact O-CD 3.43Å; K595-P600 VanDerWaalsContact O-CG 3.25Å; K595-P600 WeakPolarHBondContact O-CG 3.19Å; P600-A602 PolarHBondContact O-N 2.71Å; P600-S603 PolarHBondContact O-N 3.36Å; P600-L604 WeakPolarHBondContact O-CG 3.49Å; P600-L604 PolarHBondContact O-N 3.1Å
601	L	96.9	Very high	95.7	Very high	1 Å²	1	52.1 Å²	52.1	1%	0.005	25%	0.246	C	C	.	.	H	α-helix	trans	-64.9	-39.2	178.6	-76.6	177.3	0	0	0	112.5	L557 L563 Y566 V597 L598 S603 R605 L610 W650	L557-L601 HydrophobicContact CD1-CD1 4.31Å; L563-L601 HydrophobicContact CD1-CD2 4.35Å; L563-L601 HydrophobicContact CD2-CD2 4.21Å; Y566-L601 HydrophobicContact CD1-CD2 4.45Å; Y566-L601 HydrophobicContact CD2-CD2 3.94Å; Y566-L601 HydrophobicContact CD2-CG 4.13Å; Y566-L601 HydrophobicContact CE2-CG 4.43Å; Y566-L601 HydrophobicContact CG-CD2 3.82Å; Y566-L601 HydrophobicContact CG-CG 4.45Å; V597-L601 HydrophobicContact CG1-CD1 3.83Å; V597-L601 VanDerWaalsContact O-CB 3.31Å; V597-L601 WeakPolarHBondContact O-CB 3.31Å; V597-L601 VanDerWaalsContact O-CG 3.25Å; V597-L601 WeakPolarHBondContact O-CG 3.4Å; V597-L601 PolarHBondContact O-N 2.91Å; V597-L601 VanDerWaalsContact O-N 3.13Å; L598-L601 PolarHBondContact O-N 3.23Å; L601-S603 VanDerWaalsContact C-N 3.33Å; L601-R605 WeakPolarHBondContact O-CB 3.27Å; L601-R605 PolarHBondContact O-N 3.31Å; L601-R605 VanDerWaalsContact O-N 3.1Å; L601-L610 HydrophobicContact CD2-CD1 4.08Å; L601-W650 HydrophobicContact CB-CH2 4.1Å
602	A	95.4	Very high	95.4	Very high	44 Å²	44	58.2 Å²	58.2	36%	0.364	27%	0.271	S	S	.	.	H	α-helix	trans	-63.7	-38.8	173.7	0	0	0	0	0	111.9	L598 P600 R605 K606	L598-A602 VanDerWaalsContact O-CB 3.31Å; L598-A602 WeakPolarHBondContact O-CB 3.49Å; L598-A602 PolarHBondContact O-N 3.15Å; P600-A602 PolarHBondContact O-N 2.71Å; A602-R605 PolarHBondContact O-N 2.9Å; A602-K606 WeakPolarHBondContact O-CB 3.39Å; A602-K606 PolarHBondContact O-N 2.91Å
603	S	96.1	Very high	95	Very high	55 Å²	55	63.2 Å²	63.2	39%	0.385	29%	0.294	S	S	.	.	H	α-helix	trans	-66	-49.5	177.5	-56.9	0	0	0	0	111.6	E599 P600 L601 R605 K606 E607	E599-S603 WeakPolarHBondContact O-CB 3.39Å; E599-S603 PolarHBondContact O-N 3.29Å; E599-S603 PolarHBondContact O-OG 3.41Å; P600-S603 PolarHBondContact O-N 3.36Å; L601-S603 VanDerWaalsContact C-N 3.33Å; S603-R605 VanDerWaalsContact C-N 3.27Å; S603-R605 PolarHBondContact O-N 2.86Å; S603-K606 WeakPolarHBondContact O-CA 3.4Å; S603-K606 WeakPolarHBondContact O-CB 3.44Å; S603-K606 PolarHBondContact O-N 3.24Å; S603-E607 WeakPolarHBondContact O-CG 3.46Å; S603-E607 PolarHBondContact O-N 2.93Å
604	L	96.3	Very high	94.7	Very high	2 Å²	2	65.9 Å²	65.9	1%	0.01	31%	0.308	C	S	.	.	H	α-helix	trans	-61.1	-32.8	177.1	-69.2	168.1	0	0	0	113.2	P565 Y566 L569 P600 R608 R609 L610	P565-L604 HydrophobicContact CB-CD1 4.45Å; P565-L604 HydrophobicContact CB-CD2 4.23Å; Y566-L604 HydrophobicContact CD2-CD1 4.45Å; L569-L604 HydrophobicContact CD2-CD1 3.98Å; L569-L604 HydrophobicContact CD2-CD2 4.34Å; L569-L604 HydrophobicContact CD2-CG 4.16Å; P600-L604 WeakPolarHBondContact O-CG 3.49Å; P600-L604 PolarHBondContact O-N 3.1Å; L604-R608 PolarHBondContact O-N 3.35Å; L604-R609 HydrophobicContact CD2-CB 4.32Å; L604-R609 PolarHBondContact O-N 3.46Å; L604-L610 HydrophobicContact CB-CD1 3.94Å; L604-L610 HydrophobicContact CB-CG 3.97Å; L604-L610 PolarHBondContact O-N 3.27Å
605	R	94.3	Very high	94.7	Very high	40 Å²	40	62 Å²	62	15%	0.151	29%	0.294	C	S	.	.	H	α-helix	trans	-71.7	-40.2	172.5	-170.1	69.8	162.2	-115	-12.4	111.8	L601 A602 S603 E607 R608 L610 P611 E612 E613 W650	L601-R605 WeakPolarHBondContact O-CB 3.27Å; L601-R605 PolarHBondContact O-N 3.31Å; L601-R605 VanDerWaalsContact O-N 3.1Å; A602-R605 PolarHBondContact O-N 2.9Å; S603-R605 VanDerWaalsContact C-N 3.27Å; S603-R605 PolarHBondContact O-N 2.86Å; R605-E607 VanDerWaalsContact C-N 3.29Å; R605-E607 PolarHBondContact O-N 2.85Å; R605-R608 PolarHBondContact O-N 3.1Å; R605-L610 HydrophobicContact CB-CD1 4.45Å; R605-P611 PolarHBondContact NE-O 3.31Å; R605-P611 PolarHBondContact NH1-O 2.69Å; R605-E612 VanDerWaalsContact NH2-C 3.29Å; R605-E613 VanDerWaalsContact CZ-O 3.24Å; R605-E613 PolarHBondContact NH1-O 2.92Å; R605-E613 PolarHBondContact NH2-O 3.37Å; R605-W650 HydrophobicContact CB-CZ2 3.98Å; R605-W650 HydrophobicContact CG-CZ2 4.22Å
606	K	94.5	Very high	94.7	Very high	189 Å²	189	58.1 Å²	58.1	82%	0.822	28%	0.277	S	S	*	.	H	α-helix	trans	-62.6	-35.9	174.2	-175.4	-174.6	176.2	-171.8	0	112.1	A602 S603 R608	A602-K606 WeakPolarHBondContact O-CB 3.39Å; A602-K606 PolarHBondContact O-N 2.91Å; S603-K606 WeakPolarHBondContact O-CA 3.4Å; S603-K606 WeakPolarHBondContact O-CB 3.44Å; S603-K606 PolarHBondContact O-N 3.24Å; K606-R608 PolarHBondContact O-N 3.04Å
607	E	95.6	Very high	94.7	Very high	113 Å²	113	58.2 Å²	58.2	53%	0.528	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73	-2.4	172.8	-70.7	168	-155.7	0	0	114	S603 R605 R609	S603-E607 WeakPolarHBondContact O-CG 3.46Å; S603-E607 PolarHBondContact O-N 2.93Å; R605-E607 VanDerWaalsContact C-N 3.29Å; R605-E607 PolarHBondContact O-N 2.85Å; E607-R609 HydrophobicContact CB-CG 4.07Å; E607-R609 PolarHBondContact O-N 3.35Å; E607-R609 WeakPolarHBondContact OE2-CD 3.34Å; E607-R609 IonicContact OE2-NH1 3Å
608	R	93.3	Very high	94.8	Very high	192 Å²	192	58.2 Å²	58.2	73%	0.725	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.9	21.9	-172.2	-58	176.5	172.9	-89.9	-3	114.2	L604 R605 K606 L610 E612	L604-R608 PolarHBondContact O-N 3.35Å; R605-R608 PolarHBondContact O-N 3.1Å; K606-R608 PolarHBondContact O-N 3.04Å; R608-L610 VanDerWaalsContact C-N 3.34Å; R608-E612 IonicContact CZ-OE1 3.74Å; R608-E612 IonicContact NH1-OE1 3.77Å; R608-E612 PolarHBondContact NH1-OE1 3.43Å
609	R	94.3	Very high	94.8	Very high	95 Å²	95	57.9 Å²	57.9	36%	0.358	28%	0.276	S	S	.	.			trans	-76.5	-21.6	174	-70.5	-179.5	68.1	-170.6	-0.6	112.7	P565 E568 L604 E607	P565-R609 HydrophobicContact CB-CB 4.22Å; P565-R609 HydrophobicContact CG-CB 4.45Å; P565-R609 WeakPolarHBondContact CG-O 3.43Å; E568-R609 IonicContact OE2-NH2 2.9Å; E568-R609 PolarHBondContact OE2-NH2 2.82Å; L604-R609 HydrophobicContact CD2-CB 4.32Å; L604-R609 PolarHBondContact O-N 3.46Å; E607-R609 HydrophobicContact CB-CG 4.07Å; E607-R609 PolarHBondContact O-N 3.35Å; E607-R609 WeakPolarHBondContact OE2-CD 3.34Å; E607-R609 IonicContact OE2-NH1 3Å
610	L	92.9	Very high	94.9	Very high	4 Å²	4	54.1 Å²	54.1	2%	0.021	26%	0.258	C	S	.	.	S	Bend	trans	-102.4	140.5	172.5	-61.4	176.9	0	0	0	110.4	L563 P565 L601 L604 R605 R608 W650	L563-L610 HydrophobicContact CD2-CD1 4.2Å; L563-L610 HydrophobicContact CD2-CD2 3.92Å; P565-L610 HydrophobicContact CB-CD2 4.27Å; P565-L610 HydrophobicContact CG-CD2 4.06Å; L601-L610 HydrophobicContact CD2-CD1 4.08Å; L604-L610 HydrophobicContact CB-CD1 3.94Å; L604-L610 HydrophobicContact CB-CG 3.97Å; L604-L610 PolarHBondContact O-N 3.27Å; R605-L610 HydrophobicContact CB-CD1 4.45Å; R608-L610 VanDerWaalsContact C-N 3.34Å; L610-W650 HydrophobicContact CD1-CH2 4.41Å
611	P	89.1	Confident	94.8	Very high	65 Å²	65	54.2 Å²	54.2	42%	0.422	26%	0.259	S	S	.	.			trans	-54.4	153.8	173.7	-24.6	33.7	0	0	0	112.8	R605 E613	R605-P611 PolarHBondContact NE-O 3.31Å; R605-P611 PolarHBondContact NH1-O 2.69Å; P611-E613 HydrophobicContact CB-CG 4.13Å; P611-E613 PolarHBondContact O-N 3.47Å
612	E	88.8	Confident	94.7	Very high	146 Å²	146	54.1 Å²	54.1	68%	0.682	26%	0.259	S	S	*	.	S	Bend	trans	-79.1	39.7	179.9	-66.9	-173.2	-173.3	0	0	113.4	R605 R608	R605-E612 VanDerWaalsContact NH2-C 3.29Å; R608-E612 IonicContact CZ-OE1 3.74Å; R608-E612 IonicContact NH1-OE1 3.77Å; R608-E612 PolarHBondContact NH1-OE1 3.43Å
613	E	90.1	Very high	94.7	Very high	109 Å²	109	52.4 Å²	52.4	51%	0.509	24%	0.244	S	C	.	.			trans	-100.3	160.8	-179	-61.4	-178.8	142.6	0	0	113.2	R605 P611 Y615	R605-E613 VanDerWaalsContact CZ-O 3.24Å; R605-E613 PolarHBondContact NH1-O 2.92Å; R605-E613 PolarHBondContact NH2-O 3.37Å; P611-E613 HydrophobicContact CB-CG 4.13Å; P611-E613 PolarHBondContact O-N 3.47Å; E613-Y615 HydrophobicContact CB-CE1 3.97Å; E613-Y615 PolarHBondContact OE2-OH 3.36Å
614	D	92.2	Very high	94.5	Very high	59 Å²	59	50.3 Å²	50.3	32%	0.316	23%	0.228	S	C	.	.			trans	-86.2	136.3	168.1	-84	-0.2	0	0	0	110.6	K529 W650 K652	K529-D614 WeakPolarHBondContact CB-O 3.48Å; K529-D614 WeakPolarHBondContact CG-O 3.4Å; D614-W650 CarbonylContact C-O 3.57Å; D614-W650 WeakPolarHBondContact CA-O 3.43Å; D614-W650 VanDerWaalsContact OD1-CA 3.23Å; D614-W650 WeakPolarHBondContact OD1-CA 3.41Å; D614-W650 VanDerWaalsContact OD1-CB 3.3Å; D614-W650 WeakPolarHBondContact OD1-CB 3.45Å; D614-K652 WeakPolarHBondContact OD2-CE 3.4Å; D614-K652 IonicContact OD2-NZ 3.8Å
615	Y	95.8	Very high	94.3	Very high	2 Å²	2	50.3 Å²	50.3	1%	0.008	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	148.5	178.9	-63.9	-44	0	0	0	111.8	K529 V531 Q562 L563 E613 W650 L651 K652	K529-Y615 CarbonylContact O-C 3.42Å; K529-Y615 WeakPolarHBondContact O-CA 3.2Å; V531-Y615 HydrophobicContact CG1-CD1 3.86Å; V531-Y615 HydrophobicContact CG1-CD2 4.49Å; V531-Y615 HydrophobicContact CG1-CG 3.83Å; Q562-Y615 HydrophobicContact CB-CE1 4.07Å; Q562-Y615 HydrophobicContact CG-CE1 4.32Å; L563-Y615 HydrophobicContact CD2-CD2 3.95Å; L563-Y615 HydrophobicContact CD2-CE2 3.88Å; E613-Y615 HydrophobicContact CB-CE1 3.97Å; E613-Y615 PolarHBondContact OE2-OH 3.36Å; Y615-W650 HydrophobicContact CD2-CE3 4.13Å; Y615-W650 AromaticContact CD2-CZ3 3.85Å; Y615-W650 HydrophobicContact CD2-CZ3 3.85Å; Y615-W650 PolarHBondContact N-O 2.67Å; Y615-L651 CarbonylContact O-C 3.54Å; Y615-L651 WeakPolarHBondContact O-CA 3.38Å; Y615-K652 PolarHBondContact O-N 3.08Å
616	I	97.3	Very high	94.2	Very high	6 Å²	6	49.9 Å²	49.9	3%	0.031	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	132.1	-170.5	-57	174.8	0	0	0	110.6	L440 L526 K529 V530 V531 L618 K652 V654	L440-I616 HydrophobicContact CD1-CD1 3.86Å; L440-I616 HydrophobicContact CD1-CG1 4.48Å; L526-I616 HydrophobicContact CD2-CD1 3.85Å; K529-I616 HydrophobicContact CB-CD1 3.9Å; K529-I616 HydrophobicContact CB-CG1 3.98Å; K529-I616 HydrophobicContact CD-CD1 4.47Å; K529-I616 PolarHBondContact O-N 3.39Å; V530-I616 WeakPolarHBondContact CA-O 3.35Å; V530-I616 HydrophobicContact CG2-CB 4.22Å; V530-I616 HydrophobicContact CG2-CG2 4.33Å; V531-I616 WeakPolarHBondContact CG2-O 3.41Å; V531-I616 PolarHBondContact N-O 2.89Å; I616-L618 HydrophobicContact CG2-CD2 3.57Å; I616-L618 HydrophobicContact CG2-CG 4.32Å; I616-K652 WeakPolarHBondContact CA-O 3.2Å; I616-K652 HydrophobicContact CG1-CB 4.39Å; I616-V654 HydrophobicContact CG2-CG2 3.93Å
617	I	98.1	Very high	93.9	Very high	1 Å²	1	47.1 Å²	47.1	1%	0.005	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	133.1	163.5	-57.3	-178.3	0	0	0	108.4	V531 A532 V553 L557 V619 F647 L651 K652 L653 V654	V531-I617 HydrophobicContact CG2-CG1 4.35Å; A532-I617 HydrophobicContact CB-CG1 4.24Å; A532-I617 HydrophobicContact CB-CG2 4.27Å; A532-I617 WeakPolarHBondContact O-CA 3.49Å; V553-I617 HydrophobicContact CG1-CD1 4.06Å; V553-I617 HydrophobicContact CG1-CG2 4.46Å; L557-I617 HydrophobicContact CD1-CD1 4.4Å; L557-I617 HydrophobicContact CD2-CD1 4.38Å; I617-V619 HydrophobicContact CG2-CG2 4.44Å; I617-F647 HydrophobicContact CD1-CE1 4.47Å; I617-L651 HydrophobicContact CD1-CD1 4.02Å; I617-L651 HydrophobicContact CD1-CD2 4.15Å; I617-L651 HydrophobicContact CD1-CG 4.23Å; I617-L651 HydrophobicContact CG1-CD1 3.99Å; I617-K652 PolarHBondContact N-O 3.36Å; I617-L653 HydrophobicContact CB-CD1 3.7Å; I617-L653 HydrophobicContact CG2-CD1 3.71Å; I617-L653 WeakPolarHBondContact O-CA 3.49Å; I617-V654 PolarHBondContact O-N 3.13Å
618	L	98.5	Very high	93.5	Very high	1 Å²	1	43.4 Å²	43.4	1%	0.005	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	134.5	179	-54	176.6	0	0	0	110.8	I465 L468 V469 V530 A532 Y533 H534 I616 V654	I465-L618 HydrophobicContact CD1-CD2 4.33Å; I465-L618 HydrophobicContact CG2-CB 3.96Å; I465-L618 HydrophobicContact CG2-CD1 4.08Å; L468-L618 HydrophobicContact CB-CD1 3.78Å; L468-L618 HydrophobicContact CD1-CD1 4.37Å; L468-L618 HydrophobicContact CD1-CD2 4.22Å; V469-L618 HydrophobicContact CG2-CD1 3.82Å; V530-L618 HydrophobicContact CG1-CD1 3.77Å; V530-L618 HydrophobicContact CG1-CG 4.05Å; V530-L618 HydrophobicContact CG2-CD1 3.85Å; V530-L618 HydrophobicContact CG2-CD2 4.3Å; V530-L618 HydrophobicContact CG2-CG 4.13Å; A532-L618 PolarHBondContact O-N 2.93Å; Y533-L618 CarbonylContact C-O 3.44Å; Y533-L618 VanDerWaalsContact CA-O 3.23Å; Y533-L618 WeakPolarHBondContact CA-O 3.43Å; H534-L618 PolarHBondContact N-O 3.39Å; I616-L618 HydrophobicContact CG2-CD2 3.57Å; I616-L618 HydrophobicContact CG2-CG 4.32Å; L618-V654 WeakPolarHBondContact CA-O 3.39Å; L618-V654 HydrophobicContact CD2-CB 3.86Å; L618-V654 HydrophobicContact CD2-CG2 4.3Å
619	V	98.2	Very high	93.3	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	102.4	175.2	-169.8	0	0	0	0	110.2	H534 F549 I617 L622 V636 I640 L653 V654 V655 T656	H534-V619 WeakPolarHBondContact O-CA 3.41Å; F549-V619 HydrophobicContact CE2-CG1 4.18Å; F549-V619 HydrophobicContact CE2-CG2 3.84Å; F549-V619 HydrophobicContact CZ-CG2 4.21Å; I617-V619 HydrophobicContact CG2-CG2 4.44Å; V619-L622 HydrophobicContact CG1-CD2 3.76Å; V619-V636 HydrophobicContact CG1-CG1 4.21Å; V619-I640 HydrophobicContact CG1-CD1 4.46Å; V619-L653 HydrophobicContact CG2-CD1 3.78Å; V619-L653 HydrophobicContact CG2-CG 4.45Å; V619-V654 PolarHBondContact N-O 3.42Å; V619-V655 HydrophobicContact CB-CG1 4.23Å; V619-V655 CarbonylContact O-C 3.29Å; V619-V655 VanDerWaalsContact O-CA 3.26Å; V619-V655 WeakPolarHBondContact O-CA 3.31Å; V619-T656 PolarHBondContact O-N 2.97Å
620	D	97.7	Very high	92.9	Very high	3 Å²	3	37.6 Å²	37.6	2%	0.016	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	141.6	-179.4	-164.2	67.5	0	0	0	112.6	T462 I465 H534 F535 C536 T656	T462-D620 WeakPolarHBondContact CA-OD1 3.38Å; T462-D620 VanDerWaalsContact CB-OD2 3.3Å; T462-D620 WeakPolarHBondContact CB-OD2 3.34Å; T462-D620 VanDerWaalsContact CG2-OD2 3.31Å; T462-D620 WeakPolarHBondContact CG2-OD2 3.4Å; T462-D620 PolarHBondContact OG1-OD2 2.87Å; I465-D620 HydrophobicContact CB-CB 4.39Å; I465-D620 HydrophobicContact CG1-CB 4.32Å; I465-D620 WeakPolarHBondContact CG1-OD1 3.32Å; I465-D620 HydrophobicContact CG2-CB 4.18Å; H534-D620 PolarHBondContact O-N 3.29Å; F535-D620 HydrophobicContact CD1-CB 3.42Å; F535-D620 VanDerWaalsContact CD1-CB 3.42Å; F535-D620 HydrophobicContact CE1-CB 3.84Å; F535-D620 HydrophobicContact CG-CB 4.2Å; C536-D620 PolarHBondContact N-O 3.43Å; D620-T656 VanDerWaalsContact CG-OG1 3.31Å; D620-T656 VanDerWaalsContact OD1-CG2 3.31Å; D620-T656 WeakPolarHBondContact OD1-CG2 3.33Å; D620-T656 PolarHBondContact OD1-OG1 3.11Å
621	S	95.5	Very high	92.5	Very high	11 Å²	11	40.8 Å²	40.8	8%	0.077	20%	0.202	C	C	.	.			trans	60.3	55.3	164.1	-61.9	0	0	0	0	115.2	C536 N623 E624 T656	C536-S621 WeakPolarHBondContact CB-O 3.22Å; S621-N623 PolarHBondContact O-N 3.44Å; S621-E624 WeakPolarHBondContact O-CB 3.44Å; S621-E624 PolarHBondContact O-N 2.68Å; S621-T656 WeakPolarHBondContact CA-O 3.27Å; S621-T656 PolarHBondContact N-O 2.98Å; S621-T656 PolarHBondContact N-OG1 3.01Å
622	L	96.1	Very high	92.4	Very high	0 Å²	0	42 Å²	42	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-51.9	-30.6	176.7	-69.9	179.7	0	0	0	113.6	V619 E624 A625 E626 V636 A637 I640 V655 T656 I664 T665 L668	V619-L622 HydrophobicContact CG1-CD2 3.76Å; L622-E624 PolarHBondContact O-N 2.69Å; L622-A625 WeakPolarHBondContact O-CB 3.45Å; L622-A625 PolarHBondContact O-N 3.29Å; L622-A625 VanDerWaalsContact O-N 3.09Å; L622-E626 PolarHBondContact O-N 3.12Å; L622-V636 HydrophobicContact CD2-CB 4.3Å; L622-V636 HydrophobicContact CD2-CG1 3.82Å; L622-A637 HydrophobicContact CB-CB 4.49Å; L622-A637 HydrophobicContact CD1-CB 4.35Å; L622-I640 HydrophobicContact CD2-CD1 3.99Å; L622-V655 HydrophobicContact CD1-CB 3.81Å; L622-V655 HydrophobicContact CD1-CG1 4.22Å; L622-V655 HydrophobicContact CD1-CG2 4Å; L622-V655 HydrophobicContact CG-CB 4.37Å; L622-T656 PolarHBondContact N-O 3.1Å; L622-I664 HydrophobicContact CB-CD1 3.97Å; L622-T665 HydrophobicContact CD1-CG2 4.1Å; L622-L668 HydrophobicContact CD1-CD1 4.49Å
623	N	94.1	Very high	92.4	Very high	8 Å²	8	37.1 Å²	37.1	4%	0.043	19%	0.187	C	C	.	.	H	α-helix	trans	-61.5	-26.5	174.4	58.5	-92.1	0	0	0	114.1	S621 A625 V657 R658 L661	S621-N623 PolarHBondContact O-N 3.44Å; N623-A625 VanDerWaalsContact C-N 3.29Å; N623-V657 HydrophobicContact CB-CG2 4.32Å; N623-R658 HydrophobicContact CB-CB 4.37Å; N623-R658 WeakPolarHBondContact ND2-CD 3.4Å; N623-R658 PolarHBondContact ND2-NE 2.84Å; N623-R658 VanDerWaalsContact ND2-NE 3.2Å; N623-R658 PolarHBondContact OD1-N 3.3Å; N623-R658 VanDerWaalsContact OD1-N 3.09Å; N623-L661 HydrophobicContact CB-CB 4.13Å; N623-L661 HydrophobicContact CB-CD1 3.7Å
624	E	92.5	Very high	92.5	Very high	11 Å²	11	33.7 Å²	33.7	5%	0.051	17%	0.172	C	C	.	.	H	α-helix	trans	-75.9	-23.1	177	-52.1	-75.9	137	0	0	110.7	C536 A538 C544 S621 L622 F627 R658	C536-E624 HydrophobicContact CB-CB 4.12Å; A538-E624 HydrophobicContact CB-CB 4.38Å; A538-E624 WeakPolarHBondContact CB-OE2 3.42Å; C544-E624 PolarHBondContact SG-O 3.13Å; C544-E624 VanDerWaalsContact SG-O 3.36Å; S621-E624 WeakPolarHBondContact O-CB 3.44Å; S621-E624 PolarHBondContact O-N 2.68Å; L622-E624 PolarHBondContact O-N 2.69Å; E624-F627 WeakPolarHBondContact O-CB 3.49Å; E624-R658 IonicContact OE1-CZ 3.59Å; E624-R658 IonicContact OE1-NE 2.89Å; E624-R658 PolarHBondContact OE1-NE 3.43Å; E624-R658 IonicContact OE1-NH2 2.7Å; E624-R658 PolarHBondContact OE1-NH2 2.91Å
625	A	92.5	Very high	92.7	Very high	1 Å²	1	31 Å²	31	1%	0.008	16%	0.159	C	C	.	.	H	α-helix	trans	-74.3	-37.6	172.9	0	0	0	0	0	112.1	C536 C544 L622 N623 F627 H628 K629 V636	C536-A625 HydrophobicContact CB-CB 4.25Å; C544-A625 HydrophobicContact CB-CB 4.2Å; L622-A625 WeakPolarHBondContact O-CB 3.45Å; L622-A625 PolarHBondContact O-N 3.29Å; L622-A625 VanDerWaalsContact O-N 3.09Å; N623-A625 VanDerWaalsContact C-N 3.29Å; A625-F627 PolarHBondContact O-N 2.84Å; A625-H628 CarbonylContact O-C 3.59Å; A625-H628 PolarHBondContact O-N 3.35Å; A625-K629 PolarHBondContact O-N 3.2Å; A625-V636 HydrophobicContact CB-CB 4.07Å; A625-V636 HydrophobicContact CB-CG2 4.04Å
626	E	91.9	Very high	92.7	Very high	32 Å²	32	31 Å²	31	15%	0.15	16%	0.158	C	C	.	.	H	α-helix	trans	-64.4	-25.2	174.4	-63.8	-65.1	135.3	0	0	112.9	L622 H628 K629 T635 I664	L622-E626 PolarHBondContact O-N 3.12Å; E626-H628 PolarHBondContact O-N 3.46Å; E626-K629 WeakPolarHBondContact O-CB 3.36Å; E626-K629 PolarHBondContact O-N 3.17Å; E626-K629 VanDerWaalsContact O-N 3.12Å; E626-K629 IonicContact OE2-NZ 2.71Å; E626-K629 PolarHBondContact OE2-NZ 3.28Å; E626-T635 WeakPolarHBondContact OE1-CB 3.12Å; E626-T635 VanDerWaalsContact OE1-CG2 3.31Å; E626-T635 WeakPolarHBondContact OE1-CG2 3.31Å; E626-T635 PolarHBondContact OE1-OG1 2.98Å; E626-I664 HydrophobicContact CG-CD1 3.82Å; E626-I664 HydrophobicContact CG-CG2 4.16Å
627	F	88.4	Confident	92.7	Very high	131 Å²	131	30.7 Å²	30.7	58%	0.575	16%	0.157	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-29.2	171.9	-175.5	-91.3	0	0	0	112.6	A538 E624 A625	A538-F627 HydrophobicContact CB-CB 4.43Å; A538-F627 HydrophobicContact CB-CD1 3.93Å; A538-F627 HydrophobicContact CB-CE1 4.49Å; A538-F627 HydrophobicContact CB-CG 4.25Å; E624-F627 WeakPolarHBondContact O-CB 3.49Å; A625-F627 PolarHBondContact O-N 2.84Å
628	H	85.7	Confident	92.6	Very high	35 Å²	35	33 Å²	33	16%	0.162	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.9	25.2	175.1	-70.2	-69.8	0	0	0	112.6	A538 T541 C544 A625 E626	A538-H628 PolarHBondContact O-NE2 2.76Å; T541-H628 HydrophobicContact CG2-CB 4.3Å; T541-H628 PolarHBondContact OG1-CE1 2.75Å; T541-H628 PolarHBondContact OG1-ND1 3.17Å; T541-H628 PolarHBondContact OG1-NE2 2.95Å; C544-H628 HydrophobicContact CB-CB 3.99Å; A625-H628 CarbonylContact O-C 3.59Å; A625-H628 PolarHBondContact O-N 3.35Å; E626-H628 PolarHBondContact O-N 3.46Å
629	K	90.1	Very high	92.5	Very high	126 Å²	126	33 Å²	33	55%	0.548	17%	0.171	S	C	.	.			trans	-52.4	124	176.7	-177	174.1	-154.6	134	0	110.9	A625 E626 T635	A625-K629 PolarHBondContact O-N 3.2Å; E626-K629 WeakPolarHBondContact O-CB 3.36Å; E626-K629 PolarHBondContact O-N 3.17Å; E626-K629 VanDerWaalsContact O-N 3.12Å; E626-K629 IonicContact OE2-NZ 2.71Å; E626-K629 PolarHBondContact OE2-NZ 3.28Å; K629-T635 HydrophobicContact CB-CG2 3.98Å; K629-T635 HydrophobicContact CD-CG2 4.39Å; K629-T635 HydrophobicContact CG-CG2 3.74Å
630	P	86.8	Confident	92.4	Very high	39 Å²	39	33.2 Å²	33.2	25%	0.253	17%	0.172	S	C	.	.			trans	-73.7	158.2	-179.1	32.4	-36.3	0	0	0	111.2	Y632	P630-Y632 WeakPolarHBondContact CB-O 3.31Å; P630-Y632 WeakPolarHBondContact CG-O 3.45Å; P630-Y632 PolarHBondContact O-N 2.9Å
631	D	83.7	Confident	92.3	Very high	71 Å²	71	34.7 Å²	34.7	38%	0.38	18%	0.182	S	C	.	.	S	Bend	trans	-60.9	-30.6	170.9	-71.7	-26.3	0	0	0	111	I943 K944	D631-I943 HydrophobicContact CB-CG1 4.41Å; D631-K944 IonicContact OD1-NZ 3.54Å; D631-K944 PolarHBondContact OD1-NZ 3.2Å; D631-K944 IonicContact OD2-NZ 2.69Å; D631-K944 PolarHBondContact OD2-NZ 3.41Å
632	Y	86.8	Confident	92.3	Very high	90 Å²	90	39.6 Å²	39.6	35%	0.353	20%	0.202	S	C	.	.	S	Bend	trans	-143.3	139.4	174.4	-177.9	-85.1	0	0	0	111.3	P630 P941 L975 H977	P630-Y632 WeakPolarHBondContact CB-O 3.31Å; P630-Y632 WeakPolarHBondContact CG-O 3.45Å; P630-Y632 PolarHBondContact O-N 2.9Å; Y632-P941 HydrophobicContact CD1-CG 4.33Å; Y632-P941 HydrophobicContact CG-CG 4.29Å; Y632-L975 PolarHBondContact OH-O 3.45Å; Y632-H977 AromaticContact CD1-NE2 3.81Å; Y632-H977 AromaticContact CE1-CD2 3.29Å; Y632-H977 WeakPolarHBondContact CE1-CD2 3.42Å; Y632-H977 AromaticContact CE1-CE1 3.78Å; Y632-H977 AromaticContact CE1-NE2 3.1Å; Y632-H977 WeakPolarHBondContact CE1-NE2 3.47Å; Y632-H977 AromaticContact CZ-CD2 3.29Å; Y632-H977 AromaticContact CZ-NE2 3.62Å; Y632-H977 PolarHBondContact OH-CD2 3.19Å; Y632-H977 VanDerWaalsContact OH-CD2 3.32Å
633	G	87.8	Confident	92.2	Very high	43 Å²	43	39.8 Å²	39.8	44%	0.443	20%	0.203	S	C	.	.	S	Bend	trans	113.4	-171.2	178.7	0	0	0	0	0	113.4
634	D	92.8	Very high	92.2	Very high	37 Å²	37	39.7 Å²	39.7	20%	0.198	20%	0.202	C	C	.	.			trans	-95	147.2	-179	-79.9	-52.5	0	0	0	113.4	V546 T638 F639 K642	V546-D634 HydrophobicContact CG2-CB 4.25Å; V546-D634 WeakPolarHBondContact CG2-O 3.45Å; D634-T638 WeakPolarHBondContact CA-OG1 3.36Å; D634-T638 WeakPolarHBondContact CB-OG1 3.46Å; D634-T638 WeakPolarHBondContact OD1-CB 3.43Å; D634-T638 PolarHBondContact OD1-OG1 3.44Å; D634-F639 HydrophobicContact CB-CB 4.11Å; D634-K642 VanDerWaalsContact OD1-CE 3.3Å; D634-K642 WeakPolarHBondContact OD1-CE 3.31Å; D634-K642 IonicContact OD1-NZ 3.58Å; D634-K642 PolarHBondContact OD1-NZ 2.99Å; D634-K642 WeakPolarHBondContact OD2-CD 3.42Å; D634-K642 IonicContact OD2-NZ 3.62Å; D634-K642 PolarHBondContact OD2-NZ 3.38Å
635	T	95.9	Very high	92.2	Very high	4 Å²	4	42.4 Å²	42.4	3%	0.025	22%	0.222	C	C	.	.			trans	-86.2	169.3	159.6	68.2	0	0	0	0	109.9	V546 E626 K629 A637 T638 F639	V546-T635 WeakPolarHBondContact CG2-O 3.25Å; E626-T635 WeakPolarHBondContact OE1-CB 3.12Å; E626-T635 VanDerWaalsContact OE1-CG2 3.31Å; E626-T635 WeakPolarHBondContact OE1-CG2 3.31Å; E626-T635 PolarHBondContact OE1-OG1 2.98Å; K629-T635 HydrophobicContact CB-CG2 3.98Å; K629-T635 HydrophobicContact CD-CG2 4.39Å; K629-T635 HydrophobicContact CG-CG2 3.74Å; T635-A637 PolarHBondContact O-N 2.95Å; T635-A637 PolarHBondContact OG1-N 3.12Å; T635-T638 PolarHBondContact N-OG1 2.94Å; T635-T638 PolarHBondContact O-N 2.85Å; T635-T638 PolarHBondContact O-OG1 3.22Å; T635-T638 PolarHBondContact OG1-N 2.93Å; T635-T638 PolarHBondContact OG1-OG1 3.48Å; T635-F639 VanDerWaalsContact O-CB 3.24Å; T635-F639 WeakPolarHBondContact O-CB 3.45Å; T635-F639 PolarHBondContact O-N 3.49Å
636	V	97.2	Very high	92.2	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-57.4	-38.1	174.8	-178.5	0	0	0	0	111.3	F549 V619 L622 A625 I640	F549-V636 HydrophobicContact CB-CG2 4.49Å; F549-V636 HydrophobicContact CD2-CG1 4.03Å; F549-V636 HydrophobicContact CE2-CG1 4.15Å; F549-V636 HydrophobicContact CG-CG1 4.29Å; F549-V636 HydrophobicContact CZ-CG1 4.5Å; V619-V636 HydrophobicContact CG1-CG1 4.21Å; L622-V636 HydrophobicContact CD2-CB 4.3Å; L622-V636 HydrophobicContact CD2-CG1 3.82Å; A625-V636 HydrophobicContact CB-CB 4.07Å; A625-V636 HydrophobicContact CB-CG2 4.04Å; V636-I640 HydrophobicContact CG1-CD1 3.82Å; V636-I640 WeakPolarHBondContact O-CB 3.24Å; V636-I640 WeakPolarHBondContact O-CD1 3.49Å; V636-I640 WeakPolarHBondContact O-CG1 3.3Å; V636-I640 PolarHBondContact O-N 3.13Å
637	A	96	Very high	92.2	Very high	1 Å²	1	47.8 Å²	47.8	1%	0.008	25%	0.245	C	C	.	.	H	α-helix	trans	-66.9	-49.9	177.4	0	0	0	0	0	112.4	L622 T635 F639 I640 T641 I664	L622-A637 HydrophobicContact CB-CB 4.49Å; L622-A637 HydrophobicContact CD1-CB 4.35Å; T635-A637 PolarHBondContact O-N 2.95Å; T635-A637 PolarHBondContact OG1-N 3.12Å; A637-F639 PolarHBondContact O-N 2.7Å; A637-I640 PolarHBondContact O-N 3.05Å; A637-T641 PolarHBondContact O-N 3.09Å; A637-T641 PolarHBondContact O-OG1 2.77Å; A637-T641 VanDerWaalsContact O-OG1 3.13Å; A637-I664 HydrophobicContact CB-CD1 4.39Å; A637-I664 HydrophobicContact CB-CG1 4.36Å
638	T	95.8	Very high	92.4	Very high	49 Å²	49	42.8 Å²	42.8	30%	0.301	23%	0.225	S	C	.	.	H	α-helix	trans	-69	-33.6	-179.4	62.8	0	0	0	0	112.5	D634 T635 T641 K642	D634-T638 WeakPolarHBondContact CA-OG1 3.36Å; D634-T638 WeakPolarHBondContact CB-OG1 3.46Å; D634-T638 WeakPolarHBondContact OD1-CB 3.43Å; D634-T638 PolarHBondContact OD1-OG1 3.44Å; T635-T638 PolarHBondContact N-OG1 2.94Å; T635-T638 PolarHBondContact O-N 2.85Å; T635-T638 PolarHBondContact O-OG1 3.22Å; T635-T638 PolarHBondContact OG1-N 2.93Å; T635-T638 PolarHBondContact OG1-OG1 3.48Å; T638-T641 PolarHBondContact O-N 2.71Å; T638-K642 WeakPolarHBondContact O-CG 3.38Å; T638-K642 PolarHBondContact O-N 3.4Å
639	F	97.4	Very high	92.5	Very high	1 Å²	1	47.6 Å²	47.6	0%	0.004	25%	0.248	C	C	.	.	H	α-helix	trans	-59.5	-50.4	170.7	176.3	-101.3	0	0	0	111.7	V546 F549 V550 P589 I590 F593 D634 T635 A637 T641 K642 I643	V546-F639 HydrophobicContact CG1-CB 3.9Å; V546-F639 HydrophobicContact CG1-CD1 3.93Å; V546-F639 HydrophobicContact CG1-CD2 3.4Å; V546-F639 VanDerWaalsContact CG1-CD2 3.4Å; V546-F639 HydrophobicContact CG1-CE1 4.31Å; V546-F639 HydrophobicContact CG1-CE2 3.81Å; V546-F639 HydrophobicContact CG1-CG 3.45Å; V546-F639 VanDerWaalsContact CG1-CG 3.45Å; V546-F639 HydrophobicContact CG1-CZ 4.25Å; V546-F639 HydrophobicContact CG2-CB 3.89Å; V546-F639 HydrophobicContact CG2-CG 4.36Å; F549-F639 HydrophobicContact CD1-CD1 4.14Å; F549-F639 HydrophobicContact CD1-CE1 4.06Å; F549-F639 HydrophobicContact CE1-CD1 4.02Å; F549-F639 AromaticContact CE1-CE1 3.88Å; F549-F639 HydrophobicContact CE1-CE1 3.88Å; V550-F639 HydrophobicContact CG2-CE1 3.87Å; V550-F639 HydrophobicContact CG2-CE2 4.32Å; V550-F639 HydrophobicContact CG2-CZ 3.56Å; P589-F639 HydrophobicContact CB-CE2 3.91Å; P589-F639 HydrophobicContact CB-CZ 4.5Å; P589-F639 HydrophobicContact CG-CE2 4.33Å; I590-F639 HydrophobicContact CB-CE2 4.43Å; I590-F639 HydrophobicContact CG1-CD2 4Å; I590-F639 HydrophobicContact CG1-CE2 3.65Å; F593-F639 HydrophobicContact CB-CZ 3.96Å; F593-F639 HydrophobicContact CG-CZ 4.33Å; D634-F639 HydrophobicContact CB-CB 4.11Å; T635-F639 VanDerWaalsContact O-CB 3.24Å; T635-F639 WeakPolarHBondContact O-CB 3.45Å; T635-F639 PolarHBondContact O-N 3.49Å; A637-F639 PolarHBondContact O-N 2.7Å; F639-T641 VanDerWaalsContact C-N 3.32Å; F639-T641 PolarHBondContact O-N 3.1Å; F639-K642 PolarHBondContact O-N 2.77Å; F639-I643 HydrophobicContact CD1-CG2 4.27Å; F639-I643 HydrophobicContact CE1-CG2 3.98Å; F639-I643 HydrophobicContact CE2-CD1 4.4Å; F639-I643 HydrophobicContact CZ-CD1 3.89Å; F639-I643 HydrophobicContact CZ-CG2 4.31Å; F639-I643 WeakPolarHBondContact O-CG2 3.42Å; F639-I643 PolarHBondContact O-N 3.06Å
640	I	96.7	Very high	92.6	Very high	4 Å²	4	42.2 Å²	42.2	2%	0.021	22%	0.224	C	C	.	.	H	α-helix	trans	-56.9	-47.1	177	-70.4	163.4	0	0	0	110	F549 V619 L622 V636 A637 K642 I643 I644 L653 L668	F549-I640 HydrophobicContact CZ-CD1 4.39Å; F549-I640 HydrophobicContact CZ-CG1 4.44Å; V619-I640 HydrophobicContact CG1-CD1 4.46Å; L622-I640 HydrophobicContact CD2-CD1 3.99Å; V636-I640 HydrophobicContact CG1-CD1 3.82Å; V636-I640 WeakPolarHBondContact O-CB 3.24Å; V636-I640 WeakPolarHBondContact O-CD1 3.49Å; V636-I640 WeakPolarHBondContact O-CG1 3.3Å; V636-I640 PolarHBondContact O-N 3.13Å; A637-I640 PolarHBondContact O-N 3.05Å; I640-K642 VanDerWaalsContact C-N 3.32Å; I640-K642 PolarHBondContact O-N 3.4Å; I640-I643 PolarHBondContact O-N 2.89Å; I640-I644 VanDerWaalsContact O-CB 3.28Å; I640-I644 WeakPolarHBondContact O-CB 3.17Å; I640-I644 WeakPolarHBondContact O-CG2 3.16Å; I640-I644 PolarHBondContact O-N 3.45Å; I640-L653 HydrophobicContact CD1-CD2 4.11Å; I640-L653 HydrophobicContact CG1-CD2 4.26Å; I640-L653 HydrophobicContact CG2-CD2 3.47Å; I640-L653 VanDerWaalsContact CG2-CD2 3.47Å; I640-L668 HydrophobicContact CB-CD2 4.49Å; I640-L668 HydrophobicContact CG2-CD2 3.72Å
641	T	95.2	Very high	92.9	Very high	35 Å²	35	40.4 Å²	40.4	22%	0.215	21%	0.212	C	C	.	.	H	α-helix	trans	-55.3	-42.7	176.9	-62.2	0	0	0	0	112.9	A637 T638 F639 L667 L668	A637-T641 PolarHBondContact O-N 3.09Å; A637-T641 PolarHBondContact O-OG1 2.77Å; A637-T641 VanDerWaalsContact O-OG1 3.13Å; T638-T641 PolarHBondContact O-N 2.71Å; F639-T641 VanDerWaalsContact C-N 3.32Å; F639-T641 PolarHBondContact O-N 3.1Å; T641-L667 HydrophobicContact CG2-CB 3.5Å; T641-L667 VanDerWaalsContact CG2-CB 3.5Å; T641-L667 HydrophobicContact CG2-CD1 4.13Å; T641-L667 HydrophobicContact CG2-CG 4.48Å; T641-L668 VanDerWaalsContact OG1-CD2 3.28Å; T641-L668 WeakPolarHBondContact OG1-CD2 3.39Å
642	K	95.1	Very high	93.4	Very high	114 Å²	114	37.4 Å²	37.4	50%	0.496	20%	0.196	S	C	.	.	H	α-helix	trans	-65.8	-44.8	176.7	-71.5	172.4	178.4	174.5	0	112.1	I590 D634 T638 F639 I640 S645	I590-K642 HydrophobicContact CD1-CD 4.19Å; D634-K642 VanDerWaalsContact OD1-CE 3.3Å; D634-K642 WeakPolarHBondContact OD1-CE 3.31Å; D634-K642 IonicContact OD1-NZ 3.58Å; D634-K642 PolarHBondContact OD1-NZ 2.99Å; D634-K642 WeakPolarHBondContact OD2-CD 3.42Å; D634-K642 IonicContact OD2-NZ 3.62Å; D634-K642 PolarHBondContact OD2-NZ 3.38Å; T638-K642 WeakPolarHBondContact O-CG 3.38Å; T638-K642 PolarHBondContact O-N 3.4Å; F639-K642 PolarHBondContact O-N 2.77Å; I640-K642 VanDerWaalsContact C-N 3.32Å; I640-K642 PolarHBondContact O-N 3.4Å; K642-S645 PolarHBondContact O-OG 2.93Å; K642-S645 VanDerWaalsContact O-OG 3.08Å
643	I	95.1	Very high	93.9	Very high	4 Å²	4	33.2 Å²	33.2	2%	0.021	18%	0.179	C	C	.	.	H	α-helix	trans	-91.9	-19.2	-168.5	-157.8	160	0	0	0	115	I590 F593 R594 L598 F639 I640 S645 K646 F647	I590-I643 HydrophobicContact CG2-CD1 4.46Å; F593-I643 HydrophobicContact CB-CD1 3.81Å; F593-I643 HydrophobicContact CD1-CD1 3.58Å; F593-I643 HydrophobicContact CD1-CG1 4.41Å; F593-I643 HydrophobicContact CG-CD1 4.04Å; R594-I643 HydrophobicContact CB-CD1 4.5Å; L598-I643 HydrophobicContact CD1-CD1 4.41Å; L598-I643 HydrophobicContact CD1-CG1 4.14Å; F639-I643 HydrophobicContact CD1-CG2 4.27Å; F639-I643 HydrophobicContact CE1-CG2 3.98Å; F639-I643 HydrophobicContact CE2-CD1 4.4Å; F639-I643 HydrophobicContact CZ-CD1 3.89Å; F639-I643 HydrophobicContact CZ-CG2 4.31Å; F639-I643 WeakPolarHBondContact O-CG2 3.42Å; F639-I643 PolarHBondContact O-N 3.06Å; I640-I643 PolarHBondContact O-N 2.89Å; I643-S645 PolarHBondContact O-N 3.28Å; I643-S645 VanDerWaalsContact O-N 3.08Å; I643-K646 WeakPolarHBondContact O-CB 3.4Å; I643-K646 PolarHBondContact O-N 3.37Å; I643-F647 HydrophobicContact CG2-CE2 4Å
644	I	93.4	Very high	94.3	Very high	6 Å²	6	31.2 Å²	31.2	3%	0.031	16%	0.158	C	C	.	.	G	3₁₀ helix	trans	-60	-24.3	-179.9	-163.9	62.7	0	0	0	112.7	R449 I640 K646 F647 F670	R449-I644 HydrophobicContact CB-CD1 3.94Å; R449-I644 HydrophobicContact CB-CG1 4.09Å; R449-I644 WeakPolarHBondContact CD-O 3.45Å; R449-I644 PolarHBondContact NH1-O 3.45Å; I640-I644 VanDerWaalsContact O-CB 3.28Å; I640-I644 WeakPolarHBondContact O-CB 3.17Å; I640-I644 WeakPolarHBondContact O-CG2 3.16Å; I640-I644 PolarHBondContact O-N 3.45Å; I644-K646 PolarHBondContact O-N 2.86Å; I644-K646 VanDerWaalsContact O-N 3.16Å; I644-F647 HydrophobicContact CD1-CB 4.07Å; I644-F647 HydrophobicContact CD1-CD1 4.06Å; I644-F647 HydrophobicContact CD1-CD2 4.16Å; I644-F647 HydrophobicContact CD1-CG 3.84Å; I644-F647 PolarHBondContact O-N 2.54Å; I644-F670 HydrophobicContact CD1-CE1 3.75Å; I644-F670 HydrophobicContact CD1-CZ 3.65Å; I644-F670 HydrophobicContact CG1-CE1 3.68Å; I644-F670 HydrophobicContact CG1-CZ 3.81Å
645	S	91.4	Very high	94.6	Very high	67 Å²	67	29.4 Å²	29.4	47%	0.469	15%	0.149	S	C	.	.	G	3₁₀ helix	trans	-55.4	-26	169.6	66.8	0	0	0	0	113.8	R449 K642 I643	R449-S645 PolarHBondContact NH1-O 3.01Å; K642-S645 PolarHBondContact O-OG 2.93Å; K642-S645 VanDerWaalsContact O-OG 3.08Å; I643-S645 PolarHBondContact O-N 3.28Å; I643-S645 VanDerWaalsContact O-N 3.08Å
646	K	93.2	Very high	94.7	Very high	132 Å²	132	29.2 Å²	29.2	57%	0.574	15%	0.148	S	C	*	.	G	3₁₀ helix	trans	-104.3	-4.6	-177.2	-51.5	-56	178	-177.8	0	114.7	L598 I643 I644	L598-K646 HydrophobicContact CD1-CB 4.1Å; I643-K646 WeakPolarHBondContact O-CB 3.4Å; I643-K646 PolarHBondContact O-N 3.37Å; I644-K646 PolarHBondContact O-N 2.86Å; I644-K646 VanDerWaalsContact O-N 3.16Å
647	F	92.9	Very high	94.6	Very high	15 Å²	15	29.2 Å²	29.2	7%	0.066	15%	0.148	C	C	.	.	S	Bend	trans	-67.9	137.5	178	-89.6	-126.4	0	0	0	111.3	F593 L598 I617 I643 I644 L651	F593-F647 HydrophobicContact CD1-CE2 4.39Å; F593-F647 AromaticContact CE1-CE2 3.55Å; F593-F647 HydrophobicContact CE1-CE2 3.55Å; F593-F647 AromaticContact CE1-CZ 3.57Å; F593-F647 HydrophobicContact CE1-CZ 3.57Å; F593-F647 HydrophobicContact CZ-CE2 4.24Å; F593-F647 AromaticContact CZ-CZ 3.79Å; F593-F647 HydrophobicContact CZ-CZ 3.79Å; L598-F647 HydrophobicContact CD1-CD2 3.82Å; L598-F647 HydrophobicContact CD1-CE2 4Å; L598-F647 HydrophobicContact CD2-CD2 4.02Å; L598-F647 HydrophobicContact CD2-CE2 4.12Å; L598-F647 HydrophobicContact CD2-CG 4.23Å; L598-F647 HydrophobicContact CD2-CZ 4.44Å; I617-F647 HydrophobicContact CD1-CE1 4.47Å; I643-F647 HydrophobicContact CG2-CE2 4Å; I644-F647 HydrophobicContact CD1-CB 4.07Å; I644-F647 HydrophobicContact CD1-CD1 4.06Å; I644-F647 HydrophobicContact CD1-CD2 4.16Å; I644-F647 HydrophobicContact CD1-CG 3.84Å; I644-F647 PolarHBondContact O-N 2.54Å; F647-L651 HydrophobicContact CD1-CB 4.41Å; F647-L651 HydrophobicContact CD1-CD2 4.04Å; F647-L651 HydrophobicContact CD1-CG 4.12Å; F647-L651 HydrophobicContact CE1-CD2 4.03Å; F647-L651 HydrophobicContact CE1-CG 4.24Å
648	P	91.1	Very high	94.5	Very high	25 Å²	25	30.8 Å²	30.8	16%	0.162	15%	0.153	C	C	.	.			trans	-70.2	146.1	170.8	31.1	-33.9	0	0	0	110.2	W650 L651	P648-W650 HydrophobicContact CB-CD2 4.46Å; P648-W650 HydrophobicContact CB-CZ2 4.36Å; P648-W650 HydrophobicContact CG-CD2 4.29Å; P648-W650 HydrophobicContact CG-CH2 4.41Å; P648-W650 HydrophobicContact CG-CZ2 3.88Å; P648-W650 PolarHBondContact O-N 2.85Å; P648-L651 HydrophobicContact CG-CB 3.84Å; P648-L651 PolarHBondContact O-N 3.47Å
649	H	88.2	Confident	94.4	Very high	137 Å²	137	30.6 Å²	30.6	63%	0.634	15%	0.152	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60	-19.7	-172	65.5	79.2	0	0	0	115.3	K652	H649-K652 WeakPolarHBondContact O-CE 3.23Å; H649-K652 PolarHBondContact O-NZ 2.88Å
650	W	91.8	Very high	94	Very high	12 Å²	12	34 Å²	34	5%	0.045	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.5	-13.2	178.5	57.6	-102.6	0	0	0	113.6	L601 R605 L610 D614 Y615 P648	L601-W650 HydrophobicContact CB-CH2 4.1Å; R605-W650 HydrophobicContact CB-CZ2 3.98Å; R605-W650 HydrophobicContact CG-CZ2 4.22Å; L610-W650 HydrophobicContact CD1-CH2 4.41Å; D614-W650 CarbonylContact C-O 3.57Å; D614-W650 WeakPolarHBondContact CA-O 3.43Å; D614-W650 VanDerWaalsContact OD1-CA 3.23Å; D614-W650 WeakPolarHBondContact OD1-CA 3.41Å; D614-W650 VanDerWaalsContact OD1-CB 3.3Å; D614-W650 WeakPolarHBondContact OD1-CB 3.45Å; Y615-W650 HydrophobicContact CD2-CE3 4.13Å; Y615-W650 AromaticContact CD2-CZ3 3.85Å; Y615-W650 HydrophobicContact CD2-CZ3 3.85Å; Y615-W650 PolarHBondContact N-O 2.67Å; P648-W650 HydrophobicContact CB-CD2 4.46Å; P648-W650 HydrophobicContact CB-CZ2 4.36Å; P648-W650 HydrophobicContact CG-CD2 4.29Å; P648-W650 HydrophobicContact CG-CH2 4.41Å; P648-W650 HydrophobicContact CG-CZ2 3.88Å; P648-W650 PolarHBondContact O-N 2.85Å
651	L	94	Very high	93.8	Very high	1 Å²	1	37.5 Å²	37.5	1%	0.005	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	95.5	175.9	-172.3	62.3	0	0	0	108.9	V531 L598 Y615 I617 F647 P648	V531-L651 HydrophobicContact CG2-CD1 4.4Å; L598-L651 HydrophobicContact CD2-CD2 4.02Å; Y615-L651 CarbonylContact O-C 3.54Å; Y615-L651 WeakPolarHBondContact O-CA 3.38Å; I617-L651 HydrophobicContact CD1-CD1 4.02Å; I617-L651 HydrophobicContact CD1-CD2 4.15Å; I617-L651 HydrophobicContact CD1-CG 4.23Å; I617-L651 HydrophobicContact CG1-CD1 3.99Å; F647-L651 HydrophobicContact CD1-CB 4.41Å; F647-L651 HydrophobicContact CD1-CD2 4.04Å; F647-L651 HydrophobicContact CD1-CG 4.12Å; F647-L651 HydrophobicContact CE1-CD2 4.03Å; F647-L651 HydrophobicContact CE1-CG 4.24Å; P648-L651 HydrophobicContact CG-CB 3.84Å; P648-L651 PolarHBondContact O-N 3.47Å
652	K	94.4	Very high	93.8	Very high	9 Å²	9	38.5 Å²	38.5	4%	0.039	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	147.7	-177.1	-48.9	-59.4	-167.9	-175.1	0	111.3	L440 G448 R449 D614 Y615 I616 I617 H649	L440-K652 HydrophobicContact CD2-CB 4.06Å; L440-K652 HydrophobicContact CD2-CG 4.28Å; G448-K652 VanDerWaalsContact O-CD 3.28Å; G448-K652 WeakPolarHBondContact O-CD 3.25Å; G448-K652 PolarHBondContact O-NZ 3.18Å; R449-K652 WeakPolarHBondContact O-CA 3.44Å; D614-K652 WeakPolarHBondContact OD2-CE 3.4Å; D614-K652 IonicContact OD2-NZ 3.8Å; Y615-K652 PolarHBondContact O-N 3.08Å; I616-K652 WeakPolarHBondContact CA-O 3.2Å; I616-K652 HydrophobicContact CG1-CB 4.39Å; I617-K652 PolarHBondContact N-O 3.36Å; H649-K652 WeakPolarHBondContact O-CE 3.23Å; H649-K652 PolarHBondContact O-NZ 2.88Å
653	L	96.4	Very high	93.7	Very high	2 Å²	2	40.4 Å²	40.4	1%	0.01	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	126.9	172.6	-162.6	68.5	0	0	0	110.5	R449 G450 A451 I617 V619 I640 V655 F670	R449-L653 PolarHBondContact O-N 3.45Å; G450-L653 CarbonylContact C-O 3.58Å; G450-L653 WeakPolarHBondContact CA-O 3.4Å; A451-L653 PolarHBondContact N-O 3.3Å; I617-L653 HydrophobicContact CB-CD1 3.7Å; I617-L653 HydrophobicContact CG2-CD1 3.71Å; I617-L653 WeakPolarHBondContact O-CA 3.49Å; V619-L653 HydrophobicContact CG2-CD1 3.78Å; V619-L653 HydrophobicContact CG2-CG 4.45Å; I640-L653 HydrophobicContact CD1-CD2 4.11Å; I640-L653 HydrophobicContact CG1-CD2 4.26Å; I640-L653 HydrophobicContact CG2-CD2 3.47Å; I640-L653 VanDerWaalsContact CG2-CD2 3.47Å; L653-V655 HydrophobicContact CD2-CG1 3.72Å; L653-V655 HydrophobicContact CG-CG1 3.76Å; L653-F670 HydrophobicContact CB-CE2 4.28Å; L653-F670 HydrophobicContact CB-CZ 3.86Å; L653-F670 HydrophobicContact CD2-CE2 4.01Å; L653-F670 HydrophobicContact CD2-CZ 3.85Å; L653-F670 HydrophobicContact CG-CE2 4.48Å; L653-F670 HydrophobicContact CG-CZ 4.38Å
654	V	97.6	Very high	93.7	Very high	0 Å²	0	42 Å²	42	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	116	169.7	-178	0	0	0	0	108.2	L436 L440 I453 I465 I616 I617 L618 V619	L436-V654 HydrophobicContact CD1-CG1 4.17Å; L436-V654 HydrophobicContact CD1-CG2 4.1Å; L436-V654 HydrophobicContact CD2-CG1 4.2Å; L436-V654 HydrophobicContact CD2-CG2 4.44Å; L440-V654 HydrophobicContact CD1-CG2 3.99Å; L440-V654 HydrophobicContact CD2-CG2 4.35Å; I453-V654 HydrophobicContact CD1-CG1 3.89Å; I453-V654 HydrophobicContact CG1-CG1 4.22Å; I465-V654 HydrophobicContact CD1-CG1 4.28Å; I616-V654 HydrophobicContact CG2-CG2 3.93Å; I617-V654 PolarHBondContact O-N 3.13Å; L618-V654 WeakPolarHBondContact CA-O 3.39Å; L618-V654 HydrophobicContact CD2-CB 3.86Å; L618-V654 HydrophobicContact CD2-CG2 4.3Å; V619-V654 PolarHBondContact N-O 3.42Å
655	V	97.8	Very high	93.7	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	151.7	-178	-52	0	0	0	0	111.1	A451 V452 I453 V619 L622 L653 L668 F670	A451-V655 PolarHBondContact O-N 3.15Å; V452-V655 WeakPolarHBondContact CA-O 3.3Å; V452-V655 HydrophobicContact CB-CG2 4.18Å; V452-V655 HydrophobicContact CG1-CG2 4.16Å; V452-V655 HydrophobicContact CG2-CG2 3.79Å; I453-V655 PolarHBondContact N-O 3.24Å; V619-V655 HydrophobicContact CB-CG1 4.23Å; V619-V655 CarbonylContact O-C 3.29Å; V619-V655 VanDerWaalsContact O-CA 3.26Å; V619-V655 WeakPolarHBondContact O-CA 3.31Å; L622-V655 HydrophobicContact CD1-CB 3.81Å; L622-V655 HydrophobicContact CD1-CG1 4.22Å; L622-V655 HydrophobicContact CD1-CG2 4Å; L622-V655 HydrophobicContact CG-CB 4.37Å; L653-V655 HydrophobicContact CD2-CG1 3.72Å; L653-V655 HydrophobicContact CG-CG1 3.76Å; V655-L668 HydrophobicContact CG2-CD1 4.23Å; V655-F670 HydrophobicContact CG1-CE2 4.04Å; V655-F670 HydrophobicContact CG2-CD2 4.13Å; V655-F670 HydrophobicContact CG2-CE2 4.26Å
656	T	97.6	Very high	93.7	Very high	0 Å²	0	44 Å²	44	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	146.4	173.4	89.1	0	0	0	0	112	I453 K461 I465 V619 D620 S621 L622	I453-T656 HydrophobicContact CB-CG2 4.12Å; I453-T656 HydrophobicContact CD1-CG2 4.44Å; I453-T656 WeakPolarHBondContact O-CA 3.17Å; K461-T656 HydrophobicContact CB-CG2 4.43Å; I465-T656 HydrophobicContact CD1-CG2 3.7Å; I465-T656 HydrophobicContact CG1-CG2 3.46Å; I465-T656 VanDerWaalsContact CG1-CG2 3.46Å; V619-T656 PolarHBondContact O-N 2.97Å; D620-T656 VanDerWaalsContact CG-OG1 3.31Å; D620-T656 VanDerWaalsContact OD1-CG2 3.31Å; D620-T656 WeakPolarHBondContact OD1-CG2 3.33Å; D620-T656 PolarHBondContact OD1-OG1 3.11Å; S621-T656 WeakPolarHBondContact CA-O 3.27Å; S621-T656 PolarHBondContact N-O 2.98Å; S621-T656 PolarHBondContact N-OG1 3.01Å; L622-T656 PolarHBondContact N-O 3.1Å
657	V	96.3	Very high	93.6	Very high	0 Å²	0	44 Å²	44	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	153.6	-176.2	72.1	0	0	0	0	111.3	V452 I453 V454 G455 K461 N623 L661 V662 I664 T665	V452-V657 HydrophobicContact CG1-CG1 3.72Å; I453-V657 PolarHBondContact O-N 3.32Å; V454-V657 HydrophobicContact CB-CG1 4.44Å; V454-V657 HydrophobicContact CG1-CG1 4.4Å; V454-V657 HydrophobicContact CG2-CG1 3.98Å; G455-V657 PolarHBondContact N-O 3.12Å; G455-V657 VanDerWaalsContact N-O 3.17Å; K461-V657 VanDerWaalsContact CD-O 3.26Å; K461-V657 WeakPolarHBondContact CD-O 3.2Å; K461-V657 WeakPolarHBondContact CE-O 3.24Å; N623-V657 HydrophobicContact CB-CG2 4.32Å; V657-L661 WeakPolarHBondContact CG2-O 3.44Å; V657-V662 HydrophobicContact CG1-CG2 4.41Å; V657-I664 HydrophobicContact CG2-CD1 3.83Å; V657-I664 HydrophobicContact CG2-CG1 4.01Å; V657-T665 HydrophobicContact CB-CG2 4.13Å; V657-T665 HydrophobicContact CG1-CG2 4.06Å; V657-T665 HydrophobicContact CG2-CG2 4.26Å
658	R	93.6	Very high	93.5	Very high	33 Å²	33	43.8 Å²	43.8	13%	0.125	25%	0.246	C	C	.	.			trans	-77.8	142.8	169.4	-70.8	179.5	-167.4	-150.6	24.4	111.8	G455 N623 E624 G660 L661 V662 E849	G455-R658 WeakPolarHBondContact O-CA 3.47Å; N623-R658 HydrophobicContact CB-CB 4.37Å; N623-R658 WeakPolarHBondContact ND2-CD 3.4Å; N623-R658 PolarHBondContact ND2-NE 2.84Å; N623-R658 VanDerWaalsContact ND2-NE 3.2Å; N623-R658 PolarHBondContact OD1-N 3.3Å; N623-R658 VanDerWaalsContact OD1-N 3.09Å; E624-R658 IonicContact OE1-CZ 3.59Å; E624-R658 IonicContact OE1-NE 2.89Å; E624-R658 PolarHBondContact OE1-NE 3.43Å; E624-R658 IonicContact OE1-NH2 2.7Å; E624-R658 PolarHBondContact OE1-NH2 2.91Å; R658-G660 PolarHBondContact O-N 3.31Å; R658-L661 CarbonylContact O-C 3.6Å; R658-L661 VanDerWaalsContact O-C 3.31Å; R658-L661 WeakPolarHBondContact O-CA 3.29Å; R658-L661 PolarHBondContact O-N 2.86Å; R658-V662 PolarHBondContact O-N 2.67Å; R658-V662 VanDerWaalsContact O-N 3.15Å; R658-E849 IonicContact CZ-OE1 3.85Å; R658-E849 IonicContact CZ-OE2 2.7Å; R658-E849 IonicContact NH1-OE1 3.69Å; R658-E849 PolarHBondContact NH1-OE1 3.35Å; R658-E849 IonicContact NH1-OE2 3.55Å; R658-E849 PolarHBondContact NH1-OE2 3.24Å; R658-E849 IonicContact NH2-OE1 3.56Å; R658-E849 PolarHBondContact NH2-OE1 2.8Å; R658-E849 IonicContact NH2-OE2 2.65Å
659	T	92.6	Very high	93.4	Very high	45 Å²	45	45 Å²	45	28%	0.276	25%	0.254	S	S	.	.	G	3₁₀ helix	trans	-57.8	-44	-175.8	-47.5	0	0	0	0	113.1	V454 G455 N456 L661 V662 D676	V454-T659 HydrophobicContact CG1-CG2 4.17Å; G455-T659 WeakPolarHBondContact CA-OG1 3.4Å; G455-T659 PolarHBondContact N-OG1 3.09Å; G455-T659 PolarHBondContact O-N 3.06Å; N456-T659 PolarHBondContact N-OG1 3.36Å; T659-L661 PolarHBondContact O-N 3.03Å; T659-L661 VanDerWaalsContact O-N 3.07Å; T659-V662 WeakPolarHBondContact O-CB 3.5Å; T659-V662 WeakPolarHBondContact O-CG1 3.24Å; T659-V662 PolarHBondContact O-N 2.85Å; T659-D676 PolarHBondContact OG1-OD2 3.45Å
660	G	90.7	Very high	93.5	Very high	74 Å²	74	39.7 Å²	39.7	76%	0.763	23%	0.229	S	C	*	.	G	3₁₀ helix	trans	-68.8	1.7	174.4	0	0	0	0	0	115.8	R658	R658-G660 PolarHBondContact O-N 3.31Å
661	L	92.4	Very high	93.4	Very high	77 Å²	77	41 Å²	41	40%	0.403	24%	0.243	S	C	.	.	G	3₁₀ helix	trans	-134.3	22.8	173.9	-76.9	169	0	0	0	111.4	N623 V657 R658 T659 E663 I664	N623-L661 HydrophobicContact CB-CB 4.13Å; N623-L661 HydrophobicContact CB-CD1 3.7Å; V657-L661 WeakPolarHBondContact CG2-O 3.44Å; R658-L661 CarbonylContact O-C 3.6Å; R658-L661 VanDerWaalsContact O-C 3.31Å; R658-L661 WeakPolarHBondContact O-CA 3.29Å; R658-L661 PolarHBondContact O-N 2.86Å; T659-L661 PolarHBondContact O-N 3.03Å; T659-L661 VanDerWaalsContact O-N 3.07Å; L661-E663 PolarHBondContact O-N 2.94Å; L661-I664 WeakPolarHBondContact O-CG1 3.38Å; L661-I664 PolarHBondContact O-N 3.49Å
662	V	93.7	Very high	93.2	Very high	55 Å²	55	43.9 Å²	43.9	33%	0.333	27%	0.272	S	S	.	.	G	3₁₀ helix	trans	-60.8	-26.3	-179.9	68.8	0	0	0	0	112.7	V454 V657 R658 T659 I664 T665	V454-V662 HydrophobicContact CG1-CB 4.25Å; V454-V662 HydrophobicContact CG1-CG2 3.99Å; V454-V662 HydrophobicContact CG2-CG2 3.82Å; V657-V662 HydrophobicContact CG1-CG2 4.41Å; R658-V662 PolarHBondContact O-N 2.67Å; R658-V662 VanDerWaalsContact O-N 3.15Å; T659-V662 WeakPolarHBondContact O-CB 3.5Å; T659-V662 WeakPolarHBondContact O-CG1 3.24Å; T659-V662 PolarHBondContact O-N 2.85Å; V662-I664 PolarHBondContact O-N 2.85Å; V662-I664 VanDerWaalsContact O-N 3.11Å; V662-T665 PolarHBondContact O-N 3.43Å; V662-T665 PolarHBondContact O-OG1 2.86Å
663	E	93.9	Very high	93	Very high	155 Å²	155	44 Å²	44	72%	0.724	27%	0.273	S	S	*	.	G	3₁₀ helix	trans	-50.8	-35.2	178.2	-65.9	178.5	-173	0	0	113.3	L661 T665 T666	L661-E663 PolarHBondContact O-N 2.94Å; E663-T665 PolarHBondContact O-N 3.32Å; E663-T666 WeakPolarHBondContact O-CB 3.49Å; E663-T666 WeakPolarHBondContact O-CG2 3.26Å; E663-T666 PolarHBondContact O-N 2.73Å; E663-T666 PolarHBondContact O-OG1 2.73Å
664	I	93.8	Very high	92.8	Very high	37 Å²	37	45.9 Å²	45.9	19%	0.19	29%	0.286	C	S	.	.	G	3₁₀ helix	trans	-66.1	-13	-179.8	81.1	-173.9	0	0	0	113.2	L622 E626 A637 V657 L661 V662	L622-I664 HydrophobicContact CB-CD1 3.97Å; E626-I664 HydrophobicContact CG-CD1 3.82Å; E626-I664 HydrophobicContact CG-CG2 4.16Å; A637-I664 HydrophobicContact CB-CD1 4.39Å; A637-I664 HydrophobicContact CB-CG1 4.36Å; V657-I664 HydrophobicContact CG2-CD1 3.83Å; V657-I664 HydrophobicContact CG2-CG1 4.01Å; L661-I664 WeakPolarHBondContact O-CG1 3.38Å; L661-I664 PolarHBondContact O-N 3.49Å; V662-I664 PolarHBondContact O-N 2.85Å; V662-I664 VanDerWaalsContact O-N 3.11Å
665	T	94	Very high	92.4	Very high	11 Å²	11	45.9 Å²	45.9	7%	0.067	29%	0.286	C	S	.	.	G	3₁₀ helix	trans	-103.7	-2.3	177.4	64.1	0	0	0	0	113.8	V452 L622 V657 V662 E663 L667 L668	V452-T665 HydrophobicContact CG1-CG2 4.09Å; L622-T665 HydrophobicContact CD1-CG2 4.1Å; V657-T665 HydrophobicContact CB-CG2 4.13Å; V657-T665 HydrophobicContact CG1-CG2 4.06Å; V657-T665 HydrophobicContact CG2-CG2 4.26Å; V662-T665 PolarHBondContact O-N 3.43Å; V662-T665 PolarHBondContact O-OG1 2.86Å; E663-T665 PolarHBondContact O-N 3.32Å; T665-L667 PolarHBondContact O-N 3.21Å; T665-L668 HydrophobicContact CG2-CD1 4.03Å; T665-L668 VanDerWaalsContact O-CB 3.32Å; T665-L668 WeakPolarHBondContact O-CB 3.44Å; T665-L668 PolarHBondContact O-N 2.66Å
666	T	91.5	Very high	91.7	Very high	104 Å²	104	47 Å²	47	64%	0.638	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-27.2	-177	53	0	0	0	0	114.5	E663 L668	E663-T666 WeakPolarHBondContact O-CB 3.49Å; E663-T666 WeakPolarHBondContact O-CG2 3.26Å; E663-T666 PolarHBondContact O-N 2.73Å; E663-T666 PolarHBondContact O-OG1 2.73Å; T666-L668 VanDerWaalsContact C-N 3.33Å
667	L	91	Very high	90.3	Very high	131 Å²	131	51.3 Å²	51.3	69%	0.686	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.2	-0.1	176.5	-58.2	179.1	0	0	0	113.3	T641 T665	T641-L667 HydrophobicContact CG2-CB 3.5Å; T641-L667 VanDerWaalsContact CG2-CB 3.5Å; T641-L667 HydrophobicContact CG2-CD1 4.13Å; T641-L667 HydrophobicContact CG2-CG 4.48Å; T665-L667 PolarHBondContact O-N 3.21Å
668	L	90.4	Very high	88.5	Confident	11 Å²	11	53.5 Å²	53.5	6%	0.058	33%	0.326	C	S	.	.	S	Bend	trans	-89	124.3	175.1	-58.5	178.1	0	0	0	109.4	L622 I640 T641 V655 T665 T666 F670	L622-L668 HydrophobicContact CD1-CD1 4.49Å; I640-L668 HydrophobicContact CB-CD2 4.49Å; I640-L668 HydrophobicContact CG2-CD2 3.72Å; T641-L668 VanDerWaalsContact OG1-CD2 3.28Å; T641-L668 WeakPolarHBondContact OG1-CD2 3.39Å; V655-L668 HydrophobicContact CG2-CD1 4.23Å; T665-L668 HydrophobicContact CG2-CD1 4.03Å; T665-L668 VanDerWaalsContact O-CB 3.32Å; T665-L668 WeakPolarHBondContact O-CB 3.44Å; T665-L668 PolarHBondContact O-N 2.66Å; T666-L668 VanDerWaalsContact C-N 3.33Å; L668-F670 HydrophobicContact CB-CB 4.41Å; L668-F670 HydrophobicContact CB-CD2 3.72Å; L668-F670 HydrophobicContact CB-CE2 4.06Å; L668-F670 HydrophobicContact CB-CG 4Å; L668-F670 HydrophobicContact CD1-CD2 3.92Å; L668-F670 HydrophobicContact CD1-CE2 3.84Å; L668-F670 HydrophobicContact CD2-CE2 4.4Å; L668-F670 HydrophobicContact CG-CD2 4.37Å; L668-F670 HydrophobicContact CG-CE2 4.33Å; L668-F670 PolarHBondContact O-N 3.24Å
669	P	89	Confident	86.4	Confident	52 Å²	52	57.2 Å²	57.2	34%	0.338	35%	0.354	S	S	.	.			trans	-79.6	62.8	179.1	34.7	-36.3	0	0	0	110	E447	E447-P669 CarbonylContact C-O 3.49Å
670	F	90.9	Very high	84.2	Confident	25 Å²	25	61.8 Å²	61.8	11%	0.11	38%	0.377	C	S	.	.			trans	-126.9	144.1	-171.7	-68.3	-11.2	0	0	0	110.8	R449 G450 V452 I644 L653 V655 L668	R449-F670 VanDerWaalsContact C-CE1 3.46Å; R449-F670 HydrophobicContact CB-CE1 3.94Å; G450-F670 VanDerWaalsContact N-CD1 3.32Å; V452-F670 HydrophobicContact CG2-CB 3.78Å; V452-F670 HydrophobicContact CG2-CD2 3.95Å; V452-F670 HydrophobicContact CG2-CG 4.41Å; I644-F670 HydrophobicContact CD1-CE1 3.75Å; I644-F670 HydrophobicContact CD1-CZ 3.65Å; I644-F670 HydrophobicContact CG1-CE1 3.68Å; I644-F670 HydrophobicContact CG1-CZ 3.81Å; L653-F670 HydrophobicContact CB-CE2 4.28Å; L653-F670 HydrophobicContact CB-CZ 3.86Å; L653-F670 HydrophobicContact CD2-CE2 4.01Å; L653-F670 HydrophobicContact CD2-CZ 3.85Å; L653-F670 HydrophobicContact CG-CE2 4.48Å; L653-F670 HydrophobicContact CG-CZ 4.38Å; V655-F670 HydrophobicContact CG1-CE2 4.04Å; V655-F670 HydrophobicContact CG2-CD2 4.13Å; V655-F670 HydrophobicContact CG2-CE2 4.26Å; L668-F670 HydrophobicContact CB-CB 4.41Å; L668-F670 HydrophobicContact CB-CD2 3.72Å; L668-F670 HydrophobicContact CB-CE2 4.06Å; L668-F670 HydrophobicContact CB-CG 4Å; L668-F670 HydrophobicContact CD1-CD2 3.92Å; L668-F670 HydrophobicContact CD1-CE2 3.84Å; L668-F670 HydrophobicContact CD2-CE2 4.4Å; L668-F670 HydrophobicContact CG-CD2 4.37Å; L668-F670 HydrophobicContact CG-CE2 4.33Å; L668-F670 PolarHBondContact O-N 3.24Å
671	A	89.3	Confident	82.8	Confident	40 Å²	40	60 Å²	60	33%	0.331	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	132	174.6	0	0	0	0	0	111.7	V439 G450 A451 V452	V439-A671 HydrophobicContact CG1-CB 3.62Å; G450-A671 PolarHBondContact O-N 3.32Å; A451-A671 CarbonylContact C-O 3.56Å; A451-A671 VanDerWaalsContact CA-O 3.29Å; A451-A671 WeakPolarHBondContact CA-O 3.19Å; V452-A671 PolarHBondContact N-O 3.05Å
672	G	89.7	Confident	81.6	Confident	60 Å²	60	61 Å²	61	62%	0.619	37%	0.366	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.9	142.5	178.5	0	0	0	0	0	113.9	V452	V452-G672 CarbonylContact O-C 3.49Å; V452-G672 WeakPolarHBondContact O-CA 3.3Å
673	I	91.4	Very high	81	Confident	12 Å²	12	61.9 Å²	61.9	6%	0.062	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	119.5	168	-48.5	172.9	0	0	0	108	L432 R435 L436 V439 V452 I453 V454	L432-I673 HydrophobicContact CD1-CB 4.41Å; L432-I673 HydrophobicContact CD1-CD1 4.23Å; L432-I673 HydrophobicContact CD1-CG2 3.58Å; R435-I673 HydrophobicContact CG-CD1 4.28Å; L436-I673 HydrophobicContact CB-CD1 4.38Å; L436-I673 HydrophobicContact CD1-CD1 4.22Å; V439-I673 HydrophobicContact CG2-CD1 4.2Å; V439-I673 HydrophobicContact CG2-CG1 4.41Å; V452-I673 PolarHBondContact O-N 3.08Å; I453-I673 WeakPolarHBondContact CA-O 3.12Å; V454-I673 PolarHBondContact N-O 3.3Å
674	S	91.1	Very high	80.6	Confident	41 Å²	41	54.5 Å²	54.5	29%	0.287	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	142.4	178.6	-176.3	0	0	0	0	112	V454 D676	V454-S674 CarbonylContact O-C 3.52Å; V454-S674 WeakPolarHBondContact O-CA 3.25Å; S674-D676 PolarHBondContact OG-N 3.03Å
675	L	90.3	Very high	80.1	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	34%	0.342	C	S	.	.	S	Bend	trans	-102.9	0.3	177.4	-59.4	-170.9	0	0	0	114	R429 W431 L432 I453 V454 K461 I464 L684	R429-L675 PolarHBondContact NH1-O 3.34Å; R429-L675 VanDerWaalsContact NH1-O 3.1Å; R429-L675 PolarHBondContact NH2-O 3.28Å; W431-L675 HydrophobicContact CH2-CD2 4.32Å; L432-L675 HydrophobicContact CD1-CD2 4.03Å; L432-L675 HydrophobicContact CD2-CD2 3.77Å; I453-L675 HydrophobicContact CG2-CD1 3.74Å; I453-L675 HydrophobicContact CG2-CD2 4.16Å; I453-L675 HydrophobicContact CG2-CG 3.89Å; V454-L675 WeakPolarHBondContact O-CG 3.38Å; V454-L675 PolarHBondContact O-N 2.78Å; K461-L675 HydrophobicContact CG-CD1 3.74Å; I464-L675 HydrophobicContact CD1-CD1 4.03Å; L675-L684 WeakPolarHBondContact O-CD2 3.45Å
676	D	82.1	Confident	79.8	Confident	23 Å²	23	56.1 Å²	56.1	12%	0.123	36%	0.357	C	S	.	.			trans	-112	-17.6	-168.8	-58.5	-15.1	0	0	0	114.4	G455 N456 T659 S674 L678	G455-D676 VanDerWaalsContact CA-OD1 3.24Å; G455-D676 WeakPolarHBondContact CA-OD1 3.34Å; G455-D676 WeakPolarHBondContact CA-OD2 3.39Å; N456-D676 VanDerWaalsContact N-CG 3.27Å; N456-D676 PolarHBondContact N-OD1 3.44Å; N456-D676 PolarHBondContact N-OD2 2.83Å; N456-D676 PolarHBondContact ND2-OD2 3Å; N456-D676 VanDerWaalsContact ND2-OD2 3.08Å; T659-D676 PolarHBondContact OG1-OD2 3.45Å; S674-D676 PolarHBondContact OG-N 3.03Å; D676-L678 PolarHBondContact O-N 2.81Å
677	I	69.2	Low	79.7	Confident	92 Å²	92	52 Å²	52	47%	0.472	33%	0.332	S	S	.	.			trans	-79.3	87.2	-173.5	-57.9	173.9	0	0	0	110	P679 S681	I677-P679 HydrophobicContact CG2-CG 4.37Å; I677-S681 PolarHBondContact O-OG 3.12Å
678	L	58.6	Low	79.7	Confident	45 Å²	45	45.8 Å²	45.8	24%	0.236	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66	-37	-179.7	-78.2	169.2	0	0	0	117.3	D676 L684 L688	D676-L678 PolarHBondContact O-N 2.81Å; L678-L684 HydrophobicContact CD2-CD2 3.96Å; L678-L684 HydrophobicContact CD2-CG 3.97Å; L678-L684 HydrophobicContact CG-CD2 4.35Å; L678-L688 HydrophobicContact CD2-CD1 3.59Å
679	P	49.3	Very low	79.6	Confident	111 Å²	111	47.4 Å²	47.4	72%	0.721	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.6	-37.8	-168	25.7	-32.9	0	0	0	114.2	I677	I677-P679 HydrophobicContact CG2-CG 4.37Å
680	D	46.4	Very low	79.6	Confident	142 Å²	142	50 Å²	50	76%	0.759	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.3	-9.4	-168.7	-52.9	-58.9	0	0	0	114.3
681	S	60.4	Low	79.7	Confident	37 Å²	37	49.5 Å²	49.5	26%	0.259	32%	0.32	S	S	.	.			trans	-106.3	97	-177.8	64.5	0	0	0	0	112.2	I677 D683 L684 G685	I677-S681 PolarHBondContact O-OG 3.12Å; S681-D683 PolarHBondContact O-N 3.3Å; S681-L684 PolarHBondContact O-N 3.47Å; S681-L684 VanDerWaalsContact OG-CB 3.24Å; S681-L684 WeakPolarHBondContact OG-CB 3.42Å; S681-G685 PolarHBondContact O-N 3.36Å
682	S	68.4	Low	79.8	Confident	97 Å²	97	47.6 Å²	47.6	68%	0.678	30%	0.304	S	S	*	.	H	α-helix	trans	-53.1	-37.4	177	53	0	0	0	0	113	L684 A686	S682-L684 VanDerWaalsContact C-N 3.33Å; S682-L684 PolarHBondContact O-N 3.33Å; S682-A686 WeakPolarHBondContact O-CB 3.39Å; S682-A686 PolarHBondContact O-N 2.98Å
683	D	80.8	Confident	79.8	Confident	73 Å²	73	49.6 Å²	49.6	39%	0.39	30%	0.297	S	S	.	.	H	α-helix	trans	-64.8	-34.1	179.7	-64.9	-45.1	0	0	0	112.8	W431 S681 D687	W431-D683 HydrophobicContact CB-CB 4.12Å; W431-D683 HydrophobicContact CD2-CB 3.97Å; W431-D683 HydrophobicContact CE3-CB 4.5Å; W431-D683 HydrophobicContact CG-CB 3.8Å; S681-D683 PolarHBondContact O-N 3.3Å; D683-D687 WeakPolarHBondContact O-CB 3.2Å; D683-D687 PolarHBondContact O-N 2.99Å
684	L	84.3	Confident	79.7	Confident	1 Å²	1	54.3 Å²	54.3	1%	0.005	32%	0.319	C	S	.	.	H	α-helix	trans	-75.1	-44.4	179.1	179.6	53.7	0	0	0	111.8	R429 W431 L675 L678 S681 S682 A686 D687 L688	R429-L684 VanDerWaalsContact NH1-CD1 3.27Å; W431-L684 HydrophobicContact CZ2-CB 4.43Å; L675-L684 WeakPolarHBondContact O-CD2 3.45Å; L678-L684 HydrophobicContact CD2-CD2 3.96Å; L678-L684 HydrophobicContact CD2-CG 3.97Å; L678-L684 HydrophobicContact CG-CD2 4.35Å; S681-L684 PolarHBondContact O-N 3.47Å; S681-L684 VanDerWaalsContact OG-CB 3.24Å; S681-L684 WeakPolarHBondContact OG-CB 3.42Å; S682-L684 VanDerWaalsContact C-N 3.33Å; S682-L684 PolarHBondContact O-N 3.33Å; L684-A686 VanDerWaalsContact C-N 3.29Å; L684-A686 PolarHBondContact O-N 2.91Å; L684-D687 PolarHBondContact O-N 2.92Å; L684-L688 HydrophobicContact CD1-CD1 3.83Å; L684-L688 HydrophobicContact CD1-CD2 4.46Å; L684-L688 HydrophobicContact CD1-CG 3.95Å; L684-L688 HydrophobicContact CG-CD1 4.05Å; L684-L688 WeakPolarHBondContact O-CG 3.35Å; L684-L688 PolarHBondContact O-N 2.73Å; L684-L688 VanDerWaalsContact O-N 3.1Å
685	G	84.8	Confident	79.7	Confident	33 Å²	33	54.6 Å²	54.6	34%	0.34	31%	0.314	S	S	.	.	H	α-helix	trans	-60.4	-40.8	175.9	0	0	0	0	0	112.1	S681 S689	S681-G685 PolarHBondContact O-N 3.36Å; G685-S689 PolarHBondContact O-N 3.34Å
686	A	86.9	Confident	79.7	Confident	48 Å²	48	54.8 Å²	54.8	40%	0.397	32%	0.315	S	S	.	.	H	α-helix	trans	-64.3	-52.8	173.7	0	0	0	0	0	112	S682 L684 L688 S689 D690	S682-A686 WeakPolarHBondContact O-CB 3.39Å; S682-A686 PolarHBondContact O-N 2.98Å; L684-A686 VanDerWaalsContact C-N 3.29Å; L684-A686 PolarHBondContact O-N 2.91Å; A686-L688 VanDerWaalsContact C-N 3.32Å; A686-L688 PolarHBondContact O-N 3.07Å; A686-S689 PolarHBondContact O-N 3.48Å; A686-S689 VanDerWaalsContact O-N 3.08Å; A686-D690 WeakPolarHBondContact O-CB 3.5Å; A686-D690 PolarHBondContact O-N 3.3Å
687	D	89.6	Confident	80	Confident	18 Å²	18	57.7 Å²	57.7	10%	0.096	34%	0.336	C	S	.	.	H	α-helix	trans	-57.1	-39.9	-176.8	-174.6	69.2	0	0	0	113.5	G428 R429 D683 L684 Y691	G428-D687 VanDerWaalsContact CA-OD1 3.25Å; G428-D687 WeakPolarHBondContact CA-OD1 3.46Å; R429-D687 WeakPolarHBondContact CD-OD2 3.43Å; R429-D687 PolarHBondContact N-OD1 3.25Å; R429-D687 PolarHBondContact N-OD2 3.41Å; R429-D687 IonicContact NE-OD2 2.71Å; D683-D687 WeakPolarHBondContact O-CB 3.2Å; D683-D687 PolarHBondContact O-N 2.99Å; L684-D687 PolarHBondContact O-N 2.92Å; D687-Y691 WeakPolarHBondContact O-CB 3.38Å; D687-Y691 PolarHBondContact O-N 2.66Å
688	L	90.1	Very high	80.9	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-70.1	-41.1	176	-63.5	168.1	0	0	0	112	L678 L684 A686 Y691 I692 I734 L737	L678-L688 HydrophobicContact CD2-CD1 3.59Å; L684-L688 HydrophobicContact CD1-CD1 3.83Å; L684-L688 HydrophobicContact CD1-CD2 4.46Å; L684-L688 HydrophobicContact CD1-CG 3.95Å; L684-L688 HydrophobicContact CG-CD1 4.05Å; L684-L688 WeakPolarHBondContact O-CG 3.35Å; L684-L688 PolarHBondContact O-N 2.73Å; L684-L688 VanDerWaalsContact O-N 3.1Å; A686-L688 VanDerWaalsContact C-N 3.32Å; A686-L688 PolarHBondContact O-N 3.07Å; L688-Y691 PolarHBondContact O-N 3.45Å; L688-I692 WeakPolarHBondContact O-CD1 3.36Å; L688-I692 VanDerWaalsContact O-CG1 3.26Å; L688-I692 WeakPolarHBondContact O-CG1 3.34Å; L688-I692 PolarHBondContact O-N 3.3Å; L688-I734 HydrophobicContact CD2-CG1 3.86Å; L688-L737 HydrophobicContact CB-CD1 4.31Å; L688-L737 HydrophobicContact CD2-CD1 3.72Å
689	S	89.6	Confident	82.3	Confident	45 Å²	45	55.3 Å²	55.3	32%	0.315	34%	0.343	S	S	.	.	H	α-helix	trans	-68.5	-38.9	177.1	-175.5	0	0	0	0	112	G685 A686 I692 H693 S723	G685-S689 PolarHBondContact O-N 3.34Å; A686-S689 PolarHBondContact O-N 3.48Å; A686-S689 VanDerWaalsContact O-N 3.08Å; S689-I692 PolarHBondContact O-N 3Å; S689-H693 VanDerWaalsContact O-CB 3.31Å; S689-H693 WeakPolarHBondContact O-CB 3.05Å; S689-H693 PolarHBondContact O-N 3.12Å; S689-S723 PolarHBondContact OG-OG 2.88Å
690	D	89.4	Confident	84.1	Confident	106 Å²	106	54.4 Å²	54.4	57%	0.567	34%	0.339	S	S	*	.	H	α-helix	trans	-63.3	-43	174.6	-76.5	-12.2	0	0	0	110.7	A686 H693 H694	A686-D690 WeakPolarHBondContact O-CB 3.5Å; A686-D690 PolarHBondContact O-N 3.3Å; D690-H693 PolarHBondContact O-N 3.46Å; D690-H694 WeakPolarHBondContact O-CB 3.49Å; D690-H694 PolarHBondContact O-N 2.98Å
691	Y	91.4	Very high	86	Confident	16 Å²	16	52.3 Å²	52.3	6%	0.063	33%	0.325	C	S	.	.	H	α-helix	trans	-59.9	-48.6	173.3	-179.3	-89.9	0	0	0	111.9	V427 D687 L688 H694 R695 I734 L737 L741	V427-Y691 HydrophobicContact CB-CD2 4.42Å; V427-Y691 WeakPolarHBondContact O-CD2 3.5Å; D687-Y691 WeakPolarHBondContact O-CB 3.38Å; D687-Y691 PolarHBondContact O-N 2.66Å; L688-Y691 PolarHBondContact O-N 3.45Å; Y691-H694 PolarHBondContact O-N 3.24Å; Y691-R695 HydrophobicContact CD1-CG 4.03Å; Y691-R695 HydrophobicContact CE1-CG 3.57Å; Y691-R695 HydrophobicContact CE2-CG 4.25Å; Y691-R695 WeakPolarHBondContact O-CB 3.45Å; Y691-R695 VanDerWaalsContact O-CG 3.28Å; Y691-R695 WeakPolarHBondContact O-CG 3.2Å; Y691-R695 PolarHBondContact O-N 3.49Å; Y691-R695 PolarHBondContact OH-NH1 3Å; Y691-R695 VanDerWaalsContact OH-NH1 3.1Å; Y691-I734 HydrophobicContact CD2-CG2 4.49Å; Y691-I734 HydrophobicContact CE1-CG2 4.48Å; Y691-I734 HydrophobicContact CE2-CG2 4.15Å; Y691-L737 HydrophobicContact CD1-CB 4.23Å; Y691-L737 HydrophobicContact CD1-CD1 4.3Å; Y691-L737 HydrophobicContact CE1-CB 4.06Å; Y691-L741 HydrophobicContact CE1-CD1 4.28Å
692	I	91.9	Very high	87.4	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-61.6	-47.9	178.5	-66.4	159.9	0	0	0	110.3	L688 S689 H694 R695 V696 F722 L726 S727 L737	L688-I692 WeakPolarHBondContact O-CD1 3.36Å; L688-I692 VanDerWaalsContact O-CG1 3.26Å; L688-I692 WeakPolarHBondContact O-CG1 3.34Å; L688-I692 PolarHBondContact O-N 3.3Å; S689-I692 PolarHBondContact O-N 3Å; I692-H694 PolarHBondContact O-N 2.98Å; I692-R695 PolarHBondContact O-N 3.3Å; I692-V696 HydrophobicContact CG2-CG2 4.26Å; I692-V696 VanDerWaalsContact O-CG2 3.29Å; I692-V696 WeakPolarHBondContact O-CG2 3.4Å; I692-V696 PolarHBondContact O-N 3.03Å; I692-F722 HydrophobicContact CG2-CD1 4.36Å; I692-F722 HydrophobicContact CG2-CE1 4.21Å; I692-L726 HydrophobicContact CD1-CB 3.78Å; I692-L726 HydrophobicContact CG2-CD1 4.49Å; I692-S727 WeakPolarHBondContact CD1-OG 3.47Å; I692-L737 HydrophobicContact CD1-CD1 4.13Å; I692-L737 HydrophobicContact CD1-CD2 3.87Å; I692-L737 HydrophobicContact CG1-CD1 4.07Å; I692-L737 HydrophobicContact CG1-CD2 4.07Å
693	H	89.6	Confident	88.1	Confident	101 Å²	101	47 Å²	47	47%	0.468	29%	0.289	S	S	.	.	H	α-helix	trans	-59.8	-48.9	179.3	-173.3	-83.3	0	0	0	111.3	S689 D690 R695 V696 S697	S689-H693 VanDerWaalsContact O-CB 3.31Å; S689-H693 WeakPolarHBondContact O-CB 3.05Å; S689-H693 PolarHBondContact O-N 3.12Å; D690-H693 PolarHBondContact O-N 3.46Å; H693-R695 PolarHBondContact O-N 3.37Å; H693-V696 PolarHBondContact O-N 3.13Å; H693-S697 PolarHBondContact CE1-OG 3.11Å; H693-S697 VanDerWaalsContact CE1-OG 3.27Å; H693-S697 WeakPolarHBondContact O-CB 3.48Å; H693-S697 PolarHBondContact O-N 3.19Å; H693-S697 PolarHBondContact O-OG 3.26Å
694	H	90.1	Very high	88.3	Confident	112 Å²	112	46.7 Å²	46.7	52%	0.519	29%	0.29	S	S	.	.	H	α-helix	trans	-56.8	-45.2	175.7	176.5	-97.9	0	0	0	112.4	D690 Y691 I692 G698	D690-H694 WeakPolarHBondContact O-CB 3.49Å; D690-H694 PolarHBondContact O-N 2.98Å; Y691-H694 PolarHBondContact O-N 3.24Å; I692-H694 PolarHBondContact O-N 2.98Å; H694-G698 PolarHBondContact O-N 2.89Å
695	R	90.9	Very high	88.3	Confident	47 Å²	47	48.5 Å²	48.5	18%	0.177	30%	0.3	C	S	.	.	H	α-helix	trans	-64.9	-38.3	177.3	-73.1	-63.3	-53.1	-101	3.4	112.9	Y691 I692 H693 S699 L741 D742	Y691-R695 HydrophobicContact CD1-CG 4.03Å; Y691-R695 HydrophobicContact CE1-CG 3.57Å; Y691-R695 HydrophobicContact CE2-CG 4.25Å; Y691-R695 WeakPolarHBondContact O-CB 3.45Å; Y691-R695 VanDerWaalsContact O-CG 3.28Å; Y691-R695 WeakPolarHBondContact O-CG 3.2Å; Y691-R695 PolarHBondContact O-N 3.49Å; Y691-R695 PolarHBondContact OH-NH1 3Å; Y691-R695 VanDerWaalsContact OH-NH1 3.1Å; I692-R695 PolarHBondContact O-N 3.3Å; H693-R695 PolarHBondContact O-N 3.37Å; R695-S699 PolarHBondContact O-N 3.38Å; R695-L741 HydrophobicContact CB-CD1 3.79Å; R695-L741 HydrophobicContact CG-CD1 4.05Å; R695-D742 IonicContact CZ-OD1 2.68Å; R695-D742 IonicContact NH1-OD1 2.65Å; R695-D742 PolarHBondContact NH1-OD1 3.23Å; R695-D742 IonicContact NH2-OD1 3.26Å; R695-D742 PolarHBondContact NH2-OD1 3.46Å
696	V	89.3	Confident	88.1	Confident	4 Å²	4	47.4 Å²	47.4	2%	0.024	29%	0.286	C	S	.	.	H	α-helix	trans	-72.7	-48.1	178.2	176.6	0	0	0	0	111	I692 H693 G698 S699 I702 A703 L719 F722	I692-V696 HydrophobicContact CG2-CG2 4.26Å; I692-V696 VanDerWaalsContact O-CG2 3.29Å; I692-V696 WeakPolarHBondContact O-CG2 3.4Å; I692-V696 PolarHBondContact O-N 3.03Å; H693-V696 PolarHBondContact O-N 3.13Å; V696-G698 VanDerWaalsContact C-N 3.26Å; V696-G698 PolarHBondContact O-N 2.85Å; V696-S699 PolarHBondContact O-N 3.26Å; V696-S699 VanDerWaalsContact O-O 3.14Å; V696-I702 HydrophobicContact CB-CG2 4.38Å; V696-I702 HydrophobicContact CG2-CG2 3.81Å; V696-A703 HydrophobicContact CG1-CB 4.17Å; V696-L719 HydrophobicContact CB-CD1 4.3Å; V696-L719 HydrophobicContact CG1-CD1 3.88Å; V696-L719 HydrophobicContact CG2-CD1 4.18Å; V696-F722 HydrophobicContact CG2-CE1 4.14Å
697	S	88	Confident	87.4	Confident	83 Å²	83	45.7 Å²	45.7	58%	0.58	27%	0.271	S	S	*	.	H	α-helix	trans	-62.9	-33.2	176.8	-58.7	0	0	0	0	112.6	H693 S699	H693-S697 PolarHBondContact CE1-OG 3.11Å; H693-S697 VanDerWaalsContact CE1-OG 3.27Å; H693-S697 WeakPolarHBondContact O-CB 3.48Å; H693-S697 PolarHBondContact O-N 3.19Å; H693-S697 PolarHBondContact O-OG 3.26Å; S697-S699 VanDerWaalsContact C-N 3.32Å; S697-S699 PolarHBondContact O-N 2.95Å
698	G	88.1	Confident	86.1	Confident	69 Å²	69	46.8 Å²	46.8	71%	0.711	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.3	-6.4	178.3	0	0	0	0	0	115.6	H694 V696	H694-G698 PolarHBondContact O-N 2.89Å; V696-G698 VanDerWaalsContact C-N 3.26Å; V696-G698 PolarHBondContact O-N 2.85Å
699	S	88.8	Confident	84.3	Confident	18 Å²	18	51.4 Å²	51.4	13%	0.126	31%	0.308	C	S	.	.			trans	-142.4	109.4	179.8	-177.4	0	0	0	0	112.5	R695 V696 S697 Q701 I702 A703 H745	R695-S699 PolarHBondContact O-N 3.38Å; V696-S699 PolarHBondContact O-N 3.26Å; V696-S699 VanDerWaalsContact O-O 3.14Å; S697-S699 VanDerWaalsContact C-N 3.32Å; S697-S699 PolarHBondContact O-N 2.95Å; S699-Q701 PolarHBondContact O-N 3Å; S699-I702 PolarHBondContact O-N 3.05Å; S699-A703 PolarHBondContact O-N 2.95Å; S699-H745 PolarHBondContact OG-ND1 3.38Å
700	S	86.2	Confident	82.4	Confident	93 Å²	93	55.1 Å²	55.1	65%	0.65	33%	0.329	S	S	*	.	H	α-helix	trans	-56.3	-34.1	176.8	54	0	0	0	0	113	A703 T704	S700-A703 PolarHBondContact O-N 3.47Å; S700-T704 WeakPolarHBondContact O-CG2 3.22Å; S700-T704 PolarHBondContact O-N 2.97Å; S700-T704 PolarHBondContact O-OG1 3.33Å
701	Q	88.1	Confident	80.5	Confident	97 Å²	97	53.2 Å²	53.2	45%	0.453	33%	0.334	S	S	.	.	H	α-helix	trans	-69.1	-38.3	176.8	-71.1	175.7	-22.9	0	0	112.6	S699 T704 N705 H745	S699-Q701 PolarHBondContact O-N 3Å; Q701-T704 PolarHBondContact O-OG1 3Å; Q701-T704 VanDerWaalsContact O-OG1 3.09Å; Q701-N705 VanDerWaalsContact O-CB 3.28Å; Q701-N705 WeakPolarHBondContact O-CB 3.39Å; Q701-N705 PolarHBondContact O-N 3.45Å; Q701-N705 VanDerWaalsContact O-N 3.13Å; Q701-N705 PolarHBondContact O-ND2 2.85Å; Q701-H745 PolarHBondContact OE1-CE1 2.95Å; Q701-H745 PolarHBondContact OE1-ND1 3.31Å; Q701-H745 PolarHBondContact OE1-O 2.79Å
702	I	88	Confident	78.7	Confident	1 Å²	1	56.6 Å²	56.6	1%	0.005	36%	0.361	C	S	.	.	H	α-helix	trans	-65.3	-47.1	172.8	-61.5	177.9	0	0	0	108.9	V696 S699 T704 N705 V706 L741 F744 H745	V696-I702 HydrophobicContact CB-CG2 4.38Å; V696-I702 HydrophobicContact CG2-CG2 3.81Å; S699-I702 PolarHBondContact O-N 3.05Å; I702-T704 PolarHBondContact O-N 3.47Å; I702-N705 PolarHBondContact O-N 2.98Å; I702-V706 HydrophobicContact CG2-CG2 4.11Å; I702-V706 WeakPolarHBondContact O-CB 3.4Å; I702-V706 VanDerWaalsContact O-CG2 3.23Å; I702-V706 WeakPolarHBondContact O-CG2 3.35Å; I702-V706 PolarHBondContact O-N 3.29Å; I702-L741 HydrophobicContact CD1-CB 4.23Å; I702-L741 WeakPolarHBondContact CD1-O 3.5Å; I702-L741 HydrophobicContact CG2-CD2 3.96Å; I702-F744 HydrophobicContact CG2-CB 4.41Å; I702-H745 HydrophobicContact CD1-CB 4.05Å; I702-H745 HydrophobicContact CG1-CB 3.72Å
703	A	85	Confident	77	Confident	21 Å²	21	60.8 Å²	60.8	17%	0.174	40%	0.395	C	S	.	.	H	α-helix	trans	-55.5	-52.6	177.9	0	0	0	0	0	112	V696 S699 S700 N705 V706 T707	V696-A703 HydrophobicContact CG1-CB 4.17Å; S699-A703 PolarHBondContact O-N 2.95Å; S700-A703 PolarHBondContact O-N 3.47Å; A703-N705 VanDerWaalsContact C-N 3.33Å; A703-N705 PolarHBondContact O-N 3.45Å; A703-V706 PolarHBondContact O-N 3.49Å; A703-T707 PolarHBondContact O-N 3.33Å; A703-T707 PolarHBondContact O-OG1 2.96Å
704	T	83.9	Confident	75.6	Confident	67 Å²	67	59.1 Å²	59.1	41%	0.411	39%	0.393	S	S	.	.	H	α-helix	trans	-59.3	-42.1	179.1	52.2	0	0	0	0	112.7	S700 Q701 I702 V706 T708	S700-T704 WeakPolarHBondContact O-CG2 3.22Å; S700-T704 PolarHBondContact O-N 2.97Å; S700-T704 PolarHBondContact O-OG1 3.33Å; Q701-T704 PolarHBondContact O-OG1 3Å; Q701-T704 VanDerWaalsContact O-OG1 3.09Å; I702-T704 PolarHBondContact O-N 3.47Å; T704-V706 VanDerWaalsContact C-N 3.26Å; T704-V706 PolarHBondContact O-N 3.23Å; T704-T708 PolarHBondContact O-N 2.83Å; T704-T708 PolarHBondContact O-OG1 2.92Å
705	N	84.8	Confident	74.6	Confident	40 Å²	40	57 Å²	57	21%	0.214	39%	0.385	C	S	.	.	H	α-helix	trans	-78.5	-9.3	-175.2	-63	-12.1	0	0	0	113.3	Q701 I702 A703 F744 A750 L751	Q701-N705 VanDerWaalsContact O-CB 3.28Å; Q701-N705 WeakPolarHBondContact O-CB 3.39Å; Q701-N705 PolarHBondContact O-N 3.45Å; Q701-N705 VanDerWaalsContact O-N 3.13Å; Q701-N705 PolarHBondContact O-ND2 2.85Å; I702-N705 PolarHBondContact O-N 2.98Å; A703-N705 VanDerWaalsContact C-N 3.33Å; A703-N705 PolarHBondContact O-N 3.45Å; N705-F744 HydrophobicContact CB-CD1 4.13Å; N705-F744 PolarHBondContact ND2-O 2.8Å; N705-A750 HydrophobicContact CB-CB 4.34Å; N705-A750 WeakPolarHBondContact O-CA 3.33Å; N705-L751 PolarHBondContact O-N 3.18Å
706	V	80.8	Confident	73.8	Confident	10 Å²	10	59.5 Å²	59.5	6%	0.061	41%	0.408	C	S	.	.	H	α-helix	trans	-104.8	-39.2	177.1	169.8	0	0	0	0	112.3	I702 A703 T704 F722 F744 L751	I702-V706 HydrophobicContact CG2-CG2 4.11Å; I702-V706 WeakPolarHBondContact O-CB 3.4Å; I702-V706 VanDerWaalsContact O-CG2 3.23Å; I702-V706 WeakPolarHBondContact O-CG2 3.35Å; I702-V706 PolarHBondContact O-N 3.29Å; A703-V706 PolarHBondContact O-N 3.49Å; T704-V706 VanDerWaalsContact C-N 3.26Å; T704-V706 PolarHBondContact O-N 3.23Å; V706-F722 HydrophobicContact CB-CE1 4.35Å; V706-F722 HydrophobicContact CB-CZ 4.34Å; V706-F722 HydrophobicContact CG1-CB 4.12Å; V706-F722 HydrophobicContact CG1-CD1 3.44Å; V706-F722 VanDerWaalsContact CG1-CD1 3.44Å; V706-F722 HydrophobicContact CG1-CD2 3.85Å; V706-F722 HydrophobicContact CG1-CE1 3.61Å; V706-F722 HydrophobicContact CG1-CE2 4Å; V706-F722 HydrophobicContact CG1-CG 3.54Å; V706-F722 HydrophobicContact CG1-CZ 3.87Å; V706-F722 HydrophobicContact CG2-CD1 4.45Å; V706-F722 HydrophobicContact CG2-CE1 3.76Å; V706-F722 HydrophobicContact CG2-CE2 3.94Å; V706-F722 HydrophobicContact CG2-CZ 3.44Å; V706-F722 VanDerWaalsContact CG2-CZ 3.44Å; V706-F744 HydrophobicContact CG2-CD1 3.98Å; V706-F744 HydrophobicContact CG2-CE1 4.19Å; V706-F744 HydrophobicContact CG2-CG 4.18Å; V706-L751 HydrophobicContact CG1-CD1 4.24Å
707	T	71.5	Confident	73.3	Confident	11 Å²	11	65 Å²	65	7%	0.067	44%	0.436	C	S	.	.	H	α-helix	trans	-109.7	1.9	-166.1	70.8	0	0	0	0	115.9	A703 P714	A703-T707 PolarHBondContact O-N 3.33Å; A703-T707 PolarHBondContact O-OG1 2.96Å; T707-P714 HydrophobicContact CG2-CB 3.71Å; T707-P714 WeakPolarHBondContact OG1-CA 3.4Å; T707-P714 WeakPolarHBondContact OG1-CB 3.4Å
708	T	61.7	Low	72.8	Confident	41 Å²	41	63.6 Å²	63.6	25%	0.252	42%	0.422	S	S	.	.			trans	-113	132.9	-173	69.1	0	0	0	0	115.1	T704	T704-T708 PolarHBondContact O-N 2.83Å; T704-T708 PolarHBondContact O-OG1 2.92Å
709	P	52.5	Low	72.5	Confident	98 Å²	98	61.4 Å²	61.4	64%	0.636	39%	0.394	S	S	*	.	S	Bend	trans	-100.4	-21.6	144.2	-11.3	29.7	0	0	0	112.4
710	T	49.9	Very low	72.2	Confident	122 Å²	122	64.3 Å²	64.3	75%	0.748	41%	0.414	S	S	*	.	S	Bend	trans	-140.3	8.1	-162.5	41.9	0	0	0	0	115.6	S712	T710-S712 PolarHBondContact O-N 2.93Å
711	G	49.7	Very low	72.2	Confident	66 Å²	66	66 Å²	66	68%	0.68	41%	0.41	S	S	*	.	S	Bend	trans	79.3	8.2	166.1	0	0	0	0	0	117.9
712	S	52.9	Low	72.1	Confident	88 Å²	88	61.4 Å²	61.4	62%	0.615	39%	0.388	S	S	*	.	S	Bend	trans	-90.6	179.7	170	56.5	0	0	0	0	112.4	T710	T710-S712 PolarHBondContact O-N 2.93Å
713	A	56.3	Low	72.2	Confident	87 Å²	87	61.8 Å²	61.8	72%	0.719	39%	0.391	S	S	*	.	S	Bend	trans	-54.5	150.1	-173.4	0	0	0	0	0	114.1	D715	A713-D715 PolarHBondContact O-N 2.94Å
714	P	61.3	Low	72.3	Confident	67 Å²	67	64.2 Å²	64.2	44%	0.435	41%	0.407	S	S	.	.	P	Polyproline II helix	trans	-63.3	120.1	-176.8	25.9	-35.5	0	0	0	112.2	T707 P716	T707-P714 HydrophobicContact CG2-CB 3.71Å; T707-P714 WeakPolarHBondContact OG1-CA 3.4Å; T707-P714 WeakPolarHBondContact OG1-CB 3.4Å; P714-P716 VanDerWaalsContact O-CD 3.28Å; P714-P716 WeakPolarHBondContact O-CD 3.33Å
715	D	68.7	Low	72.5	Confident	66 Å²	66	63 Å²	63	35%	0.353	40%	0.398	S	S	.	.	P	Polyproline II helix	trans	-64.2	117.3	171	176.7	0	0	0	0	110	A713 L717 L718 L719	A713-D715 PolarHBondContact O-N 2.94Å; D715-L717 PolarHBondContact O-N 2.99Å; D715-L717 WeakPolarHBondContact OD1-CB 3.28Å; D715-L717 PolarHBondContact OD1-N 3.49Å; D715-L718 HydrophobicContact CB-CB 4.19Å; D715-L718 HydrophobicContact CB-CD1 4.08Å; D715-L718 HydrophobicContact CB-CG 4.07Å; D715-L718 PolarHBondContact O-N 3Å; D715-L718 VanDerWaalsContact O-N 3.13Å; D715-L719 PolarHBondContact O-N 2.92Å
716	P	74.8	Confident	72.8	Confident	100 Å²	100	61.1 Å²	61.1	65%	0.649	39%	0.388	S	S	*	.	H	α-helix	trans	-57.7	-29.2	178.8	-24.8	35.6	0	0	0	113.6	P714 S720	P714-P716 VanDerWaalsContact O-CD 3.28Å; P714-P716 WeakPolarHBondContact O-CD 3.33Å; P716-S720 VanDerWaalsContact O-CB 3.29Å; P716-S720 WeakPolarHBondContact O-CB 3.37Å; P716-S720 PolarHBondContact O-N 3.38Å
717	L	77.8	Confident	73.2	Confident	119 Å²	119	61.3 Å²	61.3	62%	0.623	39%	0.39	S	S	*	.	H	α-helix	trans	-73.6	-35.2	179.4	-60.8	175.1	0	0	0	112	D715 K721	D715-L717 PolarHBondContact O-N 2.99Å; D715-L717 WeakPolarHBondContact OD1-CB 3.28Å; D715-L717 PolarHBondContact OD1-N 3.49Å; L717-K721 WeakPolarHBondContact O-CD 3.49Å; L717-K721 VanDerWaalsContact O-CG 3.29Å; L717-K721 WeakPolarHBondContact O-CG 3.33Å; L717-K721 PolarHBondContact O-N 3.31Å
718	L	78.1	Confident	74	Confident	54 Å²	54	65 Å²	65	28%	0.283	41%	0.413	S	S	.	.	H	α-helix	trans	-72.6	-38.7	172.9	-67.9	179.9	0	0	0	111.5	D715 K721 F722 Y756	D715-L718 HydrophobicContact CB-CB 4.19Å; D715-L718 HydrophobicContact CB-CD1 4.08Å; D715-L718 HydrophobicContact CB-CG 4.07Å; D715-L718 PolarHBondContact O-N 3Å; D715-L718 VanDerWaalsContact O-N 3.13Å; L718-K721 PolarHBondContact O-N 3.18Å; L718-F722 WeakPolarHBondContact O-CB 3.42Å; L718-F722 PolarHBondContact O-N 2.94Å; L718-Y756 PolarHBondContact O-OH 3.24Å
719	L	81.2	Confident	75.3	Confident	24 Å²	24	65.2 Å²	65.2	13%	0.126	41%	0.409	C	S	.	.	H	α-helix	trans	-65.1	-42.2	176	-178	57.2	0	0	0	111.9	V696 D715 F722 S723	V696-L719 HydrophobicContact CB-CD1 4.3Å; V696-L719 HydrophobicContact CG1-CD1 3.88Å; V696-L719 HydrophobicContact CG2-CD1 4.18Å; D715-L719 PolarHBondContact O-N 2.92Å; L719-F722 HydrophobicContact CD1-CD1 4.32Å; L719-F722 PolarHBondContact O-N 3.22Å; L719-S723 PolarHBondContact O-N 2.92Å
720	S	83.6	Confident	77	Confident	78 Å²	78	60.7 Å²	60.7	55%	0.545	38%	0.38	S	S	.	.	H	α-helix	trans	-60.2	-47.9	174.5	177.1	0	0	0	0	112	P716 F722 S723 S724	P716-S720 VanDerWaalsContact O-CB 3.29Å; P716-S720 WeakPolarHBondContact O-CB 3.37Å; P716-S720 PolarHBondContact O-N 3.38Å; S720-F722 VanDerWaalsContact C-N 3.34Å; S720-F722 PolarHBondContact O-N 3.3Å; S720-S723 PolarHBondContact O-N 2.95Å; S720-S724 WeakPolarHBondContact O-CB 3.34Å; S720-S724 PolarHBondContact O-N 3.32Å
721	K	85.4	Confident	78.8	Confident	128 Å²	128	60.4 Å²	60.4	56%	0.557	37%	0.369	S	S	*	.	H	α-helix	trans	-61.5	-39.6	175.9	-73	170.2	-177.4	174.7	0	112.6	L717 L718 N725 Y756	L717-K721 WeakPolarHBondContact O-CD 3.49Å; L717-K721 VanDerWaalsContact O-CG 3.29Å; L717-K721 WeakPolarHBondContact O-CG 3.33Å; L717-K721 PolarHBondContact O-N 3.31Å; L718-K721 PolarHBondContact O-N 3.18Å; K721-N725 WeakPolarHBondContact O-CB 3.41Å; K721-N725 PolarHBondContact O-N 3.09Å; K721-Y756 WeakPolarHBondContact CB-OH 3.45Å
722	F	86.4	Confident	80.7	Confident	1 Å²	1	57.2 Å²	57.2	0%	0.004	34%	0.337	C	S	.	.	H	α-helix	trans	-64.6	-47.3	174.8	174.2	-108.3	0	0	0	112.3	I692 V696 V706 L718 L719 S720 S724 N725 L726 L741 F744 L751 Y756	I692-F722 HydrophobicContact CG2-CD1 4.36Å; I692-F722 HydrophobicContact CG2-CE1 4.21Å; V696-F722 HydrophobicContact CG2-CE1 4.14Å; V706-F722 HydrophobicContact CB-CE1 4.35Å; V706-F722 HydrophobicContact CB-CZ 4.34Å; V706-F722 HydrophobicContact CG1-CB 4.12Å; V706-F722 HydrophobicContact CG1-CD1 3.44Å; V706-F722 VanDerWaalsContact CG1-CD1 3.44Å; V706-F722 HydrophobicContact CG1-CD2 3.85Å; V706-F722 HydrophobicContact CG1-CE1 3.61Å; V706-F722 HydrophobicContact CG1-CE2 4Å; V706-F722 HydrophobicContact CG1-CG 3.54Å; V706-F722 HydrophobicContact CG1-CZ 3.87Å; V706-F722 HydrophobicContact CG2-CD1 4.45Å; V706-F722 HydrophobicContact CG2-CE1 3.76Å; V706-F722 HydrophobicContact CG2-CE2 3.94Å; V706-F722 HydrophobicContact CG2-CZ 3.44Å; V706-F722 VanDerWaalsContact CG2-CZ 3.44Å; L718-F722 WeakPolarHBondContact O-CB 3.42Å; L718-F722 PolarHBondContact O-N 2.94Å; L719-F722 HydrophobicContact CD1-CD1 4.32Å; L719-F722 PolarHBondContact O-N 3.22Å; S720-F722 VanDerWaalsContact C-N 3.34Å; S720-F722 PolarHBondContact O-N 3.3Å; F722-S724 PolarHBondContact O-N 3.33Å; F722-N725 PolarHBondContact O-N 3.5Å; F722-L726 HydrophobicContact CD1-CD1 4.3Å; F722-L726 HydrophobicContact CD2-CD1 4.39Å; F722-L726 HydrophobicContact CD2-CG 4.49Å; F722-L726 HydrophobicContact CE1-CD1 3.6Å; F722-L726 HydrophobicContact CE2-CD1 3.71Å; F722-L726 HydrophobicContact CE2-CG 4.07Å; F722-L726 HydrophobicContact CZ-CD1 3.29Å; F722-L726 HydrophobicContact CZ-CG 4.16Å; F722-L726 PolarHBondContact O-N 3.37Å; F722-L741 HydrophobicContact CE1-CD2 4.11Å; F722-L741 HydrophobicContact CZ-CD2 4.02Å; F722-F744 AromaticContact CE2-CE2 3.99Å; F722-F744 HydrophobicContact CE2-CE2 3.99Å; F722-F744 HydrophobicContact CE2-CZ 4.17Å; F722-F744 HydrophobicContact CZ-CD2 4.36Å; F722-F744 HydrophobicContact CZ-CE2 4.09Å; F722-L751 HydrophobicContact CD2-CD1 3.72Å; F722-L751 HydrophobicContact CE2-CD1 3.97Å; F722-Y756 HydrophobicContact CB-CE1 3.97Å; F722-Y756 HydrophobicContact CD2-CD1 4.27Å; F722-Y756 AromaticContact CD2-CE1 3.97Å; F722-Y756 HydrophobicContact CD2-CE1 3.97Å; F722-Y756 HydrophobicContact CG-CE1 4.49Å
723	S	89.1	Confident	82.5	Confident	9 Å²	9	53.4 Å²	53.4	6%	0.063	31%	0.31	C	S	.	.	H	α-helix	trans	-59.8	-45.3	177.5	-171	0	0	0	0	111.7	S689 L719 S720 N725 S727	S689-S723 PolarHBondContact OG-OG 2.88Å; L719-S723 PolarHBondContact O-N 2.92Å; S720-S723 PolarHBondContact O-N 2.95Å; S723-N725 PolarHBondContact O-N 3.03Å; S723-S727 VanDerWaalsContact O-CB 3.24Å; S723-S727 WeakPolarHBondContact O-CB 3.4Å; S723-S727 PolarHBondContact O-N 2.92Å; S723-S727 PolarHBondContact O-OG 3.26Å
724	S	88.3	Confident	84.2	Confident	72 Å²	72	49.4 Å²	49.4	50%	0.503	28%	0.277	S	S	.	.	H	α-helix	trans	-60.2	-45.6	175.4	175.8	0	0	0	0	112.3	S720 F722 S727 T728	S720-S724 WeakPolarHBondContact O-CB 3.34Å; S720-S724 PolarHBondContact O-N 3.32Å; F722-S724 PolarHBondContact O-N 3.33Å; S724-S727 PolarHBondContact O-N 3.48Å; S724-T728 WeakPolarHBondContact O-CB 3.46Å; S724-T728 PolarHBondContact O-N 3.39Å; S724-T728 PolarHBondContact O-OG1 3.25Å
725	N	88.6	Confident	85.7	Confident	43 Å²	43	47.4 Å²	47.4	23%	0.23	26%	0.262	C	S	.	.	H	α-helix	trans	-63.3	-47.8	179.7	-171.3	-100.4	0	0	0	112.4	K721 F722 S723 R729	K721-N725 WeakPolarHBondContact O-CB 3.41Å; K721-N725 PolarHBondContact O-N 3.09Å; F722-N725 PolarHBondContact O-N 3.5Å; S723-N725 PolarHBondContact O-N 3.03Å; N725-R729 WeakPolarHBondContact O-CG 2.98Å; N725-R729 PolarHBondContact O-N 2.93Å; N725-R729 VanDerWaalsContact O-N 3.09Å
726	L	90.5	Very high	86.9	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-64.9	-42.9	176.5	-88	-176.1	0	0	0	112.4	I692 F722 T728 R729 S730 Y736 L737 T740 L741 V759	I692-L726 HydrophobicContact CD1-CB 3.78Å; I692-L726 HydrophobicContact CG2-CD1 4.49Å; F722-L726 HydrophobicContact CD1-CD1 4.3Å; F722-L726 HydrophobicContact CD2-CD1 4.39Å; F722-L726 HydrophobicContact CD2-CG 4.49Å; F722-L726 HydrophobicContact CE1-CD1 3.6Å; F722-L726 HydrophobicContact CE2-CD1 3.71Å; F722-L726 HydrophobicContact CE2-CG 4.07Å; F722-L726 HydrophobicContact CZ-CD1 3.29Å; F722-L726 HydrophobicContact CZ-CG 4.16Å; F722-L726 PolarHBondContact O-N 3.37Å; L726-T728 VanDerWaalsContact C-N 3.34Å; L726-T728 PolarHBondContact O-N 2.98Å; L726-R729 PolarHBondContact O-N 3.43Å; L726-S730 WeakPolarHBondContact O-CB 3.48Å; L726-S730 PolarHBondContact O-N 3.04Å; L726-Y736 HydrophobicContact CD2-CE1 3.87Å; L726-L737 HydrophobicContact CB-CD2 3.79Å; L726-L737 HydrophobicContact CD1-CD2 4.38Å; L726-L737 HydrophobicContact CD2-CD2 4.3Å; L726-L737 HydrophobicContact CG-CD2 4.4Å; L726-T740 HydrophobicContact CD2-CG2 4.02Å; L726-L741 HydrophobicContact CD1-CD2 4.09Å; L726-L741 HydrophobicContact CD1-CG 4.46Å; L726-V759 HydrophobicContact CD2-CG1 3.77Å
727	S	89.3	Confident	87.8	Confident	14 Å²	14	39.7 Å²	39.7	10%	0.098	22%	0.215	C	C	.	.	H	α-helix	trans	-59.7	-46.1	178.8	-61.1	0	0	0	0	110.9	I692 S723 S724 S730	I692-S727 WeakPolarHBondContact CD1-OG 3.47Å; S723-S727 VanDerWaalsContact O-CB 3.24Å; S723-S727 WeakPolarHBondContact O-CB 3.4Å; S723-S727 PolarHBondContact O-N 2.92Å; S723-S727 PolarHBondContact O-OG 3.26Å; S724-S727 PolarHBondContact O-N 3.48Å; S727-S730 PolarHBondContact O-N 3.38Å; S727-S730 PolarHBondContact O-OG 3.18Å
728	T	87.7	Confident	88.5	Confident	89 Å²	89	37.4 Å²	37.4	55%	0.546	20%	0.201	S	C	.	.	H	α-helix	trans	-60.9	-48.3	177.1	-53.9	0	0	0	0	111.7	S724 L726 S730	S724-T728 WeakPolarHBondContact O-CB 3.46Å; S724-T728 PolarHBondContact O-N 3.39Å; S724-T728 PolarHBondContact O-OG1 3.25Å; L726-T728 VanDerWaalsContact C-N 3.34Å; L726-T728 PolarHBondContact O-N 2.98Å; T728-S730 VanDerWaalsContact C-N 3.29Å; T728-S730 PolarHBondContact O-N 3.24Å
729	R	88.6	Confident	89.2	Confident	44 Å²	44	36 Å²	36	17%	0.166	19%	0.194	C	C	.	.	H	α-helix	trans	-71.2	-19.2	179.6	-71.8	-177.9	175	-164.1	10.5	114.4	N725 L726 H731 Y736 Y756 V759 P760	N725-R729 WeakPolarHBondContact O-CG 2.98Å; N725-R729 PolarHBondContact O-N 2.93Å; N725-R729 VanDerWaalsContact O-N 3.09Å; L726-R729 PolarHBondContact O-N 3.43Å; R729-H731 PolarHBondContact O-CD2 3.36Å; R729-H731 PolarHBondContact O-N 2.92Å; R729-Y736 HydrophobicContact CB-CE1 4.17Å; R729-Y736 WeakPolarHBondContact CB-OH 3.47Å; R729-Y756 PolarHBondContact NH2-O 3.24Å; R729-Y756 VanDerWaalsContact NH2-O 3.13Å; R729-V759 PolarHBondContact NH1-O 3.21Å; R729-P760 PolarHBondContact NH1-O 3.45Å
730	S	89.6	Confident	89.8	Confident	4 Å²	4	34.9 Å²	34.9	3%	0.028	19%	0.188	C	C	.	.	H	α-helix	trans	-66.2	-27.8	-179.6	75	0	0	0	0	113.2	L726 S727 T728 G732 S733	L726-S730 WeakPolarHBondContact O-CB 3.48Å; L726-S730 PolarHBondContact O-N 3.04Å; S727-S730 PolarHBondContact O-N 3.38Å; S727-S730 PolarHBondContact O-OG 3.18Å; T728-S730 VanDerWaalsContact C-N 3.29Å; T728-S730 PolarHBondContact O-N 3.24Å; S730-G732 PolarHBondContact O-N 3.37Å; S730-G732 VanDerWaalsContact O-N 3.13Å; S730-G732 PolarHBondContact OG-N 2.82Å; S730-S733 WeakPolarHBondContact O-CA 3.42Å; S730-S733 WeakPolarHBondContact O-CB 3.49Å; S730-S733 PolarHBondContact O-N 3.42Å
731	H	87.2	Confident	90.3	Very high	115 Å²	115	31.1 Å²	31.1	53%	0.532	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	47.9	35.8	-168.8	-60	-74.8	0	0	0	112.9	R729 S733	R729-H731 PolarHBondContact O-CD2 3.36Å; R729-H731 PolarHBondContact O-N 2.92Å; H731-S733 VanDerWaalsContact C-N 3.33Å
732	G	88.5	Confident	90.6	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	84.4	-5.2	-176.2	0	0	0	0	0	115.3	R429 S730 I734	R429-G732 PolarHBondContact NH2-O 3.34Å; S730-G732 PolarHBondContact O-N 3.37Å; S730-G732 VanDerWaalsContact O-N 3.13Å; S730-G732 PolarHBondContact OG-N 2.82Å; G732-I734 PolarHBondContact O-N 3.46Å
733	S	91.7	Very high	90.9	Very high	8 Å²	8	26.6 Å²	26.6	6%	0.056	14%	0.144	C	C	.	.			trans	-78.2	101.7	-177.5	-167.4	0	0	0	0	112.3	A457 S730 H731 L735 Y736 L737	A457-S733 WeakPolarHBondContact O-CB 3.45Å; A457-S733 PolarHBondContact O-OG 2.93Å; S730-S733 WeakPolarHBondContact O-CA 3.42Å; S730-S733 WeakPolarHBondContact O-CB 3.49Å; S730-S733 PolarHBondContact O-N 3.42Å; H731-S733 VanDerWaalsContact C-N 3.33Å; S733-L735 PolarHBondContact O-N 2.74Å; S733-Y736 PolarHBondContact O-N 2.67Å; S733-Y736 PolarHBondContact OG-N 3.19Å; S733-L737 PolarHBondContact O-N 2.88Å
734	I	91.7	Very high	91	Very high	2 Å²	2	26.2 Å²	26.2	1%	0.01	14%	0.141	C	C	.	.	H	α-helix	trans	-65.9	-28.5	172.6	-69.1	166.6	0	0	0	110.5	F426 R429 G458 L688 Y691 G732 L737 Q738	F426-I734 HydrophobicContact CE2-CD1 4.33Å; F426-I734 HydrophobicContact CE2-CG2 3.97Å; F426-I734 HydrophobicContact CZ-CD1 3.71Å; F426-I734 HydrophobicContact CZ-CG2 4.43Å; R429-I734 HydrophobicContact CG-CD1 3.76Å; G458-I734 PolarHBondContact O-N 3.08Å; L688-I734 HydrophobicContact CD2-CG1 3.86Å; Y691-I734 HydrophobicContact CD2-CG2 4.49Å; Y691-I734 HydrophobicContact CE1-CG2 4.48Å; Y691-I734 HydrophobicContact CE2-CG2 4.15Å; G732-I734 PolarHBondContact O-N 3.46Å; I734-L737 PolarHBondContact O-N 2.65Å; I734-Q738 VanDerWaalsContact O-CB 3.31Å; I734-Q738 WeakPolarHBondContact O-CB 3.42Å; I734-Q738 PolarHBondContact O-N 2.86Å
735	L	92.4	Very high	91.2	Very high	26 Å²	26	26.4 Å²	26.4	14%	0.136	13%	0.134	C	C	.	.	H	α-helix	trans	-63.9	-42.2	173	-174.7	63	0	0	0	112.6	G458 S733 L737 Q738 L739 L763 H844	G458-L735 PolarHBondContact O-N 3.39Å; G458-L735 VanDerWaalsContact O-N 3.11Å; S733-L735 PolarHBondContact O-N 2.74Å; L735-L737 VanDerWaalsContact C-N 3.34Å; L735-Q738 PolarHBondContact O-N 2.87Å; L735-L739 HydrophobicContact CD1-CD1 3.9Å; L735-L739 HydrophobicContact CD1-CG 3.98Å; L735-L739 HydrophobicContact CG-CD1 3.9Å; L735-L739 HydrophobicContact CG-CG 4.33Å; L735-L739 WeakPolarHBondContact O-CB 3.38Å; L735-L739 WeakPolarHBondContact O-CG 3.15Å; L735-L739 PolarHBondContact O-N 2.88Å; L735-L763 HydrophobicContact CD2-CD1 4.41Å; L735-L763 HydrophobicContact CD2-CD2 4.28Å; L735-L763 HydrophobicContact CG-CD1 4.3Å; L735-H844 HydrophobicContact CD2-CB 4.2Å; L735-H844 WeakPolarHBondContact CD2-ND1 3.16Å
736	Y	94.4	Very high	91.3	Very high	3 Å²	3	30.4 Å²	30.4	1%	0.012	15%	0.149	C	C	.	.	H	α-helix	trans	-60	-45.3	173.7	163.4	-89.6	0	0	0	111	L726 R729 S733 T740 P760 V766	L726-Y736 HydrophobicContact CD2-CE1 3.87Å; R729-Y736 HydrophobicContact CB-CE1 4.17Å; R729-Y736 WeakPolarHBondContact CB-OH 3.47Å; S733-Y736 PolarHBondContact O-N 2.67Å; S733-Y736 PolarHBondContact OG-N 3.19Å; Y736-T740 WeakPolarHBondContact O-CB 3.44Å; Y736-T740 PolarHBondContact O-N 3.32Å; Y736-T740 PolarHBondContact O-OG1 3.46Å; Y736-P760 HydrophobicContact CE2-CB 4.4Å; Y736-P760 PolarHBondContact OH-O 2.81Å; Y736-V766 HydrophobicContact CD2-CG2 3.79Å; Y736-V766 HydrophobicContact CE2-CG2 3.94Å
737	L	93.3	Very high	91.1	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-62.2	-48.4	177	-66.6	179	0	0	0	111.4	L688 Y691 I692 L726 S733 I734 L735 L741	L688-L737 HydrophobicContact CB-CD1 4.31Å; L688-L737 HydrophobicContact CD2-CD1 3.72Å; Y691-L737 HydrophobicContact CD1-CB 4.23Å; Y691-L737 HydrophobicContact CD1-CD1 4.3Å; Y691-L737 HydrophobicContact CE1-CB 4.06Å; I692-L737 HydrophobicContact CD1-CD1 4.13Å; I692-L737 HydrophobicContact CD1-CD2 3.87Å; I692-L737 HydrophobicContact CG1-CD1 4.07Å; I692-L737 HydrophobicContact CG1-CD2 4.07Å; L726-L737 HydrophobicContact CB-CD2 3.79Å; L726-L737 HydrophobicContact CD1-CD2 4.38Å; L726-L737 HydrophobicContact CD2-CD2 4.3Å; L726-L737 HydrophobicContact CG-CD2 4.4Å; S733-L737 PolarHBondContact O-N 2.88Å; I734-L737 PolarHBondContact O-N 2.65Å; L735-L737 VanDerWaalsContact C-N 3.34Å; L737-L741 VanDerWaalsContact O-CB 3.24Å; L737-L741 WeakPolarHBondContact O-CB 3.39Å; L737-L741 WeakPolarHBondContact O-CD1 3.33Å; L737-L741 WeakPolarHBondContact O-CG 3.42Å; L737-L741 PolarHBondContact O-N 2.82Å
738	Q	92.4	Very high	91.1	Very high	71 Å²	71	35.7 Å²	35.7	33%	0.332	19%	0.185	S	C	.	.	H	α-helix	trans	-55.8	-57.1	178	174.4	170.3	-13.9	0	0	111.3	I734 L735 T740 L741 D742	I734-Q738 VanDerWaalsContact O-CB 3.31Å; I734-Q738 WeakPolarHBondContact O-CB 3.42Å; I734-Q738 PolarHBondContact O-N 2.86Å; L735-Q738 PolarHBondContact O-N 2.87Å; Q738-T740 PolarHBondContact O-N 2.87Å; Q738-L741 PolarHBondContact O-N 3.37Å; Q738-D742 WeakPolarHBondContact O-CB 3.49Å; Q738-D742 PolarHBondContact O-N 3.1Å
739	L	93.1	Very high	91.1	Very high	25 Å²	25	31.8 Å²	31.8	13%	0.131	16%	0.161	C	C	.	.	H	α-helix	trans	-65.9	-39.1	-175.8	-66.4	175.9	0	0	0	112	L735 D742 L743 L763 V766 Y767 M770	L735-L739 HydrophobicContact CD1-CD1 3.9Å; L735-L739 HydrophobicContact CD1-CG 3.98Å; L735-L739 HydrophobicContact CG-CD1 3.9Å; L735-L739 HydrophobicContact CG-CG 4.33Å; L735-L739 WeakPolarHBondContact O-CB 3.38Å; L735-L739 WeakPolarHBondContact O-CG 3.15Å; L735-L739 PolarHBondContact O-N 2.88Å; L739-D742 PolarHBondContact O-N 3.29Å; L739-L743 WeakPolarHBondContact O-CG 3.39Å; L739-L743 PolarHBondContact O-N 3.37Å; L739-L763 HydrophobicContact CD1-CD1 4.07Å; L739-V766 HydrophobicContact CB-CG1 3.54Å; L739-V766 HydrophobicContact CD1-CG1 4.2Å; L739-Y767 HydrophobicContact CD1-CD1 4.3Å; L739-Y767 HydrophobicContact CD1-CE1 3.7Å; L739-M770 HydrophobicContact CB-SD 4.38Å; L739-M770 HydrophobicContact CD1-SD 4.13Å; L739-M770 HydrophobicContact CD2-CE 4.2Å; L739-M770 HydrophobicContact CD2-SD 4.04Å; L739-M770 HydrophobicContact CG-SD 4.42Å
740	T	94.7	Very high	90.9	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-64.1	-42.1	175.9	-56.5	0	0	0	0	111.4	L726 Y736 Q738 L743 F744 L749 V759 V766	L726-T740 HydrophobicContact CD2-CG2 4.02Å; Y736-T740 WeakPolarHBondContact O-CB 3.44Å; Y736-T740 PolarHBondContact O-N 3.32Å; Y736-T740 PolarHBondContact O-OG1 3.46Å; Q738-T740 PolarHBondContact O-N 2.87Å; T740-L743 WeakPolarHBondContact O-CB 3.31Å; T740-L743 PolarHBondContact O-N 3.02Å; T740-F744 HydrophobicContact CG2-CD2 4.22Å; T740-F744 HydrophobicContact CG2-CE2 4.01Å; T740-F744 VanDerWaalsContact O-CD2 3.25Å; T740-F744 WeakPolarHBondContact O-CD2 3.45Å; T740-F744 PolarHBondContact O-N 2.73Å; T740-F744 VanDerWaalsContact O-N 3.09Å; T740-L749 HydrophobicContact CG2-CD1 4.13Å; T740-V759 HydrophobicContact CG2-CG1 4.03Å; T740-V766 WeakPolarHBondContact OG1-CG2 3.42Å
741	L	93.1	Very high	90.6	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-71.6	-29.4	176.4	-68.4	168.7	0	0	0	112.4	Y691 R695 I702 F722 L726 L737 Q738 F744 H745	Y691-L741 HydrophobicContact CE1-CD1 4.28Å; R695-L741 HydrophobicContact CB-CD1 3.79Å; R695-L741 HydrophobicContact CG-CD1 4.05Å; I702-L741 HydrophobicContact CD1-CB 4.23Å; I702-L741 WeakPolarHBondContact CD1-O 3.5Å; I702-L741 HydrophobicContact CG2-CD2 3.96Å; F722-L741 HydrophobicContact CE1-CD2 4.11Å; F722-L741 HydrophobicContact CZ-CD2 4.02Å; L726-L741 HydrophobicContact CD1-CD2 4.09Å; L726-L741 HydrophobicContact CD1-CG 4.46Å; L737-L741 VanDerWaalsContact O-CB 3.24Å; L737-L741 WeakPolarHBondContact O-CB 3.39Å; L737-L741 WeakPolarHBondContact O-CD1 3.33Å; L737-L741 WeakPolarHBondContact O-CG 3.42Å; L737-L741 PolarHBondContact O-N 2.82Å; Q738-L741 PolarHBondContact O-N 3.37Å; L741-F744 PolarHBondContact O-N 2.87Å; L741-H745 WeakPolarHBondContact O-CB 3.26Å; L741-H745 PolarHBondContact O-N 2.85Å
742	D	92.1	Very high	90	Very high	32 Å²	32	34.8 Å²	34.8	17%	0.171	18%	0.182	C	C	.	.	H	α-helix	trans	-68.5	-34.7	171.4	-66.6	-18.7	0	0	0	111.7	R695 Q738 L739 H745 K746	R695-D742 IonicContact CZ-OD1 2.68Å; R695-D742 IonicContact NH1-OD1 2.65Å; R695-D742 PolarHBondContact NH1-OD1 3.23Å; R695-D742 IonicContact NH2-OD1 3.26Å; R695-D742 PolarHBondContact NH2-OD1 3.46Å; Q738-D742 WeakPolarHBondContact O-CB 3.49Å; Q738-D742 PolarHBondContact O-N 3.1Å; L739-D742 PolarHBondContact O-N 3.29Å; D742-H745 PolarHBondContact O-N 3.46Å; D742-K746 WeakPolarHBondContact O-CB 3.37Å; D742-K746 WeakPolarHBondContact O-CD 3.07Å; D742-K746 WeakPolarHBondContact O-CG 3.42Å; D742-K746 PolarHBondContact O-N 3.48Å
743	L	92.5	Very high	88.9	Confident	1 Å²	1	38 Å²	38	1%	0.005	22%	0.215	C	C	.	.	H	α-helix	trans	-67.5	-40	171.7	-69	171.9	0	0	0	111.8	L739 T740 G747 Q748 L749 V766 L769 M770	L739-L743 WeakPolarHBondContact O-CG 3.39Å; L739-L743 PolarHBondContact O-N 3.37Å; T740-L743 WeakPolarHBondContact O-CB 3.31Å; T740-L743 PolarHBondContact O-N 3.02Å; L743-G747 PolarHBondContact O-N 3.18Å; L743-Q748 HydrophobicContact CD2-CB 4.12Å; L743-Q748 PolarHBondContact O-N 3.39Å; L743-L749 HydrophobicContact CB-CB 4.39Å; L743-L749 HydrophobicContact CB-CD1 3.77Å; L743-L749 HydrophobicContact CB-CG 3.93Å; L743-L749 HydrophobicContact CD1-CD1 4.01Å; L743-L749 HydrophobicContact CD1-CG 4.5Å; L743-L749 PolarHBondContact O-N 3.01Å; L743-L749 VanDerWaalsContact O-N 3.13Å; L743-V766 HydrophobicContact CD1-CG1 4.16Å; L743-L769 HydrophobicContact CD1-CD2 3.91Å; L743-L769 HydrophobicContact CD1-CG 4.26Å; L743-M770 HydrophobicContact CD2-CG 4.04Å
744	F	91.7	Very high	87.7	Confident	1 Å²	1	39 Å²	39	0%	0.004	23%	0.226	C	C	.	.	H	α-helix	trans	-63.2	-43	170.9	-83.2	-70	0	0	0	112	I702 N705 V706 F722 T740 L741 K746 G747 L749 L751 V759	I702-F744 HydrophobicContact CG2-CB 4.41Å; N705-F744 HydrophobicContact CB-CD1 4.13Å; N705-F744 PolarHBondContact ND2-O 2.8Å; V706-F744 HydrophobicContact CG2-CD1 3.98Å; V706-F744 HydrophobicContact CG2-CE1 4.19Å; V706-F744 HydrophobicContact CG2-CG 4.18Å; F722-F744 AromaticContact CE2-CE2 3.99Å; F722-F744 HydrophobicContact CE2-CE2 3.99Å; F722-F744 HydrophobicContact CE2-CZ 4.17Å; F722-F744 HydrophobicContact CZ-CD2 4.36Å; F722-F744 HydrophobicContact CZ-CE2 4.09Å; T740-F744 HydrophobicContact CG2-CD2 4.22Å; T740-F744 HydrophobicContact CG2-CE2 4.01Å; T740-F744 VanDerWaalsContact O-CD2 3.25Å; T740-F744 WeakPolarHBondContact O-CD2 3.45Å; T740-F744 PolarHBondContact O-N 2.73Å; T740-F744 VanDerWaalsContact O-N 3.09Å; L741-F744 PolarHBondContact O-N 2.87Å; F744-K746 PolarHBondContact O-N 2.93Å; F744-G747 PolarHBondContact O-N 3.33Å; F744-G747 VanDerWaalsContact O-N 3.12Å; F744-L749 HydrophobicContact CD1-CB 3.73Å; F744-L749 VanDerWaalsContact CD1-O 3.25Å; F744-L749 WeakPolarHBondContact CD1-O 3.37Å; F744-L749 HydrophobicContact CD2-CB 4.21Å; F744-L749 HydrophobicContact CD2-CD1 4.31Å; F744-L749 HydrophobicContact CE1-CB 3.72Å; F744-L749 HydrophobicContact CE2-CB 4.2Å; F744-L749 HydrophobicContact CE2-CD1 4.09Å; F744-L749 HydrophobicContact CG-CB 3.97Å; F744-L749 HydrophobicContact CZ-CB 3.96Å; F744-L749 HydrophobicContact CZ-CD1 4.43Å; F744-L751 HydrophobicContact CE1-CD2 4.27Å; F744-L751 HydrophobicContact CE1-CG 3.88Å; F744-L751 HydrophobicContact CZ-CD2 3.95Å; F744-L751 HydrophobicContact CZ-CG 3.91Å; F744-V759 HydrophobicContact CE2-CG2 4.44Å; F744-V759 HydrophobicContact CZ-CG2 4.17Å
745	H	91.6	Very high	86.9	Confident	77 Å²	77	42.6 Å²	42.6	36%	0.356	25%	0.246	S	C	.	.	H	α-helix	trans	-59.2	-45.2	177.1	-179.3	23.3	0	0	0	111.8	S699 Q701 I702 L741 D742 G747	S699-H745 PolarHBondContact OG-ND1 3.38Å; Q701-H745 PolarHBondContact OE1-CE1 2.95Å; Q701-H745 PolarHBondContact OE1-ND1 3.31Å; Q701-H745 PolarHBondContact OE1-O 2.79Å; I702-H745 HydrophobicContact CD1-CB 4.05Å; I702-H745 HydrophobicContact CG1-CB 3.72Å; L741-H745 WeakPolarHBondContact O-CB 3.26Å; L741-H745 PolarHBondContact O-N 2.85Å; D742-H745 PolarHBondContact O-N 3.46Å; H745-G747 PolarHBondContact O-N 2.97Å
746	K	90.7	Very high	86.3	Confident	126 Å²	126	43.5 Å²	43.5	55%	0.548	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-2	177.8	-68	165.2	-173.8	170.4	0	114.2	D742 F744 Q748	D742-K746 WeakPolarHBondContact O-CB 3.37Å; D742-K746 WeakPolarHBondContact O-CD 3.07Å; D742-K746 WeakPolarHBondContact O-CG 3.42Å; D742-K746 PolarHBondContact O-N 3.48Å; F744-K746 PolarHBondContact O-N 2.93Å; K746-Q748 HydrophobicContact CB-CB 4.5Å; K746-Q748 HydrophobicContact CB-CG 3.87Å; K746-Q748 PolarHBondContact O-N 3.17Å
747	G	87.3	Confident	85.6	Confident	48 Å²	48	50.3 Å²	50.3	50%	0.495	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.9	15.3	-174.3	0	0	0	0	0	114.3	L743 F744 H745	L743-G747 PolarHBondContact O-N 3.18Å; F744-G747 PolarHBondContact O-N 3.33Å; F744-G747 VanDerWaalsContact O-N 3.12Å; H745-G747 PolarHBondContact O-N 2.97Å
748	Q	88.3	Confident	85.1	Confident	77 Å²	77	53.7 Å²	53.7	36%	0.36	30%	0.304	S	S	.	.	S	Bend	trans	-83.5	-21.2	179.1	-65	170.9	-5.4	0	0	111.3	L743 K746 V773	L743-Q748 HydrophobicContact CD2-CB 4.12Å; L743-Q748 PolarHBondContact O-N 3.39Å; K746-Q748 HydrophobicContact CB-CB 4.5Å; K746-Q748 HydrophobicContact CB-CG 3.87Å; K746-Q748 PolarHBondContact O-N 3.17Å; Q748-V773 HydrophobicContact CG-CG1 4.17Å
749	L	88.3	Confident	84.9	Confident	8 Å²	8	50.5 Å²	50.5	4%	0.042	29%	0.289	C	S	.	.			trans	-120.4	144.5	162.9	-72	175.9	0	0	0	110.3	T740 L743 F744 V758 L769	T740-L749 HydrophobicContact CG2-CD1 4.13Å; L743-L749 HydrophobicContact CB-CB 4.39Å; L743-L749 HydrophobicContact CB-CD1 3.77Å; L743-L749 HydrophobicContact CB-CG 3.93Å; L743-L749 HydrophobicContact CD1-CD1 4.01Å; L743-L749 HydrophobicContact CD1-CG 4.5Å; L743-L749 PolarHBondContact O-N 3.01Å; L743-L749 VanDerWaalsContact O-N 3.13Å; F744-L749 HydrophobicContact CD1-CB 3.73Å; F744-L749 VanDerWaalsContact CD1-O 3.25Å; F744-L749 WeakPolarHBondContact CD1-O 3.37Å; F744-L749 HydrophobicContact CD2-CB 4.21Å; F744-L749 HydrophobicContact CD2-CD1 4.31Å; F744-L749 HydrophobicContact CE1-CB 3.72Å; F744-L749 HydrophobicContact CE2-CB 4.2Å; F744-L749 HydrophobicContact CE2-CD1 4.09Å; F744-L749 HydrophobicContact CG-CB 3.97Å; F744-L749 HydrophobicContact CZ-CB 3.96Å; F744-L749 HydrophobicContact CZ-CD1 4.43Å; L749-V758 HydrophobicContact CD2-CG1 4.13Å; L749-V758 WeakPolarHBondContact CD2-O 3.5Å; L749-L769 HydrophobicContact CD1-CD2 4.3Å; L749-L769 HydrophobicContact CD2-CD2 3.65Å; L749-L769 HydrophobicContact CG-CD2 4.01Å
750	A	84.7	Confident	84.8	Confident	43 Å²	43	49.6 Å²	49.6	36%	0.355	29%	0.285	S	S	.	.			trans	-152.8	134	171.5	0	0	0	0	0	110.6	N705 K752	N705-A750 HydrophobicContact CB-CB 4.34Å; N705-A750 WeakPolarHBondContact O-CA 3.33Å; A750-K752 PolarHBondContact O-N 3.47Å
751	L	83.3	Confident	84.6	Confident	7 Å²	7	53.3 Å²	53.3	4%	0.037	31%	0.307	C	S	.	.			trans	-83.5	109.3	179.3	-65.7	-175.7	0	0	0	110.9	N705 V706 F722 F744 Y756 V759	N705-L751 PolarHBondContact O-N 3.18Å; V706-L751 HydrophobicContact CG1-CD1 4.24Å; F722-L751 HydrophobicContact CD2-CD1 3.72Å; F722-L751 HydrophobicContact CE2-CD1 3.97Å; F744-L751 HydrophobicContact CE1-CD2 4.27Å; F744-L751 HydrophobicContact CE1-CG 3.88Å; F744-L751 HydrophobicContact CZ-CD2 3.95Å; F744-L751 HydrophobicContact CZ-CG 3.91Å; L751-Y756 HydrophobicContact CD1-CD1 3.83Å; L751-Y756 HydrophobicContact CD1-CE1 3.68Å; L751-Y756 HydrophobicContact CD2-CD1 4.27Å; L751-V759 HydrophobicContact CD2-CG2 3.84Å
752	K	74.4	Confident	84.5	Confident	176 Å²	176	55.2 Å²	55.2	77%	0.765	32%	0.321	S	S	*	.	S	Bend	trans	-87.3	112.9	171.2	-66.3	-176.3	179.8	179.5	0	109.6	A750 G754 N755	A750-K752 PolarHBondContact O-N 3.47Å; K752-G754 VanDerWaalsContact C-N 3.34Å; K752-G754 PolarHBondContact O-N 3.49Å; K752-N755 WeakPolarHBondContact O-CB 3.45Å; K752-N755 PolarHBondContact O-N 2.88Å
753	G	65	Low	84.5	Confident	67 Å²	67	55 Å²	55	69%	0.691	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	63	31.4	173.4	0	0	0	0	0	115.2	N755	G753-N755 VanDerWaalsContact C-N 3.3Å; G753-N755 PolarHBondContact O-N 3.36Å
754	G	67.3	Low	84.5	Confident	29 Å²	29	55.9 Å²	55.9	30%	0.299	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.3	13.2	-179.3	0	0	0	0	0	115.1	K752 Y756	K752-G754 VanDerWaalsContact C-N 3.34Å; K752-G754 PolarHBondContact O-N 3.49Å; G754-Y756 VanDerWaalsContact O-CD2 3.3Å; G754-Y756 WeakPolarHBondContact O-CD2 3.32Å; G754-Y756 WeakPolarHBondContact O-CE2 3.37Å; G754-Y756 PolarHBondContact O-N 3.16Å; G754-Y756 VanDerWaalsContact O-N 3.07Å
755	N	75.2	Confident	84.6	Confident	78 Å²	78	59.7 Å²	59.7	42%	0.417	34%	0.343	S	S	.	.			trans	-76.4	94	179.3	-174.9	2.4	0	0	0	112.5	K752 G753 L757	K752-N755 WeakPolarHBondContact O-CB 3.45Å; K752-N755 PolarHBondContact O-N 2.88Å; G753-N755 VanDerWaalsContact C-N 3.3Å; G753-N755 PolarHBondContact O-N 3.36Å; N755-L757 PolarHBondContact O-N 3.38Å; N755-L757 WeakPolarHBondContact OD1-CB 3.41Å; N755-L757 VanDerWaalsContact OD1-CG 3.26Å; N755-L757 WeakPolarHBondContact OD1-CG 3.4Å; N755-L757 PolarHBondContact OD1-N 2.94Å
756	Y	79.6	Confident	84.7	Confident	45 Å²	45	56 Å²	56	18%	0.176	33%	0.326	C	S	.	.	G	3₁₀ helix	trans	-71.7	2.3	177.8	-50.1	-69.3	0	0	0	115	L718 K721 F722 R729 L751 G754 V758 V759	L718-Y756 PolarHBondContact O-OH 3.24Å; K721-Y756 WeakPolarHBondContact CB-OH 3.45Å; F722-Y756 HydrophobicContact CB-CE1 3.97Å; F722-Y756 HydrophobicContact CD2-CD1 4.27Å; F722-Y756 AromaticContact CD2-CE1 3.97Å; F722-Y756 HydrophobicContact CD2-CE1 3.97Å; F722-Y756 HydrophobicContact CG-CE1 4.49Å; R729-Y756 PolarHBondContact NH2-O 3.24Å; R729-Y756 VanDerWaalsContact NH2-O 3.13Å; L751-Y756 HydrophobicContact CD1-CD1 3.83Å; L751-Y756 HydrophobicContact CD1-CE1 3.68Å; L751-Y756 HydrophobicContact CD2-CD1 4.27Å; G754-Y756 VanDerWaalsContact O-CD2 3.3Å; G754-Y756 WeakPolarHBondContact O-CD2 3.32Å; G754-Y756 WeakPolarHBondContact O-CE2 3.37Å; G754-Y756 PolarHBondContact O-N 3.16Å; G754-Y756 VanDerWaalsContact O-N 3.07Å; Y756-V758 PolarHBondContact O-N 3.1Å; Y756-V759 PolarHBondContact O-N 2.99Å
757	L	79.4	Confident	84.9	Confident	145 Å²	145	50.3 Å²	50.3	76%	0.759	30%	0.301	S	S	*	.	G	3₁₀ helix	trans	-69.6	-16.2	172.1	-61.5	174.4	0	0	0	113.1	N755	N755-L757 PolarHBondContact O-N 3.38Å; N755-L757 WeakPolarHBondContact OD1-CB 3.41Å; N755-L757 VanDerWaalsContact OD1-CG 3.26Å; N755-L757 WeakPolarHBondContact OD1-CG 3.4Å; N755-L757 PolarHBondContact OD1-N 2.94Å
758	V	82.6	Confident	85.2	Confident	72 Å²	72	49.1 Å²	49.1	44%	0.436	28%	0.284	S	S	.	.	G	3₁₀ helix	trans	-83.1	-16.3	176.4	-169.5	0	0	0	0	111.8	L749 Y756	L749-V758 HydrophobicContact CD2-CG1 4.13Å; L749-V758 WeakPolarHBondContact CD2-O 3.5Å; Y756-V758 PolarHBondContact O-N 3.1Å
759	V	87.5	Confident	85.5	Confident	3 Å²	3	47.6 Å²	47.6	2%	0.018	28%	0.278	C	S	.	.	S	Bend	trans	-73.7	135.1	171.1	-172.9	0	0	0	0	108.1	L726 R729 T740 F744 L751 Y756	L726-V759 HydrophobicContact CD2-CG1 3.77Å; R729-V759 PolarHBondContact NH1-O 3.21Å; T740-V759 HydrophobicContact CG2-CG1 4.03Å; F744-V759 HydrophobicContact CE2-CG2 4.44Å; F744-V759 HydrophobicContact CZ-CG2 4.17Å; L751-V759 HydrophobicContact CD2-CG2 3.84Å; Y756-V759 PolarHBondContact O-N 2.99Å
760	P	91.3	Very high	85.7	Confident	7 Å²	7	48.4 Å²	48.4	5%	0.045	28%	0.282	C	S	.	.			trans	-55.2	149.1	170.2	-29.8	38.8	0	0	0	113	R729 Y736 E765 V766 L769	R729-P760 PolarHBondContact NH1-O 3.45Å; Y736-P760 HydrophobicContact CE2-CB 4.4Å; Y736-P760 PolarHBondContact OH-O 2.81Å; P760-E765 WeakPolarHBondContact CA-OE2 3.36Å; P760-E765 HydrophobicContact CB-CB 3.83Å; P760-V766 HydrophobicContact CB-CG2 3.68Å; P760-V766 HydrophobicContact CG-CG2 3.86Å; P760-L769 HydrophobicContact CG-CD2 4.48Å
761	V	90.1	Very high	86.2	Confident	78 Å²	78	46.4 Å²	46.4	47%	0.473	27%	0.265	S	S	.	.	S	Bend	trans	-94.2	-15.6	173.7	-59.1	0	0	0	0	113.5	E765	V761-E765 WeakPolarHBondContact CG2-OE2 3.45Å; V761-E765 PolarHBondContact N-OE2 3.04Å
762	S	91.1	Very high	86.7	Confident	40 Å²	40	51.9 Å²	51.9	28%	0.28	29%	0.285	S	S	.	.	S	Bend	trans	-143.3	163.2	-179.4	78.6	0	0	0	0	112.7	S764 E765 V766	S762-S764 PolarHBondContact O-N 3.43Å; S762-S764 WeakPolarHBondContact OG-CB 3.25Å; S762-S764 PolarHBondContact OG-N 3.01Å; S762-E765 PolarHBondContact O-N 3.23Å; S762-E765 PolarHBondContact OG-N 2.84Å; S762-V766 WeakPolarHBondContact O-CG2 3.42Å; S762-V766 PolarHBondContact O-N 3.02Å
763	L	92.1	Very high	87.5	Confident	27 Å²	27	46.4 Å²	46.4	14%	0.141	27%	0.266	C	S	.	.	H	α-helix	trans	-62.4	-28.8	172.2	-175.3	63.2	0	0	0	112.2	A457 L735 L739 V766 Y767	A457-L763 HydrophobicContact CB-CD2 4.25Å; L735-L763 HydrophobicContact CD2-CD1 4.41Å; L735-L763 HydrophobicContact CD2-CD2 4.28Å; L735-L763 HydrophobicContact CG-CD1 4.3Å; L739-L763 HydrophobicContact CD1-CD1 4.07Å; L763-V766 WeakPolarHBondContact O-CB 3.44Å; L763-V766 PolarHBondContact O-N 3.26Å; L763-Y767 HydrophobicContact CD1-CE1 4.18Å; L763-Y767 HydrophobicContact CD1-CE2 4.31Å; L763-Y767 HydrophobicContact CD2-CE2 4.09Å; L763-Y767 HydrophobicContact CG-CD2 4.32Å; L763-Y767 HydrophobicContact CG-CE1 4.47Å; L763-Y767 HydrophobicContact CG-CE2 3.72Å; L763-Y767 WeakPolarHBondContact O-CD2 3.47Å; L763-Y767 PolarHBondContact O-N 3.2Å
764	S	93.3	Very high	88.8	Confident	19 Å²	19	46 Å²	46	13%	0.133	25%	0.253	C	S	.	.	H	α-helix	trans	-66.6	-41.8	175.4	179.6	0	0	0	0	112.1	S762 V766 Y767 L768 W850 E858	S762-S764 PolarHBondContact O-N 3.43Å; S762-S764 WeakPolarHBondContact OG-CB 3.25Å; S762-S764 PolarHBondContact OG-N 3.01Å; S764-V766 VanDerWaalsContact C-N 3.35Å; S764-Y767 PolarHBondContact O-N 3.07Å; S764-L768 WeakPolarHBondContact O-CB 3.26Å; S764-L768 PolarHBondContact O-N 3.39Å; S764-W850 PolarHBondContact O-NE1 3.35Å; S764-W850 PolarHBondContact OG-NE1 3.49Å; S764-E858 WeakPolarHBondContact CB-OE1 3.48Å; S764-E858 VanDerWaalsContact OG-CD 3.3Å; S764-E858 PolarHBondContact OG-OE1 3.24Å
765	E	93.3	Very high	90.2	Very high	82 Å²	82	44.9 Å²	44.9	38%	0.383	24%	0.24	S	C	.	.	H	α-helix	trans	-67.1	-34.2	173.3	-74.5	-171	161.8	0	0	112.7	P760 V761 S762 L768 L769	P760-E765 WeakPolarHBondContact CA-OE2 3.36Å; P760-E765 HydrophobicContact CB-CB 3.83Å; V761-E765 WeakPolarHBondContact CG2-OE2 3.45Å; V761-E765 PolarHBondContact N-OE2 3.04Å; S762-E765 PolarHBondContact O-N 3.23Å; S762-E765 PolarHBondContact OG-N 2.84Å; E765-L768 PolarHBondContact O-N 2.96Å; E765-L769 WeakPolarHBondContact O-CB 3.3Å; E765-L769 PolarHBondContact O-N 3.35Å
766	V	94.4	Very high	90.9	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-61.5	-47.4	173.1	175.8	0	0	0	0	110.5	Y736 L739 T740 L743 P760 S762 L763 S764 L769 M770	Y736-V766 HydrophobicContact CD2-CG2 3.79Å; Y736-V766 HydrophobicContact CE2-CG2 3.94Å; L739-V766 HydrophobicContact CB-CG1 3.54Å; L739-V766 HydrophobicContact CD1-CG1 4.2Å; T740-V766 WeakPolarHBondContact OG1-CG2 3.42Å; L743-V766 HydrophobicContact CD1-CG1 4.16Å; P760-V766 HydrophobicContact CB-CG2 3.68Å; P760-V766 HydrophobicContact CG-CG2 3.86Å; S762-V766 WeakPolarHBondContact O-CG2 3.42Å; S762-V766 PolarHBondContact O-N 3.02Å; L763-V766 WeakPolarHBondContact O-CB 3.44Å; L763-V766 PolarHBondContact O-N 3.26Å; S764-V766 VanDerWaalsContact C-N 3.35Å; V766-L769 PolarHBondContact O-N 2.87Å; V766-M770 HydrophobicContact CG1-SD 4.09Å; V766-M770 WeakPolarHBondContact O-CG 3.41Å; V766-M770 PolarHBondContact O-N 3.5Å
767	Y	95.1	Very high	91.5	Very high	6 Å²	6	48.9 Å²	48.9	2%	0.024	27%	0.27	C	S	.	.	H	α-helix	trans	-63.4	-42.4	175.2	-64.5	-36.7	0	0	0	112.4	L739 L763 S764 L769 M770 C771 S846 F847 W850	L739-Y767 HydrophobicContact CD1-CD1 4.3Å; L739-Y767 HydrophobicContact CD1-CE1 3.7Å; L763-Y767 HydrophobicContact CD1-CE1 4.18Å; L763-Y767 HydrophobicContact CD1-CE2 4.31Å; L763-Y767 HydrophobicContact CD2-CE2 4.09Å; L763-Y767 HydrophobicContact CG-CD2 4.32Å; L763-Y767 HydrophobicContact CG-CE1 4.47Å; L763-Y767 HydrophobicContact CG-CE2 3.72Å; L763-Y767 WeakPolarHBondContact O-CD2 3.47Å; L763-Y767 PolarHBondContact O-N 3.2Å; S764-Y767 PolarHBondContact O-N 3.07Å; Y767-L769 VanDerWaalsContact C-N 3.3Å; Y767-L769 PolarHBondContact O-N 3.11Å; Y767-M770 HydrophobicContact CD1-SD 4.34Å; Y767-M770 PolarHBondContact O-N 3.35Å; Y767-C771 WeakPolarHBondContact O-CB 3.39Å; Y767-C771 PolarHBondContact O-N 3.14Å; Y767-C771 PolarHBondContact O-SG 3.37Å; Y767-S846 PolarHBondContact OH-OG 3.29Å; Y767-F847 AromaticContact CD1-CD2 3.66Å; Y767-F847 HydrophobicContact CD1-CD2 3.66Å; Y767-F847 HydrophobicContact CD1-CE2 4.33Å; Y767-F847 HydrophobicContact CD2-CD2 4.03Å; Y767-F847 HydrophobicContact CE1-CB 4.07Å; Y767-F847 AromaticContact CE1-CD2 3.94Å; Y767-F847 HydrophobicContact CE1-CD2 3.94Å; Y767-F847 HydrophobicContact CE1-CG 4.39Å; Y767-F847 HydrophobicContact CE2-CB 4.18Å; Y767-F847 HydrophobicContact CE2-CD2 4.28Å; Y767-F847 AromaticContact CG-CD2 3.72Å; Y767-F847 HydrophobicContact CG-CD2 3.72Å; Y767-F847 HydrophobicContact CG-CE2 4.3Å; Y767-W850 HydrophobicContact CD2-CB 3.81Å; Y767-W850 AromaticContact CD2-CD1 3.8Å; Y767-W850 AromaticContact CD2-CD2 3.95Å; Y767-W850 HydrophobicContact CD2-CD2 3.95Å; Y767-W850 AromaticContact CD2-CG 3.57Å; Y767-W850 HydrophobicContact CD2-CG 3.57Å; Y767-W850 HydrophobicContact CE2-CB 4.17Å; Y767-W850 HydrophobicContact CE2-CG 4.39Å; Y767-W850 HydrophobicContact CG-CD2 4.21Å; Y767-W850 HydrophobicContact CG-CG 4.31Å
768	L	93.9	Very high	92	Very high	23 Å²	23	49 Å²	49	12%	0.12	26%	0.264	C	S	.	.	H	α-helix	trans	-58.7	-42	176.1	-176.4	57.7	0	0	0	111.8	S764 E765 R772 W850 D861 F862	S764-L768 WeakPolarHBondContact O-CB 3.26Å; S764-L768 PolarHBondContact O-N 3.39Å; E765-L768 PolarHBondContact O-N 2.96Å; L768-R772 WeakPolarHBondContact O-CB 3.49Å; L768-R772 VanDerWaalsContact O-CG 3.26Å; L768-R772 WeakPolarHBondContact O-CG 3.2Å; L768-R772 PolarHBondContact O-N 3.49Å; L768-W850 HydrophobicContact CB-CZ2 3.9Å; L768-W850 HydrophobicContact CD1-CZ2 4.39Å; L768-W850 VanDerWaalsContact N-CZ2 3.35Å; L768-D861 HydrophobicContact CD1-CB 3.82Å; L768-F862 HydrophobicContact CD1-CD2 3.88Å; L768-F862 HydrophobicContact CD1-CE2 3.94Å
769	L	93.2	Very high	92.4	Very high	45 Å²	45	51.2 Å²	51.2	24%	0.236	27%	0.273	C	S	.	.	H	α-helix	trans	-69.2	-43.3	176.5	-179.4	54.7	0	0	0	111.9	L743 L749 P760 E765 V766 Y767 C771 R772 V773	L743-L769 HydrophobicContact CD1-CD2 3.91Å; L743-L769 HydrophobicContact CD1-CG 4.26Å; L749-L769 HydrophobicContact CD1-CD2 4.3Å; L749-L769 HydrophobicContact CD2-CD2 3.65Å; L749-L769 HydrophobicContact CG-CD2 4.01Å; P760-L769 HydrophobicContact CG-CD2 4.48Å; E765-L769 WeakPolarHBondContact O-CB 3.3Å; E765-L769 PolarHBondContact O-N 3.35Å; V766-L769 PolarHBondContact O-N 2.87Å; Y767-L769 VanDerWaalsContact C-N 3.3Å; Y767-L769 PolarHBondContact O-N 3.11Å; L769-C771 PolarHBondContact O-N 3.01Å; L769-R772 PolarHBondContact O-N 2.94Å; L769-V773 HydrophobicContact CD1-CG2 4.16Å; L769-V773 WeakPolarHBondContact O-CG2 3.24Å; L769-V773 PolarHBondContact O-N 3.43Å
770	M	93.4	Very high	92.7	Very high	25 Å²	25	53.6 Å²	53.6	12%	0.123	29%	0.288	C	S	.	.	H	α-helix	trans	-56.9	-48.2	173.8	-73.6	172.3	61.5	0	0	111.5	L739 L743 V766 Y767 V773 S774 F831	L739-M770 HydrophobicContact CB-SD 4.38Å; L739-M770 HydrophobicContact CD1-SD 4.13Å; L739-M770 HydrophobicContact CD2-CE 4.2Å; L739-M770 HydrophobicContact CD2-SD 4.04Å; L739-M770 HydrophobicContact CG-SD 4.42Å; L743-M770 HydrophobicContact CD2-CG 4.04Å; V766-M770 HydrophobicContact CG1-SD 4.09Å; V766-M770 WeakPolarHBondContact O-CG 3.41Å; V766-M770 PolarHBondContact O-N 3.5Å; Y767-M770 HydrophobicContact CD1-SD 4.34Å; Y767-M770 PolarHBondContact O-N 3.35Å; M770-V773 PolarHBondContact O-N 3.11Å; M770-S774 PolarHBondContact O-N 3.12Å; M770-S774 PolarHBondContact O-OG 3.29Å; M770-F831 HydrophobicContact CB-CE1 4.1Å; M770-F831 HydrophobicContact CB-CZ 4.33Å; M770-F831 HydrophobicContact CE-CE1 4.07Å
771	C	94.4	Very high	92.9	Very high	1 Å²	1	53.8 Å²	53.8	1%	0.007	29%	0.288	C	S	.	.	H	α-helix	trans	-64.4	-40.6	177.7	-69.7	0	0	0	0	112.4	Y767 L769 V773 S774 F775 W850 F862	Y767-C771 WeakPolarHBondContact O-CB 3.39Å; Y767-C771 PolarHBondContact O-N 3.14Å; Y767-C771 PolarHBondContact O-SG 3.37Å; L769-C771 PolarHBondContact O-N 3.01Å; C771-V773 VanDerWaalsContact C-N 3.3Å; C771-V773 PolarHBondContact O-N 2.96Å; C771-S774 PolarHBondContact O-N 3.22Å; C771-F775 HydrophobicContact CB-CD2 4.37Å; C771-F775 WeakPolarHBondContact O-CA 3.33Å; C771-F775 WeakPolarHBondContact O-CB 3.4Å; C771-F775 WeakPolarHBondContact O-CD2 3.41Å; C771-F775 PolarHBondContact O-N 3.1Å; C771-W850 HydrophobicContact CB-CH2 4.26Å; C771-F862 HydrophobicContact CB-CB 4.38Å; C771-F862 HydrophobicContact CB-CD1 3.94Å; C771-F862 HydrophobicContact CB-CD2 3.59Å; C771-F862 HydrophobicContact CB-CE1 4.13Å; C771-F862 HydrophobicContact CB-CE2 3.81Å; C771-F862 HydrophobicContact CB-CG 3.67Å; C771-F862 HydrophobicContact CB-CZ 4.06Å
772	R	93.6	Very high	93.1	Very high	121 Å²	121	53.9 Å²	53.9	46%	0.457	28%	0.283	S	S	.	.	H	α-helix	trans	-65	-28.8	175.8	-74.7	175.4	176.7	165.6	-2.4	113.9	L768 L769 D861 F862	L768-R772 WeakPolarHBondContact O-CB 3.49Å; L768-R772 VanDerWaalsContact O-CG 3.26Å; L768-R772 WeakPolarHBondContact O-CG 3.2Å; L768-R772 PolarHBondContact O-N 3.49Å; L769-R772 PolarHBondContact O-N 2.94Å; R772-D861 IonicContact CZ-OD2 2.78Å; R772-D861 IonicContact NE-OD2 2.78Å; R772-D861 IonicContact NH2-OD2 3.67Å; R772-D861 PolarHBondContact NH2-OD2 2.98Å; R772-F862 HydrophobicContact CG-CE2 3.65Å; R772-F862 HydrophobicContact CG-CZ 3.88Å
773	V	92.6	Very high	93.3	Very high	61 Å²	61	58.9 Å²	58.9	37%	0.37	30%	0.296	S	S	.	.	H	α-helix	trans	-82	-37.3	176	178.5	0	0	0	0	111.8	Q748 L769 M770 C771	Q748-V773 HydrophobicContact CG-CG1 4.17Å; L769-V773 HydrophobicContact CD1-CG2 4.16Å; L769-V773 WeakPolarHBondContact O-CG2 3.24Å; L769-V773 PolarHBondContact O-N 3.43Å; M770-V773 PolarHBondContact O-N 3.11Å; C771-V773 VanDerWaalsContact C-N 3.3Å; C771-V773 PolarHBondContact O-N 2.96Å
774	S	92.5	Very high	93.5	Very high	59 Å²	59	57.7 Å²	57.7	41%	0.413	29%	0.29	S	S	.	.	H	α-helix	trans	-74.2	-29.8	174.5	-71.3	0	0	0	0	113.7	M770 C771 F831	M770-S774 PolarHBondContact O-N 3.12Å; M770-S774 PolarHBondContact O-OG 3.29Å; C771-S774 PolarHBondContact O-N 3.22Å; S774-F831 WeakPolarHBondContact OG-CE2 3.33Å
775	F	94.9	Very high	93.6	Very high	5 Å²	5	58.2 Å²	58.2	2%	0.022	29%	0.291	C	S	.	.			trans	-132.6	78.1	-176.2	-46.6	-64.5	0	0	0	110.1	C771 D777 V780 F781 V784 L828 F831 F862	C771-F775 HydrophobicContact CB-CD2 4.37Å; C771-F775 WeakPolarHBondContact O-CA 3.33Å; C771-F775 WeakPolarHBondContact O-CB 3.4Å; C771-F775 WeakPolarHBondContact O-CD2 3.41Å; C771-F775 PolarHBondContact O-N 3.1Å; F775-D777 VanDerWaalsContact C-N 3.35Å; F775-D777 PolarHBondContact O-N 3.13Å; F775-V780 HydrophobicContact CD1-CG1 4.04Å; F775-F781 HydrophobicContact CB-CB 4.08Å; F775-F781 AromaticContact CD2-CD2 3.77Å; F775-F781 HydrophobicContact CD2-CD2 3.77Å; F775-F781 HydrophobicContact CD2-CE2 4.45Å; F775-F781 HydrophobicContact CE2-CD2 4.11Å; F775-F781 HydrophobicContact CE2-CE2 4.49Å; F775-F781 HydrophobicContact CG-CB 4.29Å; F775-F781 HydrophobicContact CG-CD2 4.06Å; F775-V784 HydrophobicContact CD1-CG2 4.42Å; F775-V784 HydrophobicContact CE1-CG1 4.46Å; F775-V784 HydrophobicContact CE1-CG2 3.91Å; F775-V784 HydrophobicContact CZ-CG2 4.1Å; F775-L828 HydrophobicContact CZ-CD2 4.06Å; F775-F831 HydrophobicContact CE2-CD2 4.23Å; F775-F831 AromaticContact CE2-CE2 3.62Å; F775-F831 HydrophobicContact CE2-CE2 3.62Å; F775-F831 HydrophobicContact CE2-CZ 4.12Å; F775-F831 HydrophobicContact CZ-CD2 4.23Å; F775-F831 AromaticContact CZ-CE2 3.86Å; F775-F831 HydrophobicContact CZ-CE2 3.86Å; F775-F862 HydrophobicContact CB-CE1 3.95Å; F775-F862 HydrophobicContact CD2-CE1 4.39Å
776	P	91.3	Very high	93.7	Very high	99 Å²	99	56 Å²	56	64%	0.643	28%	0.284	S	S	*	.	S	Bend	trans	-65.8	-36.2	-176.3	-22.5	35	0	0	0	113.4
777	D	90.8	Very high	93.9	Very high	109 Å²	109	56 Å²	56	58%	0.583	28%	0.284	S	S	*	.	S	Bend	trans	-108.7	140.4	178.8	-59.1	-68.5	0	0	0	110.7	F775 D779 V780	F775-D777 VanDerWaalsContact C-N 3.35Å; F775-D777 PolarHBondContact O-N 3.13Å; D777-D779 PolarHBondContact O-N 3.36Å; D777-V780 HydrophobicContact CB-CG2 4.22Å; D777-V780 WeakPolarHBondContact O-CB 3.36Å; D777-V780 PolarHBondContact O-N 3.09Å
778	K	90.1	Very high	94	Very high	146 Å²	146	55.9 Å²	55.9	64%	0.635	28%	0.284	S	S	*	.	H	α-helix	trans	-54.7	-41	-179.5	-168.4	-176.2	-174.5	-126.3	0	112.2	V780 F781 E782	K778-V780 PolarHBondContact O-N 3.4Å; K778-V780 VanDerWaalsContact O-N 3.13Å; K778-F781 PolarHBondContact O-N 3.28Å; K778-E782 WeakPolarHBondContact CE-OE1 3.23Å; K778-E782 HydrophobicContact CG-CG 4.13Å; K778-E782 IonicContact NZ-OE1 2.72Å; K778-E782 PolarHBondContact NZ-OE1 3.47Å; K778-E782 WeakPolarHBondContact O-CG 3.31Å; K778-E782 PolarHBondContact O-N 2.91Å
779	D	91.9	Very high	94.1	Very high	119 Å²	119	55.1 Å²	55.1	64%	0.636	28%	0.28	S	S	*	.	H	α-helix	trans	-64.4	-16.2	-178.2	-59.6	-21.4	0	0	0	113.8	D777 R783	D777-D779 PolarHBondContact O-N 3.36Å; D779-R783 WeakPolarHBondContact O-CG 3.47Å; D779-R783 PolarHBondContact O-NE 3.07Å
780	V	93	Very high	94.3	Very high	54 Å²	54	53 Å²	53	33%	0.327	27%	0.269	S	S	.	.	H	α-helix	trans	-81.8	-41.6	171.8	-173.8	0	0	0	0	110.1	F775 D777 K778 R783	F775-V780 HydrophobicContact CD1-CG1 4.04Å; D777-V780 HydrophobicContact CB-CG2 4.22Å; D777-V780 WeakPolarHBondContact O-CB 3.36Å; D777-V780 PolarHBondContact O-N 3.09Å; K778-V780 PolarHBondContact O-N 3.4Å; K778-V780 VanDerWaalsContact O-N 3.13Å; V780-R783 PolarHBondContact O-N 2.9Å
781	F	95.5	Very high	94.5	Very high	11 Å²	11	52.4 Å²	52.4	5%	0.048	27%	0.268	C	S	.	.	H	α-helix	trans	-66.4	-41.9	176.3	-174.3	-108.6	0	0	0	112.4	F775 K778 R783 V784 L785 L788 F862	F775-F781 HydrophobicContact CB-CB 4.08Å; F775-F781 AromaticContact CD2-CD2 3.77Å; F775-F781 HydrophobicContact CD2-CD2 3.77Å; F775-F781 HydrophobicContact CD2-CE2 4.45Å; F775-F781 HydrophobicContact CE2-CD2 4.11Å; F775-F781 HydrophobicContact CE2-CE2 4.49Å; F775-F781 HydrophobicContact CG-CB 4.29Å; F775-F781 HydrophobicContact CG-CD2 4.06Å; K778-F781 PolarHBondContact O-N 3.28Å; F781-R783 PolarHBondContact O-N 3.25Å; F781-R783 VanDerWaalsContact O-N 3.08Å; F781-V784 HydrophobicContact CD2-CG2 3.84Å; F781-V784 HydrophobicContact CE2-CG2 4.32Å; F781-V784 HydrophobicContact CG-CG2 4.49Å; F781-V784 WeakPolarHBondContact O-CG2 3.39Å; F781-V784 PolarHBondContact O-N 2.95Å; F781-L785 HydrophobicContact CE1-CB 4.44Å; F781-L785 HydrophobicContact CE1-CD1 4.02Å; F781-L785 HydrophobicContact CZ-CD1 4.35Å; F781-L785 PolarHBondContact O-N 2.86Å; F781-L788 HydrophobicContact CE2-CD1 3.59Å; F781-L788 HydrophobicContact CZ-CD1 3.87Å; F781-F862 HydrophobicContact CB-CD1 4.2Å; F781-F862 HydrophobicContact CB-CE1 4.21Å; F781-F862 AromaticContact CD1-CD1 3.95Å; F781-F862 HydrophobicContact CD1-CD1 3.95Å; F781-F862 AromaticContact CD2-CD1 3.6Å; F781-F862 HydrophobicContact CD2-CD1 3.6Å; F781-F862 HydrophobicContact CD2-CE1 4.27Å; F781-F862 HydrophobicContact CE1-CB 4.18Å; F781-F862 HydrophobicContact CE1-CD1 4.19Å; F781-F862 HydrophobicContact CE2-CB 4.17Å; F781-F862 AromaticContact CE2-CD1 3.86Å; F781-F862 HydrophobicContact CE2-CD1 3.86Å; F781-F862 HydrophobicContact CE2-CG 4.49Å; F781-F862 AromaticContact CG-CD1 3.63Å; F781-F862 HydrophobicContact CG-CD1 3.63Å; F781-F862 HydrophobicContact CG-CE1 4.15Å; F781-F862 HydrophobicContact CZ-CB 3.86Å; F781-F862 HydrophobicContact CZ-CD1 4.14Å; F781-F862 WeakPolarHBondContact CZ-O 3.38Å
782	E	94.7	Very high	94.5	Very high	79 Å²	79	52.7 Å²	52.7	37%	0.369	27%	0.269	S	S	.	.	H	α-helix	trans	-58.3	-24.1	177.4	-65.8	-77.1	-173.2	0	0	112.7	K778 L785 P786	K778-E782 WeakPolarHBondContact CE-OE1 3.23Å; K778-E782 HydrophobicContact CG-CG 4.13Å; K778-E782 IonicContact NZ-OE1 2.72Å; K778-E782 PolarHBondContact NZ-OE1 3.47Å; K778-E782 WeakPolarHBondContact O-CG 3.31Å; K778-E782 PolarHBondContact O-N 2.91Å; E782-L785 WeakPolarHBondContact OE2-CD2 3.44Å; E782-P786 WeakPolarHBondContact O-CD 3.45Å
783	R	94.6	Very high	94.7	Very high	146 Å²	146	47 Å²	47	55%	0.551	25%	0.248	S	C	*	.	H	α-helix	trans	-74.6	-33.4	173.7	-66.8	172.8	-166.4	-150.2	2.1	113.5	D779 V780 F781 R824	D779-R783 WeakPolarHBondContact O-CG 3.47Å; D779-R783 PolarHBondContact O-NE 3.07Å; V780-R783 PolarHBondContact O-N 2.9Å; F781-R783 PolarHBondContact O-N 3.25Å; F781-R783 VanDerWaalsContact O-N 3.08Å; R783-R824 HydrophobicContact CB-CG 4.45Å; R783-R824 WeakPolarHBondContact O-CD 3.43Å; R783-R824 PolarHBondContact O-NH1 2.9Å
784	V	96.3	Very high	94.8	Very high	2 Å²	2	44.7 Å²	44.7	1%	0.012	23%	0.234	C	C	.	.	H	α-helix	trans	-92.1	-17.8	179.5	-62.1	0	0	0	0	112.7	F775 F781 V787 L788 R824 L828	F775-V784 HydrophobicContact CD1-CG2 4.42Å; F775-V784 HydrophobicContact CE1-CG1 4.46Å; F775-V784 HydrophobicContact CE1-CG2 3.91Å; F775-V784 HydrophobicContact CZ-CG2 4.1Å; F781-V784 HydrophobicContact CD2-CG2 3.84Å; F781-V784 HydrophobicContact CE2-CG2 4.32Å; F781-V784 HydrophobicContact CG-CG2 4.49Å; F781-V784 WeakPolarHBondContact O-CG2 3.39Å; F781-V784 PolarHBondContact O-N 2.95Å; V784-V787 WeakPolarHBondContact O-CA 3.29Å; V784-V787 VanDerWaalsContact O-CB 3.27Å; V784-V787 WeakPolarHBondContact O-CB 3.38Å; V784-V787 PolarHBondContact O-N 3.44Å; V784-L788 PolarHBondContact O-N 2.89Å; V784-L788 VanDerWaalsContact O-N 3.1Å; V784-R824 HydrophobicContact CG1-CB 4.08Å; V784-R824 HydrophobicContact CG1-CG 4.44Å; V784-R824 WeakPolarHBondContact CG1-O 3.43Å; V784-L828 HydrophobicContact CB-CD1 4Å; V784-L828 HydrophobicContact CB-CD2 4.14Å; V784-L828 HydrophobicContact CB-CG 4.03Å; V784-L828 HydrophobicContact CG1-CD1 4.38Å; V784-L828 HydrophobicContact CG1-CG 4.14Å; V784-L828 HydrophobicContact CG2-CD2 4.19Å
785	L	96.1	Very high	94.8	Very high	29 Å²	29	43.4 Å²	43.4	15%	0.152	22%	0.223	C	C	.	.	H	α-helix	trans	-52.3	-41.1	179.7	179.2	59.8	0	0	0	114.5	F781 E782 V787 L788 N789 C864	F781-L785 HydrophobicContact CE1-CB 4.44Å; F781-L785 HydrophobicContact CE1-CD1 4.02Å; F781-L785 HydrophobicContact CZ-CD1 4.35Å; F781-L785 PolarHBondContact O-N 2.86Å; E782-L785 WeakPolarHBondContact OE2-CD2 3.44Å; L785-V787 VanDerWaalsContact C-N 3.31Å; L785-V787 PolarHBondContact O-N 3.35Å; L785-L788 PolarHBondContact O-N 3.34Å; L785-N789 WeakPolarHBondContact CD1-OD1 3.44Å; L785-N789 WeakPolarHBondContact O-CB 3.42Å; L785-N789 PolarHBondContact O-N 2.99Å; L785-N789 PolarHBondContact O-ND2 2.87Å; L785-C864 HydrophobicContact CD1-CB 4.12Å
786	P	96.3	Very high	94.7	Very high	37 Å²	37	45 Å²	45	24%	0.24	23%	0.231	C	C	.	.	H	α-helix	trans	-63.4	-35	175.3	-23.7	35.1	0	0	0	113.5	E782 V790 L807 L872	E782-P786 WeakPolarHBondContact O-CD 3.45Å; P786-V790 WeakPolarHBondContact O-CG2 3.32Å; P786-V790 PolarHBondContact O-N 2.75Å; P786-L807 HydrophobicContact CB-CD1 4.4Å; P786-L807 HydrophobicContact CB-CD2 4.07Å; P786-L807 HydrophobicContact CB-CG 4.01Å; P786-L872 HydrophobicContact CB-CD1 4.36Å
787	V	96.9	Very high	94.8	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-66.6	-46.9	178	-171.4	0	0	0	0	109.9	V784 L785 V790 A791 M803 L807 R824 L825 L828	V784-V787 WeakPolarHBondContact O-CA 3.29Å; V784-V787 VanDerWaalsContact O-CB 3.27Å; V784-V787 WeakPolarHBondContact O-CB 3.38Å; V784-V787 PolarHBondContact O-N 3.44Å; L785-V787 VanDerWaalsContact C-N 3.31Å; L785-V787 PolarHBondContact O-N 3.35Å; V787-V790 PolarHBondContact O-N 2.96Å; V787-A791 PolarHBondContact O-N 2.84Å; V787-M803 HydrophobicContact CG1-CG 4.26Å; V787-M803 HydrophobicContact CG1-SD 3.44Å; V787-M803 WeakPolarHBondContact CG1-SD 3.37Å; V787-L807 HydrophobicContact CG2-CD2 3.82Å; V787-R824 HydrophobicContact CG2-CB 4.22Å; V787-L825 HydrophobicContact CG1-CD2 3.74Å; V787-L828 HydrophobicContact CB-CD1 3.87Å; V787-L828 HydrophobicContact CG1-CD1 3.71Å
788	L	97.3	Very high	95	Very high	3 Å²	3	35.9 Å²	35.9	2%	0.016	18%	0.177	C	C	.	.	H	α-helix	trans	-62.8	-48	174.7	-70.9	176.3	0	0	0	111.7	F781 V784 L785 V790 A791 L792 L828 M832 L842 L851	F781-L788 HydrophobicContact CE2-CD1 3.59Å; F781-L788 HydrophobicContact CZ-CD1 3.87Å; V784-L788 PolarHBondContact O-N 2.89Å; V784-L788 VanDerWaalsContact O-N 3.1Å; L785-L788 PolarHBondContact O-N 3.34Å; L788-V790 VanDerWaalsContact C-N 3.3Å; L788-V790 PolarHBondContact O-N 2.95Å; L788-A791 PolarHBondContact O-N 3.39Å; L788-A791 VanDerWaalsContact O-N 3.16Å; L788-L792 WeakPolarHBondContact O-CB 3.25Å; L788-L792 WeakPolarHBondContact O-CG 3.37Å; L788-L792 PolarHBondContact O-N 2.7Å; L788-L828 HydrophobicContact CD1-CD2 4.1Å; L788-L828 HydrophobicContact CD2-CD1 4.27Å; L788-L828 HydrophobicContact CD2-CD2 3.83Å; L788-L828 HydrophobicContact CG-CD1 4.26Å; L788-L828 HydrophobicContact CG-CD2 3.98Å; L788-M832 HydrophobicContact CD2-SD 4.34Å; L788-L842 HydrophobicContact CD2-CD2 4.23Å; L788-L851 HydrophobicContact CD1-CD1 4.4Å; L788-L851 HydrophobicContact CD1-CD2 4.47Å; L788-L851 HydrophobicContact CD2-CD1 3.94Å
789	N	97.4	Very high	95.3	Very high	7 Å²	7	30.4 Å²	30.4	4%	0.037	16%	0.156	C	C	.	.	H	α-helix	trans	-55.4	-45	178.4	-74.2	-15.3	0	0	0	111.5	L785 L792 A793 C864 D865 G869	L785-N789 WeakPolarHBondContact CD1-OD1 3.44Å; L785-N789 WeakPolarHBondContact O-CB 3.42Å; L785-N789 PolarHBondContact O-N 2.99Å; L785-N789 PolarHBondContact O-ND2 2.87Å; N789-L792 PolarHBondContact O-N 3.36Å; N789-A793 WeakPolarHBondContact O-CB 3.46Å; N789-A793 PolarHBondContact O-N 3.42Å; N789-A793 VanDerWaalsContact O-N 3.11Å; N789-C864 VanDerWaalsContact OD1-CB 3.31Å; N789-C864 WeakPolarHBondContact OD1-CB 3.11Å; N789-D865 VanDerWaalsContact CG-O 3.32Å; N789-D865 PolarHBondContact OD1-N 2.98Å; N789-D865 PolarHBondContact OD1-O 2.87Å; N789-G869 WeakPolarHBondContact O-CA 3.1Å
790	V	97.5	Very high	95.5	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-63.9	-46.2	176.3	165.9	0	0	0	0	112	P786 V787 L788 L792 A793 S794 L798 M803 A806 L807 L872 L873	P786-V790 WeakPolarHBondContact O-CG2 3.32Å; P786-V790 PolarHBondContact O-N 2.75Å; V787-V790 PolarHBondContact O-N 2.96Å; L788-V790 VanDerWaalsContact C-N 3.3Å; L788-V790 PolarHBondContact O-N 2.95Å; V790-L792 VanDerWaalsContact C-N 3.3Å; V790-L792 PolarHBondContact O-N 3.49Å; V790-A793 PolarHBondContact O-N 3.41Å; V790-A793 VanDerWaalsContact O-N 3.14Å; V790-S794 PolarHBondContact O-N 2.92Å; V790-S794 PolarHBondContact O-OG 2.67Å; V790-L798 HydrophobicContact CG1-CD1 3.74Å; V790-M803 HydrophobicContact CG1-CG 4.12Å; V790-A806 HydrophobicContact CG1-CB 3.97Å; V790-A806 HydrophobicContact CG2-CB 4.07Å; V790-L807 HydrophobicContact CB-CD1 4.41Å; V790-L807 HydrophobicContact CG2-CD1 3.93Å; V790-L872 HydrophobicContact CG2-CB 3.8Å; V790-L872 HydrophobicContact CG2-CD1 3.69Å; V790-L872 HydrophobicContact CG2-CG 4.4Å; V790-L873 HydrophobicContact CG1-CD2 4.11Å; V790-L873 HydrophobicContact CG1-CG 4.37Å
791	A	96.2	Very high	95.6	Very high	13 Å²	13	26.1 Å²	26.1	11%	0.107	13%	0.128	C	C	.	.	H	α-helix	trans	-64.7	-30.9	178.2	0	0	0	0	0	113.5	V787 L788 S794 M803 M832	V787-A791 PolarHBondContact O-N 2.84Å; L788-A791 PolarHBondContact O-N 3.39Å; L788-A791 VanDerWaalsContact O-N 3.16Å; A791-S794 PolarHBondContact O-OG 2.95Å; A791-M803 HydrophobicContact CB-CE 3.99Å; A791-M832 HydrophobicContact CB-CE 3.78Å
792	L	95.7	Very high	95.7	Very high	7 Å²	7	28.6 Å²	28.6	4%	0.037	14%	0.14	C	C	.	.	H	α-helix	trans	-76	-24.7	175	-67.7	167.7	0	0	0	113	L788 N789 V790 L842 R848 L851 V852 C864 P866	L788-L792 WeakPolarHBondContact O-CB 3.25Å; L788-L792 WeakPolarHBondContact O-CG 3.37Å; L788-L792 PolarHBondContact O-N 2.7Å; N789-L792 PolarHBondContact O-N 3.36Å; V790-L792 VanDerWaalsContact C-N 3.3Å; V790-L792 PolarHBondContact O-N 3.49Å; L792-L842 HydrophobicContact CD2-CD1 3.61Å; L792-L842 HydrophobicContact CG-CD1 4.46Å; L792-R848 HydrophobicContact CD2-CB 4.37Å; L792-R848 HydrophobicContact CD2-CG 3.4Å; L792-R848 PolarHBondContact O-NH2 3.35Å; L792-L851 HydrophobicContact CD1-CB 3.89Å; L792-L851 HydrophobicContact CD1-CD1 4.31Å; L792-L851 HydrophobicContact CD2-CB 4.16Å; L792-L851 HydrophobicContact CD2-CD1 4.33Å; L792-V852 HydrophobicContact CB-CG2 4.48Å; L792-V852 HydrophobicContact CD1-CG2 4Å; L792-V852 HydrophobicContact CD2-CG2 3.89Å; L792-V852 HydrophobicContact CG-CG2 4.35Å; L792-C864 HydrophobicContact CD1-CB 3.32Å; L792-P866 HydrophobicContact CB-CB 4.49Å; L792-P866 HydrophobicContact CB-CG 4.16Å
793	A	96.5	Very high	95.8	Very high	2 Å²	2	24.9 Å²	24.9	2%	0.017	12%	0.123	C	C	.	.	H	α-helix	trans	-99.1	-15.8	-173.4	0	0	0	0	0	114.5	N789 V790 P866 G869 H870 L873 H895	N789-A793 WeakPolarHBondContact O-CB 3.46Å; N789-A793 PolarHBondContact O-N 3.42Å; N789-A793 VanDerWaalsContact O-N 3.11Å; V790-A793 PolarHBondContact O-N 3.41Å; V790-A793 VanDerWaalsContact O-N 3.14Å; A793-P866 HydrophobicContact CB-CB 4.46Å; A793-P866 WeakPolarHBondContact CB-O 3.41Å; A793-G869 VanDerWaalsContact CB-C 3.47Å; A793-H870 PolarHBondContact O-CE1 2.95Å; A793-H870 PolarHBondContact O-ND1 3.41Å; A793-H870 VanDerWaalsContact O-ND1 3.1Å; A793-L873 HydrophobicContact CB-CD1 4.04Å; A793-H895 PolarHBondContact O-CE1 3Å
794	S	95.4	Very high	95.9	Very high	11 Å²	11	20 Å²	20	8%	0.077	11%	0.105	C	C	.	.			trans	-72.2	142.2	178.6	52.4	0	0	0	0	112.4	V790 A791 H796	V790-S794 PolarHBondContact O-N 2.92Å; V790-S794 PolarHBondContact O-OG 2.67Å; A791-S794 PolarHBondContact O-OG 2.95Å; S794-H796 VanDerWaalsContact C-N 3.3Å; S794-H796 WeakPolarHBondContact CB-O 3.47Å; S794-H796 PolarHBondContact OG-O 2.76Å
795	L	92.8	Very high	95.8	Very high	33 Å²	33	27.3 Å²	27.3	17%	0.173	13%	0.133	C	C	.	.	S	Bend	trans	-78.7	-15.3	175.8	-61.4	-176.2	0	0	0	113.1	T541 E891	T541-L795 WeakPolarHBondContact CB-O 3.28Å; T541-L795 PolarHBondContact N-O 3.47Å; T541-L795 PolarHBondContact OG1-O 3.47Å; L795-E891 HydrophobicContact CD1-CG 3.97Å
796	H	92.5	Very high	95.8	Very high	39 Å²	39	26 Å²	26	18%	0.181	13%	0.126	C	C	.	.	S	Bend	trans	-147	163.1	175.4	61.2	73	0	0	0	110.5	D539 Y542 S794	D539-H796 CarbonylContact O-C 3.58Å; D539-H796 VanDerWaalsContact O-CA 3.3Å; D539-H796 WeakPolarHBondContact O-CA 3.49Å; Y542-H796 HydrophobicContact CD2-CB 4.34Å; Y542-H796 HydrophobicContact CE2-CB 4.21Å; S794-H796 VanDerWaalsContact C-N 3.3Å; S794-H796 WeakPolarHBondContact CB-O 3.47Å; S794-H796 PolarHBondContact OG-O 2.76Å
797	P	93.1	Very high	95.8	Very high	11 Å²	11	24.8 Å²	24.8	7%	0.071	12%	0.117	C	C	.	.			trans	-56.1	141.4	173.8	-26.5	38.3	0	0	0	111.3	D539 N540 T839 M841	D539-P797 VanDerWaalsContact O-CD 3.29Å; D539-P797 WeakPolarHBondContact O-CD 3.34Å; N540-P797 HydrophobicContact CB-CG 4.32Å; P797-T839 HydrophobicContact CB-CG2 4.23Å; P797-T839 WeakPolarHBondContact CB-OG1 3.42Å; P797-M841 HydrophobicContact CB-CG 3.99Å; P797-M841 HydrophobicContact CG-CG 3.6Å; P797-M841 HydrophobicContact CG-SD 3.76Å
798	L	95.1	Very high	95.7	Very high	5 Å²	5	25.4 Å²	25.4	3%	0.026	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	147.2	-177.9	-62.6	179.8	0	0	0	111	V790 Q802 M803 T839 R840 L873	V790-L798 HydrophobicContact CG1-CD1 3.74Å; L798-Q802 HydrophobicContact CB-CB 4.17Å; L798-Q802 HydrophobicContact CD2-CB 4.29Å; L798-M803 HydrophobicContact CB-CE 4.18Å; L798-T839 CarbonylContact O-C 3.6Å; L798-T839 WeakPolarHBondContact O-CA 3.4Å; L798-T839 WeakPolarHBondContact O-CB 3.35Å; L798-R840 PolarHBondContact O-N 2.98Å; L798-L873 HydrophobicContact CD1-CD2 3.96Å
799	T	96.4	Very high	95.6	Very high	31 Å²	31	25.7 Å²	25.7	19%	0.19	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	160.6	168.6	78.7	0	0	0	0	111.4	E801 Q802 M803 T839	T799-E801 WeakPolarHBondContact CB-OE2 3.43Å; T799-E801 PolarHBondContact O-N 2.99Å; T799-E801 PolarHBondContact OG1-N 3.06Å; T799-E801 PolarHBondContact OG1-OE2 3.04Å; T799-Q802 PolarHBondContact O-N 3.4Å; T799-Q802 VanDerWaalsContact O-N 3.08Å; T799-Q802 PolarHBondContact OG1-N 3.41Å; T799-M803 WeakPolarHBondContact O-CB 3.38Å; T799-M803 PolarHBondContact O-N 2.87Å; T799-T839 HydrophobicContact CG2-CG2 3.9Å
800	D	96.3	Very high	95.3	Very high	2 Å²	2	26.8 Å²	26.8	1%	0.011	14%	0.137	C	C	.	.	H	α-helix	trans	-53.5	-39.4	176.5	-62	9.2	0	0	0	110.5	M803 F804 W818 F821 L825 R834 R840	D800-M803 PolarHBondContact O-N 2.87Å; D800-F804 VanDerWaalsContact O-CB 3.28Å; D800-F804 WeakPolarHBondContact O-CB 3.44Å; D800-F804 PolarHBondContact O-N 2.92Å; D800-W818 HydrophobicContact CB-CH2 3.92Å; D800-W818 HydrophobicContact CB-CZ2 4.43Å; D800-F821 HydrophobicContact CB-CE1 4.27Å; D800-F821 WeakPolarHBondContact O-CE1 3.29Å; D800-F821 VanDerWaalsContact O-CZ 3.24Å; D800-F821 WeakPolarHBondContact O-CZ 3.35Å; D800-L825 HydrophobicContact CB-CD1 4.13Å; D800-R834 IonicContact OD2-CZ 3.6Å; D800-R834 IonicContact OD2-NH1 3.73Å; D800-R834 PolarHBondContact OD2-NH1 3Å; D800-R834 IonicContact OD2-NH2 2.7Å; D800-R834 PolarHBondContact OD2-NH2 3.31Å; D800-R840 IonicContact OD1-CZ 3.86Å; D800-R840 IonicContact OD1-NE 3.54Å; D800-R840 PolarHBondContact OD1-NE 2.97Å; D800-R840 IonicContact OD1-NH2 2.65Å; D800-R840 IonicContact OD2-CZ 3.76Å; D800-R840 IonicContact OD2-NE 2.86Å; D800-R840 IonicContact OD2-NH2 2.95Å; D800-R840 PolarHBondContact OD2-NH2 2.88Å
801	E	95.9	Very high	94.9	Very high	81 Å²	81	28.6 Å²	28.6	38%	0.379	15%	0.149	S	C	.	.	H	α-helix	trans	-71.4	-35.5	178.2	-48.7	76.2	-167	0	0	113.5	T799 R805 W818	T799-E801 WeakPolarHBondContact CB-OE2 3.43Å; T799-E801 PolarHBondContact O-N 2.99Å; T799-E801 PolarHBondContact OG1-N 3.06Å; T799-E801 PolarHBondContact OG1-OE2 3.04Å; E801-R805 VanDerWaalsContact O-CG 3.22Å; E801-R805 WeakPolarHBondContact O-CG 3.29Å; E801-R805 PolarHBondContact O-N 2.89Å; E801-R805 VanDerWaalsContact O-N 3.09Å; E801-W818 HydrophobicContact CG-CH2 4.06Å; E801-W818 HydrophobicContact CG-CZ3 4.39Å
802	Q	96.1	Very high	94.2	Very high	62 Å²	62	34.5 Å²	34.5	29%	0.29	18%	0.183	S	C	.	.	H	α-helix	trans	-68	-44.1	174.5	-70.2	176.2	-53.7	0	0	110.7	L798 T799 R805 A806	L798-Q802 HydrophobicContact CB-CB 4.17Å; L798-Q802 HydrophobicContact CD2-CB 4.29Å; T799-Q802 PolarHBondContact O-N 3.4Å; T799-Q802 VanDerWaalsContact O-N 3.08Å; T799-Q802 PolarHBondContact OG1-N 3.41Å; Q802-R805 PolarHBondContact O-N 3.12Å; Q802-A806 PolarHBondContact O-N 2.83Å
803	M	96.7	Very high	93.4	Very high	2 Å²	2	43.5 Å²	43.5	1%	0.01	22%	0.222	C	C	.	.	H	α-helix	trans	-66.6	-39.2	179.5	-169.2	172	-68.6	0	0	111.4	V787 V790 A791 L798 T799 D800 A806 L807 F821 L825 M832	V787-M803 HydrophobicContact CG1-CG 4.26Å; V787-M803 HydrophobicContact CG1-SD 3.44Å; V787-M803 WeakPolarHBondContact CG1-SD 3.37Å; V790-M803 HydrophobicContact CG1-CG 4.12Å; A791-M803 HydrophobicContact CB-CE 3.99Å; L798-M803 HydrophobicContact CB-CE 4.18Å; T799-M803 WeakPolarHBondContact O-CB 3.38Å; T799-M803 PolarHBondContact O-N 2.87Å; D800-M803 PolarHBondContact O-N 2.87Å; M803-A806 PolarHBondContact O-N 3.23Å; M803-L807 VanDerWaalsContact O-CD1 3.3Å; M803-L807 WeakPolarHBondContact O-CD1 3.16Å; M803-L807 PolarHBondContact O-N 3.44Å; M803-L807 VanDerWaalsContact O-N 3.1Å; M803-F821 HydrophobicContact CB-CE2 4.41Å; M803-F821 HydrophobicContact CB-CZ 3.99Å; M803-F821 HydrophobicContact CG-CE2 4.15Å; M803-F821 HydrophobicContact CG-CZ 4.14Å; M803-L825 HydrophobicContact SD-CD2 4.1Å; M803-M832 HydrophobicContact CE-CE 4Å; M803-M832 HydrophobicContact SD-CE 4.25Å
804	F	96.8	Very high	92.4	Very high	42 Å²	42	46.4 Å²	46.4	18%	0.184	25%	0.252	C	S	.	.	H	α-helix	trans	-57.8	-48.3	170	179.7	-111.1	0	0	0	112.7	D800 A806 L807 N808 L816 W818 F821	D800-F804 VanDerWaalsContact O-CB 3.28Å; D800-F804 WeakPolarHBondContact O-CB 3.44Å; D800-F804 PolarHBondContact O-N 2.92Å; F804-A806 VanDerWaalsContact C-N 3.33Å; F804-A806 PolarHBondContact O-N 3.42Å; F804-L807 PolarHBondContact O-N 3.15Å; F804-N808 WeakPolarHBondContact CE2-ND2 3.28Å; F804-N808 WeakPolarHBondContact CZ-ND2 3.22Å; F804-N808 PolarHBondContact O-N 3.3Å; F804-L816 WeakPolarHBondContact CE2-O 3.47Å; F804-L816 WeakPolarHBondContact CZ-O 3.07Å; F804-W818 HydrophobicContact CB-CE3 4.06Å; F804-W818 HydrophobicContact CB-CZ3 3.62Å; F804-W818 AromaticContact CD1-CE3 3.77Å; F804-W818 HydrophobicContact CD1-CE3 3.77Å; F804-W818 AromaticContact CD1-CZ3 3.96Å; F804-W818 HydrophobicContact CD1-CZ3 3.96Å; F804-W818 AromaticContact CD2-CE3 3.75Å; F804-W818 HydrophobicContact CD2-CE3 3.75Å; F804-W818 HydrophobicContact CD2-CZ3 4.2Å; F804-W818 HydrophobicContact CE1-CE3 4.06Å; F804-W818 HydrophobicContact CE2-CB 4.29Å; F804-W818 HydrophobicContact CE2-CE3 4.03Å; F804-W818 AromaticContact CG-CE3 3.59Å; F804-W818 HydrophobicContact CG-CE3 3.59Å; F804-W818 AromaticContact CG-CZ3 3.68Å; F804-W818 HydrophobicContact CG-CZ3 3.68Å; F804-W818 HydrophobicContact CZ-CB 4.3Å; F804-W818 HydrophobicContact CZ-CE3 4.18Å; F804-F821 HydrophobicContact CB-CD1 3.89Å; F804-F821 HydrophobicContact CB-CE1 3.71Å; F804-F821 HydrophobicContact CB-CE2 4.36Å; F804-F821 HydrophobicContact CB-CG 4.28Å; F804-F821 HydrophobicContact CB-CZ 3.96Å; F804-F821 HydrophobicContact CD2-CB 3.67Å; F804-F821 AromaticContact CD2-CD1 3.7Å; F804-F821 HydrophobicContact CD2-CD1 3.7Å; F804-F821 HydrophobicContact CD2-CD2 4.21Å; F804-F821 HydrophobicContact CD2-CE1 4.4Å; F804-F821 AromaticContact CD2-CG 3.58Å; F804-F821 HydrophobicContact CD2-CG 3.58Å; F804-F821 HydrophobicContact CE2-CB 4.02Å; F804-F821 HydrophobicContact CE2-CG 4.42Å; F804-F821 HydrophobicContact CG-CD1 4.2Å; F804-F821 HydrophobicContact CG-CE1 4.5Å; F804-F821 HydrophobicContact CG-CG 4.41Å
805	R	95.6	Very high	91.9	Very high	157 Å²	157	53 Å²	53	59%	0.592	28%	0.282	S	S	*	.	H	α-helix	trans	-61.9	-39.2	176.6	-72.1	169.6	-165.1	179.9	5	112.1	E801 Q802 N808 A809 M876	E801-R805 VanDerWaalsContact O-CG 3.22Å; E801-R805 WeakPolarHBondContact O-CG 3.29Å; E801-R805 PolarHBondContact O-N 2.89Å; E801-R805 VanDerWaalsContact O-N 3.09Å; Q802-R805 PolarHBondContact O-N 3.12Å; R805-N808 PolarHBondContact O-N 3.47Å; R805-A809 VanDerWaalsContact O-CB 3.24Å; R805-A809 WeakPolarHBondContact O-CB 3.49Å; R805-A809 PolarHBondContact O-N 3.14Å; R805-M876 HydrophobicContact CB-CG 4.2Å; R805-M876 HydrophobicContact CB-SD 4.2Å
806	A	96.4	Very high	91.9	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-61.6	-44.6	176.3	0	0	0	0	0	112.1	V790 Q802 M803 F804 A809 L872 L873 M876	V790-A806 HydrophobicContact CG1-CB 3.97Å; V790-A806 HydrophobicContact CG2-CB 4.07Å; Q802-A806 PolarHBondContact O-N 2.83Å; M803-A806 PolarHBondContact O-N 3.23Å; F804-A806 VanDerWaalsContact C-N 3.33Å; F804-A806 PolarHBondContact O-N 3.42Å; A806-A809 PolarHBondContact O-N 3.22Å; A806-L872 WeakPolarHBondContact O-CB 3.46Å; A806-L873 HydrophobicContact CB-CD2 4.05Å; A806-M876 HydrophobicContact CB-CB 4.43Å; A806-M876 HydrophobicContact CB-SD 3.93Å
807	L	95.8	Very high	92.1	Very high	12 Å²	12	57 Å²	57	6%	0.063	30%	0.3	C	S	.	.	H	α-helix	trans	-62.4	-48.3	175.4	-91.2	68	0	0	0	111.4	P786 V787 V790 M803 F804 A809 G810 L816 F821	P786-L807 HydrophobicContact CB-CD1 4.4Å; P786-L807 HydrophobicContact CB-CD2 4.07Å; P786-L807 HydrophobicContact CB-CG 4.01Å; V787-L807 HydrophobicContact CG2-CD2 3.82Å; V790-L807 HydrophobicContact CB-CD1 4.41Å; V790-L807 HydrophobicContact CG2-CD1 3.93Å; M803-L807 VanDerWaalsContact O-CD1 3.3Å; M803-L807 WeakPolarHBondContact O-CD1 3.16Å; M803-L807 PolarHBondContact O-N 3.44Å; M803-L807 VanDerWaalsContact O-N 3.1Å; F804-L807 PolarHBondContact O-N 3.15Å; L807-A809 VanDerWaalsContact C-N 3.33Å; L807-A809 PolarHBondContact O-N 3.11Å; L807-G810 PolarHBondContact O-N 3.05Å; L807-L816 HydrophobicContact CB-CD2 4.19Å; L807-L816 HydrophobicContact CD2-CD2 3.69Å; L807-F821 HydrophobicContact CD2-CD2 4.17Å; L807-F821 HydrophobicContact CD2-CE2 4.42Å
808	N	95.2	Very high	92.2	Very high	14 Å²	14	60.7 Å²	60.7	8%	0.075	31%	0.313	C	S	.	.	H	α-helix	trans	-70	-24.5	-179.7	-88.8	-33.7	0	0	0	114.3	F804 R805 G810 S811 L816	F804-N808 WeakPolarHBondContact CE2-ND2 3.28Å; F804-N808 WeakPolarHBondContact CZ-ND2 3.22Å; F804-N808 PolarHBondContact O-N 3.3Å; R805-N808 PolarHBondContact O-N 3.47Å; N808-G810 PolarHBondContact O-N 2.86Å; N808-S811 WeakPolarHBondContact O-CB 3.32Å; N808-S811 PolarHBondContact O-N 3.15Å; N808-L816 PolarHBondContact ND2-O 3.03Å; N808-L816 WeakPolarHBondContact OD1-CB 3.23Å; N808-L816 PolarHBondContact OD1-N 2.82Å
809	A	94.2	Very high	92.3	Very high	8 Å²	8	65.8 Å²	65.8	7%	0.066	34%	0.34	C	S	.	.	H	α-helix	trans	-65.1	-25.7	174.5	0	0	0	0	0	113.1	R805 A806 L807 S811 F875 M876 R879	R805-A809 VanDerWaalsContact O-CB 3.24Å; R805-A809 WeakPolarHBondContact O-CB 3.49Å; R805-A809 PolarHBondContact O-N 3.14Å; A806-A809 PolarHBondContact O-N 3.22Å; L807-A809 VanDerWaalsContact C-N 3.33Å; L807-A809 PolarHBondContact O-N 3.11Å; A809-S811 VanDerWaalsContact C-N 3.34Å; A809-F875 HydrophobicContact CB-CB 3.84Å; A809-F875 WeakPolarHBondContact O-CB 3.33Å; A809-M876 HydrophobicContact CB-CB 4.1Å; A809-R879 WeakPolarHBondContact O-CD 3.2Å; A809-R879 PolarHBondContact O-NH1 3.2Å
810	G	91.6	Very high	92.3	Very high	31 Å²	31	66.7 Å²	66.7	32%	0.32	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-15.6	170.8	0	0	0	0	0	114.7	L807 N808	L807-G810 PolarHBondContact O-N 3.05Å; N808-G810 PolarHBondContact O-N 2.86Å
811	S	88.6	Confident	92.3	Very high	38 Å²	38	66.6 Å²	66.6	27%	0.266	34%	0.343	S	S	.	.			trans	-83.3	127.5	-177.1	-62.3	0	0	0	0	112	N808 A809 G814 R879	N808-S811 WeakPolarHBondContact O-CB 3.32Å; N808-S811 PolarHBondContact O-N 3.15Å; A809-S811 VanDerWaalsContact C-N 3.34Å; S811-G814 VanDerWaalsContact CB-O 3.3Å; S811-G814 WeakPolarHBondContact CB-O 3.4Å; S811-R879 PolarHBondContact O-NH1 3.15Å
812	V	81.9	Confident	92.4	Very high	136 Å²	136	64.9 Å²	64.9	82%	0.824	34%	0.335	S	S	*	.	S	Bend	trans	-102	-23.1	176.7	-176.4	0	0	0	0	112
813	K	78.1	Confident	92.4	Very high	197 Å²	197	68 Å²	68	86%	0.857	35%	0.35	S	S	*	.	S	Bend	trans	-146.6	126.3	177.1	-66.2	-173.4	179.5	-177.1	0	109.8
814	G	75.6	Confident	92.3	Very high	62 Å²	62	70.1 Å²	70.1	64%	0.639	36%	0.358	S	S	*	.	S	Bend	trans	74.1	147.6	-170.5	0	0	0	0	0	111.7	S811	S811-G814 VanDerWaalsContact CB-O 3.3Å; S811-G814 WeakPolarHBondContact CB-O 3.4Å
815	E	85.3	Confident	92.2	Very high	149 Å²	149	68.1 Å²	68.1	70%	0.696	35%	0.349	S	S	*	.			trans	-114.5	148.2	175.2	-62.5	-170	169.7	0	0	109.3	E817	E815-E817 PolarHBondContact O-N 2.98Å
816	L	93.3	Very high	92.2	Very high	25 Å²	25	65 Å²	65	13%	0.131	34%	0.344	C	S	.	.			trans	-69.5	119.5	168.8	178.4	65.1	0	0	0	108	F804 L807 N808 D820 F821	F804-L816 WeakPolarHBondContact CE2-O 3.47Å; F804-L816 WeakPolarHBondContact CZ-O 3.07Å; L807-L816 HydrophobicContact CB-CD2 4.19Å; L807-L816 HydrophobicContact CD2-CD2 3.69Å; N808-L816 PolarHBondContact ND2-O 3.03Å; N808-L816 WeakPolarHBondContact OD1-CB 3.23Å; N808-L816 PolarHBondContact OD1-N 2.82Å; L816-D820 HydrophobicContact CD1-CB 3.85Å; L816-D820 WeakPolarHBondContact CD1-OD2 3.43Å; L816-F821 HydrophobicContact CD2-CB 3.86Å; L816-F821 HydrophobicContact CD2-CD2 4.17Å; L816-F821 HydrophobicContact CD2-CG 4.46Å; L816-F821 HydrophobicContact CG-CB 4.16Å
817	E	95.7	Very high	92.1	Very high	131 Å²	131	67.8 Å²	67.8	61%	0.612	36%	0.364	S	S	*	.			trans	-64.9	141.7	173.8	-75.6	-63.6	157.5	0	0	111.5	E815 N819 D820 F821	E815-E817 PolarHBondContact O-N 2.98Å; E817-N819 PolarHBondContact O-N 3.02Å; E817-N819 VanDerWaalsContact O-N 3.13Å; E817-D820 PolarHBondContact O-N 2.85Å; E817-F821 PolarHBondContact O-N 3.4Å
818	W	96.4	Very high	92	Very high	90 Å²	90	67.3 Å²	67.3	34%	0.341	36%	0.361	S	S	.	.	H	α-helix	trans	-55.6	-35.1	179.7	-179.6	-93.6	0	0	0	112.5	D800 E801 F804 F821 Q822	D800-W818 HydrophobicContact CB-CH2 3.92Å; D800-W818 HydrophobicContact CB-CZ2 4.43Å; E801-W818 HydrophobicContact CG-CH2 4.06Å; E801-W818 HydrophobicContact CG-CZ3 4.39Å; F804-W818 HydrophobicContact CB-CE3 4.06Å; F804-W818 HydrophobicContact CB-CZ3 3.62Å; F804-W818 AromaticContact CD1-CE3 3.77Å; F804-W818 HydrophobicContact CD1-CE3 3.77Å; F804-W818 AromaticContact CD1-CZ3 3.96Å; F804-W818 HydrophobicContact CD1-CZ3 3.96Å; F804-W818 AromaticContact CD2-CE3 3.75Å; F804-W818 HydrophobicContact CD2-CE3 3.75Å; F804-W818 HydrophobicContact CD2-CZ3 4.2Å; F804-W818 HydrophobicContact CE1-CE3 4.06Å; F804-W818 HydrophobicContact CE2-CB 4.29Å; F804-W818 HydrophobicContact CE2-CE3 4.03Å; F804-W818 AromaticContact CG-CE3 3.59Å; F804-W818 HydrophobicContact CG-CE3 3.59Å; F804-W818 AromaticContact CG-CZ3 3.68Å; F804-W818 HydrophobicContact CG-CZ3 3.68Å; F804-W818 HydrophobicContact CZ-CB 4.3Å; F804-W818 HydrophobicContact CZ-CE3 4.18Å; W818-F821 HydrophobicContact CD2-CD1 4.46Å; W818-F821 HydrophobicContact CE3-CD1 4.07Å; W818-F821 HydrophobicContact CH2-CD1 4.32Å; W818-F821 HydrophobicContact CH2-CE1 4.11Å; W818-F821 AromaticContact CZ3-CD1 4Å; W818-F821 HydrophobicContact CZ3-CD1 4Å; W818-F821 HydrophobicContact CZ3-CE1 4.02Å; W818-F821 PolarHBondContact O-N 3Å; W818-Q822 WeakPolarHBondContact O-CB 3.3Å; W818-Q822 PolarHBondContact O-N 2.87Å
819	N	97.1	Very high	91.8	Very high	111 Å²	111	69.8 Å²	69.8	59%	0.594	38%	0.384	S	S	*	.	H	α-helix	trans	-70.4	-33.5	-179.9	-65.3	-34.8	0	0	0	113.3	E817 Q823	E817-N819 PolarHBondContact O-N 3.02Å; E817-N819 VanDerWaalsContact O-N 3.13Å; N819-Q823 VanDerWaalsContact O-CG 3.29Å; N819-Q823 WeakPolarHBondContact O-CG 3.48Å; N819-Q823 PolarHBondContact O-N 3.38Å; N819-Q823 VanDerWaalsContact O-N 3.13Å
820	D	96.1	Very high	91.5	Very high	51 Å²	51	72 Å²	72	27%	0.273	41%	0.407	S	S	.	.	H	α-helix	trans	-74.4	-41.4	174.1	-179.5	10.9	0	0	0	110.1	L816 E817 Q822 Q823 R824	L816-D820 HydrophobicContact CD1-CB 3.85Å; L816-D820 WeakPolarHBondContact CD1-OD2 3.43Å; E817-D820 PolarHBondContact O-N 2.85Å; D820-Q822 VanDerWaalsContact C-N 3.34Å; D820-Q822 PolarHBondContact O-N 3.14Å; D820-Q823 PolarHBondContact O-N 3.44Å; D820-R824 VanDerWaalsContact O-CG 3.31Å; D820-R824 WeakPolarHBondContact O-CG 3.49Å; D820-R824 PolarHBondContact O-N 3.16Å; D820-R824 IonicContact OD1-CZ 3.36Å; D820-R824 IonicContact OD1-NE 3.17Å; D820-R824 PolarHBondContact OD1-NE 2.84Å; D820-R824 IonicContact OD1-NH2 3.49Å; D820-R824 PolarHBondContact OD1-NH2 2.68Å; D820-R824 IonicContact OD2-CZ 2.7Å; D820-R824 IonicContact OD2-NE 3.64Å; D820-R824 IonicContact OD2-NH2 3.46Å; D820-R824 PolarHBondContact OD2-NH2 2.93Å
821	F	96.7	Very high	91.5	Very high	0 Å²	0	70.7 Å²	70.7	0%	0	39%	0.393	C	S	.	.	H	α-helix	trans	-56.1	-45	170.4	174.6	-109.4	0	0	0	112.9	D800 M803 F804 L807 L816 E817 W818 R824 L825	D800-F821 HydrophobicContact CB-CE1 4.27Å; D800-F821 WeakPolarHBondContact O-CE1 3.29Å; D800-F821 VanDerWaalsContact O-CZ 3.24Å; D800-F821 WeakPolarHBondContact O-CZ 3.35Å; M803-F821 HydrophobicContact CB-CE2 4.41Å; M803-F821 HydrophobicContact CB-CZ 3.99Å; M803-F821 HydrophobicContact CG-CE2 4.15Å; M803-F821 HydrophobicContact CG-CZ 4.14Å; F804-F821 HydrophobicContact CB-CD1 3.89Å; F804-F821 HydrophobicContact CB-CE1 3.71Å; F804-F821 HydrophobicContact CB-CE2 4.36Å; F804-F821 HydrophobicContact CB-CG 4.28Å; F804-F821 HydrophobicContact CB-CZ 3.96Å; F804-F821 HydrophobicContact CD2-CB 3.67Å; F804-F821 AromaticContact CD2-CD1 3.7Å; F804-F821 HydrophobicContact CD2-CD1 3.7Å; F804-F821 HydrophobicContact CD2-CD2 4.21Å; F804-F821 HydrophobicContact CD2-CE1 4.4Å; F804-F821 AromaticContact CD2-CG 3.58Å; F804-F821 HydrophobicContact CD2-CG 3.58Å; F804-F821 HydrophobicContact CE2-CB 4.02Å; F804-F821 HydrophobicContact CE2-CG 4.42Å; F804-F821 HydrophobicContact CG-CD1 4.2Å; F804-F821 HydrophobicContact CG-CE1 4.5Å; F804-F821 HydrophobicContact CG-CG 4.41Å; L807-F821 HydrophobicContact CD2-CD2 4.17Å; L807-F821 HydrophobicContact CD2-CE2 4.42Å; L816-F821 HydrophobicContact CD2-CB 3.86Å; L816-F821 HydrophobicContact CD2-CD2 4.17Å; L816-F821 HydrophobicContact CD2-CG 4.46Å; L816-F821 HydrophobicContact CG-CB 4.16Å; E817-F821 PolarHBondContact O-N 3.4Å; W818-F821 HydrophobicContact CD2-CD1 4.46Å; W818-F821 HydrophobicContact CE3-CD1 4.07Å; W818-F821 HydrophobicContact CH2-CD1 4.32Å; W818-F821 HydrophobicContact CH2-CE1 4.11Å; W818-F821 AromaticContact CZ3-CD1 4Å; W818-F821 HydrophobicContact CZ3-CD1 4Å; W818-F821 HydrophobicContact CZ3-CE1 4.02Å; W818-F821 PolarHBondContact O-N 3Å; F821-R824 WeakPolarHBondContact O-CB 3.29Å; F821-R824 PolarHBondContact O-N 3.44Å; F821-L825 HydrophobicContact CD1-CD1 4.04Å; F821-L825 HydrophobicContact CE1-CD1 3.32Å; F821-L825 HydrophobicContact CE1-CG 4.16Å; F821-L825 HydrophobicContact CE2-CD1 4.17Å; F821-L825 HydrophobicContact CE2-CG 4.18Å; F821-L825 HydrophobicContact CZ-CD1 3.4Å; F821-L825 HydrophobicContact CZ-CD2 4.37Å; F821-L825 HydrophobicContact CZ-CG 3.89Å; F821-L825 PolarHBondContact O-N 3.46Å
822	Q	96.6	Very high	91.7	Very high	45 Å²	45	69.2 Å²	69.2	21%	0.21	38%	0.382	C	S	.	.	H	α-helix	trans	-63.2	-43.5	176.8	-170.6	63.1	62.6	0	0	111.6	W818 D820 R824 L825 D826	W818-Q822 WeakPolarHBondContact O-CB 3.3Å; W818-Q822 PolarHBondContact O-N 2.87Å; D820-Q822 VanDerWaalsContact C-N 3.34Å; D820-Q822 PolarHBondContact O-N 3.14Å; Q822-R824 VanDerWaalsContact C-N 3.26Å; Q822-R824 PolarHBondContact O-N 3.31Å; Q822-L825 CarbonylContact O-C 3.55Å; Q822-L825 WeakPolarHBondContact O-CB 3.18Å; Q822-L825 PolarHBondContact O-N 2.83Å; Q822-L825 VanDerWaalsContact O-N 3.09Å; Q822-D826 PolarHBondContact NE2-OD1 3.39Å; Q822-D826 WeakPolarHBondContact O-CB 3.26Å; Q822-D826 PolarHBondContact O-N 3.1Å
823	Q	96.1	Very high	92.1	Very high	126 Å²	126	65 Å²	65	59%	0.589	36%	0.356	S	S	*	.	H	α-helix	trans	-60.1	-35.4	175.5	-73.2	170.4	31.9	0	0	112.7	N819 D820 S827	N819-Q823 VanDerWaalsContact O-CG 3.29Å; N819-Q823 WeakPolarHBondContact O-CG 3.48Å; N819-Q823 PolarHBondContact O-N 3.38Å; N819-Q823 VanDerWaalsContact O-N 3.13Å; D820-Q823 PolarHBondContact O-N 3.44Å; Q823-S827 WeakPolarHBondContact O-CB 3.4Å; Q823-S827 PolarHBondContact O-N 2.91Å; Q823-S827 PolarHBondContact O-OG 3.33Å
824	R	95.9	Very high	92.6	Very high	47 Å²	47	62 Å²	62	18%	0.177	34%	0.339	C	S	.	.	H	α-helix	trans	-68.5	-39.7	173.8	-66.3	162.8	-168.4	-129.4	15.1	111.9	R783 V784 V787 D820 F821 Q822 L828	R783-R824 HydrophobicContact CB-CG 4.45Å; R783-R824 WeakPolarHBondContact O-CD 3.43Å; R783-R824 PolarHBondContact O-NH1 2.9Å; V784-R824 HydrophobicContact CG1-CB 4.08Å; V784-R824 HydrophobicContact CG1-CG 4.44Å; V784-R824 WeakPolarHBondContact CG1-O 3.43Å; V787-R824 HydrophobicContact CG2-CB 4.22Å; D820-R824 VanDerWaalsContact O-CG 3.31Å; D820-R824 WeakPolarHBondContact O-CG 3.49Å; D820-R824 PolarHBondContact O-N 3.16Å; D820-R824 IonicContact OD1-CZ 3.36Å; D820-R824 IonicContact OD1-NE 3.17Å; D820-R824 PolarHBondContact OD1-NE 2.84Å; D820-R824 IonicContact OD1-NH2 3.49Å; D820-R824 PolarHBondContact OD1-NH2 2.68Å; D820-R824 IonicContact OD2-CZ 2.7Å; D820-R824 IonicContact OD2-NE 3.64Å; D820-R824 IonicContact OD2-NH2 3.46Å; D820-R824 PolarHBondContact OD2-NH2 2.93Å; F821-R824 WeakPolarHBondContact O-CB 3.29Å; F821-R824 PolarHBondContact O-N 3.44Å; Q822-R824 VanDerWaalsContact C-N 3.26Å; Q822-R824 PolarHBondContact O-N 3.31Å; R824-L828 WeakPolarHBondContact O-CG 3.26Å; R824-L828 PolarHBondContact O-N 3.1Å
825	L	94.6	Very high	93.2	Very high	0 Å²	0	60 Å²	60	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-67.2	-38.3	173.5	-79.6	177.8	0	0	0	113.1	V787 D800 M803 F821 Q822 L828 A829	V787-L825 HydrophobicContact CG1-CD2 3.74Å; D800-L825 HydrophobicContact CB-CD1 4.13Å; M803-L825 HydrophobicContact SD-CD2 4.1Å; F821-L825 HydrophobicContact CD1-CD1 4.04Å; F821-L825 HydrophobicContact CE1-CD1 3.32Å; F821-L825 HydrophobicContact CE1-CG 4.16Å; F821-L825 HydrophobicContact CE2-CD1 4.17Å; F821-L825 HydrophobicContact CE2-CG 4.18Å; F821-L825 HydrophobicContact CZ-CD1 3.4Å; F821-L825 HydrophobicContact CZ-CD2 4.37Å; F821-L825 HydrophobicContact CZ-CG 3.89Å; F821-L825 PolarHBondContact O-N 3.46Å; Q822-L825 CarbonylContact O-C 3.55Å; Q822-L825 WeakPolarHBondContact O-CB 3.18Å; Q822-L825 PolarHBondContact O-N 2.83Å; Q822-L825 VanDerWaalsContact O-N 3.09Å; L825-L828 CarbonylContact O-C 3.59Å; L825-L828 WeakPolarHBondContact O-CA 3.36Å; L825-L828 WeakPolarHBondContact O-CB 3.38Å; L825-L828 PolarHBondContact O-N 3.37Å; L825-L828 VanDerWaalsContact O-N 3.08Å; L825-A829 PolarHBondContact O-N 2.96Å
826	D	94.4	Very high	93.2	Very high	91 Å²	91	61.6 Å²	61.6	49%	0.487	31%	0.312	S	S	.	.	H	α-helix	trans	-70.7	-36.1	179.8	-63.6	-15.9	0	0	0	110.7	Q822 L828 A829	Q822-D826 PolarHBondContact NE2-OD1 3.39Å; Q822-D826 WeakPolarHBondContact O-CB 3.26Å; Q822-D826 PolarHBondContact O-N 3.1Å; D826-L828 PolarHBondContact O-N 3.08Å; D826-A829 VanDerWaalsContact O-CB 3.25Å; D826-A829 WeakPolarHBondContact O-CB 3.24Å; D826-A829 PolarHBondContact O-N 3.08Å; D826-A829 VanDerWaalsContact O-N 3.1Å
827	S	94.4	Very high	92.7	Very high	60 Å²	60	63 Å²	63	42%	0.42	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-21.3	169	-57.3	0	0	0	0	113.2	Q823	Q823-S827 WeakPolarHBondContact O-CB 3.4Å; Q823-S827 PolarHBondContact O-N 2.91Å; Q823-S827 PolarHBondContact O-OG 3.33Å
828	L	95.1	Very high	92.5	Very high	1 Å²	1	57.6 Å²	57.6	1%	0.005	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.2	2.4	177	-71.6	170.5	0	0	0	113.8	F775 V784 V787 L788 R824 L825 D826 G830 F831 M832	F775-L828 HydrophobicContact CZ-CD2 4.06Å; V784-L828 HydrophobicContact CB-CD1 4Å; V784-L828 HydrophobicContact CB-CD2 4.14Å; V784-L828 HydrophobicContact CB-CG 4.03Å; V784-L828 HydrophobicContact CG1-CD1 4.38Å; V784-L828 HydrophobicContact CG1-CG 4.14Å; V784-L828 HydrophobicContact CG2-CD2 4.19Å; V787-L828 HydrophobicContact CB-CD1 3.87Å; V787-L828 HydrophobicContact CG1-CD1 3.71Å; L788-L828 HydrophobicContact CD1-CD2 4.1Å; L788-L828 HydrophobicContact CD2-CD1 4.27Å; L788-L828 HydrophobicContact CD2-CD2 3.83Å; L788-L828 HydrophobicContact CG-CD1 4.26Å; L788-L828 HydrophobicContact CG-CD2 3.98Å; R824-L828 WeakPolarHBondContact O-CG 3.26Å; R824-L828 PolarHBondContact O-N 3.1Å; L825-L828 CarbonylContact O-C 3.59Å; L825-L828 WeakPolarHBondContact O-CA 3.36Å; L825-L828 WeakPolarHBondContact O-CB 3.38Å; L825-L828 PolarHBondContact O-N 3.37Å; L825-L828 VanDerWaalsContact O-N 3.08Å; D826-L828 PolarHBondContact O-N 3.08Å; L828-G830 PolarHBondContact O-N 2.88Å; L828-G830 VanDerWaalsContact O-N 3.08Å; L828-F831 HydrophobicContact CD2-CD2 4.45Å; L828-F831 CarbonylContact O-C 3.53Å; L828-F831 WeakPolarHBondContact O-CA 3.18Å; L828-F831 PolarHBondContact O-N 3.38Å; L828-M832 HydrophobicContact CB-CG 4.37Å; L828-M832 HydrophobicContact CB-SD 4.08Å; L828-M832 HydrophobicContact CD1-SD 3.76Å; L828-M832 HydrophobicContact CG-SD 4.45Å; L828-M832 PolarHBondContact O-N 3.2Å
829	A	89.8	Confident	92.3	Very high	67 Å²	67	54 Å²	54	55%	0.554	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-21.6	-175	0	0	0	0	0	114.7	L825 D826 F831	L825-A829 PolarHBondContact O-N 2.96Å; D826-A829 VanDerWaalsContact O-CB 3.25Å; D826-A829 WeakPolarHBondContact O-CB 3.24Å; D826-A829 PolarHBondContact O-N 3.08Å; D826-A829 VanDerWaalsContact O-N 3.1Å; A829-F831 VanDerWaalsContact C-N 3.31Å
830	G	87.6	Confident	92.1	Very high	54 Å²	54	49.6 Å²	49.6	56%	0.557	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.1	-9.2	172	0	0	0	0	0	115.1	L828	L828-G830 PolarHBondContact O-N 2.88Å; L828-G830 VanDerWaalsContact O-N 3.08Å
831	F	92.7	Very high	91.8	Very high	4 Å²	4	47.7 Å²	47.7	2%	0.018	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-126.7	-21	-171	-56.8	-77.9	0	0	0	113.5	M770 S774 F775 L828 A829 C843 F847	M770-F831 HydrophobicContact CB-CE1 4.1Å; M770-F831 HydrophobicContact CB-CZ 4.33Å; M770-F831 HydrophobicContact CE-CE1 4.07Å; S774-F831 WeakPolarHBondContact OG-CE2 3.33Å; F775-F831 HydrophobicContact CE2-CD2 4.23Å; F775-F831 AromaticContact CE2-CE2 3.62Å; F775-F831 HydrophobicContact CE2-CE2 3.62Å; F775-F831 HydrophobicContact CE2-CZ 4.12Å; F775-F831 HydrophobicContact CZ-CD2 4.23Å; F775-F831 AromaticContact CZ-CE2 3.86Å; F775-F831 HydrophobicContact CZ-CE2 3.86Å; L828-F831 HydrophobicContact CD2-CD2 4.45Å; L828-F831 CarbonylContact O-C 3.53Å; L828-F831 WeakPolarHBondContact O-CA 3.18Å; L828-F831 PolarHBondContact O-N 3.38Å; A829-F831 VanDerWaalsContact C-N 3.31Å; F831-C843 WeakPolarHBondContact O-CB 3.37Å; F831-C843 PolarHBondContact O-N 3.28Å; F831-F847 HydrophobicContact CB-CE1 3.82Å; F831-F847 HydrophobicContact CB-CZ 4.29Å; F831-F847 AromaticContact CD1-CE1 3.69Å; F831-F847 HydrophobicContact CD1-CE1 3.69Å; F831-F847 AromaticContact CD1-CE2 3.97Å; F831-F847 HydrophobicContact CD1-CE2 3.97Å; F831-F847 AromaticContact CD1-CZ 3.35Å; F831-F847 HydrophobicContact CD1-CZ 3.35Å; F831-F847 HydrophobicContact CE1-CE2 4.27Å; F831-F847 AromaticContact CE1-CZ 3.96Å; F831-F847 HydrophobicContact CE1-CZ 3.96Å; F831-F847 HydrophobicContact CG-CE1 4.11Å; F831-F847 HydrophobicContact CG-CZ 4.08Å
832	M	92.3	Very high	91.6	Very high	6 Å²	6	47.9 Å²	47.9	3%	0.03	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	130.3	179.3	-64.8	179.8	77	0	0	111.1	L788 A791 M803 L828 R840 M841 L842	L788-M832 HydrophobicContact CD2-SD 4.34Å; A791-M832 HydrophobicContact CB-CE 3.78Å; M803-M832 HydrophobicContact CE-CE 4Å; M803-M832 HydrophobicContact SD-CE 4.25Å; L828-M832 HydrophobicContact CB-CG 4.37Å; L828-M832 HydrophobicContact CB-SD 4.08Å; L828-M832 HydrophobicContact CD1-SD 3.76Å; L828-M832 HydrophobicContact CG-SD 4.45Å; L828-M832 PolarHBondContact O-N 3.2Å; M832-R840 HydrophobicContact CE-CB 3.93Å; M832-M841 CarbonylContact C-O 3.57Å; M832-M841 VanDerWaalsContact CA-O 3.3Å; M832-M841 WeakPolarHBondContact CA-O 3.25Å; M832-L842 HydrophobicContact CG-CD2 3.96Å
833	V	89.6	Confident	91.3	Very high	49 Å²	49	47.4 Å²	47.4	30%	0.297	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	131.1	178.7	179	0	0	0	0	109.5	P418 R840 M841 C843	P418-V833 HydrophobicContact CB-CB 4.34Å; P418-V833 HydrophobicContact CB-CG2 4.06Å; V833-R840 WeakPolarHBondContact O-CA 3.18Å; V833-M841 PolarHBondContact N-O 2.86Å; V833-M841 PolarHBondContact O-N 2.99Å; V833-C843 HydrophobicContact CG2-CB 4.45Å
834	R	90.1	Very high	91	Very high	132 Å²	132	43.7 Å²	43.7	50%	0.498	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	126.3	171	-167.6	176.7	-166.9	156.9	9.3	109.9	D800 T839	D800-R834 IonicContact OD2-CZ 3.6Å; D800-R834 IonicContact OD2-NH1 3.73Å; D800-R834 PolarHBondContact OD2-NH1 3Å; D800-R834 IonicContact OD2-NH2 2.7Å; D800-R834 PolarHBondContact OD2-NH2 3.31Å; R834-T839 WeakPolarHBondContact CA-O 3.44Å
835	R	88.1	Confident	90.8	Very high	22 Å²	22	43.7 Å²	43.7	8%	0.083	24%	0.243	C	C	.	.	P	Polyproline II helix	trans	-85.3	163.1	-178.4	-69.5	-179.7	64.6	-116	-5.3	111.8	E416 D837 G838 T839 M841	E416-R835 HydrophobicContact CG-CG 4.44Å; E416-R835 VanDerWaalsContact OE2-CA 3.26Å; E416-R835 WeakPolarHBondContact OE2-CA 3.32Å; E416-R835 WeakPolarHBondContact OE2-CB 3.2Å; E416-R835 IonicContact OE2-NE 2.77Å; R835-D837 WeakPolarHBondContact CB-OD1 3.43Å; R835-D837 IonicContact CZ-OD1 2.7Å; R835-D837 IonicContact CZ-OD2 3.12Å; R835-D837 VanDerWaalsContact CZ-OD2 3.29Å; R835-D837 VanDerWaalsContact NH1-CG 3.35Å; R835-D837 IonicContact NH1-OD1 3.62Å; R835-D837 PolarHBondContact NH1-OD1 3.01Å; R835-D837 IonicContact NH1-OD2 2.77Å; R835-D837 PolarHBondContact NH1-OD2 3.04Å; R835-D837 IonicContact NH2-OD2 2.71Å; R835-D837 PolarHBondContact NH2-OD2 2.65Å; R835-D837 PolarHBondContact O-N 2.98Å; R835-G838 PolarHBondContact O-N 3.33Å; R835-T839 WeakPolarHBondContact CB-O 3.46Å; R835-T839 WeakPolarHBondContact CD-OG1 3.42Å; R835-T839 PolarHBondContact N-O 3.21Å; R835-T839 PolarHBondContact NH1-OG1 3.47Å; R835-M841 VanDerWaalsContact CD-SD 3.59Å
836	R	85.3	Confident	90.6	Very high	181 Å²	181	44.1 Å²	44.1	68%	0.683	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-26.1	-179.5	-68.7	170.7	-167.5	-159.7	0.9	114.3	E416 M476 G838	E416-R836 WeakPolarHBondContact OE1-CG 3.3Å; E416-R836 IonicContact OE1-NE 3.32Å; E416-R836 PolarHBondContact OE1-NE 2.97Å; E416-R836 PolarHBondContact OE2-N 3.31Å; M476-R836 PolarHBondContact SD-NH1 3.31Å; R836-G838 VanDerWaalsContact C-N 3.26Å
837	D	82.9	Confident	90.6	Very high	56 Å²	56	39.9 Å²	39.9	30%	0.299	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.1	2.1	175.3	60.8	15.5	0	0	0	113.5	V357 R835 T839	V357-D837 HydrophobicContact CB-CB 4.43Å; V357-D837 HydrophobicContact CG2-CB 3.91Å; R835-D837 WeakPolarHBondContact CB-OD1 3.43Å; R835-D837 IonicContact CZ-OD1 2.7Å; R835-D837 IonicContact CZ-OD2 3.12Å; R835-D837 VanDerWaalsContact CZ-OD2 3.29Å; R835-D837 VanDerWaalsContact NH1-CG 3.35Å; R835-D837 IonicContact NH1-OD1 3.62Å; R835-D837 PolarHBondContact NH1-OD1 3.01Å; R835-D837 IonicContact NH1-OD2 2.77Å; R835-D837 PolarHBondContact NH1-OD2 3.04Å; R835-D837 IonicContact NH2-OD2 2.71Å; R835-D837 PolarHBondContact NH2-OD2 2.65Å; R835-D837 PolarHBondContact O-N 2.98Å; D837-T839 VanDerWaalsContact C-N 3.34Å; D837-T839 WeakPolarHBondContact OD1-CB 3.3Å; D837-T839 WeakPolarHBondContact OD1-CG2 3.47Å; D837-T839 PolarHBondContact OD1-N 3.13Å; D837-T839 PolarHBondContact OD1-OG1 2.91Å
838	G	90	Very high	90.5	Very high	17 Å²	17	38.1 Å²	38.1	18%	0.175	21%	0.207	C	C	.	.	S	Bend	trans	87.5	-4.8	179.9	0	0	0	0	0	114.8	R835 R836	R835-G838 PolarHBondContact O-N 3.33Å; R836-G838 VanDerWaalsContact C-N 3.26Å
839	T	93.1	Very high	90.4	Very high	13 Å²	13	41.9 Å²	41.9	8%	0.08	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	169.5	174.7	65	0	0	0	0	112.7	P797 L798 T799 R834 R835 D837	P797-T839 HydrophobicContact CB-CG2 4.23Å; P797-T839 WeakPolarHBondContact CB-OG1 3.42Å; L798-T839 CarbonylContact O-C 3.6Å; L798-T839 WeakPolarHBondContact O-CA 3.4Å; L798-T839 WeakPolarHBondContact O-CB 3.35Å; T799-T839 HydrophobicContact CG2-CG2 3.9Å; R834-T839 WeakPolarHBondContact CA-O 3.44Å; R835-T839 WeakPolarHBondContact CB-O 3.46Å; R835-T839 WeakPolarHBondContact CD-OG1 3.42Å; R835-T839 PolarHBondContact N-O 3.21Å; R835-T839 PolarHBondContact NH1-OG1 3.47Å; D837-T839 VanDerWaalsContact C-N 3.34Å; D837-T839 WeakPolarHBondContact OD1-CB 3.3Å; D837-T839 WeakPolarHBondContact OD1-CG2 3.47Å; D837-T839 PolarHBondContact OD1-N 3.13Å; D837-T839 PolarHBondContact OD1-OG1 2.91Å
840	R	92.3	Very high	90.6	Very high	20 Å²	20	39.3 Å²	39.3	8%	0.075	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	145.6	172.6	-59.7	-168.3	-177.1	-134.1	-0.3	112.8	L798 D800 M832 V833	L798-R840 PolarHBondContact O-N 2.98Å; D800-R840 IonicContact OD1-CZ 3.86Å; D800-R840 IonicContact OD1-NE 3.54Å; D800-R840 PolarHBondContact OD1-NE 2.97Å; D800-R840 IonicContact OD1-NH2 2.65Å; D800-R840 IonicContact OD2-CZ 3.76Å; D800-R840 IonicContact OD2-NE 2.86Å; D800-R840 IonicContact OD2-NH2 2.95Å; D800-R840 PolarHBondContact OD2-NH2 2.88Å; M832-R840 HydrophobicContact CE-CB 3.93Å; V833-R840 WeakPolarHBondContact O-CA 3.18Å
841	M	90.9	Very high	91	Very high	11 Å²	11	36.8 Å²	36.8	5%	0.054	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	162.6	169.8	-82.6	-178.7	54.8	0	0	110.2	P418 D539 P797 M832 V833 R835	P418-M841 HydrophobicContact CG-CB 4.36Å; P418-M841 HydrophobicContact CG-CE 4.14Å; D539-M841 HydrophobicContact CB-CE 3.78Å; D539-M841 HydrophobicContact CB-CG 4.17Å; D539-M841 HydrophobicContact CB-SD 4.31Å; P797-M841 HydrophobicContact CB-CG 3.99Å; P797-M841 HydrophobicContact CG-CG 3.6Å; P797-M841 HydrophobicContact CG-SD 3.76Å; M832-M841 CarbonylContact C-O 3.57Å; M832-M841 VanDerWaalsContact CA-O 3.3Å; M832-M841 WeakPolarHBondContact CA-O 3.25Å; V833-M841 PolarHBondContact N-O 2.86Å; V833-M841 PolarHBondContact O-N 2.99Å; R835-M841 VanDerWaalsContact CD-SD 3.59Å
842	L	92.4	Very high	91	Very high	4 Å²	4	39.6 Å²	39.6	2%	0.021	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74	154.9	172.8	-72.7	160	0	0	0	110.9	D539 L788 L792 M832 H844 F847 R848 L851	D539-L842 PolarHBondContact OD2-N 3.36Å; L788-L842 HydrophobicContact CD2-CD2 4.23Å; L792-L842 HydrophobicContact CD2-CD1 3.61Å; L792-L842 HydrophobicContact CG-CD1 4.46Å; M832-L842 HydrophobicContact CG-CD2 3.96Å; L842-H844 VanDerWaalsContact C-N 3.29Å; L842-H844 PolarHBondContact O-N 3.26Å; L842-F847 HydrophobicContact CD2-CD1 4.11Å; L842-F847 HydrophobicContact CD2-CE1 4.14Å; L842-R848 HydrophobicContact CD1-CB 3.81Å; L842-R848 HydrophobicContact CD1-CG 3.71Å; L842-L851 HydrophobicContact CD2-CD1 4.11Å
843	C	89.6	Confident	91	Very high	35 Å²	35	47.1 Å²	47.1	24%	0.236	22%	0.22	C	C	.	.	S	Bend	trans	-67.1	-24.2	-172.2	63	0	0	0	0	114.5	F831 V833	F831-C843 WeakPolarHBondContact O-CB 3.37Å; F831-C843 PolarHBondContact O-N 3.28Å; V833-C843 HydrophobicContact CG2-CB 4.45Å
844	H	90.4	Very high	90.9	Very high	47 Å²	47	46 Å²	46	22%	0.218	21%	0.21	C	C	.	.			trans	-161.4	143.9	173.8	-168.3	-102	0	0	0	111.4	L735 L842 S846 F847 R848	L735-H844 HydrophobicContact CD2-CB 4.2Å; L735-H844 WeakPolarHBondContact CD2-ND1 3.16Å; L842-H844 VanDerWaalsContact C-N 3.29Å; L842-H844 PolarHBondContact O-N 3.26Å; H844-S846 VanDerWaalsContact C-N 3.32Å; H844-S846 PolarHBondContact CE1-OG 3.5Å; H844-S846 PolarHBondContact ND1-N 3.47Å; H844-S846 PolarHBondContact ND1-OG 2.86Å; H844-S846 PolarHBondContact O-N 3.15Å; H844-F847 WeakPolarHBondContact O-CA 3.29Å; H844-F847 WeakPolarHBondContact O-CB 3.49Å; H844-F847 PolarHBondContact O-N 2.91Å; H844-R848 PolarHBondContact O-N 3.08Å
845	P	90.3	Very high	90.7	Very high	48 Å²	48	41.6 Å²	41.6	31%	0.312	20%	0.202	S	C	.	.	H	α-helix	trans	-55.9	-37	179.9	-30.4	37.8	0	0	0	115.2	F847 R848 E849	P845-F847 PolarHBondContact O-N 3.46Å; P845-R848 WeakPolarHBondContact O-CA 3.38Å; P845-R848 VanDerWaalsContact O-CB 3.24Å; P845-R848 WeakPolarHBondContact O-CB 3.49Å; P845-R848 PolarHBondContact O-N 3.26Å; P845-E849 PolarHBondContact O-N 3.15Å
846	S	92	Very high	90.6	Very high	8 Å²	8	48.8 Å²	48.8	6%	0.056	24%	0.242	C	C	.	.	H	α-helix	trans	-70	-17.4	175.4	63.5	0	0	0	0	114.4	Y767 H844 E849 W850	Y767-S846 PolarHBondContact OH-OG 3.29Å; H844-S846 VanDerWaalsContact C-N 3.32Å; H844-S846 PolarHBondContact CE1-OG 3.5Å; H844-S846 PolarHBondContact ND1-N 3.47Å; H844-S846 PolarHBondContact ND1-OG 2.86Å; H844-S846 PolarHBondContact O-N 3.15Å; S846-E849 WeakPolarHBondContact CA-OE2 3.39Å; S846-W850 VanDerWaalsContact O-CB 3.24Å; S846-W850 WeakPolarHBondContact O-CB 3.26Å; S846-W850 PolarHBondContact O-N 2.88Å; S846-W850 VanDerWaalsContact O-N 3.12Å
847	F	94.1	Very high	90.4	Very high	3 Å²	3	44.3 Å²	44.3	1%	0.013	25%	0.252	C	S	.	.	H	α-helix	trans	-78.1	-33.8	168.1	-176.1	-110.6	0	0	0	111	Y767 F831 L842 H844 P845 W850 L851	Y767-F847 AromaticContact CD1-CD2 3.66Å; Y767-F847 HydrophobicContact CD1-CD2 3.66Å; Y767-F847 HydrophobicContact CD1-CE2 4.33Å; Y767-F847 HydrophobicContact CD2-CD2 4.03Å; Y767-F847 HydrophobicContact CE1-CB 4.07Å; Y767-F847 AromaticContact CE1-CD2 3.94Å; Y767-F847 HydrophobicContact CE1-CD2 3.94Å; Y767-F847 HydrophobicContact CE1-CG 4.39Å; Y767-F847 HydrophobicContact CE2-CB 4.18Å; Y767-F847 HydrophobicContact CE2-CD2 4.28Å; Y767-F847 AromaticContact CG-CD2 3.72Å; Y767-F847 HydrophobicContact CG-CD2 3.72Å; Y767-F847 HydrophobicContact CG-CE2 4.3Å; F831-F847 HydrophobicContact CB-CE1 3.82Å; F831-F847 HydrophobicContact CB-CZ 4.29Å; F831-F847 AromaticContact CD1-CE1 3.69Å; F831-F847 HydrophobicContact CD1-CE1 3.69Å; F831-F847 AromaticContact CD1-CE2 3.97Å; F831-F847 HydrophobicContact CD1-CE2 3.97Å; F831-F847 AromaticContact CD1-CZ 3.35Å; F831-F847 HydrophobicContact CD1-CZ 3.35Å; F831-F847 HydrophobicContact CE1-CE2 4.27Å; F831-F847 AromaticContact CE1-CZ 3.96Å; F831-F847 HydrophobicContact CE1-CZ 3.96Å; F831-F847 HydrophobicContact CG-CE1 4.11Å; F831-F847 HydrophobicContact CG-CZ 4.08Å; L842-F847 HydrophobicContact CD2-CD1 4.11Å; L842-F847 HydrophobicContact CD2-CE1 4.14Å; H844-F847 WeakPolarHBondContact O-CA 3.29Å; H844-F847 WeakPolarHBondContact O-CB 3.49Å; H844-F847 PolarHBondContact O-N 2.91Å; P845-F847 PolarHBondContact O-N 3.46Å; F847-W850 AromaticContact CD2-CE3 3.95Å; F847-W850 HydrophobicContact CD2-CE3 3.95Å; F847-W850 AromaticContact CE2-CE3 3.6Å; F847-W850 HydrophobicContact CE2-CE3 3.6Å; F847-W850 AromaticContact CE2-CZ3 3.78Å; F847-W850 HydrophobicContact CE2-CZ3 3.78Å; F847-W850 HydrophobicContact CZ-CE3 4.48Å; F847-W850 HydrophobicContact CZ-CZ3 4.49Å; F847-W850 PolarHBondContact O-N 3.4Å; F847-L851 HydrophobicContact CD1-CD1 4.11Å; F847-L851 HydrophobicContact CD1-CG 4.41Å; F847-L851 HydrophobicContact CE1-CD1 3.56Å; F847-L851 HydrophobicContact CE1-CD2 4.33Å; F847-L851 HydrophobicContact CE1-CG 3.95Å; F847-L851 HydrophobicContact CE2-CD2 4.32Å; F847-L851 HydrophobicContact CE2-CG 4.34Å; F847-L851 HydrophobicContact CZ-CD1 3.96Å; F847-L851 HydrophobicContact CZ-CD2 3.86Å; F847-L851 HydrophobicContact CZ-CG 3.91Å; F847-L851 WeakPolarHBondContact O-CG 3.49Å; F847-L851 PolarHBondContact O-N 3.28Å
848	R	92.4	Very high	90.7	Very high	22 Å²	22	44.6 Å²	44.6	8%	0.083	25%	0.252	C	S	.	.	H	α-helix	trans	-59.2	-49.8	170.1	-168.4	-152.7	-176.8	144.9	-5.3	111.3	A538 D539 L792 L842 H844 P845 W850 L851 V852	A538-R848 PolarHBondContact O-NH1 3.07Å; D539-R848 VanDerWaalsContact CA-NH1 3.31Å; D539-R848 VanDerWaalsContact N-NH1 3.16Å; D539-R848 WeakPolarHBondContact OD1-CD 3.41Å; D539-R848 IonicContact OD1-CZ 3.47Å; D539-R848 IonicContact OD1-NE 2.69Å; D539-R848 IonicContact OD1-NH1 3.61Å; D539-R848 PolarHBondContact OD1-NH1 2.95Å; L792-R848 HydrophobicContact CD2-CB 4.37Å; L792-R848 HydrophobicContact CD2-CG 3.4Å; L792-R848 PolarHBondContact O-NH2 3.35Å; L842-R848 HydrophobicContact CD1-CB 3.81Å; L842-R848 HydrophobicContact CD1-CG 3.71Å; H844-R848 PolarHBondContact O-N 3.08Å; P845-R848 WeakPolarHBondContact O-CA 3.38Å; P845-R848 VanDerWaalsContact O-CB 3.24Å; P845-R848 WeakPolarHBondContact O-CB 3.49Å; P845-R848 PolarHBondContact O-N 3.26Å; R848-W850 VanDerWaalsContact C-N 3.33Å; R848-W850 PolarHBondContact O-N 3.18Å; R848-L851 PolarHBondContact O-N 3.1Å; R848-V852 PolarHBondContact O-N 3Å
849	E	92.1	Very high	90.6	Very high	80 Å²	80	46 Å²	46	37%	0.374	26%	0.259	S	S	.	.	H	α-helix	trans	-57.6	-47.5	176	-71.6	159.7	-174.7	0	0	111.1	R658 P845 S846 L851 V852 W853	R658-E849 IonicContact CZ-OE1 3.85Å; R658-E849 IonicContact CZ-OE2 2.7Å; R658-E849 IonicContact NH1-OE1 3.69Å; R658-E849 PolarHBondContact NH1-OE1 3.35Å; R658-E849 IonicContact NH1-OE2 3.55Å; R658-E849 PolarHBondContact NH1-OE2 3.24Å; R658-E849 IonicContact NH2-OE1 3.56Å; R658-E849 PolarHBondContact NH2-OE1 2.8Å; R658-E849 IonicContact NH2-OE2 2.65Å; P845-E849 PolarHBondContact O-N 3.15Å; S846-E849 WeakPolarHBondContact CA-OE2 3.39Å; E849-L851 VanDerWaalsContact C-N 3.28Å; E849-L851 PolarHBondContact O-N 3.05Å; E849-V852 PolarHBondContact O-N 3.02Å; E849-W853 PolarHBondContact O-N 3.05Å
850	W	94.9	Very high	90.5	Very high	14 Å²	14	50.3 Å²	50.3	5%	0.053	29%	0.285	C	S	.	.	H	α-helix	trans	-63.2	-28.8	177.4	-174.3	91.3	0	0	0	113.3	S764 Y767 L768 C771 S846 F847 R848 V852 R854 F862	S764-W850 PolarHBondContact O-NE1 3.35Å; S764-W850 PolarHBondContact OG-NE1 3.49Å; Y767-W850 HydrophobicContact CD2-CB 3.81Å; Y767-W850 AromaticContact CD2-CD1 3.8Å; Y767-W850 AromaticContact CD2-CD2 3.95Å; Y767-W850 HydrophobicContact CD2-CD2 3.95Å; Y767-W850 AromaticContact CD2-CG 3.57Å; Y767-W850 HydrophobicContact CD2-CG 3.57Å; Y767-W850 HydrophobicContact CE2-CB 4.17Å; Y767-W850 HydrophobicContact CE2-CG 4.39Å; Y767-W850 HydrophobicContact CG-CD2 4.21Å; Y767-W850 HydrophobicContact CG-CG 4.31Å; L768-W850 HydrophobicContact CB-CZ2 3.9Å; L768-W850 HydrophobicContact CD1-CZ2 4.39Å; L768-W850 VanDerWaalsContact N-CZ2 3.35Å; C771-W850 HydrophobicContact CB-CH2 4.26Å; S846-W850 VanDerWaalsContact O-CB 3.24Å; S846-W850 WeakPolarHBondContact O-CB 3.26Å; S846-W850 PolarHBondContact O-N 2.88Å; S846-W850 VanDerWaalsContact O-N 3.12Å; F847-W850 AromaticContact CD2-CE3 3.95Å; F847-W850 HydrophobicContact CD2-CE3 3.95Å; F847-W850 AromaticContact CE2-CE3 3.6Å; F847-W850 HydrophobicContact CE2-CE3 3.6Å; F847-W850 AromaticContact CE2-CZ3 3.78Å; F847-W850 HydrophobicContact CE2-CZ3 3.78Å; F847-W850 HydrophobicContact CZ-CE3 4.48Å; F847-W850 HydrophobicContact CZ-CZ3 4.49Å; F847-W850 PolarHBondContact O-N 3.4Å; R848-W850 VanDerWaalsContact C-N 3.33Å; R848-W850 PolarHBondContact O-N 3.18Å; W850-V852 VanDerWaalsContact C-N 3.28Å; W850-V852 PolarHBondContact O-N 3.35Å; W850-R854 VanDerWaalsContact CE2-CZ 3.47Å; W850-R854 VanDerWaalsContact CE2-NH2 3.28Å; W850-R854 PolarHBondContact O-NH1 3.01Å; W850-R854 PolarHBondContact O-NH2 3.04Å; W850-F862 HydrophobicContact CH2-CB 4.01Å; W850-F862 HydrophobicContact CH2-CD2 4.26Å; W850-F862 HydrophobicContact CZ3-CB 4.15Å
851	L	95.4	Very high	90.5	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-72.8	-19.9	172.1	-73.3	177.2	0	0	0	113.1	L788 L792 L842 F847 R848 E849 C864	L788-L851 HydrophobicContact CD1-CD1 4.4Å; L788-L851 HydrophobicContact CD1-CD2 4.47Å; L788-L851 HydrophobicContact CD2-CD1 3.94Å; L792-L851 HydrophobicContact CD1-CB 3.89Å; L792-L851 HydrophobicContact CD1-CD1 4.31Å; L792-L851 HydrophobicContact CD2-CB 4.16Å; L792-L851 HydrophobicContact CD2-CD1 4.33Å; L842-L851 HydrophobicContact CD2-CD1 4.11Å; F847-L851 HydrophobicContact CD1-CD1 4.11Å; F847-L851 HydrophobicContact CD1-CG 4.41Å; F847-L851 HydrophobicContact CE1-CD1 3.56Å; F847-L851 HydrophobicContact CE1-CD2 4.33Å; F847-L851 HydrophobicContact CE1-CG 3.95Å; F847-L851 HydrophobicContact CE2-CD2 4.32Å; F847-L851 HydrophobicContact CE2-CG 4.34Å; F847-L851 HydrophobicContact CZ-CD1 3.96Å; F847-L851 HydrophobicContact CZ-CD2 3.86Å; F847-L851 HydrophobicContact CZ-CG 3.91Å; F847-L851 WeakPolarHBondContact O-CG 3.49Å; F847-L851 PolarHBondContact O-N 3.28Å; R848-L851 PolarHBondContact O-N 3.1Å; E849-L851 VanDerWaalsContact C-N 3.28Å; E849-L851 PolarHBondContact O-N 3.05Å; L851-C864 HydrophobicContact CB-CB 4.47Å; L851-C864 WeakPolarHBondContact O-CB 3.23Å; L851-C864 PolarHBondContact O-N 3.34Å
852	V	93.8	Very high	90.6	Very high	63 Å²	63	53.1 Å²	53.1	38%	0.382	30%	0.301	S	S	.	.	H	α-helix	trans	-108.7	-24.5	-174	-179.8	0	0	0	0	113.1	L792 R848 E849 W850 P866	L792-V852 HydrophobicContact CB-CG2 4.48Å; L792-V852 HydrophobicContact CD1-CG2 4Å; L792-V852 HydrophobicContact CD2-CG2 3.89Å; L792-V852 HydrophobicContact CG-CG2 4.35Å; R848-V852 PolarHBondContact O-N 3Å; E849-V852 PolarHBondContact O-N 3.02Å; W850-V852 VanDerWaalsContact C-N 3.28Å; W850-V852 PolarHBondContact O-N 3.35Å; V852-P866 HydrophobicContact CG1-CG 4.04Å; V852-P866 HydrophobicContact CG2-CG 3.74Å
853	W	90.7	Very high	90.7	Very high	164 Å²	164	56.3 Å²	56.3	62%	0.621	32%	0.317	S	S	*	.			trans	-143.1	155.2	-171.9	-173.8	83.7	0	0	0	112.8	E849 A855	E849-W853 PolarHBondContact O-N 3.05Å; W853-A855 HydrophobicContact CH2-CB 4Å; W853-A855 HydrophobicContact CZ3-CB 4.24Å
854	R	88.2	Confident	91	Very high	26 Å²	26	55.1 Å²	55.1	10%	0.098	31%	0.31	C	S	.	.			trans	-136.1	144.9	-179.6	-76	-79.4	170.6	-76.2	-12.1	108.7	W850 E858 S859 D861 L863	W850-R854 VanDerWaalsContact CE2-CZ 3.47Å; W850-R854 VanDerWaalsContact CE2-NH2 3.28Å; W850-R854 PolarHBondContact O-NH1 3.01Å; W850-R854 PolarHBondContact O-NH2 3.04Å; R854-E858 HydrophobicContact CB-CB 4.28Å; R854-E858 WeakPolarHBondContact CD-OE2 3.36Å; R854-E858 HydrophobicContact CG-CB 4.48Å; R854-S859 WeakPolarHBondContact CD-O 3.4Å; R854-S859 PolarHBondContact NE-O 2.71Å; R854-D861 PolarHBondContact NH2-O 3.45Å; R854-L863 HydrophobicContact CG-CD1 4.27Å
855	A	86.2	Confident	91.2	Very high	39 Å²	39	55.5 Å²	55.5	32%	0.322	31%	0.313	S	S	.	.			trans	-72.7	155.7	164.1	0	0	0	0	0	110.5	W853 G857 E858	W853-A855 HydrophobicContact CH2-CB 4Å; W853-A855 HydrophobicContact CZ3-CB 4.24Å; A855-G857 PolarHBondContact O-N 3.46Å; A855-E858 HydrophobicContact CB-CG 4.08Å; A855-E858 PolarHBondContact N-OE2 3.25Å; A855-E858 WeakPolarHBondContact O-CB 3.39Å; A855-E858 WeakPolarHBondContact O-CG 3.42Å; A855-E858 PolarHBondContact O-N 3.23Å; A855-E858 VanDerWaalsContact O-N 3.1Å
856	D	84.8	Confident	91.4	Very high	173 Å²	173	54.3 Å²	54.3	93%	0.925	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	128	-179	-71.5	-55	0	0	0	111.9
857	G	83	Confident	91.6	Very high	87 Å²	87	59.9 Å²	59.9	90%	0.897	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.3	-6.1	-177.6	0	0	0	0	0	115.7	A855	A855-G857 PolarHBondContact O-N 3.46Å
858	E	88.6	Confident	91.7	Very high	63 Å²	63	62.2 Å²	62.2	29%	0.294	34%	0.342	S	S	.	.	S	Bend	trans	-72.9	159.4	170.9	-63.9	-168.7	124.3	0	0	112.6	S764 R854 A855 T860	S764-E858 WeakPolarHBondContact CB-OE1 3.48Å; S764-E858 VanDerWaalsContact OG-CD 3.3Å; S764-E858 PolarHBondContact OG-OE1 3.24Å; R854-E858 HydrophobicContact CB-CB 4.28Å; R854-E858 WeakPolarHBondContact CD-OE2 3.36Å; R854-E858 HydrophobicContact CG-CB 4.48Å; A855-E858 HydrophobicContact CB-CG 4.08Å; A855-E858 PolarHBondContact N-OE2 3.25Å; A855-E858 WeakPolarHBondContact O-CB 3.39Å; A855-E858 WeakPolarHBondContact O-CG 3.42Å; A855-E858 PolarHBondContact O-N 3.23Å; A855-E858 VanDerWaalsContact O-N 3.1Å; E858-T860 PolarHBondContact O-N 3.06Å
859	S	87.8	Confident	91.9	Very high	46 Å²	46	61.1 Å²	61.1	32%	0.322	34%	0.338	S	S	.	.			trans	-71.2	126.8	177.5	-172.1	0	0	0	0	111.9	R854 D861	R854-S859 WeakPolarHBondContact CD-O 3.4Å; R854-S859 PolarHBondContact NE-O 2.71Å; S859-D861 PolarHBondContact O-N 2.77Å; S859-D861 VanDerWaalsContact O-N 3.07Å; S859-D861 PolarHBondContact OG-N 3.2Å; S859-D861 PolarHBondContact OG-OD2 2.99Å
860	T	90.4	Very high	92.2	Very high	104 Å²	104	58.1 Å²	58.1	64%	0.638	32%	0.324	S	S	*	.			trans	-72.5	9	173	59.4	0	0	0	0	114	E858 L863	E858-T860 PolarHBondContact O-N 3.06Å; T860-L863 WeakPolarHBondContact O-CB 3.48Å; T860-L863 PolarHBondContact O-N 3.07Å
861	D	91.9	Very high	92.3	Very high	62 Å²	62	58 Å²	58	33%	0.332	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.2	143.1	170.5	-63.8	-42	0	0	0	111	L768 R772 R854 S859 L863	L768-D861 HydrophobicContact CD1-CB 3.82Å; R772-D861 IonicContact CZ-OD2 2.78Å; R772-D861 IonicContact NE-OD2 2.78Å; R772-D861 IonicContact NH2-OD2 3.67Å; R772-D861 PolarHBondContact NH2-OD2 2.98Å; R854-D861 PolarHBondContact NH2-O 3.45Å; S859-D861 PolarHBondContact O-N 2.77Å; S859-D861 VanDerWaalsContact O-N 3.07Å; S859-D861 PolarHBondContact OG-N 3.2Å; S859-D861 PolarHBondContact OG-OD2 2.99Å; D861-L863 PolarHBondContact O-N 3.45Å; D861-L863 VanDerWaalsContact O-N 3.12Å
862	F	94.6	Very high	92.4	Very high	27 Å²	27	59.1 Å²	59.1	12%	0.118	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	59.2	15	177.8	-46.4	-76.1	0	0	0	115.8	L768 C771 R772 F775 F781 W850	L768-F862 HydrophobicContact CD1-CD2 3.88Å; L768-F862 HydrophobicContact CD1-CE2 3.94Å; C771-F862 HydrophobicContact CB-CB 4.38Å; C771-F862 HydrophobicContact CB-CD1 3.94Å; C771-F862 HydrophobicContact CB-CD2 3.59Å; C771-F862 HydrophobicContact CB-CE1 4.13Å; C771-F862 HydrophobicContact CB-CE2 3.81Å; C771-F862 HydrophobicContact CB-CG 3.67Å; C771-F862 HydrophobicContact CB-CZ 4.06Å; R772-F862 HydrophobicContact CG-CE2 3.65Å; R772-F862 HydrophobicContact CG-CZ 3.88Å; F775-F862 HydrophobicContact CB-CE1 3.95Å; F775-F862 HydrophobicContact CD2-CE1 4.39Å; F781-F862 HydrophobicContact CB-CD1 4.2Å; F781-F862 HydrophobicContact CB-CE1 4.21Å; F781-F862 AromaticContact CD1-CD1 3.95Å; F781-F862 HydrophobicContact CD1-CD1 3.95Å; F781-F862 AromaticContact CD2-CD1 3.6Å; F781-F862 HydrophobicContact CD2-CD1 3.6Å; F781-F862 HydrophobicContact CD2-CE1 4.27Å; F781-F862 HydrophobicContact CE1-CB 4.18Å; F781-F862 HydrophobicContact CE1-CD1 4.19Å; F781-F862 HydrophobicContact CE2-CB 4.17Å; F781-F862 AromaticContact CE2-CD1 3.86Å; F781-F862 HydrophobicContact CE2-CD1 3.86Å; F781-F862 HydrophobicContact CE2-CG 4.49Å; F781-F862 AromaticContact CG-CD1 3.63Å; F781-F862 HydrophobicContact CG-CD1 3.63Å; F781-F862 HydrophobicContact CG-CE1 4.15Å; F781-F862 HydrophobicContact CZ-CB 3.86Å; F781-F862 HydrophobicContact CZ-CD1 4.14Å; F781-F862 WeakPolarHBondContact CZ-O 3.38Å; W850-F862 HydrophobicContact CH2-CB 4.01Å; W850-F862 HydrophobicContact CH2-CD2 4.26Å; W850-F862 HydrophobicContact CZ3-CB 4.15Å
863	L	94	Very high	92.6	Very high	71 Å²	71	56.2 Å²	56.2	37%	0.372	31%	0.314	S	S	.	.			trans	-67.9	131.6	173.8	-165.9	73.1	0	0	0	110.8	R854 T860 D861	R854-L863 HydrophobicContact CG-CD1 4.27Å; T860-L863 WeakPolarHBondContact O-CB 3.48Å; T860-L863 PolarHBondContact O-N 3.07Å; D861-L863 PolarHBondContact O-N 3.45Å; D861-L863 VanDerWaalsContact O-N 3.12Å
864	C	95.9	Very high	92.9	Very high	11 Å²	11	48.4 Å²	48.4	7%	0.074	28%	0.284	C	S	.	.			trans	-95.5	162.5	178.3	-68.6	0	0	0	0	112.3	L785 N789 L792 L851	L785-C864 HydrophobicContact CD1-CB 4.12Å; N789-C864 VanDerWaalsContact OD1-CB 3.31Å; N789-C864 WeakPolarHBondContact OD1-CB 3.11Å; L792-C864 HydrophobicContact CD1-CB 3.32Å; L851-C864 HydrophobicContact CB-CB 4.47Å; L851-C864 WeakPolarHBondContact O-CB 3.23Å; L851-C864 PolarHBondContact O-N 3.34Å
865	D	93.6	Very high	93.3	Very high	54 Å²	54	50.4 Å²	50.4	29%	0.289	29%	0.294	S	S	.	.			trans	-121.7	93.7	172.9	-173	-6.8	0	0	0	110.6	N789 R867 S868	N789-D865 VanDerWaalsContact CG-O 3.32Å; N789-D865 PolarHBondContact OD1-N 2.98Å; N789-D865 PolarHBondContact OD1-O 2.87Å; D865-R867 PolarHBondContact O-N 2.94Å; D865-R867 WeakPolarHBondContact OD1-CB 3.44Å; D865-R867 VanDerWaalsContact OD1-CG 3.24Å; D865-R867 WeakPolarHBondContact OD1-CG 3.4Å; D865-R867 IonicContact OD1-CZ 3.52Å; D865-R867 PolarHBondContact OD1-N 3.5Å; D865-R867 IonicContact OD1-NE 2.86Å; D865-R867 PolarHBondContact OD1-NE 2.94Å; D865-R867 IonicContact OD1-NH2 3.48Å; D865-R867 IonicContact OD2-CZ 3.47Å; D865-R867 IonicContact OD2-NE 2.73Å; D865-R867 PolarHBondContact OD2-NE 3.25Å; D865-R867 VanDerWaalsContact OD2-NE 3.15Å; D865-R867 IonicContact OD2-NH2 2.66Å; D865-R867 PolarHBondContact OD2-NH2 2.89Å; D865-S868 WeakPolarHBondContact O-CB 3.34Å; D865-S868 PolarHBondContact O-N 3.22Å
866	P	94.9	Very high	93.7	Very high	24 Å²	24	50 Å²	50	16%	0.156	29%	0.285	C	S	.	.	H	α-helix	trans	-56.9	-19.4	177.6	-26.9	35.9	0	0	0	114.4	L792 A793 V852 S868 G869 H870	L792-P866 HydrophobicContact CB-CB 4.49Å; L792-P866 HydrophobicContact CB-CG 4.16Å; A793-P866 HydrophobicContact CB-CB 4.46Å; A793-P866 WeakPolarHBondContact CB-O 3.41Å; V852-P866 HydrophobicContact CG1-CG 4.04Å; V852-P866 HydrophobicContact CG2-CG 3.74Å; P866-S868 VanDerWaalsContact C-N 3.29Å; P866-S868 PolarHBondContact O-N 3.3Å; P866-G869 PolarHBondContact O-N 2.94Å; P866-G869 VanDerWaalsContact O-N 3.14Å; P866-H870 PolarHBondContact O-CD2 2.7Å; P866-H870 PolarHBondContact O-N 3.31Å
867	R	96.4	Very high	94.2	Very high	125 Å²	125	42.5 Å²	42.5	47%	0.472	25%	0.245	S	C	.	.	H	α-helix	trans	-65.5	-35.3	175.4	-53.2	172.8	-63.6	176.7	5.9	111.4	D865 H870 A871	D865-R867 PolarHBondContact O-N 2.94Å; D865-R867 WeakPolarHBondContact OD1-CB 3.44Å; D865-R867 VanDerWaalsContact OD1-CG 3.24Å; D865-R867 WeakPolarHBondContact OD1-CG 3.4Å; D865-R867 IonicContact OD1-CZ 3.52Å; D865-R867 PolarHBondContact OD1-N 3.5Å; D865-R867 IonicContact OD1-NE 2.86Å; D865-R867 PolarHBondContact OD1-NE 2.94Å; D865-R867 IonicContact OD1-NH2 3.48Å; D865-R867 IonicContact OD2-CZ 3.47Å; D865-R867 IonicContact OD2-NE 2.73Å; D865-R867 PolarHBondContact OD2-NE 3.25Å; D865-R867 VanDerWaalsContact OD2-NE 3.15Å; D865-R867 IonicContact OD2-NH2 2.66Å; D865-R867 PolarHBondContact OD2-NH2 2.89Å; R867-H870 PolarHBondContact O-N 3.21Å; R867-A871 PolarHBondContact O-N 2.77Å
868	S	95.9	Very high	94.7	Very high	51 Å²	51	40.1 Å²	40.1	36%	0.357	22%	0.215	S	C	.	.	H	α-helix	trans	-64	-41.7	171.7	174.4	0	0	0	0	111	D865 P866 A871 L872	D865-S868 WeakPolarHBondContact O-CB 3.34Å; D865-S868 PolarHBondContact O-N 3.22Å; P866-S868 VanDerWaalsContact C-N 3.29Å; P866-S868 PolarHBondContact O-N 3.3Å; S868-A871 WeakPolarHBondContact O-CB 3.5Å; S868-A871 PolarHBondContact O-N 3.3Å; S868-L872 WeakPolarHBondContact O-CG 3.32Å; S868-L872 PolarHBondContact O-N 3.43Å
869	G	97.4	Very high	94.8	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-63.5	-44.3	174.5	0	0	0	0	0	113	N789 A793 P866 A871 L872 L873	N789-G869 WeakPolarHBondContact O-CA 3.1Å; A793-G869 VanDerWaalsContact CB-C 3.47Å; P866-G869 PolarHBondContact O-N 2.94Å; P866-G869 VanDerWaalsContact O-N 3.14Å; G869-A871 VanDerWaalsContact C-N 3.3Å; G869-A871 PolarHBondContact O-N 2.93Å; G869-L872 PolarHBondContact O-N 3.19Å; G869-L873 WeakPolarHBondContact O-CG 3.45Å; G869-L873 PolarHBondContact O-N 3.44Å
870	H	97.9	Very high	94.8	Very high	17 Å²	17	45.1 Å²	45.1	8%	0.079	23%	0.227	C	C	.	.	H	α-helix	trans	-62.3	-36	174.1	-68.4	-52.6	0	0	0	111.9	A793 P866 R867 L873 A874 H895 K898 A899	A793-H870 PolarHBondContact O-CE1 2.95Å; A793-H870 PolarHBondContact O-ND1 3.41Å; A793-H870 VanDerWaalsContact O-ND1 3.1Å; P866-H870 PolarHBondContact O-CD2 2.7Å; P866-H870 PolarHBondContact O-N 3.31Å; R867-H870 PolarHBondContact O-N 3.21Å; H870-L873 PolarHBondContact O-N 3.16Å; H870-A874 WeakPolarHBondContact O-CB 3.49Å; H870-A874 PolarHBondContact O-N 3.26Å; H870-H895 HydrophobicContact CB-CB 4.46Å; H870-H895 AromaticContact CE1-ND1 3.93Å; H870-H895 AromaticContact ND1-CE1 3.68Å; H870-H895 AromaticContact ND1-ND1 3.09Å; H870-H895 PolarHBondContact ND1-ND1 3.43Å; H870-K898 HydrophobicContact CB-CB 4.36Å; H870-K898 WeakPolarHBondContact CD2-CB 3.12Å; H870-A899 HydrophobicContact CB-CB 3.94Å
871	A	97.7	Very high	94.4	Very high	12 Å²	12	47.6 Å²	47.6	10%	0.099	23%	0.231	C	C	.	.	H	α-helix	trans	-63.6	-47.6	174.1	0	0	0	0	0	111.5	R867 S868 G869 L873 A874 F875 A899 I901	R867-A871 PolarHBondContact O-N 2.77Å; S868-A871 WeakPolarHBondContact O-CB 3.5Å; S868-A871 PolarHBondContact O-N 3.3Å; G869-A871 VanDerWaalsContact C-N 3.3Å; G869-A871 PolarHBondContact O-N 2.93Å; A871-L873 VanDerWaalsContact C-N 3.34Å; A871-L873 PolarHBondContact O-N 3.48Å; A871-A874 PolarHBondContact O-N 3.28Å; A871-F875 HydrophobicContact CB-CE2 4.2Å; A871-F875 WeakPolarHBondContact O-CD2 3.45Å; A871-F875 WeakPolarHBondContact O-CG 3.46Å; A871-F875 PolarHBondContact O-N 3.1Å; A871-A899 HydrophobicContact CB-CB 3.98Å; A871-I901 HydrophobicContact CB-CG2 3.82Å
872	L	97.3	Very high	93.9	Very high	22 Å²	22	47.5 Å²	47.5	12%	0.115	25%	0.245	C	C	.	.	H	α-helix	trans	-60.4	-41.3	177	-69.6	174	0	0	0	112.3	P786 V790 A806 S868 G869 F875 M876	P786-L872 HydrophobicContact CB-CD1 4.36Å; V790-L872 HydrophobicContact CG2-CB 3.8Å; V790-L872 HydrophobicContact CG2-CD1 3.69Å; V790-L872 HydrophobicContact CG2-CG 4.4Å; A806-L872 WeakPolarHBondContact O-CB 3.46Å; S868-L872 WeakPolarHBondContact O-CG 3.32Å; S868-L872 PolarHBondContact O-N 3.43Å; G869-L872 PolarHBondContact O-N 3.19Å; L872-F875 PolarHBondContact O-N 3.19Å; L872-M876 WeakPolarHBondContact O-CB 3.18Å; L872-M876 PolarHBondContact O-N 3.33Å
873	L	97.6	Very high	93.3	Very high	3 Å²	3	52.7 Å²	52.7	2%	0.016	27%	0.268	C	S	.	.	H	α-helix	trans	-68.3	-40.3	175	-69.4	168.6	0	0	0	112.6	V790 A793 L798 A806 G869 H870 A871 M876 F877	V790-L873 HydrophobicContact CG1-CD2 4.11Å; V790-L873 HydrophobicContact CG1-CG 4.37Å; A793-L873 HydrophobicContact CB-CD1 4.04Å; L798-L873 HydrophobicContact CD1-CD2 3.96Å; A806-L873 HydrophobicContact CB-CD2 4.05Å; G869-L873 WeakPolarHBondContact O-CG 3.45Å; G869-L873 PolarHBondContact O-N 3.44Å; H870-L873 PolarHBondContact O-N 3.16Å; A871-L873 VanDerWaalsContact C-N 3.34Å; A871-L873 PolarHBondContact O-N 3.48Å; L873-M876 HydrophobicContact CD2-CE 3.8Å; L873-M876 WeakPolarHBondContact O-CB 3.33Å; L873-M876 PolarHBondContact O-N 2.85Å; L873-F877 WeakPolarHBondContact O-CD2 3.41Å; L873-F877 PolarHBondContact O-N 3.42Å
874	A	97.3	Very high	93.1	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-62	-44	173.5	0	0	0	0	0	111.6	H870 A871 M876 F877 S878 L892 H895 I896 W920	H870-A874 WeakPolarHBondContact O-CB 3.49Å; H870-A874 PolarHBondContact O-N 3.26Å; A871-A874 PolarHBondContact O-N 3.28Å; A874-M876 VanDerWaalsContact C-N 3.31Å; A874-M876 PolarHBondContact O-N 2.81Å; A874-F877 PolarHBondContact O-N 3Å; A874-S878 PolarHBondContact O-N 3.1Å; A874-S878 PolarHBondContact O-OG 3.38Å; A874-L892 HydrophobicContact CB-CD1 3.91Å; A874-L892 WeakPolarHBondContact O-CD1 3.13Å; A874-H895 HydrophobicContact CB-CB 3.98Å; A874-I896 HydrophobicContact CB-CG1 4.05Å; A874-W920 HydrophobicContact CB-CH2 3.5Å; A874-W920 VanDerWaalsContact CB-CH2 3.5Å; A874-W920 HydrophobicContact CB-CZ2 3.63Å; A874-W920 HydrophobicContact CB-CZ3 4.38Å
875	F	96	Very high	92.8	Very high	68 Å²	68	52 Å²	52	30%	0.298	26%	0.263	S	S	.	.	H	α-helix	trans	-62.3	-37.3	172.9	-63.8	-48.4	0	0	0	112.3	A809 A871 L872 S878 R879 I901 W920	A809-F875 HydrophobicContact CB-CB 3.84Å; A809-F875 WeakPolarHBondContact O-CB 3.33Å; A871-F875 HydrophobicContact CB-CE2 4.2Å; A871-F875 WeakPolarHBondContact O-CD2 3.45Å; A871-F875 WeakPolarHBondContact O-CG 3.46Å; A871-F875 PolarHBondContact O-N 3.1Å; L872-F875 PolarHBondContact O-N 3.19Å; F875-S878 PolarHBondContact O-N 3.31Å; F875-R879 VanDerWaalsContact O-CB 3.26Å; F875-R879 WeakPolarHBondContact O-CB 3.4Å; F875-R879 WeakPolarHBondContact O-CG 3.43Å; F875-R879 PolarHBondContact O-N 2.88Å; F875-I901 HydrophobicContact CZ-CD1 4.32Å; F875-W920 HydrophobicContact CD1-CH2 4.09Å; F875-W920 AromaticContact CD1-CZ2 3.53Å; F875-W920 HydrophobicContact CD1-CZ2 3.53Å; F875-W920 AromaticContact CE1-CH2 3.82Å; F875-W920 HydrophobicContact CE1-CH2 3.82Å; F875-W920 AromaticContact CE1-CZ2 3.6Å; F875-W920 HydrophobicContact CE1-CZ2 3.6Å; F875-W920 HydrophobicContact CG-CZ2 4.39Å; F875-W920 HydrophobicContact CZ-CH2 4.33Å
876	M	95.3	Very high	92.6	Very high	29 Å²	29	53.9 Å²	53.9	14%	0.143	27%	0.267	C	S	.	.	H	α-helix	trans	-60.9	-45.8	177.1	-172.2	-173	63.3	0	0	111.9	R805 A806 A809 L872 L873 A874 Q880	R805-M876 HydrophobicContact CB-CG 4.2Å; R805-M876 HydrophobicContact CB-SD 4.2Å; A806-M876 HydrophobicContact CB-CB 4.43Å; A806-M876 HydrophobicContact CB-SD 3.93Å; A809-M876 HydrophobicContact CB-CB 4.1Å; L872-M876 WeakPolarHBondContact O-CB 3.18Å; L872-M876 PolarHBondContact O-N 3.33Å; L873-M876 HydrophobicContact CD2-CE 3.8Å; L873-M876 WeakPolarHBondContact O-CB 3.33Å; L873-M876 PolarHBondContact O-N 2.85Å; A874-M876 VanDerWaalsContact C-N 3.31Å; A874-M876 PolarHBondContact O-N 2.81Å; M876-Q880 PolarHBondContact O-N 2.95Å; M876-Q880 VanDerWaalsContact O-N 3.14Å
877	F	94.9	Very high	92.3	Very high	17 Å²	17	54.5 Å²	54.5	8%	0.075	27%	0.267	C	S	.	.	H	α-helix	trans	-67.1	-44.9	176	-76.8	-65.3	0	0	0	111.6	L873 A874 R879 Q880 L884 Q888 E891 L892 H895	L873-F877 WeakPolarHBondContact O-CD2 3.41Å; L873-F877 PolarHBondContact O-N 3.42Å; A874-F877 PolarHBondContact O-N 3Å; F877-R879 VanDerWaalsContact C-N 3.27Å; F877-R879 PolarHBondContact O-N 2.84Å; F877-Q880 WeakPolarHBondContact O-CB 3.22Å; F877-Q880 PolarHBondContact O-N 3.25Å; F877-L884 HydrophobicContact CB-CD1 4.01Å; F877-L884 HydrophobicContact CB-CD2 4.38Å; F877-L884 HydrophobicContact CD1-CD2 4.03Å; F877-Q888 HydrophobicContact CD1-CB 4.39Å; F877-Q888 HydrophobicContact CE1-CB 4.26Å; F877-Q888 HydrophobicContact CE1-CG 4.08Å; F877-E891 HydrophobicContact CE2-CG 3.76Å; F877-E891 HydrophobicContact CZ-CB 4.5Å; F877-E891 HydrophobicContact CZ-CG 3.87Å; F877-L892 HydrophobicContact CB-CB 4.23Å; F877-L892 HydrophobicContact CB-CD1 4.01Å; F877-H895 AromaticContact CE2-CD2 3.8Å
878	S	93.7	Very high	92.1	Very high	37 Å²	37	50.2 Å²	50.2	26%	0.259	25%	0.253	S	S	.	.	H	α-helix	trans	-68.3	-19.4	177.7	-66.7	0	0	0	0	115.1	A874 F875 W920 S924	A874-S878 PolarHBondContact O-N 3.1Å; A874-S878 PolarHBondContact O-OG 3.38Å; F875-S878 PolarHBondContact O-N 3.31Å; S878-W920 PolarHBondContact OG-NE1 3.23Å; S878-S924 WeakPolarHBondContact CB-OG 3.31Å; S878-S924 PolarHBondContact OG-OG 3.07Å
879	R	90.8	Very high	92	Very high	139 Å²	139	47.8 Å²	47.8	53%	0.525	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.9	9.3	176	-64.6	176.1	66.1	169.4	0.6	112.8	A809 S811 F875 F877	A809-R879 WeakPolarHBondContact O-CD 3.2Å; A809-R879 PolarHBondContact O-NH1 3.2Å; S811-R879 PolarHBondContact O-NH1 3.15Å; F875-R879 VanDerWaalsContact O-CB 3.26Å; F875-R879 WeakPolarHBondContact O-CB 3.4Å; F875-R879 WeakPolarHBondContact O-CG 3.43Å; F875-R879 PolarHBondContact O-N 2.88Å; F877-R879 VanDerWaalsContact C-N 3.27Å; F877-R879 PolarHBondContact O-N 2.84Å
880	Q	87.4	Confident	91.9	Very high	75 Å²	75	49.1 Å²	49.1	35%	0.35	24%	0.242	S	C	.	.	S	Bend	trans	-68.7	143	176.6	-158.9	-155.1	-95.3	0	0	110.3	M876 F877 L884	M876-Q880 PolarHBondContact O-N 2.95Å; M876-Q880 VanDerWaalsContact O-N 3.14Å; F877-Q880 WeakPolarHBondContact O-CB 3.22Å; F877-Q880 PolarHBondContact O-N 3.25Å; Q880-L884 HydrophobicContact CB-CD2 4.33Å
881	E	80.9	Confident	91.7	Very high	155 Å²	155	49.3 Å²	49.3	72%	0.724	24%	0.243	S	C	*	.	S	Bend	trans	-68.5	141.9	166.6	-67.2	-179.8	-179	0	0	111	L349	L349-E881 HydrophobicContact CD1-CB 4.11Å; L349-E881 WeakPolarHBondContact CD1-O 3.24Å
882	G	82.4	Confident	91.6	Very high	61 Å²	61	48.8 Å²	48.8	63%	0.629	24%	0.239	S	C	*	.	S	Bend	trans	76.9	168.1	-172.8	0	0	0	0	0	113.4
883	K	81.6	Confident	91.6	Very high	136 Å²	136	47.7 Å²	47.7	59%	0.591	23%	0.233	S	C	*	.	P	Polyproline II helix	trans	-84.7	143.3	179	-60.8	103.1	162	-73.2	0	110.9	D926	K883-D926 VanDerWaalsContact CD-OD2 3.27Å; K883-D926 WeakPolarHBondContact CD-OD2 3.49Å; K883-D926 WeakPolarHBondContact CG-OD1 3.48Å; K883-D926 WeakPolarHBondContact CG-OD2 3.41Å; K883-D926 IonicContact NZ-OD1 2.61Å; K883-D926 PolarHBondContact NZ-OD1 3.22Å; K883-D926 IonicContact NZ-OD2 2.7Å; K883-D926 PolarHBondContact NZ-OD2 3.21Å
884	L	90.6	Very high	91.5	Very high	9 Å²	9	49.4 Å²	49.4	5%	0.047	24%	0.241	C	C	.	.	B	Isolated β-bridge	trans	-67.5	139.7	-179.8	-62.7	-179	0	0	0	111.8	F877 Q880 Q888 L892 S924	F877-L884 HydrophobicContact CB-CD1 4.01Å; F877-L884 HydrophobicContact CB-CD2 4.38Å; F877-L884 HydrophobicContact CD1-CD2 4.03Å; Q880-L884 HydrophobicContact CB-CD2 4.33Å; L884-Q888 HydrophobicContact CB-CB 4.02Å; L884-Q888 HydrophobicContact CD2-CB 4.12Å; L884-L892 HydrophobicContact CD1-CB 4.26Å; L884-L892 HydrophobicContact CD1-CD2 3.63Å; L884-S924 WeakPolarHBondContact CD1-O 3.39Å; L884-S924 WeakPolarHBondContact CG-O 3.47Å
885	N	88.6	Confident	91.5	Very high	58 Å²	58	49.4 Å²	49.4	31%	0.31	24%	0.241	S	C	.	.	P	Polyproline II helix	trans	-74.9	172.2	173.4	73.9	53	0	0	0	112.2	Q887 Q888 T889	N885-Q887 VanDerWaalsContact C-N 3.3Å; N885-Q887 PolarHBondContact O-N 3.04Å; N885-Q887 WeakPolarHBondContact OD1-CA 3.42Å; N885-Q887 WeakPolarHBondContact OD1-CB 3.42Å; N885-Q887 PolarHBondContact OD1-N 3.41Å; N885-Q888 VanDerWaalsContact N-OE1 3.15Å; N885-Q888 PolarHBondContact ND2-OE1 2.8Å; N885-Q888 PolarHBondContact O-N 3.5Å; N885-Q888 PolarHBondContact OD1-N 3.3Å; N885-T889 WeakPolarHBondContact O-CB 3.43Å; N885-T889 PolarHBondContact O-N 2.68Å; N885-T889 PolarHBondContact O-OG1 3.04Å
886	R	89.3	Confident	91.6	Very high	94 Å²	94	46.2 Å²	46.2	36%	0.355	23%	0.227	S	C	.	.	H	α-helix	trans	-51.8	-45.4	-178.4	-61.1	175.7	-174.6	173.3	0.6	112.4	E366 M890 A930 A931	E366-R886 WeakPolarHBondContact OE2-CD 3.31Å; E366-R886 IonicContact OE2-CZ 3.87Å; E366-R886 IonicContact OE2-NE 3.82Å; E366-R886 IonicContact OE2-NH1 3.3Å; E366-R886 PolarHBondContact OE2-NH1 2.99Å; R886-M890 PolarHBondContact O-N 3.19Å; R886-A930 WeakPolarHBondContact CD-O 3.48Å; R886-A930 HydrophobicContact CG-CB 4.03Å; R886-A930 WeakPolarHBondContact CG-O 3.25Å; R886-A931 WeakPolarHBondContact O-CB 3.39Å
887	Q	88.8	Confident	91.6	Very high	36 Å²	36	46.8 Å²	46.8	17%	0.168	23%	0.23	C	C	.	.	H	α-helix	trans	-72.9	-44	-179.9	-171.2	-177.3	-13.5	0	0	112.3	S362 Y542 N885 T889 M890 E891	S362-Q887 VanDerWaalsContact C-OE1 3.3Å; S362-Q887 VanDerWaalsContact CB-OE1 3.26Å; S362-Q887 VanDerWaalsContact OG-CD 3.29Å; S362-Q887 PolarHBondContact OG-NE2 3.17Å; S362-Q887 PolarHBondContact OG-OE1 3.36Å; Y542-Q887 PolarHBondContact OH-NE2 2.89Å; N885-Q887 VanDerWaalsContact C-N 3.3Å; N885-Q887 PolarHBondContact O-N 3.04Å; N885-Q887 WeakPolarHBondContact OD1-CA 3.42Å; N885-Q887 WeakPolarHBondContact OD1-CB 3.42Å; N885-Q887 PolarHBondContact OD1-N 3.41Å; Q887-T889 PolarHBondContact O-N 3.22Å; Q887-M890 WeakPolarHBondContact O-CB 3.35Å; Q887-M890 PolarHBondContact O-N 3.23Å; Q887-M890 VanDerWaalsContact O-N 3.1Å; Q887-E891 PolarHBondContact O-N 3.4Å
888	Q	92.4	Very high	91.7	Very high	36 Å²	36	51 Å²	51	17%	0.168	25%	0.249	C	C	.	.	H	α-helix	trans	-61.2	-31.7	175.8	-69.7	179	-64.3	0	0	112.1	F877 L884 N885 E891 L892	F877-Q888 HydrophobicContact CD1-CB 4.39Å; F877-Q888 HydrophobicContact CE1-CB 4.26Å; F877-Q888 HydrophobicContact CE1-CG 4.08Å; L884-Q888 HydrophobicContact CB-CB 4.02Å; L884-Q888 HydrophobicContact CD2-CB 4.12Å; N885-Q888 VanDerWaalsContact N-OE1 3.15Å; N885-Q888 PolarHBondContact ND2-OE1 2.8Å; N885-Q888 PolarHBondContact O-N 3.5Å; N885-Q888 PolarHBondContact OD1-N 3.3Å; Q888-E891 PolarHBondContact O-N 2.95Å; Q888-L892 WeakPolarHBondContact O-CB 3.34Å; Q888-L892 PolarHBondContact O-N 2.58Å
889	T	94.8	Very high	91.8	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-66.8	-39.8	174.6	-57.5	0	0	0	0	111.4	N885 Q887 G893 V921 T925 L928 A931 L949	N885-T889 WeakPolarHBondContact O-CB 3.43Å; N885-T889 PolarHBondContact O-N 2.68Å; N885-T889 PolarHBondContact O-OG1 3.04Å; Q887-T889 PolarHBondContact O-N 3.22Å; T889-G893 PolarHBondContact O-N 3.26Å; T889-V921 HydrophobicContact CG2-CG2 4.42Å; T889-T925 HydrophobicContact CG2-CG2 3.81Å; T889-T925 PolarHBondContact OG1-OG1 3.49Å; T889-L928 HydrophobicContact CG2-CD2 4.25Å; T889-A931 HydrophobicContact CG2-CB 3.52Å; T889-L949 HydrophobicContact CG2-CD2 3.93Å
890	M	94	Very high	92	Very high	28 Å²	28	47.5 Å²	47.5	14%	0.138	24%	0.235	C	C	.	.	H	α-helix	trans	-64.9	-40.1	172.6	-66.1	-64.7	-65.9	0	0	112.1	R886 Q887 G893 H894 A931 N937 N942 V945 L949	R886-M890 PolarHBondContact O-N 3.19Å; Q887-M890 WeakPolarHBondContact O-CB 3.35Å; Q887-M890 PolarHBondContact O-N 3.23Å; Q887-M890 VanDerWaalsContact O-N 3.1Å; M890-G893 PolarHBondContact O-N 3.21Å; M890-H894 PolarHBondContact O-N 2.8Å; M890-A931 HydrophobicContact CG-CB 4.42Å; M890-A931 HydrophobicContact SD-CB 4.38Å; M890-N937 HydrophobicContact CE-CB 3.94Å; M890-N937 VanDerWaalsContact CE-OD1 3.24Å; M890-N937 WeakPolarHBondContact CE-OD1 3.38Å; M890-N942 HydrophobicContact CE-CB 4.19Å; M890-V945 HydrophobicContact CE-CB 4.1Å; M890-V945 HydrophobicContact CE-CG1 3.64Å; M890-V945 HydrophobicContact SD-CG1 3.8Å; M890-L949 HydrophobicContact SD-CD1 3.55Å; M890-L949 VanDerWaalsContact SD-CD1 3.55Å
891	E	94.7	Very high	92.2	Very high	21 Å²	21	46.7 Å²	46.7	10%	0.098	23%	0.232	C	C	.	.	H	α-helix	trans	-69.4	-42.5	178.8	-176.8	164.3	-158	0	0	112.6	L795 F877 Q887 Q888 G893 H894 H895	L795-E891 HydrophobicContact CD1-CG 3.97Å; F877-E891 HydrophobicContact CE2-CG 3.76Å; F877-E891 HydrophobicContact CZ-CB 4.5Å; F877-E891 HydrophobicContact CZ-CG 3.87Å; Q887-E891 PolarHBondContact O-N 3.4Å; Q888-E891 PolarHBondContact O-N 2.95Å; E891-G893 VanDerWaalsContact C-N 3.31Å; E891-G893 PolarHBondContact O-N 3.46Å; E891-H894 WeakPolarHBondContact O-CB 3.33Å; E891-H894 PolarHBondContact O-N 2.84Å; E891-H895 PolarHBondContact O-CD2 3.1Å; E891-H895 PolarHBondContact O-N 3.5Å
892	L	96.2	Very high	92.7	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-56.4	-46.6	168.4	173.4	61.7	0	0	0	110.7	A874 F877 L884 Q888 H894 H895 I896 V921	A874-L892 HydrophobicContact CB-CD1 3.91Å; A874-L892 WeakPolarHBondContact O-CD1 3.13Å; F877-L892 HydrophobicContact CB-CB 4.23Å; F877-L892 HydrophobicContact CB-CD1 4.01Å; L884-L892 HydrophobicContact CD1-CB 4.26Å; L884-L892 HydrophobicContact CD1-CD2 3.63Å; Q888-L892 WeakPolarHBondContact O-CB 3.34Å; Q888-L892 PolarHBondContact O-N 2.58Å; L892-H894 VanDerWaalsContact C-N 3.34Å; L892-H894 PolarHBondContact O-N 3.32Å; L892-H895 PolarHBondContact O-N 3.09Å; L892-I896 HydrophobicContact CD1-CD1 3.66Å; L892-I896 HydrophobicContact CD1-CG1 3.78Å; L892-I896 HydrophobicContact CD2-CD1 4.28Å; L892-I896 HydrophobicContact CG-CD1 3.7Å; L892-I896 HydrophobicContact CG-CG1 4.21Å; L892-I896 WeakPolarHBondContact O-CB 3.37Å; L892-I896 VanDerWaalsContact O-CG1 3.31Å; L892-I896 WeakPolarHBondContact O-CG1 3.42Å; L892-I896 PolarHBondContact O-N 3.47Å; L892-V921 HydrophobicContact CD2-CG2 4.21Å; L892-V921 HydrophobicContact CG-CG2 4.43Å
893	G	96.6	Very high	92.9	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-57.4	-43.7	175.9	0	0	0	0	0	113	T889 M890 E891 L897	T889-G893 PolarHBondContact O-N 3.26Å; M890-G893 PolarHBondContact O-N 3.21Å; E891-G893 VanDerWaalsContact C-N 3.31Å; E891-G893 PolarHBondContact O-N 3.46Å; G893-L897 VanDerWaalsContact O-CG 3.31Å; G893-L897 WeakPolarHBondContact O-CG 3.42Å; G893-L897 PolarHBondContact O-N 2.87Å; G893-L897 VanDerWaalsContact O-N 3.15Å
894	H	95.7	Very high	93	Very high	38 Å²	38	42.4 Å²	42.4	18%	0.176	21%	0.211	C	C	.	.	H	α-helix	trans	-58.2	-49	174	177.8	112.7	0	0	0	111.4	M890 E891 L892 L897 K898 V945	M890-H894 PolarHBondContact O-N 2.8Å; E891-H894 WeakPolarHBondContact O-CB 3.33Å; E891-H894 PolarHBondContact O-N 2.84Å; L892-H894 VanDerWaalsContact C-N 3.34Å; L892-H894 PolarHBondContact O-N 3.32Å; H894-L897 PolarHBondContact O-N 2.79Å; H894-K898 PolarHBondContact O-N 2.89Å; H894-V945 HydrophobicContact CB-CG2 4.32Å
895	H	97.6	Very high	92.7	Very high	1 Å²	1	45 Å²	45	1%	0.005	22%	0.224	C	C	.	.	H	α-helix	trans	-67.2	-42.3	-178.7	-69.8	-32.8	0	0	0	112.7	A793 H870 A874 F877 E891 L892 L897 K898 A899	A793-H895 PolarHBondContact O-CE1 3Å; H870-H895 HydrophobicContact CB-CB 4.46Å; H870-H895 AromaticContact CE1-ND1 3.93Å; H870-H895 AromaticContact ND1-CE1 3.68Å; H870-H895 AromaticContact ND1-ND1 3.09Å; H870-H895 PolarHBondContact ND1-ND1 3.43Å; A874-H895 HydrophobicContact CB-CB 3.98Å; F877-H895 AromaticContact CE2-CD2 3.8Å; E891-H895 PolarHBondContact O-CD2 3.1Å; E891-H895 PolarHBondContact O-N 3.5Å; L892-H895 PolarHBondContact O-N 3.09Å; H895-L897 VanDerWaalsContact C-N 3.26Å; H895-L897 PolarHBondContact O-N 2.95Å; H895-K898 PolarHBondContact O-N 3.13Å; H895-A899 WeakPolarHBondContact O-CB 3.49Å; H895-A899 PolarHBondContact O-N 3.38Å
896	I	97.3	Very high	92.6	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-57.5	-39.1	175.2	-72.8	177.8	0	0	0	111.6	A874 L892 Q917 W920 V921 L948	A874-I896 HydrophobicContact CB-CG1 4.05Å; L892-I896 HydrophobicContact CD1-CD1 3.66Å; L892-I896 HydrophobicContact CD1-CG1 3.78Å; L892-I896 HydrophobicContact CD2-CD1 4.28Å; L892-I896 HydrophobicContact CG-CD1 3.7Å; L892-I896 HydrophobicContact CG-CG1 4.21Å; L892-I896 WeakPolarHBondContact O-CB 3.37Å; L892-I896 VanDerWaalsContact O-CG1 3.31Å; L892-I896 WeakPolarHBondContact O-CG1 3.42Å; L892-I896 PolarHBondContact O-N 3.47Å; I896-Q917 HydrophobicContact CG2-CB 3.61Å; I896-Q917 HydrophobicContact CG2-CG 3.6Å; I896-Q917 PolarHBondContact O-NE2 3.38Å; I896-W920 HydrophobicContact CB-CE3 4.31Å; I896-W920 HydrophobicContact CB-CZ3 4.37Å; I896-W920 HydrophobicContact CD1-CB 4.28Å; I896-W920 HydrophobicContact CD1-CD2 3.71Å; I896-W920 HydrophobicContact CD1-CE3 3.86Å; I896-W920 HydrophobicContact CD1-CG 3.9Å; I896-W920 HydrophobicContact CD1-CZ3 4.48Å; I896-W920 HydrophobicContact CG1-CD2 3.91Å; I896-W920 HydrophobicContact CG1-CE3 3.62Å; I896-W920 HydrophobicContact CG1-CH2 4.16Å; I896-W920 HydrophobicContact CG1-CZ2 4.38Å; I896-W920 HydrophobicContact CG1-CZ3 3.76Å; I896-W920 HydrophobicContact CG2-CE3 3.93Å; I896-W920 HydrophobicContact CG2-CZ3 4.29Å; I896-V921 HydrophobicContact CD1-CB 3.92Å; I896-V921 HydrophobicContact CD1-CG2 4.49Å; I896-L948 HydrophobicContact CB-CD2 4.34Å; I896-L948 HydrophobicContact CG2-CD2 4.05Å
897	L	96.4	Very high	92.4	Very high	42 Å²	42	47 Å²	47	22%	0.22	24%	0.238	C	C	.	.	H	α-helix	trans	-70.2	-51	177.2	-69.2	172.5	0	0	0	111.8	G893 H894 H895 A899 H900 K944 V945 L948	G893-L897 VanDerWaalsContact O-CG 3.31Å; G893-L897 WeakPolarHBondContact O-CG 3.42Å; G893-L897 PolarHBondContact O-N 2.87Å; G893-L897 VanDerWaalsContact O-N 3.15Å; H894-L897 PolarHBondContact O-N 2.79Å; H895-L897 VanDerWaalsContact C-N 3.26Å; H895-L897 PolarHBondContact O-N 2.95Å; L897-A899 PolarHBondContact O-N 2.65Å; L897-H900 PolarHBondContact O-N 3.07Å; L897-H900 PolarHBondContact O-ND1 2.89Å; L897-K944 HydrophobicContact CD1-CB 4.02Å; L897-V945 HydrophobicContact CD1-CG2 3.88Å; L897-L948 HydrophobicContact CD1-CB 4.47Å; L897-L948 HydrophobicContact CD1-CD2 4.27Å; L897-L948 HydrophobicContact CD2-CB 4.42Å; L897-L948 HydrophobicContact CD2-CD2 4.05Å; L897-L948 HydrophobicContact CG-CD2 3.84Å
898	K	96.1	Very high	92.3	Very high	105 Å²	105	53.9 Å²	53.9	46%	0.457	27%	0.267	S	S	.	.	H	α-helix	trans	-72.1	-23.7	-177.6	-69.4	-136.7	-178.6	-178.5	0	114.6	H870 H894 H895 H900	H870-K898 HydrophobicContact CB-CB 4.36Å; H870-K898 WeakPolarHBondContact CD2-CB 3.12Å; H894-K898 PolarHBondContact O-N 2.89Å; H895-K898 PolarHBondContact O-N 3.13Å; K898-H900 VanDerWaalsContact C-N 3.28Å; K898-H900 PolarHBondContact O-CD2 3.24Å; K898-H900 VanDerWaalsContact O-CD2 3.22Å; K898-H900 PolarHBondContact O-N 2.7Å
899	A	96.4	Very high	92	Very high	7 Å²	7	55.5 Å²	55.5	6%	0.058	28%	0.28	C	S	.	.	H	α-helix	trans	-69.4	-24.5	177.8	0	0	0	0	0	113.4	H870 A871 H895 L897 I901	H870-A899 HydrophobicContact CB-CB 3.94Å; A871-A899 HydrophobicContact CB-CB 3.98Å; H895-A899 WeakPolarHBondContact O-CB 3.49Å; H895-A899 PolarHBondContact O-N 3.38Å; L897-A899 PolarHBondContact O-N 2.65Å; A899-I901 HydrophobicContact CB-CG2 3.86Å; A899-I901 PolarHBondContact O-N 2.98Å
900	H	93.8	Very high	91.8	Very high	96 Å²	96	59 Å²	59	44%	0.444	32%	0.316	S	S	.	.			trans	52.4	21.1	178.6	-65.5	-64.7	0	0	0	116.2	L897 K898 F902 K903	L897-H900 PolarHBondContact O-N 3.07Å; L897-H900 PolarHBondContact O-ND1 2.89Å; K898-H900 VanDerWaalsContact C-N 3.28Å; K898-H900 PolarHBondContact O-CD2 3.24Å; K898-H900 VanDerWaalsContact O-CD2 3.22Å; K898-H900 PolarHBondContact O-N 2.7Å; H900-F902 PolarHBondContact O-N 3Å; H900-K903 HydrophobicContact CB-CB 4.38Å; H900-K903 VanDerWaalsContact O-CB 3.26Å; H900-K903 WeakPolarHBondContact O-CB 3.48Å; H900-K903 PolarHBondContact O-N 2.95Å
901	I	92.3	Very high	91.6	Very high	57 Å²	57	60.2 Å²	60.2	29%	0.292	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-25.9	-168.3	72.2	167	0	0	0	114.8	A871 F875 A899 W920	A871-I901 HydrophobicContact CB-CG2 3.82Å; F875-I901 HydrophobicContact CZ-CD1 4.32Å; A899-I901 HydrophobicContact CB-CG2 3.86Å; A899-I901 PolarHBondContact O-N 2.98Å; I901-W920 HydrophobicContact CD1-CE3 3.96Å; I901-W920 HydrophobicContact CD1-CH2 3.77Å; I901-W920 HydrophobicContact CD1-CZ3 3.3Å; I901-W920 HydrophobicContact CG1-CZ3 3.88Å
902	F	90.6	Very high	91.5	Very high	37 Å²	37	61.5 Å²	61.5	16%	0.162	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.5	4.9	178.9	-56.2	-69.8	0	0	0	114.2	H900 G904 L905 S913 L916 Q917 W920	H900-F902 PolarHBondContact O-N 3Å; F902-G904 PolarHBondContact O-N 3.42Å; F902-L905 HydrophobicContact CD1-CD1 4.18Å; F902-L905 PolarHBondContact O-N 3.26Å; F902-S913 PolarHBondContact O-OG 3.09Å; F902-L916 HydrophobicContact CB-CD1 4.25Å; F902-L916 HydrophobicContact CD1-CB 3.82Å; F902-L916 HydrophobicContact CD1-CD1 3.57Å; F902-L916 HydrophobicContact CD1-CG 4.3Å; F902-L916 HydrophobicContact CD2-CB 3.84Å; F902-L916 HydrophobicContact CE1-CB 3.87Å; F902-L916 HydrophobicContact CE1-CD1 4.1Å; F902-L916 HydrophobicContact CE1-CG 4.49Å; F902-L916 HydrophobicContact CE2-CB 3.84Å; F902-L916 HydrophobicContact CG-CB 3.81Å; F902-L916 HydrophobicContact CG-CD1 4Å; F902-L916 HydrophobicContact CZ-CB 3.87Å; F902-Q917 HydrophobicContact CD2-CG 3.67Å; F902-Q917 HydrophobicContact CE2-CG 4.07Å; F902-W920 AromaticContact CE2-CE3 3.83Å; F902-W920 HydrophobicContact CE2-CE3 3.83Å; F902-W920 HydrophobicContact CE2-CZ3 4.41Å; F902-W920 HydrophobicContact CZ-CE3 4.26Å
903	K	87.8	Confident	91.3	Very high	169 Å²	169	63 Å²	63	74%	0.735	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	121.7	179.3	-173.9	171.5	-177.2	173	0	110	H900 L905	H900-K903 HydrophobicContact CB-CB 4.38Å; H900-K903 VanDerWaalsContact O-CB 3.26Å; H900-K903 WeakPolarHBondContact O-CB 3.48Å; H900-K903 PolarHBondContact O-N 2.95Å; K903-L905 VanDerWaalsContact C-N 3.27Å; K903-L905 PolarHBondContact O-N 3.44Å
904	G	83.6	Confident	91.1	Very high	57 Å²	57	65.6 Å²	65.6	59%	0.588	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.7	-4.3	-177.1	0	0	0	0	0	115.6	F902	F902-G904 PolarHBondContact O-N 3.42Å
905	L	85	Confident	91	Very high	62 Å²	62	66.9 Å²	66.9	33%	0.325	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-20.3	177.3	-63.2	-170.4	0	0	0	113.6	F902 K903 K907 K908 T909	F902-L905 HydrophobicContact CD1-CD1 4.18Å; F902-L905 PolarHBondContact O-N 3.26Å; K903-L905 VanDerWaalsContact C-N 3.27Å; K903-L905 PolarHBondContact O-N 3.44Å; L905-K907 PolarHBondContact O-N 3.07Å; L905-K907 VanDerWaalsContact O-N 3.13Å; L905-K908 HydrophobicContact CD2-CD 4.26Å; L905-K908 WeakPolarHBondContact O-CA 3.44Å; L905-K908 WeakPolarHBondContact O-CB 3.19Å; L905-K908 PolarHBondContact O-N 2.93Å; L905-T909 PolarHBondContact O-N 3.27Å; L905-T909 PolarHBondContact O-OG1 3.47Å
906	S	85.7	Confident	90.8	Very high	44 Å²	44	68.1 Å²	68.1	31%	0.308	38%	0.382	S	S	.	.	H	α-helix	trans	-54.5	-34.7	-178.9	-172	0	0	0	0	114.1	K908 G910 V911 S912	S906-K908 VanDerWaalsContact C-N 3.26Å; S906-K908 PolarHBondContact O-N 3.03Å; S906-G910 WeakPolarHBondContact O-CA 3.24Å; S906-G910 PolarHBondContact O-N 3.06Å; S906-V911 WeakPolarHBondContact CA-O 3.39Å; S906-V911 PolarHBondContact OG-O 2.99Å; S906-S912 WeakPolarHBondContact OG-CA 3.45Å
907	K	84.5	Confident	90.7	Very high	152 Å²	152	69.2 Å²	69.2	66%	0.661	39%	0.387	S	S	*	.	H	α-helix	trans	-71.5	-16.5	176.1	-72.7	-179.6	173.5	-68.5	0	113.8	E257 L905	E257-K907 VanDerWaalsContact OE1-CE 3.24Å; E257-K907 WeakPolarHBondContact OE1-CE 3.25Å; E257-K907 IonicContact OE1-NZ 3.85Å; E257-K907 PolarHBondContact OE1-NZ 3.26Å; E257-K907 IonicContact OE2-NZ 2.68Å; E257-K907 PolarHBondContact OE2-NZ 3.07Å; L905-K907 PolarHBondContact O-N 3.07Å; L905-K907 VanDerWaalsContact O-N 3.13Å
908	K	87.1	Confident	90.6	Very high	179 Å²	179	67.4 Å²	67.4	78%	0.778	38%	0.378	S	S	*	.	H	α-helix	trans	-99.2	-32.6	178.7	-60.7	-175.7	178.9	-178	0	112.6	L905 S906	L905-K908 HydrophobicContact CD2-CD 4.26Å; L905-K908 WeakPolarHBondContact O-CA 3.44Å; L905-K908 WeakPolarHBondContact O-CB 3.19Å; L905-K908 PolarHBondContact O-N 2.93Å; S906-K908 VanDerWaalsContact C-N 3.26Å; S906-K908 PolarHBondContact O-N 3.03Å
909	T	86.3	Confident	90.5	Very high	71 Å²	71	67.1 Å²	67.1	44%	0.436	38%	0.379	S	S	.	.	H	α-helix	trans	-93.9	-21.1	-177.7	53.7	0	0	0	0	113.5	L905 V911 L916	L905-T909 PolarHBondContact O-N 3.27Å; L905-T909 PolarHBondContact O-OG1 3.47Å; T909-V911 PolarHBondContact O-N 2.78Å; T909-V911 PolarHBondContact OG1-N 2.73Å; T909-V911 PolarHBondContact OG1-O 3.08Å; T909-L916 HydrophobicContact CG2-CD1 4.35Å
910	G	89.9	Confident	90.3	Very high	74 Å²	74	68.6 Å²	68.6	76%	0.763	38%	0.383	S	S	*	.	S	Bend	trans	71.1	-0	-166.3	0	0	0	0	0	113.9	S906	S906-G910 WeakPolarHBondContact O-CA 3.24Å; S906-G910 PolarHBondContact O-N 3.06Å
911	V	91.3	Very high	90.3	Very high	53 Å²	53	64 Å²	64	32%	0.321	36%	0.362	S	S	.	.	S	Bend	trans	-117.7	129.2	-175.3	-177.5	0	0	0	0	109.4	S906 T909 V915 L916	S906-V911 WeakPolarHBondContact CA-O 3.39Å; S906-V911 PolarHBondContact OG-O 2.99Å; T909-V911 PolarHBondContact O-N 2.78Å; T909-V911 PolarHBondContact OG1-N 2.73Å; T909-V911 PolarHBondContact OG1-O 3.08Å; V911-V915 HydrophobicContact CG1-CB 3.84Å; V911-V915 HydrophobicContact CG1-CG1 3.62Å; V911-L916 HydrophobicContact CB-CD2 4.14Å; V911-L916 HydrophobicContact CB-CG 4.34Å; V911-L916 HydrophobicContact CG1-CD2 3.81Å; V911-L916 HydrophobicContact CG1-CG 3.94Å
912	S	91.9	Very high	90.3	Very high	47 Å²	47	65.2 Å²	65.2	33%	0.329	37%	0.369	S	S	.	.			trans	-61.5	148.4	-177.7	67.4	0	0	0	0	112.8	S906 S914 V915 L916	S906-S912 WeakPolarHBondContact OG-CA 3.45Å; S912-S914 PolarHBondContact O-N 2.79Å; S912-S914 PolarHBondContact OG-OG 2.73Å; S912-V915 PolarHBondContact O-N 3.03Å; S912-V915 VanDerWaalsContact O-N 3.12Å; S912-V915 WeakPolarHBondContact OG-CG2 3.44Å; S912-V915 PolarHBondContact OG-N 2.82Å; S912-L916 PolarHBondContact O-N 2.99Å; S912-L916 VanDerWaalsContact O-N 3.12Å
913	S	92.5	Very high	90.3	Very high	32 Å²	32	68.9 Å²	68.9	22%	0.224	40%	0.398	C	S	.	.	H	α-helix	trans	-57.4	-35.3	180	-54.2	0	0	0	0	112.3	F902 L916 Q917	F902-S913 PolarHBondContact O-OG 3.09Å; S913-L916 PolarHBondContact O-N 3.3Å; S913-Q917 VanDerWaalsContact O-CG 3.25Å; S913-Q917 WeakPolarHBondContact O-CG 3.49Å; S913-Q917 PolarHBondContact O-N 3.01Å; S913-Q917 PolarHBondContact O-OE1 3.37Å
914	S	91.7	Very high	90.4	Very high	54 Å²	54	61.6 Å²	61.6	38%	0.378	37%	0.369	S	S	.	.	H	α-helix	trans	-65.8	-40.3	177	49.1	0	0	0	0	113	S912 Q917 A918	S912-S914 PolarHBondContact O-N 2.79Å; S912-S914 PolarHBondContact OG-OG 2.73Å; S914-Q917 PolarHBondContact O-N 2.83Å; S914-A918 VanDerWaalsContact O-CB 3.22Å; S914-A918 WeakPolarHBondContact O-CB 3.27Å; S914-A918 PolarHBondContact O-N 2.79Å
915	V	92.8	Very high	90.6	Very high	65 Å²	65	59.8 Å²	59.8	39%	0.394	35%	0.346	S	S	.	.	H	α-helix	trans	-67.7	-38.4	175.6	171.8	0	0	0	0	111.1	V911 S912 A918 M919	V911-V915 HydrophobicContact CG1-CB 3.84Å; V911-V915 HydrophobicContact CG1-CG1 3.62Å; S912-V915 PolarHBondContact O-N 3.03Å; S912-V915 VanDerWaalsContact O-N 3.12Å; S912-V915 WeakPolarHBondContact OG-CG2 3.44Å; S912-V915 PolarHBondContact OG-N 2.82Å; V915-A918 PolarHBondContact O-N 2.61Å; V915-M919 HydrophobicContact CG1-CE 4.24Å; V915-M919 WeakPolarHBondContact O-CG 3.36Å; V915-M919 PolarHBondContact O-N 2.92Å
916	L	93.3	Very high	90.4	Very high	27 Å²	27	62.1 Å²	62.1	14%	0.141	36%	0.359	C	S	.	.	H	α-helix	trans	-65.1	-40.7	174.6	-63.3	175.3	0	0	0	112.2	F902 T909 V911 S912 S913 M919 W920	F902-L916 HydrophobicContact CB-CD1 4.25Å; F902-L916 HydrophobicContact CD1-CB 3.82Å; F902-L916 HydrophobicContact CD1-CD1 3.57Å; F902-L916 HydrophobicContact CD1-CG 4.3Å; F902-L916 HydrophobicContact CD2-CB 3.84Å; F902-L916 HydrophobicContact CE1-CB 3.87Å; F902-L916 HydrophobicContact CE1-CD1 4.1Å; F902-L916 HydrophobicContact CE1-CG 4.49Å; F902-L916 HydrophobicContact CE2-CB 3.84Å; F902-L916 HydrophobicContact CG-CB 3.81Å; F902-L916 HydrophobicContact CG-CD1 4Å; F902-L916 HydrophobicContact CZ-CB 3.87Å; T909-L916 HydrophobicContact CG2-CD1 4.35Å; V911-L916 HydrophobicContact CB-CD2 4.14Å; V911-L916 HydrophobicContact CB-CG 4.34Å; V911-L916 HydrophobicContact CG1-CD2 3.81Å; V911-L916 HydrophobicContact CG1-CG 3.94Å; S912-L916 PolarHBondContact O-N 2.99Å; S912-L916 VanDerWaalsContact O-N 3.12Å; S913-L916 PolarHBondContact O-N 3.3Å; L916-M919 HydrophobicContact CD2-CE 3.81Å; L916-W920 WeakPolarHBondContact O-CB 3.44Å; L916-W920 PolarHBondContact O-N 3.28Å; L916-W920 VanDerWaalsContact O-N 3.16Å
917	Q	95.6	Very high	90.6	Very high	24 Å²	24	61.7 Å²	61.7	11%	0.112	36%	0.356	C	S	.	.	H	α-helix	trans	-64.5	-42.3	173.4	-70	172.9	-58.3	0	0	111.7	I896 F902 S913 S914 W920 V921 L948	I896-Q917 HydrophobicContact CG2-CB 3.61Å; I896-Q917 HydrophobicContact CG2-CG 3.6Å; I896-Q917 PolarHBondContact O-NE2 3.38Å; F902-Q917 HydrophobicContact CD2-CG 3.67Å; F902-Q917 HydrophobicContact CE2-CG 4.07Å; S913-Q917 VanDerWaalsContact O-CG 3.25Å; S913-Q917 WeakPolarHBondContact O-CG 3.49Å; S913-Q917 PolarHBondContact O-N 3.01Å; S913-Q917 PolarHBondContact O-OE1 3.37Å; S914-Q917 PolarHBondContact O-N 2.83Å; Q917-W920 PolarHBondContact O-N 3.4Å; Q917-V921 PolarHBondContact O-N 2.98Å; Q917-L948 HydrophobicContact CB-CD1 3.62Å
918	A	94.8	Very high	91.1	Very high	3 Å²	3	54.7 Å²	54.7	3%	0.025	33%	0.325	C	S	.	.	H	α-helix	trans	-63	-45.1	179.8	0	0	0	0	0	112.7	S914 V915 V921 N922 L948 H951	S914-A918 VanDerWaalsContact O-CB 3.22Å; S914-A918 WeakPolarHBondContact O-CB 3.27Å; S914-A918 PolarHBondContact O-N 2.79Å; V915-A918 PolarHBondContact O-N 2.61Å; A918-V921 WeakPolarHBondContact O-CG1 3.47Å; A918-N922 WeakPolarHBondContact O-CB 3.48Å; A918-N922 PolarHBondContact O-N 3.02Å; A918-N922 VanDerWaalsContact O-N 3.13Å; A918-L948 HydrophobicContact CB-CD1 4.27Å; A918-H951 HydrophobicContact CB-CB 3.77Å
919	M	93	Very high	91.4	Very high	100 Å²	100	46.9 Å²	46.9	49%	0.493	29%	0.293	S	S	.	.	H	α-helix	trans	-63.2	-41.1	173.6	-69.6	-171	-61.2	0	0	111.7	V915 L916 N922 C923	V915-M919 HydrophobicContact CG1-CE 4.24Å; V915-M919 WeakPolarHBondContact O-CG 3.36Å; V915-M919 PolarHBondContact O-N 2.92Å; L916-M919 HydrophobicContact CD2-CE 3.81Å; M919-N922 PolarHBondContact O-N 3.3Å; M919-C923 PolarHBondContact O-N 3.13Å; M919-C923 PolarHBondContact O-SG 3.13Å
920	W	93.4	Very high	91.7	Very high	37 Å²	37	44 Å²	44	14%	0.14	28%	0.277	C	S	.	.	H	α-helix	trans	-62.2	-45.7	-180	-176.1	13.4	0	0	0	112.6	A874 F875 S878 I896 I901 F902 L916 Q917 C923 S924	A874-W920 HydrophobicContact CB-CH2 3.5Å; A874-W920 VanDerWaalsContact CB-CH2 3.5Å; A874-W920 HydrophobicContact CB-CZ2 3.63Å; A874-W920 HydrophobicContact CB-CZ3 4.38Å; F875-W920 HydrophobicContact CD1-CH2 4.09Å; F875-W920 AromaticContact CD1-CZ2 3.53Å; F875-W920 HydrophobicContact CD1-CZ2 3.53Å; F875-W920 AromaticContact CE1-CH2 3.82Å; F875-W920 HydrophobicContact CE1-CH2 3.82Å; F875-W920 AromaticContact CE1-CZ2 3.6Å; F875-W920 HydrophobicContact CE1-CZ2 3.6Å; F875-W920 HydrophobicContact CG-CZ2 4.39Å; F875-W920 HydrophobicContact CZ-CH2 4.33Å; S878-W920 PolarHBondContact OG-NE1 3.23Å; I896-W920 HydrophobicContact CB-CE3 4.31Å; I896-W920 HydrophobicContact CB-CZ3 4.37Å; I896-W920 HydrophobicContact CD1-CB 4.28Å; I896-W920 HydrophobicContact CD1-CD2 3.71Å; I896-W920 HydrophobicContact CD1-CE3 3.86Å; I896-W920 HydrophobicContact CD1-CG 3.9Å; I896-W920 HydrophobicContact CD1-CZ3 4.48Å; I896-W920 HydrophobicContact CG1-CD2 3.91Å; I896-W920 HydrophobicContact CG1-CE3 3.62Å; I896-W920 HydrophobicContact CG1-CH2 4.16Å; I896-W920 HydrophobicContact CG1-CZ2 4.38Å; I896-W920 HydrophobicContact CG1-CZ3 3.76Å; I896-W920 HydrophobicContact CG2-CE3 3.93Å; I896-W920 HydrophobicContact CG2-CZ3 4.29Å; I901-W920 HydrophobicContact CD1-CE3 3.96Å; I901-W920 HydrophobicContact CD1-CH2 3.77Å; I901-W920 HydrophobicContact CD1-CZ3 3.3Å; I901-W920 HydrophobicContact CG1-CZ3 3.88Å; F902-W920 AromaticContact CE2-CE3 3.83Å; F902-W920 HydrophobicContact CE2-CE3 3.83Å; F902-W920 HydrophobicContact CE2-CZ3 4.41Å; F902-W920 HydrophobicContact CZ-CE3 4.26Å; L916-W920 WeakPolarHBondContact O-CB 3.44Å; L916-W920 PolarHBondContact O-N 3.28Å; L916-W920 VanDerWaalsContact O-N 3.16Å; Q917-W920 PolarHBondContact O-N 3.4Å; W920-C923 PolarHBondContact O-N 3.05Å; W920-S924 PolarHBondContact O-OG 2.93Å
921	V	94.1	Very high	91.8	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-66.6	-38.6	177	70.9	0	0	0	0	111.7	T889 L892 I896 Q917 A918 C923 S924 L928 L948 L949	T889-V921 HydrophobicContact CG2-CG2 4.42Å; L892-V921 HydrophobicContact CD2-CG2 4.21Å; L892-V921 HydrophobicContact CG-CG2 4.43Å; I896-V921 HydrophobicContact CD1-CB 3.92Å; I896-V921 HydrophobicContact CD1-CG2 4.49Å; Q917-V921 PolarHBondContact O-N 2.98Å; A918-V921 WeakPolarHBondContact O-CG1 3.47Å; V921-C923 PolarHBondContact O-N 2.9Å; V921-S924 PolarHBondContact O-N 3.41Å; V921-S924 VanDerWaalsContact O-N 3.14Å; V921-L928 HydrophobicContact CB-CD2 4.4Å; V921-L928 HydrophobicContact CG1-CD2 3.92Å; V921-L928 HydrophobicContact CG2-CD2 3.89Å; V921-L948 HydrophobicContact CG1-CD1 4.23Å; V921-L948 HydrophobicContact CG1-CG 4.08Å; V921-L949 HydrophobicContact CG2-CD2 3.99Å
922	N	92.7	Very high	92	Very high	83 Å²	83	38 Å²	38	44%	0.444	23%	0.226	S	C	.	.	H	α-helix	trans	-62.3	-42	177.5	-168.2	37.8	0	0	0	112.3	A918 M919 S924 L928 G952	A918-N922 WeakPolarHBondContact O-CB 3.48Å; A918-N922 PolarHBondContact O-N 3.02Å; A918-N922 VanDerWaalsContact O-N 3.13Å; M919-N922 PolarHBondContact O-N 3.3Å; N922-S924 PolarHBondContact O-N 3.25Å; N922-L928 HydrophobicContact CB-CD1 3.89Å; N922-L928 WeakPolarHBondContact OD1-CD1 3.39Å; N922-G952 VanDerWaalsContact CG-O 3.29Å
923	C	90.1	Very high	92.1	Very high	114 Å²	114	36.2 Å²	36.2	77%	0.77	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68	-2.4	176.7	-67.2	0	0	0	0	114.8	M919 W920 V921	M919-C923 PolarHBondContact O-N 3.13Å; M919-C923 PolarHBondContact O-SG 3.13Å; W920-C923 PolarHBondContact O-N 3.05Å; V921-C923 PolarHBondContact O-N 2.9Å
924	S	89.1	Confident	92.1	Very high	16 Å²	16	35 Å²	35	11%	0.112	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-115	1.5	-174.1	-52.5	0	0	0	0	114.4	S878 L884 W920 V921 N922	S878-S924 WeakPolarHBondContact CB-OG 3.31Å; S878-S924 PolarHBondContact OG-OG 3.07Å; L884-S924 WeakPolarHBondContact CD1-O 3.39Å; L884-S924 WeakPolarHBondContact CG-O 3.47Å; W920-S924 PolarHBondContact O-OG 2.93Å; V921-S924 PolarHBondContact O-N 3.41Å; V921-S924 VanDerWaalsContact O-N 3.14Å; N922-S924 PolarHBondContact O-N 3.25Å
925	T	87.8	Confident	92	Very high	19 Å²	19	32.6 Å²	32.6	12%	0.117	19%	0.189	C	C	.	.	B	Isolated β-bridge	trans	-149.3	160.9	-174.7	-168.7	0	0	0	0	112.7	T889 L928	T889-T925 HydrophobicContact CG2-CG2 3.81Å; T889-T925 PolarHBondContact OG1-OG1 3.49Å; T925-L928 HydrophobicContact CG2-CD2 3.47Å; T925-L928 VanDerWaalsContact CG2-CD2 3.47Å; T925-L928 HydrophobicContact CG2-CG 3.86Å
926	D	80.8	Confident	91.8	Very high	110 Å²	110	31.3 Å²	31.3	59%	0.588	18%	0.177	S	C	*	.	S	Bend	trans	-85.6	-24.1	176.2	-87.2	-15.8	0	0	0	113.8	K883	K883-D926 VanDerWaalsContact CD-OD2 3.27Å; K883-D926 WeakPolarHBondContact CD-OD2 3.49Å; K883-D926 WeakPolarHBondContact CG-OD1 3.48Å; K883-D926 WeakPolarHBondContact CG-OD2 3.41Å; K883-D926 IonicContact NZ-OD1 2.61Å; K883-D926 PolarHBondContact NZ-OD1 3.22Å; K883-D926 IonicContact NZ-OD2 2.7Å; K883-D926 PolarHBondContact NZ-OD2 3.21Å
927	S	89.3	Confident	91.8	Very high	35 Å²	35	30.2 Å²	30.2	25%	0.245	17%	0.171	C	C	.	.			trans	-157	92.6	-174.7	-168.3	0	0	0	0	112.3	S929 A930 A931	S927-S929 PolarHBondContact O-N 3.03Å; S927-A930 PolarHBondContact O-N 3.09Å; S927-A930 WeakPolarHBondContact OG-CB 3.45Å; S927-A930 PolarHBondContact OG-N 2.93Å; S927-A930 VanDerWaalsContact OG-N 3.13Å; S927-A931 PolarHBondContact O-N 3.22Å
928	L	95	Very high	91.7	Very high	5 Å²	5	29.1 Å²	29.1	3%	0.026	17%	0.167	C	C	.	.	H	α-helix	trans	-56.6	-35.4	167.3	-58.2	169	0	0	0	111.1	T889 V921 N922 T925 A931 L932 L949 G952 A954	T889-L928 HydrophobicContact CG2-CD2 4.25Å; V921-L928 HydrophobicContact CB-CD2 4.4Å; V921-L928 HydrophobicContact CG1-CD2 3.92Å; V921-L928 HydrophobicContact CG2-CD2 3.89Å; N922-L928 HydrophobicContact CB-CD1 3.89Å; N922-L928 WeakPolarHBondContact OD1-CD1 3.39Å; T925-L928 HydrophobicContact CG2-CD2 3.47Å; T925-L928 VanDerWaalsContact CG2-CD2 3.47Å; T925-L928 HydrophobicContact CG2-CG 3.86Å; L928-A931 PolarHBondContact O-N 3.36Å; L928-L932 WeakPolarHBondContact O-CB 3.34Å; L928-L932 PolarHBondContact O-N 3.26Å; L928-L949 HydrophobicContact CB-CB 4.47Å; L928-L949 HydrophobicContact CB-CD2 4.35Å; L928-L949 HydrophobicContact CD2-CD2 3.5Å; L928-L949 VanDerWaalsContact CD2-CD2 3.5Å; L928-G952 WeakPolarHBondContact CD1-O 3.43Å; L928-A954 HydrophobicContact CB-CB 3.69Å
929	S	94.8	Very high	91.6	Very high	15 Å²	15	30.7 Å²	30.7	11%	0.105	17%	0.172	C	C	.	.	H	α-helix	trans	-61.3	-43.3	176.4	-43.9	0	0	0	0	112.8	S927 A931 L932 G933 S955	S927-S929 PolarHBondContact O-N 3.03Å; S929-A931 VanDerWaalsContact C-N 3.33Å; S929-A931 PolarHBondContact O-N 3.03Å; S929-L932 PolarHBondContact O-N 3.22Å; S929-G933 PolarHBondContact O-N 3.33Å; S929-S955 PolarHBondContact OG-N 3.4Å
930	A	91.4	Very high	91.4	Very high	12 Å²	12	28.5 Å²	28.5	10%	0.099	16%	0.164	C	C	.	.	H	α-helix	trans	-71.7	-26.9	177.7	0	0	0	0	0	112.9	R886 S927 S934 W958	R886-A930 WeakPolarHBondContact CD-O 3.48Å; R886-A930 HydrophobicContact CG-CB 4.03Å; R886-A930 WeakPolarHBondContact CG-O 3.25Å; S927-A930 PolarHBondContact O-N 3.09Å; S927-A930 WeakPolarHBondContact OG-CB 3.45Å; S927-A930 PolarHBondContact OG-N 2.93Å; S927-A930 VanDerWaalsContact OG-N 3.13Å; A930-S934 PolarHBondContact O-N 3.41Å; A930-W958 HydrophobicContact CB-CH2 4.36Å; A930-W958 HydrophobicContact CB-CZ2 3.88Å
931	A	93.7	Very high	91.4	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-72.8	-44.5	170.2	0	0	0	0	0	111.6	R886 T889 M890 S927 L928 S929 G933 S934 L949	R886-A931 WeakPolarHBondContact O-CB 3.39Å; T889-A931 HydrophobicContact CG2-CB 3.52Å; M890-A931 HydrophobicContact CG-CB 4.42Å; M890-A931 HydrophobicContact SD-CB 4.38Å; S927-A931 PolarHBondContact O-N 3.22Å; L928-A931 PolarHBondContact O-N 3.36Å; S929-A931 VanDerWaalsContact C-N 3.33Å; S929-A931 PolarHBondContact O-N 3.03Å; A931-G933 VanDerWaalsContact C-N 3.32Å; A931-G933 PolarHBondContact O-N 3.09Å; A931-S934 VanDerWaalsContact O-CB 3.22Å; A931-S934 WeakPolarHBondContact O-CB 3.34Å; A931-S934 PolarHBondContact O-N 2.92Å; A931-S934 VanDerWaalsContact O-N 3.09Å; A931-S934 PolarHBondContact O-OG 2.77Å; A931-L949 HydrophobicContact CB-CD1 3.95Å
932	L	95.3	Very high	91.4	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-58	-43.5	175.8	-176.6	71.8	0	0	0	111.5	L928 S929 S934 N937 L949 M950 A954 I968 M980	L928-L932 WeakPolarHBondContact O-CB 3.34Å; L928-L932 PolarHBondContact O-N 3.26Å; S929-L932 PolarHBondContact O-N 3.22Å; L932-S934 VanDerWaalsContact C-N 3.33Å; L932-S934 PolarHBondContact O-N 2.88Å; L932-N937 PolarHBondContact O-ND2 3.47Å; L932-L949 HydrophobicContact CB-CD1 4.12Å; L932-M950 HydrophobicContact CD1-CE 3.96Å; L932-M950 HydrophobicContact CD1-CG 4.3Å; L932-M950 HydrophobicContact CD2-CG 3.79Å; L932-M950 HydrophobicContact CD2-SD 4.25Å; L932-A954 HydrophobicContact CB-CB 4.19Å; L932-A954 HydrophobicContact CD2-CB 3.84Å; L932-I968 HydrophobicContact CD2-CD1 4.15Å; L932-I968 HydrophobicContact CG-CD1 3.74Å; L932-M980 HydrophobicContact CD1-CE 4.02Å
933	G	93.1	Very high	91.5	Very high	10 Å²	10	26.3 Å²	26.3	10%	0.103	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.2	13.9	175.4	0	0	0	0	0	115.8	S929 A931	S929-G933 PolarHBondContact O-N 3.33Å; A931-G933 VanDerWaalsContact C-N 3.32Å; A931-G933 PolarHBondContact O-N 3.09Å
934	S	91.7	Very high	91.8	Very high	6 Å²	6	26.5 Å²	26.5	4%	0.042	14%	0.143	C	C	.	.			trans	-68.4	146.8	177.3	63.7	0	0	0	0	111.9	A930 A931 L932 R936 N937 L938	A930-S934 PolarHBondContact O-N 3.41Å; A931-S934 VanDerWaalsContact O-CB 3.22Å; A931-S934 WeakPolarHBondContact O-CB 3.34Å; A931-S934 PolarHBondContact O-N 2.92Å; A931-S934 VanDerWaalsContact O-N 3.09Å; A931-S934 PolarHBondContact O-OG 2.77Å; L932-S934 VanDerWaalsContact C-N 3.33Å; L932-S934 PolarHBondContact O-N 2.88Å; S934-R936 VanDerWaalsContact C-N 3.29Å; S934-R936 PolarHBondContact O-N 3.34Å; S934-N937 CarbonylContact O-C 3.44Å; S934-N937 WeakPolarHBondContact O-CA 3.43Å; S934-N937 PolarHBondContact O-N 2.97Å; S934-L938 WeakPolarHBondContact O-CG 3.48Å; S934-L938 PolarHBondContact O-N 3.46Å
935	L	89.8	Confident	92.1	Very high	4 Å²	4	25.8 Å²	25.8	2%	0.021	14%	0.138	C	C	.	.	H	α-helix	trans	-58.1	-40.1	-169.4	-165.2	83	0	0	0	112.3	L365 E366 R583 V586 N937 L938 Y939 V962	L365-L935 HydrophobicContact CD2-CB 4.33Å; L365-L935 HydrophobicContact CD2-CD2 3.86Å; L365-L935 HydrophobicContact CG-CD2 3.96Å; E366-L935 HydrophobicContact CG-CB 4.17Å; E366-L935 WeakPolarHBondContact OE1-CB 3.29Å; E366-L935 PolarHBondContact OE1-N 3.18Å; R583-L935 HydrophobicContact CB-CD2 4.5Å; R583-L935 HydrophobicContact CG-CD2 3.71Å; V586-L935 HydrophobicContact CB-CD2 4.2Å; V586-L935 HydrophobicContact CG1-CD2 3.91Å; V586-L935 HydrophobicContact CG1-CG 4.06Å; L935-N937 VanDerWaalsContact C-N 3.32Å; L935-N937 PolarHBondContact O-N 3.41Å; L935-L938 PolarHBondContact O-N 3.26Å; L935-Y939 HydrophobicContact CD1-CD2 4.18Å; L935-Y939 HydrophobicContact CD1-CE2 3.8Å; L935-Y939 HydrophobicContact CG-CD2 4.15Å; L935-Y939 HydrophobicContact CG-CE2 4.26Å; L935-Y939 WeakPolarHBondContact O-CD2 3.47Å; L935-Y939 PolarHBondContact O-N 2.87Å; L935-V962 HydrophobicContact CD1-CG2 4.16Å
936	R	90.1	Very high	92.6	Very high	38 Å²	38	24.9 Å²	24.9	14%	0.143	13%	0.133	C	C	.	.	H	α-helix	trans	-61.5	-39.1	175	-70.6	-175.3	179.8	-93.3	1.6	112.1	S362 L365 E548 S934 T940	S362-R936 VanDerWaalsContact OG-CZ 3.29Å; S362-R936 PolarHBondContact OG-NE 3.07Å; S362-R936 PolarHBondContact OG-NH2 3.32Å; L365-R936 HydrophobicContact CD2-CG 4.14Å; E548-R936 IonicContact OE1-CZ 3.64Å; E548-R936 IonicContact OE1-NH1 3.44Å; E548-R936 PolarHBondContact OE1-NH1 3.28Å; E548-R936 IonicContact OE1-NH2 3.39Å; E548-R936 PolarHBondContact OE1-NH2 3.28Å; E548-R936 IonicContact OE2-NH1 2.61Å; S934-R936 VanDerWaalsContact C-N 3.29Å; S934-R936 PolarHBondContact O-N 3.34Å; R936-T940 CarbonylContact O-C 3.49Å; R936-T940 VanDerWaalsContact O-C 3.29Å; R936-T940 WeakPolarHBondContact O-CA 3.41Å; R936-T940 PolarHBondContact O-N 3.27Å; R936-T940 PolarHBondContact O-OG1 3.31Å
937	N	93.4	Very high	93.3	Very high	3 Å²	3	23.5 Å²	23.5	2%	0.016	12%	0.119	C	C	.	.	H	α-helix	trans	-77	-25.7	178.3	-160.3	57.4	0	0	0	112.4	M890 L932 S934 L935 P941 N942 S946 H972	M890-N937 HydrophobicContact CE-CB 3.94Å; M890-N937 VanDerWaalsContact CE-OD1 3.24Å; M890-N937 WeakPolarHBondContact CE-OD1 3.38Å; L932-N937 PolarHBondContact O-ND2 3.47Å; S934-N937 CarbonylContact O-C 3.44Å; S934-N937 WeakPolarHBondContact O-CA 3.43Å; S934-N937 PolarHBondContact O-N 2.97Å; L935-N937 VanDerWaalsContact C-N 3.32Å; L935-N937 PolarHBondContact O-N 3.41Å; N937-P941 WeakPolarHBondContact O-CA 3.22Å; N937-P941 WeakPolarHBondContact O-CB 3.28Å; N937-N942 PolarHBondContact OD1-N 2.66Å; N937-S946 PolarHBondContact ND2-OG 3.01Å; N937-S946 PolarHBondContact OD1-OG 2.85Å; N937-H972 PolarHBondContact O-CE1 3.5Å
938	L	92.9	Very high	93.7	Very high	2 Å²	2	22.2 Å²	22.2	1%	0.01	11%	0.109	C	C	.	.	H	α-helix	trans	-67	-44.7	174.2	-64.8	179.9	0	0	0	112.3	S934 L935 T960 V962 I968 V971 H972 L975 H977	S934-L938 WeakPolarHBondContact O-CG 3.48Å; S934-L938 PolarHBondContact O-N 3.46Å; L935-L938 PolarHBondContact O-N 3.26Å; L938-T960 HydrophobicContact CD1-CG2 3.78Å; L938-T960 HydrophobicContact CD2-CG2 3.83Å; L938-T960 HydrophobicContact CG-CG2 4.45Å; L938-V962 HydrophobicContact CD1-CG2 3.69Å; L938-I968 HydrophobicContact CD2-CD1 4.03Å; L938-I968 HydrophobicContact CD2-CG1 3.84Å; L938-V971 HydrophobicContact CD2-CG1 4.28Å; L938-H972 PolarHBondContact O-CE1 2.7Å; L938-H972 VanDerWaalsContact O-CE1 3.24Å; L938-H972 PolarHBondContact O-ND1 2.91Å; L938-L975 WeakPolarHBondContact O-CD1 3.47Å; L938-H977 PolarHBondContact O-CE1 3.13Å; L938-H977 PolarHBondContact O-ND1 3.24Å
939	Y	91.6	Very high	93.8	Very high	35 Å²	35	22 Å²	22	14%	0.137	11%	0.108	C	C	.	.	H	α-helix	trans	-97.1	-26.8	-175.3	-70.1	-87	0	0	0	114.6	V586 Q587 L935 V962 L975 H977	V586-Y939 HydrophobicContact CG1-CD2 4.39Å; V586-Y939 VanDerWaalsContact O-CB 3.25Å; V586-Y939 WeakPolarHBondContact O-CB 3.14Å; Q587-Y939 HydrophobicContact CB-CD1 4.47Å; Q587-Y939 HydrophobicContact CB-CE1 3.94Å; Q587-Y939 HydrophobicContact CB-CE2 4.25Å; Q587-Y939 HydrophobicContact CG-CD2 4.31Å; Q587-Y939 HydrophobicContact CG-CE1 4.26Å; Q587-Y939 HydrophobicContact CG-CE2 3.67Å; Q587-Y939 PolarHBondContact NE2-OH 2.96Å; Q587-Y939 WeakPolarHBondContact O-CD1 3.46Å; Q587-Y939 WeakPolarHBondContact O-CE1 3.5Å; L935-Y939 HydrophobicContact CD1-CD2 4.18Å; L935-Y939 HydrophobicContact CD1-CE2 3.8Å; L935-Y939 HydrophobicContact CG-CD2 4.15Å; L935-Y939 HydrophobicContact CG-CE2 4.26Å; L935-Y939 WeakPolarHBondContact O-CD2 3.47Å; L935-Y939 PolarHBondContact O-N 2.87Å; Y939-V962 WeakPolarHBondContact OH-CG1 3.25Å; Y939-L975 HydrophobicContact CD1-CD1 3.86Å; Y939-L975 HydrophobicContact CD1-CD2 4.15Å; Y939-L975 HydrophobicContact CE1-CD1 3.88Å; Y939-L975 HydrophobicContact CE1-CD2 3.72Å; Y939-L975 HydrophobicContact CE1-CG 4.49Å; Y939-L975 HydrophobicContact CG-CD1 4.36Å; Y939-H977 PolarHBondContact O-CE1 2.85Å
940	T	90.6	Very high	93.9	Very high	54 Å²	54	21.7 Å²	21.7	33%	0.331	11%	0.105	S	C	.	.	S	Bend	trans	-130.8	75.1	173.1	46.6	0	0	0	0	109.4	R936 N942	R936-T940 CarbonylContact O-C 3.49Å; R936-T940 VanDerWaalsContact O-C 3.29Å; R936-T940 WeakPolarHBondContact O-CA 3.41Å; R936-T940 PolarHBondContact O-N 3.27Å; R936-T940 PolarHBondContact O-OG1 3.31Å; T940-N942 PolarHBondContact O-N 2.9Å
941	P	93.3	Very high	94.1	Very high	4 Å²	4	25.1 Å²	25.1	3%	0.026	12%	0.119	C	C	.	.			trans	-65.9	129.7	-170.4	27.7	-37.1	0	0	0	112.2	Y632 N937 I943 H977 M980	Y632-P941 HydrophobicContact CD1-CG 4.33Å; Y632-P941 HydrophobicContact CG-CG 4.29Å; N937-P941 WeakPolarHBondContact O-CA 3.22Å; N937-P941 WeakPolarHBondContact O-CB 3.28Å; P941-I943 HydrophobicContact CB-CD1 4.09Å; P941-I943 HydrophobicContact CG-CD1 4.27Å; P941-I943 PolarHBondContact O-N 3.02Å; P941-H977 WeakPolarHBondContact CD-ND1 3.49Å; P941-H977 WeakPolarHBondContact CG-ND1 3.29Å; P941-M980 HydrophobicContact CB-CB 4.44Å; P941-M980 HydrophobicContact CB-CG 4.27Å; P941-M980 HydrophobicContact CB-SD 4.45Å
942	N	93.7	Very high	94.2	Very high	49 Å²	49	25.6 Å²	25.6	26%	0.262	12%	0.124	S	C	.	.			trans	-90.1	96.3	165.1	-168.9	-60.9	0	0	0	108.3	M890 N937 T940 K944 V945 S946	M890-N942 HydrophobicContact CE-CB 4.19Å; N937-N942 PolarHBondContact OD1-N 2.66Å; T940-N942 PolarHBondContact O-N 2.9Å; N942-K944 PolarHBondContact O-N 3.33Å; N942-K944 PolarHBondContact OD1-N 2.9Å; N942-V945 HydrophobicContact CB-CB 4.17Å; N942-V945 HydrophobicContact CB-CG2 4.49Å; N942-V945 PolarHBondContact O-N 3.07Å; N942-V945 WeakPolarHBondContact OD1-CB 3.34Å; N942-V945 WeakPolarHBondContact OD1-CG2 3.49Å; N942-V945 PolarHBondContact OD1-N 2.82Å; N942-S946 VanDerWaalsContact O-CB 3.22Å; N942-S946 WeakPolarHBondContact O-CB 3.36Å; N942-S946 PolarHBondContact O-N 2.98Å; N942-S946 PolarHBondContact O-OG 2.96Å
943	I	95	Very high	94.1	Very high	21 Å²	21	28.4 Å²	28.4	11%	0.108	15%	0.153	C	C	.	.	H	α-helix	trans	-58.3	-39.6	-174.7	-54.7	-60.3	0	0	0	111.1	D631 P941 S946 R947 E979 M980 L983	D631-I943 HydrophobicContact CB-CG1 4.41Å; P941-I943 HydrophobicContact CB-CD1 4.09Å; P941-I943 HydrophobicContact CG-CD1 4.27Å; P941-I943 PolarHBondContact O-N 3.02Å; I943-S946 PolarHBondContact O-N 3.1Å; I943-R947 WeakPolarHBondContact O-CB 3.5Å; I943-R947 PolarHBondContact O-N 3.23Å; I943-E979 HydrophobicContact CD1-CB 4.05Å; I943-E979 HydrophobicContact CG1-CB 4.34Å; I943-M980 HydrophobicContact CD1-CB 3.72Å; I943-M980 HydrophobicContact CD1-CG 4.37Å; I943-M980 HydrophobicContact CD1-SD 4.05Å; I943-L983 HydrophobicContact CG2-CD2 3.93Å
944	K	95.4	Very high	94.2	Very high	118 Å²	118	28.2 Å²	28.2	51%	0.513	15%	0.151	S	C	.	.	H	α-helix	trans	-70.9	-45.5	-175.8	-56.6	175.9	-174	63.6	0	111.9	D631 L897 N942 L948	D631-K944 IonicContact OD1-NZ 3.54Å; D631-K944 PolarHBondContact OD1-NZ 3.2Å; D631-K944 IonicContact OD2-NZ 2.69Å; D631-K944 PolarHBondContact OD2-NZ 3.41Å; L897-K944 HydrophobicContact CD1-CB 4.02Å; N942-K944 PolarHBondContact O-N 3.33Å; N942-K944 PolarHBondContact OD1-N 2.9Å; K944-L948 PolarHBondContact O-N 3.5Å
945	V	96.2	Very high	94.4	Very high	2 Å²	2	29.9 Å²	29.9	1%	0.012	16%	0.162	C	C	.	.	H	α-helix	trans	-68.1	-40.8	173.6	174.4	0	0	0	0	110.7	M890 H894 L897 N942 R947 L948 L949	M890-V945 HydrophobicContact CE-CB 4.1Å; M890-V945 HydrophobicContact CE-CG1 3.64Å; M890-V945 HydrophobicContact SD-CG1 3.8Å; H894-V945 HydrophobicContact CB-CG2 4.32Å; L897-V945 HydrophobicContact CD1-CG2 3.88Å; N942-V945 HydrophobicContact CB-CB 4.17Å; N942-V945 HydrophobicContact CB-CG2 4.49Å; N942-V945 PolarHBondContact O-N 3.07Å; N942-V945 WeakPolarHBondContact OD1-CB 3.34Å; N942-V945 WeakPolarHBondContact OD1-CG2 3.49Å; N942-V945 PolarHBondContact OD1-N 2.82Å; V945-R947 PolarHBondContact O-N 3.29Å; V945-L948 WeakPolarHBondContact O-CB 3.49Å; V945-L948 PolarHBondContact O-N 3.12Å; V945-L948 VanDerWaalsContact O-N 3.1Å; V945-L949 HydrophobicContact CG1-CD1 4.27Å; V945-L949 HydrophobicContact CG1-CG 4.23Å; V945-L949 WeakPolarHBondContact O-CG 3.43Å; V945-L949 PolarHBondContact O-N 2.96Å
946	S	97	Very high	94.7	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-58	-46	176.9	-63.8	0	0	0	0	112	N937 N942 I943 L948 L949 M950	N937-S946 PolarHBondContact ND2-OG 3.01Å; N937-S946 PolarHBondContact OD1-OG 2.85Å; N942-S946 VanDerWaalsContact O-CB 3.22Å; N942-S946 WeakPolarHBondContact O-CB 3.36Å; N942-S946 PolarHBondContact O-N 2.98Å; N942-S946 PolarHBondContact O-OG 2.96Å; I943-S946 PolarHBondContact O-N 3.1Å; S946-L948 VanDerWaalsContact C-N 3.34Å; S946-L948 PolarHBondContact O-N 3.01Å; S946-L949 PolarHBondContact O-N 3.38Å; S946-M950 VanDerWaalsContact C-CE 3.43Å; S946-M950 WeakPolarHBondContact O-CE 3.33Å; S946-M950 PolarHBondContact O-N 3.34Å
947	R	97.1	Very high	94.8	Very high	81 Å²	81	32.5 Å²	32.5	31%	0.306	18%	0.182	S	C	.	.	H	α-helix	trans	-59.3	-42.7	173.9	-177.8	-179.2	-73.7	-85.3	5.1	111.9	I943 V945 M950 H951 L983 E986	I943-R947 WeakPolarHBondContact O-CB 3.5Å; I943-R947 PolarHBondContact O-N 3.23Å; V945-R947 PolarHBondContact O-N 3.29Å; R947-M950 PolarHBondContact O-N 3.41Å; R947-H951 WeakPolarHBondContact CG-NE2 3.22Å; R947-H951 PolarHBondContact O-CD2 3.12Å; R947-H951 PolarHBondContact O-N 3.44Å; R947-L983 HydrophobicContact CB-CD1 3.88Å; R947-L983 HydrophobicContact CB-CD2 4.01Å; R947-L983 HydrophobicContact CG-CD1 3.97Å; R947-L983 VanDerWaalsContact CZ-CD1 3.47Å; R947-E986 IonicContact CZ-OE1 3.5Å; R947-E986 IonicContact CZ-OE2 2.73Å; R947-E986 IonicContact NH1-OE1 3.34Å; R947-E986 PolarHBondContact NH1-OE1 3.13Å; R947-E986 IonicContact NH1-OE2 3.54Å; R947-E986 PolarHBondContact NH1-OE2 2.7Å; R947-E986 IonicContact NH2-OE1 3.37Å; R947-E986 PolarHBondContact NH2-OE1 2.9Å; R947-E986 IonicContact NH2-OE2 3.52Å; R947-E986 PolarHBondContact NH2-OE2 3.32Å
948	L	97.3	Very high	94.8	Very high	7 Å²	7	36.7 Å²	36.7	4%	0.037	20%	0.198	C	C	.	.	H	α-helix	trans	-61.3	-45.1	175	172.8	61.6	0	0	0	112.3	I896 L897 Q917 A918 V921 K944 V945 S946 H951 G952	I896-L948 HydrophobicContact CB-CD2 4.34Å; I896-L948 HydrophobicContact CG2-CD2 4.05Å; L897-L948 HydrophobicContact CD1-CB 4.47Å; L897-L948 HydrophobicContact CD1-CD2 4.27Å; L897-L948 HydrophobicContact CD2-CB 4.42Å; L897-L948 HydrophobicContact CD2-CD2 4.05Å; L897-L948 HydrophobicContact CG-CD2 3.84Å; Q917-L948 HydrophobicContact CB-CD1 3.62Å; A918-L948 HydrophobicContact CB-CD1 4.27Å; V921-L948 HydrophobicContact CG1-CD1 4.23Å; V921-L948 HydrophobicContact CG1-CG 4.08Å; K944-L948 PolarHBondContact O-N 3.5Å; V945-L948 WeakPolarHBondContact O-CB 3.49Å; V945-L948 PolarHBondContact O-N 3.12Å; V945-L948 VanDerWaalsContact O-N 3.1Å; S946-L948 VanDerWaalsContact C-N 3.34Å; S946-L948 PolarHBondContact O-N 3.01Å; L948-H951 PolarHBondContact O-N 2.84Å; L948-G952 PolarHBondContact O-N 2.89Å
949	L	97.2	Very high	94.7	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-62.9	-42.5	177.3	-65	-180	0	0	0	111.6	T889 M890 V921 L928 A931 L932 V945 S946 G952 G953 A954	T889-L949 HydrophobicContact CG2-CD2 3.93Å; M890-L949 HydrophobicContact SD-CD1 3.55Å; M890-L949 VanDerWaalsContact SD-CD1 3.55Å; V921-L949 HydrophobicContact CG2-CD2 3.99Å; L928-L949 HydrophobicContact CB-CB 4.47Å; L928-L949 HydrophobicContact CB-CD2 4.35Å; L928-L949 HydrophobicContact CD2-CD2 3.5Å; L928-L949 VanDerWaalsContact CD2-CD2 3.5Å; A931-L949 HydrophobicContact CB-CD1 3.95Å; L932-L949 HydrophobicContact CB-CD1 4.12Å; V945-L949 HydrophobicContact CG1-CD1 4.27Å; V945-L949 HydrophobicContact CG1-CG 4.23Å; V945-L949 WeakPolarHBondContact O-CG 3.43Å; V945-L949 PolarHBondContact O-N 2.96Å; S946-L949 PolarHBondContact O-N 3.38Å; L949-G952 CarbonylContact O-C 3.58Å; L949-G952 WeakPolarHBondContact O-CA 3.46Å; L949-G952 PolarHBondContact O-N 3Å; L949-G952 VanDerWaalsContact O-N 3.1Å; L949-G953 PolarHBondContact O-N 3.39Å; L949-A954 VanDerWaalsContact C-CB 3.49Å; L949-A954 HydrophobicContact CB-CB 3.99Å; L949-A954 WeakPolarHBondContact O-CB 3.31Å; L949-A954 PolarHBondContact O-N 2.97Å
950	M	96.9	Very high	94.5	Very high	9 Å²	9	38.1 Å²	38.1	4%	0.044	21%	0.213	C	C	.	.	H	α-helix	trans	-65.6	-41.6	177	-74.2	177.8	-88.5	0	0	112.4	L932 S946 R947 G952 G953 A954 V956 M980 L983 L984 M987	L932-M950 HydrophobicContact CD1-CE 3.96Å; L932-M950 HydrophobicContact CD1-CG 4.3Å; L932-M950 HydrophobicContact CD2-CG 3.79Å; L932-M950 HydrophobicContact CD2-SD 4.25Å; S946-M950 VanDerWaalsContact C-CE 3.43Å; S946-M950 WeakPolarHBondContact O-CE 3.33Å; S946-M950 PolarHBondContact O-N 3.34Å; R947-M950 PolarHBondContact O-N 3.41Å; M950-G952 PolarHBondContact O-N 3.06Å; M950-G953 PolarHBondContact O-N 3.29Å; M950-G953 VanDerWaalsContact O-N 3.07Å; M950-A954 HydrophobicContact CG-CB 4.32Å; M950-V956 HydrophobicContact CG-CG1 4.05Å; M950-V956 HydrophobicContact SD-CG1 3.68Å; M950-M980 HydrophobicContact CE-CE 4.35Å; M950-L983 HydrophobicContact CE-CD1 4.16Å; M950-L983 HydrophobicContact CE-CD2 3.49Å; M950-L983 VanDerWaalsContact CE-CD2 3.49Å; M950-L983 HydrophobicContact CE-CG 3.56Å; M950-L984 HydrophobicContact CE-CD2 4.38Å; M950-L984 HydrophobicContact SD-CD2 3.65Å; M950-L984 HydrophobicContact SD-CG 4.44Å; M950-M987 HydrophobicContact CB-CE 3.85Å; M950-M987 HydrophobicContact CB-CG 4.1Å; M950-M987 HydrophobicContact SD-CB 3.97Å; M950-M987 HydrophobicContact SD-CG 3.95Å
951	H	95.4	Very high	94.1	Very high	85 Å²	85	39.6 Å²	39.6	39%	0.394	22%	0.216	S	C	.	.	H	α-helix	trans	-62.7	-28.2	170.4	-69.7	-45.7	0	0	0	113	A918 R947 L948 G953	A918-H951 HydrophobicContact CB-CB 3.77Å; R947-H951 WeakPolarHBondContact CG-NE2 3.22Å; R947-H951 PolarHBondContact O-CD2 3.12Å; R947-H951 PolarHBondContact O-N 3.44Å; L948-H951 PolarHBondContact O-N 2.84Å; H951-G953 VanDerWaalsContact C-N 3.28Å
952	G	94.5	Very high	93.4	Very high	10 Å²	10	40.1 Å²	40.1	10%	0.103	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-11.8	173.8	0	0	0	0	0	114.6	N922 L928 L948 L949 M950	N922-G952 VanDerWaalsContact CG-O 3.29Å; L928-G952 WeakPolarHBondContact CD1-O 3.43Å; L948-G952 PolarHBondContact O-N 2.89Å; L949-G952 CarbonylContact O-C 3.58Å; L949-G952 WeakPolarHBondContact O-CA 3.46Å; L949-G952 PolarHBondContact O-N 3Å; L949-G952 VanDerWaalsContact O-N 3.1Å; M950-G952 PolarHBondContact O-N 3.06Å
953	G	94.1	Very high	92.7	Very high	58 Å²	58	40.2 Å²	40.2	60%	0.598	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	109.7	14.1	-177.6	0	0	0	0	0	115.5	L949 M950 H951 S955	L949-G953 PolarHBondContact O-N 3.39Å; M950-G953 PolarHBondContact O-N 3.29Å; M950-G953 VanDerWaalsContact O-N 3.07Å; H951-G953 VanDerWaalsContact C-N 3.28Å; G953-S955 PolarHBondContact O-N 2.9Å
954	A	96.1	Very high	91.6	Very high	7 Å²	7	41.3 Å²	41.3	6%	0.058	24%	0.236	C	C	.	.			trans	-60.5	131.6	170.2	0	0	0	0	0	111.1	L928 L932 L949 M950 V956	L928-A954 HydrophobicContact CB-CB 3.69Å; L932-A954 HydrophobicContact CB-CB 4.19Å; L932-A954 HydrophobicContact CD2-CB 3.84Å; L949-A954 VanDerWaalsContact C-CB 3.49Å; L949-A954 HydrophobicContact CB-CB 3.99Å; L949-A954 WeakPolarHBondContact O-CB 3.31Å; L949-A954 PolarHBondContact O-N 2.97Å; M950-A954 HydrophobicContact CG-CB 4.32Å; A954-V956 PolarHBondContact O-N 3.47Å
955	S	95.2	Very high	91	Very high	41 Å²	41	41.8 Å²	41.8	29%	0.287	24%	0.239	S	C	.	.			trans	-71.7	119.7	-178.9	-177.9	0	0	0	0	112	S929 G953 T957 W958	S929-S955 PolarHBondContact OG-N 3.4Å; G953-S955 PolarHBondContact O-N 2.9Å; S955-T957 PolarHBondContact O-N 3.26Å; S955-T957 PolarHBondContact OG-N 3.06Å; S955-T957 PolarHBondContact OG-OG1 3.08Å; S955-W958 VanDerWaalsContact O-CB 3.25Å; S955-W958 WeakPolarHBondContact O-CB 3.21Å; S955-W958 PolarHBondContact O-N 2.95Å
956	V	95	Very high	90.6	Very high	21 Å²	21	41.7 Å²	41.7	13%	0.127	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-12.1	170.9	-60.3	0	0	0	0	113.5	M950 A954 I968 L984 M987 A989	M950-V956 HydrophobicContact CG-CG1 4.05Å; M950-V956 HydrophobicContact SD-CG1 3.68Å; A954-V956 PolarHBondContact O-N 3.47Å; V956-I968 WeakPolarHBondContact O-CG2 3.46Å; V956-L984 HydrophobicContact CB-CD2 4.08Å; V956-L984 HydrophobicContact CG1-CD2 4.07Å; V956-M987 HydrophobicContact CG1-CB 3.81Å; V956-A989 HydrophobicContact CB-CB 4.05Å; V956-A989 HydrophobicContact CG2-CB 4.23Å
957	T	93.3	Very high	90.4	Very high	75 Å²	75	42.3 Å²	42.3	46%	0.46	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.5	8.1	173.6	61.3	0	0	0	0	113.1	S955 C959 P990	S955-T957 PolarHBondContact O-N 3.26Å; S955-T957 PolarHBondContact OG-N 3.06Å; S955-T957 PolarHBondContact OG-OG1 3.08Å; T957-C959 PolarHBondContact O-N 3.19Å; T957-P990 HydrophobicContact CG2-CG 3.83Å
958	W	92.9	Very high	90.3	Very high	91 Å²	91	38.4 Å²	38.4	35%	0.345	23%	0.228	S	C	.	.	P	Polyproline II helix	trans	-59.5	121.1	-178.5	-174.5	-95.8	0	0	0	111.9	A930 S955 I968	A930-W958 HydrophobicContact CB-CH2 4.36Å; A930-W958 HydrophobicContact CB-CZ2 3.88Å; S955-W958 VanDerWaalsContact O-CB 3.25Å; S955-W958 WeakPolarHBondContact O-CB 3.21Å; S955-W958 PolarHBondContact O-N 2.95Å; W958-I968 PolarHBondContact O-N 3.18Å
959	C	90.8	Very high	90.2	Very high	63 Å²	63	38.2 Å²	38.2	43%	0.426	23%	0.227	S	C	.	.	B	Isolated β-bridge	trans	-81	132.7	173.6	-68.9	0	0	0	0	110.8	T957 H965 A966	T957-C959 PolarHBondContact O-N 3.19Å; C959-H965 WeakPolarHBondContact CB-O 3.1Å; C959-H965 PolarHBondContact SG-O 3.19Å; C959-H965 VanDerWaalsContact SG-O 3.33Å; C959-A966 WeakPolarHBondContact CA-O 3.47Å
960	T	87.7	Confident	90.1	Very high	5 Å²	5	38.2 Å²	38.2	3%	0.031	23%	0.227	C	C	.	.	P	Polyproline II helix	trans	-96	163.6	177.9	82.1	0	0	0	0	110.6	L938 V962 H965 A966 I968 V971	L938-T960 HydrophobicContact CD1-CG2 3.78Å; L938-T960 HydrophobicContact CD2-CG2 3.83Å; L938-T960 HydrophobicContact CG-CG2 4.45Å; T960-V962 PolarHBondContact O-N 3.23Å; T960-V962 WeakPolarHBondContact OG1-CB 3.4Å; T960-V962 PolarHBondContact OG1-N 2.6Å; T960-V962 PolarHBondContact OG1-O 3.47Å; T960-H965 VanDerWaalsContact O-CA 3.25Å; T960-H965 WeakPolarHBondContact O-CA 3.47Å; T960-A966 PolarHBondContact N-O 3.41Å; T960-I968 HydrophobicContact CG2-CB 4.38Å; T960-V971 HydrophobicContact CG2-CG2 4.17Å
961	E	81.4	Confident	89.9	Confident	85 Å²	85	37.8 Å²	37.8	40%	0.397	23%	0.225	S	C	.	.	S	Bend	trans	-69.9	-8.7	170.5	-65.3	162.1	-171.9	0	0	113	L368 R583	L368-E961 WeakPolarHBondContact CD1-OE2 3.29Å; R583-E961 IonicContact NH2-OE2 3.76Å
962	V	80.2	Confident	89.9	Confident	14 Å²	14	33.8 Å²	33.8	9%	0.085	21%	0.206	C	C	.	.	S	Bend	trans	-90.1	148.6	-176.4	-157.1	0	0	0	0	109.8	L935 L938 Y939 T960 G964 A966	L935-V962 HydrophobicContact CD1-CG2 4.16Å; L938-V962 HydrophobicContact CD1-CG2 3.69Å; Y939-V962 WeakPolarHBondContact OH-CG1 3.25Å; T960-V962 PolarHBondContact O-N 3.23Å; T960-V962 WeakPolarHBondContact OG1-CB 3.4Å; T960-V962 PolarHBondContact OG1-N 2.6Å; T960-V962 PolarHBondContact OG1-O 3.47Å; V962-G964 VanDerWaalsContact C-N 3.31Å; V962-G964 PolarHBondContact O-N 3.31Å; V962-A966 PolarHBondContact O-N 3.02Å
963	I	77.2	Confident	89.9	Confident	51 Å²	51	33.3 Å²	33.3	26%	0.262	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	54	40.6	177.7	-31	-174.8	0	0	0	113.6	A966 V971 H974 L1004	I963-A966 HydrophobicContact CB-CB 3.89Å; I963-A966 WeakPolarHBondContact O-CB 3.37Å; I963-V971 HydrophobicContact CD1-CB 4.37Å; I963-V971 HydrophobicContact CD1-CG1 4.24Å; I963-V971 HydrophobicContact CD1-CG2 4.27Å; I963-V971 HydrophobicContact CG1-CG2 4.4Å; I963-H974 HydrophobicContact CD1-CB 3.7Å; I963-H974 VanDerWaalsContact CD1-CD2 3.49Å; I963-H974 WeakPolarHBondContact CD1-CD2 3.15Å; I963-L1004 HydrophobicContact CG2-CD2 4.4Å
964	G	72.8	Confident	89.9	Confident	45 Å²	45	33.9 Å²	33.9	46%	0.464	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	68.4	57.4	171.9	0	0	0	0	0	113.7	V962 A966 G996	V962-G964 VanDerWaalsContact C-N 3.31Å; V962-G964 PolarHBondContact O-N 3.31Å; G964-A966 VanDerWaalsContact C-N 3.26Å; G964-A966 PolarHBondContact O-N 3.25Å; G964-G996 WeakPolarHBondContact O-CA 3.33Å; G964-G996 PolarHBondContact O-N 3.21Å
965	H	83.1	Confident	89.7	Confident	127 Å²	127	35.3 Å²	35.3	59%	0.588	20%	0.195	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.2	36.4	-176.6	-66.7	-62.4	0	0	0	114.1	C959 T960	C959-H965 WeakPolarHBondContact CB-O 3.1Å; C959-H965 PolarHBondContact SG-O 3.19Å; C959-H965 VanDerWaalsContact SG-O 3.33Å; T960-H965 VanDerWaalsContact O-CA 3.25Å; T960-H965 WeakPolarHBondContact O-CA 3.47Å
966	A	88	Confident	89.7	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	19%	0.186	C	C	.	.			trans	-65.6	136	178.5	0	0	0	0	0	112.4	C959 T960 V962 I963 G964 A970 V971 T995	C959-A966 WeakPolarHBondContact CA-O 3.47Å; T960-A966 PolarHBondContact N-O 3.41Å; V962-A966 PolarHBondContact O-N 3.02Å; I963-A966 HydrophobicContact CB-CB 3.89Å; I963-A966 WeakPolarHBondContact O-CB 3.37Å; G964-A966 VanDerWaalsContact C-N 3.26Å; G964-A966 PolarHBondContact O-N 3.25Å; A966-A970 HydrophobicContact CB-CB 4.21Å; A966-V971 HydrophobicContact CB-CG2 3.68Å; A966-T995 HydrophobicContact CB-CG2 3.64Å
967	P	92.4	Very high	89.7	Confident	13 Å²	13	33.2 Å²	33.2	8%	0.084	18%	0.182	C	C	.	.	B	Isolated β-bridge	trans	-54.7	145.6	163.4	-24.4	34.5	0	0	0	111	L969 A970 V971 T994	P967-L969 PolarHBondContact O-N 3.04Å; P967-L969 VanDerWaalsContact O-N 3.09Å; P967-A970 WeakPolarHBondContact O-CA 3.05Å; P967-A970 WeakPolarHBondContact O-CB 3.34Å; P967-A970 PolarHBondContact O-N 3.45Å; P967-V971 PolarHBondContact O-N 3.46Å; P967-T994 VanDerWaalsContact CD-O 3.29Å; P967-T994 WeakPolarHBondContact CD-O 3.44Å; P967-T994 WeakPolarHBondContact CG-O 3.43Å
968	I	95	Very high	89.8	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-55.1	-32.7	-176.7	-169.5	170.2	0	0	0	113.9	L932 L938 V956 W958 T960 V971 H972 M980 L984	L932-I968 HydrophobicContact CD2-CD1 4.15Å; L932-I968 HydrophobicContact CG-CD1 3.74Å; L938-I968 HydrophobicContact CD2-CD1 4.03Å; L938-I968 HydrophobicContact CD2-CG1 3.84Å; V956-I968 WeakPolarHBondContact O-CG2 3.46Å; W958-I968 PolarHBondContact O-N 3.18Å; T960-I968 HydrophobicContact CG2-CB 4.38Å; I968-V971 PolarHBondContact O-N 3.1Å; I968-H972 PolarHBondContact O-CD2 3.28Å; I968-H972 VanDerWaalsContact O-CD2 3.23Å; I968-H972 PolarHBondContact O-N 2.93Å; I968-M980 HydrophobicContact CD1-CE 4.31Å; I968-L984 HydrophobicContact CG1-CD1 4.31Å; I968-L984 HydrophobicContact CG2-CD1 4.1Å; I968-L984 HydrophobicContact CG2-CD2 3.87Å
969	L	95.6	Very high	89.9	Confident	3 Å²	3	34.2 Å²	34.2	2%	0.016	19%	0.189	C	C	.	.	H	α-helix	trans	-59.6	-45.6	171.6	179.1	67.7	0	0	0	112.5	P967 V971 H972 A973 V981 L984 L985 A989 P990 P1001	P967-L969 PolarHBondContact O-N 3.04Å; P967-L969 VanDerWaalsContact O-N 3.09Å; L969-V971 VanDerWaalsContact C-N 3.32Å; L969-V971 PolarHBondContact O-N 3.3Å; L969-H972 PolarHBondContact O-N 2.83Å; L969-A973 VanDerWaalsContact O-CB 3.26Å; L969-A973 WeakPolarHBondContact O-CB 3.28Å; L969-A973 PolarHBondContact O-N 3.44Å; L969-V981 HydrophobicContact CD1-CB 4.44Å; L969-V981 HydrophobicContact CD1-CG1 3.9Å; L969-V981 HydrophobicContact CD1-CG2 4.49Å; L969-L984 HydrophobicContact CB-CD1 4.42Å; L969-L984 HydrophobicContact CD1-CB 4Å; L969-L984 HydrophobicContact CD1-CD1 4.5Å; L969-L985 HydrophobicContact CD1-CD1 4.47Å; L969-L985 HydrophobicContact CD1-CD2 4.13Å; L969-L985 HydrophobicContact CD1-CG 3.96Å; L969-L985 HydrophobicContact CD2-CD2 3.94Å; L969-A989 HydrophobicContact CB-CB 4.29Å; L969-A989 HydrophobicContact CD1-CB 4.49Å; L969-A989 HydrophobicContact CD2-CB 3.95Å; L969-A989 HydrophobicContact CG-CB 4.47Å; L969-P990 WeakPolarHBondContact CD2-O 3.34Å; L969-P1001 HydrophobicContact CD2-CB 4.47Å; L969-P1001 HydrophobicContact CD2-CG 3.97Å; L969-P1001 HydrophobicContact CG-CB 4.27Å; L969-P1001 HydrophobicContact CG-CG 4.09Å
970	A	93.6	Very high	90.2	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-65.8	-35.7	179	0	0	0	0	0	111.8	A966 P967 H974 T995 P1001 L1004	A966-A970 HydrophobicContact CB-CB 4.21Å; P967-A970 WeakPolarHBondContact O-CA 3.05Å; P967-A970 WeakPolarHBondContact O-CB 3.34Å; P967-A970 PolarHBondContact O-N 3.45Å; A970-H974 PolarHBondContact O-N 3.32Å; A970-H974 VanDerWaalsContact O-N 3.07Å; A970-T995 HydrophobicContact CB-CG2 4.31Å; A970-P1001 HydrophobicContact CB-CB 4.47Å; A970-P1001 HydrophobicContact CB-CG 4.09Å; A970-L1004 HydrophobicContact CB-CD1 3.84Å
971	V	94.1	Very high	90.6	Very high	0 Å²	0	31 Å²	31	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-65	-50.7	174.8	-178.2	0	0	0	0	111.3	L938 T960 I963 A966 P967 I968 L969 A973 H974 L975	L938-V971 HydrophobicContact CD2-CG1 4.28Å; T960-V971 HydrophobicContact CG2-CG2 4.17Å; I963-V971 HydrophobicContact CD1-CB 4.37Å; I963-V971 HydrophobicContact CD1-CG1 4.24Å; I963-V971 HydrophobicContact CD1-CG2 4.27Å; I963-V971 HydrophobicContact CG1-CG2 4.4Å; A966-V971 HydrophobicContact CB-CG2 3.68Å; P967-V971 PolarHBondContact O-N 3.46Å; I968-V971 PolarHBondContact O-N 3.1Å; L969-V971 VanDerWaalsContact C-N 3.32Å; L969-V971 PolarHBondContact O-N 3.3Å; V971-A973 VanDerWaalsContact C-N 3.3Å; V971-A973 PolarHBondContact O-N 3.31Å; V971-H974 PolarHBondContact O-N 3.24Å; V971-L975 HydrophobicContact CG1-CD1 3.83Å; V971-L975 HydrophobicContact CG1-CG 4.44Å; V971-L975 WeakPolarHBondContact O-CG 3.47Å; V971-L975 PolarHBondContact O-N 2.72Å
972	H	95.3	Very high	91.4	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-68.6	-28.6	179.3	-72.2	-54.4	0	0	0	113.7	N937 L938 I968 L969 L975 G976 H977 M980 V981	N937-H972 PolarHBondContact O-CE1 3.5Å; L938-H972 PolarHBondContact O-CE1 2.7Å; L938-H972 VanDerWaalsContact O-CE1 3.24Å; L938-H972 PolarHBondContact O-ND1 2.91Å; I968-H972 PolarHBondContact O-CD2 3.28Å; I968-H972 VanDerWaalsContact O-CD2 3.23Å; I968-H972 PolarHBondContact O-N 2.93Å; L969-H972 PolarHBondContact O-N 2.83Å; H972-L975 PolarHBondContact O-N 3.34Å; H972-G976 PolarHBondContact O-N 2.77Å; H972-H977 HydrophobicContact CB-CB 4.05Å; H972-H977 AromaticContact CE1-ND1 3.74Å; H972-H977 AromaticContact ND1-CG 3.7Å; H972-H977 AromaticContact ND1-ND1 3.12Å; H972-H977 PolarHBondContact ND1-ND1 3.4Å; H972-H977 VanDerWaalsContact ND1-ND1 3.12Å; H972-H977 PolarHBondContact O-N 3.04Å; H972-M980 HydrophobicContact CB-CB 4.45Å; H972-M980 HydrophobicContact CB-CG 4.31Å; H972-M980 WeakPolarHBondContact CD2-CG 3.3Å; H972-M980 WeakPolarHBondContact NE2-CG 3.44Å; H972-V981 HydrophobicContact CB-CG2 3.78Å
973	A	95.3	Very high	92.2	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-66.7	-38.3	171.5	0	0	0	0	0	112.3	L969 V971 V981 P1001 A1005 I1013 L1017	L969-A973 VanDerWaalsContact O-CB 3.26Å; L969-A973 WeakPolarHBondContact O-CB 3.28Å; L969-A973 PolarHBondContact O-N 3.44Å; V971-A973 VanDerWaalsContact C-N 3.3Å; V971-A973 PolarHBondContact O-N 3.31Å; A973-V981 HydrophobicContact CB-CG2 4.29Å; A973-P1001 HydrophobicContact CB-CB 3.89Å; A973-P1001 WeakPolarHBondContact CB-O 3.24Å; A973-A1005 HydrophobicContact CB-CB 4.3Å; A973-A1005 WeakPolarHBondContact O-CA 3.38Å; A973-I1013 HydrophobicContact CB-CG2 4.04Å; A973-L1017 HydrophobicContact CB-CD1 4.46Å
974	H	93.6	Very high	93.2	Very high	70 Å²	70	25.9 Å²	25.9	32%	0.324	15%	0.148	S	C	.	.	H	α-helix	trans	-70.9	-33.6	174.4	-172.6	57.6	0	0	0	113.8	I963 A970 V971 L1004 A1008 H1010	I963-H974 HydrophobicContact CD1-CB 3.7Å; I963-H974 VanDerWaalsContact CD1-CD2 3.49Å; I963-H974 WeakPolarHBondContact CD1-CD2 3.15Å; A970-H974 PolarHBondContact O-N 3.32Å; A970-H974 VanDerWaalsContact O-N 3.07Å; V971-H974 PolarHBondContact O-N 3.24Å; H974-L1004 HydrophobicContact CB-CB 4.07Å; H974-A1008 WeakPolarHBondContact O-CB 3.26Å; H974-H1010 PolarHBondContact O-NE2 2.92Å
975	L	92.1	Very high	94.3	Very high	38 Å²	38	24.5 Å²	24.5	20%	0.199	13%	0.13	C	C	.	.	H	α-helix	trans	-88.7	-5.6	-175.9	-63.7	175.9	0	0	0	114.4	Y632 L938 Y939 V971 H972 H977	Y632-L975 PolarHBondContact OH-O 3.45Å; L938-L975 WeakPolarHBondContact O-CD1 3.47Å; Y939-L975 HydrophobicContact CD1-CD1 3.86Å; Y939-L975 HydrophobicContact CD1-CD2 4.15Å; Y939-L975 HydrophobicContact CE1-CD1 3.88Å; Y939-L975 HydrophobicContact CE1-CD2 3.72Å; Y939-L975 HydrophobicContact CE1-CG 4.49Å; Y939-L975 HydrophobicContact CG-CD1 4.36Å; V971-L975 HydrophobicContact CG1-CD1 3.83Å; V971-L975 HydrophobicContact CG1-CG 4.44Å; V971-L975 WeakPolarHBondContact O-CG 3.47Å; V971-L975 PolarHBondContact O-N 2.72Å; H972-L975 PolarHBondContact O-N 3.34Å; L975-H977 WeakPolarHBondContact CB-NE2 3.49Å; L975-H977 PolarHBondContact O-CD2 3.44Å
976	G	94.1	Very high	95	Very high	10 Å²	10	23.9 Å²	23.9	10%	0.103	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	87.5	16.4	177.3	0	0	0	0	0	115.3	H972 V978 H1010 I1013	H972-G976 PolarHBondContact O-N 2.77Å; G976-V978 VanDerWaalsContact C-N 3.33Å; G976-V978 PolarHBondContact O-N 3.14Å; G976-H1010 WeakPolarHBondContact CA-CD2 3.24Å; G976-H1010 VanDerWaalsContact CA-NE2 3.34Å; G976-H1010 WeakPolarHBondContact CA-NE2 3.22Å; G976-H1010 PolarHBondContact N-CD2 3.14Å; G976-H1010 VanDerWaalsContact N-CD2 3.33Å; G976-H1010 PolarHBondContact N-NE2 2.88Å; G976-I1013 VanDerWaalsContact C-CD1 3.48Å
977	H	95	Very high	95.3	Very high	8 Å²	8	26.4 Å²	26.4	4%	0.037	14%	0.14	C	C	.	.			trans	-85.9	69.7	-169.5	-61.1	-167.5	0	0	0	111.5	Y632 L938 Y939 P941 H972 L975 E979 M980 V981	Y632-H977 AromaticContact CD1-NE2 3.81Å; Y632-H977 AromaticContact CE1-CD2 3.29Å; Y632-H977 WeakPolarHBondContact CE1-CD2 3.42Å; Y632-H977 AromaticContact CE1-CE1 3.78Å; Y632-H977 AromaticContact CE1-NE2 3.1Å; Y632-H977 WeakPolarHBondContact CE1-NE2 3.47Å; Y632-H977 AromaticContact CZ-CD2 3.29Å; Y632-H977 AromaticContact CZ-NE2 3.62Å; Y632-H977 PolarHBondContact OH-CD2 3.19Å; Y632-H977 VanDerWaalsContact OH-CD2 3.32Å; L938-H977 PolarHBondContact O-CE1 3.13Å; L938-H977 PolarHBondContact O-ND1 3.24Å; Y939-H977 PolarHBondContact O-CE1 2.85Å; P941-H977 WeakPolarHBondContact CD-ND1 3.49Å; P941-H977 WeakPolarHBondContact CG-ND1 3.29Å; H972-H977 HydrophobicContact CB-CB 4.05Å; H972-H977 AromaticContact CE1-ND1 3.74Å; H972-H977 AromaticContact ND1-CG 3.7Å; H972-H977 AromaticContact ND1-ND1 3.12Å; H972-H977 PolarHBondContact ND1-ND1 3.4Å; H972-H977 VanDerWaalsContact ND1-ND1 3.12Å; H972-H977 PolarHBondContact O-N 3.04Å; L975-H977 WeakPolarHBondContact CB-NE2 3.49Å; L975-H977 PolarHBondContact O-CD2 3.44Å; H977-E979 PolarHBondContact O-N 3.03Å; H977-M980 HydrophobicContact CB-CB 3.96Å; H977-M980 PolarHBondContact O-N 3.35Å; H977-V981 PolarHBondContact O-N 3.06Å
978	V	95.4	Very high	95.4	Very high	58 Å²	58	28.5 Å²	28.5	35%	0.352	16%	0.163	S	C	.	.	H	α-helix	trans	-48.3	-51.1	-171.4	-171.2	0	0	0	0	113.2	G976 M980 V981 A982 D1012 I1013 L1016	G976-V978 VanDerWaalsContact C-N 3.33Å; G976-V978 PolarHBondContact O-N 3.14Å; V978-M980 VanDerWaalsContact C-N 3.32Å; V978-M980 PolarHBondContact O-N 2.68Å; V978-V981 PolarHBondContact O-N 3.2Å; V978-A982 WeakPolarHBondContact O-CB 3.48Å; V978-A982 PolarHBondContact O-N 3.33Å; V978-D1012 HydrophobicContact CG2-CB 4.33Å; V978-I1013 HydrophobicContact CB-CG1 4.44Å; V978-I1013 HydrophobicContact CG2-CD1 4.24Å; V978-I1013 HydrophobicContact CG2-CG1 3.87Å; V978-L1016 HydrophobicContact CG1-CD2 4.47Å
979	E	95.5	Very high	95.5	Very high	129 Å²	129	28.7 Å²	28.7	60%	0.603	17%	0.165	S	C	*	.	H	α-helix	trans	-63	-36.7	-179.9	-65.2	-168.4	178.6	0	0	112.9	I943 H977 A982 L983	I943-E979 HydrophobicContact CD1-CB 4.05Å; I943-E979 HydrophobicContact CG1-CB 4.34Å; H977-E979 PolarHBondContact O-N 3.03Å; E979-A982 PolarHBondContact O-N 3.19Å; E979-L983 VanDerWaalsContact O-CB 3.29Å; E979-L983 WeakPolarHBondContact O-CB 3.25Å; E979-L983 PolarHBondContact O-N 2.95Å
980	M	96.6	Very high	95.4	Very high	1 Å²	1	31.5 Å²	31.5	1%	0.005	18%	0.183	C	C	.	.	H	α-helix	trans	-74.1	-36.5	-179.7	-170.6	59.9	-179.2	0	0	111.3	L932 P941 I943 M950 I968 H972 H977 V978 L983 L984	L932-M980 HydrophobicContact CD1-CE 4.02Å; P941-M980 HydrophobicContact CB-CB 4.44Å; P941-M980 HydrophobicContact CB-CG 4.27Å; P941-M980 HydrophobicContact CB-SD 4.45Å; I943-M980 HydrophobicContact CD1-CB 3.72Å; I943-M980 HydrophobicContact CD1-CG 4.37Å; I943-M980 HydrophobicContact CD1-SD 4.05Å; M950-M980 HydrophobicContact CE-CE 4.35Å; I968-M980 HydrophobicContact CD1-CE 4.31Å; H972-M980 HydrophobicContact CB-CB 4.45Å; H972-M980 HydrophobicContact CB-CG 4.31Å; H972-M980 WeakPolarHBondContact CD2-CG 3.3Å; H972-M980 WeakPolarHBondContact NE2-CG 3.44Å; H977-M980 HydrophobicContact CB-CB 3.96Å; H977-M980 PolarHBondContact O-N 3.35Å; V978-M980 VanDerWaalsContact C-N 3.32Å; V978-M980 PolarHBondContact O-N 2.68Å; M980-L983 HydrophobicContact SD-CD2 4.03Å; M980-L984 HydrophobicContact CE-CD1 4.22Å; M980-L984 HydrophobicContact CE-CG 4.39Å; M980-L984 HydrophobicContact CG-CD1 4.32Å; M980-L984 WeakPolarHBondContact O-CB 3.05Å; M980-L984 WeakPolarHBondContact O-CG 3.34Å; M980-L984 PolarHBondContact O-N 3.16Å
981	V	97.3	Very high	95.4	Very high	0 Å²	0	33 Å²	33	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-63.4	-46.1	169.9	171.4	0	0	0	0	110.6	L969 H972 A973 H977 V978 L983 L984 L985 I1013 L1016 L1017	L969-V981 HydrophobicContact CD1-CB 4.44Å; L969-V981 HydrophobicContact CD1-CG1 3.9Å; L969-V981 HydrophobicContact CD1-CG2 4.49Å; H972-V981 HydrophobicContact CB-CG2 3.78Å; A973-V981 HydrophobicContact CB-CG2 4.29Å; H977-V981 PolarHBondContact O-N 3.06Å; V978-V981 PolarHBondContact O-N 3.2Å; V981-L983 PolarHBondContact O-N 3.1Å; V981-L984 PolarHBondContact O-N 2.94Å; V981-L985 HydrophobicContact CG1-CD1 3.6Å; V981-L985 HydrophobicContact CG1-CG 4.39Å; V981-L985 WeakPolarHBondContact O-CB 3.21Å; V981-L985 WeakPolarHBondContact O-CD1 3.18Å; V981-L985 VanDerWaalsContact O-CG 3.23Å; V981-L985 WeakPolarHBondContact O-CG 3.5Å; V981-L985 PolarHBondContact O-N 3.5Å; V981-I1013 HydrophobicContact CG1-CG2 4.24Å; V981-I1013 HydrophobicContact CG2-CD1 4.21Å; V981-I1013 HydrophobicContact CG2-CG2 4.43Å; V981-L1016 HydrophobicContact CB-CD2 4.42Å; V981-L1016 HydrophobicContact CG1-CD2 3.91Å; V981-L1017 HydrophobicContact CG1-CD2 4.43Å
982	A	97.1	Very high	95.2	Very high	38 Å²	38	35.1 Å²	35.1	31%	0.314	20%	0.204	S	C	.	.	H	α-helix	trans	-59.4	-46.4	176.8	0	0	0	0	0	111.9	V978 E979 L985 E986 L1016	V978-A982 WeakPolarHBondContact O-CB 3.48Å; V978-A982 PolarHBondContact O-N 3.33Å; E979-A982 PolarHBondContact O-N 3.19Å; A982-L985 PolarHBondContact O-N 2.89Å; A982-E986 WeakPolarHBondContact O-CB 3.25Å; A982-E986 PolarHBondContact O-N 3.21Å; A982-L1016 HydrophobicContact CB-CD2 3.93Å
983	L	97.1	Very high	94.8	Very high	4 Å²	4	35.8 Å²	35.8	2%	0.021	21%	0.21	C	C	.	.	H	α-helix	trans	-61	-43.7	175.7	170.5	61.2	0	0	0	112.5	I943 R947 M950 E979 M980 V981 E986 M987	I943-L983 HydrophobicContact CG2-CD2 3.93Å; R947-L983 HydrophobicContact CB-CD1 3.88Å; R947-L983 HydrophobicContact CB-CD2 4.01Å; R947-L983 HydrophobicContact CG-CD1 3.97Å; R947-L983 VanDerWaalsContact CZ-CD1 3.47Å; M950-L983 HydrophobicContact CE-CD1 4.16Å; M950-L983 HydrophobicContact CE-CD2 3.49Å; M950-L983 VanDerWaalsContact CE-CD2 3.49Å; M950-L983 HydrophobicContact CE-CG 3.56Å; E979-L983 VanDerWaalsContact O-CB 3.29Å; E979-L983 WeakPolarHBondContact O-CB 3.25Å; E979-L983 PolarHBondContact O-N 2.95Å; M980-L983 HydrophobicContact SD-CD2 4.03Å; V981-L983 PolarHBondContact O-N 3.1Å; L983-E986 WeakPolarHBondContact O-CB 3.43Å; L983-E986 PolarHBondContact O-N 3.22Å; L983-M987 HydrophobicContact CD1-CG 4Å; L983-M987 WeakPolarHBondContact O-CB 3.38Å; L983-M987 WeakPolarHBondContact O-CG 3.41Å; L983-M987 PolarHBondContact O-N 3.14Å
984	L	97.6	Very high	94.4	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-64.5	-41	177.6	-78.9	165.1	0	0	0	111.7	M950 V956 I968 L969 M980 V981 M987 G988 A989	M950-L984 HydrophobicContact CE-CD2 4.38Å; M950-L984 HydrophobicContact SD-CD2 3.65Å; M950-L984 HydrophobicContact SD-CG 4.44Å; V956-L984 HydrophobicContact CB-CD2 4.08Å; V956-L984 HydrophobicContact CG1-CD2 4.07Å; I968-L984 HydrophobicContact CG1-CD1 4.31Å; I968-L984 HydrophobicContact CG2-CD1 4.1Å; I968-L984 HydrophobicContact CG2-CD2 3.87Å; L969-L984 HydrophobicContact CB-CD1 4.42Å; L969-L984 HydrophobicContact CD1-CB 4Å; L969-L984 HydrophobicContact CD1-CD1 4.5Å; M980-L984 HydrophobicContact CE-CD1 4.22Å; M980-L984 HydrophobicContact CE-CG 4.39Å; M980-L984 HydrophobicContact CG-CD1 4.32Å; M980-L984 WeakPolarHBondContact O-CB 3.05Å; M980-L984 WeakPolarHBondContact O-CG 3.34Å; M980-L984 PolarHBondContact O-N 3.16Å; V981-L984 PolarHBondContact O-N 2.94Å; L984-M987 CarbonylContact O-C 3.41Å; L984-M987 PolarHBondContact O-N 3.19Å; L984-G988 PolarHBondContact O-N 3.31Å; L984-A989 HydrophobicContact CB-CB 3.96Å; L984-A989 WeakPolarHBondContact O-CB 3.45Å; L984-A989 PolarHBondContact O-N 3.3Å
985	L	96.9	Very high	94	Very high	16 Å²	16	36.3 Å²	36.3	8%	0.084	22%	0.219	C	C	.	.	H	α-helix	trans	-70.2	-31.1	176.3	-66.1	164.6	0	0	0	112.6	L969 V981 A982 G988 V991 L1016 L1017 K1020	L969-L985 HydrophobicContact CD1-CD1 4.47Å; L969-L985 HydrophobicContact CD1-CD2 4.13Å; L969-L985 HydrophobicContact CD1-CG 3.96Å; L969-L985 HydrophobicContact CD2-CD2 3.94Å; V981-L985 HydrophobicContact CG1-CD1 3.6Å; V981-L985 HydrophobicContact CG1-CG 4.39Å; V981-L985 WeakPolarHBondContact O-CB 3.21Å; V981-L985 WeakPolarHBondContact O-CD1 3.18Å; V981-L985 VanDerWaalsContact O-CG 3.23Å; V981-L985 WeakPolarHBondContact O-CG 3.5Å; V981-L985 PolarHBondContact O-N 3.5Å; A982-L985 PolarHBondContact O-N 2.89Å; L985-G988 PolarHBondContact O-N 3.38Å; L985-V991 HydrophobicContact CD2-CB 4.32Å; L985-V991 HydrophobicContact CD2-CG1 4.1Å; L985-V991 HydrophobicContact CD2-CG2 3.93Å; L985-L1016 HydrophobicContact CD1-CD2 4.36Å; L985-L1016 HydrophobicContact CD1-CG 4.14Å; L985-L1017 HydrophobicContact CD1-CD2 3.9Å; L985-L1017 HydrophobicContact CD2-CD2 4.31Å; L985-K1020 HydrophobicContact CD1-CG 4.23Å
986	E	96.5	Very high	93.6	Very high	114 Å²	114	38 Å²	38	53%	0.533	25%	0.245	S	C	.	.	H	α-helix	trans	-65.3	-42.5	169.7	-172.6	-164.9	148.9	0	0	111.2	R947 A982 L983 G988	R947-E986 IonicContact CZ-OE1 3.5Å; R947-E986 IonicContact CZ-OE2 2.73Å; R947-E986 IonicContact NH1-OE1 3.34Å; R947-E986 PolarHBondContact NH1-OE1 3.13Å; R947-E986 IonicContact NH1-OE2 3.54Å; R947-E986 PolarHBondContact NH1-OE2 2.7Å; R947-E986 IonicContact NH2-OE1 3.37Å; R947-E986 PolarHBondContact NH2-OE1 2.9Å; R947-E986 IonicContact NH2-OE2 3.52Å; R947-E986 PolarHBondContact NH2-OE2 3.32Å; A982-E986 WeakPolarHBondContact O-CB 3.25Å; A982-E986 PolarHBondContact O-N 3.21Å; L983-E986 WeakPolarHBondContact O-CB 3.43Å; L983-E986 PolarHBondContact O-N 3.22Å; E986-G988 PolarHBondContact O-N 3.02Å
987	M	96.1	Very high	93	Very high	53 Å²	53	41.7 Å²	41.7	26%	0.261	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.2	14.2	177	-63	-58.1	-63.7	0	0	113.8	M950 V956 L983 L984	M950-M987 HydrophobicContact CB-CE 3.85Å; M950-M987 HydrophobicContact CB-CG 4.1Å; M950-M987 HydrophobicContact SD-CB 3.97Å; M950-M987 HydrophobicContact SD-CG 3.95Å; V956-M987 HydrophobicContact CG1-CB 3.81Å; L983-M987 HydrophobicContact CD1-CG 4Å; L983-M987 WeakPolarHBondContact O-CB 3.38Å; L983-M987 WeakPolarHBondContact O-CG 3.41Å; L983-M987 PolarHBondContact O-N 3.14Å; L984-M987 CarbonylContact O-C 3.41Å; L984-M987 PolarHBondContact O-N 3.19Å
988	G	94.7	Very high	92.6	Very high	56 Å²	56	43.1 Å²	43.1	58%	0.577	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.1	21.6	170.1	0	0	0	0	0	116.4	L984 L985 E986	L984-G988 PolarHBondContact O-N 3.31Å; L985-G988 PolarHBondContact O-N 3.38Å; E986-G988 PolarHBondContact O-N 3.02Å
989	A	95.8	Very high	92.2	Very high	5 Å²	5	42 Å²	42	4%	0.041	28%	0.278	C	S	.	.			trans	-60.6	136.7	173.9	0	0	0	0	0	111.8	V956 L969 L984 V991	V956-A989 HydrophobicContact CB-CB 4.05Å; V956-A989 HydrophobicContact CG2-CB 4.23Å; L969-A989 HydrophobicContact CB-CB 4.29Å; L969-A989 HydrophobicContact CD1-CB 4.49Å; L969-A989 HydrophobicContact CD2-CB 3.95Å; L969-A989 HydrophobicContact CG-CB 4.47Å; L984-A989 HydrophobicContact CB-CB 3.96Å; L984-A989 WeakPolarHBondContact O-CB 3.45Å; L984-A989 PolarHBondContact O-N 3.3Å; A989-V991 PolarHBondContact O-N 3.41Å
990	P	93.8	Very high	92	Very high	61 Å²	61	36.3 Å²	36.3	40%	0.396	25%	0.252	S	S	.	.			trans	-69.5	116.5	-178.9	28	-34.1	0	0	0	110.7	T957 L969 D992 G993	T957-P990 HydrophobicContact CG2-CG 3.83Å; L969-P990 WeakPolarHBondContact CD2-O 3.34Å; P990-D992 VanDerWaalsContact C-N 3.27Å; P990-D992 PolarHBondContact O-N 2.94Å; P990-G993 PolarHBondContact O-N 3.32Å
991	V	94	Very high	91.8	Very high	31 Å²	31	36.3 Å²	36.3	19%	0.188	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59	-36.5	-171.3	-158.5	0	0	0	0	113	L985 A989 P1001 L1017 K1020 A1022	L985-V991 HydrophobicContact CD2-CB 4.32Å; L985-V991 HydrophobicContact CD2-CG1 4.1Å; L985-V991 HydrophobicContact CD2-CG2 3.93Å; A989-V991 PolarHBondContact O-N 3.41Å; V991-P1001 WeakPolarHBondContact O-CD 3.44Å; V991-P1001 WeakPolarHBondContact O-CG 3.44Å; V991-L1017 HydrophobicContact CG1-CD2 3.75Å; V991-K1020 HydrophobicContact CG1-CB 4.23Å; V991-K1020 HydrophobicContact CG2-CB 4.32Å; V991-A1022 HydrophobicContact CG1-CB 3.68Å
992	D	89.7	Confident	91.7	Very high	46 Å²	46	36.9 Å²	36.9	25%	0.246	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.6	15.1	177.7	-56.9	-40.1	0	0	0	113.2	P990 T994 A1022 K1023	P990-D992 VanDerWaalsContact C-N 3.27Å; P990-D992 PolarHBondContact O-N 2.94Å; D992-T994 PolarHBondContact O-N 2.92Å; D992-A1022 WeakPolarHBondContact OD1-CA 3.41Å; D992-K1023 PolarHBondContact OD1-N 3.43Å; D992-K1023 WeakPolarHBondContact OD2-CG 3.49Å; D992-K1023 IonicContact OD2-NZ 2.73Å; D992-K1023 PolarHBondContact OD2-NZ 3.1Å
993	G	86.4	Confident	91.3	Very high	13 Å²	13	35.7 Å²	35.7	13%	0.134	24%	0.244	C	C	.	.			trans	-62.8	103.9	-172.9	0	0	0	0	0	113.6	P990 P1001	P990-G993 PolarHBondContact O-N 3.32Å; G993-P1001 WeakPolarHBondContact O-CD 3.32Å
994	T	86.9	Confident	91.1	Very high	76 Å²	76	36 Å²	36	47%	0.466	25%	0.246	S	C	.	.			trans	-76.6	151.4	-171.5	53.3	0	0	0	0	114.7	P967 D992 G998 M999 T1000	P967-T994 VanDerWaalsContact CD-O 3.29Å; P967-T994 WeakPolarHBondContact CD-O 3.44Å; P967-T994 WeakPolarHBondContact CG-O 3.43Å; D992-T994 PolarHBondContact O-N 2.92Å; T994-G998 WeakPolarHBondContact CG2-O 3.49Å; T994-M999 CarbonylContact C-O 3.43Å; T994-M999 VanDerWaalsContact CA-O 3.25Å; T994-M999 WeakPolarHBondContact CA-O 3.38Å; T994-T1000 HydrophobicContact CG2-CG2 4.09Å
995	T	86.1	Confident	90.9	Very high	6 Å²	6	36 Å²	36	4%	0.037	25%	0.246	C	C	.	.			trans	-67.5	172.6	164	67	0	0	0	0	112.3	A966 A970 S997 G998 M999 L1004	A966-T995 HydrophobicContact CB-CG2 3.64Å; A970-T995 HydrophobicContact CB-CG2 4.31Å; T995-S997 PolarHBondContact O-N 3.28Å; T995-S997 VanDerWaalsContact O-N 3.14Å; T995-S997 PolarHBondContact OG1-N 3.23Å; T995-S997 VanDerWaalsContact OG1-N 3.13Å; T995-S997 PolarHBondContact OG1-OG 2.88Å; T995-G998 PolarHBondContact O-N 2.84Å; T995-G998 PolarHBondContact OG1-N 2.89Å; T995-M999 HydrophobicContact CG2-CB 4.16Å; T995-M999 PolarHBondContact N-O 3.05Å; T995-M999 PolarHBondContact OG1-N 3.02Å; T995-M999 VanDerWaalsContact OG1-N 3.13Å; T995-L1004 HydrophobicContact CG2-CD1 3.8Å
996	G	82.5	Confident	90.7	Very high	73 Å²	73	37.1 Å²	37.1	75%	0.753	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-11.3	168.5	0	0	0	0	0	114.5	G964	G964-G996 WeakPolarHBondContact O-CA 3.33Å; G964-G996 PolarHBondContact O-N 3.21Å
997	S	82.1	Confident	90.5	Very high	87 Å²	87	34.5 Å²	34.5	61%	0.608	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.5	8.6	171.3	57	0	0	0	0	113.8	T995 M999	T995-S997 PolarHBondContact O-N 3.28Å; T995-S997 VanDerWaalsContact O-N 3.14Å; T995-S997 PolarHBondContact OG1-N 3.23Å; T995-S997 VanDerWaalsContact OG1-N 3.13Å; T995-S997 PolarHBondContact OG1-OG 2.88Å; S997-M999 VanDerWaalsContact C-N 3.28Å; S997-M999 PolarHBondContact O-N 3.1Å
998	G	86.1	Confident	90.2	Very high	39 Å²	39	33.7 Å²	33.7	40%	0.402	26%	0.257	S	S	.	.			trans	78	2.4	178.4	0	0	0	0	0	115.4	T994 T995	T994-G998 WeakPolarHBondContact CG2-O 3.49Å; T995-G998 PolarHBondContact O-N 2.84Å; T995-G998 PolarHBondContact OG1-N 2.89Å
999	M	87	Confident	90.2	Very high	33 Å²	33	33.8 Å²	33.8	16%	0.163	26%	0.258	C	S	.	.			trans	-72.9	130.6	178.4	-72.3	-73.5	-78	0	0	110.9	T994 T995 S997 C1003 L1004 V1029	T994-M999 CarbonylContact C-O 3.43Å; T994-M999 VanDerWaalsContact CA-O 3.25Å; T994-M999 WeakPolarHBondContact CA-O 3.38Å; T995-M999 HydrophobicContact CG2-CB 4.16Å; T995-M999 PolarHBondContact N-O 3.05Å; T995-M999 PolarHBondContact OG1-N 3.02Å; T995-M999 VanDerWaalsContact OG1-N 3.13Å; S997-M999 VanDerWaalsContact C-N 3.28Å; S997-M999 PolarHBondContact O-N 3.1Å; M999-C1003 HydrophobicContact CE-CB 3.67Å; M999-C1003 HydrophobicContact SD-CB 4.08Å; M999-L1004 HydrophobicContact CB-CD1 4.34Å; M999-L1004 HydrophobicContact CB-CD2 4.3Å; M999-L1004 HydrophobicContact CB-CG 4.1Å; M999-L1004 HydrophobicContact CE-CD2 3.9Å; M999-L1004 HydrophobicContact CE-CG 4.21Å; M999-V1029 HydrophobicContact SD-CG2 3.75Å
1000	T	91.5	Very high	90.2	Very high	11 Å²	11	36.3 Å²	36.3	7%	0.067	27%	0.269	C	S	.	.			trans	-80.1	162.1	172.6	68.3	0	0	0	0	111.2	T994 L1002 C1003 L1004	T994-T1000 HydrophobicContact CG2-CG2 4.09Å; T1000-L1002 PolarHBondContact O-N 3.13Å; T1000-L1002 PolarHBondContact OG1-N 3.32Å; T1000-C1003 PolarHBondContact O-N 3.14Å; T1000-C1003 PolarHBondContact OG1-N 2.97Å; T1000-C1003 VanDerWaalsContact OG1-N 3.15Å; T1000-C1003 PolarHBondContact OG1-SG 3.46Å; T1000-L1004 PolarHBondContact O-N 2.9Å; T1000-L1004 VanDerWaalsContact O-N 3.15Å
1001	P	93.4	Very high	90.2	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-57.9	-32.4	171.5	-23	34.7	0	0	0	112.4	L969 A970 A973 V991 G993 L1004 A1005 L1017	L969-P1001 HydrophobicContact CD2-CB 4.47Å; L969-P1001 HydrophobicContact CD2-CG 3.97Å; L969-P1001 HydrophobicContact CG-CB 4.27Å; L969-P1001 HydrophobicContact CG-CG 4.09Å; A970-P1001 HydrophobicContact CB-CB 4.47Å; A970-P1001 HydrophobicContact CB-CG 4.09Å; A973-P1001 HydrophobicContact CB-CB 3.89Å; A973-P1001 WeakPolarHBondContact CB-O 3.24Å; V991-P1001 WeakPolarHBondContact O-CD 3.44Å; V991-P1001 WeakPolarHBondContact O-CG 3.44Å; G993-P1001 WeakPolarHBondContact O-CD 3.32Å; P1001-L1004 PolarHBondContact O-N 3.16Å; P1001-A1005 WeakPolarHBondContact O-CB 3.48Å; P1001-A1005 PolarHBondContact O-N 3.3Å; P1001-L1017 HydrophobicContact CB-CD1 4.04Å; P1001-L1017 HydrophobicContact CB-CD2 4.4Å
1002	L	93.9	Very high	90.3	Very high	13 Å²	13	41 Å²	41	7%	0.068	30%	0.299	C	S	.	.	H	α-helix	trans	-65.8	-48.9	177.9	-176.1	67.9	0	0	0	111.7	T1000 L1004 A1005 A1006 V1014 L1017 A1022 V1024	T1000-L1002 PolarHBondContact O-N 3.13Å; T1000-L1002 PolarHBondContact OG1-N 3.32Å; L1002-L1004 VanDerWaalsContact C-N 3.29Å; L1002-L1004 PolarHBondContact O-N 3.48Å; L1002-A1005 PolarHBondContact O-N 2.98Å; L1002-A1006 WeakPolarHBondContact O-CB 3.47Å; L1002-A1006 PolarHBondContact O-N 2.84Å; L1002-V1014 HydrophobicContact CD1-CB 4.36Å; L1002-V1014 HydrophobicContact CD1-CG1 3.98Å; L1002-V1014 HydrophobicContact CD1-CG2 4.43Å; L1002-L1017 HydrophobicContact CB-CD1 4.29Å; L1002-L1017 HydrophobicContact CD1-CB 3.98Å; L1002-L1017 HydrophobicContact CD1-CD1 4.35Å; L1002-A1022 HydrophobicContact CB-CB 4.35Å; L1002-A1022 HydrophobicContact CD1-CB 4.5Å; L1002-A1022 HydrophobicContact CD2-CB 4.07Å; L1002-V1024 HydrophobicContact CD2-CG2 4.11Å
1003	C	89.9	Confident	90.7	Very high	12 Å²	12	38.8 Å²	38.8	8%	0.081	29%	0.287	C	S	.	.	H	α-helix	trans	-62.1	-37.4	177.2	-62.2	0	0	0	0	111.8	M999 T1000 A1007	M999-C1003 HydrophobicContact CE-CB 3.67Å; M999-C1003 HydrophobicContact SD-CB 4.08Å; T1000-C1003 PolarHBondContact O-N 3.14Å; T1000-C1003 PolarHBondContact OG1-N 2.97Å; T1000-C1003 VanDerWaalsContact OG1-N 3.15Å; T1000-C1003 PolarHBondContact OG1-SG 3.46Å; C1003-A1007 VanDerWaalsContact O-CB 3.26Å; C1003-A1007 WeakPolarHBondContact O-CB 3.32Å; C1003-A1007 PolarHBondContact O-N 3.38Å
1004	L	91.7	Very high	91.1	Very high	12 Å²	12	40.1 Å²	40.1	6%	0.063	29%	0.293	C	S	.	.	H	α-helix	trans	-70.7	-37.4	178.1	-72.2	169	0	0	0	113.5	I963 A970 H974 T995 M999 T1000 P1001 L1002 A1008	I963-L1004 HydrophobicContact CG2-CD2 4.4Å; A970-L1004 HydrophobicContact CB-CD1 3.84Å; H974-L1004 HydrophobicContact CB-CB 4.07Å; T995-L1004 HydrophobicContact CG2-CD1 3.8Å; M999-L1004 HydrophobicContact CB-CD1 4.34Å; M999-L1004 HydrophobicContact CB-CD2 4.3Å; M999-L1004 HydrophobicContact CB-CG 4.1Å; M999-L1004 HydrophobicContact CE-CD2 3.9Å; M999-L1004 HydrophobicContact CE-CG 4.21Å; T1000-L1004 PolarHBondContact O-N 2.9Å; T1000-L1004 VanDerWaalsContact O-N 3.15Å; P1001-L1004 PolarHBondContact O-N 3.16Å; L1002-L1004 VanDerWaalsContact C-N 3.29Å; L1002-L1004 PolarHBondContact O-N 3.48Å; L1004-A1008 VanDerWaalsContact O-CB 3.32Å; L1004-A1008 WeakPolarHBondContact O-CB 3.5Å; L1004-A1008 PolarHBondContact O-N 3.44Å; L1004-A1008 VanDerWaalsContact O-N 3.17Å
1005	A	94.3	Very high	91.5	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-69.1	-40.6	173.6	0	0	0	0	0	112	A973 P1001 L1002 A1008 G1009 H1010 I1013 V1014 L1017	A973-A1005 HydrophobicContact CB-CB 4.3Å; A973-A1005 WeakPolarHBondContact O-CA 3.38Å; P1001-A1005 WeakPolarHBondContact O-CB 3.48Å; P1001-A1005 PolarHBondContact O-N 3.3Å; L1002-A1005 PolarHBondContact O-N 2.98Å; A1005-A1008 PolarHBondContact O-N 2.8Å; A1005-G1009 PolarHBondContact O-N 3.25Å; A1005-G1009 VanDerWaalsContact O-N 3.11Å; A1005-H1010 HydrophobicContact CB-CB 4.46Å; A1005-H1010 PolarHBondContact O-N 3.32Å; A1005-I1013 HydrophobicContact CB-CB 4.03Å; A1005-I1013 HydrophobicContact CB-CG2 3.58Å; A1005-V1014 HydrophobicContact CB-CG2 3.94Å; A1005-L1017 HydrophobicContact CB-CD1 4.39Å
1006	A	92.9	Very high	92	Very high	39 Å²	39	40.1 Å²	40.1	32%	0.322	29%	0.293	S	S	.	.	H	α-helix	trans	-63.8	-48.8	176	0	0	0	0	0	111.6	L1002 A1008 G1009 V1014	L1002-A1006 WeakPolarHBondContact O-CB 3.47Å; L1002-A1006 PolarHBondContact O-N 2.84Å; A1006-A1008 PolarHBondContact O-N 3.31Å; A1006-G1009 PolarHBondContact O-N 2.96Å; A1006-V1014 HydrophobicContact CB-CG2 4.1Å
1007	A	90.8	Very high	92.6	Very high	59 Å²	59	36.7 Å²	36.7	49%	0.488	26%	0.258	S	S	.	.	H	α-helix	trans	-63.2	-25.9	177.2	0	0	0	0	0	113.7	C1003	C1003-A1007 VanDerWaalsContact O-CB 3.26Å; C1003-A1007 WeakPolarHBondContact O-CB 3.32Å; C1003-A1007 PolarHBondContact O-N 3.38Å
1008	A	90.9	Very high	93.2	Very high	35 Å²	35	35.1 Å²	35.1	29%	0.289	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.2	-3.4	173.6	0	0	0	0	0	114.1	H974 L1004 A1005 A1006 H1010	H974-A1008 WeakPolarHBondContact O-CB 3.26Å; L1004-A1008 VanDerWaalsContact O-CB 3.32Å; L1004-A1008 WeakPolarHBondContact O-CB 3.5Å; L1004-A1008 PolarHBondContact O-N 3.44Å; L1004-A1008 VanDerWaalsContact O-N 3.17Å; A1005-A1008 PolarHBondContact O-N 2.8Å; A1006-A1008 PolarHBondContact O-N 3.31Å; A1008-H1010 VanDerWaalsContact CB-CD2 3.41Å; A1008-H1010 WeakPolarHBondContact CB-CD2 3.39Å
1009	G	94.3	Very high	93.5	Very high	59 Å²	59	41 Å²	41	61%	0.608	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.9	14.9	179.6	0	0	0	0	0	115.4	A1005 A1006 A1011	A1005-G1009 PolarHBondContact O-N 3.25Å; A1005-G1009 VanDerWaalsContact O-N 3.11Å; A1006-G1009 PolarHBondContact O-N 2.96Å; G1009-A1011 VanDerWaalsContact C-N 3.33Å; G1009-A1011 PolarHBondContact O-N 3.4Å
1010	H	95.8	Very high	93.8	Very high	58 Å²	58	44.9 Å²	44.9	27%	0.269	28%	0.276	S	S	.	.			trans	-83.2	71.8	-175.5	-62.5	-43.1	0	0	0	112.4	H974 G976 A1005 A1008 D1012 I1013 V1014	H974-H1010 PolarHBondContact O-NE2 2.92Å; G976-H1010 WeakPolarHBondContact CA-CD2 3.24Å; G976-H1010 VanDerWaalsContact CA-NE2 3.34Å; G976-H1010 WeakPolarHBondContact CA-NE2 3.22Å; G976-H1010 PolarHBondContact N-CD2 3.14Å; G976-H1010 VanDerWaalsContact N-CD2 3.33Å; G976-H1010 PolarHBondContact N-NE2 2.88Å; A1005-H1010 HydrophobicContact CB-CB 4.46Å; A1005-H1010 PolarHBondContact O-N 3.32Å; A1008-H1010 VanDerWaalsContact CB-CD2 3.41Å; A1008-H1010 WeakPolarHBondContact CB-CD2 3.39Å; H1010-D1012 VanDerWaalsContact C-N 3.27Å; H1010-D1012 PolarHBondContact O-N 3.41Å; H1010-I1013 HydrophobicContact CB-CB 4.1Å; H1010-I1013 HydrophobicContact CB-CD1 4.11Å; H1010-I1013 HydrophobicContact CB-CG1 4.18Å; H1010-I1013 WeakPolarHBondContact O-CB 3.4Å; H1010-I1013 PolarHBondContact O-N 2.83Å; H1010-V1014 PolarHBondContact O-N 3.39Å
1011	A	94.7	Very high	93.7	Very high	69 Å²	69	47 Å²	47	57%	0.57	30%	0.301	S	S	*	.	H	α-helix	trans	-52.3	-37.9	-176.4	0	0	0	0	0	114.3	G1009 I1013 V1014 S1015	G1009-A1011 VanDerWaalsContact C-N 3.33Å; G1009-A1011 PolarHBondContact O-N 3.4Å; A1011-I1013 VanDerWaalsContact C-N 3.33Å; A1011-I1013 PolarHBondContact O-N 2.79Å; A1011-V1014 PolarHBondContact O-N 3Å; A1011-S1015 WeakPolarHBondContact O-CB 3.36Å; A1011-S1015 PolarHBondContact O-N 3.28Å
1012	D	96.4	Very high	93.5	Very high	120 Å²	120	47.4 Å²	47.4	64%	0.642	30%	0.304	S	S	*	.	H	α-helix	trans	-65	-37.6	178	-57.3	-34	0	0	0	112.1	V978 H1010 S1015 L1016	V978-D1012 HydrophobicContact CG2-CB 4.33Å; H1010-D1012 VanDerWaalsContact C-N 3.27Å; H1010-D1012 PolarHBondContact O-N 3.41Å; D1012-S1015 WeakPolarHBondContact O-CB 3.2Å; D1012-S1015 PolarHBondContact O-N 2.74Å; D1012-L1016 WeakPolarHBondContact O-CB 3.37Å; D1012-L1016 PolarHBondContact O-N 3.4Å
1013	I	97.1	Very high	93	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-72.6	-40.9	176.5	-62.2	-173.6	0	0	0	110.5	A973 G976 V978 V981 A1005 H1010 A1011 S1015 L1016 L1017	A973-I1013 HydrophobicContact CB-CG2 4.04Å; G976-I1013 VanDerWaalsContact C-CD1 3.48Å; V978-I1013 HydrophobicContact CB-CG1 4.44Å; V978-I1013 HydrophobicContact CG2-CD1 4.24Å; V978-I1013 HydrophobicContact CG2-CG1 3.87Å; V981-I1013 HydrophobicContact CG1-CG2 4.24Å; V981-I1013 HydrophobicContact CG2-CD1 4.21Å; V981-I1013 HydrophobicContact CG2-CG2 4.43Å; A1005-I1013 HydrophobicContact CB-CB 4.03Å; A1005-I1013 HydrophobicContact CB-CG2 3.58Å; H1010-I1013 HydrophobicContact CB-CB 4.1Å; H1010-I1013 HydrophobicContact CB-CD1 4.11Å; H1010-I1013 HydrophobicContact CB-CG1 4.18Å; H1010-I1013 WeakPolarHBondContact O-CB 3.4Å; H1010-I1013 PolarHBondContact O-N 2.83Å; A1011-I1013 VanDerWaalsContact C-N 3.33Å; A1011-I1013 PolarHBondContact O-N 2.79Å; I1013-S1015 VanDerWaalsContact C-N 3.32Å; I1013-S1015 PolarHBondContact O-N 3.05Å; I1013-L1016 PolarHBondContact O-N 3.45Å; I1013-L1017 HydrophobicContact CG2-CD1 3.74Å; I1013-L1017 HydrophobicContact CG2-CG 4.17Å; I1013-L1017 WeakPolarHBondContact O-CB 3.46Å; I1013-L1017 VanDerWaalsContact O-CG 3.3Å; I1013-L1017 WeakPolarHBondContact O-CG 3.27Å; I1013-L1017 PolarHBondContact O-N 3.37Å
1014	V	95.7	Very high	92.4	Very high	41 Å²	41	58.4 Å²	58.4	25%	0.248	36%	0.36	C	S	.	.	H	α-helix	trans	-57.7	-46.5	172	172.8	0	0	0	0	110.2	L1002 A1005 A1006 H1010 A1011 L1016 L1017 C1018	L1002-V1014 HydrophobicContact CD1-CB 4.36Å; L1002-V1014 HydrophobicContact CD1-CG1 3.98Å; L1002-V1014 HydrophobicContact CD1-CG2 4.43Å; A1005-V1014 HydrophobicContact CB-CG2 3.94Å; A1006-V1014 HydrophobicContact CB-CG2 4.1Å; H1010-V1014 PolarHBondContact O-N 3.39Å; A1011-V1014 PolarHBondContact O-N 3Å; V1014-L1016 PolarHBondContact O-N 3.09Å; V1014-L1017 PolarHBondContact O-N 3.02Å; V1014-C1018 WeakPolarHBondContact O-CB 3.3Å; V1014-C1018 PolarHBondContact O-N 3.31Å; V1014-C1018 PolarHBondContact O-SG 3.34Å
1015	S	95.2	Very high	91.1	Very high	48 Å²	48	60.5 Å²	60.5	34%	0.336	38%	0.375	S	S	.	.	H	α-helix	trans	-59.5	-46.7	175.1	-168.8	0	0	0	0	112.2	A1011 D1012 I1013 K1019	A1011-S1015 WeakPolarHBondContact O-CB 3.36Å; A1011-S1015 PolarHBondContact O-N 3.28Å; D1012-S1015 WeakPolarHBondContact O-CB 3.2Å; D1012-S1015 PolarHBondContact O-N 2.74Å; I1013-S1015 VanDerWaalsContact C-N 3.32Å; I1013-S1015 PolarHBondContact O-N 3.05Å; S1015-K1019 WeakPolarHBondContact O-CB 3.4Å; S1015-K1019 WeakPolarHBondContact O-CD 3.07Å; S1015-K1019 WeakPolarHBondContact O-CG 3.22Å; S1015-K1019 PolarHBondContact O-N 3.07Å; S1015-K1019 WeakPolarHBondContact OG-CE 3.2Å; S1015-K1019 PolarHBondContact OG-NZ 3.13Å
1016	L	96.2	Very high	89.1	Confident	35 Å²	35	67.2 Å²	67.2	18%	0.183	42%	0.416	C	S	.	.	H	α-helix	trans	-63.2	-44.2	179	176	60.3	0	0	0	112.6	V978 V981 A982 L985 D1012 I1013 V1014 K1019 K1020	V978-L1016 HydrophobicContact CG1-CD2 4.47Å; V981-L1016 HydrophobicContact CB-CD2 4.42Å; V981-L1016 HydrophobicContact CG1-CD2 3.91Å; A982-L1016 HydrophobicContact CB-CD2 3.93Å; L985-L1016 HydrophobicContact CD1-CD2 4.36Å; L985-L1016 HydrophobicContact CD1-CG 4.14Å; D1012-L1016 WeakPolarHBondContact O-CB 3.37Å; D1012-L1016 PolarHBondContact O-N 3.4Å; I1013-L1016 PolarHBondContact O-N 3.45Å; V1014-L1016 PolarHBondContact O-N 3.09Å; L1016-K1019 PolarHBondContact O-N 3.18Å; L1016-K1020 WeakPolarHBondContact O-CG 3.37Å; L1016-K1020 PolarHBondContact O-N 3.46Å; L1016-K1020 VanDerWaalsContact O-N 3.11Å
1017	L	95.3	Very high	87.1	Confident	0 Å²	0	68.9 Å²	68.9	0%	0	42%	0.422	C	S	.	.	H	α-helix	trans	-66.9	-45.4	178.5	-73.1	171.1	0	0	0	111.3	A973 V981 L985 V991 P1001 L1002 A1005 I1013 V1014 K1019 K1020 G1021 A1022	A973-L1017 HydrophobicContact CB-CD1 4.46Å; V981-L1017 HydrophobicContact CG1-CD2 4.43Å; L985-L1017 HydrophobicContact CD1-CD2 3.9Å; L985-L1017 HydrophobicContact CD2-CD2 4.31Å; V991-L1017 HydrophobicContact CG1-CD2 3.75Å; P1001-L1017 HydrophobicContact CB-CD1 4.04Å; P1001-L1017 HydrophobicContact CB-CD2 4.4Å; L1002-L1017 HydrophobicContact CB-CD1 4.29Å; L1002-L1017 HydrophobicContact CD1-CB 3.98Å; L1002-L1017 HydrophobicContact CD1-CD1 4.35Å; A1005-L1017 HydrophobicContact CB-CD1 4.39Å; I1013-L1017 HydrophobicContact CG2-CD1 3.74Å; I1013-L1017 HydrophobicContact CG2-CG 4.17Å; I1013-L1017 WeakPolarHBondContact O-CB 3.46Å; I1013-L1017 VanDerWaalsContact O-CG 3.3Å; I1013-L1017 WeakPolarHBondContact O-CG 3.27Å; I1013-L1017 PolarHBondContact O-N 3.37Å; V1014-L1017 PolarHBondContact O-N 3.02Å; L1017-K1019 PolarHBondContact O-N 2.72Å; L1017-K1020 CarbonylContact O-C 3.58Å; L1017-K1020 WeakPolarHBondContact O-CA 3.49Å; L1017-K1020 PolarHBondContact O-N 3.03Å; L1017-G1021 PolarHBondContact O-N 3.48Å; L1017-A1022 HydrophobicContact CB-CB 3.9Å; L1017-A1022 VanDerWaalsContact O-CB 3.25Å; L1017-A1022 WeakPolarHBondContact O-CB 3.41Å; L1017-A1022 PolarHBondContact O-N 3.31Å
1018	C	93.2	Very high	84.9	Confident	54 Å²	54	71.4 Å²	71.4	37%	0.365	44%	0.436	S	S	.	.	H	α-helix	trans	-60.6	-41.9	174.2	-70.8	0	0	0	0	112.1	V1014 K1020 G1021	V1014-C1018 WeakPolarHBondContact O-CB 3.3Å; V1014-C1018 PolarHBondContact O-N 3.31Å; V1014-C1018 PolarHBondContact O-SG 3.34Å; C1018-K1020 PolarHBondContact O-N 3.14Å; C1018-G1021 PolarHBondContact O-N 3.24Å
1019	K	93.9	Very high	82.9	Confident	163 Å²	163	73.9 Å²	73.9	71%	0.709	45%	0.447	S	S	*	.	H	α-helix	trans	-62	-22.2	172.8	-75.7	164.8	179.8	161.4	0	113.6	S1015 L1016 L1017	S1015-K1019 WeakPolarHBondContact O-CB 3.4Å; S1015-K1019 WeakPolarHBondContact O-CD 3.07Å; S1015-K1019 WeakPolarHBondContact O-CG 3.22Å; S1015-K1019 PolarHBondContact O-N 3.07Å; S1015-K1019 WeakPolarHBondContact OG-CE 3.2Å; S1015-K1019 PolarHBondContact OG-NZ 3.13Å; L1016-K1019 PolarHBondContact O-N 3.18Å; L1017-K1019 PolarHBondContact O-N 2.72Å
1020	K	92.6	Very high	80.2	Confident	114 Å²	114	79.1 Å²	79.1	50%	0.496	46%	0.456	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.7	8.1	174.2	-68.4	-71.4	-173.7	171.9	0	113.3	L985 V991 L1016 L1017 C1018	L985-K1020 HydrophobicContact CD1-CG 4.23Å; V991-K1020 HydrophobicContact CG1-CB 4.23Å; V991-K1020 HydrophobicContact CG2-CB 4.32Å; L1016-K1020 WeakPolarHBondContact O-CG 3.37Å; L1016-K1020 PolarHBondContact O-N 3.46Å; L1016-K1020 VanDerWaalsContact O-N 3.11Å; L1017-K1020 CarbonylContact O-C 3.58Å; L1017-K1020 WeakPolarHBondContact O-CA 3.49Å; L1017-K1020 PolarHBondContact O-N 3.03Å; C1018-K1020 PolarHBondContact O-N 3.14Å
1021	G	89.8	Confident	77.5	Confident	56 Å²	56	81.2 Å²	81.2	58%	0.577	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.8	21.6	174.4	0	0	0	0	0	115.2	L1017 C1018 K1023	L1017-G1021 PolarHBondContact O-N 3.48Å; C1018-G1021 PolarHBondContact O-N 3.24Å; G1021-K1023 PolarHBondContact O-N 3.12Å
1022	A	88.6	Confident	74.8	Confident	9 Å²	9	84.1 Å²	84.1	7%	0.074	49%	0.487	C	S	.	.			trans	-55.4	136.5	172.8	0	0	0	0	0	111.5	V991 D992 L1002 L1017 V1024	V991-A1022 HydrophobicContact CG1-CB 3.68Å; D992-A1022 WeakPolarHBondContact OD1-CA 3.41Å; L1002-A1022 HydrophobicContact CB-CB 4.35Å; L1002-A1022 HydrophobicContact CD1-CB 4.5Å; L1002-A1022 HydrophobicContact CD2-CB 4.07Å; L1017-A1022 HydrophobicContact CB-CB 3.9Å; L1017-A1022 VanDerWaalsContact O-CB 3.25Å; L1017-A1022 WeakPolarHBondContact O-CB 3.41Å; L1017-A1022 PolarHBondContact O-N 3.31Å; A1022-V1024 PolarHBondContact O-N 2.98Å
1023	K	84.7	Confident	72	Confident	135 Å²	135	83.8 Å²	83.8	59%	0.587	49%	0.49	S	S	*	.			trans	-75.1	115	179.1	-66.9	-173.8	-170	78.2	0	110.7	D992 G1021 S1025	D992-K1023 PolarHBondContact OD1-N 3.43Å; D992-K1023 WeakPolarHBondContact OD2-CG 3.49Å; D992-K1023 IonicContact OD2-NZ 2.73Å; D992-K1023 PolarHBondContact OD2-NZ 3.1Å; G1021-K1023 PolarHBondContact O-N 3.12Å; K1023-S1025 PolarHBondContact O-N 2.81Å
1024	V	76.3	Confident	69.1	Low	120 Å²	120	90.8 Å²	90.8	73%	0.727	53%	0.527	S	S	*	.			trans	-74.6	70.2	169.3	-168.1	0	0	0	0	109.6	L1002 A1022	L1002-V1024 HydrophobicContact CD2-CG2 4.11Å; A1022-V1024 PolarHBondContact O-N 2.98Å
1025	S	65.3	Low	66.1	Low	56 Å²	56	97.9 Å²	97.9	39%	0.392	56%	0.557	S	S	.	*			trans	-90.9	125.9	175.7	56.4	0	0	0	0	110.8	K1023 V1027	K1023-S1025 PolarHBondContact O-N 2.81Å; S1025-V1027 VanDerWaalsContact C-N 3.33Å; S1025-V1027 PolarHBondContact O-N 3.18Å
1026	V	50.8	Low	63	Low	142 Å²	142	99.2 Å²	99.2	86%	0.861	57%	0.567	S	S	*	*			trans	-74.1	85.1	175.5	-174.4	0	0	0	0	109.6	S1028	V1026-S1028 PolarHBondContact O-N 3.06Å
1027	V	52.4	Low	59.9	Low	74 Å²	74	107.9 Å²	107.9	45%	0.448	60%	0.603	S	S	.	*			trans	-91.6	94.3	172	-172	0	0	0	0	108.4	S1025 V1029	S1025-V1027 VanDerWaalsContact C-N 3.33Å; S1025-V1027 PolarHBondContact O-N 3.18Å; V1027-V1029 HydrophobicContact CG1-CG2 3.85Å; V1027-V1029 PolarHBondContact O-N 2.8Å
1028	S	43.9	Very low	56.9	Low	112 Å²	112	117.1 Å²	117.1	78%	0.783	64%	0.639	S	S	*	*			trans	-71.5	90.3	175.4	56.9	0	0	0	0	110.7	V1026	V1026-S1028 PolarHBondContact O-N 3.06Å
1029	V	48.1	Very low	53.8	Low	86 Å²	86	120 Å²	120	52%	0.521	66%	0.66	S	S	.	*			trans	-85.8	117.3	174	-175.8	0	0	0	0	109.5	M999 V1027 C1031	M999-V1029 HydrophobicContact SD-CG2 3.75Å; V1027-V1029 HydrophobicContact CG1-CG2 3.85Å; V1027-V1029 PolarHBondContact O-N 2.8Å; V1029-C1031 PolarHBondContact O-N 2.7Å
1030	E	38.6	Very low	50.8	Low	169 Å²	169	118 Å²	118	79%	0.79	67%	0.665	S	S	*	*			trans	-68.4	97.1	169.7	-68.5	-163.9	125.6	0	0	109.9	T1032	E1030-T1032 VanDerWaalsContact C-N 3.33Å; E1030-T1032 HydrophobicContact CB-CG2 4.46Å; E1030-T1032 PolarHBondContact O-N 3.48Å
1031	C	38.6	Very low	48.7	Very low	102 Å²	102	118.3 Å²	118.3	69%	0.689	67%	0.674	S	S	*	*			trans	-71.6	86	178.7	-164.8	0	0	0	0	110.6	V1029 T1033	V1029-C1031 PolarHBondContact O-N 2.7Å; C1031-T1033 PolarHBondContact O-N 2.61Å
1032	T	37.8	Very low	46.6	Very low	131 Å²	131	121.5 Å²	121.5	80%	0.804	68%	0.679	S	S	*	*			trans	-80.7	40.9	-175.5	42.7	0	0	0	0	113.6	E1030	E1030-T1032 VanDerWaalsContact C-N 3.33Å; E1030-T1032 HydrophobicContact CB-CG2 4.46Å; E1030-T1032 PolarHBondContact O-N 3.48Å
1033	T	38	Very low	44.2	Very low	113 Å²	113	127.8 Å²	127.8	69%	0.693	71%	0.713	S	S	*	*	S	Bend	trans	-141.5	112	166.8	44.4	0	0	0	0	110.6	C1031	C1031-T1033 PolarHBondContact O-N 2.61Å
1034	D	35.3	Very low	41.8	Very low	146 Å²	146	127.4 Å²	127.4	78%	0.781	72%	0.72	S	S	*	*	S	Bend	trans	28.5	106.8	173.4	-85.6	-46.8	0	0	0	121	S1036	D1034-S1036 PolarHBondContact O-N 3.04Å
1035	Q	32.8	Very low	39.7	Very low	190 Å²	190	127.8 Å²	127.8	89%	0.888	72%	0.719	S	S	*	*	S	Bend	trans	44.2	55.1	140.3	-56.5	-162.4	29	0	0	119.1
1036	S	30.7	Very low	38	Very low	76 Å²	76	132.6 Å²	132.6	53%	0.531	74%	0.741	S	S	.	*			trans	-148.3	113.5	136.6	50.5	0	0	0	0	112	D1034 Y1038	D1034-S1036 PolarHBondContact O-N 3.04Å; S1036-Y1038 PolarHBondContact O-N 3.04Å; S1036-Y1038 VanDerWaalsContact O-N 3.13Å
1037	K	31.2	Very low	37.1	Very low	218 Å²	218	131.9 Å²	131.9	95%	0.948	73%	0.733	S	S	*	*			trans	-81.7	84	173.6	-76.9	-168.3	175.1	-171.8	0	110
1038	Y	33.1	Very low	35.9	Very low	194 Å²	194	136.4 Å²	136.4	76%	0.761	76%	0.755	S	S	*	*			trans	-88.4	118.1	159.9	-65.8	-74.5	0	0	0	108.9	S1036	S1036-Y1038 PolarHBondContact O-N 3.04Å; S1036-Y1038 VanDerWaalsContact O-N 3.13Å
1039	S	27.4	Very low	35.2	Very low	114 Å²	114	138.4 Å²	138.4	80%	0.797	75%	0.752	S	S	*	*			trans	-73.2	144.2	158.8	-165.6	0	0	0	0	108.2
1040	C	31.2	Very low	34.1	Very low	122 Å²	122	143.2 Å²	143.2	82%	0.824	77%	0.773	S	S	*	*			trans	-71.5	0	150.7	-67.6	0	0	0	0	109.9

Retrieved 1,040 of 1,040 residues in 490.4 ms (Link to these results)

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