TRI33_MOUSE Loading...

Isoform Beta of E3 ubiquitin-protein ligase TRIM33 AlphaSync

Canonical isoform description: Acts as an E3 ubiquitin-protein ligase. Promotes SMAD4 ubiquitination, nuclear exclusion and degradation via the ubiquitin proteasome pathway (By similarity). May act as a transcriptional repressor (By similarity). Inhibits the transcriptional response to TGF-beta/BMP signaling cascade (By similarity). Plays a role in the control of cell proliferation (By similarity). Its association with SMAD2 and SMAD3 stimulates erythroid differentiation of hematopoietic stem/progenitor. Monoubiquitinates SMAD4 and acts as an inhibitor of SMAD4-dependent TGF-beta/BMP signaling cascade (Monoubiquitination of SMAD4 hampers its ability to form a stable complex with activated SMAD2/3 resulting in inhibition of TGF-beta/BMP signaling cascade) (By similarity).

AlphaFold DB , UniProt , Accession Q99PP7-2 (canonical: Q99PP7), Species MOUSE (Mus musculus, Mouse), Gene Trim33, Length 1,125 aa.

						>TRI33_MOUSE|Q99PP7-2|Trim33
MAENKGGGEAESGGGGSGSAPVTAGAAGPTAQEAEPPLAAVLVEEEEEEGGRAGAEGGAAGPDDGGVAAASSSSAPAASVPAASVGSAVPGGAASTPAPAAAPAPAPAPAPAPAPAPAPAPAPGSSSGPPLGPPASLLDTCAVCQQSLQSRREAEPKLLPCLHSFCLRCLPEPERQLSVPIPGGSNGDVQQVGVIRCPVCRQECRQIDLVDNYFVKDTSEAPSSSDEKSEQVCTSCEDNASAVGFCVECGEWLCKTCIEAHQRVKFTKDHLIRKKEDVSESVGTSGQRPVFCPVHKQEQLKLFCETCDRLTCRDCQLLEHKEHRYQFLEEAFQNQKGAIENLLAKLLEKKNYVHFAATQVQNRIKEVNETNKRVEQEIKVAIFTLINEINKKGKSLLQQLENVTKERQMKLLQQQNDITGLSRQVKHVMNFTNWAIASGSSTALLYSKRLITFQLRHILKARCDPVPAANGAIRFHCDPTFWAKNVVNLGNLVIESKPAPGYTPNVVVGQVPPGTNHISKTPGQINLAQLRLQHMQQQVYAQKHQQLQQMRLQQPPAPIPTTTATTQQHPRQAAPQMLQQQPPRLISVQTMQRGNMNCGAFQAHQMRLAQNAARIPGIPRHSAPQYSMMQPHLQRQHSNPGHAGPFPVVSAHNPINPTSPTTATMANANRGPTSPSVTAIELIPSVTNPENLPSLPDIPPIQLEDAGSSSLDNLLSRYISGSHLPPQPTSTMNPSPGPSALSPGSSGLSNSHTPVRPPSTSSTGSRGSCGSSGRTAEKSAHSFKSDQVKVKQEPGTEEEICSFSGAVKQEKTEDGRRSACMLSSPESSLTPPLSTNLHLESELDTLTGLENHVKTEPTDISESCKQSGLSNLVNGKSPIRNLMHRSARIGGDGNSKDDDPNEDWCAVCQNGGDLLCCEKCPKVFHLTCHVPTLLSFPSGDWICTFCRDIGKPEVEYDCDNMQHSKKGKTAQGLSPVDQRKCERLLLYLYCHELSIEFQEPVPVSIPNYYKIIKKPMDLSTVKKKLQKKHSQHYQIPDDFVADVRLIFKNCERFNEGDSEVAKAGKAVALYFEDKLSEIYSDRTFTPLPEFEQDEDDGEVTEDSDEDFIQPRRKRLKSDERPVHIK
					

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters 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	38.1	Very low	40.8	Very low	249 Å²	249	144.2 Å²	144.2	100%	1.227	85%	0.854	S	S	*	*				0	120.2	0	-58.4	174.5	-175	0	0	106.2
2	A	36.5	Very low	40.6	Very low	83 Å²	83	141 Å²	141	69%	0.686	84%	0.844	S	S	*	*			cis	-139.6	126.6	-13.3	0	0	0	0	0	105.7
3	E	37.7	Very low	40.4	Very low	191 Å²	191	136.8 Å²	136.8	89%	0.893	85%	0.848	S	S	*	*				52.9	98.8	100.8	-66	-175.9	105	0	0	114.3
4	N	49.5	Very low	40.2	Very low	170 Å²	170	133 Å²	133	91%	0.909	85%	0.849	S	S	*	*				-138.3	153	128.7	-158.8	1.9	0	0	0	109.2
5	K	39	Very low	40	Very low	202 Å²	202	129.9 Å²	129.9	88%	0.878	85%	0.852	S	S	*	*			trans	-158	127.2	-159.5	-175.5	-176.2	-179.3	-175.8	0	113
6	G	44.7	Very low	40.1	Very low	80 Å²	80	127.1 Å²	127.1	83%	0.825	85%	0.853	S	S	*	*			trans	161	150.5	168.6	0	0	0	0	0	111.5
7	G	40.3	Very low	39.9	Very low	84 Å²	84	127.2 Å²	127.2	87%	0.866	86%	0.856	S	S	*	*			cis	159.7	135.6	-5.3	0	0	0	0	0	111.7
8	G	44.4	Very low	40.2	Very low	64 Å²	64	124.5 Å²	124.5	66%	0.66	85%	0.853	S	S	*	*			trans	116.6	114.1	-172	0	0	0	0	0	110.4
9	E	39.9	Very low	40.2	Very low	199 Å²	199	124.2 Å²	124.2	93%	0.93	85%	0.852	S	S	*	*			cis	75.6	132.2	38.9	-51.4	-175.3	145.6	0	0	112.4
10	A	40.3	Very low	40.3	Very low	79 Å²	79	122.5 Å²	122.5	65%	0.653	85%	0.847	S	S	*	*			cis	-155.8	163.5	4.1	0	0	0	0	0	113.8
11	E	38.3	Very low	40.8	Very low	185 Å²	185	122.4 Å²	122.4	86%	0.864	84%	0.844	S	S	*	*			trans	56.8	175	144.8	-69.5	174	123.5	0	0	122.4
12	S	37.9	Very low	40.9	Very low	106 Å²	106	116.6 Å²	116.6	74%	0.741	82%	0.822	S	S	*	*				-171.3	161.9	-73.9	63.6	0	0	0	0	111.5
13	G	39.1	Very low	41.1	Very low	86 Å²	86	119 Å²	119	89%	0.887	83%	0.828	S	S	*	*			trans	79.9	157.1	-178.3	0	0	0	0	0	113.3
14	G	37.1	Very low	41.3	Very low	84 Å²	84	114.7 Å²	114.7	87%	0.866	83%	0.825	S	S	*	*			cis	147.9	135.3	7.6	0	0	0	0	0	105.9
15	G	36.6	Very low	40.9	Very low	87 Å²	87	110.3 Å²	110.3	90%	0.897	82%	0.82	S	S	*	*			cis	129.3	109.2	28.7	0	0	0	0	0	106.9
16	G	41.6	Very low	41.2	Very low	84 Å²	84	105.9 Å²	105.9	87%	0.866	82%	0.821	S	S	*	*			trans	176.7	145.5	-176.2	0	0	0	0	0	114.3
17	S	37.3	Very low	41	Very low	130 Å²	130	107.2 Å²	107.2	91%	0.909	83%	0.825	S	S	*	*			trans	-144.2	145.6	-169.3	57.7	0	0	0	0	112.7
18	G	45	Very low	41	Very low	78 Å²	78	106.6 Å²	106.6	80%	0.804	82%	0.819	S	S	*	*			trans	-156.7	122.1	178.5	0	0	0	0	0	115.7
19	S	40.7	Very low	41.1	Very low	118 Å²	118	109.8 Å²	109.8	83%	0.825	83%	0.828	S	S	*	*			trans	-30	139.7	166.2	-45.3	0	0	0	0	116.9
20	A	41.5	Very low	40.8	Very low	91 Å²	91	107.1 Å²	107.1	75%	0.752	83%	0.825	S	S	*	*			cis	73.1	154.1	49.3	0	0	0	0	0	114.4
21	P	50.4	Low	40.8	Very low	120 Å²	120	107.8 Å²	107.8	78%	0.779	83%	0.83	S	S	*	*			cis	-105.2	-153.8	-3.9	20.7	4	0	0	0	111
22	V	40.8	Very low	40.5	Very low	128 Å²	128	108 Å²	108	78%	0.776	83%	0.831	S	S	*	*			cis	-138	-147	10.5	-139.7	0	0	0	0	109.7
23	T	41.9	Very low	40.2	Very low	133 Å²	133	112 Å²	112	82%	0.816	84%	0.838	S	S	*	*			cis	-155.9	-178.4	15.1	-29	0	0	0	0	110.6
24	A	41.5	Very low	40.1	Very low	100 Å²	100	112.3 Å²	112.3	83%	0.826	83%	0.833	S	S	*	*			trans	-101.9	164.7	175.2	0	0	0	0	0	112.7
25	G	41.4	Very low	40.1	Very low	78 Å²	78	117.8 Å²	117.8	80%	0.804	84%	0.836	S	S	*	*			cis	-169.1	-175.4	0.7	0	0	0	0	0	109.9
26	A	44.3	Very low	40.3	Very low	109 Å²	109	119 Å²	119	90%	0.901	83%	0.828	S	S	*	*			cis	-151.4	-174.9	12	0	0	0	0	0	112.8
27	A	41.4	Very low	40	Very low	109 Å²	109	120.5 Å²	120.5	90%	0.901	82%	0.822	S	S	*	*			trans	-51.1	162.9	-173.4	0	0	0	0	0	117
28	G	39.7	Very low	39.7	Very low	71 Å²	71	122.4 Å²	122.4	73%	0.732	82%	0.821	S	S	*	*			cis	127.6	175.7	11	0	0	0	0	0	110.8
29	P	47.3	Very low	39.2	Very low	131 Å²	131	123.9 Å²	123.9	85%	0.851	83%	0.826	S	S	*	*			cis	-122	179.6	-2.9	42.6	-29.2	0	0	0	114.1
30	T	33.6	Very low	38.8	Very low	143 Å²	143	122.5 Å²	122.5	88%	0.877	82%	0.822	S	S	*	*			trans	-119	146.1	163.2	41.7	0	0	0	0	111.1
31	A	39.1	Very low	38.4	Very low	92 Å²	92	123.7 Å²	123.7	76%	0.76	82%	0.819	S	S	*	*			trans	-134.2	140.2	166	0	0	0	0	0	107
32	Q	31.9	Very low	37.6	Very low	189 Å²	189	124.5 Å²	124.5	88%	0.883	82%	0.816	S	S	*	*			cis	72.8	73.3	46.5	-71.8	-159.6	-35.5	0	0	115
33	E	33.3	Very low	37.4	Very low	191 Å²	191	124.5 Å²	124.5	89%	0.893	82%	0.817	S	S	*	*			trans	-146.6	129.6	140.6	-96.4	164	162.1	0	0	104.8
34	A	35.3	Very low	37	Very low	93 Å²	93	125.8 Å²	125.8	77%	0.769	81%	0.813	S	S	*	*			cis	89.6	74	33.5	0	0	0	0	0	113.6
35	E	36.7	Very low	36.7	Very low	198 Å²	198	130.2 Å²	130.2	93%	0.925	82%	0.817	S	S	*	*			trans	-75.8	133	170.4	-75.7	-159.9	115.5	0	0	112.9
36	P	41.3	Very low	36.5	Very low	114 Å²	114	135.6 Å²	135.6	74%	0.74	82%	0.821	S	S	*	*			trans	-92.4	157.7	162.8	36.7	-32.1	0	0	0	112
37	P	36.3	Very low	36.2	Very low	114 Å²	114	139.7 Å²	139.7	74%	0.74	82%	0.822	S	S	*	*			trans	-103.1	175	-167.9	40.9	-38.3	0	0	0	115.5
38	L	29.8	Very low	36	Very low	170 Å²	170	143.6 Å²	143.6	89%	0.89	82%	0.821	S	S	*	*			trans	75.7	110.3	163.6	-55.9	172.4	0	0	0	118.6
39	A	34.6	Very low	35.9	Very low	109 Å²	109	149.5 Å²	149.5	90%	0.901	83%	0.83	S	S	*	*				-175.2	146.9	101.3	0	0	0	0	0	111
40	A	32.7	Very low	35.3	Very low	90 Å²	90	146.9 Å²	146.9	74%	0.744	83%	0.826	S	S	*	*			trans	-121.5	145.2	178.2	0	0	0	0	0	111.6
41	V	32.9	Very low	35.4	Very low	115 Å²	115	143.6 Å²	143.6	70%	0.697	82%	0.821	S	S	*	*			trans	-138.8	118.6	163.6	-179.3	0	0	0	0	107.7
42	L	34.7	Very low	35.2	Very low	137 Å²	137	150.8 Å²	150.8	72%	0.717	83%	0.828	S	S	*	*			trans	-97.2	151.1	168.9	-71.1	166.1	0	0	0	109.3
43	V	34.9	Very low	35.5	Very low	129 Å²	129	146.9 Å²	146.9	78%	0.782	83%	0.829	S	S	*	*			trans	-137.2	121.1	157	-175.5	0	0	0	0	106.9
44	E	34.4	Very low	35.6	Very low	160 Å²	160	141.1 Å²	141.1	75%	0.748	82%	0.82	S	S	*	*			trans	-105.8	142.4	176.4	-64.6	164.5	121.5	0	0	108.4
45	E	36	Very low	35.8	Very low	193 Å²	193	140.9 Å²	140.9	90%	0.902	82%	0.818	S	S	*	*			trans	-126.5	107	165.6	-71.8	-166.9	124.5	0	0	108.3
46	E	36.9	Very low	35.9	Very low	190 Å²	190	141 Å²	141	89%	0.888	82%	0.819	S	S	*	*			trans	-85.4	132.9	177	-62.5	-178.5	99.3	0	0	110.9	E48	E46-E48 PolarHBondContact O-N 3.49Å
47	E	37.5	Very low	35.7	Very low	196 Å²	196	139.5 Å²	139.5	92%	0.916	83%	0.825	S	S	*	*			trans	-85.3	103.6	166.3	-73.8	-164.8	124.2	0	0	110.2
48	E	36.5	Very low	35.6	Very low	190 Å²	190	137.8 Å²	137.8	89%	0.888	83%	0.828	S	S	*	*			trans	-82.3	118.2	-179.9	-169.7	-165.7	170.7	0	0	112.9	E46	E46-E48 PolarHBondContact O-N 3.49Å
49	E	37.4	Very low	36	Very low	196 Å²	196	134.3 Å²	134.3	92%	0.916	82%	0.823	S	S	*	*			trans	-146.7	126.6	162.6	-167.4	179.2	-164.2	0	0	111.6
50	G	35.5	Very low	36.3	Very low	75 Å²	75	134.1 Å²	134.1	77%	0.773	82%	0.821	S	S	*	*			trans	159.8	-60	166.7	0	0	0	0	0	117.6
51	G	35.9	Very low	36.7	Very low	74 Å²	74	133.2 Å²	133.2	76%	0.763	82%	0.821	S	S	*	*			trans	61.8	-172.8	171.8	0	0	0	0	0	119.5
52	R	35.6	Very low	37.6	Very low	243 Å²	243	133.8 Å²	133.8	92%	0.917	83%	0.827	S	S	*	*			trans	113	93.9	157.3	-161.4	-179.7	-166.2	165.3	3.7	119
53	A	38.2	Very low	37.7	Very low	108 Å²	108	134.9 Å²	134.9	89%	0.893	83%	0.834	S	S	*	*			trans	65.7	153.6	161.4	0	0	0	0	0	117.1
54	G	35.4	Very low	38	Very low	69 Å²	69	136.2 Å²	136.2	71%	0.711	84%	0.837	S	S	*	*			cis	161	162.6	-7.8	0	0	0	0	0	112.9
55	A	39.5	Very low	38.5	Very low	89 Å²	89	131.9 Å²	131.9	74%	0.736	84%	0.835	S	S	*	*			trans	79.7	128.8	179	0	0	0	0	0	118.3
56	E	38.5	Very low	38.8	Very low	199 Å²	199	126.1 Å²	126.1	93%	0.93	83%	0.828	S	S	*	*			trans	54.3	137.6	142.2	-58.7	172.6	144.2	0	0	120.9
57	G	36.3	Very low	39	Very low	84 Å²	84	124.3 Å²	124.3	87%	0.866	83%	0.829	S	S	*	*			cis	148.8	122.8	-9.5	0	0	0	0	0	114.5
58	G	35.2	Very low	39.3	Very low	78 Å²	78	119.8 Å²	119.8	80%	0.804	83%	0.825	S	S	*	*			trans	123.1	136.1	161.1	0	0	0	0	0	117.7
59	A	38	Very low	39.4	Very low	96 Å²	96	115.6 Å²	115.6	79%	0.793	82%	0.823	S	S	*	*			trans	23.6	124.2	157.2	0	0	0	0	0	120.3
60	A	40.7	Very low	39.5	Very low	105 Å²	105	110.7 Å²	110.7	87%	0.868	82%	0.816	S	S	*	*				63.6	140	66.6	0	0	0	0	0	114.3
61	G	40.9	Very low	39.7	Very low	72 Å²	72	112.2 Å²	112.2	74%	0.742	82%	0.815	S	S	*	*			cis	-166.1	-166.7	9.8	0	0	0	0	0	114.1
62	P	51.6	Low	40.1	Very low	127 Å²	127	114 Å²	114	83%	0.825	82%	0.815	S	S	*	*			trans	-118.6	-174.6	-157.7	44	-34.7	0	0	0	115.4
63	D	37.9	Very low	40.6	Very low	160 Å²	160	107.1 Å²	107.1	86%	0.856	81%	0.805	S	S	*	*			trans	-159.1	159.3	163.5	-110.3	-27.9	0	0	0	108.7
64	D	40.6	Very low	41	Very low	156 Å²	156	107.7 Å²	107.7	83%	0.834	80%	0.802	S	S	*	*			cis	-153.7	163.7	5.8	179.2	17.7	0	0	0	110.4
65	G	43.8	Very low	42	Very low	69 Å²	69	108.8 Å²	108.8	71%	0.711	81%	0.805	S	S	*	*			trans	120.2	114.4	150.3	0	0	0	0	0	118.2
66	G	43.9	Very low	42.7	Very low	73 Å²	73	110.4 Å²	110.4	75%	0.753	81%	0.808	S	S	*	*			trans	169.9	-25.5	163.6	0	0	0	0	0	122.4
67	V	40.3	Very low	43.1	Very low	151 Å²	151	105.7 Å²	105.7	92%	0.915	80%	0.803	S	S	*	*			trans	35.7	112.4	172.2	-73.8	0	0	0	0	121.7
68	A	44.2	Very low	43.5	Very low	101 Å²	101	106 Å²	106	84%	0.835	80%	0.798	S	S	*	*			trans	-156.8	126.3	142.1	0	0	0	0	0	114.5
69	A	38.9	Very low	43.7	Very low	103 Å²	103	107 Å²	107	85%	0.851	79%	0.792	S	S	*	*			trans	66	114.8	158.5	0	0	0	0	0	122.9
70	A	39.3	Very low	44	Very low	93 Å²	93	109.3 Å²	109.3	77%	0.769	80%	0.796	S	S	*	*			trans	98.3	120.6	139.9	0	0	0	0	0	123.1
71	S	39.9	Very low	44.4	Very low	107 Å²	107	110.1 Å²	110.1	75%	0.748	79%	0.793	S	S	*	*			trans	71.2	97.1	151.1	37.2	0	0	0	0	123.4
72	S	43.1	Very low	44.4	Very low	110 Å²	110	111.1 Å²	111.1	77%	0.769	79%	0.794	S	S	*	*			trans	53.6	142	130.1	57.4	0	0	0	0	123.1
73	S	45.7	Very low	43.8	Very low	99 Å²	99	109.8 Å²	109.8	69%	0.692	79%	0.794	S	S	*	*			cis	-179.8	151.6	-11.6	48.6	0	0	0	0	113
74	S	48.5	Very low	44	Very low	120 Å²	120	107.1 Å²	107.1	84%	0.839	79%	0.787	S	S	*	*			trans	66.7	149.8	161.7	60.9	0	0	0	0	120.2
75	A	54.7	Low	44	Very low	93 Å²	93	106.8 Å²	106.8	77%	0.769	79%	0.79	S	S	*	*			cis	-165.8	-160.5	-17.3	0	0	0	0	0	110.7
76	P	54.8	Low	43.8	Very low	122 Å²	122	106.9 Å²	106.9	79%	0.792	79%	0.792	S	S	*	*				-136.4	-175.9	-99	44	-25.7	0	0	0	119.5
77	A	46.3	Very low	43.5	Very low	100 Å²	100	109.4 Å²	109.4	83%	0.826	80%	0.798	S	S	*	*			trans	81.9	153.9	153.4	0	0	0	0	0	120.6
78	A	45.1	Very low	43.6	Very low	92 Å²	92	106.6 Å²	106.6	76%	0.76	79%	0.79	S	S	*	*			cis	177.4	168.7	-16.9	0	0	0	0	0	109.9
79	S	40.1	Very low	43.4	Very low	99 Å²	99	108.2 Å²	108.2	69%	0.692	79%	0.789	S	S	*	*			cis	-178.3	155.5	-26	57.8	0	0	0	0	113.5
80	V	43.5	Very low	43.8	Very low	143 Å²	143	109.2 Å²	109.2	87%	0.867	79%	0.787	S	S	*	*			trans	71.4	157.2	156	-69.7	0	0	0	0	124.3
81	P	49.8	Very low	44	Very low	123 Å²	123	108.7 Å²	108.7	80%	0.799	79%	0.791	S	S	*	*			trans	-138.9	-162.9	-155.8	46.1	-26.6	0	0	0	117.8
82	A	40.5	Very low	43.9	Very low	93 Å²	93	107.5 Å²	107.5	77%	0.769	80%	0.796	S	S	*	*			trans	131.1	148.1	138	0	0	0	0	0	120.5
83	A	40.1	Very low	43.8	Very low	99 Å²	99	107.1 Å²	107.1	82%	0.818	80%	0.799	S	S	*	*			trans	67	159.3	155.7	0	0	0	0	0	121.1
84	S	40.3	Very low	43.6	Very low	103 Å²	103	107.2 Å²	107.2	72%	0.72	81%	0.806	S	S	*	*			cis	-176.8	160.6	-28.8	61.7	0	0	0	0	113.3
85	V	41.5	Very low	43.3	Very low	149 Å²	149	107.6 Å²	107.6	90%	0.903	81%	0.809	S	S	*	*			trans	72.9	141.7	159.7	-172.9	0	0	0	0	120.8
86	G	38.9	Very low	42.5	Very low	72 Å²	72	109.8 Å²	109.8	74%	0.742	81%	0.813	S	S	*	*			trans	152.4	132.2	152.5	0	0	0	0	0	118.5
87	S	39.2	Very low	41.9	Very low	126 Å²	126	109.8 Å²	109.8	88%	0.881	81%	0.813	S	S	*	*			trans	-117.6	168.8	-169.9	-52.7	0	0	0	0	116.9
88	A	41	Very low	41.7	Very low	91 Å²	91	109.4 Å²	109.4	75%	0.752	81%	0.81	S	S	*	*			trans	94.6	98.8	146.1	0	0	0	0	0	123.9
89	V	39.6	Very low	41.7	Very low	135 Å²	135	111.6 Å²	111.6	82%	0.818	82%	0.816	S	S	*	*				34.4	141.4	104.2	-173.8	0	0	0	0	119.6
90	P	48.7	Very low	41.9	Very low	124 Å²	124	111.5 Å²	111.5	81%	0.805	82%	0.822	S	S	*	*			cis	-142.7	-177.8	-27.3	42.9	-24.5	0	0	0	117
91	G	42.1	Very low	41.9	Very low	82 Å²	82	109.5 Å²	109.5	85%	0.845	82%	0.82	S	S	*	*			trans	119.3	142.1	135.2	0	0	0	0	0	121.4
92	G	37.6	Very low	41.4	Very low	82 Å²	82	108.1 Å²	108.1	85%	0.845	82%	0.819	S	S	*	*			trans	130.1	102.7	151.4	0	0	0	0	0	121.3
93	A	42.8	Very low	41.9	Very low	103 Å²	103	109.6 Å²	109.6	85%	0.851	82%	0.82	S	S	*	*			trans	59.1	97.6	143.4	0	0	0	0	0	124.3
94	A	39.9	Very low	42.2	Very low	101 Å²	101	109.2 Å²	109.2	84%	0.835	82%	0.818	S	S	*	*				48.2	116.1	124.6	0	0	0	0	0	124.1
95	S	42.2	Very low	42.8	Very low	127 Å²	127	110.4 Å²	110.4	89%	0.888	82%	0.823	S	S	*	*				-168.4	150	119.8	21.3	0	0	0	0	112.9
96	T	38.6	Very low	43.1	Very low	140 Å²	140	107.6 Å²	107.6	86%	0.859	82%	0.815	S	S	*	*			trans	-112.9	178	178.3	34.3	0	0	0	0	110.6
97	P	42.8	Very low	44	Very low	121 Å²	121	110.1 Å²	110.1	79%	0.786	82%	0.818	S	S	*	*			cis	-131.4	162.2	-2.3	39.5	-24.1	0	0	0	116.1
98	A	40.8	Very low	44.3	Very low	93 Å²	93	108.5 Å²	108.5	77%	0.769	81%	0.812	S	S	*	*			trans	178.3	139.3	139.4	0	0	0	0	0	110.4
99	P	45.4	Very low	45	Very low	137 Å²	137	110.1 Å²	110.1	89%	0.89	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-82.5	119.3	173.9	31.8	-31.4	0	0	0	111.4
100	A	43.8	Very low	45.3	Very low	98 Å²	98	108 Å²	108	81%	0.81	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-86.9	157.9	164.5	0	0	0	0	0	110.5
101	A	44.2	Very low	45.5	Very low	101 Å²	101	108 Å²	108	84%	0.835	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-62.8	149.7	-177.4	0	0	0	0	0	113
102	A	40.2	Very low	46	Very low	93 Å²	93	108.5 Å²	108.5	77%	0.769	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-65.7	145.8	175	0	0	0	0	0	111.5
103	P	51.2	Low	46.8	Very low	124 Å²	124	110.6 Å²	110.6	81%	0.805	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-73.7	145.9	176.9	31.4	-34.8	0	0	0	111.4
104	A	46.1	Very low	47	Very low	92 Å²	92	110 Å²	110	76%	0.76	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-67.6	148.7	168.4	0	0	0	0	0	110.9
105	P	53	Low	47.9	Very low	128 Å²	128	111.1 Å²	111.1	83%	0.831	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-64.3	144.3	172	28.5	-34.4	0	0	0	110.8
106	A	48	Very low	48.2	Very low	89 Å²	89	109.5 Å²	109.5	74%	0.736	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-71	148.1	178.1	0	0	0	0	0	111.4
107	P	57.5	Low	48.8	Very low	126 Å²	126	107 Å²	107	82%	0.818	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-64.7	139.8	172.6	28.4	-34.5	0	0	0	110.7
108	A	44.8	Very low	49.3	Very low	91 Å²	91	105.5 Å²	105.5	75%	0.752	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-64.9	148	171.4	0	0	0	0	0	110.7
109	P	54.9	Low	49.7	Very low	125 Å²	125	107 Å²	107	81%	0.812	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-67.8	136.5	-179.4	28.5	-34.7	0	0	0	111.2
110	A	46.4	Very low	49.6	Very low	91 Å²	91	104.2 Å²	104.2	75%	0.752	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-66	142.5	175	0	0	0	0	0	111.3
111	P	53.9	Low	49.7	Very low	124 Å²	124	105.5 Å²	105.5	81%	0.805	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-65.4	144.4	170.8	28.9	-33.9	0	0	0	110.6
112	A	52.5	Low	49.4	Very low	92 Å²	92	104.8 Å²	104.8	76%	0.76	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-69.3	149.6	178.5	0	0	0	0	0	111.6	A114	A112-A114 PolarHBondContact O-N 3.21Å
113	P	54.9	Low	49.4	Very low	126 Å²	126	106.7 Å²	106.7	82%	0.818	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-65.7	131.2	-179.6	27	-34.7	0	0	0	111.6
114	A	45.4	Very low	48.6	Very low	90 Å²	90	103.9 Å²	103.9	74%	0.744	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-70.4	148.2	169	0	0	0	0	0	110.6	A112	A112-A114 PolarHBondContact O-N 3.21Å
115	P	59.4	Low	47.9	Very low	126 Å²	126	105.6 Å²	105.6	82%	0.818	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-68.1	139.8	178.2	28.8	-34.6	0	0	0	111.3
116	A	48.4	Very low	47.1	Very low	93 Å²	93	104.8 Å²	104.8	77%	0.769	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-64.3	142.6	-176.3	0	0	0	0	0	112.8
117	P	51.9	Low	46.3	Very low	87 Å²	87	106.6 Å²	106.6	57%	0.565	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-65.9	147.3	170.1	29.2	-34.1	0	0	0	110.8
118	A	51.7	Low	45.3	Very low	89 Å²	89	103.5 Å²	103.5	74%	0.736	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-65.8	147.9	176.1	0	0	0	0	0	111.1	A120	A118-A120 PolarHBondContact O-N 3Å
119	P	51.2	Low	44.8	Very low	124 Å²	124	104.8 Å²	104.8	81%	0.805	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-63.7	128.7	-176.2	25.7	-34.7	0	0	0	111.5
120	A	41.4	Very low	43.9	Very low	80 Å²	80	104.8 Å²	104.8	66%	0.661	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-58.4	142.3	167.4	0	0	0	0	0	109.9	A118 A122	A118-A120 PolarHBondContact O-N 3Å; A120-A122 PolarHBondContact O-N 3.27Å
121	P	47.6	Very low	43.3	Very low	125 Å²	125	109 Å²	109	81%	0.812	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-65	125.6	-177.4	26.6	-33.9	0	0	0	110.3
122	A	37.4	Very low	42.1	Very low	85 Å²	85	105.7 Å²	105.7	70%	0.702	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-55.4	143.3	174.6	0	0	0	0	0	110.7	A120 G124	A120-A122 PolarHBondContact O-N 3.27Å; A122-G124 PolarHBondContact O-N 3.45Å
123	P	40.3	Very low	41.3	Very low	133 Å²	133	106.9 Å²	106.9	86%	0.864	76%	0.762	S	S	*	*			trans	-61.9	103.3	178.8	25	-33.5	0	0	0	109.8	S125	P123-S125 PolarHBondContact O-N 3.23Å
124	G	34	Very low	40.6	Very low	66 Å²	66	105.6 Å²	105.6	68%	0.68	75%	0.754	S	S	*	*			trans	-59.8	124.5	-172.5	0	0	0	0	0	111.7	A122 S126	A122-G124 PolarHBondContact O-N 3.45Å; G124-S126 PolarHBondContact O-N 3.02Å
125	S	30.9	Very low	40.6	Very low	128 Å²	128	105 Å²	105	90%	0.895	75%	0.749	S	S	*	*			trans	-68.6	86.5	-175.8	58.4	0	0	0	0	112.3	P123	P123-S125 PolarHBondContact O-N 3.23Å
126	S	36.2	Very low	40.3	Very low	110 Å²	110	102.4 Å²	102.4	77%	0.769	73%	0.734	S	S	*	*			trans	-94.9	111.3	166.7	57	0	0	0	0	109.9	G124 G128	G124-S126 PolarHBondContact O-N 3.02Å; S126-G128 VanDerWaalsContact C-N 3.3Å; S126-G128 PolarHBondContact O-N 3Å
127	S	32.6	Very low	40.8	Very low	127 Å²	127	102.3 Å²	102.3	89%	0.888	72%	0.72	S	S	*	*			trans	-74.9	80.1	178.2	56.9	0	0	0	0	111.1
128	G	35	Very low	41.6	Very low	62 Å²	62	103.9 Å²	103.9	64%	0.639	72%	0.723	S	S	*	*	P	Polyproline II helix	trans	-74.6	149.9	170.8	0	0	0	0	0	112.5	S126	S126-G128 VanDerWaalsContact C-N 3.3Å; S126-G128 PolarHBondContact O-N 3Å
129	P	35.8	Very low	42.8	Very low	118 Å²	118	102.1 Å²	102.1	77%	0.766	70%	0.701	S	S	*	*	P	Polyproline II helix	trans	-63	159.8	167.7	29.6	-34.7	0	0	0	110.7	L131	P129-L131 PolarHBondContact O-N 3.47Å
130	P	34.9	Very low	44.4	Very low	124 Å²	124	97 Å²	97	81%	0.805	67%	0.668	S	S	*	*	P	Polyproline II helix	trans	-56.7	139.3	-175.3	23.4	-34.8	0	0	0	112	G132	P130-G132 PolarHBondContact O-N 3.46Å; P130-G132 VanDerWaalsContact O-N 3.11Å
131	L	33.5	Very low	46.7	Very low	179 Å²	179	93.2 Å²	93.2	94%	0.937	64%	0.636	S	S	*	*	P	Polyproline II helix	trans	-49	117	178	-75	162.9	0	0	0	110.5	P129	P129-L131 PolarHBondContact O-N 3.47Å
132	G	29.9	Very low	48.6	Very low	56 Å²	56	88.2 Å²	88.2	58%	0.577	61%	0.606	S	S	*	*			trans	-66.7	178.8	171.2	0	0	0	0	0	112	P130	P130-G132 PolarHBondContact O-N 3.46Å; P130-G132 VanDerWaalsContact O-N 3.11Å
133	P	34.6	Very low	51	Low	116 Å²	116	87.7 Å²	87.7	75%	0.753	59%	0.594	S	S	*	*			trans	-53.8	148.2	171.5	-22	33.2	0	0	0	111	A135	P133-A135 PolarHBondContact O-N 3.41Å
134	P	40.5	Very low	53.3	Low	100 Å²	100	83.5 Å²	83.5	65%	0.649	57%	0.567	S	S	*	*			trans	-71.9	73	178.1	31.1	-36	0	0	0	110.9	S136 L137	P134-S136 PolarHBondContact O-N 2.95Å; P134-L137 HydrophobicContact CB-CD1 4.42Å
135	A	44.8	Very low	55.8	Low	76 Å²	76	86 Å²	86	63%	0.628	56%	0.561	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.1	-25	-171.7	0	0	0	0	0	113.4	P133 L137	P133-A135 PolarHBondContact O-N 3.41Å; A135-L137 VanDerWaalsContact C-N 3.27Å; A135-L137 PolarHBondContact O-N 2.76Å
136	S	54.3	Low	58.3	Low	72 Å²	72	83.6 Å²	83.6	50%	0.503	54%	0.536	S	S	.	.	H	α-helix	trans	-75.7	-2.6	-174	64	0	0	0	0	115.5	P134 D139 T140	P134-S136 PolarHBondContact O-N 2.95Å; S136-D139 WeakPolarHBondContact CA-OD1 3.39Å; S136-T140 WeakPolarHBondContact O-CB 3.34Å; S136-T140 WeakPolarHBondContact O-CG2 3.28Å; S136-T140 PolarHBondContact O-OG1 3.41Å
137	L	58.1	Low	60.6	Low	92 Å²	92	80 Å²	80	48%	0.482	51%	0.51	S	S	.	.	H	α-helix	trans	-92.1	-4	-178.7	-73.9	174.1	0	0	0	114	P134 A135	P134-L137 HydrophobicContact CB-CD1 4.42Å; A135-L137 VanDerWaalsContact C-N 3.27Å; A135-L137 PolarHBondContact O-N 2.76Å
138	L	68.4	Low	63	Low	119 Å²	119	74.2 Å²	74.2	62%	0.623	47%	0.469	S	S	*	.	H	α-helix	trans	-103.8	-28.5	-179.8	-68.5	170.9	0	0	0	112.7	V215	L138-V215 WeakPolarHBondContact O-CG2 3.22Å
139	D	77.9	Confident	64.8	Low	52 Å²	52	74.9 Å²	74.9	28%	0.278	46%	0.456	S	S	.	.	H	α-helix	trans	-103.7	-14.3	-179.2	68.7	-36.2	0	0	0	113.5	S136 L148	S136-D139 WeakPolarHBondContact CA-OD1 3.39Å; D139-L148 WeakPolarHBondContact O-CB 3.47Å; D139-L148 PolarHBondContact O-N 3.07Å
140	T	85.6	Confident	66.2	Low	17 Å²	17	73.4 Å²	73.4	10%	0.104	45%	0.448	C	S	.	.	B	Isolated β-bridge	trans	-106.9	157.9	171.8	76.9	0	0	0	0	112.9	S136 Q146	S136-T140 WeakPolarHBondContact O-CB 3.34Å; S136-T140 WeakPolarHBondContact O-CG2 3.28Å; S136-T140 PolarHBondContact O-OG1 3.41Å; T140-Q146 CarbonylContact C-O 3.53Å; T140-Q146 VanDerWaalsContact CA-O 3.3Å; T140-Q146 WeakPolarHBondContact CA-O 3.37Å; T140-Q146 WeakPolarHBondContact CB-O 3.42Å
141	C	88.6	Confident	67.4	Low	0 Å²	0	72.4 Å²	72.4	0%	0	43%	0.428	C	S	.	.			trans	-77.4	122.9	172.4	175	0	0	0	0	110.7	V143 C144 Q145 Q146 L148 C166 C169	C141-V143 PolarHBondContact O-N 3Å; C141-V143 PolarHBondContact SG-N 2.85Å; C141-C144 VanDerWaalsContact CB-SG 3.55Å; C141-C144 PolarHBondContact O-N 2.93Å; C141-Q145 VanDerWaalsContact O-CA 3.27Å; C141-Q145 WeakPolarHBondContact O-CA 3.24Å; C141-Q145 PolarHBondContact O-N 3.12Å; C141-Q146 PolarHBondContact N-O 2.95Å; C141-L148 HydrophobicContact CB-CD2 3.75Å; C141-L148 HydrophobicContact CB-CG 4.38Å; C141-C166 HydrophobicContact CB-CB 4.44Å; C141-C166 PolarHBondContact SG-N 2.88Å; C141-C169 VanDerWaalsContact SG-CB 3.51Å; C141-C169 PolarHBondContact SG-SG 2.94Å
142	A	87.1	Confident	68.4	Low	21 Å²	21	74.7 Å²	74.7	17%	0.174	43%	0.425	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-5.4	-178.5	0	0	0	0	0	116	Q145 S164 F165 V199	A142-Q145 PolarHBondContact O-NE2 2.89Å; A142-Q145 VanDerWaalsContact O-NE2 3.15Å; A142-S164 PolarHBondContact N-O 3.13Å; A142-S164 VanDerWaalsContact N-O 3.1Å; A142-F165 HydrophobicContact CB-CE1 4.14Å; A142-V199 HydrophobicContact CB-CG2 3.65Å
143	V	87.9	Confident	69.7	Low	74 Å²	74	78.3 Å²	78.3	45%	0.448	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.5	-60	172.1	171.6	0	0	0	0	111.1	C141 F165 C169 P198	C141-V143 PolarHBondContact O-N 3Å; C141-V143 PolarHBondContact SG-N 2.85Å; V143-F165 HydrophobicContact CG2-CD1 3.8Å; V143-F165 HydrophobicContact CG2-CE1 3.81Å; V143-C169 HydrophobicContact CB-CB 4.21Å; V143-P198 HydrophobicContact CG2-CB 3.86Å; V143-P198 HydrophobicContact CG2-CG 4.04Å
144	C	88.8	Confident	71	Confident	45 Å²	45	73 Å²	73	30%	0.304	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.8	-0.8	-172.5	74.4	0	0	0	0	114.7	C141 Q146 C169	C141-C144 VanDerWaalsContact CB-SG 3.55Å; C141-C144 PolarHBondContact O-N 2.93Å; C144-Q146 PolarHBondContact O-N 3.41Å; C144-C169 PolarHBondContact SG-SG 2.76Å
145	Q	86.1	Confident	72.9	Confident	118 Å²	118	72.6 Å²	72.6	55%	0.551	38%	0.381	S	S	*	.			trans	55	11.4	177.9	-52.6	-61.6	-33.1	0	0	115.4	C141 A142	C141-Q145 VanDerWaalsContact O-CA 3.27Å; C141-Q145 WeakPolarHBondContact O-CA 3.24Å; C141-Q145 PolarHBondContact O-N 3.12Å; A142-Q145 PolarHBondContact O-NE2 2.89Å; A142-Q145 VanDerWaalsContact O-NE2 3.15Å
146	Q	84.3	Confident	74.9	Confident	78 Å²	78	69.4 Å²	69.4	36%	0.364	36%	0.355	S	S	.	.			trans	-81.5	146.9	173.6	-71.3	163.5	57.9	0	0	110.4	T140 C141 C144 L148	T140-Q146 CarbonylContact C-O 3.53Å; T140-Q146 VanDerWaalsContact CA-O 3.3Å; T140-Q146 WeakPolarHBondContact CA-O 3.37Å; T140-Q146 WeakPolarHBondContact CB-O 3.42Å; C141-Q146 PolarHBondContact N-O 2.95Å; C144-Q146 PolarHBondContact O-N 3.41Å; Q146-L148 PolarHBondContact O-N 3.47Å
147	S	84.9	Confident	76.6	Confident	34 Å²	34	67.5 Å²	67.5	24%	0.238	34%	0.337	C	S	.	.	B	Isolated β-bridge	trans	-56.1	131.8	168.5	176.9	0	0	0	0	110.6	Q149 S150	S147-Q149 WeakPolarHBondContact OG-CB 3.41Å; S147-Q149 PolarHBondContact OG-N 3.07Å; S147-S150 PolarHBondContact O-OG 3.05Å
148	L	82.8	Confident	78.1	Confident	5 Å²	5	64.3 Å²	64.3	3%	0.026	32%	0.32	C	S	.	.	S	Bend	trans	-75.8	-16.5	174.4	-67.1	173.5	0	0	0	112.2	D139 C141 Q146 P156 C166 V215	D139-L148 WeakPolarHBondContact O-CB 3.47Å; D139-L148 PolarHBondContact O-N 3.07Å; C141-L148 HydrophobicContact CB-CD2 3.75Å; C141-L148 HydrophobicContact CB-CG 4.38Å; Q146-L148 PolarHBondContact O-N 3.47Å; L148-P156 HydrophobicContact CB-CB 4.02Å; L148-P156 HydrophobicContact CD1-CB 4.21Å; L148-P156 HydrophobicContact CD2-CB 4.15Å; L148-P156 HydrophobicContact CG-CB 4.36Å; L148-C166 HydrophobicContact CD2-CB 4.16Å; L148-V215 HydrophobicContact CB-CG1 3.7Å; L148-V215 HydrophobicContact CB-CG2 4.25Å; L148-V215 HydrophobicContact CD1-CG2 4.25Å
149	Q	73.1	Confident	79.2	Confident	77 Å²	77	58.8 Å²	58.8	36%	0.36	29%	0.291	S	S	.	.	S	Bend	trans	-81.1	-36	176.2	-57.5	165.4	-8.9	0	0	111.1	S147 R151 V215	S147-Q149 WeakPolarHBondContact OG-CB 3.41Å; S147-Q149 PolarHBondContact OG-N 3.07Å; Q149-R151 PolarHBondContact O-N 2.69Å; Q149-R151 VanDerWaalsContact O-N 3.09Å; Q149-V215 HydrophobicContact CG-CG1 3.87Å
150	S	63.5	Low	79.8	Confident	86 Å²	86	59.1 Å²	59.1	60%	0.601	30%	0.296	S	S	*	.	S	Bend	trans	-78.9	8.8	-166.5	80.5	0	0	0	0	115.8	S147	S147-S150 PolarHBondContact O-OG 3.05Å
151	R	60.3	Low	80	Confident	104 Å²	104	58.9 Å²	58.9	39%	0.392	30%	0.295	S	S	.	.			trans	-143.4	119.6	169.5	-60.5	-174.8	-165.8	-110.9	2.2	110.4	Q149 E153 A154 R168	Q149-R151 PolarHBondContact O-N 2.69Å; Q149-R151 VanDerWaalsContact O-N 3.09Å; R151-E153 HydrophobicContact CB-CB 4.41Å; R151-E153 PolarHBondContact O-N 2.94Å; R151-E153 VanDerWaalsContact O-N 3.09Å; R151-A154 HydrophobicContact CB-CB 4.02Å; R151-A154 WeakPolarHBondContact O-CB 3.19Å; R151-A154 PolarHBondContact O-N 3.49Å; R151-R168 VanDerWaalsContact CD-NH2 3.33Å
152	R	54.4	Low	80.1	Confident	227 Å²	227	65 Å²	65	86%	0.857	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	-24.9	166	-83.5	-173.8	166.9	-165.8	-3.3	113	E220	R152-E220 IonicContact CZ-OE1 3.73Å; R152-E220 IonicContact NH2-OE1 2.99Å; R152-E220 PolarHBondContact NH2-OE1 2.86Å
153	E	56.9	Low	80.3	Confident	132 Å²	132	66.7 Å²	66.7	62%	0.617	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.1	-14.4	176.1	-53.7	173	165.8	0	0	115.5	R151 E155 R168	R151-E153 HydrophobicContact CB-CB 4.41Å; R151-E153 PolarHBondContact O-N 2.94Å; R151-E153 VanDerWaalsContact O-N 3.09Å; E153-E155 PolarHBondContact O-N 3.39Å; E153-R168 IonicContact OE2-NH1 3.88Å; E153-R168 PolarHBondContact OE2-NH1 3.47Å; E153-R168 VanDerWaalsContact OE2-NH1 3.1Å
154	A	62.2	Low	80.3	Confident	4 Å²	4	63.2 Å²	63.2	3%	0.033	31%	0.311	C	S	.	.	S	Bend	trans	-71.1	-21	-167.8	0	0	0	0	0	113.7	R151 C166 L167	R151-A154 HydrophobicContact CB-CB 4.02Å; R151-A154 WeakPolarHBondContact O-CB 3.19Å; R151-A154 PolarHBondContact O-N 3.49Å; A154-C166 HydrophobicContact CB-CB 4.33Å; A154-C166 CarbonylContact O-C 3.34Å; A154-C166 WeakPolarHBondContact O-CA 3.37Å; A154-L167 PolarHBondContact O-N 2.99Å
155	E	80.8	Confident	80.4	Confident	91 Å²	91	61.1 Å²	61.1	43%	0.425	30%	0.296	S	S	.	.			trans	35.6	76.9	-171.3	-85	-155	-149.9	0	0	112.6	E153 K157 L167	E153-E155 PolarHBondContact O-N 3.39Å; E155-K157 WeakPolarHBondContact O-CG 3.16Å; E155-K157 PolarHBondContact O-N 3.48Å; E155-K157 WeakPolarHBondContact OE2-CE 3.26Å; E155-K157 IonicContact OE2-NZ 3.89Å; E155-K157 PolarHBondContact OE2-NZ 3.49Å; E155-L167 HydrophobicContact CB-CB 3.83Å; E155-L167 HydrophobicContact CB-CD2 4.04Å; E155-L167 PolarHBondContact O-N 3.3Å
156	P	88.1	Confident	80.5	Confident	10 Å²	10	55.7 Å²	55.7	7%	0.065	27%	0.272	C	S	.	.			trans	-65.9	120.4	-172.9	28.5	-36.2	0	0	0	111	L148 F165 D211 N212 V215 K216	L148-P156 HydrophobicContact CB-CB 4.02Å; L148-P156 HydrophobicContact CD1-CB 4.21Å; L148-P156 HydrophobicContact CD2-CB 4.15Å; L148-P156 HydrophobicContact CG-CB 4.36Å; P156-F165 WeakPolarHBondContact CA-O 3.44Å; P156-D211 WeakPolarHBondContact O-CA 3.21Å; P156-N212 HydrophobicContact CB-CB 4.21Å; P156-N212 PolarHBondContact O-N 2.81Å; P156-V215 HydrophobicContact CB-CB 4.37Å; P156-V215 HydrophobicContact CB-CG1 4.17Å; P156-V215 HydrophobicContact CG-CB 4.22Å; P156-V215 HydrophobicContact CG-CG1 3.91Å; P156-K216 HydrophobicContact CG-CG 4.08Å
157	K	89.2	Confident	80.7	Confident	31 Å²	31	56 Å²	56	14%	0.135	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	143.4	177.2	-53.3	-55.2	175	-176.5	0	110.3	E155 S164 F165 L167 L170 V210 D211	E155-K157 WeakPolarHBondContact O-CG 3.16Å; E155-K157 PolarHBondContact O-N 3.48Å; E155-K157 WeakPolarHBondContact OE2-CE 3.26Å; E155-K157 IonicContact OE2-NZ 3.89Å; E155-K157 PolarHBondContact OE2-NZ 3.49Å; K157-S164 WeakPolarHBondContact O-CA 3.4Å; K157-F165 PolarHBondContact N-O 2.97Å; K157-F165 PolarHBondContact O-N 3.49Å; K157-L167 HydrophobicContact CG-CD1 4.34Å; K157-L170 HydrophobicContact CB-CD1 4.01Å; K157-L170 HydrophobicContact CG-CD1 3.94Å; K157-V210 WeakPolarHBondContact CA-O 3.45Å; K157-D211 IonicContact NZ-OD1 2.67Å; K157-D211 PolarHBondContact NZ-OD1 2.88Å
158	L	90.2	Very high	80.9	Confident	25 Å²	25	61 Å²	61	13%	0.131	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	124.9	171.5	-175.5	68.8	0	0	0	107.9	L162 S164 V210 N212	L158-L162 WeakPolarHBondContact CD1-O 3.48Å; L158-S164 WeakPolarHBondContact CD1-OG 3.3Å; L158-V210 HydrophobicContact CB-CG2 3.95Å; L158-V210 HydrophobicContact CD2-CG2 4.27Å; L158-V210 PolarHBondContact N-O 3.35Å; L158-V210 PolarHBondContact O-N 3.21Å; L158-N212 HydrophobicContact CB-CB 4.14Å
159	L	91.4	Very high	81.2	Confident	3 Å²	3	61.8 Å²	61.8	2%	0.016	29%	0.294	C	S	.	.			trans	-83.4	158.4	173.5	-93	63.2	0	0	0	110.5	C161 L162 H163 F165 L170 C197 C204 L209	L159-C161 WeakPolarHBondContact CB-SG 3.38Å; L159-C161 PolarHBondContact O-N 2.96Å; L159-L162 WeakPolarHBondContact O-CA 3.3Å; L159-L162 PolarHBondContact O-N 2.99Å; L159-H163 PolarHBondContact N-O 3.22Å; L159-H163 VanDerWaalsContact N-O 3.13Å; L159-F165 HydrophobicContact CD1-CD2 3.87Å; L159-F165 HydrophobicContact CD1-CE2 4.11Å; L159-F165 HydrophobicContact CD2-CE2 4.15Å; L159-L170 HydrophobicContact CD1-CD1 4.44Å; L159-L170 HydrophobicContact CD1-CD2 3.53Å; L159-C197 HydrophobicContact CD2-CB 3.99Å; L159-C204 HydrophobicContact CD2-CB 4.18Å; L159-C204 HydrophobicContact CG-CB 4.27Å; L159-L209 HydrophobicContact CD1-CD1 4.21Å; L159-L209 HydrophobicContact CD1-CD2 3.96Å; L159-L209 HydrophobicContact CD1-CG 3.73Å; L159-L209 HydrophobicContact CG-CD1 3.97Å; L159-L209 HydrophobicContact CG-CG 4.05Å
160	P	90	Very high	82	Confident	59 Å²	59	59.4 Å²	59.4	38%	0.383	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48.8	-29.2	169.4	-31.2	35.4	0	0	0	114.9	L162 C204 D208	P160-L162 PolarHBondContact O-N 2.92Å; P160-C204 HydrophobicContact CG-CB 4.18Å; P160-D208 HydrophobicContact CG-CB 3.58Å
161	C	89.6	Confident	83	Confident	12 Å²	12	57.8 Å²	57.8	8%	0.081	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.7	10.6	173.4	68.4	0	0	0	0	115	L159 H163 C197 C200 Q202	L159-C161 WeakPolarHBondContact CB-SG 3.38Å; L159-C161 PolarHBondContact O-N 2.96Å; C161-H163 PolarHBondContact O-N 3.27Å; C161-H163 VanDerWaalsContact O-N 3.1Å; C161-H163 PolarHBondContact O-ND1 3.36Å; C161-C197 PolarHBondContact SG-SG 3.07Å; C161-C200 VanDerWaalsContact CB-SG 3.52Å; C161-Q202 HydrophobicContact CB-CB 4.02Å; C161-Q202 HydrophobicContact CB-CG 4.22Å
162	L	91	Very high	84.2	Confident	129 Å²	129	61.2 Å²	61.2	68%	0.675	29%	0.292	S	S	*	.	S	Bend	trans	60.5	11.1	-179.8	-51.3	-178.1	0	0	0	116.4	L158 L159 P160	L158-L162 WeakPolarHBondContact CD1-O 3.48Å; L159-L162 WeakPolarHBondContact O-CA 3.3Å; L159-L162 PolarHBondContact O-N 2.99Å; P160-L162 PolarHBondContact O-N 2.92Å
163	H	90.5	Very high	85.6	Confident	57 Å²	57	52.8 Å²	52.8	26%	0.264	27%	0.267	S	S	.	.			trans	-86.1	140.5	173.9	-68.4	75.6	0	0	0	111.3	L159 C161 F165 V199	L159-H163 PolarHBondContact N-O 3.22Å; L159-H163 VanDerWaalsContact N-O 3.13Å; C161-H163 PolarHBondContact O-N 3.27Å; C161-H163 VanDerWaalsContact O-N 3.1Å; C161-H163 PolarHBondContact O-ND1 3.36Å; H163-F165 HydrophobicContact CB-CD2 4.49Å; H163-F165 HydrophobicContact CB-CE2 3.44Å; H163-F165 VanDerWaalsContact CB-CE2 3.44Å; H163-F165 HydrophobicContact CB-CZ 3.6Å; H163-F165 WeakPolarHBondContact O-CD2 3.17Å; H163-F165 WeakPolarHBondContact O-CE2 3.34Å; H163-V199 VanDerWaalsContact CD2-CB 3.48Å; H163-V199 WeakPolarHBondContact CD2-CB 3.48Å; H163-V199 WeakPolarHBondContact NE2-CG1 3.32Å
164	S	89	Confident	86.7	Confident	1 Å²	1	51.9 Å²	51.9	1%	0.007	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	135.6	-176	-66.6	0	0	0	0	113	A142 K157 L158 N212	A142-S164 PolarHBondContact N-O 3.13Å; A142-S164 VanDerWaalsContact N-O 3.1Å; K157-S164 WeakPolarHBondContact O-CA 3.4Å; L158-S164 WeakPolarHBondContact CD1-OG 3.3Å; S164-N212 PolarHBondContact OG-ND2 3.05Å
165	F	89.8	Confident	87.8	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	154.1	-175.5	-54.3	-90.5	0	0	0	112.1	A142 V143 P156 K157 L159 H163 C169 L170 P198 V199	A142-F165 HydrophobicContact CB-CE1 4.14Å; V143-F165 HydrophobicContact CG2-CD1 3.8Å; V143-F165 HydrophobicContact CG2-CE1 3.81Å; P156-F165 WeakPolarHBondContact CA-O 3.44Å; K157-F165 PolarHBondContact N-O 2.97Å; K157-F165 PolarHBondContact O-N 3.49Å; L159-F165 HydrophobicContact CD1-CD2 3.87Å; L159-F165 HydrophobicContact CD1-CE2 4.11Å; L159-F165 HydrophobicContact CD2-CE2 4.15Å; H163-F165 HydrophobicContact CB-CD2 4.49Å; H163-F165 HydrophobicContact CB-CE2 3.44Å; H163-F165 VanDerWaalsContact CB-CE2 3.44Å; H163-F165 HydrophobicContact CB-CZ 3.6Å; H163-F165 WeakPolarHBondContact O-CD2 3.17Å; H163-F165 WeakPolarHBondContact O-CE2 3.34Å; F165-C169 HydrophobicContact CB-CB 4.44Å; F165-L170 HydrophobicContact CB-CD2 3.61Å; F165-L170 HydrophobicContact CB-CG 4.11Å; F165-L170 HydrophobicContact CD1-CD2 4.42Å; F165-L170 HydrophobicContact CD2-CD2 3.68Å; F165-L170 HydrophobicContact CE2-CD2 4.46Å; F165-L170 HydrophobicContact CG-CD2 3.64Å; F165-P198 HydrophobicContact CE1-CB 4.27Å; F165-P198 HydrophobicContact CE1-CG 4.02Å; F165-P198 HydrophobicContact CZ-CG 4.48Å; F165-V199 HydrophobicContact CE1-CG2 4.04Å; F165-V199 HydrophobicContact CZ-CG2 4Å
166	C	89.1	Confident	87.7	Confident	5 Å²	5	58.7 Å²	58.7	3%	0.034	29%	0.289	C	S	.	.			trans	-71.9	149.7	160.3	95.7	0	0	0	0	109.2	C141 L148 A154 R168 C169	C141-C166 HydrophobicContact CB-CB 4.44Å; C141-C166 PolarHBondContact SG-N 2.88Å; L148-C166 HydrophobicContact CD2-CB 4.16Å; A154-C166 HydrophobicContact CB-CB 4.33Å; A154-C166 CarbonylContact O-C 3.34Å; A154-C166 WeakPolarHBondContact O-CA 3.37Å; C166-R168 PolarHBondContact O-N 3.34Å; C166-C169 HydrophobicContact CB-CB 4.04Å; C166-C169 WeakPolarHBondContact CB-SG 3.38Å; C166-C169 WeakPolarHBondContact O-CA 3.47Å; C166-C169 WeakPolarHBondContact O-CB 3.19Å; C166-C169 PolarHBondContact O-N 2.94Å; C166-C169 WeakPolarHBondContact SG-CB 3.4Å; C166-C169 PolarHBondContact SG-N 2.69Å; C166-C169 CovalentContact SG-SG 2.05Å; C166-C169 PolarHBondContact SG-SG 3.35Å
167	L	88.6	Confident	87.1	Confident	83 Å²	83	61 Å²	61	44%	0.435	30%	0.301	S	S	.	.	G	3₁₀ helix	trans	-57.6	-38.8	178.7	178.3	57.4	0	0	0	112.2	A154 E155 K157 C169 L170	A154-L167 PolarHBondContact O-N 2.99Å; E155-L167 HydrophobicContact CB-CB 3.83Å; E155-L167 HydrophobicContact CB-CD2 4.04Å; E155-L167 PolarHBondContact O-N 3.3Å; K157-L167 HydrophobicContact CG-CD1 4.34Å; L167-C169 PolarHBondContact O-N 3.45Å; L167-C169 VanDerWaalsContact O-N 3.13Å; L167-L170 HydrophobicContact CD1-CD1 4.34Å; L167-L170 PolarHBondContact O-N 3.49Å
168	R	88.4	Confident	86.3	Confident	140 Å²	140	63.8 Å²	63.8	53%	0.528	32%	0.324	S	S	.	.	G	3₁₀ helix	trans	-68.6	-4.3	175	-47.3	-179.9	-64.9	-141	0.8	114.2	R151 E153 C166	R151-R168 VanDerWaalsContact CD-NH2 3.33Å; E153-R168 IonicContact OE2-NH1 3.88Å; E153-R168 PolarHBondContact OE2-NH1 3.47Å; E153-R168 VanDerWaalsContact OE2-NH1 3.1Å; C166-R168 PolarHBondContact O-N 3.34Å
169	C	90.2	Very high	85.2	Confident	21 Å²	21	65 Å²	65	14%	0.142	33%	0.332	C	S	.	.	G	3₁₀ helix	trans	-111.6	-1.7	-173.5	-54.6	0	0	0	0	112.2	C141 V143 C144 F165 C166 L167	C141-C169 VanDerWaalsContact SG-CB 3.51Å; C141-C169 PolarHBondContact SG-SG 2.94Å; V143-C169 HydrophobicContact CB-CB 4.21Å; C144-C169 PolarHBondContact SG-SG 2.76Å; F165-C169 HydrophobicContact CB-CB 4.44Å; C166-C169 HydrophobicContact CB-CB 4.04Å; C166-C169 WeakPolarHBondContact CB-SG 3.38Å; C166-C169 WeakPolarHBondContact O-CA 3.47Å; C166-C169 WeakPolarHBondContact O-CB 3.19Å; C166-C169 PolarHBondContact O-N 2.94Å; C166-C169 WeakPolarHBondContact SG-CB 3.4Å; C166-C169 PolarHBondContact SG-N 2.69Å; C166-C169 CovalentContact SG-SG 2.05Å; C166-C169 PolarHBondContact SG-SG 3.35Å; L167-C169 PolarHBondContact O-N 3.45Å; L167-C169 VanDerWaalsContact O-N 3.13Å
170	L	88.6	Confident	83.7	Confident	27 Å²	27	69.6 Å²	69.6	14%	0.141	36%	0.362	C	S	.	.	S	Bend	trans	-86.5	136.8	172.5	-66	177.2	0	0	0	109.6	K157 L159 F165 L167 L209	K157-L170 HydrophobicContact CB-CD1 4.01Å; K157-L170 HydrophobicContact CG-CD1 3.94Å; L159-L170 HydrophobicContact CD1-CD1 4.44Å; L159-L170 HydrophobicContact CD1-CD2 3.53Å; F165-L170 HydrophobicContact CB-CD2 3.61Å; F165-L170 HydrophobicContact CB-CG 4.11Å; F165-L170 HydrophobicContact CD1-CD2 4.42Å; F165-L170 HydrophobicContact CD2-CD2 3.68Å; F165-L170 HydrophobicContact CE2-CD2 4.46Å; F165-L170 HydrophobicContact CG-CD2 3.64Å; L167-L170 HydrophobicContact CD1-CD1 4.34Å; L167-L170 PolarHBondContact O-N 3.49Å; L170-L209 HydrophobicContact CD1-CD2 3.71Å
171	P	85.9	Confident	82.2	Confident	53 Å²	53	70.2 Å²	70.2	34%	0.344	36%	0.361	S	S	.	.	P	Polyproline II helix	trans	-70.3	153.5	174.2	27.1	-29.1	0	0	0	111	I195 P198	P171-I195 HydrophobicContact CG-CG2 3.86Å; P171-P198 HydrophobicContact CG-CG 4.27Å
172	E	84.1	Confident	80.5	Confident	176 Å²	176	74.9 Å²	74.9	82%	0.822	39%	0.392	S	S	*	.	P	Polyproline II helix	trans	-62.9	152.1	171	-64.5	-167.6	155.5	0	0	110.9	E174	E172-E174 PolarHBondContact O-N 2.93Å
173	P	84	Confident	78.9	Confident	50 Å²	50	72.7 Å²	72.7	33%	0.325	40%	0.4	S	S	.	.	P	Polyproline II helix	trans	-63.9	118.9	-176.7	-22.2	33.3	0	0	0	113.4	R175 V194 I195	P173-R175 PolarHBondContact O-N 2.84Å; P173-V194 CarbonylContact C-O 3.25Å; P173-V194 WeakPolarHBondContact CA-O 3.45Å; P173-I195 HydrophobicContact CB-CG1 4.22Å; P173-I195 HydrophobicContact CG-CD1 4.32Å; P173-I195 HydrophobicContact CG-CG1 4Å
174	E	79.9	Confident	76.8	Confident	113 Å²	113	71.6 Å²	71.6	53%	0.528	41%	0.405	S	S	.	.	S	Bend	trans	-58.7	-31.3	-179.4	-62.3	178.2	174.8	0	0	112.6	E172 V194 R196	E172-E174 PolarHBondContact O-N 2.93Å; E174-V194 PolarHBondContact N-O 2.95Å; E174-R196 WeakPolarHBondContact OE1-CB 3.45Å; E174-R196 IonicContact OE1-NE 3.1Å; E174-R196 IonicContact OE2-NE 3.37Å
175	R	84.7	Confident	74.6	Confident	105 Å²	105	76 Å²	76	40%	0.396	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157	156.7	-175.8	60.5	-168.2	-171.2	84.3	-2.3	111.2	P173 V194 E203	P173-R175 PolarHBondContact O-N 2.84Å; R175-V194 HydrophobicContact CG-CB 3.84Å; R175-V194 HydrophobicContact CG-CG2 4.13Å; R175-V194 PolarHBondContact O-N 3.47Å; R175-E203 IonicContact CZ-OE2 2.87Å; R175-E203 IonicContact NE-OE2 2.75Å; R175-E203 IonicContact NH2-OE2 3.57Å; R175-E203 PolarHBondContact NH2-OE2 3.44Å
176	Q	80.3	Confident	72.4	Confident	132 Å²	132	83.8 Å²	83.8	62%	0.617	48%	0.477	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.4	134.1	174.1	-65	173	-6.6	0	0	110.4	Q191	Q176-Q191 VanDerWaalsContact OE1-NE2 3.12Å
177	L	75.3	Confident	70.6	Confident	60 Å²	60	86.6 Å²	86.6	31%	0.314	51%	0.506	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	134.1	169	-80	174	0	0	0	110.4	V179 Q191 V192 V194	L177-V179 HydrophobicContact CB-CG2 4.18Å; L177-V179 PolarHBondContact O-N 3.38Å; L177-Q191 WeakPolarHBondContact O-CA 3.19Å; L177-V192 PolarHBondContact N-O 3.01Å; L177-V192 PolarHBondContact O-N 3.47Å; L177-V194 HydrophobicContact CB-CG2 4.42Å; L177-V194 HydrophobicContact CD1-CG2 3.45Å; L177-V194 VanDerWaalsContact CD1-CG2 3.45Å; L177-V194 HydrophobicContact CG-CG2 3.61Å
178	S	71.9	Confident	69	Low	89 Å²	89	87.2 Å²	87.2	62%	0.622	51%	0.51	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81	104.7	166.8	-73.3	0	0	0	0	110	V189	S178-V189 VanDerWaalsContact CB-CG1 3.42Å
179	V	66.7	Low	67.8	Low	50 Å²	50	84.5 Å²	84.5	30%	0.303	51%	0.509	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	123.7	179.1	-174.2	0	0	0	0	109.2	L177 I181 Q190 V192	L177-V179 HydrophobicContact CB-CG2 4.18Å; L177-V179 PolarHBondContact O-N 3.38Å; V179-I181 PolarHBondContact O-N 3.17Å; V179-Q190 PolarHBondContact N-O 3.45Å; V179-Q190 PolarHBondContact O-N 2.99Å; V179-V192 HydrophobicContact CB-CG2 4.1Å; V179-V192 HydrophobicContact CG2-CB 4.11Å; V179-V192 HydrophobicContact CG2-CG2 3.76Å
180	P	60.3	Low	66.8	Low	99 Å²	99	88.1 Å²	88.1	64%	0.643	52%	0.524	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62.4	132.9	173.7	-20.7	32.7	0	0	0	111.1	P182	P180-P182 VanDerWaalsContact O-CD 3.32Å; P180-P182 WeakPolarHBondContact O-CD 3.25Å
181	I	59.3	Low	66.1	Low	72 Å²	72	92.4 Å²	92.4	37%	0.369	54%	0.543	S	S	.	.			trans	-74	121.4	-180	-61.2	-179	0	0	0	110	V179 G183 G184 D188 Q190	V179-I181 PolarHBondContact O-N 3.17Å; I181-G183 PolarHBondContact O-N 3.47Å; I181-G184 PolarHBondContact O-N 2.93Å; I181-G184 VanDerWaalsContact O-N 3.11Å; I181-D188 HydrophobicContact CD1-CB 3.93Å; I181-D188 PolarHBondContact N-O 3.23Å; I181-Q190 HydrophobicContact CD1-CB 4.11Å; I181-Q190 HydrophobicContact CG1-CB 3.78Å
182	P	53.5	Low	65.8	Low	111 Å²	111	90.3 Å²	90.3	72%	0.721	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	102	176.3	-20.7	34.2	0	0	0	111.1	P180 M821	P180-P182 VanDerWaalsContact O-CD 3.32Å; P180-P182 WeakPolarHBondContact O-CD 3.25Å; P182-M821 HydrophobicContact CB-CE 4.49Å; P182-M821 HydrophobicContact CG-CE 4.45Å
183	G	55.9	Low	65.8	Low	82 Å²	82	82.1 Å²	82.1	85%	0.845	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	105	1.6	-178.9	0	0	0	0	0	115.8	I181	I181-G183 PolarHBondContact O-N 3.47Å
184	G	46.6	Very low	66	Low	35 Å²	35	79.9 Å²	79.9	36%	0.361	48%	0.478	S	S	.	.			trans	-65.4	134.8	173.5	0	0	0	0	0	112.6	I181	I181-G184 PolarHBondContact O-N 2.93Å; I181-G184 VanDerWaalsContact O-N 3.11Å
185	S	43.5	Very low	66.5	Low	94 Å²	94	74.7 Å²	74.7	66%	0.657	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.4	125.2	175.1	180	0	0	0	0	109.9
186	N	42.6	Very low	66.7	Low	163 Å²	163	74 Å²	74	87%	0.872	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.4	47.7	179.6	-60.8	-25.8	0	0	0	116.1
187	G	53.2	Low	67.2	Low	63 Å²	63	67.8 Å²	67.8	65%	0.649	42%	0.422	S	S	*	.			trans	81.9	23.2	154.4	0	0	0	0	0	116.4	V189	G187-V189 PolarHBondContact O-N 3.29Å
188	D	53.2	Low	67.8	Low	97 Å²	97	67.8 Å²	67.8	52%	0.519	43%	0.426	S	S	.	.			trans	-58.2	125.5	172.4	-71.5	-46.3	0	0	0	111.9	I181	I181-D188 HydrophobicContact CD1-CB 3.93Å; I181-D188 PolarHBondContact N-O 3.23Å
189	V	64.2	Low	68.6	Low	82 Å²	82	66.9 Å²	66.9	50%	0.497	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	114.6	179.6	173.3	0	0	0	0	108.6	S178 G187	S178-V189 VanDerWaalsContact CB-CG1 3.42Å; G187-V189 PolarHBondContact O-N 3.29Å
190	Q	68.7	Low	69.7	Low	98 Å²	98	67.1 Å²	67.1	46%	0.458	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	128.2	170.8	-176.7	58.3	53.2	0	0	109.5	V179 I181 V192	V179-Q190 PolarHBondContact N-O 3.45Å; V179-Q190 PolarHBondContact O-N 2.99Å; I181-Q190 HydrophobicContact CD1-CB 4.11Å; I181-Q190 HydrophobicContact CG1-CB 3.78Å; Q190-V192 HydrophobicContact CB-CG2 4.38Å; Q190-V192 HydrophobicContact CG-CG2 3.78Å
191	Q	74.7	Confident	71.1	Confident	117 Å²	117	71.1 Å²	71.1	55%	0.547	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	122.6	163	-70.3	-176.9	-43.2	0	0	108.9	Q176 L177	Q176-Q191 VanDerWaalsContact OE1-NE2 3.12Å; L177-Q191 WeakPolarHBondContact O-CA 3.19Å
192	V	79.3	Confident	72.5	Confident	8 Å²	8	71 Å²	71	5%	0.048	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	124.8	179.3	-176.8	0	0	0	0	108.5	L177 V179 Q190 R205 I207	L177-V192 PolarHBondContact N-O 3.01Å; L177-V192 PolarHBondContact O-N 3.47Å; V179-V192 HydrophobicContact CB-CG2 4.1Å; V179-V192 HydrophobicContact CG2-CB 4.11Å; V179-V192 HydrophobicContact CG2-CG2 3.76Å; Q190-V192 HydrophobicContact CB-CG2 4.38Å; Q190-V192 HydrophobicContact CG-CG2 3.78Å; V192-R205 HydrophobicContact CG1-CB 3.98Å; V192-I207 HydrophobicContact CG1-CB 3.93Å; V192-I207 HydrophobicContact CG1-CG2 3.74Å
193	G	84.5	Confident	74.2	Confident	5 Å²	5	67.5 Å²	67.5	5%	0.052	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.9	147.6	174.9	0	0	0	0	0	112.3	Q206	G193-Q206 WeakPolarHBondContact O-CB 3.25Å; G193-Q206 PolarHBondContact O-N 3.04Å
194	V	88	Confident	75.6	Confident	2 Å²	2	63.7 Å²	63.7	1%	0.012	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	126.5	166.6	-178.7	0	0	0	0	108.7	P173 E174 R175 L177 E203 C204	P173-V194 CarbonylContact C-O 3.25Å; P173-V194 WeakPolarHBondContact CA-O 3.45Å; E174-V194 PolarHBondContact N-O 2.95Å; R175-V194 HydrophobicContact CG-CB 3.84Å; R175-V194 HydrophobicContact CG-CG2 4.13Å; R175-V194 PolarHBondContact O-N 3.47Å; L177-V194 HydrophobicContact CB-CG2 4.42Å; L177-V194 HydrophobicContact CD1-CG2 3.45Å; L177-V194 VanDerWaalsContact CD1-CG2 3.45Å; L177-V194 HydrophobicContact CG-CG2 3.61Å; V194-E203 HydrophobicContact CG1-CB 4.08Å; V194-E203 HydrophobicContact CG1-CG 4.33Å; V194-C204 WeakPolarHBondContact CA-O 3.48Å
195	I	89.1	Confident	77.6	Confident	5 Å²	5	65 Å²	65	3%	0.026	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	121.6	-177	-60.7	176.4	0	0	0	107.2	P171 P173 C204 Q206 L209	P171-I195 HydrophobicContact CG-CG2 3.86Å; P173-I195 HydrophobicContact CB-CG1 4.22Å; P173-I195 HydrophobicContact CG-CD1 4.32Å; P173-I195 HydrophobicContact CG-CG1 4Å; I195-C204 PolarHBondContact N-O 2.86Å; I195-C204 PolarHBondContact O-N 3.33Å; I195-Q206 HydrophobicContact CD1-CB 4.01Å; I195-Q206 HydrophobicContact CD1-CG 3.81Å; I195-Q206 HydrophobicContact CG1-CB 4.43Å; I195-L209 HydrophobicContact CD1-CD2 3.96Å
196	R	90.5	Very high	79.6	Confident	90 Å²	90	65.1 Å²	65.1	34%	0.34	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	130.2	174.9	-171.2	172.6	-78.4	-99.7	10.9	109.9	E174 P198 R201 E203	E174-R196 WeakPolarHBondContact OE1-CB 3.45Å; E174-R196 IonicContact OE1-NE 3.1Å; E174-R196 IonicContact OE2-NE 3.37Å; R196-P198 WeakPolarHBondContact O-CD 3.3Å; R196-R201 HydrophobicContact CG-CB 4.47Å; R196-R201 VanDerWaalsContact CG-O 3.32Å; R196-R201 WeakPolarHBondContact CG-O 3.41Å; R196-R201 PolarHBondContact NH1-O 3.18Å; R196-E203 IonicContact CZ-OE1 3.27Å; R196-E203 IonicContact NE-OE1 2.6Å; R196-E203 IonicContact NH2-OE1 2.71Å; R196-E203 PolarHBondContact NH2-OE1 2.91Å
197	C	90.3	Very high	81.7	Confident	1 Å²	1	63 Å²	63	1%	0.007	33%	0.326	C	S	.	.			trans	-63.9	123.5	178.7	175.7	0	0	0	0	110.8	L159 C161 V199 C200 R201 Q202	L159-C197 HydrophobicContact CD2-CB 3.99Å; C161-C197 PolarHBondContact SG-SG 3.07Å; C197-V199 PolarHBondContact O-N 3.03Å; C197-V199 VanDerWaalsContact O-N 3.1Å; C197-V199 PolarHBondContact SG-N 3.49Å; C197-C200 PolarHBondContact SG-SG 3.05Å; C197-R201 WeakPolarHBondContact O-CA 3.21Å; C197-R201 PolarHBondContact O-N 3.03Å; C197-Q202 PolarHBondContact N-O 3.31Å
198	P	88.1	Confident	83.4	Confident	60 Å²	60	62.5 Å²	62.5	39%	0.39	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-24.9	179.3	-28.7	36.3	0	0	0	115.3	V143 F165 P171 R196	V143-P198 HydrophobicContact CG2-CB 3.86Å; V143-P198 HydrophobicContact CG2-CG 4.04Å; F165-P198 HydrophobicContact CE1-CB 4.27Å; F165-P198 HydrophobicContact CE1-CG 4.02Å; F165-P198 HydrophobicContact CZ-CG 4.48Å; P171-P198 HydrophobicContact CG-CG 4.27Å; R196-P198 WeakPolarHBondContact O-CD 3.3Å
199	V	88.7	Confident	85.1	Confident	70 Å²	70	59.6 Å²	59.6	42%	0.424	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.9	-64.7	-174.4	-171.9	0	0	0	0	111.7	A142 H163 F165 C197	A142-V199 HydrophobicContact CB-CG2 3.65Å; H163-V199 VanDerWaalsContact CD2-CB 3.48Å; H163-V199 WeakPolarHBondContact CD2-CB 3.48Å; H163-V199 WeakPolarHBondContact NE2-CG1 3.32Å; F165-V199 HydrophobicContact CE1-CG2 4.04Å; F165-V199 HydrophobicContact CZ-CG2 4Å; C197-V199 PolarHBondContact O-N 3.03Å; C197-V199 VanDerWaalsContact O-N 3.1Å; C197-V199 PolarHBondContact SG-N 3.49Å
200	C	88.9	Confident	86.3	Confident	55 Å²	55	59.4 Å²	59.4	37%	0.372	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.3	-2.6	-176.6	63.6	0	0	0	0	114.4	C161 C197 Q202	C161-C200 VanDerWaalsContact CB-SG 3.52Å; C197-C200 PolarHBondContact SG-SG 3.05Å; C200-Q202 PolarHBondContact O-N 3.02Å; C200-Q202 VanDerWaalsContact O-N 3.08Å; C200-Q202 VanDerWaalsContact SG-CB 3.5Å
201	R	90	Very high	87.1	Confident	184 Å²	184	56.5 Å²	56.5	69%	0.694	28%	0.279	S	S	*	.			trans	60.2	11.7	-179	-55.4	-177.8	179.8	-124.8	1	115.9	R196 C197	R196-R201 HydrophobicContact CG-CB 4.47Å; R196-R201 VanDerWaalsContact CG-O 3.32Å; R196-R201 WeakPolarHBondContact CG-O 3.41Å; R196-R201 PolarHBondContact NH1-O 3.18Å; C197-R201 WeakPolarHBondContact O-CA 3.21Å; C197-R201 PolarHBondContact O-N 3.03Å
202	Q	88.2	Confident	87.7	Confident	69 Å²	69	51 Å²	51	32%	0.322	25%	0.254	S	S	.	.			trans	-64.9	143.5	173.7	-164.7	170.9	-6.2	0	0	111.6	C161 C197 C200 E826	C161-Q202 HydrophobicContact CB-CB 4.02Å; C161-Q202 HydrophobicContact CB-CG 4.22Å; C197-Q202 PolarHBondContact N-O 3.31Å; C200-Q202 PolarHBondContact O-N 3.02Å; C200-Q202 VanDerWaalsContact O-N 3.08Å; C200-Q202 VanDerWaalsContact SG-CB 3.5Å; Q202-E826 VanDerWaalsContact CG-CD 3.43Å; Q202-E826 WeakPolarHBondContact CG-OE1 3.42Å; Q202-E826 WeakPolarHBondContact CG-OE2 3.2Å; Q202-E826 PolarHBondContact NE2-OE2 2.8Å
203	E	89.2	Confident	87.9	Confident	37 Å²	37	56.3 Å²	56.3	17%	0.173	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	107.5	-175.9	-77.6	-167.3	-167.3	0	0	111.8	R175 V194 R196 E826	R175-E203 IonicContact CZ-OE2 2.87Å; R175-E203 IonicContact NE-OE2 2.75Å; R175-E203 IonicContact NH2-OE2 3.57Å; R175-E203 PolarHBondContact NH2-OE2 3.44Å; V194-E203 HydrophobicContact CG1-CB 4.08Å; V194-E203 HydrophobicContact CG1-CG 4.33Å; R196-E203 IonicContact CZ-OE1 3.27Å; R196-E203 IonicContact NE-OE1 2.6Å; R196-E203 IonicContact NH2-OE1 2.71Å; R196-E203 PolarHBondContact NH2-OE1 2.91Å; E203-E826 PolarHBondContact N-OE1 2.7Å
204	C	86.9	Confident	87.8	Confident	3 Å²	3	63.9 Å²	63.9	2%	0.02	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	140.1	-178	-62.1	0	0	0	0	111	L159 P160 V194 I195 L209	L159-C204 HydrophobicContact CD2-CB 4.18Å; L159-C204 HydrophobicContact CG-CB 4.27Å; P160-C204 HydrophobicContact CG-CB 4.18Å; V194-C204 WeakPolarHBondContact CA-O 3.48Å; I195-C204 PolarHBondContact N-O 2.86Å; I195-C204 PolarHBondContact O-N 3.33Å; C204-L209 HydrophobicContact CB-CD1 4.19Å
205	R	88.2	Confident	87.4	Confident	63 Å²	63	64 Å²	64	24%	0.238	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	136.6	170.7	-45	175.8	-63	-151.4	-0.1	108.5	V192 I207 D208 L209 S823	V192-R205 HydrophobicContact CG1-CB 3.98Å; R205-I207 HydrophobicContact CB-CG2 4.18Å; R205-I207 PolarHBondContact O-N 3.43Å; R205-D208 VanDerWaalsContact CB-OD2 3.29Å; R205-D208 WeakPolarHBondContact CB-OD2 3.34Å; R205-D208 IonicContact CZ-OD1 3.85Å; R205-D208 IonicContact CZ-OD2 3.07Å; R205-D208 VanDerWaalsContact CZ-OD2 3.28Å; R205-D208 IonicContact NE-OD1 3.81Å; R205-D208 IonicContact NE-OD2 3.48Å; R205-D208 PolarHBondContact NE-OD2 3.5Å; R205-D208 VanDerWaalsContact NH2-CG 3.32Å; R205-D208 IonicContact NH2-OD1 2.91Å; R205-D208 PolarHBondContact NH2-OD1 3.29Å; R205-D208 IonicContact NH2-OD2 3.17Å; R205-D208 PolarHBondContact NH2-OD2 3.18Å; R205-D208 VanDerWaalsContact NH2-OD2 3.1Å; R205-D208 PolarHBondContact O-N 2.91Å; R205-L209 WeakPolarHBondContact O-CD1 3.37Å; R205-S823 PolarHBondContact NH2-OG 2.72Å
206	Q	85.5	Confident	86.6	Confident	96 Å²	96	67.2 Å²	67.2	45%	0.449	32%	0.32	S	S	.	.	G	3₁₀ helix	trans	-58.2	-25.1	-176.1	-171.7	173.6	21.3	0	0	113.5	G193 I195	G193-Q206 WeakPolarHBondContact O-CB 3.25Å; G193-Q206 PolarHBondContact O-N 3.04Å; I195-Q206 HydrophobicContact CD1-CB 4.01Å; I195-Q206 HydrophobicContact CD1-CG 3.81Å; I195-Q206 HydrophobicContact CG1-CB 4.43Å
207	I	85.8	Confident	85.4	Confident	118 Å²	118	65 Å²	65	61%	0.605	31%	0.314	S	S	*	.	G	3₁₀ helix	trans	-74.9	-20.1	176.2	-162.6	167.3	0	0	0	113.8	V192 R205	V192-I207 HydrophobicContact CG1-CB 3.93Å; V192-I207 HydrophobicContact CG1-CG2 3.74Å; R205-I207 HydrophobicContact CB-CG2 4.18Å; R205-I207 PolarHBondContact O-N 3.43Å
208	D	89.1	Confident	84	Confident	53 Å²	53	68.8 Å²	68.8	28%	0.283	34%	0.338	S	S	.	.	G	3₁₀ helix	trans	-90.6	-0.1	179.7	-51.7	-45	0	0	0	112.6	P160 R205 V210	P160-D208 HydrophobicContact CG-CB 3.58Å; R205-D208 VanDerWaalsContact CB-OD2 3.29Å; R205-D208 WeakPolarHBondContact CB-OD2 3.34Å; R205-D208 IonicContact CZ-OD1 3.85Å; R205-D208 IonicContact CZ-OD2 3.07Å; R205-D208 VanDerWaalsContact CZ-OD2 3.28Å; R205-D208 IonicContact NE-OD1 3.81Å; R205-D208 IonicContact NE-OD2 3.48Å; R205-D208 PolarHBondContact NE-OD2 3.5Å; R205-D208 VanDerWaalsContact NH2-CG 3.32Å; R205-D208 IonicContact NH2-OD1 2.91Å; R205-D208 PolarHBondContact NH2-OD1 3.29Å; R205-D208 IonicContact NH2-OD2 3.17Å; R205-D208 PolarHBondContact NH2-OD2 3.18Å; R205-D208 VanDerWaalsContact NH2-OD2 3.1Å; R205-D208 PolarHBondContact O-N 2.91Å; D208-V210 PolarHBondContact O-N 2.87Å
209	L	89.3	Confident	82.3	Confident	36 Å²	36	69 Å²	69	19%	0.188	34%	0.341	C	S	.	.	P	Polyproline II helix	trans	-76	116.8	177	-86.8	56.7	0	0	0	109.5	L159 L170 I195 C204 R205	L159-L209 HydrophobicContact CD1-CD1 4.21Å; L159-L209 HydrophobicContact CD1-CD2 3.96Å; L159-L209 HydrophobicContact CD1-CG 3.73Å; L159-L209 HydrophobicContact CG-CD1 3.97Å; L159-L209 HydrophobicContact CG-CG 4.05Å; L170-L209 HydrophobicContact CD1-CD2 3.71Å; I195-L209 HydrophobicContact CD1-CD2 3.96Å; C204-L209 HydrophobicContact CB-CD1 4.19Å; R205-L209 WeakPolarHBondContact O-CD1 3.37Å
210	V	88.6	Confident	80.4	Confident	78 Å²	78	71.4 Å²	71.4	47%	0.473	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	157.9	176.1	-58.7	0	0	0	0	110.7	K157 L158 D208	K157-V210 WeakPolarHBondContact CA-O 3.45Å; L158-V210 HydrophobicContact CB-CG2 3.95Å; L158-V210 HydrophobicContact CD2-CG2 4.27Å; L158-V210 PolarHBondContact N-O 3.35Å; L158-V210 PolarHBondContact O-N 3.21Å; D208-V210 PolarHBondContact O-N 2.87Å
211	D	87.2	Confident	78.2	Confident	36 Å²	36	72.1 Å²	72.1	19%	0.193	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	140.5	163.4	-77.3	-36.1	0	0	0	109.9	P156 K157 Y213 K216	P156-D211 WeakPolarHBondContact O-CA 3.21Å; K157-D211 IonicContact NZ-OD1 2.67Å; K157-D211 PolarHBondContact NZ-OD1 2.88Å; D211-Y213 HydrophobicContact CB-CD2 4.31Å; D211-Y213 HydrophobicContact CB-CE2 3.92Å; D211-Y213 WeakPolarHBondContact O-CD2 3.43Å; D211-Y213 PolarHBondContact O-N 3.19Å; D211-K216 HydrophobicContact CB-CD 4.25Å; D211-K216 IonicContact OD1-NZ 3.79Å; D211-K216 PolarHBondContact OD1-NZ 2.68Å; D211-K216 IonicContact OD2-NZ 3.84Å; D211-K216 PolarHBondContact OD2-NZ 2.93Å
212	N	86.3	Confident	75.6	Confident	3 Å²	3	69 Å²	69	2%	0.016	36%	0.361	C	S	.	.			trans	-76.6	90.5	170.6	-174.1	-24.2	0	0	0	109.4	P156 L158 S164 F214 V215 K216	P156-N212 HydrophobicContact CB-CB 4.21Å; P156-N212 PolarHBondContact O-N 2.81Å; L158-N212 HydrophobicContact CB-CB 4.14Å; S164-N212 PolarHBondContact OG-ND2 3.05Å; N212-F214 VanDerWaalsContact C-N 3.3Å; N212-F214 PolarHBondContact O-N 2.99Å; N212-F214 WeakPolarHBondContact OD1-CB 3.45Å; N212-F214 PolarHBondContact OD1-N 3.45Å; N212-F214 VanDerWaalsContact OD1-N 3.15Å; N212-V215 HydrophobicContact CB-CB 4.44Å; N212-V215 HydrophobicContact CB-CG2 4.35Å; N212-V215 PolarHBondContact O-N 3.39Å; N212-V215 PolarHBondContact OD1-N 2.96Å; N212-V215 VanDerWaalsContact OD1-N 3.16Å; N212-K216 PolarHBondContact O-N 2.93Å
213	Y	83.8	Confident	73	Confident	118 Å²	118	71 Å²	71	46%	0.463	38%	0.383	S	S	.	.	H	α-helix	trans	-63	-32.4	178.6	-72.3	-85.6	0	0	0	113.1	D211 V215 K216 D217	D211-Y213 HydrophobicContact CB-CD2 4.31Å; D211-Y213 HydrophobicContact CB-CE2 3.92Å; D211-Y213 WeakPolarHBondContact O-CD2 3.43Å; D211-Y213 PolarHBondContact O-N 3.19Å; Y213-V215 PolarHBondContact O-N 3.4Å; Y213-K216 PolarHBondContact O-N 3.14Å; Y213-K216 VanDerWaalsContact O-N 3.11Å; Y213-D217 WeakPolarHBondContact O-CB 3.17Å; Y213-D217 PolarHBondContact O-N 2.98Å
214	F	81.6	Confident	70.7	Confident	164 Å²	164	74.5 Å²	74.5	72%	0.719	41%	0.411	S	S	*	.	H	α-helix	trans	-58.4	-37.1	175.9	-51.8	-78.8	0	0	0	112	N212 T218	N212-F214 VanDerWaalsContact C-N 3.3Å; N212-F214 PolarHBondContact O-N 2.99Å; N212-F214 WeakPolarHBondContact OD1-CB 3.45Å; N212-F214 PolarHBondContact OD1-N 3.45Å; N212-F214 VanDerWaalsContact OD1-N 3.15Å; F214-T218 PolarHBondContact O-OG1 3.46Å
215	V	80	Confident	68.4	Low	6 Å²	6	79.4 Å²	79.4	4%	0.036	45%	0.446	C	S	.	.	H	α-helix	trans	-73.1	-46.4	172.9	173.8	0	0	0	0	111.5	L138 L148 Q149 P156 N212 Y213 D217 T218	L138-V215 WeakPolarHBondContact O-CG2 3.22Å; L148-V215 HydrophobicContact CB-CG1 3.7Å; L148-V215 HydrophobicContact CB-CG2 4.25Å; L148-V215 HydrophobicContact CD1-CG2 4.25Å; Q149-V215 HydrophobicContact CG-CG1 3.87Å; P156-V215 HydrophobicContact CB-CB 4.37Å; P156-V215 HydrophobicContact CB-CG1 4.17Å; P156-V215 HydrophobicContact CG-CB 4.22Å; P156-V215 HydrophobicContact CG-CG1 3.91Å; N212-V215 HydrophobicContact CB-CB 4.44Å; N212-V215 HydrophobicContact CB-CG2 4.35Å; N212-V215 PolarHBondContact O-N 3.39Å; N212-V215 PolarHBondContact OD1-N 2.96Å; N212-V215 VanDerWaalsContact OD1-N 3.16Å; Y213-V215 PolarHBondContact O-N 3.4Å; V215-D217 PolarHBondContact O-N 3.09Å; V215-T218 PolarHBondContact O-N 3.44Å
216	K	72.3	Confident	66	Low	71 Å²	71	83.5 Å²	83.5	31%	0.309	47%	0.472	S	S	.	.	H	α-helix	trans	-62.6	-38.8	-177.3	-69.4	-171.1	175.4	-168.3	0	112.9	P156 D211 N212 Y213 T218 S219	P156-K216 HydrophobicContact CG-CG 4.08Å; D211-K216 HydrophobicContact CB-CD 4.25Å; D211-K216 IonicContact OD1-NZ 3.79Å; D211-K216 PolarHBondContact OD1-NZ 2.68Å; D211-K216 IonicContact OD2-NZ 3.84Å; D211-K216 PolarHBondContact OD2-NZ 2.93Å; N212-K216 PolarHBondContact O-N 2.93Å; Y213-K216 PolarHBondContact O-N 3.14Å; Y213-K216 VanDerWaalsContact O-N 3.11Å; K216-T218 VanDerWaalsContact C-N 3.29Å; K216-T218 PolarHBondContact O-N 3.41Å; K216-S219 PolarHBondContact O-N 2.85Å; K216-S219 PolarHBondContact O-OG 2.88Å
217	D	65.1	Low	63.9	Low	43 Å²	43	87.3 Å²	87.3	23%	0.23	49%	0.49	C	S	.	.	H	α-helix	trans	-71.9	-24.1	-179.6	-71.2	-3	0	0	0	112.4	Y213 V215 Q287	Y213-D217 WeakPolarHBondContact O-CB 3.17Å; Y213-D217 PolarHBondContact O-N 2.98Å; V215-D217 PolarHBondContact O-N 3.09Å; D217-Q287 PolarHBondContact OD2-NE2 3.33Å
218	T	60.6	Low	61.5	Low	81 Å²	81	90.1 Å²	90.1	50%	0.497	50%	0.498	S	S	.	.	H	α-helix	trans	-81.9	-18	-179.3	-54.7	0	0	0	0	112.8	F214 V215 K216 E220	F214-T218 PolarHBondContact O-OG1 3.46Å; V215-T218 PolarHBondContact O-N 3.44Å; K216-T218 VanDerWaalsContact C-N 3.29Å; K216-T218 PolarHBondContact O-N 3.41Å; T218-E220 PolarHBondContact O-N 3.4Å
219	S	52.7	Low	59.8	Low	64 Å²	64	92.1 Å²	92.1	45%	0.448	52%	0.516	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.3	5.8	-161.5	65.6	0	0	0	0	117.9	K216	K216-S219 PolarHBondContact O-N 2.85Å; K216-S219 PolarHBondContact O-OG 2.88Å
220	E	49.7	Very low	58.6	Low	121 Å²	121	95.6 Å²	95.6	57%	0.565	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-127.1	26.7	180	-63.1	-168.7	149.5	0	0	113.8	R152 T218	R152-E220 IonicContact CZ-OE1 3.73Å; R152-E220 IonicContact NH2-OE1 2.99Å; R152-E220 PolarHBondContact NH2-OE1 2.86Å; T218-E220 PolarHBondContact O-N 3.4Å
221	A	42.6	Very low	58	Low	70 Å²	70	96 Å²	96	58%	0.579	53%	0.528	S	S	*	.			trans	-69.5	120.7	162.8	0	0	0	0	0	110.1	S223	A221-S223 VanDerWaalsContact C-N 3.3Å; A221-S223 PolarHBondContact O-N 3.33Å
222	P	35.8	Very low	58	Low	119 Å²	119	97.3 Å²	97.3	77%	0.773	54%	0.537	S	S	*	.			trans	-83.2	64.7	-165.5	33.9	-37.3	0	0	0	113.3
223	S	32.5	Very low	58.2	Low	112 Å²	112	97.4 Å²	97.4	78%	0.783	54%	0.538	S	S	*	.			trans	-104.3	45.3	-172	65.5	0	0	0	0	115	A221	A221-S223 VanDerWaalsContact C-N 3.3Å; A221-S223 PolarHBondContact O-N 3.33Å
224	S	40.6	Very low	58.4	Low	110 Å²	110	95.9 Å²	95.9	77%	0.769	54%	0.541	S	S	*	.	S	Bend	trans	-150.5	125	162.8	65.6	0	0	0	0	112.1	D226	S224-D226 PolarHBondContact O-N 3.04Å
225	S	38.6	Very low	58.5	Low	106 Å²	106	90.5 Å²	90.5	74%	0.741	52%	0.524	S	S	*	.			trans	-45	117.9	174.8	49.5	0	0	0	0	114.5
226	D	39.3	Very low	58.8	Low	149 Å²	149	91.3 Å²	91.3	80%	0.797	53%	0.529	S	S	*	.				-177.2	170.8	106.5	-88.1	-25	0	0	0	111.1	S224	S224-D226 PolarHBondContact O-N 3.04Å
227	E	40.4	Very low	59.5	Low	175 Å²	175	97.3 Å²	97.3	82%	0.818	56%	0.559	S	S	*	*			trans	59.5	105.2	174.4	-64.8	-67.6	76.8	0	0	118.6	S229	E227-S229 VanDerWaalsContact C-N 3.33Å; E227-S229 PolarHBondContact O-N 2.98Å
228	K	36.1	Very low	60.4	Low	178 Å²	178	101.4 Å²	101.4	77%	0.774	58%	0.581	S	S	*	*			trans	-63.8	78.6	176.6	-175.9	-158.2	166.7	-158.2	0	112.5	E230	K228-E230 IonicContact NZ-OE1 3.26Å; K228-E230 PolarHBondContact NZ-OE1 3.43Å; K228-E230 PolarHBondContact O-N 2.91Å
229	S	53.5	Low	61.3	Low	95 Å²	95	103.1 Å²	103.1	66%	0.664	59%	0.586	S	S	*	*			trans	-78.3	111.4	171.2	41.9	0	0	0	0	110.9	E227 Q231	E227-S229 VanDerWaalsContact C-N 3.33Å; E227-S229 PolarHBondContact O-N 2.98Å; S229-Q231 PolarHBondContact O-N 3.1Å; S229-Q231 PolarHBondContact O-NE2 3.33Å
230	E	63.6	Low	63	Low	108 Å²	108	101.6 Å²	101.6	51%	0.505	58%	0.578	S	S	.	*	P	Polyproline II helix	trans	-71.5	120.4	179	-63.5	-163.5	176.4	0	0	111.3	K228 V232 S241	K228-E230 IonicContact NZ-OE1 3.26Å; K228-E230 PolarHBondContact NZ-OE1 3.43Å; K228-E230 PolarHBondContact O-N 2.91Å; E230-V232 PolarHBondContact O-N 3.43Å; E230-V232 VanDerWaalsContact O-N 3.12Å; E230-S241 PolarHBondContact OE2-OG 2.99Å
231	Q	75.4	Confident	64.9	Low	87 Å²	87	98.2 Å²	98.2	41%	0.407	57%	0.567	S	S	.	*	P	Polyproline II helix	trans	-58	119.8	170.7	-73.2	65	33.6	0	0	109.5	S229 A242 W252 K275	S229-Q231 PolarHBondContact O-N 3.1Å; S229-Q231 PolarHBondContact O-NE2 3.33Å; Q231-A242 HydrophobicContact CB-CB 4.49Å; Q231-A242 VanDerWaalsContact O-CB 3.26Å; Q231-A242 WeakPolarHBondContact O-CB 3.31Å; Q231-A242 PolarHBondContact O-N 3.47Å; Q231-W252 HydrophobicContact CB-CD2 4.31Å; Q231-W252 HydrophobicContact CG-CD2 4.49Å; Q231-W252 HydrophobicContact CG-CZ2 4.43Å; Q231-K275 PolarHBondContact O-NZ 3.44Å
232	V	87.2	Confident	67	Low	64 Å²	64	95 Å²	95	39%	0.388	54%	0.541	S	S	.	.	B	Isolated β-bridge	trans	-90.3	161.2	174	-62.3	0	0	0	0	111	E230 N239	E230-V232 PolarHBondContact O-N 3.43Å; E230-V232 VanDerWaalsContact O-N 3.12Å; V232-N239 WeakPolarHBondContact CB-O 3.27Å; V232-N239 WeakPolarHBondContact CG1-O 3.4Å
233	C	91.6	Very high	69.6	Low	5 Å²	5	93 Å²	93	3%	0.034	53%	0.526	C	S	.	.	P	Polyproline II helix	trans	-66.3	137.9	174	-175	0	0	0	0	111.7	S235 C236 A240 W252 C254 C257	C233-S235 PolarHBondContact SG-N 3.48Å; C233-S235 VanDerWaalsContact SG-N 3.42Å; C233-C236 WeakPolarHBondContact CB-SG 3.31Å; C233-C236 PolarHBondContact SG-SG 3.02Å; C233-A240 VanDerWaalsContact CB-O 3.29Å; C233-A240 WeakPolarHBondContact CB-O 3.45Å; C233-A240 PolarHBondContact N-O 3.29Å; C233-W252 CarbonylContact C-O 3.54Å; C233-W252 VanDerWaalsContact CA-O 3.26Å; C233-W252 WeakPolarHBondContact CA-O 3.31Å; C233-W252 PolarHBondContact SG-O 2.98Å; C233-C254 HydrophobicContact CB-CB 3.75Å; C233-C254 PolarHBondContact SG-N 3.48Å; C233-C257 VanDerWaalsContact SG-SG 3.67Å
234	T	86.4	Confident	72.3	Confident	85 Å²	85	87.6 Å²	87.6	52%	0.521	49%	0.489	S	S	.	.	S	Bend	trans	-89.2	-24.1	174.8	51.8	0	0	0	0	113	E251 W252	T234-E251 WeakPolarHBondContact CB-OE2 3.36Å; T234-E251 VanDerWaalsContact OG1-CB 3.29Å; T234-E251 WeakPolarHBondContact OG1-CB 3.34Å; T234-E251 WeakPolarHBondContact OG1-CG 3.14Å; T234-E251 PolarHBondContact OG1-OE2 3.1Å; T234-W252 PolarHBondContact N-O 3.44Å; T234-W252 PolarHBondContact OG1-N 2.83Å; T234-W252 PolarHBondContact OG1-O 3.44Å
235	S	84.2	Confident	74.6	Confident	51 Å²	51	84.3 Å²	84.3	36%	0.357	46%	0.461	S	S	.	.	S	Bend	trans	-99.3	13.7	-174.4	-20.4	0	0	0	0	114.9	C233 E251 L253	C233-S235 PolarHBondContact SG-N 3.48Å; C233-S235 VanDerWaalsContact SG-N 3.42Å; S235-E251 WeakPolarHBondContact CB-OE2 3.26Å; S235-E251 PolarHBondContact N-OE2 2.85Å; S235-E251 PolarHBondContact OG-OE2 2.68Å; S235-L253 WeakPolarHBondContact OG-CD2 3.45Å
236	C	87.1	Confident	77.1	Confident	24 Å²	24	79.2 Å²	79.2	16%	0.162	43%	0.425	C	S	.	.			trans	-140.7	145.6	169.2	65.9	0	0	0	0	111.8	C233 D238	C233-C236 WeakPolarHBondContact CB-SG 3.31Å; C233-C236 PolarHBondContact SG-SG 3.02Å; C236-D238 PolarHBondContact O-N 2.7Å
237	E	86.5	Confident	79.2	Confident	197 Å²	197	73.1 Å²	73.1	92%	0.921	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.3	-14.8	179.9	-59.3	179.6	126.2	0	0	112.9	N239	E237-N239 PolarHBondContact O-N 2.78Å
238	D	84.2	Confident	81.2	Confident	129 Å²	129	69.5 Å²	69.5	69%	0.69	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-2.7	-176.9	-54.5	-57.9	0	0	0	115.2	C236 A240	C236-D238 PolarHBondContact O-N 2.7Å; D238-A240 HydrophobicContact CB-CB 4.3Å; D238-A240 PolarHBondContact O-N 3.31Å
239	N	80.2	Confident	83.5	Confident	116 Å²	116	63.5 Å²	63.5	62%	0.62	36%	0.356	S	S	*	.			trans	48.1	25	-168.3	-64.8	123.4	0	0	0	114.5	V232 E237 S241	V232-N239 WeakPolarHBondContact CB-O 3.27Å; V232-N239 WeakPolarHBondContact CG1-O 3.4Å; E237-N239 PolarHBondContact O-N 2.78Å; N239-S241 PolarHBondContact O-N 2.92Å
240	A	87.3	Confident	84.9	Confident	32 Å²	32	61.2 Å²	61.2	26%	0.264	35%	0.348	S	S	.	.	P	Polyproline II helix	trans	-61.4	134.8	-172.7	0	0	0	0	0	112.4	C233 D238 A242 C254	C233-A240 VanDerWaalsContact CB-O 3.29Å; C233-A240 WeakPolarHBondContact CB-O 3.45Å; C233-A240 PolarHBondContact N-O 3.29Å; D238-A240 HydrophobicContact CB-CB 4.3Å; D238-A240 PolarHBondContact O-N 3.31Å; A240-A242 PolarHBondContact O-N 3.43Å; A240-C254 HydrophobicContact CB-CB 3.69Å
241	S	89.2	Confident	86	Confident	50 Å²	50	59.2 Å²	59.2	35%	0.35	34%	0.338	S	S	.	.	B	Isolated β-bridge	trans	-55.5	127.4	-177.5	-160.7	0	0	0	0	111	E230 N239	E230-S241 PolarHBondContact OE2-OG 2.99Å; N239-S241 PolarHBondContact O-N 2.92Å
242	A	88.4	Confident	86.6	Confident	4 Å²	4	58.1 Å²	58.1	3%	0.033	33%	0.33	C	S	.	.	P	Polyproline II helix	trans	-73	143	-173.3	0	0	0	0	0	111.4	Q231 A240 W252 K275	Q231-A242 HydrophobicContact CB-CB 4.49Å; Q231-A242 VanDerWaalsContact O-CB 3.26Å; Q231-A242 WeakPolarHBondContact O-CB 3.31Å; Q231-A242 PolarHBondContact O-N 3.47Å; A240-A242 PolarHBondContact O-N 3.43Å; A242-W252 HydrophobicContact CB-CB 3.9Å; A242-W252 HydrophobicContact CB-CE3 4Å; A242-K275 WeakPolarHBondContact O-CD 3.42Å; A242-K275 PolarHBondContact O-NZ 3.44Å
243	V	89.8	Confident	86.9	Confident	75 Å²	75	55 Å²	55	46%	0.455	31%	0.312	S	S	.	.			trans	-117.4	-17	-176.1	-161.6	0	0	0	0	111.5	L253 K255 I258 K274 K275	V243-L253 PolarHBondContact N-O 3.38Å; V243-K255 HydrophobicContact CG2-CB 4.31Å; V243-I258 HydrophobicContact CB-CD1 4.27Å; V243-K274 WeakPolarHBondContact O-CA 3.31Å; V243-K275 PolarHBondContact O-N 2.94Å
244	G	88.3	Confident	86.9	Confident	0 Å²	0	55 Å²	55	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.6	175.9	174.7	0	0	0	0	0	113	L253 R273	G244-L253 PolarHBondContact N-O 3.06Å; G244-L253 PolarHBondContact O-N 2.97Å; G244-R273 CarbonylContact C-O 3.57Å; G244-R273 WeakPolarHBondContact CA-O 3.1Å
245	F	90.5	Very high	87.2	Confident	40 Å²	40	57.3 Å²	57.3	18%	0.175	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	127.8	-178.8	179.3	-96.4	0	0	0	109.6	V247 G250 E251 W252 I272 R273 V278	F245-V247 HydrophobicContact CD1-CG2 4.44Å; F245-G250 VanDerWaalsContact CE2-C 3.4Å; F245-G250 WeakPolarHBondContact CE2-O 3.37Å; F245-E251 WeakPolarHBondContact CA-O 3.37Å; F245-E251 WeakPolarHBondContact CD2-O 3.27Å; F245-W252 HydrophobicContact CB-CD2 4.29Å; F245-W252 HydrophobicContact CB-CE3 4.03Å; F245-W252 HydrophobicContact CB-CH2 4.42Å; F245-W252 HydrophobicContact CB-CZ3 4.11Å; F245-W252 AromaticContact CD2-CD1 3.96Å; F245-W252 AromaticContact CD2-CD2 3.9Å; F245-W252 HydrophobicContact CD2-CD2 3.9Å; F245-W252 AromaticContact CD2-CE2 3.83Å; F245-W252 HydrophobicContact CD2-CE3 4.49Å; F245-W252 HydrophobicContact CD2-CG 4Å; F245-W252 HydrophobicContact CD2-CZ2 4.38Å; F245-W252 AromaticContact CD2-NE1 3.84Å; F245-I272 WeakPolarHBondContact O-CA 3.48Å; F245-R273 PolarHBondContact N-O 3.19Å; F245-R273 PolarHBondContact O-N 3.38Å; F245-V278 HydrophobicContact CB-CG2 4.02Å
246	C	89.7	Confident	87.6	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	116	176.6	176.3	0	0	0	0	109.8	E248 C249 G250 E251 L253 H261 H270 I272	C246-E248 PolarHBondContact O-N 2.6Å; C246-C249 HydrophobicContact CB-CB 4.27Å; C246-G250 WeakPolarHBondContact O-CA 3.47Å; C246-G250 PolarHBondContact O-N 3.34Å; C246-E251 PolarHBondContact N-O 2.86Å; C246-E251 PolarHBondContact O-N 3.08Å; C246-L253 HydrophobicContact CB-CD1 3.82Å; C246-L253 HydrophobicContact CB-CG 4.3Å; C246-H261 PolarHBondContact SG-CE1 3.28Å; C246-H270 PolarHBondContact SG-ND1 2.86Å; C246-H270 VanDerWaalsContact SG-ND1 3.38Å; C246-I272 HydrophobicContact CB-CG1 4.2Å
247	V	83.6	Confident	87.9	Confident	20 Å²	20	58.6 Å²	58.6	12%	0.121	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-38.5	-172.8	178.6	0	0	0	0	111.9	F245 L271 R273 T284	F245-V247 HydrophobicContact CD1-CG2 4.44Å; V247-L271 HydrophobicContact CG2-CB 4.42Å; V247-L271 HydrophobicContact CG2-CD2 4.29Å; V247-L271 HydrophobicContact CG2-CG 4.3Å; V247-L271 WeakPolarHBondContact CG2-O 3.49Å; V247-L271 PolarHBondContact N-O 3.41Å; V247-R273 HydrophobicContact CG2-CG 4.35Å; V247-T284 HydrophobicContact CG1-CG2 3.91Å
248	E	83.3	Confident	88.2	Confident	99 Å²	99	50.4 Å²	50.4	46%	0.463	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.6	-22.2	-173.8	-58.5	79.2	179.1	0	0	113.2	C246 H270 L271	C246-E248 PolarHBondContact O-N 2.6Å; E248-H270 HydrophobicContact CB-CB 4.43Å; E248-H270 HydrophobicContact CG-CB 4.47Å; E248-H270 WeakPolarHBondContact OE2-CA 3.42Å; E248-H270 VanDerWaalsContact OE2-CB 3.23Å; E248-H270 WeakPolarHBondContact OE2-CB 3.45Å; E248-H270 IonicContact OE2-CG 3.15Å; E248-L271 VanDerWaalsContact OE1-CB 3.31Å; E248-L271 WeakPolarHBondContact OE1-CB 3.24Å; E248-L271 PolarHBondContact OE1-N 3.2Å; E248-L271 PolarHBondContact OE2-N 2.89Å
249	C	84.4	Confident	88.6	Confident	52 Å²	52	48.5 Å²	48.5	35%	0.351	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.8	-21.6	170.7	-70.7	0	0	0	0	113	C246 E251 H261 H270	C246-C249 HydrophobicContact CB-CB 4.27Å; C249-E251 VanDerWaalsContact C-N 3.29Å; C249-E251 HydrophobicContact CB-CB 4.14Å; C249-E251 HydrophobicContact CB-CG 4.27Å; C249-H261 VanDerWaalsContact SG-CE1 3.6Å; C249-H270 VanDerWaalsContact SG-CE1 3.51Å; C249-H270 PolarHBondContact SG-ND1 2.64Å
250	G	81.4	Confident	89.1	Confident	47 Å²	47	44 Å²	44	49%	0.485	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	71.6	22.7	-172.2	0	0	0	0	0	113.7	F245 C246	F245-G250 VanDerWaalsContact CE2-C 3.4Å; F245-G250 WeakPolarHBondContact CE2-O 3.37Å; C246-G250 WeakPolarHBondContact O-CA 3.47Å; C246-G250 PolarHBondContact O-N 3.34Å
251	E	87.1	Confident	89.3	Confident	66 Å²	66	43.5 Å²	43.5	31%	0.308	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	142.2	-167.4	-79.9	-160.7	-125.3	0	0	113.6	T234 S235 F245 C246 C249 L253	T234-E251 WeakPolarHBondContact CB-OE2 3.36Å; T234-E251 VanDerWaalsContact OG1-CB 3.29Å; T234-E251 WeakPolarHBondContact OG1-CB 3.34Å; T234-E251 WeakPolarHBondContact OG1-CG 3.14Å; T234-E251 PolarHBondContact OG1-OE2 3.1Å; S235-E251 WeakPolarHBondContact CB-OE2 3.26Å; S235-E251 PolarHBondContact N-OE2 2.85Å; S235-E251 PolarHBondContact OG-OE2 2.68Å; F245-E251 WeakPolarHBondContact CA-O 3.37Å; F245-E251 WeakPolarHBondContact CD2-O 3.27Å; C246-E251 PolarHBondContact N-O 2.86Å; C246-E251 PolarHBondContact O-N 3.08Å; C249-E251 VanDerWaalsContact C-N 3.29Å; C249-E251 HydrophobicContact CB-CB 4.14Å; C249-E251 HydrophobicContact CB-CG 4.27Å; E251-L253 HydrophobicContact CB-CD2 4.21Å
252	W	89.4	Confident	89.3	Confident	64 Å²	64	46.4 Å²	46.4	24%	0.242	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	127.8	172.6	-76.6	98.9	0	0	0	109.7	Q231 C233 T234 A242 F245 K275 V278	Q231-W252 HydrophobicContact CB-CD2 4.31Å; Q231-W252 HydrophobicContact CG-CD2 4.49Å; Q231-W252 HydrophobicContact CG-CZ2 4.43Å; C233-W252 CarbonylContact C-O 3.54Å; C233-W252 VanDerWaalsContact CA-O 3.26Å; C233-W252 WeakPolarHBondContact CA-O 3.31Å; C233-W252 PolarHBondContact SG-O 2.98Å; T234-W252 PolarHBondContact N-O 3.44Å; T234-W252 PolarHBondContact OG1-N 2.83Å; T234-W252 PolarHBondContact OG1-O 3.44Å; A242-W252 HydrophobicContact CB-CB 3.9Å; A242-W252 HydrophobicContact CB-CE3 4Å; F245-W252 HydrophobicContact CB-CD2 4.29Å; F245-W252 HydrophobicContact CB-CE3 4.03Å; F245-W252 HydrophobicContact CB-CH2 4.42Å; F245-W252 HydrophobicContact CB-CZ3 4.11Å; F245-W252 AromaticContact CD2-CD1 3.96Å; F245-W252 AromaticContact CD2-CD2 3.9Å; F245-W252 HydrophobicContact CD2-CD2 3.9Å; F245-W252 AromaticContact CD2-CE2 3.83Å; F245-W252 HydrophobicContact CD2-CE3 4.49Å; F245-W252 HydrophobicContact CD2-CG 4Å; F245-W252 HydrophobicContact CD2-CZ2 4.38Å; F245-W252 AromaticContact CD2-NE1 3.84Å; W252-K275 HydrophobicContact CZ3-CB 4.23Å; W252-K275 HydrophobicContact CZ3-CD 4.37Å; W252-K275 HydrophobicContact CZ3-CG 4.05Å; W252-V278 HydrophobicContact CH2-CB 4.25Å; W252-V278 HydrophobicContact CH2-CG1 4.04Å; W252-V278 HydrophobicContact CH2-CG2 4.46Å; W252-V278 HydrophobicContact CZ2-CG1 4.42Å
253	L	91.9	Very high	89.5	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	129.5	-171.7	-54.4	-175.3	0	0	0	111.2	S235 V243 G244 C246 E251 C257 I258 H261 I272	S235-L253 WeakPolarHBondContact OG-CD2 3.45Å; V243-L253 PolarHBondContact N-O 3.38Å; G244-L253 PolarHBondContact N-O 3.06Å; G244-L253 PolarHBondContact O-N 2.97Å; C246-L253 HydrophobicContact CB-CD1 3.82Å; C246-L253 HydrophobicContact CB-CG 4.3Å; E251-L253 HydrophobicContact CB-CD2 4.21Å; L253-C257 HydrophobicContact CB-CB 4.12Å; L253-C257 HydrophobicContact CD2-CB 4.07Å; L253-I258 HydrophobicContact CB-CD1 4.36Å; L253-I258 HydrophobicContact CB-CG1 3.53Å; L253-I258 HydrophobicContact CD1-CG1 4.08Å; L253-I258 HydrophobicContact CG-CG1 4.46Å; L253-H261 HydrophobicContact CD1-CB 4.44Å; L253-I272 HydrophobicContact CD1-CD1 3.85Å; L253-I272 HydrophobicContact CD1-CG1 4.27Å
254	C	93.2	Very high	89.4	Confident	4 Å²	4	54.1 Å²	54.1	3%	0.027	28%	0.276	C	S	.	.			trans	-69.8	166.3	160.8	70.7	0	0	0	0	110	C233 A240 T256 C257 I258	C233-C254 HydrophobicContact CB-CB 3.75Å; C233-C254 PolarHBondContact SG-N 3.48Å; A240-C254 HydrophobicContact CB-CB 3.69Å; C254-T256 PolarHBondContact O-N 2.9Å; C254-C257 PolarHBondContact O-N 2.71Å; C254-C257 VanDerWaalsContact SG-SG 3.65Å; C254-I258 WeakPolarHBondContact O-CG1 3.35Å; C254-I258 PolarHBondContact O-N 3.28Å
255	K	92.6	Very high	89.4	Confident	133 Å²	133	63.6 Å²	63.6	58%	0.578	32%	0.317	S	S	*	.	H	α-helix	trans	-51.3	-43.7	-180	-166	-170.4	-179.7	-128.8	0	112.8	V243 C257 I258 E259	V243-K255 HydrophobicContact CG2-CB 4.31Å; K255-C257 VanDerWaalsContact C-N 3.31Å; K255-C257 PolarHBondContact O-N 2.97Å; K255-I258 WeakPolarHBondContact O-CB 3.41Å; K255-I258 PolarHBondContact O-N 2.84Å; K255-E259 WeakPolarHBondContact CE-OE1 3.19Å; K255-E259 IonicContact NZ-OE1 2.79Å; K255-E259 PolarHBondContact NZ-OE1 3.47Å; K255-E259 WeakPolarHBondContact O-CG 3.39Å; K255-E259 PolarHBondContact O-N 3.4Å
256	T	92.7	Very high	89.1	Confident	89 Å²	89	70.4 Å²	70.4	55%	0.546	35%	0.347	S	S	.	.	H	α-helix	trans	-62.8	-35.4	179.1	-38.5	0	0	0	0	112.6	C254 A260	C254-T256 PolarHBondContact O-N 2.9Å; T256-A260 WeakPolarHBondContact O-CB 3.48Å; T256-A260 PolarHBondContact O-N 2.97Å
257	C	92.9	Very high	89	Confident	13 Å²	13	71.6 Å²	71.6	9%	0.088	35%	0.354	C	S	.	.	H	α-helix	trans	-80.5	-28.6	177.2	-66.6	0	0	0	0	112.9	C233 L253 C254 K255 A260 H261	C233-C257 VanDerWaalsContact SG-SG 3.67Å; L253-C257 HydrophobicContact CB-CB 4.12Å; L253-C257 HydrophobicContact CD2-CB 4.07Å; C254-C257 PolarHBondContact O-N 2.71Å; C254-C257 VanDerWaalsContact SG-SG 3.65Å; K255-C257 VanDerWaalsContact C-N 3.31Å; K255-C257 PolarHBondContact O-N 2.97Å; C257-A260 CarbonylContact O-C 3.42Å; C257-A260 WeakPolarHBondContact O-CB 3.37Å; C257-A260 PolarHBondContact O-N 3.48Å; C257-H261 PolarHBondContact O-N 3.02Å
258	I	92	Very high	89.1	Confident	25 Å²	25	76 Å²	76	13%	0.128	37%	0.371	C	S	.	.	H	α-helix	trans	-63	-47.9	167.6	-64.2	175.5	0	0	0	109.9	V243 L253 C254 K255 A260 H261 Q262 I272	V243-I258 HydrophobicContact CB-CD1 4.27Å; L253-I258 HydrophobicContact CB-CD1 4.36Å; L253-I258 HydrophobicContact CB-CG1 3.53Å; L253-I258 HydrophobicContact CD1-CG1 4.08Å; L253-I258 HydrophobicContact CG-CG1 4.46Å; C254-I258 WeakPolarHBondContact O-CG1 3.35Å; C254-I258 PolarHBondContact O-N 3.28Å; K255-I258 WeakPolarHBondContact O-CB 3.41Å; K255-I258 PolarHBondContact O-N 2.84Å; I258-A260 PolarHBondContact O-N 2.78Å; I258-H261 PolarHBondContact O-N 3.25Å; I258-Q262 WeakPolarHBondContact O-CG 3.2Å; I258-Q262 PolarHBondContact O-N 3.07Å; I258-I272 HydrophobicContact CB-CD1 4.34Å; I258-I272 HydrophobicContact CD1-CG2 4.03Å; I258-I272 HydrophobicContact CG1-CD1 4.39Å; I258-I272 HydrophobicContact CG1-CG2 4.02Å; I258-I272 HydrophobicContact CG2-CD1 3.9Å; I258-I272 HydrophobicContact CG2-CG2 4.34Å
259	E	92.3	Very high	89.3	Confident	90 Å²	90	77.2 Å²	77.2	42%	0.421	38%	0.381	S	S	.	.	H	α-helix	trans	-64.3	-26.5	173.9	-67.8	172.4	-164.9	0	0	111.9	K255 R263	K255-E259 WeakPolarHBondContact CE-OE1 3.19Å; K255-E259 IonicContact NZ-OE1 2.79Å; K255-E259 PolarHBondContact NZ-OE1 3.47Å; K255-E259 WeakPolarHBondContact O-CG 3.39Å; K255-E259 PolarHBondContact O-N 3.4Å; E259-R263 WeakPolarHBondContact O-CD 3.48Å; E259-R263 WeakPolarHBondContact O-CG 3.37Å; E259-R263 PolarHBondContact O-N 3.36Å
260	A	91.2	Very high	89.6	Confident	22 Å²	22	77 Å²	77	18%	0.182	38%	0.375	C	S	.	.	H	α-helix	trans	-75.6	-37.6	171.9	0	0	0	0	0	113.6	T256 C257 I258 R263 V264	T256-A260 WeakPolarHBondContact O-CB 3.48Å; T256-A260 PolarHBondContact O-N 2.97Å; C257-A260 CarbonylContact O-C 3.42Å; C257-A260 WeakPolarHBondContact O-CB 3.37Å; C257-A260 PolarHBondContact O-N 3.48Å; I258-A260 PolarHBondContact O-N 2.78Å; A260-R263 WeakPolarHBondContact O-CG 3.4Å; A260-V264 WeakPolarHBondContact O-CB 3.47Å; A260-V264 WeakPolarHBondContact O-CG2 3.39Å; A260-V264 PolarHBondContact O-N 3.26Å
261	H	92.2	Very high	89.9	Confident	20 Å²	20	79.1 Å²	79.1	9%	0.093	37%	0.374	C	S	.	.	H	α-helix	trans	-61.3	-55.5	170.9	-95.7	-126.4	0	0	0	110.6	C246 C249 L253 C257 I258 R263 V264 T267 K268 H270 I272	C246-H261 PolarHBondContact SG-CE1 3.28Å; C249-H261 VanDerWaalsContact SG-CE1 3.6Å; L253-H261 HydrophobicContact CD1-CB 4.44Å; C257-H261 PolarHBondContact O-N 3.02Å; I258-H261 PolarHBondContact O-N 3.25Å; H261-R263 PolarHBondContact O-N 3.16Å; H261-V264 PolarHBondContact O-N 3.12Å; H261-T267 CarbonylContact O-C 3.57Å; H261-T267 PolarHBondContact O-OG1 3.33Å; H261-K268 VanDerWaalsContact O-CA 3.23Å; H261-K268 WeakPolarHBondContact O-CA 3.37Å; H261-K268 PolarHBondContact O-N 3.34Å; H261-K268 VanDerWaalsContact O-N 3.13Å; H261-H270 AromaticContact CE1-ND1 3.94Å; H261-I272 HydrophobicContact CB-CD1 3.73Å
262	Q	89	Confident	90	Very high	111 Å²	111	77.6 Å²	77.6	52%	0.519	37%	0.368	S	S	.	.	H	α-helix	trans	-63	-17.9	-173.5	-68.3	174.4	-0.4	0	0	114.1	I258 K268 I272	I258-Q262 WeakPolarHBondContact O-CG 3.2Å; I258-Q262 PolarHBondContact O-N 3.07Å; Q262-K268 WeakPolarHBondContact O-CG 3.28Å; Q262-I272 HydrophobicContact CG-CD1 4.47Å
263	R	91.3	Very high	89.8	Confident	178 Å²	178	76.9 Å²	76.9	67%	0.672	37%	0.365	S	S	*	.	H	α-helix	trans	-96.7	-16.5	174.6	78.5	-171.9	-172.8	-124.5	-0.9	114.9	E259 A260 H261	E259-R263 WeakPolarHBondContact O-CD 3.48Å; E259-R263 WeakPolarHBondContact O-CG 3.37Å; E259-R263 PolarHBondContact O-N 3.36Å; A260-R263 WeakPolarHBondContact O-CG 3.4Å; H261-R263 PolarHBondContact O-N 3.16Å
264	V	89	Confident	89.4	Confident	64 Å²	64	82 Å²	82	39%	0.388	39%	0.388	S	S	.	.	S	Bend	trans	-93.8	128.9	-174.1	164.8	0	0	0	0	110.7	A260 H261 F266 T267 K268	A260-V264 WeakPolarHBondContact O-CB 3.47Å; A260-V264 WeakPolarHBondContact O-CG2 3.39Å; A260-V264 PolarHBondContact O-N 3.26Å; H261-V264 PolarHBondContact O-N 3.12Å; V264-F266 PolarHBondContact O-N 3.45Å; V264-T267 WeakPolarHBondContact CB-OG1 3.39Å; V264-T267 PolarHBondContact O-N 2.95Å; V264-K268 VanDerWaalsContact O-CB 3.28Å; V264-K268 WeakPolarHBondContact O-CB 3.42Å; V264-K268 PolarHBondContact O-N 2.94Å
265	K	87.4	Confident	88.7	Confident	199 Å²	199	85.3 Å²	85.3	87%	0.865	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.3	-24.7	-173.2	-75.6	-170.7	175.5	-175.8	0	115.8
266	F	84.3	Confident	87.8	Confident	183 Å²	183	85.9 Å²	85.9	80%	0.803	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.6	-28.9	179	-83	-82.2	0	0	0	113.8	V264 H270	V264-F266 PolarHBondContact O-N 3.45Å; F266-H270 PolarHBondContact O-NE2 2.92Å
267	T	86.8	Confident	86.6	Confident	25 Å²	25	85.9 Å²	85.9	15%	0.153	40%	0.403	C	S	.	.	T	Hydrogen-bonded Turn	trans	-117.8	0.8	-170.3	51	0	0	0	0	113.7	H261 V264 D269 H270	H261-T267 CarbonylContact O-C 3.57Å; H261-T267 PolarHBondContact O-OG1 3.33Å; V264-T267 WeakPolarHBondContact CB-OG1 3.39Å; V264-T267 PolarHBondContact O-N 2.95Å; T267-D269 VanDerWaalsContact C-N 3.33Å; T267-D269 PolarHBondContact O-N 2.98Å; T267-H270 WeakPolarHBondContact O-CB 3.18Å; T267-H270 PolarHBondContact O-N 3.43Å
268	K	87.5	Confident	84.9	Confident	112 Å²	112	87.6 Å²	87.6	49%	0.487	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-39.5	177.2	167.8	179.1	163	-75.6	0	113.1	H261 Q262 V264 H270	H261-K268 VanDerWaalsContact O-CA 3.23Å; H261-K268 WeakPolarHBondContact O-CA 3.37Å; H261-K268 PolarHBondContact O-N 3.34Å; H261-K268 VanDerWaalsContact O-N 3.13Å; Q262-K268 WeakPolarHBondContact O-CG 3.28Å; V264-K268 VanDerWaalsContact O-CB 3.28Å; V264-K268 WeakPolarHBondContact O-CB 3.42Å; V264-K268 PolarHBondContact O-N 2.94Å; K268-H270 VanDerWaalsContact C-N 3.27Å; K268-H270 PolarHBondContact O-N 2.74Å
269	D	86.9	Confident	82.7	Confident	124 Å²	124	90.2 Å²	90.2	66%	0.663	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.3	13.5	-173	-54.3	-44.7	0	0	0	111.9	T267	T267-D269 VanDerWaalsContact C-N 3.33Å; T267-D269 PolarHBondContact O-N 2.98Å
270	H	89.8	Confident	80.6	Confident	48 Å²	48	94.8 Å²	94.8	22%	0.222	46%	0.455	C	S	.	.	S	Bend	trans	-78.9	138.3	174.3	-71.9	-158.7	0	0	0	111.9	C246 E248 C249 H261 F266 T267 K268 I272	C246-H270 PolarHBondContact SG-ND1 2.86Å; C246-H270 VanDerWaalsContact SG-ND1 3.38Å; E248-H270 HydrophobicContact CB-CB 4.43Å; E248-H270 HydrophobicContact CG-CB 4.47Å; E248-H270 WeakPolarHBondContact OE2-CA 3.42Å; E248-H270 VanDerWaalsContact OE2-CB 3.23Å; E248-H270 WeakPolarHBondContact OE2-CB 3.45Å; E248-H270 IonicContact OE2-CG 3.15Å; C249-H270 VanDerWaalsContact SG-CE1 3.51Å; C249-H270 PolarHBondContact SG-ND1 2.64Å; H261-H270 AromaticContact CE1-ND1 3.94Å; F266-H270 PolarHBondContact O-NE2 2.92Å; T267-H270 WeakPolarHBondContact O-CB 3.18Å; T267-H270 PolarHBondContact O-N 3.43Å; K268-H270 VanDerWaalsContact C-N 3.27Å; K268-H270 PolarHBondContact O-N 2.74Å; H270-I272 PolarHBondContact O-N 2.75Å
271	L	88.3	Confident	78.1	Confident	91 Å²	91	99 Å²	99	48%	0.476	48%	0.483	S	S	.	.			trans	-74.1	104.8	175	-178.6	61.7	0	0	0	111.1	V247 E248 R273	V247-L271 HydrophobicContact CG2-CB 4.42Å; V247-L271 HydrophobicContact CG2-CD2 4.29Å; V247-L271 HydrophobicContact CG2-CG 4.3Å; V247-L271 WeakPolarHBondContact CG2-O 3.49Å; V247-L271 PolarHBondContact N-O 3.41Å; E248-L271 VanDerWaalsContact OE1-CB 3.31Å; E248-L271 WeakPolarHBondContact OE1-CB 3.24Å; E248-L271 PolarHBondContact OE1-N 3.2Å; E248-L271 PolarHBondContact OE2-N 2.89Å; L271-R273 HydrophobicContact CG-CG 4.46Å
272	I	89.2	Confident	75.5	Confident	35 Å²	35	101.4 Å²	101.4	18%	0.179	50%	0.499	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	111.5	171.2	-58.3	172.6	0	0	0	108.8	F245 C246 L253 I258 H261 Q262 H270	F245-I272 WeakPolarHBondContact O-CA 3.48Å; C246-I272 HydrophobicContact CB-CG1 4.2Å; L253-I272 HydrophobicContact CD1-CD1 3.85Å; L253-I272 HydrophobicContact CD1-CG1 4.27Å; I258-I272 HydrophobicContact CB-CD1 4.34Å; I258-I272 HydrophobicContact CD1-CG2 4.03Å; I258-I272 HydrophobicContact CG1-CD1 4.39Å; I258-I272 HydrophobicContact CG1-CG2 4.02Å; I258-I272 HydrophobicContact CG2-CD1 3.9Å; I258-I272 HydrophobicContact CG2-CG2 4.34Å; H261-I272 HydrophobicContact CB-CD1 3.73Å; Q262-I272 HydrophobicContact CG-CD1 4.47Å; H270-I272 PolarHBondContact O-N 2.75Å
273	R	84.9	Confident	72.9	Confident	48 Å²	48	99 Å²	99	18%	0.181	50%	0.503	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	145.1	169	-59.1	-166	-167.3	111.3	6	109.4	G244 F245 V247 L271 D277 V278 V282	G244-R273 CarbonylContact C-O 3.57Å; G244-R273 WeakPolarHBondContact CA-O 3.1Å; F245-R273 PolarHBondContact N-O 3.19Å; F245-R273 PolarHBondContact O-N 3.38Å; V247-R273 HydrophobicContact CG2-CG 4.35Å; L271-R273 HydrophobicContact CG-CG 4.46Å; R273-D277 HydrophobicContact CB-CB 4.43Å; R273-V278 HydrophobicContact CB-CG2 3.77Å; R273-V282 VanDerWaalsContact CZ-CG1 3.49Å; R273-V282 PolarHBondContact NH1-O 3.36Å; R273-V282 VanDerWaalsContact NH2-CG1 3.3Å
274	K	83.6	Confident	70.3	Confident	109 Å²	109	95.1 Å²	95.1	47%	0.474	50%	0.5	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	159.7	172.9	-51.6	-179.1	-169.6	167.9	0	110.6	V243 E276 D277 V278	V243-K274 WeakPolarHBondContact O-CA 3.31Å; K274-E276 HydrophobicContact CB-CB 4.3Å; K274-E276 HydrophobicContact CB-CG 4.45Å; K274-E276 HydrophobicContact CD-CG 4.48Å; K274-E276 WeakPolarHBondContact CD-OE1 3.41Å; K274-E276 WeakPolarHBondContact CE-OE1 3.26Å; K274-E276 IonicContact NZ-OE1 2.79Å; K274-E276 PolarHBondContact NZ-OE1 3.38Å; K274-E276 PolarHBondContact O-N 3.03Å; K274-E276 VanDerWaalsContact O-N 3.12Å; K274-D277 VanDerWaalsContact CB-OD2 3.25Å; K274-D277 WeakPolarHBondContact CB-OD2 3.42Å; K274-D277 VanDerWaalsContact CG-OD2 3.25Å; K274-D277 WeakPolarHBondContact CG-OD2 3.42Å; K274-D277 PolarHBondContact N-OD2 3.45Å; K274-D277 PolarHBondContact O-N 3.31Å; K274-V278 WeakPolarHBondContact O-CG2 3.49Å; K274-V278 PolarHBondContact O-N 2.85Å; K274-V278 VanDerWaalsContact O-N 3.12Å
275	K	79.2	Confident	68.2	Low	72 Å²	72	96.2 Å²	96.2	31%	0.313	51%	0.51	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-23	171.5	-169.6	162.9	177.6	174.9	0	113.1	Q231 A242 V243 W252	Q231-K275 PolarHBondContact O-NZ 3.44Å; A242-K275 WeakPolarHBondContact O-CD 3.42Å; A242-K275 PolarHBondContact O-NZ 3.44Å; V243-K275 PolarHBondContact O-N 2.94Å; W252-K275 HydrophobicContact CZ3-CB 4.23Å; W252-K275 HydrophobicContact CZ3-CD 4.37Å; W252-K275 HydrophobicContact CZ3-CG 4.05Å
276	E	72.9	Confident	66.3	Low	145 Å²	145	90.5 Å²	90.5	68%	0.678	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-40.8	170.1	-51.5	174.8	-96	0	0	112.6	K274	K274-E276 HydrophobicContact CB-CB 4.3Å; K274-E276 HydrophobicContact CB-CG 4.45Å; K274-E276 HydrophobicContact CD-CG 4.48Å; K274-E276 WeakPolarHBondContact CD-OE1 3.41Å; K274-E276 WeakPolarHBondContact CE-OE1 3.26Å; K274-E276 IonicContact NZ-OE1 2.79Å; K274-E276 PolarHBondContact NZ-OE1 3.38Å; K274-E276 PolarHBondContact O-N 3.03Å; K274-E276 VanDerWaalsContact O-N 3.12Å
277	D	67.5	Low	64.9	Low	90 Å²	90	88 Å²	88	48%	0.481	50%	0.499	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.7	-10.9	-171.4	-52.8	-54.4	0	0	0	112.8	R273 K274 S279	R273-D277 HydrophobicContact CB-CB 4.43Å; K274-D277 VanDerWaalsContact CB-OD2 3.25Å; K274-D277 WeakPolarHBondContact CB-OD2 3.42Å; K274-D277 VanDerWaalsContact CG-OD2 3.25Å; K274-D277 WeakPolarHBondContact CG-OD2 3.42Å; K274-D277 PolarHBondContact N-OD2 3.45Å; K274-D277 PolarHBondContact O-N 3.31Å; D277-S279 PolarHBondContact O-N 3.22Å
278	V	57	Low	63.8	Low	49 Å²	49	94.6 Å²	94.6	30%	0.297	52%	0.521	S	S	.	.			trans	-82.3	67.4	174.7	-176.7	0	0	0	0	109.5	F245 W252 R273 K274	F245-V278 HydrophobicContact CB-CG2 4.02Å; W252-V278 HydrophobicContact CH2-CB 4.25Å; W252-V278 HydrophobicContact CH2-CG1 4.04Å; W252-V278 HydrophobicContact CH2-CG2 4.46Å; W252-V278 HydrophobicContact CZ2-CG1 4.42Å; R273-V278 HydrophobicContact CB-CG2 3.77Å; K274-V278 WeakPolarHBondContact O-CG2 3.49Å; K274-V278 PolarHBondContact O-N 2.85Å; K274-V278 VanDerWaalsContact O-N 3.12Å
279	S	47.2	Very low	63.2	Low	79 Å²	79	92.5 Å²	92.5	55%	0.552	52%	0.518	S	S	*	.			trans	-72.1	151.8	156.2	-66.2	0	0	0	0	109.7	D277 S281	D277-S279 PolarHBondContact O-N 3.22Å; S279-S281 PolarHBondContact O-N 2.93Å
280	E	46.9	Very low	63	Low	187 Å²	187	89.1 Å²	89.1	87%	0.874	50%	0.502	S	S	*	.	G	3₁₀ helix	trans	-59.1	-14.3	-164	-62.9	172.7	107.1	0	0	115.8	V282	E280-V282 PolarHBondContact O-N 3.29Å
281	S	40.1	Very low	63	Low	110 Å²	110	91.3 Å²	91.3	77%	0.769	51%	0.511	S	S	*	.	G	3₁₀ helix	trans	-87.8	12.4	-169.5	65.7	0	0	0	0	116.3	S279	S279-S281 PolarHBondContact O-N 2.93Å
282	V	36.5	Very low	63.1	Low	70 Å²	70	87.2 Å²	87.2	42%	0.424	49%	0.491	S	S	.	.	G	3₁₀ helix	trans	-136.1	29.4	-175.2	-145.2	0	0	0	0	114.8	R273 E280	R273-V282 VanDerWaalsContact CZ-CG1 3.49Å; R273-V282 PolarHBondContact NH1-O 3.36Å; R273-V282 VanDerWaalsContact NH2-CG1 3.3Å; E280-V282 PolarHBondContact O-N 3.29Å
283	G	35.3	Very low	63	Low	60 Å²	60	90.1 Å²	90.1	62%	0.619	51%	0.512	S	S	*	.			trans	-72.3	122.5	162.5	0	0	0	0	0	111	S285	G283-S285 PolarHBondContact O-N 2.91Å
284	T	36	Very low	63.3	Low	97 Å²	97	92.1 Å²	92.1	60%	0.595	53%	0.529	S	S	*	.	S	Bend	trans	-65.1	100.9	166.5	41.2	0	0	0	0	108.8	V247	V247-T284 HydrophobicContact CG1-CG2 3.91Å
285	S	44.4	Very low	63.7	Low	87 Å²	87	88.8 Å²	88.8	61%	0.608	52%	0.515	S	S	*	.			trans	42.5	90.6	-175.8	-63.1	0	0	0	0	113.5	G283 Q287	G283-S285 PolarHBondContact O-N 2.91Å; S285-Q287 PolarHBondContact O-N 3Å
286	G	47.6	Very low	64.1	Low	79 Å²	79	93.3 Å²	93.3	81%	0.814	54%	0.535	S	S	*	.			trans	-64.5	24.2	178.8	0	0	0	0	0	116.3
287	Q	55.4	Low	64.9	Low	130 Å²	130	95.1 Å²	95.1	61%	0.607	54%	0.543	S	S	*	.	P	Polyproline II helix	trans	-74.6	133.6	173.6	-63	-174.2	-84	0	0	110.3	D217 S285	D217-Q287 PolarHBondContact OD2-NE2 3.33Å; S285-Q287 PolarHBondContact O-N 3Å
288	R	64.3	Low	66	Low	165 Å²	165	93.9 Å²	93.9	62%	0.623	53%	0.534	S	S	*	.	P	Polyproline II helix	trans	-65.1	130.2	174.5	-170.7	169.8	179.8	-83.2	0.2	109.4	V290	R288-V290 PolarHBondContact O-N 3.5Å; R288-V290 VanDerWaalsContact O-N 3.08Å
289	P	73.4	Confident	67.5	Low	67 Å²	67	94.4 Å²	94.4	44%	0.435	53%	0.533	S	S	.	.	P	Polyproline II helix	trans	-57.1	118.5	-178.8	-27.1	34.8	0	0	0	112	F291 Q299	P289-F291 HydrophobicContact CB-CE2 4.05Å; P289-F291 HydrophobicContact CB-CZ 4.34Å; P289-F291 WeakPolarHBondContact O-CD2 3.35Å; P289-F291 VanDerWaalsContact O-CE2 3.31Å; P289-F291 WeakPolarHBondContact O-CE2 3.31Å; P289-Q299 HydrophobicContact CB-CG 4.21Å
290	V	83.8	Confident	69.7	Low	54 Å²	54	92 Å²	92	33%	0.327	51%	0.514	S	S	.	.	P	Polyproline II helix	trans	-84.5	118.2	178.6	-172.1	0	0	0	0	108.9	R288 L300	R288-V290 PolarHBondContact O-N 3.5Å; R288-V290 VanDerWaalsContact O-N 3.08Å; V290-L300 HydrophobicContact CB-CD1 4.44Å; V290-L300 HydrophobicContact CG1-CD1 3.8Å; V290-L300 HydrophobicContact CG1-CG 4.49Å; V290-L300 PolarHBondContact O-N 3.38Å
291	F	88.6	Confident	71.8	Confident	93 Å²	93	88.8 Å²	88.8	41%	0.408	50%	0.497	S	S	.	.	B	Isolated β-bridge	trans	-90.8	152.7	-179.9	-67.2	-91.5	0	0	0	111.6	P289 K296 Q297 E298 Q299	P289-F291 HydrophobicContact CB-CE2 4.05Å; P289-F291 HydrophobicContact CB-CZ 4.34Å; P289-F291 WeakPolarHBondContact O-CD2 3.35Å; P289-F291 VanDerWaalsContact O-CE2 3.31Å; P289-F291 WeakPolarHBondContact O-CE2 3.31Å; F291-K296 WeakPolarHBondContact CD1-O 3.48Å; F291-Q297 WeakPolarHBondContact CE1-O 3.35Å; F291-E298 WeakPolarHBondContact CA-O 3.4Å; F291-Q299 HydrophobicContact CD1-CG 3.91Å; F291-Q299 HydrophobicContact CE1-CG 3.62Å; F291-Q299 HydrophobicContact CZ-CG 4.07Å
292	C	90.9	Very high	74.3	Confident	6 Å²	6	84.6 Å²	84.6	4%	0.041	47%	0.466	C	S	.	.	P	Polyproline II helix	trans	-67.2	134.1	177.6	-179.6	0	0	0	0	111.2	V294 H295 K296 E298 L300 C312	C292-V294 PolarHBondContact O-N 3.19Å; C292-V294 PolarHBondContact SG-N 3.21Å; C292-H295 HydrophobicContact CB-CB 4.02Å; C292-H295 WeakPolarHBondContact CB-O 3.49Å; C292-H295 CarbonylContact O-C 3.56Å; C292-H295 PolarHBondContact SG-N 3.04Å; C292-H295 VanDerWaalsContact SG-N 3.37Å; C292-K296 WeakPolarHBondContact O-CA 3.43Å; C292-K296 PolarHBondContact O-N 3.47Å; C292-E298 PolarHBondContact N-O 2.73Å; C292-L300 HydrophobicContact CB-CD2 3.92Å; C292-C312 HydrophobicContact CB-CB 3.89Å; C292-C312 VanDerWaalsContact CB-SG 3.58Å; C292-C312 VanDerWaalsContact SG-SG 3.6Å
293	P	88.1	Confident	77.1	Confident	96 Å²	96	82.1 Å²	82.1	62%	0.623	45%	0.45	S	S	*	.	S	Bend	trans	-65.1	-24.8	177.8	25.7	-34.7	0	0	0	113.4
294	V	91.4	Very high	80	Confident	89 Å²	89	79.3 Å²	79.3	54%	0.539	42%	0.42	S	S	.	.	S	Bend	trans	-86.5	-61.1	173.8	-176.8	0	0	0	0	109.8	C292 K296	C292-V294 PolarHBondContact O-N 3.19Å; C292-V294 PolarHBondContact SG-N 3.21Å; V294-K296 PolarHBondContact O-N 3.11Å
295	H	91	Very high	82.7	Confident	39 Å²	39	77.2 Å²	77.2	18%	0.181	40%	0.404	C	S	.	.	S	Bend	trans	-92.3	74.6	-176.4	-55	99.6	0	0	0	110.6	C292 Q297 E298 D314 C315	C292-H295 HydrophobicContact CB-CB 4.02Å; C292-H295 WeakPolarHBondContact CB-O 3.49Å; C292-H295 CarbonylContact O-C 3.56Å; C292-H295 PolarHBondContact SG-N 3.04Å; C292-H295 VanDerWaalsContact SG-N 3.37Å; H295-Q297 PolarHBondContact O-N 2.98Å; H295-E298 HydrophobicContact CB-CB 3.97Å; H295-E298 HydrophobicContact CB-CG 4.39Å; H295-E298 PolarHBondContact O-N 3.43Å; H295-D314 HydrophobicContact CB-CB 4.37Å; H295-D314 IonicContact CD2-OD2 3.79Å; H295-C315 PolarHBondContact ND1-SG 3.26Å
296	K	88.8	Confident	85	Confident	168 Å²	168	75.3 Å²	75.3	73%	0.73	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-16.6	-166.1	-61.6	-174.2	-179	-177.3	0	117.3	F291 C292 V294	F291-K296 WeakPolarHBondContact CD1-O 3.48Å; C292-K296 WeakPolarHBondContact O-CA 3.43Å; C292-K296 PolarHBondContact O-N 3.47Å; V294-K296 PolarHBondContact O-N 3.11Å
297	Q	88.1	Confident	87.1	Confident	182 Å²	182	74 Å²	74	85%	0.85	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.9	-18.1	176.4	-68	177.9	-15.2	0	0	113	F291 H295	F291-Q297 WeakPolarHBondContact CE1-O 3.35Å; H295-Q297 PolarHBondContact O-N 2.98Å
298	E	90.3	Very high	88.8	Confident	64 Å²	64	73 Å²	73	30%	0.299	37%	0.365	S	S	.	.	S	Bend	trans	-89.6	135.2	-178.5	-84.9	-69.7	116.6	0	0	111.6	F291 C292 H295 C312 R313	F291-E298 WeakPolarHBondContact CA-O 3.4Å; C292-E298 PolarHBondContact N-O 2.73Å; H295-E298 HydrophobicContact CB-CB 3.97Å; H295-E298 HydrophobicContact CB-CG 4.39Å; H295-E298 PolarHBondContact O-N 3.43Å; E298-C312 HydrophobicContact CB-CB 3.78Å; E298-R313 WeakPolarHBondContact OE2-CB 3.44Å
299	Q	90.4	Very high	90.1	Very high	60 Å²	60	71.4 Å²	71.4	28%	0.28	36%	0.359	S	S	.	.	B	Isolated β-bridge	trans	-85	144.3	179.1	-66.4	171.6	-2.6	0	0	110.9	P289 F291 K301 C312	P289-Q299 HydrophobicContact CB-CG 4.21Å; F291-Q299 HydrophobicContact CD1-CG 3.91Å; F291-Q299 HydrophobicContact CE1-CG 3.62Å; F291-Q299 HydrophobicContact CZ-CG 4.07Å; Q299-K301 HydrophobicContact CB-CD 4.35Å; Q299-K301 HydrophobicContact CB-CG 4.17Å; Q299-K301 PolarHBondContact O-N 3.01Å; Q299-K301 VanDerWaalsContact O-N 3.16Å; Q299-C312 WeakPolarHBondContact O-CB 3.44Å
300	L	91.4	Very high	91.1	Very high	28 Å²	28	72 Å²	72	15%	0.147	36%	0.359	C	S	.	.			trans	-73.1	103.3	171.9	-61	-178.4	0	0	0	109.1	V290 C292 L310 C312	V290-L300 HydrophobicContact CB-CD1 4.44Å; V290-L300 HydrophobicContact CG1-CD1 3.8Å; V290-L300 HydrophobicContact CG1-CG 4.49Å; V290-L300 PolarHBondContact O-N 3.38Å; C292-L300 HydrophobicContact CB-CD2 3.92Å; L300-L310 HydrophobicContact CB-CB 4.34Å; L300-L310 HydrophobicContact CD1-CB 4.11Å; L300-C312 HydrophobicContact CD2-CB 4.18Å
301	K	91.1	Very high	91.6	Very high	121 Å²	121	69.6 Å²	69.6	53%	0.526	34%	0.344	S	S	.	.			trans	-127.3	-2.7	-175.1	-73.7	-173.8	174.5	169.6	0	114.3	Q299 T311 L328	Q299-K301 HydrophobicContact CB-CD 4.35Å; Q299-K301 HydrophobicContact CB-CG 4.17Å; Q299-K301 PolarHBondContact O-N 3.01Å; Q299-K301 VanDerWaalsContact O-N 3.16Å; K301-T311 PolarHBondContact N-O 3.3Å; K301-L328 WeakPolarHBondContact O-CB 3.33Å; K301-L328 PolarHBondContact O-N 2.79Å; K301-L328 VanDerWaalsContact O-N 3.11Å
302	L	94.1	Very high	91.9	Very high	21 Å²	21	65.1 Å²	65.1	11%	0.11	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	154.3	178.7	-58	176.5	0	0	0	109.1	L310 T311 Q316 Y325 Q326 F327	L302-L310 WeakPolarHBondContact O-CA 3.41Å; L302-T311 WeakPolarHBondContact CB-OG1 3.39Å; L302-T311 PolarHBondContact N-O 3.26Å; L302-T311 VanDerWaalsContact N-O 3.07Å; L302-T311 PolarHBondContact O-N 3.48Å; L302-Q316 HydrophobicContact CD1-CB 3.78Å; L302-Q316 HydrophobicContact CD1-CG 4.02Å; L302-Y325 HydrophobicContact CD1-CD2 4.5Å; L302-Y325 HydrophobicContact CD2-CD2 4.04Å; L302-Y325 HydrophobicContact CD2-CE2 4.17Å; L302-Q326 WeakPolarHBondContact CA-O 3.35Å; L302-F327 HydrophobicContact CD2-CD1 3.68Å; L302-F327 HydrophobicContact CD2-CE1 3.85Å; L302-F327 HydrophobicContact CD2-CG 4.43Å
303	F	94.7	Very high	92.1	Very high	19 Å²	19	72.6 Å²	72.6	8%	0.083	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	116.9	172.6	173.4	-98.7	0	0	0	108.6	E305 D308 L310 Y325 Q326 A331 Q335	F303-E305 HydrophobicContact CD1-CG 4.23Å; F303-E305 HydrophobicContact CE1-CB 4.48Å; F303-E305 HydrophobicContact CE1-CG 4.14Å; F303-E305 PolarHBondContact O-N 2.95Å; F303-D308 VanDerWaalsContact CZ-OD1 3.31Å; F303-D308 WeakPolarHBondContact CZ-OD1 3.47Å; F303-L310 HydrophobicContact CB-CD2 4.33Å; F303-L310 HydrophobicContact CD2-CD2 4.28Å; F303-Y325 CarbonylContact O-C 3.27Å; F303-Y325 WeakPolarHBondContact O-CA 3.17Å; F303-Y325 WeakPolarHBondContact O-CB 3.33Å; F303-Q326 PolarHBondContact N-O 3.4Å; F303-Q326 PolarHBondContact O-N 3.2Å; F303-A331 HydrophobicContact CB-CB 3.53Å; F303-A331 HydrophobicContact CD1-CB 3.9Å; F303-A331 HydrophobicContact CG-CB 3.83Å; F303-Q335 HydrophobicContact CZ-CG 4.49Å; F303-Q335 VanDerWaalsContact CZ-NE2 3.32Å
304	C	95.2	Very high	92.4	Very high	0 Å²	0	70.9 Å²	70.9	0%	0	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	96.2	179.3	176.1	0	0	0	0	109.6	T306 C307 D308 R309 T311 H323 R324	C304-T306 VanDerWaalsContact C-N 3.25Å; C304-T306 PolarHBondContact O-N 3.37Å; C304-C307 HydrophobicContact CB-CB 4.45Å; C304-C307 CarbonylContact O-C 3.49Å; C304-C307 PolarHBondContact O-N 3.46Å; C304-D308 PolarHBondContact O-N 3.01Å; C304-R309 PolarHBondContact N-O 3.35Å; C304-T311 HydrophobicContact CB-CG2 3.76Å; C304-H323 VanDerWaalsContact SG-CB 3.55Å; C304-R324 CarbonylContact C-O 3.41Å
305	E	92.7	Very high	92.6	Very high	54 Å²	54	66.9 Å²	66.9	25%	0.252	31%	0.313	S	S	.	.	G	3₁₀ helix	trans	-50.5	-44.3	179.1	-66.3	-174.9	-153.8	0	0	112.2	F303 C307 D308 R324 Q326	F303-E305 HydrophobicContact CD1-CG 4.23Å; F303-E305 HydrophobicContact CE1-CB 4.48Å; F303-E305 HydrophobicContact CE1-CG 4.14Å; F303-E305 PolarHBondContact O-N 2.95Å; E305-C307 PolarHBondContact O-N 3.25Å; E305-D308 PolarHBondContact O-N 3.19Å; E305-R324 HydrophobicContact CB-CB 4.46Å; E305-R324 HydrophobicContact CB-CG 4.47Å; E305-R324 HydrophobicContact CG-CG 4.38Å; E305-R324 PolarHBondContact N-O 2.98Å; E305-R324 IonicContact OE1-CZ 3.58Å; E305-R324 IonicContact OE1-NE 2.72Å; E305-R324 PolarHBondContact OE1-NE 2.93Å; E305-R324 IonicContact OE1-NH2 2.69Å; E305-R324 PolarHBondContact OE1-NH2 3.07Å; E305-R324 VanDerWaalsContact OE2-CD 3.28Å; E305-R324 WeakPolarHBondContact OE2-CD 3.25Å; E305-R324 IonicContact OE2-CZ 2.67Å; E305-R324 IonicContact OE2-NE 3.68Å; E305-R324 PolarHBondContact OE2-NE 3.17Å; E305-R324 IonicContact OE2-NH1 2.72Å; E305-R324 IonicContact OE2-NH2 2.7Å; E305-R324 PolarHBondContact OE2-NH2 3.29Å; E305-R324 VanDerWaalsContact OE2-NH2 3.15Å; E305-Q326 HydrophobicContact CG-CG 4.48Å; E305-Q326 WeakPolarHBondContact OE1-CG 3.12Å; E305-Q326 PolarHBondContact OE1-NE2 3.39Å
306	T	92.9	Very high	92.6	Very high	46 Å²	46	65.6 Å²	65.6	28%	0.282	31%	0.307	S	S	.	.	G	3₁₀ helix	trans	-67.1	-5.1	-178	-41.9	0	0	0	0	113.8	C304 H323 R324 A819	C304-T306 VanDerWaalsContact C-N 3.25Å; C304-T306 PolarHBondContact O-N 3.37Å; T306-H323 HydrophobicContact CG2-CB 4.38Å; T306-R324 PolarHBondContact OG1-N 3.33Å; T306-A819 HydrophobicContact CG2-CB 4.32Å
307	C	91.9	Very high	92.9	Very high	52 Å²	52	62.4 Å²	62.4	35%	0.351	30%	0.298	S	S	.	.	G	3₁₀ helix	trans	-132.6	3.4	177.7	-69.1	0	0	0	0	114.1	C304 E305 R309 H323	C304-C307 HydrophobicContact CB-CB 4.45Å; C304-C307 CarbonylContact O-C 3.49Å; C304-C307 PolarHBondContact O-N 3.46Å; E305-C307 PolarHBondContact O-N 3.25Å; C307-R309 HydrophobicContact CB-CB 4.37Å; C307-R309 PolarHBondContact O-N 3.37Å; C307-H323 PolarHBondContact SG-CE1 3.5Å; C307-H323 PolarHBondContact SG-ND1 2.98Å
308	D	92.1	Very high	93.1	Very high	108 Å²	108	58.4 Å²	58.4	58%	0.578	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.6	45.9	-175.4	-161.8	24.2	0	0	0	113.3	F303 C304 E305	F303-D308 VanDerWaalsContact CZ-OD1 3.31Å; F303-D308 WeakPolarHBondContact CZ-OD1 3.47Å; C304-D308 PolarHBondContact O-N 3.01Å; E305-D308 PolarHBondContact O-N 3.19Å
309	R	91.9	Very high	93.2	Very high	133 Å²	133	60.5 Å²	60.5	50%	0.502	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	139.9	-169.5	-161.1	-174.4	-174.4	-152.9	4.4	113	C304 C307	C304-R309 PolarHBondContact N-O 3.35Å; C307-R309 HydrophobicContact CB-CB 4.37Å; C307-R309 PolarHBondContact O-N 3.37Å
310	L	93.1	Very high	93.2	Very high	80 Å²	80	58.5 Å²	58.5	42%	0.419	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	133.1	166.9	-68.4	176.1	0	0	0	111.4	L300 L302 F303 L328	L300-L310 HydrophobicContact CB-CB 4.34Å; L300-L310 HydrophobicContact CD1-CB 4.11Å; L302-L310 WeakPolarHBondContact O-CA 3.41Å; F303-L310 HydrophobicContact CB-CD2 4.33Å; F303-L310 HydrophobicContact CD2-CD2 4.28Å; L310-L328 HydrophobicContact CD2-CD1 3.57Å
311	T	94.6	Very high	93.2	Very high	2 Å²	2	64.1 Å²	64.1	1%	0.012	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	149.3	179	53.3	0	0	0	0	110.5	K301 L302 C304 C315 Q316 H320	K301-T311 PolarHBondContact N-O 3.3Å; L302-T311 WeakPolarHBondContact CB-OG1 3.39Å; L302-T311 PolarHBondContact N-O 3.26Å; L302-T311 VanDerWaalsContact N-O 3.07Å; L302-T311 PolarHBondContact O-N 3.48Å; C304-T311 HydrophobicContact CB-CG2 3.76Å; T311-C315 HydrophobicContact CG2-CB 4.4Å; T311-Q316 PolarHBondContact OG1-OE1 3.5Å; T311-H320 VanDerWaalsContact CG2-CD2 3.48Å; T311-H320 WeakPolarHBondContact CG2-CD2 3.49Å
312	C	95.2	Very high	93.2	Very high	0 Å²	0	66.3 Å²	66.3	0%	0	32%	0.317	C	S	.	.			trans	-85.2	171.7	159.7	65.6	0	0	0	0	110	C292 E298 Q299 L300 D314 C315 Q316	C292-C312 HydrophobicContact CB-CB 3.89Å; C292-C312 VanDerWaalsContact CB-SG 3.58Å; C292-C312 VanDerWaalsContact SG-SG 3.6Å; E298-C312 HydrophobicContact CB-CB 3.78Å; Q299-C312 WeakPolarHBondContact O-CB 3.44Å; L300-C312 HydrophobicContact CD2-CB 4.18Å; C312-D314 VanDerWaalsContact C-N 3.29Å; C312-D314 PolarHBondContact O-N 2.85Å; C312-C315 PolarHBondContact O-N 3.36Å; C312-C315 PolarHBondContact SG-N 3.05Å; C312-C315 VanDerWaalsContact SG-N 3.4Å; C312-Q316 PolarHBondContact O-N 3Å
313	R	94.2	Very high	93.3	Very high	162 Å²	162	68 Å²	68	61%	0.611	32%	0.324	S	S	*	.	H	α-helix	trans	-52.5	-47.8	176.6	-172.7	-175.4	-178.4	-172	-0.1	111.9	E298 Q316 L317	E298-R313 WeakPolarHBondContact OE2-CB 3.44Å; R313-Q316 PolarHBondContact O-N 2.96Å; R313-L317 HydrophobicContact CG-CD1 3.86Å; R313-L317 HydrophobicContact CG-CG 4.49Å; R313-L317 WeakPolarHBondContact O-CB 3.44Å; R313-L317 VanDerWaalsContact O-CG 3.32Å; R313-L317 WeakPolarHBondContact O-CG 3.45Å; R313-L317 PolarHBondContact O-N 3.46Å
314	D	95.3	Very high	93.2	Very high	60 Å²	60	74.8 Å²	74.8	32%	0.321	35%	0.35	S	S	.	.	H	α-helix	trans	-68.1	-43.1	-176.3	-69.3	-6.4	0	0	0	112.4	H295 C312 Q316 L317 L318	H295-D314 HydrophobicContact CB-CB 4.37Å; H295-D314 IonicContact CD2-OD2 3.79Å; C312-D314 VanDerWaalsContact C-N 3.29Å; C312-D314 PolarHBondContact O-N 2.85Å; D314-Q316 VanDerWaalsContact C-N 3.28Å; D314-Q316 PolarHBondContact O-N 2.89Å; D314-L317 CarbonylContact O-C 3.45Å; D314-L317 PolarHBondContact O-N 2.93Å; D314-L318 HydrophobicContact CB-CD1 4.44Å; D314-L318 WeakPolarHBondContact O-CB 3.36Å; D314-L318 VanDerWaalsContact O-CG 3.22Å; D314-L318 WeakPolarHBondContact O-CG 3.4Å; D314-L318 PolarHBondContact O-N 2.93Å
315	C	95.3	Very high	93.2	Very high	6 Å²	6	80.2 Å²	80.2	4%	0.041	37%	0.371	C	S	.	.	H	α-helix	trans	-58.8	-40.1	171.8	-77.9	0	0	0	0	111.8	H295 T311 C312 E319 H320	H295-C315 PolarHBondContact ND1-SG 3.26Å; T311-C315 HydrophobicContact CG2-CB 4.4Å; C312-C315 PolarHBondContact O-N 3.36Å; C312-C315 PolarHBondContact SG-N 3.05Å; C312-C315 VanDerWaalsContact SG-N 3.4Å; C315-E319 PolarHBondContact O-N 3.36Å; C315-H320 PolarHBondContact O-N 3.04Å; C315-H320 VanDerWaalsContact O-N 3.09Å
316	Q	92.3	Very high	93.2	Very high	11 Å²	11	78.7 Å²	78.7	5%	0.051	36%	0.364	C	S	.	.	H	α-helix	trans	-66.5	-39.5	177.3	-159.7	67.4	38.7	0	0	112.2	L302 T311 C312 R313 D314 H320 K321 Y325	L302-Q316 HydrophobicContact CD1-CB 3.78Å; L302-Q316 HydrophobicContact CD1-CG 4.02Å; T311-Q316 PolarHBondContact OG1-OE1 3.5Å; C312-Q316 PolarHBondContact O-N 3Å; R313-Q316 PolarHBondContact O-N 2.96Å; D314-Q316 VanDerWaalsContact C-N 3.28Å; D314-Q316 PolarHBondContact O-N 2.89Å; Q316-H320 PolarHBondContact NE2-O 3.23Å; Q316-H320 VanDerWaalsContact NE2-O 3.1Å; Q316-H320 CarbonylContact O-C 3.59Å; Q316-H320 VanDerWaalsContact O-C 3.27Å; Q316-K321 PolarHBondContact O-N 3.22Å; Q316-Y325 HydrophobicContact CG-CD1 4.12Å; Q316-Y325 HydrophobicContact CG-CG 4.27Å
317	L	93.4	Very high	93.3	Very high	102 Å²	102	82.8 Å²	82.8	53%	0.534	38%	0.378	S	S	.	.	H	α-helix	trans	-82.1	-14.5	-179.3	-67.4	176.9	0	0	0	114.5	R313 D314 K321	R313-L317 HydrophobicContact CG-CD1 3.86Å; R313-L317 HydrophobicContact CG-CG 4.49Å; R313-L317 WeakPolarHBondContact O-CB 3.44Å; R313-L317 VanDerWaalsContact O-CG 3.32Å; R313-L317 WeakPolarHBondContact O-CG 3.45Å; R313-L317 PolarHBondContact O-N 3.46Å; D314-L317 CarbonylContact O-C 3.45Å; D314-L317 PolarHBondContact O-N 2.93Å; L317-K321 WeakPolarHBondContact O-CE 3.23Å; L317-K321 VanDerWaalsContact O-CG 3.26Å; L317-K321 WeakPolarHBondContact O-CG 3.32Å
318	L	92.8	Very high	93.2	Very high	98 Å²	98	83.8 Å²	83.8	51%	0.513	38%	0.379	S	S	.	.	H	α-helix	trans	-108.6	-55	-178.1	-65.4	175.8	0	0	0	112.8	D314 K321	D314-L318 HydrophobicContact CB-CD1 4.44Å; D314-L318 WeakPolarHBondContact O-CB 3.36Å; D314-L318 VanDerWaalsContact O-CG 3.22Å; D314-L318 WeakPolarHBondContact O-CG 3.4Å; D314-L318 PolarHBondContact O-N 2.93Å; L318-K321 VanDerWaalsContact O-CE 3.25Å; L318-K321 WeakPolarHBondContact O-CE 3.3Å; L318-K321 PolarHBondContact O-NZ 3.3Å
319	E	91.7	Very high	93	Very high	108 Å²	108	83.9 Å²	83.9	51%	0.505	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96	-42.8	-171.3	-64	173	177.8	0	0	111.9	C315	C315-E319 PolarHBondContact O-N 3.36Å
320	H	92.3	Very high	92.9	Very high	18 Å²	18	82.9 Å²	82.9	8%	0.083	38%	0.377	C	S	.	.	S	Bend	trans	-104.2	31.8	-172.5	-55.7	-76.7	0	0	0	113.7	T311 C315 Q316 E322 H323	T311-H320 VanDerWaalsContact CG2-CD2 3.48Å; T311-H320 WeakPolarHBondContact CG2-CD2 3.49Å; C315-H320 PolarHBondContact O-N 3.04Å; C315-H320 VanDerWaalsContact O-N 3.09Å; Q316-H320 PolarHBondContact NE2-O 3.23Å; Q316-H320 VanDerWaalsContact NE2-O 3.1Å; Q316-H320 CarbonylContact O-C 3.59Å; Q316-H320 VanDerWaalsContact O-C 3.27Å; H320-E322 VanDerWaalsContact C-N 3.31Å; H320-E322 PolarHBondContact O-N 2.98Å; H320-H323 HydrophobicContact CB-CB 4.08Å; H320-H323 AromaticContact CG-ND1 3.99Å; H320-H323 AromaticContact ND1-CE1 3.68Å; H320-H323 AromaticContact ND1-ND1 3.32Å; H320-H323 PolarHBondContact ND1-ND1 3.45Å; H320-H323 WeakPolarHBondContact O-CB 3.39Å; H320-H323 PolarHBondContact O-N 3.4Å
321	K	90.6	Very high	92.9	Very high	145 Å²	145	79.3 Å²	79.3	63%	0.63	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.2	-40.2	-171.4	-73.3	170.6	176.8	159.9	0	115.6	Q316 L317 L318	Q316-K321 PolarHBondContact O-N 3.22Å; L317-K321 WeakPolarHBondContact O-CE 3.23Å; L317-K321 VanDerWaalsContact O-CG 3.26Å; L317-K321 WeakPolarHBondContact O-CG 3.32Å; L318-K321 VanDerWaalsContact O-CE 3.25Å; L318-K321 WeakPolarHBondContact O-CE 3.3Å; L318-K321 PolarHBondContact O-NZ 3.3Å
322	E	91.6	Very high	92.7	Very high	168 Å²	168	84.6 Å²	84.6	79%	0.785	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.1	5.3	-175	-64.9	171.5	170.3	0	0	112	H320	H320-E322 VanDerWaalsContact C-N 3.31Å; H320-E322 PolarHBondContact O-N 2.98Å
323	H	95.4	Very high	92.6	Very high	56 Å²	56	89 Å²	89	26%	0.259	40%	0.403	S	S	.	.	S	Bend	trans	-93.5	146.4	-174.5	-65.3	-165.3	0	0	0	111.4	C304 T306 C307 H320	C304-H323 VanDerWaalsContact SG-CB 3.55Å; T306-H323 HydrophobicContact CG2-CB 4.38Å; C307-H323 PolarHBondContact SG-CE1 3.5Å; C307-H323 PolarHBondContact SG-ND1 2.98Å; H320-H323 HydrophobicContact CB-CB 4.08Å; H320-H323 AromaticContact CG-ND1 3.99Å; H320-H323 AromaticContact ND1-CE1 3.68Å; H320-H323 AromaticContact ND1-ND1 3.32Å; H320-H323 PolarHBondContact ND1-ND1 3.45Å; H320-H323 WeakPolarHBondContact O-CB 3.39Å; H320-H323 PolarHBondContact O-N 3.4Å
324	R	93.6	Very high	92.4	Very high	162 Å²	162	85.5 Å²	85.5	61%	0.611	40%	0.396	S	S	*	.			trans	-72.1	139.6	173.2	-177.9	172	160.2	-168	-24.5	109.7	C304 E305 T306	C304-R324 CarbonylContact C-O 3.41Å; E305-R324 HydrophobicContact CB-CB 4.46Å; E305-R324 HydrophobicContact CB-CG 4.47Å; E305-R324 HydrophobicContact CG-CG 4.38Å; E305-R324 PolarHBondContact N-O 2.98Å; E305-R324 IonicContact OE1-CZ 3.58Å; E305-R324 IonicContact OE1-NE 2.72Å; E305-R324 PolarHBondContact OE1-NE 2.93Å; E305-R324 IonicContact OE1-NH2 2.69Å; E305-R324 PolarHBondContact OE1-NH2 3.07Å; E305-R324 VanDerWaalsContact OE2-CD 3.28Å; E305-R324 WeakPolarHBondContact OE2-CD 3.25Å; E305-R324 IonicContact OE2-CZ 2.67Å; E305-R324 IonicContact OE2-NE 3.68Å; E305-R324 PolarHBondContact OE2-NE 3.17Å; E305-R324 IonicContact OE2-NH1 2.72Å; E305-R324 IonicContact OE2-NH2 2.7Å; E305-R324 PolarHBondContact OE2-NH2 3.29Å; E305-R324 VanDerWaalsContact OE2-NH2 3.15Å; T306-R324 PolarHBondContact OG1-N 3.33Å
325	Y	94.5	Very high	92.2	Very high	113 Å²	113	86.2 Å²	86.2	44%	0.443	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	160.3	179.1	70.3	-87.5	0	0	0	112	L302 F303 Q316	L302-Y325 HydrophobicContact CD1-CD2 4.5Å; L302-Y325 HydrophobicContact CD2-CD2 4.04Å; L302-Y325 HydrophobicContact CD2-CE2 4.17Å; F303-Y325 CarbonylContact O-C 3.27Å; F303-Y325 WeakPolarHBondContact O-CA 3.17Å; F303-Y325 WeakPolarHBondContact O-CB 3.33Å; Q316-Y325 HydrophobicContact CG-CD1 4.12Å; Q316-Y325 HydrophobicContact CG-CG 4.27Å
326	Q	92.9	Very high	92	Very high	23 Å²	23	89.9 Å²	89.9	11%	0.107	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	162.2	168.9	-74.7	176.5	40	0	0	110.1	L302 F303 E305 E330 A331 N334	L302-Q326 WeakPolarHBondContact CA-O 3.35Å; F303-Q326 PolarHBondContact N-O 3.4Å; F303-Q326 PolarHBondContact O-N 3.2Å; E305-Q326 HydrophobicContact CG-CG 4.48Å; E305-Q326 WeakPolarHBondContact OE1-CG 3.12Å; E305-Q326 PolarHBondContact OE1-NE2 3.39Å; Q326-E330 PolarHBondContact OE1-O 3.29Å; Q326-A331 HydrophobicContact CB-CB 3.95Å; Q326-A331 VanDerWaalsContact OE1-CA 3.24Å; Q326-N334 PolarHBondContact OE1-ND2 3.3Å
327	F	94.1	Very high	91.9	Very high	131 Å²	131	90.4 Å²	90.4	58%	0.575	42%	0.421	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.2	150.7	165.4	-68.6	-81	0	0	0	110.4	L302 E329 E330 A331	L302-F327 HydrophobicContact CD2-CD1 3.68Å; L302-F327 HydrophobicContact CD2-CE1 3.85Å; L302-F327 HydrophobicContact CD2-CG 4.43Å; F327-E329 VanDerWaalsContact C-N 3.34Å; F327-E329 PolarHBondContact O-N 3.39Å; F327-E330 PolarHBondContact O-N 2.85Å; F327-E330 VanDerWaalsContact O-N 3.16Å; F327-A331 WeakPolarHBondContact O-CB 3.49Å; F327-A331 PolarHBondContact O-N 2.87Å
328	L	89.5	Confident	91.8	Very high	73 Å²	73	87.6 Å²	87.6	38%	0.382	41%	0.413	S	S	.	.	H	α-helix	trans	-51.5	-44.1	-170.5	-177.5	60.7	0	0	0	114.8	K301 L310 F332	K301-L328 WeakPolarHBondContact O-CB 3.33Å; K301-L328 PolarHBondContact O-N 2.79Å; K301-L328 VanDerWaalsContact O-N 3.11Å; L310-L328 HydrophobicContact CD2-CD1 3.57Å; L328-F332 VanDerWaalsContact O-CB 3.25Å; L328-F332 WeakPolarHBondContact O-CB 3.35Å; L328-F332 PolarHBondContact O-N 2.6Å
329	E	88.7	Confident	91.6	Very high	110 Å²	110	88.1 Å²	88.1	51%	0.514	42%	0.415	S	S	.	.	H	α-helix	trans	-70.5	-40.6	-178.1	-174.9	58.5	-142.7	0	0	112.5	F327 F332 Q333	F327-E329 VanDerWaalsContact C-N 3.34Å; F327-E329 PolarHBondContact O-N 3.39Å; E329-F332 PolarHBondContact O-N 3.38Å; E329-Q333 WeakPolarHBondContact O-CG 3.4Å; E329-Q333 PolarHBondContact O-N 2.88Å; E329-Q333 PolarHBondContact OE1-NE2 2.87Å
330	E	90.2	Very high	91.8	Very high	113 Å²	113	88 Å²	88	53%	0.528	41%	0.414	S	S	.	.	H	α-helix	trans	-65.3	-44.3	176.2	-172.1	-178.7	-172	0	0	110.6	Q326 F327 F332 Q333 N334	Q326-E330 PolarHBondContact OE1-O 3.29Å; F327-E330 PolarHBondContact O-N 2.85Å; F327-E330 VanDerWaalsContact O-N 3.16Å; E330-F332 VanDerWaalsContact C-N 3.33Å; E330-F332 PolarHBondContact O-N 3.09Å; E330-Q333 PolarHBondContact O-N 2.92Å; E330-N334 WeakPolarHBondContact O-CB 3.5Å; E330-N334 PolarHBondContact O-N 2.75Å; E330-N334 PolarHBondContact O-ND2 3.19Å; E330-N334 VanDerWaalsContact O-ND2 3.13Å
331	A	93	Very high	91.7	Very high	4 Å²	4	92.3 Å²	92.3	3%	0.033	44%	0.438	C	S	.	.	H	α-helix	trans	-59.4	-43.6	173.2	0	0	0	0	0	111.7	F303 Q326 F327 N334 Q335	F303-A331 HydrophobicContact CB-CB 3.53Å; F303-A331 HydrophobicContact CD1-CB 3.9Å; F303-A331 HydrophobicContact CG-CB 3.83Å; Q326-A331 HydrophobicContact CB-CB 3.95Å; Q326-A331 VanDerWaalsContact OE1-CA 3.24Å; F327-A331 WeakPolarHBondContact O-CB 3.49Å; F327-A331 PolarHBondContact O-N 2.87Å; A331-N334 PolarHBondContact O-N 3.17Å; A331-Q335 WeakPolarHBondContact O-CB 3.47Å; A331-Q335 VanDerWaalsContact O-CG 3.24Å; A331-Q335 WeakPolarHBondContact O-CG 3.38Å; A331-Q335 PolarHBondContact O-N 3.18Å
332	F	90.5	Very high	91.8	Very high	113 Å²	113	90.9 Å²	90.9	50%	0.496	44%	0.437	S	S	.	.	H	α-helix	trans	-60.2	-50.8	178.6	172.6	-106.6	0	0	0	111.7	L328 E329 E330 N334 K336	L328-F332 VanDerWaalsContact O-CB 3.25Å; L328-F332 WeakPolarHBondContact O-CB 3.35Å; L328-F332 PolarHBondContact O-N 2.6Å; E329-F332 PolarHBondContact O-N 3.38Å; E330-F332 VanDerWaalsContact C-N 3.33Å; E330-F332 PolarHBondContact O-N 3.09Å; F332-N334 PolarHBondContact O-N 2.67Å; F332-K336 HydrophobicContact CE1-CD 4.36Å; F332-K336 HydrophobicContact CZ-CD 4.24Å; F332-K336 WeakPolarHBondContact O-CB 3.38Å; F332-K336 PolarHBondContact O-N 3.07Å
333	Q	92	Very high	91.8	Very high	93 Å²	93	87.4 Å²	87.4	44%	0.435	42%	0.423	S	S	.	.	H	α-helix	trans	-65	-40.5	179.8	-60	-62.1	-18.2	0	0	111.9	E329 E330 G337	E329-Q333 WeakPolarHBondContact O-CG 3.4Å; E329-Q333 PolarHBondContact O-N 2.88Å; E329-Q333 PolarHBondContact OE1-NE2 2.87Å; E330-Q333 PolarHBondContact O-N 2.92Å; Q333-G337 PolarHBondContact O-N 2.82Å
334	N	91.1	Very high	91.6	Very high	88 Å²	88	87.4 Å²	87.4	47%	0.471	43%	0.433	S	S	.	.	H	α-helix	trans	-64	-48.8	177.5	-77.3	-36.3	0	0	0	112.3	Q326 E330 A331 F332 G337 A338	Q326-N334 PolarHBondContact OE1-ND2 3.3Å; E330-N334 WeakPolarHBondContact O-CB 3.5Å; E330-N334 PolarHBondContact O-N 2.75Å; E330-N334 PolarHBondContact O-ND2 3.19Å; E330-N334 VanDerWaalsContact O-ND2 3.13Å; A331-N334 PolarHBondContact O-N 3.17Å; F332-N334 PolarHBondContact O-N 2.67Å; N334-G337 PolarHBondContact O-N 2.96Å; N334-A338 PolarHBondContact O-N 2.86Å; N334-A338 VanDerWaalsContact O-N 3.09Å
335	Q	91.6	Very high	91.6	Very high	75 Å²	75	86.5 Å²	86.5	35%	0.35	43%	0.433	S	S	.	.	H	α-helix	trans	-70.1	-37.6	179.7	-64.9	-65.3	6.5	0	0	112	F303 A331 G337 A338 I339	F303-Q335 HydrophobicContact CZ-CG 4.49Å; F303-Q335 VanDerWaalsContact CZ-NE2 3.32Å; A331-Q335 WeakPolarHBondContact O-CB 3.47Å; A331-Q335 VanDerWaalsContact O-CG 3.24Å; A331-Q335 WeakPolarHBondContact O-CG 3.38Å; A331-Q335 PolarHBondContact O-N 3.18Å; Q335-G337 PolarHBondContact O-N 3.44Å; Q335-A338 WeakPolarHBondContact O-CB 3.42Å; Q335-A338 PolarHBondContact O-N 3.31Å; Q335-I339 VanDerWaalsContact O-CG1 3.29Å; Q335-I339 WeakPolarHBondContact O-CG1 3.38Å; Q335-I339 PolarHBondContact O-N 2.93Å
336	K	89.7	Confident	91.4	Very high	83 Å²	83	86.3 Å²	86.3	36%	0.361	44%	0.439	S	S	.	.	H	α-helix	trans	-56.6	-50	171.9	177.4	-174.7	166	-170.3	0	111	F332 A338 I339 E340	F332-K336 HydrophobicContact CE1-CD 4.36Å; F332-K336 HydrophobicContact CZ-CD 4.24Å; F332-K336 WeakPolarHBondContact O-CB 3.38Å; F332-K336 PolarHBondContact O-N 3.07Å; K336-A338 VanDerWaalsContact C-N 3.3Å; K336-A338 PolarHBondContact O-N 3.03Å; K336-I339 PolarHBondContact O-N 3.33Å; K336-E340 WeakPolarHBondContact CE-OE1 3.21Å; K336-E340 HydrophobicContact CG-CG 4.38Å; K336-E340 IonicContact NZ-OE1 3.1Å; K336-E340 WeakPolarHBondContact O-CG 3.3Å; K336-E340 PolarHBondContact O-N 2.86Å
337	G	90.1	Very high	91.2	Very high	22 Å²	22	89.6 Å²	89.6	23%	0.227	46%	0.457	C	S	.	.	H	α-helix	trans	-60.8	-36.6	177.4	0	0	0	0	0	113.1	Q333 N334 Q335 N341	Q333-G337 PolarHBondContact O-N 2.82Å; N334-G337 PolarHBondContact O-N 2.96Å; Q335-G337 PolarHBondContact O-N 3.44Å; G337-N341 PolarHBondContact O-N 3.47Å; G337-N341 VanDerWaalsContact O-N 3.15Å; G337-N341 PolarHBondContact O-ND2 3.35Å
338	A	91.1	Very high	91	Very high	43 Å²	43	88.2 Å²	88.2	36%	0.355	45%	0.452	S	S	.	.	H	α-helix	trans	-64.7	-45	173.4	0	0	0	0	0	112.2	N334 Q335 K336 N341 L342	N334-A338 PolarHBondContact O-N 2.86Å; N334-A338 VanDerWaalsContact O-N 3.09Å; Q335-A338 WeakPolarHBondContact O-CB 3.42Å; Q335-A338 PolarHBondContact O-N 3.31Å; K336-A338 VanDerWaalsContact C-N 3.3Å; K336-A338 PolarHBondContact O-N 3.03Å; A338-N341 PolarHBondContact O-N 3.42Å; A338-L342 WeakPolarHBondContact O-CG 3.47Å; A338-L342 PolarHBondContact O-N 3.27Å
339	I	90.3	Very high	91	Very high	109 Å²	109	91.2 Å²	91.2	56%	0.559	46%	0.463	S	S	*	.	H	α-helix	trans	-65.4	-42.7	178.2	-67.6	164.3	0	0	0	111.4	Q335 K336 N341 L342 L343	Q335-I339 VanDerWaalsContact O-CG1 3.29Å; Q335-I339 WeakPolarHBondContact O-CG1 3.38Å; Q335-I339 PolarHBondContact O-N 2.93Å; K336-I339 PolarHBondContact O-N 3.33Å; I339-N341 VanDerWaalsContact C-N 3.33Å; I339-N341 PolarHBondContact O-N 2.92Å; I339-L342 PolarHBondContact O-N 2.92Å; I339-L343 WeakPolarHBondContact O-CB 3.45Å; I339-L343 PolarHBondContact O-N 3.12Å
340	E	94	Very high	90.9	Very high	105 Å²	105	92.6 Å²	92.6	49%	0.491	47%	0.467	S	S	.	.	H	α-helix	trans	-61.4	-39.4	176.5	-73.9	175.3	159.5	0	0	111.8	K336 L343 A344	K336-E340 WeakPolarHBondContact CE-OE1 3.21Å; K336-E340 HydrophobicContact CG-CG 4.38Å; K336-E340 IonicContact NZ-OE1 3.1Å; K336-E340 WeakPolarHBondContact O-CG 3.3Å; K336-E340 PolarHBondContact O-N 2.86Å; E340-L343 PolarHBondContact O-N 3.31Å; E340-A344 PolarHBondContact O-N 2.9Å
341	N	92.2	Very high	90.9	Very high	109 Å²	109	92.6 Å²	92.6	58%	0.583	47%	0.47	S	S	*	.	H	α-helix	trans	-67.1	-35.8	174	-82.7	-68.2	0	0	0	113.3	G337 A338 I339 K345	G337-N341 PolarHBondContact O-N 3.47Å; G337-N341 VanDerWaalsContact O-N 3.15Å; G337-N341 PolarHBondContact O-ND2 3.35Å; A338-N341 PolarHBondContact O-N 3.42Å; I339-N341 VanDerWaalsContact C-N 3.33Å; I339-N341 PolarHBondContact O-N 2.92Å; N341-K345 PolarHBondContact O-N 3.3Å
342	L	92	Very high	90.8	Very high	115 Å²	115	97.4 Å²	97.4	60%	0.602	49%	0.488	S	S	*	.	H	α-helix	trans	-70.6	-39.8	173.7	-70.7	171.6	0	0	0	111.6	A338 I339 A344 K345 L346	A338-L342 WeakPolarHBondContact O-CG 3.47Å; A338-L342 PolarHBondContact O-N 3.27Å; I339-L342 PolarHBondContact O-N 2.92Å; L342-A344 PolarHBondContact O-N 3.17Å; L342-K345 PolarHBondContact O-N 2.9Å; L342-L346 PolarHBondContact O-N 3.18Å
343	L	90.3	Very high	90.8	Very high	95 Å²	95	96 Å²	96	50%	0.497	49%	0.489	S	S	.	.	H	α-helix	trans	-62.1	-41.3	175.8	-179.5	60.2	0	0	0	111.8	I339 E340 K345 L346 L347	I339-L343 WeakPolarHBondContact O-CB 3.45Å; I339-L343 PolarHBondContact O-N 3.12Å; E340-L343 PolarHBondContact O-N 3.31Å; L343-K345 PolarHBondContact O-N 3.38Å; L343-L346 PolarHBondContact O-N 3.01Å; L343-L346 VanDerWaalsContact O-N 3.16Å; L343-L347 HydrophobicContact CG-CD1 4.39Å; L343-L347 WeakPolarHBondContact O-CG 3.47Å; L343-L347 PolarHBondContact O-N 3.09Å
344	A	93	Very high	90.7	Very high	57 Å²	57	98 Å²	98	47%	0.471	50%	0.498	S	S	.	.	H	α-helix	trans	-58.1	-45.9	175.1	0	0	0	0	0	112.3	E340 L342 L346 L347 E348	E340-A344 PolarHBondContact O-N 2.9Å; L342-A344 PolarHBondContact O-N 3.17Å; A344-L346 VanDerWaalsContact C-N 3.33Å; A344-L346 PolarHBondContact O-N 3.46Å; A344-L347 PolarHBondContact O-N 3.16Å; A344-E348 PolarHBondContact O-N 3.09Å
345	K	92.2	Very high	90.8	Very high	142 Å²	142	99.1 Å²	99.1	62%	0.617	50%	0.499	S	S	*	.	H	α-helix	trans	-64.4	-36.1	174.9	-66.7	174.9	-178.8	-179.7	0	112.4	N341 L342 L343 E348 K349	N341-K345 PolarHBondContact O-N 3.3Å; L342-K345 PolarHBondContact O-N 2.9Å; L343-K345 PolarHBondContact O-N 3.38Å; K345-E348 PolarHBondContact O-N 3.45Å; K345-K349 PolarHBondContact O-N 3.06Å
346	L	90.6	Very high	90.8	Very high	109 Å²	109	97.2 Å²	97.2	57%	0.571	50%	0.496	S	S	*	.	H	α-helix	trans	-69.4	-33.2	177	-171.6	60.7	0	0	0	112.3	L342 L343 A344 K349 K350	L342-L346 PolarHBondContact O-N 3.18Å; L343-L346 PolarHBondContact O-N 3.01Å; L343-L346 VanDerWaalsContact O-N 3.16Å; A344-L346 VanDerWaalsContact C-N 3.33Å; A344-L346 PolarHBondContact O-N 3.46Å; L346-K349 PolarHBondContact O-N 2.97Å; L346-K350 PolarHBondContact O-N 3.49Å
347	L	90	Very high	90.9	Very high	92 Å²	92	96.1 Å²	96.1	48%	0.482	50%	0.502	S	S	.	.	H	α-helix	trans	-68.2	-36.3	173.3	-71.4	169.7	0	0	0	112.4	L343 A344 K350 N351	L343-L347 HydrophobicContact CG-CD1 4.39Å; L343-L347 WeakPolarHBondContact O-CG 3.47Å; L343-L347 PolarHBondContact O-N 3.09Å; A344-L347 PolarHBondContact O-N 3.16Å; L347-K350 WeakPolarHBondContact O-CB 3.34Å; L347-K350 PolarHBondContact O-N 2.96Å; L347-N351 PolarHBondContact O-N 3.06Å; L347-N351 PolarHBondContact O-ND2 2.9Å
348	E	89.3	Confident	91.2	Very high	102 Å²	102	97.7 Å²	97.7	48%	0.477	51%	0.508	S	S	.	.	H	α-helix	trans	-63.3	-47.5	169.5	-176.5	172.9	-149.1	0	0	111	A344 K345 K350 N351 Y352	A344-E348 PolarHBondContact O-N 3.09Å; K345-E348 PolarHBondContact O-N 3.45Å; E348-K350 VanDerWaalsContact C-N 3.29Å; E348-K350 PolarHBondContact O-N 3.15Å; E348-N351 PolarHBondContact O-N 3.46Å; E348-N351 VanDerWaalsContact O-N 3.11Å; E348-Y352 PolarHBondContact O-N 3.03Å; E348-Y352 VanDerWaalsContact O-N 3.12Å
349	K	88.6	Confident	91.3	Very high	137 Å²	137	100.1 Å²	100.1	60%	0.596	51%	0.512	S	S	*	.	H	α-helix	trans	-60.5	-35.4	176.5	-168.9	171.4	-177.6	176.4	0	112.6	K345 L346 N351 Y352 V353	K345-K349 PolarHBondContact O-N 3.06Å; L346-K349 PolarHBondContact O-N 2.97Å; K349-N351 PolarHBondContact O-N 2.9Å; K349-Y352 PolarHBondContact O-N 3.16Å; K349-V353 HydrophobicContact CG-CG2 4.43Å; K349-V353 VanDerWaalsContact O-CG2 3.32Å; K349-V353 WeakPolarHBondContact O-CG2 3.28Å; K349-V353 PolarHBondContact O-N 3.4Å
350	K	87.4	Confident	91.4	Very high	139 Å²	139	99.1 Å²	99.1	60%	0.604	51%	0.511	S	S	*	.	H	α-helix	trans	-57.8	-46.3	173	175.6	-172.6	172.7	-176.7	0	111.7	L346 L347 E348 V353 H354	L346-K350 PolarHBondContact O-N 3.49Å; L347-K350 WeakPolarHBondContact O-CB 3.34Å; L347-K350 PolarHBondContact O-N 2.96Å; E348-K350 VanDerWaalsContact C-N 3.29Å; E348-K350 PolarHBondContact O-N 3.15Å; K350-V353 PolarHBondContact O-N 2.82Å; K350-H354 PolarHBondContact O-N 3.47Å
351	N	90.7	Very high	91.4	Very high	112 Å²	112	99.2 Å²	99.2	60%	0.599	51%	0.511	S	S	*	.	H	α-helix	trans	-65.2	-41.4	179.7	-64.8	-24.5	0	0	0	111.3	L347 E348 K349 H354 F355	L347-N351 PolarHBondContact O-N 3.06Å; L347-N351 PolarHBondContact O-ND2 2.9Å; E348-N351 PolarHBondContact O-N 3.46Å; E348-N351 VanDerWaalsContact O-N 3.11Å; K349-N351 PolarHBondContact O-N 2.9Å; N351-H354 PolarHBondContact O-N 3.22Å; N351-F355 PolarHBondContact O-N 2.88Å
352	Y	90.5	Very high	91.5	Very high	105 Å²	105	97 Å²	97	41%	0.412	50%	0.499	S	S	.	.	H	α-helix	trans	-61.4	-44.7	173.7	173	-91.7	0	0	0	112.5	E348 K349 H354 F355 A356 Y502	E348-Y352 PolarHBondContact O-N 3.03Å; E348-Y352 VanDerWaalsContact O-N 3.12Å; K349-Y352 PolarHBondContact O-N 3.16Å; Y352-H354 PolarHBondContact O-N 2.89Å; Y352-F355 PolarHBondContact O-N 2.71Å; Y352-A356 WeakPolarHBondContact O-CB 3.4Å; Y352-A356 PolarHBondContact O-N 3.38Å; Y352-Y502 WeakPolarHBondContact CE2-OH 3.48Å; Y352-Y502 WeakPolarHBondContact OH-CE1 3.28Å; Y352-Y502 PolarHBondContact OH-OH 3.34Å
353	V	89.3	Confident	91.6	Very high	83 Å²	83	98.7 Å²	98.7	50%	0.503	50%	0.497	S	S	.	.	H	α-helix	trans	-62.5	-41.6	177.1	168.7	0	0	0	0	111.4	K349 K350 A356 A357	K349-V353 HydrophobicContact CG-CG2 4.43Å; K349-V353 VanDerWaalsContact O-CG2 3.32Å; K349-V353 WeakPolarHBondContact O-CG2 3.28Å; K349-V353 PolarHBondContact O-N 3.4Å; K350-V353 PolarHBondContact O-N 2.82Å; V353-A356 PolarHBondContact O-N 2.95Å; V353-A357 WeakPolarHBondContact O-CB 3.37Å; V353-A357 PolarHBondContact O-N 3.11Å
354	H	90.1	Very high	91.8	Very high	135 Å²	135	98 Å²	98	63%	0.625	49%	0.493	S	S	*	.	H	α-helix	trans	-62.8	-42.7	174.7	-174.8	-73	0	0	0	112.1	K350 N351 Y352 T358	K350-H354 PolarHBondContact O-N 3.47Å; N351-H354 PolarHBondContact O-N 3.22Å; Y352-H354 PolarHBondContact O-N 2.89Å; H354-T358 WeakPolarHBondContact O-CB 3.25Å; H354-T358 PolarHBondContact O-N 3.42Å; H354-T358 PolarHBondContact O-OG1 3.22Å
355	F	92.9	Very high	91.9	Very high	112 Å²	112	100.7 Å²	100.7	49%	0.491	49%	0.494	S	S	.	.	H	α-helix	trans	-61.2	-48.4	174.5	172.9	-101.2	0	0	0	111.7	N351 Y352 A357 T358 Q359	N351-F355 PolarHBondContact O-N 2.88Å; Y352-F355 PolarHBondContact O-N 2.71Å; F355-A357 PolarHBondContact O-N 3.09Å; F355-T358 WeakPolarHBondContact O-CB 3.39Å; F355-T358 PolarHBondContact O-N 3.37Å; F355-Q359 HydrophobicContact CD1-CG 4.34Å; F355-Q359 HydrophobicContact CD2-CG 4.3Å; F355-Q359 HydrophobicContact CE1-CG 3.93Å; F355-Q359 HydrophobicContact CE2-CG 3.88Å; F355-Q359 HydrophobicContact CZ-CG 3.68Å; F355-Q359 WeakPolarHBondContact O-CG 3.35Å; F355-Q359 PolarHBondContact O-N 3.49Å
356	A	92.9	Very high	92	Very high	35 Å²	35	98.1 Å²	98.1	29%	0.289	48%	0.484	S	S	.	.	H	α-helix	trans	-59.6	-45.9	178.3	0	0	0	0	0	112.1	Y352 V353 T358 Q359 V360	Y352-A356 WeakPolarHBondContact O-CB 3.4Å; Y352-A356 PolarHBondContact O-N 3.38Å; V353-A356 PolarHBondContact O-N 2.95Å; A356-T358 VanDerWaalsContact C-N 3.34Å; A356-T358 PolarHBondContact O-N 3.2Å; A356-Q359 PolarHBondContact O-N 3.08Å; A356-V360 WeakPolarHBondContact O-CG2 3.47Å; A356-V360 PolarHBondContact O-N 2.91Å
357	A	91.9	Very high	92.2	Very high	60 Å²	60	97.4 Å²	97.4	50%	0.496	48%	0.484	S	S	.	.	H	α-helix	trans	-60.1	-42	175.2	0	0	0	0	0	112.2	V353 F355 Q359 V360 Q361	V353-A357 WeakPolarHBondContact O-CB 3.37Å; V353-A357 PolarHBondContact O-N 3.11Å; F355-A357 PolarHBondContact O-N 3.09Å; A357-Q359 VanDerWaalsContact C-N 3.35Å; A357-Q359 PolarHBondContact O-N 3.47Å; A357-V360 PolarHBondContact O-N 3.25Å; A357-Q361 PolarHBondContact O-N 3.04Å
358	T	95.5	Very high	92.4	Very high	56 Å²	56	97.3 Å²	97.3	34%	0.344	48%	0.484	S	S	.	.	H	α-helix	trans	-61.9	-41.9	175.5	-53.6	0	0	0	0	111.4	H354 F355 A356 Q361 N362	H354-T358 WeakPolarHBondContact O-CB 3.25Å; H354-T358 PolarHBondContact O-N 3.42Å; H354-T358 PolarHBondContact O-OG1 3.22Å; F355-T358 WeakPolarHBondContact O-CB 3.39Å; F355-T358 PolarHBondContact O-N 3.37Å; A356-T358 VanDerWaalsContact C-N 3.34Å; A356-T358 PolarHBondContact O-N 3.2Å; T358-Q361 PolarHBondContact O-N 3.37Å; T358-N362 VanDerWaalsContact O-CG 3.24Å; T358-N362 PolarHBondContact O-N 3.46Å; T358-N362 PolarHBondContact O-ND2 3.06Å
359	Q	93.4	Very high	92.7	Very high	94 Å²	94	98 Å²	98	44%	0.439	49%	0.488	S	S	.	.	H	α-helix	trans	-68.1	-36.3	178.7	-69.4	-68.6	85.3	0	0	112.8	F355 A356 A357 N362 R363	F355-Q359 HydrophobicContact CD1-CG 4.34Å; F355-Q359 HydrophobicContact CD2-CG 4.3Å; F355-Q359 HydrophobicContact CE1-CG 3.93Å; F355-Q359 HydrophobicContact CE2-CG 3.88Å; F355-Q359 HydrophobicContact CZ-CG 3.68Å; F355-Q359 WeakPolarHBondContact O-CG 3.35Å; F355-Q359 PolarHBondContact O-N 3.49Å; A356-Q359 PolarHBondContact O-N 3.08Å; A357-Q359 VanDerWaalsContact C-N 3.35Å; A357-Q359 PolarHBondContact O-N 3.47Å; Q359-N362 PolarHBondContact O-N 2.9Å; Q359-N362 PolarHBondContact OE1-ND2 2.88Å; Q359-R363 PolarHBondContact O-N 3.46Å
360	V	92	Very high	93	Very high	88 Å²	88	95.1 Å²	95.1	53%	0.533	48%	0.482	S	S	.	.	H	α-helix	trans	-65.4	-44	171.5	173	0	0	0	0	110.7	A356 A357 N362 R363 I364	A356-V360 WeakPolarHBondContact O-CG2 3.47Å; A356-V360 PolarHBondContact O-N 2.91Å; A357-V360 PolarHBondContact O-N 3.25Å; V360-N362 VanDerWaalsContact C-N 3.32Å; V360-N362 PolarHBondContact O-N 2.89Å; V360-R363 WeakPolarHBondContact O-CB 3.38Å; V360-R363 PolarHBondContact O-N 2.83Å; V360-R363 VanDerWaalsContact O-N 3.11Å; V360-I364 HydrophobicContact CG1-CD1 4.03Å; V360-I364 WeakPolarHBondContact O-CG1 3.27Å; V360-I364 PolarHBondContact O-N 2.97Å
361	Q	94.3	Very high	93.4	Very high	106 Å²	106	93.5 Å²	93.5	50%	0.495	48%	0.48	S	S	.	.	H	α-helix	trans	-62.6	-37.7	177.4	-169	64.8	5.2	0	0	112.5	A357 T358 I364 K365	A357-Q361 PolarHBondContact O-N 3.04Å; T358-Q361 PolarHBondContact O-N 3.37Å; Q361-I364 PolarHBondContact O-N 2.81Å; Q361-K365 PolarHBondContact O-N 3.27Å
362	N	94.8	Very high	93.7	Very high	62 Å²	62	95.4 Å²	95.4	33%	0.332	48%	0.483	S	S	.	.	H	α-helix	trans	-63.9	-42.4	172.6	-69.2	-23	0	0	0	111.6	T358 Q359 V360 I364 K365 E366	T358-N362 VanDerWaalsContact O-CG 3.24Å; T358-N362 PolarHBondContact O-N 3.46Å; T358-N362 PolarHBondContact O-ND2 3.06Å; Q359-N362 PolarHBondContact O-N 2.9Å; Q359-N362 PolarHBondContact OE1-ND2 2.88Å; V360-N362 VanDerWaalsContact C-N 3.32Å; V360-N362 PolarHBondContact O-N 2.89Å; N362-I364 PolarHBondContact O-N 3.09Å; N362-K365 WeakPolarHBondContact O-CB 3.27Å; N362-K365 PolarHBondContact O-N 2.99Å; N362-E366 WeakPolarHBondContact O-CG 3.28Å; N362-E366 PolarHBondContact O-N 2.94Å
363	R	94.7	Very high	93.9	Very high	152 Å²	152	97.3 Å²	97.3	57%	0.574	49%	0.489	S	S	*	.	H	α-helix	trans	-62	-38.9	175.4	-83.8	-76.5	129	85.8	7.7	113.2	Q359 V360 K365 E366 V367	Q359-R363 PolarHBondContact O-N 3.46Å; V360-R363 WeakPolarHBondContact O-CB 3.38Å; V360-R363 PolarHBondContact O-N 2.83Å; V360-R363 VanDerWaalsContact O-N 3.11Å; R363-K365 VanDerWaalsContact C-N 3.32Å; R363-K365 PolarHBondContact O-N 3.26Å; R363-E366 IonicContact CZ-OE1 3.18Å; R363-E366 IonicContact CZ-OE2 2.71Å; R363-E366 VanDerWaalsContact CZ-OE2 3.27Å; R363-E366 IonicContact NE-OE1 2.73Å; R363-E366 IonicContact NE-OE2 3.28Å; R363-E366 PolarHBondContact NE-OE2 3.5Å; R363-E366 IonicContact NH2-OE1 3.37Å; R363-E366 PolarHBondContact NH2-OE1 3.21Å; R363-E366 IonicContact NH2-OE2 3.78Å; R363-E366 PolarHBondContact NH2-OE2 3.39Å; R363-E366 PolarHBondContact O-N 3.05Å; R363-V367 WeakPolarHBondContact O-CG2 3.35Å; R363-V367 PolarHBondContact O-N 3.39Å
364	I	93.6	Very high	94.3	Very high	80 Å²	80	95.7 Å²	95.7	41%	0.41	48%	0.479	S	S	.	.	H	α-helix	trans	-62.1	-41.2	175.1	-67.9	165.5	0	0	0	110.6	V360 Q361 N362 V367 N368	V360-I364 HydrophobicContact CG1-CD1 4.03Å; V360-I364 WeakPolarHBondContact O-CG1 3.27Å; V360-I364 PolarHBondContact O-N 2.97Å; Q361-I364 PolarHBondContact O-N 2.81Å; N362-I364 PolarHBondContact O-N 3.09Å; I364-V367 PolarHBondContact O-N 2.71Å; I364-N368 PolarHBondContact O-N 3.33Å; I364-N368 VanDerWaalsContact O-N 3.08Å
365	K	95.2	Very high	94.6	Very high	114 Å²	114	93.3 Å²	93.3	50%	0.496	47%	0.468	S	S	.	.	H	α-helix	trans	-63.8	-49.2	173.8	-67.8	179.3	177.3	-171.8	0	112.4	Q361 N362 R363 V367 N368 E369	Q361-K365 PolarHBondContact O-N 3.27Å; N362-K365 WeakPolarHBondContact O-CB 3.27Å; N362-K365 PolarHBondContact O-N 2.99Å; R363-K365 VanDerWaalsContact C-N 3.32Å; R363-K365 PolarHBondContact O-N 3.26Å; K365-V367 PolarHBondContact O-N 3.33Å; K365-N368 PolarHBondContact O-N 3.35Å; K365-N368 VanDerWaalsContact O-N 3.11Å; K365-E369 WeakPolarHBondContact O-CG 3.48Å; K365-E369 PolarHBondContact O-N 3.31Å
366	E	94.5	Very high	94.8	Very high	87 Å²	87	93 Å²	93	41%	0.407	47%	0.469	S	S	.	.	H	α-helix	trans	-54.6	-39.7	177.3	-72.6	176.2	-154.7	0	0	112.1	N362 R363 T370	N362-E366 WeakPolarHBondContact O-CG 3.28Å; N362-E366 PolarHBondContact O-N 2.94Å; R363-E366 IonicContact CZ-OE1 3.18Å; R363-E366 IonicContact CZ-OE2 2.71Å; R363-E366 VanDerWaalsContact CZ-OE2 3.27Å; R363-E366 IonicContact NE-OE1 2.73Å; R363-E366 IonicContact NE-OE2 3.28Å; R363-E366 PolarHBondContact NE-OE2 3.5Å; R363-E366 IonicContact NH2-OE1 3.37Å; R363-E366 PolarHBondContact NH2-OE1 3.21Å; R363-E366 IonicContact NH2-OE2 3.78Å; R363-E366 PolarHBondContact NH2-OE2 3.39Å; R363-E366 PolarHBondContact O-N 3.05Å; E366-T370 WeakPolarHBondContact O-CB 3.34Å; E366-T370 PolarHBondContact O-N 3.11Å; E366-T370 VanDerWaalsContact O-N 3.09Å; E366-T370 PolarHBondContact O-OG1 3.46Å
367	V	94.1	Very high	94.9	Very high	94 Å²	94	97.1 Å²	97.1	57%	0.57	48%	0.482	S	S	*	.	H	α-helix	trans	-68.2	-45.8	176.4	169.8	0	0	0	0	111.7	R363 I364 K365 T370 N371	R363-V367 WeakPolarHBondContact O-CG2 3.35Å; R363-V367 PolarHBondContact O-N 3.39Å; I364-V367 PolarHBondContact O-N 2.71Å; K365-V367 PolarHBondContact O-N 3.33Å; V367-T370 PolarHBondContact O-N 3.44Å; V367-N371 PolarHBondContact O-N 3.11Å
368	N	95	Very high	95	Very high	90 Å²	90	98.1 Å²	98.1	48%	0.481	48%	0.478	S	S	.	.	H	α-helix	trans	-65.2	-40.1	179.7	-71.7	-13.3	0	0	0	112.5	I364 K365 T370 N371 K372	I364-N368 PolarHBondContact O-N 3.33Å; I364-N368 VanDerWaalsContact O-N 3.08Å; K365-N368 PolarHBondContact O-N 3.35Å; K365-N368 VanDerWaalsContact O-N 3.11Å; N368-T370 VanDerWaalsContact C-N 3.33Å; N368-N371 PolarHBondContact O-N 3.11Å; N368-K372 PolarHBondContact O-N 2.95Å; N368-K372 VanDerWaalsContact O-N 3.09Å
369	E	96.1	Very high	95.1	Very high	117 Å²	117	100.7 Å²	100.7	55%	0.547	48%	0.484	S	S	.	.	H	α-helix	trans	-63.4	-37.7	172.5	-72.7	175.5	-151.8	0	0	112.3	K365 R373	K365-E369 WeakPolarHBondContact O-CG 3.48Å; K365-E369 PolarHBondContact O-N 3.31Å; E369-R373 WeakPolarHBondContact O-CB 3.37Å; E369-R373 PolarHBondContact O-N 3.29Å
370	T	94	Very high	95.2	Very high	77 Å²	77	99.8 Å²	99.8	47%	0.472	49%	0.485	S	S	.	.	H	α-helix	trans	-68.2	-40.9	176.8	-58.8	0	0	0	0	111.1	E366 V367 N368 R373 V374	E366-T370 WeakPolarHBondContact O-CB 3.34Å; E366-T370 PolarHBondContact O-N 3.11Å; E366-T370 VanDerWaalsContact O-N 3.09Å; E366-T370 PolarHBondContact O-OG1 3.46Å; V367-T370 PolarHBondContact O-N 3.44Å; N368-T370 VanDerWaalsContact C-N 3.33Å; T370-R373 PolarHBondContact O-N 3.35Å; T370-V374 HydrophobicContact CG2-CG2 4.43Å; T370-V374 WeakPolarHBondContact O-CG2 3.41Å; T370-V374 PolarHBondContact O-N 2.96Å
371	N	95	Very high	95.2	Very high	105 Å²	105	97.7 Å²	97.7	56%	0.561	48%	0.477	S	S	*	.	H	α-helix	trans	-60.4	-56.3	176.3	-170.1	20.1	0	0	0	111.4	V367 N368 R373 V374 E375	V367-N371 PolarHBondContact O-N 3.11Å; N368-N371 PolarHBondContact O-N 3.11Å; N371-R373 PolarHBondContact O-N 3.03Å; N371-R373 VanDerWaalsContact O-N 3.12Å; N371-V374 PolarHBondContact O-N 2.93Å; N371-E375 WeakPolarHBondContact O-CB 3.43Å; N371-E375 PolarHBondContact O-N 3.48Å
372	K	97.1	Very high	95.2	Very high	151 Å²	151	96.3 Å²	96.3	66%	0.657	47%	0.472	S	S	*	.	H	α-helix	trans	-52.6	-37	177	-73.9	-172.1	175.3	-171.3	0	112.4	N368 Q376	N368-K372 PolarHBondContact O-N 2.95Å; N368-K372 VanDerWaalsContact O-N 3.09Å; K372-Q376 WeakPolarHBondContact O-CB 3.45Å; K372-Q376 PolarHBondContact O-N 3.04Å
373	R	96.5	Very high	95.3	Very high	146 Å²	146	99.6 Å²	99.6	55%	0.551	48%	0.484	S	S	*	.	H	α-helix	trans	-69.4	-51.7	178.3	-172	-172.8	-49.9	-160.9	2.7	112.9	E369 T370 N371 E375 Q376 E377	E369-R373 WeakPolarHBondContact O-CB 3.37Å; E369-R373 PolarHBondContact O-N 3.29Å; T370-R373 PolarHBondContact O-N 3.35Å; N371-R373 PolarHBondContact O-N 3.03Å; N371-R373 VanDerWaalsContact O-N 3.12Å; R373-E375 VanDerWaalsContact C-N 3.31Å; R373-E375 PolarHBondContact O-N 3.41Å; R373-Q376 PolarHBondContact O-N 3.18Å; R373-Q376 VanDerWaalsContact O-N 3.16Å; R373-E377 WeakPolarHBondContact CG-OE1 3.5Å; R373-E377 WeakPolarHBondContact O-CG 3.4Å; R373-E377 PolarHBondContact O-N 3.23Å
374	V	96	Very high	95.3	Very high	49 Å²	49	96 Å²	96	30%	0.297	48%	0.479	S	S	.	.	H	α-helix	trans	-65.3	-37.8	-178.2	173.2	0	0	0	0	110.8	T370 N371 Q376 E377 I378 L492	T370-V374 HydrophobicContact CG2-CG2 4.43Å; T370-V374 WeakPolarHBondContact O-CG2 3.41Å; T370-V374 PolarHBondContact O-N 2.96Å; N371-V374 PolarHBondContact O-N 2.93Å; V374-Q376 VanDerWaalsContact C-N 3.33Å; V374-Q376 PolarHBondContact O-N 3.11Å; V374-E377 PolarHBondContact O-N 2.82Å; V374-I378 HydrophobicContact CG1-CD1 3.99Å; V374-I378 VanDerWaalsContact O-CG1 3.3Å; V374-I378 WeakPolarHBondContact O-CG1 3.46Å; V374-I378 PolarHBondContact O-N 2.88Å; V374-L492 HydrophobicContact CG1-CD2 3.77Å
375	E	96.8	Very high	95.2	Very high	84 Å²	84	95.9 Å²	95.9	39%	0.393	48%	0.478	S	S	.	.	H	α-helix	trans	-56.9	-45.7	171.8	-168.5	-163.2	144.1	0	0	111.8	N371 R373 I378 K379	N371-E375 WeakPolarHBondContact O-CB 3.43Å; N371-E375 PolarHBondContact O-N 3.48Å; R373-E375 VanDerWaalsContact C-N 3.31Å; R373-E375 PolarHBondContact O-N 3.41Å; E375-I378 PolarHBondContact O-N 2.75Å; E375-K379 HydrophobicContact CG-CD 4.43Å; E375-K379 WeakPolarHBondContact O-CG 3.41Å; E375-K379 PolarHBondContact O-N 3.41Å; E375-K379 VanDerWaalsContact OE1-CE 3.3Å; E375-K379 WeakPolarHBondContact OE1-CE 3.39Å; E375-K379 IonicContact OE1-NZ 3.82Å; E375-K379 PolarHBondContact OE1-NZ 3.06Å
376	Q	96.9	Very high	95.2	Very high	107 Å²	107	94.3 Å²	94.3	50%	0.5	48%	0.475	S	S	.	.	H	α-helix	trans	-69.2	-36.9	177.9	-175.7	61.4	6.9	0	0	112.8	K372 R373 V374 I378 K379 V380	K372-Q376 WeakPolarHBondContact O-CB 3.45Å; K372-Q376 PolarHBondContact O-N 3.04Å; R373-Q376 PolarHBondContact O-N 3.18Å; R373-Q376 VanDerWaalsContact O-N 3.16Å; V374-Q376 VanDerWaalsContact C-N 3.33Å; V374-Q376 PolarHBondContact O-N 3.11Å; Q376-I378 VanDerWaalsContact C-N 3.35Å; Q376-K379 PolarHBondContact O-N 3Å; Q376-V380 WeakPolarHBondContact O-CB 3.48Å; Q376-V380 VanDerWaalsContact O-CG2 3.31Å; Q376-V380 WeakPolarHBondContact O-CG2 3.45Å; Q376-V380 PolarHBondContact O-N 3.3Å
377	E	95.2	Very high	95.3	Very high	120 Å²	120	93.3 Å²	93.3	56%	0.561	47%	0.472	S	S	*	.	H	α-helix	trans	-61.7	-41.9	173.8	-73.2	174.7	-163.7	0	0	111.4	R373 V374 V380 A381	R373-E377 WeakPolarHBondContact CG-OE1 3.5Å; R373-E377 WeakPolarHBondContact O-CG 3.4Å; R373-E377 PolarHBondContact O-N 3.23Å; V374-E377 PolarHBondContact O-N 2.82Å; E377-V380 PolarHBondContact O-N 3.08Å; E377-A381 WeakPolarHBondContact O-CB 3.45Å; E377-A381 PolarHBondContact O-N 3.09Å
378	I	95.3	Very high	95.3	Very high	82 Å²	82	93.7 Å²	93.7	42%	0.421	47%	0.468	S	S	.	.	H	α-helix	trans	-63.1	-48.2	173.9	-68.3	164.4	0	0	0	111	V374 E375 Q376 V380 A381 I382 L492	V374-I378 HydrophobicContact CG1-CD1 3.99Å; V374-I378 VanDerWaalsContact O-CG1 3.3Å; V374-I378 WeakPolarHBondContact O-CG1 3.46Å; V374-I378 PolarHBondContact O-N 2.88Å; E375-I378 PolarHBondContact O-N 2.75Å; Q376-I378 VanDerWaalsContact C-N 3.35Å; I378-V380 VanDerWaalsContact C-N 3.34Å; I378-V380 PolarHBondContact O-N 3.5Å; I378-A381 PolarHBondContact O-N 2.9Å; I378-I382 HydrophobicContact CG2-CD1 3.75Å; I378-I382 HydrophobicContact CG2-CG1 4.5Å; I378-I382 WeakPolarHBondContact O-CG1 3.49Å; I378-I382 PolarHBondContact O-N 3.12Å; I378-L492 HydrophobicContact CD1-CD2 4.3Å
379	K	96.1	Very high	95.3	Very high	109 Å²	109	94.8 Å²	94.8	47%	0.474	47%	0.472	S	S	.	.	H	α-helix	trans	-56.6	-45.1	177.3	-77.3	169.4	168.2	175.6	0	112	E375 Q376 I382 F383	E375-K379 HydrophobicContact CG-CD 4.43Å; E375-K379 WeakPolarHBondContact O-CG 3.41Å; E375-K379 PolarHBondContact O-N 3.41Å; E375-K379 VanDerWaalsContact OE1-CE 3.3Å; E375-K379 WeakPolarHBondContact OE1-CE 3.39Å; E375-K379 IonicContact OE1-NZ 3.82Å; E375-K379 PolarHBondContact OE1-NZ 3.06Å; Q376-K379 PolarHBondContact O-N 3Å; K379-I382 PolarHBondContact O-N 3.48Å; K379-F383 WeakPolarHBondContact O-CB 3.34Å; K379-F383 PolarHBondContact O-N 2.92Å
380	V	95.6	Very high	95.3	Very high	75 Å²	75	93.3 Å²	93.3	46%	0.455	47%	0.468	S	S	.	.	H	α-helix	trans	-65.4	-41	178.1	169.6	0	0	0	0	111.9	Q376 E377 I378 T384	Q376-V380 WeakPolarHBondContact O-CB 3.48Å; Q376-V380 VanDerWaalsContact O-CG2 3.31Å; Q376-V380 WeakPolarHBondContact O-CG2 3.45Å; Q376-V380 PolarHBondContact O-N 3.3Å; E377-V380 PolarHBondContact O-N 3.08Å; I378-V380 VanDerWaalsContact C-N 3.34Å; I378-V380 PolarHBondContact O-N 3.5Å; V380-T384 WeakPolarHBondContact O-CB 3.29Å; V380-T384 PolarHBondContact O-N 3.48Å; V380-T384 PolarHBondContact O-OG1 3.2Å
381	A	93	Very high	95.5	Very high	44 Å²	44	95.4 Å²	95.4	36%	0.364	47%	0.471	S	S	.	.	H	α-helix	trans	-62.9	-46.6	177.1	0	0	0	0	0	112.1	E377 I378 T384 L385	E377-A381 WeakPolarHBondContact O-CB 3.45Å; E377-A381 PolarHBondContact O-N 3.09Å; I378-A381 PolarHBondContact O-N 2.9Å; A381-T384 PolarHBondContact O-N 2.74Å; A381-L385 PolarHBondContact O-N 3.19Å
382	I	94.3	Very high	95.5	Very high	78 Å²	78	96.3 Å²	96.3	40%	0.4	47%	0.47	S	S	.	.	H	α-helix	trans	-62.4	-48.8	177.7	-67.9	169.9	0	0	0	110.8	I378 K379 T384 L385 I386 L489	I378-I382 HydrophobicContact CG2-CD1 3.75Å; I378-I382 HydrophobicContact CG2-CG1 4.5Å; I378-I382 WeakPolarHBondContact O-CG1 3.49Å; I378-I382 PolarHBondContact O-N 3.12Å; K379-I382 PolarHBondContact O-N 3.48Å; I382-T384 VanDerWaalsContact C-N 3.28Å; I382-T384 PolarHBondContact O-N 2.93Å; I382-L385 PolarHBondContact O-N 3.46Å; I382-I386 HydrophobicContact CG2-CD1 3.71Å; I382-I386 HydrophobicContact CG2-CG1 4.4Å; I382-I386 WeakPolarHBondContact O-CG1 3.2Å; I382-I386 PolarHBondContact O-N 2.86Å; I382-L489 HydrophobicContact CG1-CD2 4.25Å
383	F	95.7	Very high	95.5	Very high	131 Å²	131	90.5 Å²	90.5	58%	0.575	45%	0.453	S	S	*	.	H	α-helix	trans	-60.6	-37.1	179.1	-175.7	-114.3	0	0	0	112.4	K379 I386 N387	K379-F383 WeakPolarHBondContact O-CB 3.34Å; K379-F383 PolarHBondContact O-N 2.92Å; F383-I386 PolarHBondContact O-N 2.99Å; F383-N387 VanDerWaalsContact CD1-ND2 3.31Å; F383-N387 WeakPolarHBondContact CD1-ND2 3.41Å; F383-N387 WeakPolarHBondContact CE1-ND2 3.18Å; F383-N387 WeakPolarHBondContact CZ-ND2 3.49Å; F383-N387 WeakPolarHBondContact O-CB 3.38Å; F383-N387 PolarHBondContact O-N 2.99Å; F383-N387 PolarHBondContact O-ND2 2.97Å
384	T	94.9	Very high	95.5	Very high	76 Å²	76	88.4 Å²	88.4	47%	0.466	45%	0.448	S	S	.	.	H	α-helix	trans	-61.7	-44.1	176.2	-59	0	0	0	0	111.8	V380 A381 I382 N387 E388	V380-T384 WeakPolarHBondContact O-CB 3.29Å; V380-T384 PolarHBondContact O-N 3.48Å; V380-T384 PolarHBondContact O-OG1 3.2Å; A381-T384 PolarHBondContact O-N 2.74Å; I382-T384 VanDerWaalsContact C-N 3.28Å; I382-T384 PolarHBondContact O-N 2.93Å; T384-N387 PolarHBondContact O-N 3.43Å; T384-E388 PolarHBondContact O-N 3.47Å
385	L	93	Very high	95.6	Very high	77 Å²	77	88.6 Å²	88.6	40%	0.403	45%	0.451	S	S	.	.	H	α-helix	trans	-68.8	-43	177.3	-70.5	-179.1	0	0	0	112.7	A381 I382 N387 E388 I389 L489	A381-L385 PolarHBondContact O-N 3.19Å; I382-L385 PolarHBondContact O-N 3.46Å; L385-N387 PolarHBondContact O-N 3.36Å; L385-E388 PolarHBondContact O-N 2.74Å; L385-I389 WeakPolarHBondContact O-CB 3.4Å; L385-I389 VanDerWaalsContact O-CG1 3.26Å; L385-I389 WeakPolarHBondContact O-CG1 3.45Å; L385-I389 PolarHBondContact O-N 3.28Å; L385-L489 HydrophobicContact CD1-CD1 3.39Å; L385-L489 HydrophobicContact CD1-CD2 4.15Å; L385-L489 HydrophobicContact CD1-CG 4.42Å
386	I	94.7	Very high	95.6	Very high	81 Å²	81	87.4 Å²	87.4	42%	0.415	45%	0.447	S	S	.	.	H	α-helix	trans	-56.3	-41.7	175.7	-70.2	171.7	0	0	0	110.5	I382 F383 N390	I382-I386 HydrophobicContact CG2-CD1 3.71Å; I382-I386 HydrophobicContact CG2-CG1 4.4Å; I382-I386 WeakPolarHBondContact O-CG1 3.2Å; I382-I386 PolarHBondContact O-N 2.86Å; F383-I386 PolarHBondContact O-N 2.99Å; I386-N390 WeakPolarHBondContact CG2-ND2 3.27Å; I386-N390 VanDerWaalsContact O-CB 3.28Å; I386-N390 WeakPolarHBondContact O-CB 3.3Å; I386-N390 VanDerWaalsContact O-CG 3.27Å; I386-N390 PolarHBondContact O-N 3.01Å; I386-N390 PolarHBondContact O-ND2 2.79Å
387	N	95.8	Very high	95.7	Very high	66 Å²	66	87.9 Å²	87.9	35%	0.353	45%	0.453	S	S	.	.	H	α-helix	trans	-65.8	-46.2	178.5	-77.1	-45.2	0	0	0	113.4	F383 T384 L385 N390 K391	F383-N387 VanDerWaalsContact CD1-ND2 3.31Å; F383-N387 WeakPolarHBondContact CD1-ND2 3.41Å; F383-N387 WeakPolarHBondContact CE1-ND2 3.18Å; F383-N387 WeakPolarHBondContact CZ-ND2 3.49Å; F383-N387 WeakPolarHBondContact O-CB 3.38Å; F383-N387 PolarHBondContact O-N 2.99Å; F383-N387 PolarHBondContact O-ND2 2.97Å; T384-N387 PolarHBondContact O-N 3.43Å; L385-N387 PolarHBondContact O-N 3.36Å; N387-N390 PolarHBondContact O-N 2.93Å; N387-K391 WeakPolarHBondContact O-CB 3.41Å; N387-K391 PolarHBondContact O-N 2.88Å
388	E	95.4	Very high	95.8	Very high	102 Å²	102	86.7 Å²	86.7	48%	0.477	45%	0.447	S	S	.	.	H	α-helix	trans	-68.9	-33.9	177.7	-71.2	-60.6	120.4	0	0	112.5	T384 L385 K391 K392	T384-E388 PolarHBondContact O-N 3.47Å; L385-E388 PolarHBondContact O-N 2.74Å; E388-K391 WeakPolarHBondContact OE1-CD 3.09Å; E388-K391 IonicContact OE1-NZ 2.64Å; E388-K391 PolarHBondContact OE1-NZ 2.93Å; E388-K391 WeakPolarHBondContact OE2-CD 3.32Å; E388-K391 IonicContact OE2-NZ 2.75Å; E388-K391 PolarHBondContact OE2-NZ 3.05Å; E388-K392 WeakPolarHBondContact O-CB 3.29Å; E388-K392 PolarHBondContact O-N 3.3Å
389	I	94	Very high	95.8	Very high	113 Å²	113	88 Å²	88	58%	0.579	45%	0.451	S	S	*	.	H	α-helix	trans	-62.7	-49.8	171.6	-69.3	166.6	0	0	0	110.3	L385 K391 K392 G393	L385-I389 WeakPolarHBondContact O-CB 3.4Å; L385-I389 VanDerWaalsContact O-CG1 3.26Å; L385-I389 WeakPolarHBondContact O-CG1 3.45Å; L385-I389 PolarHBondContact O-N 3.28Å; I389-K391 VanDerWaalsContact C-N 3.34Å; I389-K391 PolarHBondContact O-N 2.96Å; I389-K392 PolarHBondContact O-N 2.83Å; I389-G393 PolarHBondContact O-N 2.63Å
390	N	96.3	Very high	95.8	Very high	87 Å²	87	86.7 Å²	86.7	47%	0.465	45%	0.449	S	S	.	.	H	α-helix	trans	-61.6	-40.2	178.2	-80	-31.4	0	0	0	112.7	I386 N387 G393 K394	I386-N390 WeakPolarHBondContact CG2-ND2 3.27Å; I386-N390 VanDerWaalsContact O-CB 3.28Å; I386-N390 WeakPolarHBondContact O-CB 3.3Å; I386-N390 VanDerWaalsContact O-CG 3.27Å; I386-N390 PolarHBondContact O-N 3.01Å; I386-N390 PolarHBondContact O-ND2 2.79Å; N387-N390 PolarHBondContact O-N 2.93Å; N390-G393 PolarHBondContact O-N 2.93Å; N390-K394 WeakPolarHBondContact O-CG 3.37Å; N390-K394 PolarHBondContact O-N 3.33Å
391	K	97.3	Very high	95.8	Very high	121 Å²	121	87.1 Å²	87.1	53%	0.526	45%	0.446	S	S	.	.	H	α-helix	trans	-63.2	-42.5	174.5	179.7	-170.8	179.1	-167.3	0	111.6	N387 E388 I389 S395	N387-K391 WeakPolarHBondContact O-CB 3.41Å; N387-K391 PolarHBondContact O-N 2.88Å; E388-K391 WeakPolarHBondContact OE1-CD 3.09Å; E388-K391 IonicContact OE1-NZ 2.64Å; E388-K391 PolarHBondContact OE1-NZ 2.93Å; E388-K391 WeakPolarHBondContact OE2-CD 3.32Å; E388-K391 IonicContact OE2-NZ 2.75Å; E388-K391 PolarHBondContact OE2-NZ 3.05Å; I389-K391 VanDerWaalsContact C-N 3.34Å; I389-K391 PolarHBondContact O-N 2.96Å; K391-S395 WeakPolarHBondContact O-CB 3.14Å; K391-S395 PolarHBondContact O-N 2.91Å
392	K	96.1	Very high	95.9	Very high	123 Å²	123	89.1 Å²	89.1	54%	0.535	45%	0.451	S	S	.	.	H	α-helix	trans	-65.6	-41.2	173.7	-177.2	58.6	176.5	178.9	0	111.9	E388 I389 S395 L396	E388-K392 WeakPolarHBondContact O-CB 3.29Å; E388-K392 PolarHBondContact O-N 3.3Å; I389-K392 PolarHBondContact O-N 2.83Å; K392-S395 PolarHBondContact O-N 3.15Å; K392-L396 HydrophobicContact CD-CD1 4.45Å; K392-L396 HydrophobicContact CD-CG 4.45Å; K392-L396 HydrophobicContact CG-CD1 4.24Å; K392-L396 WeakPolarHBondContact O-CG 3.34Å; K392-L396 PolarHBondContact O-N 2.93Å
393	G	96	Very high	95.9	Very high	29 Å²	29	88 Å²	88	30%	0.299	45%	0.448	S	S	.	.	H	α-helix	trans	-58.3	-52.5	174.5	0	0	0	0	0	112.4	I389 N390 S395 L396 L397	I389-G393 PolarHBondContact O-N 2.63Å; N390-G393 PolarHBondContact O-N 2.93Å; G393-S395 VanDerWaalsContact C-N 3.31Å; G393-S395 PolarHBondContact O-N 2.84Å; G393-L396 PolarHBondContact O-N 3.47Å; G393-L396 VanDerWaalsContact O-N 3.16Å; G393-L397 WeakPolarHBondContact O-CG 3.45Å; G393-L397 PolarHBondContact O-N 3.18Å
394	K	97.9	Very high	95.7	Very high	102 Å²	102	84.9 Å²	84.9	44%	0.443	44%	0.439	S	S	.	.	H	α-helix	trans	-54.9	-44.2	174.5	-72.7	171.6	-179.4	174.6	0	112.3	N390 L396 L397 Q398	N390-K394 WeakPolarHBondContact O-CG 3.37Å; N390-K394 PolarHBondContact O-N 3.33Å; K394-L396 PolarHBondContact O-N 2.82Å; K394-L397 PolarHBondContact O-N 3.38Å; K394-Q398 PolarHBondContact O-N 2.91Å
395	S	97.4	Very high	95.6	Very high	54 Å²	54	86.3 Å²	86.3	38%	0.378	44%	0.439	S	S	.	.	H	α-helix	trans	-61.6	-41.8	177.3	-179.5	0	0	0	0	113	K391 K392 G393 Q398 Q399	K391-S395 WeakPolarHBondContact O-CB 3.14Å; K391-S395 PolarHBondContact O-N 2.91Å; K392-S395 PolarHBondContact O-N 3.15Å; G393-S395 VanDerWaalsContact C-N 3.31Å; G393-S395 PolarHBondContact O-N 2.84Å; S395-Q398 PolarHBondContact O-N 3.45Å; S395-Q399 WeakPolarHBondContact O-CG 3.21Å; S395-Q399 PolarHBondContact O-N 3.43Å; S395-Q399 VanDerWaalsContact O-N 3.12Å
396	L	97.5	Very high	95.6	Very high	58 Å²	58	87 Å²	87	30%	0.304	44%	0.44	S	S	.	.	H	α-helix	trans	-69.2	-39.5	177	-70.5	168.9	0	0	0	112.3	K392 G393 K394 Q399 L400 F475	K392-L396 HydrophobicContact CD-CD1 4.45Å; K392-L396 HydrophobicContact CD-CG 4.45Å; K392-L396 HydrophobicContact CG-CD1 4.24Å; K392-L396 WeakPolarHBondContact O-CG 3.34Å; K392-L396 PolarHBondContact O-N 2.93Å; G393-L396 PolarHBondContact O-N 3.47Å; G393-L396 VanDerWaalsContact O-N 3.16Å; K394-L396 PolarHBondContact O-N 2.82Å; L396-Q399 PolarHBondContact O-N 2.75Å; L396-L400 PolarHBondContact O-N 3.42Å; L396-F475 HydrophobicContact CD1-CE2 3.97Å
397	L	97.8	Very high	95.4	Very high	117 Å²	117	86.1 Å²	86.1	61%	0.613	43%	0.432	S	S	*	.	H	α-helix	trans	-62.2	-41.7	174.2	-70.5	169.8	0	0	0	111.5	G393 K394 Q399 L400 E401	G393-L397 WeakPolarHBondContact O-CG 3.45Å; G393-L397 PolarHBondContact O-N 3.18Å; K394-L397 PolarHBondContact O-N 3.38Å; L397-Q399 VanDerWaalsContact C-N 3.33Å; L397-Q399 PolarHBondContact O-N 3.48Å; L397-L400 PolarHBondContact O-N 3.42Å; L397-E401 WeakPolarHBondContact O-CB 3.49Å; L397-E401 PolarHBondContact O-N 3.43Å
398	Q	97.3	Very high	95.2	Very high	96 Å²	96	88.3 Å²	88.3	45%	0.449	44%	0.44	S	S	.	.	H	α-helix	trans	-65.4	-35.4	175.8	-167.9	59.3	66	0	0	112.5	K394 S395 E401 N402	K394-Q398 PolarHBondContact O-N 2.91Å; S395-Q398 PolarHBondContact O-N 3.45Å; Q398-E401 PolarHBondContact NE2-OE2 3.32Å; Q398-E401 PolarHBondContact O-N 3.15Å; Q398-N402 PolarHBondContact NE2-OD1 3.12Å; Q398-N402 WeakPolarHBondContact O-CB 3.3Å; Q398-N402 PolarHBondContact O-N 3.49Å; Q398-N402 PolarHBondContact O-ND2 2.87Å; Q398-N402 PolarHBondContact O-OD1 3.35Å
399	Q	96	Very high	95	Very high	109 Å²	109	89.4 Å²	89.4	51%	0.509	45%	0.447	S	S	.	.	H	α-helix	trans	-65.2	-44.2	173.3	-73.1	175.9	-4.2	0	0	111.7	S395 L396 L397 N402 V403	S395-Q399 WeakPolarHBondContact O-CG 3.21Å; S395-Q399 PolarHBondContact O-N 3.43Å; S395-Q399 VanDerWaalsContact O-N 3.12Å; L396-Q399 PolarHBondContact O-N 2.75Å; L397-Q399 VanDerWaalsContact C-N 3.33Å; L397-Q399 PolarHBondContact O-N 3.48Å; Q399-N402 PolarHBondContact O-N 3.25Å; Q399-V403 WeakPolarHBondContact O-CG2 3.34Å; Q399-V403 PolarHBondContact O-N 2.85Å
400	L	95.7	Very high	94.8	Very high	82 Å²	82	88.7 Å²	88.7	43%	0.429	44%	0.439	S	S	.	.	H	α-helix	trans	-60.5	-44.6	174.8	177	62.2	0	0	0	111.5	L396 L397 T404 I473	L396-L400 PolarHBondContact O-N 3.42Å; L397-L400 PolarHBondContact O-N 3.42Å; L400-T404 VanDerWaalsContact O-CB 3.31Å; L400-T404 WeakPolarHBondContact O-CB 3.48Å; L400-T404 PolarHBondContact O-N 2.58Å; L400-T404 PolarHBondContact O-OG1 3.21Å; L400-I473 HydrophobicContact CD1-CD1 4.1Å; L400-I473 HydrophobicContact CD1-CG2 3.94Å
401	E	96.4	Very high	94.6	Very high	84 Å²	84	88 Å²	88	39%	0.393	44%	0.435	S	S	.	.	H	α-helix	trans	-63.2	-45.5	179	-159.4	-151.3	-161.5	0	0	111.3	L397 Q398 T404 K405	L397-E401 WeakPolarHBondContact O-CB 3.49Å; L397-E401 PolarHBondContact O-N 3.43Å; Q398-E401 PolarHBondContact NE2-OE2 3.32Å; Q398-E401 PolarHBondContact O-N 3.15Å; E401-T404 PolarHBondContact O-N 3.43Å; E401-K405 HydrophobicContact CG-CD 4.26Å; E401-K405 WeakPolarHBondContact O-CB 3.38Å; E401-K405 WeakPolarHBondContact O-CG 3.5Å; E401-K405 PolarHBondContact O-N 3.11Å; E401-K405 WeakPolarHBondContact OE1-CE 3.16Å; E401-K405 IonicContact OE1-NZ 2.7Å; E401-K405 PolarHBondContact OE1-NZ 3.28Å; E401-K405 WeakPolarHBondContact OE2-CE 3.34Å; E401-K405 IonicContact OE2-NZ 2.68Å; E401-K405 PolarHBondContact OE2-NZ 3Å
402	N	95.1	Very high	94.3	Very high	85 Å²	85	86.7 Å²	86.7	46%	0.455	43%	0.433	S	S	.	.	H	α-helix	trans	-61.4	-48.3	179.1	-71.5	-5.7	0	0	0	112	Q398 Q399 T404 K405 E406	Q398-N402 PolarHBondContact NE2-OD1 3.12Å; Q398-N402 WeakPolarHBondContact O-CB 3.3Å; Q398-N402 PolarHBondContact O-N 3.49Å; Q398-N402 PolarHBondContact O-ND2 2.87Å; Q398-N402 PolarHBondContact O-OD1 3.35Å; Q399-N402 PolarHBondContact O-N 3.25Å; N402-T404 VanDerWaalsContact C-N 3.3Å; N402-T404 PolarHBondContact O-N 2.99Å; N402-K405 PolarHBondContact O-N 3.47Å; N402-E406 PolarHBondContact O-N 3.35Å
403	V	92.9	Very high	94.1	Very high	55 Å²	55	85.6 Å²	85.6	33%	0.333	43%	0.43	S	S	.	.	H	α-helix	trans	-64.5	-36.6	177.9	173.5	0	0	0	0	111.1	Q399 R407 I473	Q399-V403 WeakPolarHBondContact O-CG2 3.34Å; Q399-V403 PolarHBondContact O-N 2.85Å; V403-R407 HydrophobicContact CG1-CG 4.44Å; V403-R407 WeakPolarHBondContact O-CB 3.38Å; V403-R407 WeakPolarHBondContact O-CD 3.41Å; V403-R407 WeakPolarHBondContact O-CG 3.28Å; V403-R407 PolarHBondContact O-N 2.64Å; V403-R407 VanDerWaalsContact O-N 3.08Å; V403-I473 HydrophobicContact CG1-CD1 3.77Å
404	T	91.9	Very high	93.8	Very high	66 Å²	66	85.9 Å²	85.9	41%	0.405	42%	0.424	S	S	.	.	H	α-helix	trans	-66.3	-47.8	176.3	-57	0	0	0	0	111.2	L400 E401 N402 E406 R407 Q408	L400-T404 VanDerWaalsContact O-CB 3.31Å; L400-T404 WeakPolarHBondContact O-CB 3.48Å; L400-T404 PolarHBondContact O-N 2.58Å; L400-T404 PolarHBondContact O-OG1 3.21Å; E401-T404 PolarHBondContact O-N 3.43Å; N402-T404 VanDerWaalsContact C-N 3.3Å; N402-T404 PolarHBondContact O-N 2.99Å; T404-E406 PolarHBondContact O-N 2.9Å; T404-R407 PolarHBondContact O-N 3.43Å; T404-Q408 VanDerWaalsContact O-CB 3.27Å; T404-Q408 WeakPolarHBondContact O-CB 3.49Å; T404-Q408 PolarHBondContact O-N 2.66Å
405	K	93.6	Very high	93.6	Very high	106 Å²	106	86.2 Å²	86.2	46%	0.461	43%	0.427	S	S	.	.	H	α-helix	trans	-57.5	-45.5	175.7	-76	170.7	175.3	169.9	0	112	E401 N402 Q408 M409	E401-K405 HydrophobicContact CG-CD 4.26Å; E401-K405 WeakPolarHBondContact O-CB 3.38Å; E401-K405 WeakPolarHBondContact O-CG 3.5Å; E401-K405 PolarHBondContact O-N 3.11Å; E401-K405 WeakPolarHBondContact OE1-CE 3.16Å; E401-K405 IonicContact OE1-NZ 2.7Å; E401-K405 PolarHBondContact OE1-NZ 3.28Å; E401-K405 WeakPolarHBondContact OE2-CE 3.34Å; E401-K405 IonicContact OE2-NZ 2.68Å; E401-K405 PolarHBondContact OE2-NZ 3Å; N402-K405 PolarHBondContact O-N 3.47Å; K405-Q408 PolarHBondContact O-N 3.4Å; K405-M409 WeakPolarHBondContact O-CB 3.32Å; K405-M409 PolarHBondContact O-N 3.38Å
406	E	91.7	Very high	93.4	Very high	92 Å²	92	88.1 Å²	88.1	43%	0.43	43%	0.433	S	S	.	.	H	α-helix	trans	-63.2	-45.7	179.5	-165.4	-153.6	137.2	0	0	112.1	N402 T404 M409 K410	N402-E406 PolarHBondContact O-N 3.35Å; T404-E406 PolarHBondContact O-N 2.9Å; E406-M409 PolarHBondContact O-N 2.8Å; E406-K410 WeakPolarHBondContact O-CG 3.15Å; E406-K410 PolarHBondContact O-N 2.93Å; E406-K410 VanDerWaalsContact O-N 3.1Å; E406-K410 WeakPolarHBondContact OE1-CE 3.21Å; E406-K410 IonicContact OE1-NZ 2.6Å; E406-K410 PolarHBondContact OE1-NZ 2.76Å
407	R	91	Very high	93.1	Very high	62 Å²	62	89.8 Å²	89.8	23%	0.234	44%	0.442	C	S	.	.	H	α-helix	trans	-64.5	-43.9	177.1	-70.8	171.3	175.9	-141.3	-0.4	111.7	V403 T404 K410 L411 N470 G471	V403-R407 HydrophobicContact CG1-CG 4.44Å; V403-R407 WeakPolarHBondContact O-CB 3.38Å; V403-R407 WeakPolarHBondContact O-CD 3.41Å; V403-R407 WeakPolarHBondContact O-CG 3.28Å; V403-R407 PolarHBondContact O-N 2.64Å; V403-R407 VanDerWaalsContact O-N 3.08Å; T404-R407 PolarHBondContact O-N 3.43Å; R407-K410 PolarHBondContact O-N 3.04Å; R407-L411 WeakPolarHBondContact O-CG 3.28Å; R407-L411 PolarHBondContact O-N 3.26Å; R407-N470 HydrophobicContact CG-CB 4.17Å; R407-N470 PolarHBondContact NH1-O 2.89Å; R407-G471 VanDerWaalsContact CZ-O 3.27Å; R407-G471 PolarHBondContact NH1-O 3.15Å; R407-G471 PolarHBondContact NH2-O 3.45Å
408	Q	91.8	Very high	92.9	Very high	112 Å²	112	86.8 Å²	86.8	52%	0.523	43%	0.426	S	S	.	.	H	α-helix	trans	-61.1	-44.2	176.5	-174.5	-178.3	4.9	0	0	111.3	T404 K405 K410 L411 L412	T404-Q408 VanDerWaalsContact O-CB 3.27Å; T404-Q408 WeakPolarHBondContact O-CB 3.49Å; T404-Q408 PolarHBondContact O-N 2.66Å; K405-Q408 PolarHBondContact O-N 3.4Å; Q408-K410 PolarHBondContact O-N 2.93Å; Q408-L411 PolarHBondContact O-N 3.24Å; Q408-L412 HydrophobicContact CG-CD1 3.99Å; Q408-L412 HydrophobicContact CG-CG 4.42Å; Q408-L412 WeakPolarHBondContact O-CB 3.44Å; Q408-L412 VanDerWaalsContact O-CG 3.31Å; Q408-L412 WeakPolarHBondContact O-CG 3.17Å; Q408-L412 PolarHBondContact O-N 3.48Å
409	M	91.8	Very high	92.7	Very high	125 Å²	125	84.6 Å²	84.6	62%	0.616	42%	0.419	S	S	*	.	H	α-helix	trans	-60.7	-43.2	176.8	-175.8	176.1	66.3	0	0	112.1	K405 E406 L412 Q413	K405-M409 WeakPolarHBondContact O-CB 3.32Å; K405-M409 PolarHBondContact O-N 3.38Å; E406-M409 PolarHBondContact O-N 2.8Å; M409-L412 PolarHBondContact O-N 3.12Å; M409-Q413 PolarHBondContact O-N 3.44Å
410	K	90.3	Very high	92.6	Very high	98 Å²	98	80.4 Å²	80.4	43%	0.426	41%	0.405	S	S	.	.	H	α-helix	trans	-62.4	-43	175.5	-75.3	170.3	170.6	174	0	112.5	E406 R407 Q408 Q413 Q414	E406-K410 WeakPolarHBondContact O-CG 3.15Å; E406-K410 PolarHBondContact O-N 2.93Å; E406-K410 VanDerWaalsContact O-N 3.1Å; E406-K410 WeakPolarHBondContact OE1-CE 3.21Å; E406-K410 IonicContact OE1-NZ 2.6Å; E406-K410 PolarHBondContact OE1-NZ 2.76Å; R407-K410 PolarHBondContact O-N 3.04Å; Q408-K410 PolarHBondContact O-N 2.93Å; K410-Q413 PolarHBondContact O-N 2.92Å; K410-Q414 PolarHBondContact O-N 2.95Å
411	L	90.5	Very high	92.6	Very high	71 Å²	71	77.8 Å²	77.8	37%	0.372	39%	0.391	S	S	.	.	H	α-helix	trans	-69.4	-38.4	177.9	-68.8	170.6	0	0	0	112.3	R407 Q408 Q413 Q414 Q415 P467	R407-L411 WeakPolarHBondContact O-CG 3.28Å; R407-L411 PolarHBondContact O-N 3.26Å; Q408-L411 PolarHBondContact O-N 3.24Å; L411-Q413 VanDerWaalsContact C-N 3.34Å; L411-Q414 PolarHBondContact O-N 3.08Å; L411-Q415 VanDerWaalsContact O-CB 3.31Å; L411-Q415 WeakPolarHBondContact O-CB 3.41Å; L411-Q415 PolarHBondContact O-N 2.94Å; L411-P467 HydrophobicContact CD2-CB 3.96Å
412	L	92.1	Very high	92.5	Very high	95 Å²	95	77.3 Å²	77.3	50%	0.497	40%	0.397	S	S	.	.	H	α-helix	trans	-63.2	-39.3	173.1	-75.7	169.8	0	0	0	111.9	Q408 M409 Q415 N416	Q408-L412 HydrophobicContact CG-CD1 3.99Å; Q408-L412 HydrophobicContact CG-CG 4.42Å; Q408-L412 WeakPolarHBondContact O-CB 3.44Å; Q408-L412 VanDerWaalsContact O-CG 3.31Å; Q408-L412 WeakPolarHBondContact O-CG 3.17Å; Q408-L412 PolarHBondContact O-N 3.48Å; M409-L412 PolarHBondContact O-N 3.12Å; L412-Q415 PolarHBondContact O-N 2.83Å; L412-N416 WeakPolarHBondContact O-CB 3.34Å; L412-N416 VanDerWaalsContact O-CG 3.26Å; L412-N416 PolarHBondContact O-N 3.22Å; L412-N416 PolarHBondContact O-ND2 3Å
413	Q	91.5	Very high	92.6	Very high	99 Å²	99	81 Å²	81	46%	0.463	41%	0.405	S	S	.	.	H	α-helix	trans	-63.2	-50.7	174.1	-176.8	56.4	46.6	0	0	111.3	M409 K410 L411 Q415 N416 D417	M409-Q413 PolarHBondContact O-N 3.44Å; K410-Q413 PolarHBondContact O-N 2.92Å; L411-Q413 VanDerWaalsContact C-N 3.34Å; Q413-Q415 VanDerWaalsContact C-N 3.29Å; Q413-Q415 PolarHBondContact O-N 3.02Å; Q413-N416 WeakPolarHBondContact O-CB 3.36Å; Q413-N416 PolarHBondContact O-N 3.47Å; Q413-N416 VanDerWaalsContact O-N 3.09Å; Q413-D417 PolarHBondContact NE2-OD1 3.08Å; Q413-D417 PolarHBondContact NE2-OD2 3.33Å; Q413-D417 PolarHBondContact O-N 3.37Å
414	Q	90.4	Very high	92.7	Very high	35 Å²	35	83 Å²	83	16%	0.164	41%	0.411	C	S	.	.	H	α-helix	trans	-58.2	-41.3	176.8	-173.2	173.9	7.6	0	0	111.8	K410 L411 D417 I418 D464 V466	K410-Q414 PolarHBondContact O-N 2.95Å; L411-Q414 PolarHBondContact O-N 3.08Å; Q414-D417 PolarHBondContact O-N 2.88Å; Q414-I418 HydrophobicContact CG-CD1 3.85Å; Q414-I418 WeakPolarHBondContact O-CB 3.19Å; Q414-I418 VanDerWaalsContact O-CG1 3.26Å; Q414-I418 WeakPolarHBondContact O-CG1 3.16Å; Q414-I418 PolarHBondContact O-N 2.78Å; Q414-D464 PolarHBondContact NE2-O 3.24Å; Q414-V466 PolarHBondContact NE2-O 2.98Å
415	Q	92	Very high	92.9	Very high	110 Å²	110	82.9 Å²	82.9	51%	0.514	41%	0.409	S	S	.	.	H	α-helix	trans	-62.3	-42.1	174.8	179.8	60.2	25.8	0	0	112.3	L411 L412 Q413 T419	L411-Q415 VanDerWaalsContact O-CB 3.31Å; L411-Q415 WeakPolarHBondContact O-CB 3.41Å; L411-Q415 PolarHBondContact O-N 2.94Å; L412-Q415 PolarHBondContact O-N 2.83Å; Q413-Q415 VanDerWaalsContact C-N 3.29Å; Q413-Q415 PolarHBondContact O-N 3.02Å; Q415-T419 PolarHBondContact NE2-OG1 2.94Å; Q415-T419 VanDerWaalsContact NE2-OG1 3.14Å; Q415-T419 WeakPolarHBondContact O-CB 3.47Å; Q415-T419 PolarHBondContact O-N 3.1Å; Q415-T419 PolarHBondContact O-OG1 3.49Å
416	N	93.5	Very high	93.1	Very high	94 Å²	94	84.3 Å²	84.3	50%	0.503	42%	0.416	S	S	.	.	H	α-helix	trans	-63.6	-43.6	176.7	-77.4	-32.2	0	0	0	111.8	L412 Q413 T419 G420	L412-N416 WeakPolarHBondContact O-CB 3.34Å; L412-N416 VanDerWaalsContact O-CG 3.26Å; L412-N416 PolarHBondContact O-N 3.22Å; L412-N416 PolarHBondContact O-ND2 3Å; Q413-N416 WeakPolarHBondContact O-CB 3.36Å; Q413-N416 PolarHBondContact O-N 3.47Å; Q413-N416 VanDerWaalsContact O-N 3.09Å; N416-T419 PolarHBondContact O-N 3Å; N416-G420 PolarHBondContact O-N 2.76Å
417	D	91.9	Very high	93.3	Very high	93 Å²	93	85.9 Å²	85.9	50%	0.497	42%	0.423	S	S	.	.	H	α-helix	trans	-67.1	-46.6	-179.4	-67.2	-37.2	0	0	0	111.7	Q413 Q414 T419 G420 L421	Q413-D417 PolarHBondContact NE2-OD1 3.08Å; Q413-D417 PolarHBondContact NE2-OD2 3.33Å; Q413-D417 PolarHBondContact O-N 3.37Å; Q414-D417 PolarHBondContact O-N 2.88Å; D417-T419 VanDerWaalsContact C-N 3.34Å; D417-T419 PolarHBondContact O-N 3.17Å; D417-G420 PolarHBondContact O-N 2.61Å; D417-L421 PolarHBondContact O-N 3.46Å
418	I	92.7	Very high	93.6	Very high	54 Å²	54	83.8 Å²	83.8	28%	0.277	42%	0.417	S	S	.	.	H	α-helix	trans	-60.8	-43.5	174.3	-66.8	171.2	0	0	0	110.7	Q414 G420 L421 S422	Q414-I418 HydrophobicContact CG-CD1 3.85Å; Q414-I418 WeakPolarHBondContact O-CB 3.19Å; Q414-I418 VanDerWaalsContact O-CG1 3.26Å; Q414-I418 WeakPolarHBondContact O-CG1 3.16Å; Q414-I418 PolarHBondContact O-N 2.78Å; I418-G420 VanDerWaalsContact C-N 3.31Å; I418-G420 PolarHBondContact O-N 3.32Å; I418-L421 PolarHBondContact O-N 2.82Å; I418-S422 WeakPolarHBondContact O-CB 3.37Å; I418-S422 PolarHBondContact O-N 3.43Å
419	T	94.2	Very high	93.8	Very high	50 Å²	50	83 Å²	83	31%	0.307	41%	0.414	S	S	.	.	H	α-helix	trans	-68.4	-30.3	177.7	-56.7	0	0	0	0	111.9	Q415 N416 D417 R423	Q415-T419 PolarHBondContact NE2-OG1 2.94Å; Q415-T419 VanDerWaalsContact NE2-OG1 3.14Å; Q415-T419 WeakPolarHBondContact O-CB 3.47Å; Q415-T419 PolarHBondContact O-N 3.1Å; Q415-T419 PolarHBondContact O-OG1 3.49Å; N416-T419 PolarHBondContact O-N 3Å; D417-T419 VanDerWaalsContact C-N 3.34Å; D417-T419 PolarHBondContact O-N 3.17Å; T419-R423 WeakPolarHBondContact O-CG 3.32Å; T419-R423 PolarHBondContact O-N 3.1Å; T419-R423 PolarHBondContact O-NE 2.05Å
420	G	94.1	Very high	94	Very high	20 Å²	20	81.3 Å²	81.3	21%	0.206	41%	0.408	C	S	.	.	H	α-helix	trans	-65.6	-54.3	171.4	0	0	0	0	0	111.9	N416 D417 I418 S422 R423 Q424	N416-G420 PolarHBondContact O-N 2.76Å; D417-G420 PolarHBondContact O-N 2.61Å; I418-G420 VanDerWaalsContact C-N 3.31Å; I418-G420 PolarHBondContact O-N 3.32Å; G420-S422 PolarHBondContact O-N 2.55Å; G420-R423 PolarHBondContact O-N 2.84Å; G420-Q424 PolarHBondContact O-N 2.81Å
421	L	94.4	Very high	94.3	Very high	27 Å²	27	81 Å²	81	14%	0.141	41%	0.406	C	S	.	.	H	α-helix	trans	-63.4	-42.4	180	-179.4	56.8	0	0	0	112.2	D417 I418 R423 Q424 V425 A461 C463	D417-L421 PolarHBondContact O-N 3.46Å; I418-L421 PolarHBondContact O-N 2.82Å; L421-R423 VanDerWaalsContact C-N 3.3Å; L421-R423 PolarHBondContact O-N 3.09Å; L421-Q424 WeakPolarHBondContact O-CB 3.41Å; L421-Q424 PolarHBondContact O-N 3Å; L421-V425 HydrophobicContact CD1-CG2 4.23Å; L421-V425 HydrophobicContact CG-CG2 4.35Å; L421-V425 WeakPolarHBondContact O-CG2 3.44Å; L421-V425 PolarHBondContact O-N 3.09Å; L421-A461 HydrophobicContact CD1-CB 3.68Å; L421-A461 HydrophobicContact CD2-CB 4.12Å; L421-C463 HydrophobicContact CD2-CB 3.75Å
422	S	95.3	Very high	94.5	Very high	74 Å²	74	78.2 Å²	78.2	52%	0.517	39%	0.392	S	S	.	.	H	α-helix	trans	-56.6	-41.6	175.8	178.8	0	0	0	0	112.6	I418 G420 V425 K426	I418-S422 WeakPolarHBondContact O-CB 3.37Å; I418-S422 PolarHBondContact O-N 3.43Å; G420-S422 PolarHBondContact O-N 2.55Å; S422-V425 PolarHBondContact O-N 3.34Å; S422-K426 WeakPolarHBondContact O-CB 3.37Å; S422-K426 PolarHBondContact O-N 3.1Å
423	R	96.6	Very high	94.7	Very high	163 Å²	163	78.1 Å²	78.1	62%	0.615	39%	0.392	S	S	*	.	H	α-helix	trans	-63.5	-40.8	173.4	-76.9	176.8	-74	177.8	-3.8	112.4	T419 G420 L421 H427	T419-R423 WeakPolarHBondContact O-CG 3.32Å; T419-R423 PolarHBondContact O-N 3.1Å; T419-R423 PolarHBondContact O-NE 2.05Å; G420-R423 PolarHBondContact O-N 2.84Å; L421-R423 VanDerWaalsContact C-N 3.3Å; L421-R423 PolarHBondContact O-N 3.09Å; R423-H427 WeakPolarHBondContact O-CB 3.4Å; R423-H427 PolarHBondContact O-N 2.88Å
424	Q	95.6	Very high	94.9	Very high	97 Å²	97	81.3 Å²	81.3	45%	0.453	40%	0.401	S	S	.	.	H	α-helix	trans	-65.8	-45.8	176.5	-64.9	177.1	22.9	0	0	112.2	G420 L421 K426 H427 V428 I458	G420-Q424 PolarHBondContact O-N 2.81Å; L421-Q424 WeakPolarHBondContact O-CB 3.41Å; L421-Q424 PolarHBondContact O-N 3Å; Q424-K426 PolarHBondContact O-N 3.21Å; Q424-H427 PolarHBondContact O-N 3.21Å; Q424-V428 PolarHBondContact O-N 3.4Å; Q424-I458 HydrophobicContact CB-CD1 4.09Å
425	V	95.9	Very high	95.1	Very high	63 Å²	63	80 Å²	80	38%	0.382	40%	0.396	S	S	.	.	H	α-helix	trans	-55.2	-51.6	175.3	172	0	0	0	0	110.2	L421 S422 H427 V428 M429 I458	L421-V425 HydrophobicContact CD1-CG2 4.23Å; L421-V425 HydrophobicContact CG-CG2 4.35Å; L421-V425 WeakPolarHBondContact O-CG2 3.44Å; L421-V425 PolarHBondContact O-N 3.09Å; S422-V425 PolarHBondContact O-N 3.34Å; V425-H427 PolarHBondContact O-N 3.08Å; V425-V428 PolarHBondContact O-N 3.19Å; V425-M429 WeakPolarHBondContact O-CB 3.36Å; V425-M429 PolarHBondContact O-N 3.03Å; V425-I458 HydrophobicContact CB-CG2 4.5Å; V425-I458 HydrophobicContact CG2-CG2 3.58Å
426	K	97	Very high	95.2	Very high	136 Å²	136	80.1 Å²	80.1	59%	0.591	40%	0.399	S	S	*	.	H	α-helix	trans	-62.4	-41.6	179.8	-169.9	170.7	-176.6	173.7	0	112.3	S422 Q424 N430	S422-K426 WeakPolarHBondContact O-CB 3.37Å; S422-K426 PolarHBondContact O-N 3.1Å; Q424-K426 PolarHBondContact O-N 3.21Å; K426-N430 VanDerWaalsContact O-CB 3.3Å; K426-N430 WeakPolarHBondContact O-CB 3.43Å; K426-N430 PolarHBondContact O-N 3.13Å; K426-N430 PolarHBondContact O-OD1 3.41Å
427	H	96.7	Very high	95.3	Very high	126 Å²	126	79.8 Å²	79.8	58%	0.583	41%	0.409	S	S	*	.	H	α-helix	trans	-62.2	-52.6	176.6	171.5	71.8	0	0	0	112.3	R423 Q424 V425 N430 F431	R423-H427 WeakPolarHBondContact O-CB 3.4Å; R423-H427 PolarHBondContact O-N 2.88Å; Q424-H427 PolarHBondContact O-N 3.21Å; V425-H427 PolarHBondContact O-N 3.08Å; H427-N430 PolarHBondContact O-N 3.32Å; H427-F431 WeakPolarHBondContact O-CB 3.44Å; H427-F431 PolarHBondContact O-N 2.86Å
428	V	96.6	Very high	95.3	Very high	17 Å²	17	77.8 Å²	77.8	10%	0.103	40%	0.402	C	S	.	.	H	α-helix	trans	-69.4	-35.7	-176.9	173.3	0	0	0	0	111.6	Q424 V425 T432 Q454 L455 I458	Q424-V428 PolarHBondContact O-N 3.4Å; V425-V428 PolarHBondContact O-N 3.19Å; V428-T432 WeakPolarHBondContact O-CB 3.4Å; V428-T432 PolarHBondContact O-N 3.46Å; V428-T432 PolarHBondContact O-OG1 3.45Å; V428-Q454 HydrophobicContact CG1-CB 4.22Å; V428-Q454 HydrophobicContact CG2-CB 4.3Å; V428-L455 HydrophobicContact CG1-CD2 3.88Å; V428-L455 HydrophobicContact CG1-CG 4.29Å; V428-I458 HydrophobicContact CB-CD1 3.68Å; V428-I458 HydrophobicContact CG1-CD1 4.2Å; V428-I458 HydrophobicContact CG2-CD1 3.47Å; V428-I458 VanDerWaalsContact CG2-CD1 3.47Å
429	M	95.9	Very high	95	Very high	96 Å²	96	78.3 Å²	78.3	47%	0.473	42%	0.42	S	S	.	.	H	α-helix	trans	-61.3	-50	172.5	-177.2	176.8	68.9	0	0	111.2	V425 F431 T432 N433	V425-M429 WeakPolarHBondContact O-CB 3.36Å; V425-M429 PolarHBondContact O-N 3.03Å; M429-F431 PolarHBondContact O-N 3.36Å; M429-T432 PolarHBondContact O-N 3.17Å; M429-N433 WeakPolarHBondContact O-CB 3.33Å; M429-N433 VanDerWaalsContact O-CG 3.23Å; M429-N433 PolarHBondContact O-N 2.98Å; M429-N433 PolarHBondContact O-ND2 2.91Å
430	N	96.8	Very high	94.9	Very high	89 Å²	89	78.5 Å²	78.5	48%	0.476	42%	0.424	S	S	.	.	H	α-helix	trans	-60.2	-46.8	178.4	-73.2	3.4	0	0	0	111.9	K426 H427 W434	K426-N430 VanDerWaalsContact O-CB 3.3Å; K426-N430 WeakPolarHBondContact O-CB 3.43Å; K426-N430 PolarHBondContact O-N 3.13Å; K426-N430 PolarHBondContact O-OD1 3.41Å; H427-N430 PolarHBondContact O-N 3.32Å; N430-W434 WeakPolarHBondContact O-CB 3.32Å; N430-W434 PolarHBondContact O-N 3.44Å
431	F	96.6	Very high	94.8	Very high	91 Å²	91	81.5 Å²	81.5	40%	0.399	44%	0.442	S	S	.	.	H	α-helix	trans	-65.2	-39.8	178.7	-174.6	-92.2	0	0	0	112.4	H427 M429 W434 A435 I451	H427-F431 WeakPolarHBondContact O-CB 3.44Å; H427-F431 PolarHBondContact O-N 2.86Å; M429-F431 PolarHBondContact O-N 3.36Å; F431-W434 HydrophobicContact CD2-CE3 4.17Å; F431-W434 HydrophobicContact CD2-CZ3 4.42Å; F431-W434 AromaticContact CE2-CE3 3.98Å; F431-W434 HydrophobicContact CE2-CE3 3.98Å; F431-W434 AromaticContact CE2-CZ3 3.78Å; F431-W434 HydrophobicContact CE2-CZ3 3.78Å; F431-W434 HydrophobicContact CZ-CE3 4.42Å; F431-W434 HydrophobicContact CZ-CZ3 4.06Å; F431-W434 PolarHBondContact O-N 3.03Å; F431-A435 HydrophobicContact CE1-CB 4.47Å; F431-A435 VanDerWaalsContact O-CB 3.26Å; F431-A435 WeakPolarHBondContact O-CB 3.45Å; F431-A435 PolarHBondContact O-N 2.9Å; F431-I451 HydrophobicContact CD1-CG1 4.49Å; F431-I451 HydrophobicContact CE1-CD1 4.13Å; F431-I451 HydrophobicContact CE1-CG1 4.04Å
432	T	95.3	Very high	94.7	Very high	13 Å²	13	84.8 Å²	84.8	8%	0.08	46%	0.463	C	S	.	.	H	α-helix	trans	-66.3	-45.8	178.3	-59.6	0	0	0	0	111.1	V428 M429 W434 A435 I436 I451 L455	V428-T432 WeakPolarHBondContact O-CB 3.4Å; V428-T432 PolarHBondContact O-N 3.46Å; V428-T432 PolarHBondContact O-OG1 3.45Å; M429-T432 PolarHBondContact O-N 3.17Å; T432-W434 PolarHBondContact O-N 2.9Å; T432-A435 PolarHBondContact O-N 3.37Å; T432-I436 HydrophobicContact CG2-CD1 3.83Å; T432-I436 VanDerWaalsContact O-CG1 3.3Å; T432-I436 WeakPolarHBondContact O-CG1 3.42Å; T432-I436 PolarHBondContact O-N 3.26Å; T432-I451 HydrophobicContact CG2-CG2 4.17Å; T432-L455 HydrophobicContact CG2-CD1 4.01Å; T432-L455 HydrophobicContact CG2-CD2 4.37Å
433	N	95.7	Very high	94.7	Very high	93 Å²	93	83.5 Å²	83.5	50%	0.497	46%	0.457	S	S	.	.	H	α-helix	trans	-60.9	-45.3	176.7	-70.8	-11.8	0	0	0	111.2	M429 I436 A437	M429-N433 WeakPolarHBondContact O-CB 3.33Å; M429-N433 VanDerWaalsContact O-CG 3.23Å; M429-N433 PolarHBondContact O-N 2.98Å; M429-N433 PolarHBondContact O-ND2 2.91Å; N433-I436 PolarHBondContact O-N 2.94Å; N433-A437 VanDerWaalsContact O-CB 3.3Å; N433-A437 WeakPolarHBondContact O-CB 3.21Å; N433-A437 PolarHBondContact O-N 3.38Å
434	W	95.6	Very high	94.6	Very high	167 Å²	167	78.7 Å²	78.7	63%	0.633	44%	0.443	S	S	*	.	H	α-helix	trans	-61	-46.7	174.5	171.4	81.6	0	0	0	112.4	N430 F431 T432 I436 A437 S438	N430-W434 WeakPolarHBondContact O-CB 3.32Å; N430-W434 PolarHBondContact O-N 3.44Å; F431-W434 HydrophobicContact CD2-CE3 4.17Å; F431-W434 HydrophobicContact CD2-CZ3 4.42Å; F431-W434 AromaticContact CE2-CE3 3.98Å; F431-W434 HydrophobicContact CE2-CE3 3.98Å; F431-W434 AromaticContact CE2-CZ3 3.78Å; F431-W434 HydrophobicContact CE2-CZ3 3.78Å; F431-W434 HydrophobicContact CZ-CE3 4.42Å; F431-W434 HydrophobicContact CZ-CZ3 4.06Å; F431-W434 PolarHBondContact O-N 3.03Å; T432-W434 PolarHBondContact O-N 2.9Å; W434-I436 VanDerWaalsContact C-N 3.32Å; W434-I436 PolarHBondContact O-N 3.43Å; W434-A437 PolarHBondContact O-N 2.89Å; W434-S438 WeakPolarHBondContact O-CB 3.38Å; W434-S438 PolarHBondContact O-N 2.97Å
435	A	94.5	Very high	94.4	Very high	7 Å²	7	79.8 Å²	79.8	6%	0.058	45%	0.451	C	S	.	.	H	α-helix	trans	-62.5	-39.2	-179	0	0	0	0	0	112.1	F431 T432 S438 L444 I451	F431-A435 HydrophobicContact CE1-CB 4.47Å; F431-A435 VanDerWaalsContact O-CB 3.26Å; F431-A435 WeakPolarHBondContact O-CB 3.45Å; F431-A435 PolarHBondContact O-N 2.9Å; T432-A435 PolarHBondContact O-N 3.37Å; A435-S438 PolarHBondContact O-OG 2.84Å; A435-L444 HydrophobicContact CB-CD1 4.3Å; A435-I451 HydrophobicContact CB-CD1 3.98Å
436	I	94.6	Very high	94.3	Very high	113 Å²	113	86.3 Å²	86.3	58%	0.579	47%	0.471	S	S	*	.	H	α-helix	trans	-67.9	-43.6	174.7	-67.4	168.4	0	0	0	111	T432 N433 W434 S438	T432-I436 HydrophobicContact CG2-CD1 3.83Å; T432-I436 VanDerWaalsContact O-CG1 3.3Å; T432-I436 WeakPolarHBondContact O-CG1 3.42Å; T432-I436 PolarHBondContact O-N 3.26Å; N433-I436 PolarHBondContact O-N 2.94Å; W434-I436 VanDerWaalsContact C-N 3.32Å; W434-I436 PolarHBondContact O-N 3.43Å; I436-S438 VanDerWaalsContact C-N 3.29Å; I436-S438 PolarHBondContact O-N 3.3Å
437	A	94.8	Very high	94.2	Very high	86 Å²	86	81.9 Å²	81.9	71%	0.711	46%	0.457	S	S	*	.	H	α-helix	trans	-72.7	-17.2	179.7	0	0	0	0	0	114.3	N433 W434 G439	N433-A437 VanDerWaalsContact O-CB 3.3Å; N433-A437 WeakPolarHBondContact O-CB 3.21Å; N433-A437 PolarHBondContact O-N 3.38Å; W434-A437 PolarHBondContact O-N 2.89Å; A437-G439 PolarHBondContact O-N 3.27Å; A437-G439 VanDerWaalsContact O-N 3.12Å
438	S	92.5	Very high	94.1	Very high	52 Å²	52	82 Å²	82	36%	0.364	46%	0.455	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-13.5	-172.8	72.6	0	0	0	0	116.1	W434 A435 I436 S440	W434-S438 WeakPolarHBondContact O-CB 3.38Å; W434-S438 PolarHBondContact O-N 2.97Å; A435-S438 PolarHBondContact O-OG 2.84Å; I436-S438 VanDerWaalsContact C-N 3.29Å; I436-S438 PolarHBondContact O-N 3.3Å; S438-S440 PolarHBondContact O-N 2.86Å; S438-S440 PolarHBondContact OG-N 3.07Å
439	G	86.7	Confident	94.1	Very high	64 Å²	64	91.2 Å²	91.2	66%	0.66	49%	0.488	S	S	*	.			trans	70.1	-13.5	-176	0	0	0	0	0	115.8	A437 S441	A437-G439 PolarHBondContact O-N 3.27Å; A437-G439 VanDerWaalsContact O-N 3.12Å; G439-S441 PolarHBondContact O-N 2.88Å
440	S	92.7	Very high	94.1	Very high	55 Å²	55	92.2 Å²	92.2	39%	0.385	50%	0.495	S	S	.	.			trans	-81	86.3	-176	-172.8	0	0	0	0	112.2	S438 T442 A443 L444	S438-S440 PolarHBondContact O-N 2.86Å; S438-S440 PolarHBondContact OG-N 3.07Å; S440-T442 PolarHBondContact O-N 3Å; S440-A443 PolarHBondContact O-N 3.26Å; S440-A443 WeakPolarHBondContact OG-CB 3.35Å; S440-A443 PolarHBondContact OG-N 3.16Å; S440-L444 WeakPolarHBondContact O-CB 3.25Å; S440-L444 PolarHBondContact O-N 3.26Å
441	S	91.9	Very high	94.1	Very high	83 Å²	83	88.8 Å²	88.8	58%	0.58	48%	0.477	S	S	*	.	H	α-helix	trans	-53.9	-40.6	179.4	-43.9	0	0	0	0	112.4	G439 L445	G439-S441 PolarHBondContact O-N 2.88Å; S441-L445 WeakPolarHBondContact O-CB 3.45Å; S441-L445 VanDerWaalsContact O-CG 3.24Å; S441-L445 WeakPolarHBondContact O-CG 3.38Å; S441-L445 PolarHBondContact O-N 3.1Å
442	T	92.5	Very high	94	Very high	95 Å²	95	86.6 Å²	86.6	58%	0.583	47%	0.471	S	S	*	.	H	α-helix	trans	-64.1	-49.7	179	-52.6	0	0	0	0	111.8	S440 L444 L445 Y446	S440-T442 PolarHBondContact O-N 3Å; T442-L444 VanDerWaalsContact C-N 3.33Å; T442-L444 PolarHBondContact O-N 3.44Å; T442-L445 PolarHBondContact O-N 3.25Å; T442-Y446 HydrophobicContact CG2-CD2 3.92Å; T442-Y446 HydrophobicContact CG2-CE2 3.92Å; T442-Y446 WeakPolarHBondContact O-CD2 3.46Å; T442-Y446 PolarHBondContact O-N 2.77Å
443	A	93.5	Very high	94.1	Very high	47 Å²	47	92 Å²	92	39%	0.388	49%	0.494	S	S	.	.	H	α-helix	trans	-65	-38.4	179.8	0	0	0	0	0	111.9	S440 S447	S440-A443 PolarHBondContact O-N 3.26Å; S440-A443 WeakPolarHBondContact OG-CB 3.35Å; S440-A443 PolarHBondContact OG-N 3.16Å; A443-S447 WeakPolarHBondContact O-CB 3.44Å; A443-S447 PolarHBondContact O-N 3.29Å; A443-S447 PolarHBondContact O-OG 2.85Å
444	L	94.2	Very high	94.1	Very high	63 Å²	63	91.5 Å²	91.5	33%	0.33	49%	0.488	S	S	.	.	H	α-helix	trans	-64.4	-41.2	175.2	-176.7	62.2	0	0	0	111.8	A435 S440 T442 S447 K448 I451	A435-L444 HydrophobicContact CB-CD1 4.3Å; S440-L444 WeakPolarHBondContact O-CB 3.25Å; S440-L444 PolarHBondContact O-N 3.26Å; T442-L444 VanDerWaalsContact C-N 3.33Å; T442-L444 PolarHBondContact O-N 3.44Å; L444-S447 PolarHBondContact O-N 3.36Å; L444-K448 WeakPolarHBondContact O-CA 3.37Å; L444-K448 WeakPolarHBondContact O-CB 3.32Å; L444-K448 PolarHBondContact O-N 2.83Å; L444-I451 HydrophobicContact CD1-CD1 4.07Å
445	L	92.8	Very high	94.1	Very high	119 Å²	119	86.5 Å²	86.5	62%	0.623	47%	0.473	S	S	*	.	H	α-helix	trans	-67.9	-43.5	177.9	-75.4	171.2	0	0	0	112.7	S441 T442 S447 K448	S441-L445 WeakPolarHBondContact O-CB 3.45Å; S441-L445 VanDerWaalsContact O-CG 3.24Å; S441-L445 WeakPolarHBondContact O-CG 3.38Å; S441-L445 PolarHBondContact O-N 3.1Å; T442-L445 PolarHBondContact O-N 3.25Å; L445-S447 VanDerWaalsContact C-N 3.35Å; L445-K448 VanDerWaalsContact O-CB 3.28Å; L445-K448 WeakPolarHBondContact O-CB 3.45Å; L445-K448 PolarHBondContact O-N 3.45Å
446	Y	94	Very high	94.2	Very high	201 Å²	201	94.1 Å²	94.1	79%	0.788	50%	0.501	S	S	*	.	H	α-helix	trans	-60.5	-43.5	171.8	-89	-77.5	0	0	0	111.7	T442 K448	T442-Y446 HydrophobicContact CG2-CD2 3.92Å; T442-Y446 HydrophobicContact CG2-CE2 3.92Å; T442-Y446 WeakPolarHBondContact O-CD2 3.46Å; T442-Y446 PolarHBondContact O-N 2.77Å; Y446-K448 VanDerWaalsContact C-N 3.33Å; Y446-K448 PolarHBondContact O-N 2.83Å
447	S	95	Very high	94.2	Very high	43 Å²	43	93.4 Å²	93.4	30%	0.301	50%	0.495	S	S	.	.	H	α-helix	trans	-78	-15.3	-177.6	-54.1	0	0	0	0	114	A443 L444 L445 R449 L450 I451	A443-S447 WeakPolarHBondContact O-CB 3.44Å; A443-S447 PolarHBondContact O-N 3.29Å; A443-S447 PolarHBondContact O-OG 2.85Å; L444-S447 PolarHBondContact O-N 3.36Å; L445-S447 VanDerWaalsContact C-N 3.35Å; S447-R449 VanDerWaalsContact C-N 3.25Å; S447-R449 PolarHBondContact O-N 3.27Å; S447-R449 VanDerWaalsContact O-N 3.07Å; S447-L450 PolarHBondContact O-N 3.36Å; S447-I451 PolarHBondContact O-N 3Å
448	K	94.8	Very high	94.2	Very high	127 Å²	127	90.6 Å²	90.6	55%	0.552	47%	0.467	S	S	*	.	H	α-helix	trans	-46.1	-44.9	-173	179.3	179	176.3	178.2	0	113.2	L444 L445 Y446 L450 T452	L444-K448 WeakPolarHBondContact O-CA 3.37Å; L444-K448 WeakPolarHBondContact O-CB 3.32Å; L444-K448 PolarHBondContact O-N 2.83Å; L445-K448 VanDerWaalsContact O-CB 3.28Å; L445-K448 WeakPolarHBondContact O-CB 3.45Å; L445-K448 PolarHBondContact O-N 3.45Å; Y446-K448 VanDerWaalsContact C-N 3.33Å; Y446-K448 PolarHBondContact O-N 2.83Å; K448-L450 PolarHBondContact O-N 3.4Å; K448-T452 WeakPolarHBondContact O-CB 3.17Å; K448-T452 PolarHBondContact O-N 2.91Å; K448-T452 PolarHBondContact O-OG1 2.89Å
449	R	95.6	Very high	94.3	Very high	211 Å²	211	95.1 Å²	95.1	80%	0.796	49%	0.487	S	S	*	.	H	α-helix	trans	-63.2	-41	-177.9	-165	177.4	78.6	160.9	3.1	111.9	S447 F453	S447-R449 VanDerWaalsContact C-N 3.25Å; S447-R449 PolarHBondContact O-N 3.27Å; S447-R449 VanDerWaalsContact O-N 3.07Å; R449-F453 WeakPolarHBondContact O-CB 3.27Å; R449-F453 PolarHBondContact O-N 2.95Å
450	L	96.7	Very high	94.7	Very high	117 Å²	117	100.2 Å²	100.2	61%	0.613	49%	0.491	S	S	*	.	H	α-helix	trans	-75.3	-46	-179.1	-64.3	174.9	0	0	0	111.7	S447 K448 T452 F453 Q454	S447-L450 PolarHBondContact O-N 3.36Å; K448-L450 PolarHBondContact O-N 3.4Å; L450-T452 PolarHBondContact O-N 3.41Å; L450-F453 WeakPolarHBondContact O-CB 3.46Å; L450-F453 PolarHBondContact O-N 3.18Å; L450-Q454 WeakPolarHBondContact O-CG 3.31Å; L450-Q454 PolarHBondContact O-N 3.5Å
451	I	96.2	Very high	94.7	Very high	18 Å²	18	99.7 Å²	99.7	9%	0.092	49%	0.489	C	S	.	.	H	α-helix	trans	-60.9	-48.4	177.8	-62.1	169.5	0	0	0	110	F431 T432 A435 L444 S447 F453 Q454 L455	F431-I451 HydrophobicContact CD1-CG1 4.49Å; F431-I451 HydrophobicContact CE1-CD1 4.13Å; F431-I451 HydrophobicContact CE1-CG1 4.04Å; T432-I451 HydrophobicContact CG2-CG2 4.17Å; A435-I451 HydrophobicContact CB-CD1 3.98Å; L444-I451 HydrophobicContact CD1-CD1 4.07Å; S447-I451 PolarHBondContact O-N 3Å; I451-F453 VanDerWaalsContact C-N 3.29Å; I451-F453 PolarHBondContact O-N 3Å; I451-Q454 PolarHBondContact O-N 3.43Å; I451-L455 HydrophobicContact CG2-CD1 3.85Å; I451-L455 HydrophobicContact CG2-CG 4.43Å; I451-L455 WeakPolarHBondContact O-CG 3.48Å; I451-L455 PolarHBondContact O-N 2.6Å
452	T	95.2	Very high	94.5	Very high	44 Å²	44	106.3 Å²	106.3	27%	0.27	50%	0.502	S	S	.	.	H	α-helix	trans	-64.1	-34.4	178.4	-52.4	0	0	0	0	111.9	K448 L450 R456	K448-T452 WeakPolarHBondContact O-CB 3.17Å; K448-T452 PolarHBondContact O-N 2.91Å; K448-T452 PolarHBondContact O-OG1 2.89Å; L450-T452 PolarHBondContact O-N 3.41Å; T452-R456 VanDerWaalsContact O-CB 3.32Å; T452-R456 WeakPolarHBondContact O-CB 3.41Å; T452-R456 WeakPolarHBondContact O-CD 3.49Å; T452-R456 WeakPolarHBondContact O-CG 3.48Å; T452-R456 PolarHBondContact O-N 3.49Å; T452-R456 VanDerWaalsContact O-N 3.13Å
453	F	95.9	Very high	94.3	Very high	128 Å²	128	104.9 Å²	104.9	56%	0.561	50%	0.495	S	S	*	.	H	α-helix	trans	-65.1	-50.2	173.8	173.8	-90.9	0	0	0	111.4	R449 L450 I451 R456 H457	R449-F453 WeakPolarHBondContact O-CB 3.27Å; R449-F453 PolarHBondContact O-N 2.95Å; L450-F453 WeakPolarHBondContact O-CB 3.46Å; L450-F453 PolarHBondContact O-N 3.18Å; I451-F453 VanDerWaalsContact C-N 3.29Å; I451-F453 PolarHBondContact O-N 3Å; F453-R456 CarbonylContact O-C 3.38Å; F453-R456 PolarHBondContact O-N 2.95Å; F453-H457 WeakPolarHBondContact O-CB 3.39Å; F453-H457 PolarHBondContact O-N 3.43Å
454	Q	95.9	Very high	93.8	Very high	82 Å²	82	107.9 Å²	107.9	38%	0.383	51%	0.505	S	S	.	.	H	α-helix	trans	-65.3	-41.5	-178	-68.8	-65	4.6	0	0	112.6	V428 L450 I451 R456 H457 I458	V428-Q454 HydrophobicContact CG1-CB 4.22Å; V428-Q454 HydrophobicContact CG2-CB 4.3Å; L450-Q454 WeakPolarHBondContact O-CG 3.31Å; L450-Q454 PolarHBondContact O-N 3.5Å; I451-Q454 PolarHBondContact O-N 3.43Å; Q454-R456 PolarHBondContact O-N 3.13Å; Q454-H457 PolarHBondContact O-N 2.86Å; Q454-I458 PolarHBondContact O-N 2.85Å
455	L	96.2	Very high	93.2	Very high	62 Å²	62	110.1 Å²	110.1	33%	0.325	52%	0.523	S	S	.	.	H	α-helix	trans	-58.4	-47.5	172.6	-70.1	167.9	0	0	0	111.3	V428 T432 I451 H457 L459	V428-L455 HydrophobicContact CG1-CD2 3.88Å; V428-L455 HydrophobicContact CG1-CG 4.29Å; T432-L455 HydrophobicContact CG2-CD1 4.01Å; T432-L455 HydrophobicContact CG2-CD2 4.37Å; I451-L455 HydrophobicContact CG2-CD1 3.85Å; I451-L455 HydrophobicContact CG2-CG 4.43Å; I451-L455 WeakPolarHBondContact O-CG 3.48Å; I451-L455 PolarHBondContact O-N 2.6Å; L455-H457 VanDerWaalsContact C-N 3.28Å; L455-H457 PolarHBondContact O-N 2.75Å; L455-L459 VanDerWaalsContact O-CB 3.25Å; L455-L459 WeakPolarHBondContact O-CB 3.12Å; L455-L459 WeakPolarHBondContact O-CD1 3.45Å; L455-L459 WeakPolarHBondContact O-CG 3.28Å; L455-L459 PolarHBondContact O-N 2.89Å
456	R	96.2	Very high	92.8	Very high	167 Å²	167	109.5 Å²	109.5	63%	0.63	52%	0.524	S	S	*	.	H	α-helix	trans	-68.5	-22.6	176.9	-72.5	172.7	-179.5	173.6	1.7	113.9	T452 F453 Q454 K460	T452-R456 VanDerWaalsContact O-CB 3.32Å; T452-R456 WeakPolarHBondContact O-CB 3.41Å; T452-R456 WeakPolarHBondContact O-CD 3.49Å; T452-R456 WeakPolarHBondContact O-CG 3.48Å; T452-R456 PolarHBondContact O-N 3.49Å; T452-R456 VanDerWaalsContact O-N 3.13Å; F453-R456 CarbonylContact O-C 3.38Å; F453-R456 PolarHBondContact O-N 2.95Å; Q454-R456 PolarHBondContact O-N 3.13Å; R456-K460 WeakPolarHBondContact O-CD 3.47Å; R456-K460 VanDerWaalsContact O-CG 3.25Å; R456-K460 WeakPolarHBondContact O-CG 3.23Å
457	H	95.4	Very high	92.1	Very high	98 Å²	98	103.9 Å²	103.9	45%	0.454	51%	0.512	S	S	.	.	H	α-helix	trans	-76.3	-51.6	175.5	179.4	63.9	0	0	0	110.1	F453 Q454 L455 L459 K460 A461	F453-H457 WeakPolarHBondContact O-CB 3.39Å; F453-H457 PolarHBondContact O-N 3.43Å; Q454-H457 PolarHBondContact O-N 2.86Å; L455-H457 VanDerWaalsContact C-N 3.28Å; L455-H457 PolarHBondContact O-N 2.75Å; H457-L459 PolarHBondContact O-N 2.65Å; H457-K460 CarbonylContact O-C 3.57Å; H457-K460 WeakPolarHBondContact O-CA 3.18Å; H457-K460 PolarHBondContact O-N 3.26Å; H457-A461 PolarHBondContact O-N 2.88Å
458	I	95	Very high	91.1	Very high	26 Å²	26	103.9 Å²	103.9	13%	0.133	51%	0.514	C	S	.	.	H	α-helix	trans	-65.2	-40	178.4	-69.1	179	0	0	0	111.6	Q424 V425 V428 Q454 K460 A461	Q424-I458 HydrophobicContact CB-CD1 4.09Å; V425-I458 HydrophobicContact CB-CG2 4.5Å; V425-I458 HydrophobicContact CG2-CG2 3.58Å; V428-I458 HydrophobicContact CB-CD1 3.68Å; V428-I458 HydrophobicContact CG1-CD1 4.2Å; V428-I458 HydrophobicContact CG2-CD1 3.47Å; V428-I458 VanDerWaalsContact CG2-CD1 3.47Å; Q454-I458 PolarHBondContact O-N 2.85Å; I458-K460 PolarHBondContact O-N 3.41Å; I458-A461 WeakPolarHBondContact O-CB 3.41Å; I458-A461 PolarHBondContact O-N 3.2Å
459	L	94.3	Very high	89.5	Confident	147 Å²	147	102.5 Å²	102.5	77%	0.77	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-7.1	172.8	-71.5	169.2	0	0	0	114.2	L455 H457	L455-L459 VanDerWaalsContact O-CB 3.25Å; L455-L459 WeakPolarHBondContact O-CB 3.12Å; L455-L459 WeakPolarHBondContact O-CD1 3.45Å; L455-L459 WeakPolarHBondContact O-CG 3.28Å; L455-L459 PolarHBondContact O-N 2.89Å; H457-L459 PolarHBondContact O-N 2.65Å
460	K	94.6	Very high	88.1	Confident	172 Å²	172	95.2 Å²	95.2	75%	0.748	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.8	-7	172.9	-71.8	-179.8	178.6	-169.2	0	113.3	R456 H457 I458	R456-K460 WeakPolarHBondContact O-CD 3.47Å; R456-K460 VanDerWaalsContact O-CG 3.25Å; R456-K460 WeakPolarHBondContact O-CG 3.23Å; H457-K460 CarbonylContact O-C 3.57Å; H457-K460 WeakPolarHBondContact O-CA 3.18Å; H457-K460 PolarHBondContact O-N 3.26Å; I458-K460 PolarHBondContact O-N 3.41Å
461	A	92	Very high	87.3	Confident	43 Å²	43	92.1 Å²	92.1	36%	0.355	50%	0.5	S	S	.	.			trans	-68.6	133.2	175.7	0	0	0	0	0	109	L421 H457 I458	L421-A461 HydrophobicContact CD1-CB 3.68Å; L421-A461 HydrophobicContact CD2-CB 4.12Å; H457-A461 PolarHBondContact O-N 2.88Å; I458-A461 WeakPolarHBondContact O-CB 3.41Å; I458-A461 PolarHBondContact O-N 3.2Å
462	R	89	Confident	86.8	Confident	222 Å²	222	95.2 Å²	95.2	84%	0.838	53%	0.528	S	S	*	.			trans	-81.9	143.6	174.3	-67.8	-173.4	178.3	-171.3	-1.3	109.8
463	C	87.2	Confident	86.5	Confident	66 Å²	66	96.9 Å²	96.9	45%	0.446	54%	0.535	S	S	.	.			trans	-136.8	112.5	170.8	-170.7	0	0	0	0	105.7	L421 P465	L421-C463 HydrophobicContact CD2-CB 3.75Å; C463-P465 VanDerWaalsContact O-CD 3.27Å; C463-P465 WeakPolarHBondContact O-CD 3.44Å
464	D	84	Confident	86.3	Confident	110 Å²	110	99.8 Å²	99.8	59%	0.588	54%	0.542	S	S	*	.			trans	-91	105.9	178.8	-64.5	-51.1	0	0	0	108.3	Q414 V466	Q414-D464 PolarHBondContact NE2-O 3.24Å; D464-V466 VanDerWaalsContact C-N 3.32Å
465	P	81	Confident	86.3	Confident	110 Å²	110	103.3 Å²	103.3	71%	0.714	56%	0.556	S	S	*	*			trans	-81.9	-13.9	-170.4	34.8	-37.1	0	0	0	112.9	C463 P467	C463-P465 VanDerWaalsContact O-CD 3.27Å; C463-P465 WeakPolarHBondContact O-CD 3.44Å; P465-P467 WeakPolarHBondContact O-CD 2.88Å
466	V	84.2	Confident	86.1	Confident	106 Å²	106	107.7 Å²	107.7	64%	0.642	58%	0.575	S	S	*	*	S	Bend	trans	-82.8	119.9	177.1	-175.3	0	0	0	0	107.8	Q414 D464 A468	Q414-V466 PolarHBondContact NE2-O 2.98Å; D464-V466 VanDerWaalsContact C-N 3.32Å; V466-A468 PolarHBondContact O-N 3.23Å
467	P	80.2	Confident	85.9	Confident	82 Å²	82	103.1 Å²	103.1	53%	0.532	57%	0.568	S	S	.	*			trans	-55.7	139.8	172.8	-23.9	34.4	0	0	0	110.5	L411 P465 A469	L411-P467 HydrophobicContact CD2-CB 3.96Å; P465-P467 WeakPolarHBondContact O-CD 2.88Å; P467-A469 PolarHBondContact O-N 3.3Å
468	A	72.4	Confident	85.8	Confident	43 Å²	43	102.1 Å²	102.1	36%	0.355	57%	0.566	S	S	.	*			trans	-48.7	114.2	179	0	0	0	0	0	110.9	V466 N470	V466-A468 PolarHBondContact O-N 3.23Å; A468-N470 VanDerWaalsContact O-CG 3.24Å; A468-N470 PolarHBondContact O-N 3.05Å; A468-N470 PolarHBondContact O-ND2 2.88Å; A468-N470 VanDerWaalsContact O-ND2 3.1Å
469	A	61.6	Low	85.5	Confident	99 Å²	99	105.3 Å²	105.3	82%	0.818	59%	0.588	S	S	*	*			trans	-71.8	87.3	-160.7	0	0	0	0	0	112.7	P467 G471	P467-A469 PolarHBondContact O-N 3.3Å; A469-G471 PolarHBondContact O-N 3.36Å
470	N	67.8	Low	85.3	Confident	58 Å²	58	101.8 Å²	101.8	31%	0.31	57%	0.573	S	S	.	*			trans	-92.3	91.6	-175.4	-69.8	-44.1	0	0	0	110.7	R407 A468	R407-N470 HydrophobicContact CG-CB 4.17Å; R407-N470 PolarHBondContact NH1-O 2.89Å; A468-N470 VanDerWaalsContact O-CG 3.24Å; A468-N470 PolarHBondContact O-N 3.05Å; A468-N470 PolarHBondContact O-ND2 2.88Å; A468-N470 VanDerWaalsContact O-ND2 3.1Å
471	G	78.9	Confident	85.1	Confident	52 Å²	52	98.6 Å²	98.6	54%	0.536	56%	0.559	S	S	.	*	P	Polyproline II helix	trans	-51.8	149.9	-178	0	0	0	0	0	114.5	R407 A469	R407-G471 VanDerWaalsContact CZ-O 3.27Å; R407-G471 PolarHBondContact NH1-O 3.15Å; R407-G471 PolarHBondContact NH2-O 3.45Å; A469-G471 PolarHBondContact O-N 3.36Å
472	A	85.4	Confident	84.9	Confident	82 Å²	82	104.1 Å²	104.1	68%	0.678	57%	0.571	S	S	*	*	P	Polyproline II helix	trans	-53.2	136.8	-170.9	0	0	0	0	0	113.4
473	I	89.2	Confident	84.9	Confident	80 Å²	80	96.1 Å²	96.1	41%	0.41	55%	0.552	S	S	.	*	P	Polyproline II helix	trans	-87.6	131.8	170.6	-49.9	177.1	0	0	0	107.3	L400 V403	L400-I473 HydrophobicContact CD1-CD1 4.1Å; L400-I473 HydrophobicContact CD1-CG2 3.94Å; V403-I473 HydrophobicContact CG1-CD1 3.77Å
474	R	92.7	Very high	84.8	Confident	189 Å²	189	99.3 Å²	99.3	71%	0.713	56%	0.558	S	S	*	*			trans	-134.5	134.7	176.2	-65.1	-177.4	-179.9	136.4	-2.5	109.8	H476	R474-H476 WeakPolarHBondContact CB-NE2 3.4Å
475	F	94.6	Very high	84.9	Confident	155 Å²	155	98 Å²	98	68%	0.68	55%	0.551	S	S	*	*			trans	-89.4	129.4	165.3	176.1	-124.4	0	0	0	108.4	L396 C477	L396-F475 HydrophobicContact CD1-CE2 3.97Å; F475-C477 HydrophobicContact CE1-CB 3.8Å; F475-C477 HydrophobicContact CE2-CB 4.38Å; F475-C477 HydrophobicContact CZ-CB 3.68Å
476	H	93	Very high	85.3	Confident	155 Å²	155	97 Å²	97	72%	0.718	54%	0.543	S	S	*	.			trans	-120.6	122.1	176.4	-70.8	-79.5	0	0	0	108.9	R474	R474-H476 WeakPolarHBondContact CB-NE2 3.4Å
477	C	91.1	Very high	85.2	Confident	71 Å²	71	97.8 Å²	97.8	48%	0.48	55%	0.548	S	S	.	.			trans	-139.6	150.7	175.4	-170.2	0	0	0	0	108.3	F475 P479	F475-C477 HydrophobicContact CE1-CB 3.8Å; F475-C477 HydrophobicContact CE2-CB 4.38Å; F475-C477 HydrophobicContact CZ-CB 3.68Å; C477-P479 WeakPolarHBondContact O-CD 3.4Å
478	D	92.6	Very high	85.2	Confident	77 Å²	77	99.7 Å²	99.7	41%	0.412	55%	0.554	S	S	.	*			trans	-111.7	96.1	167.1	179	-9.9	0	0	0	108.1	T480 F481 W482	D478-T480 PolarHBondContact O-N 2.81Å; D478-T480 WeakPolarHBondContact OD1-CA 3.43Å; D478-T480 WeakPolarHBondContact OD1-CB 3.26Å; D478-T480 PolarHBondContact OD1-N 3.32Å; D478-T480 PolarHBondContact OD1-OG1 3.18Å; D478-F481 HydrophobicContact CB-CB 3.95Å; D478-F481 PolarHBondContact O-N 3.45Å; D478-F481 PolarHBondContact OD1-N 2.88Å; D478-F481 WeakPolarHBondContact OD2-CB 3.5Å; D478-W482 PolarHBondContact O-N 2.79Å
479	P	89.9	Confident	85.6	Confident	92 Å²	92	101.8 Å²	101.8	60%	0.597	56%	0.558	S	S	*	*	H	α-helix	trans	-60.7	-30.2	176.9	-23	34.3	0	0	0	112.4	C477 W482 A483	C477-P479 WeakPolarHBondContact O-CD 3.4Å; P479-W482 PolarHBondContact O-N 2.66Å; P479-A483 WeakPolarHBondContact O-CB 3.25Å; P479-A483 PolarHBondContact O-N 2.72Å
480	T	89.9	Confident	86.7	Confident	74 Å²	74	99.7 Å²	99.7	45%	0.454	55%	0.546	S	S	.	.	H	α-helix	trans	-71.4	-35.9	-177.6	87.9	0	0	0	0	111.5	D478 K484	D478-T480 PolarHBondContact O-N 2.81Å; D478-T480 WeakPolarHBondContact OD1-CA 3.43Å; D478-T480 WeakPolarHBondContact OD1-CB 3.26Å; D478-T480 PolarHBondContact OD1-N 3.32Å; D478-T480 PolarHBondContact OD1-OG1 3.18Å; T480-K484 WeakPolarHBondContact O-CB 3.37Å; T480-K484 VanDerWaalsContact O-CD 3.23Å; T480-K484 WeakPolarHBondContact O-CD 3.36Å; T480-K484 WeakPolarHBondContact O-CG 3.5Å; T480-K484 PolarHBondContact O-N 2.86Å; T480-K484 VanDerWaalsContact O-N 3.09Å; T480-K484 PolarHBondContact OG1-NZ 3.26Å; T480-K484 VanDerWaalsContact OG1-NZ 3.17Å
481	F	90.2	Very high	87.7	Confident	104 Å²	104	103.9 Å²	103.9	46%	0.456	57%	0.569	S	S	.	*	H	α-helix	trans	-62.7	-49.1	172.4	178.6	-92.5	0	0	0	110.6	D478 K484 N485	D478-F481 HydrophobicContact CB-CB 3.95Å; D478-F481 PolarHBondContact O-N 3.45Å; D478-F481 PolarHBondContact OD1-N 2.88Å; D478-F481 WeakPolarHBondContact OD2-CB 3.5Å; F481-K484 PolarHBondContact O-N 2.88Å; F481-N485 WeakPolarHBondContact CE1-ND2 3.25Å; F481-N485 PolarHBondContact O-N 2.84Å; F481-N485 PolarHBondContact O-ND2 3.19Å
482	W	88.7	Confident	88.3	Confident	159 Å²	159	107.5 Å²	107.5	60%	0.602	58%	0.575	S	S	*	*	H	α-helix	trans	-65	-43.4	179.5	-67.9	112.1	0	0	0	112.4	D478 P479 K484 N485 V486	D478-W482 PolarHBondContact O-N 2.79Å; P479-W482 PolarHBondContact O-N 2.66Å; W482-K484 PolarHBondContact O-N 3.28Å; W482-N485 PolarHBondContact O-N 3.29Å; W482-V486 WeakPolarHBondContact O-CG2 3.39Å; W482-V486 PolarHBondContact O-N 2.99Å
483	A	87.7	Confident	88.4	Confident	54 Å²	54	109.9 Å²	109.9	45%	0.446	58%	0.581	S	S	.	*	H	α-helix	trans	-57.1	-45.2	175.4	0	0	0	0	0	112.3	P479 N485 V486 V487	P479-A483 WeakPolarHBondContact O-CB 3.25Å; P479-A483 PolarHBondContact O-N 2.72Å; A483-N485 VanDerWaalsContact C-N 3.25Å; A483-N485 PolarHBondContact O-N 2.88Å; A483-V486 PolarHBondContact O-N 3.27Å; A483-V486 VanDerWaalsContact O-N 3.17Å; A483-V487 WeakPolarHBondContact O-CG2 3.46Å; A483-V487 PolarHBondContact O-N 3.28Å
484	K	86.7	Confident	88.2	Confident	133 Å²	133	113 Å²	113	58%	0.578	60%	0.597	S	S	*	*	H	α-helix	trans	-60.9	-31.7	175.9	-71.9	161	-169.8	153	0	113	T480 F481 W482 N488	T480-K484 WeakPolarHBondContact O-CB 3.37Å; T480-K484 VanDerWaalsContact O-CD 3.23Å; T480-K484 WeakPolarHBondContact O-CD 3.36Å; T480-K484 WeakPolarHBondContact O-CG 3.5Å; T480-K484 PolarHBondContact O-N 2.86Å; T480-K484 VanDerWaalsContact O-N 3.09Å; T480-K484 PolarHBondContact OG1-NZ 3.26Å; T480-K484 VanDerWaalsContact OG1-NZ 3.17Å; F481-K484 PolarHBondContact O-N 2.88Å; W482-K484 PolarHBondContact O-N 3.28Å; K484-N488 PolarHBondContact O-ND2 2.88Å
485	N	85.3	Confident	87.4	Confident	83 Å²	83	111.1 Å²	111.1	44%	0.444	60%	0.596	S	S	.	*	H	α-helix	trans	-76.8	-39.5	174.5	-75.7	-90.7	0	0	0	111.8	F481 W482 A483 V487 N488 L489	F481-N485 WeakPolarHBondContact CE1-ND2 3.25Å; F481-N485 PolarHBondContact O-N 2.84Å; F481-N485 PolarHBondContact O-ND2 3.19Å; W482-N485 PolarHBondContact O-N 3.29Å; A483-N485 VanDerWaalsContact C-N 3.25Å; A483-N485 PolarHBondContact O-N 2.88Å; N485-V487 PolarHBondContact O-N 3.15Å; N485-N488 CarbonylContact O-C 3.54Å; N485-N488 PolarHBondContact O-N 3.29Å; N485-L489 PolarHBondContact O-N 2.98Å
486	V	88.4	Confident	85.8	Confident	89 Å²	89	108.7 Å²	108.7	54%	0.539	60%	0.599	S	S	.	*	H	α-helix	trans	-65.3	-36.9	177.5	173.3	0	0	0	0	112.2	W482 A483 N488 L489	W482-V486 WeakPolarHBondContact O-CG2 3.39Å; W482-V486 PolarHBondContact O-N 2.99Å; A483-V486 PolarHBondContact O-N 3.27Å; A483-V486 VanDerWaalsContact O-N 3.17Å; V486-N488 PolarHBondContact O-N 3.47Å; V486-N488 VanDerWaalsContact O-N 3.15Å; V486-L489 WeakPolarHBondContact O-CB 3.23Å; V486-L489 PolarHBondContact O-N 3.4Å; V486-L489 VanDerWaalsContact O-N 3.09Å
487	V	82.6	Confident	84.1	Confident	122 Å²	122	109.1 Å²	109.1	74%	0.739	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60	-22.9	172.4	170.2	0	0	0	0	112.5	A483 N485	A483-V487 WeakPolarHBondContact O-CG2 3.46Å; A483-V487 PolarHBondContact O-N 3.28Å; N485-V487 PolarHBondContact O-N 3.15Å
488	N	79.8	Confident	81.8	Confident	123 Å²	123	111.3 Å²	111.3	66%	0.658	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.8	20.7	178.5	-69.7	-83	0	0	0	113.1	K484 N485 V486 G490	K484-N488 PolarHBondContact O-ND2 2.88Å; N485-N488 CarbonylContact O-C 3.54Å; N485-N488 PolarHBondContact O-N 3.29Å; V486-N488 PolarHBondContact O-N 3.47Å; V486-N488 VanDerWaalsContact O-N 3.15Å; N488-G490 VanDerWaalsContact C-N 3.31Å; N488-G490 PolarHBondContact O-N 2.86Å
489	L	82.4	Confident	79.4	Confident	87 Å²	87	111.2 Å²	111.2	46%	0.455	62%	0.622	S	S	.	*	S	Bend	trans	-57.3	-38.5	-176	175.5	56.6	0	0	0	113.9	I382 L385 N485 V486	I382-L489 HydrophobicContact CG1-CD2 4.25Å; L385-L489 HydrophobicContact CD1-CD1 3.39Å; L385-L489 HydrophobicContact CD1-CD2 4.15Å; L385-L489 HydrophobicContact CD1-CG 4.42Å; N485-L489 PolarHBondContact O-N 2.98Å; V486-L489 WeakPolarHBondContact O-CB 3.23Å; V486-L489 PolarHBondContact O-N 3.4Å; V486-L489 VanDerWaalsContact O-N 3.09Å
490	G	83.6	Confident	77.2	Confident	55 Å²	55	112.6 Å²	112.6	57%	0.567	63%	0.631	S	S	*	*			trans	-176.8	167.2	-178.8	0	0	0	0	0	111.8	N488	N488-G490 VanDerWaalsContact C-N 3.31Å; N488-G490 PolarHBondContact O-N 2.86Å
491	N	89.2	Confident	74.5	Confident	145 Å²	145	112.6 Å²	112.6	78%	0.775	65%	0.645	S	S	*	*			trans	-134.6	144.3	178.4	-67.5	-75.3	0	0	0	109.6	V493	N491-V493 PolarHBondContact O-N 3.45Å
492	L	90.7	Very high	72.1	Confident	128 Å²	128	115.1 Å²	115.1	67%	0.67	65%	0.653	S	S	*	*			trans	-73.7	116.4	170.3	-67.8	174.7	0	0	0	109.4	V374 I378	V374-L492 HydrophobicContact CG1-CD2 3.77Å; I378-L492 HydrophobicContact CD1-CD2 4.3Å
493	V	87.6	Confident	69.7	Low	133 Å²	133	112.2 Å²	112.2	81%	0.806	65%	0.652	S	S	*	*			trans	-94.5	99.8	178.4	-178	0	0	0	0	109.4	N491 E495	N491-V493 PolarHBondContact O-N 3.45Å; V493-E495 PolarHBondContact O-N 3.31Å
494	I	85.3	Confident	67.4	Low	145 Å²	145	114.4 Å²	114.4	74%	0.744	66%	0.662	S	S	*	*			trans	-87.1	95.1	178.1	-55.3	176.6	0	0	0	108.7	S496	I494-S496 VanDerWaalsContact C-N 3.35Å; I494-S496 PolarHBondContact O-N 3.43Å
495	E	75.6	Confident	65	Low	150 Å²	150	115 Å²	115	70%	0.701	67%	0.671	S	S	*	*			trans	-76.4	85.7	173.1	-169.8	-174.7	-136.6	0	0	110.4	V493 K497	V493-E495 PolarHBondContact O-N 3.31Å; E495-K497 VanDerWaalsContact C-N 3.32Å; E495-K497 PolarHBondContact O-N 3.49Å
496	S	60.6	Low	62.9	Low	104 Å²	104	117 Å²	117	73%	0.727	69%	0.687	S	S	*	*			trans	-63.5	89.5	168.4	-63.1	0	0	0	0	110.4	I494	I494-S496 VanDerWaalsContact C-N 3.35Å; I494-S496 PolarHBondContact O-N 3.43Å
497	K	57.2	Low	60.4	Low	164 Å²	164	117.7 Å²	117.7	71%	0.713	69%	0.691	S	S	*	*	P	Polyproline II helix	trans	-59.4	129.5	169.2	-73.6	171.1	-177.7	160.1	0	108.6	E495 A499	E495-K497 VanDerWaalsContact C-N 3.32Å; E495-K497 PolarHBondContact O-N 3.49Å; K497-A499 PolarHBondContact O-N 3.16Å
498	P	43.5	Very low	58.3	Low	117 Å²	117	118.2 Å²	118.2	76%	0.76	69%	0.694	S	S	*	*	P	Polyproline II helix	trans	-57.8	131.6	172.6	25.6	-33.4	0	0	0	108.4
499	A	42.8	Very low	56.1	Low	75 Å²	75	115.9 Å²	115.9	62%	0.62	70%	0.699	S	S	*	*	P	Polyproline II helix	trans	-59.8	124.9	-176.6	0	0	0	0	0	109.5	K497 G501	K497-A499 PolarHBondContact O-N 3.16Å; A499-G501 PolarHBondContact O-N 2.84Å; A499-G501 VanDerWaalsContact O-N 3.08Å
500	P	44	Very low	53.7	Low	121 Å²	121	121 Å²	121	79%	0.786	72%	0.72	S	S	*	*			trans	-64.2	115	170.7	26.8	-31.8	0	0	0	107.5	Y502	P500-Y502 PolarHBondContact O-N 3.14Å
501	G	33.3	Very low	51.4	Low	73 Å²	73	125.1 Å²	125.1	75%	0.753	73%	0.734	S	S	*	*			trans	-52.2	109.5	-172.6	0	0	0	0	0	111.6	A499 T503	A499-G501 PolarHBondContact O-N 2.84Å; A499-G501 VanDerWaalsContact O-N 3.08Å; G501-T503 PolarHBondContact O-N 2.97Å
502	Y	38.7	Very low	48.8	Very low	158 Å²	158	123.7 Å²	123.7	62%	0.62	73%	0.733	S	S	*	*			trans	-89.5	86.7	-174.3	-167.1	-90.8	0	0	0	110	Y352 P500 P504	Y352-Y502 WeakPolarHBondContact CE2-OH 3.48Å; Y352-Y502 WeakPolarHBondContact OH-CE1 3.28Å; Y352-Y502 PolarHBondContact OH-OH 3.34Å; P500-Y502 PolarHBondContact O-N 3.14Å; Y502-P504 WeakPolarHBondContact O-CD 2.93Å
503	T	38.4	Very low	46.3	Very low	97 Å²	97	123.8 Å²	123.8	60%	0.595	74%	0.741	S	S	*	*			trans	-70.6	124.1	170.6	48.8	0	0	0	0	109.6	G501 N505	G501-T503 PolarHBondContact O-N 2.97Å; T503-N505 VanDerWaalsContact C-N 3.3Å; T503-N505 PolarHBondContact O-N 2.95Å
504	P	40.2	Very low	43.8	Very low	100 Å²	100	121.4 Å²	121.4	65%	0.649	74%	0.743	S	S	*	*			trans	-75	84.7	177.3	30.5	-33.9	0	0	0	109.7	Y502 V506	Y502-P504 WeakPolarHBondContact O-CD 2.93Å; P504-V506 PolarHBondContact O-N 2.84Å
505	N	35.9	Very low	41.5	Very low	145 Å²	145	120.3 Å²	120.3	78%	0.775	74%	0.744	S	S	*	*			trans	-63.8	92.1	177.5	-97	-45.8	0	0	0	111.3	T503	T503-N505 VanDerWaalsContact C-N 3.3Å; T503-N505 PolarHBondContact O-N 2.95Å
506	V	41.3	Very low	39.5	Very low	127 Å²	127	121.1 Å²	121.1	77%	0.77	75%	0.753	S	S	*	*			trans	-73.1	126.7	167.6	179.5	0	0	0	0	108.7	P504 V508	P504-V506 PolarHBondContact O-N 2.84Å; V506-V508 PolarHBondContact O-N 2.82Å
507	V	35.2	Very low	38.3	Very low	102 Å²	102	124.4 Å²	124.4	62%	0.618	76%	0.756	S	S	*	*			trans	-71.6	113.6	-169.2	176.1	0	0	0	0	112.2
508	V	38.1	Very low	37.1	Very low	134 Å²	134	124.1 Å²	124.1	81%	0.812	76%	0.761	S	S	*	*			trans	-143.4	124	163.6	-176.8	0	0	0	0	110.2	V506	V506-V508 PolarHBondContact O-N 2.82Å
509	G	33.6	Very low	36.5	Very low	74 Å²	74	122.8 Å²	122.8	76%	0.763	76%	0.755	S	S	*	*			trans	77.3	106.5	157.6	0	0	0	0	0	117.9
510	Q	32.7	Very low	36.1	Very low	194 Å²	194	128.7 Å²	128.7	91%	0.907	77%	0.766	S	S	*	*			trans	-86.9	133.3	170.9	-63.3	171.6	-22.3	0	0	112.2
511	V	34.5	Very low	35.6	Very low	142 Å²	142	129.6 Å²	129.6	86%	0.861	77%	0.769	S	S	*	*			trans	-141.5	131.4	151.8	-173	0	0	0	0	109.6
512	P	36	Very low	35.4	Very low	115 Å²	115	132.1 Å²	132.1	75%	0.747	77%	0.773	S	S	*	*			trans	-74.5	167.3	-179.2	-18.2	33.7	0	0	0	115.1
513	P	38.4	Very low	35	Very low	130 Å²	130	128 Å²	128	84%	0.844	78%	0.779	S	S	*	*			trans	-82.2	136.7	-159	31.5	-36.2	0	0	0	115.5
514	G	34.8	Very low	35	Very low	82 Å²	82	133.1 Å²	133.1	85%	0.845	80%	0.796	S	S	*	*			trans	-104.6	124	167	0	0	0	0	0	111.7
515	T	36.4	Very low	35.1	Very low	123 Å²	123	134.2 Å²	134.2	76%	0.755	80%	0.795	S	S	*	*			trans	-86.3	133.6	-178.1	55.6	0	0	0	0	112.8
516	N	34.9	Very low	35.6	Very low	166 Å²	166	131.8 Å²	131.8	89%	0.888	78%	0.782	S	S	*	*			trans	-164.7	163.3	131.3	-101	-48.5	0	0	0	112.2
517	H	35	Very low	36.6	Very low	174 Å²	174	130.4 Å²	130.4	81%	0.806	77%	0.77	S	S	*	*			trans	-109.9	176.3	-162.7	-95.8	-84.5	0	0	0	114.5
518	I	32	Very low	37.8	Very low	157 Å²	157	128.4 Å²	128.4	81%	0.805	76%	0.764	S	S	*	*			trans	95.4	126.7	154.4	-72.8	139.2	0	0	0	116.9
519	S	31.3	Very low	39.2	Very low	90 Å²	90	128.3 Å²	128.3	63%	0.629	76%	0.755	S	S	*	*			cis	-170.6	161.9	-12.2	-96.9	0	0	0	0	112.7
520	K	33.4	Very low	41	Very low	199 Å²	199	129.1 Å²	129.1	87%	0.865	74%	0.741	S	S	*	*			trans	87.3	140.7	169.1	-51.9	163.5	-173.2	169.7	0	114
521	T	32.8	Very low	42.7	Very low	139 Å²	139	128 Å²	128	85%	0.853	73%	0.729	S	S	*	*			cis	-118	133.4	4.1	37.4	0	0	0	0	112.7
522	P	30.9	Very low	44.6	Very low	126 Å²	126	126.7 Å²	126.7	82%	0.818	72%	0.716	S	S	*	*			trans	-102.5	139.4	179.8	36.3	-31.3	0	0	0	114.4
523	G	30	Very low	46.4	Very low	73 Å²	73	127.3 Å²	127.3	75%	0.753	71%	0.709	S	S	*	*			trans	85	100.3	142.2	0	0	0	0	0	119.3
524	Q	37	Very low	48.3	Very low	203 Å²	203	126.1 Å²	126.1	95%	0.949	69%	0.692	S	S	*	*			trans	-102.1	95.7	131.3	-79.8	-166	-2.6	0	0	108.9	N526	Q524-N526 PolarHBondContact O-N 3.38Å
525	I	42.2	Very low	50.4	Low	124 Å²	124	127.6 Å²	127.6	64%	0.636	68%	0.678	S	S	*	*			trans	-68.7	124.8	157	-72.8	176	0	0	0	106.2	L527 L530	I525-L527 PolarHBondContact O-N 3Å; I525-L530 HydrophobicContact CG2-CB 4.11Å
526	N	48	Very low	52.5	Low	94 Å²	94	128.3 Å²	128.3	50%	0.503	67%	0.673	S	S	.	*			trans	-59.1	124.9	179.5	-174.4	-26.2	0	0	0	109.3	Q524 A528 Q529 L530	Q524-N526 PolarHBondContact O-N 3.38Å; N526-A528 PolarHBondContact O-N 3.38Å; N526-A528 VanDerWaalsContact O-N 3.12Å; N526-A528 VanDerWaalsContact OD1-CB 3.29Å; N526-A528 WeakPolarHBondContact OD1-CB 3.4Å; N526-A528 PolarHBondContact OD1-N 3.43Å; N526-Q529 HydrophobicContact CB-CB 4.43Å; N526-Q529 HydrophobicContact CB-CG 4.38Å; N526-Q529 WeakPolarHBondContact O-CB 3.47Å; N526-Q529 PolarHBondContact O-N 3.31Å; N526-L530 PolarHBondContact O-N 2.87Å; N526-L530 VanDerWaalsContact O-N 3.09Å
527	L	61.5	Low	54.6	Low	97 Å²	97	126.8 Å²	126.8	51%	0.508	66%	0.661	S	S	.	*	H	α-helix	trans	-59.9	-24.9	-178.4	-175.5	60	0	0	0	112.2	I525 R531	I525-L527 PolarHBondContact O-N 3Å; L527-R531 WeakPolarHBondContact O-CB 3.06Å; L527-R531 VanDerWaalsContact O-CG 3.27Å; L527-R531 WeakPolarHBondContact O-CG 3.45Å; L527-R531 PolarHBondContact O-N 3.01Å; L527-R531 VanDerWaalsContact O-N 3.08Å
528	A	60.2	Low	56.5	Low	61 Å²	61	124.1 Å²	124.1	50%	0.504	65%	0.648	S	S	.	*	H	α-helix	trans	-65.3	-47.9	169.1	0	0	0	0	0	112	N526 L530 R531 L532	N526-A528 PolarHBondContact O-N 3.38Å; N526-A528 VanDerWaalsContact O-N 3.12Å; N526-A528 VanDerWaalsContact OD1-CB 3.29Å; N526-A528 WeakPolarHBondContact OD1-CB 3.4Å; N526-A528 PolarHBondContact OD1-N 3.43Å; A528-L530 PolarHBondContact O-N 2.94Å; A528-R531 PolarHBondContact O-N 3.32Å; A528-L532 WeakPolarHBondContact O-CB 3.32Å; A528-L532 PolarHBondContact O-N 3.25Å
529	Q	67.3	Low	58.5	Low	132 Å²	132	120.6 Å²	120.6	62%	0.617	63%	0.634	S	S	*	*	H	α-helix	trans	-63	-41.9	177.6	-77.5	-176.9	-18.7	0	0	112.3	N526 R531 L532 Q533	N526-Q529 HydrophobicContact CB-CB 4.43Å; N526-Q529 HydrophobicContact CB-CG 4.38Å; N526-Q529 WeakPolarHBondContact O-CB 3.47Å; N526-Q529 PolarHBondContact O-N 3.31Å; Q529-R531 PolarHBondContact O-N 3.14Å; Q529-L532 PolarHBondContact O-N 2.89Å; Q529-Q533 WeakPolarHBondContact O-CB 3.17Å; Q529-Q533 PolarHBondContact O-N 2.86Å
530	L	71.6	Confident	60.7	Low	91 Å²	91	124.4 Å²	124.4	48%	0.476	64%	0.636	S	S	.	*	H	α-helix	trans	-66.5	-37.9	177.7	-169.3	64.1	0	0	0	111.7	I525 N526 A528 H534	I525-L530 HydrophobicContact CG2-CB 4.11Å; N526-L530 PolarHBondContact O-N 2.87Å; N526-L530 VanDerWaalsContact O-N 3.09Å; A528-L530 PolarHBondContact O-N 2.94Å; L530-H534 VanDerWaalsContact O-CB 3.27Å; L530-H534 WeakPolarHBondContact O-CB 3.39Å; L530-H534 PolarHBondContact O-N 3.12Å
531	R	69.6	Low	62.7	Low	170 Å²	170	117.8 Å²	117.8	64%	0.642	62%	0.619	S	S	*	*	H	α-helix	trans	-65.7	-41.5	171.6	-78.2	174.4	174	150	-0.8	112.3	L527 A528 Q529 H534 M535	L527-R531 WeakPolarHBondContact O-CB 3.06Å; L527-R531 VanDerWaalsContact O-CG 3.27Å; L527-R531 WeakPolarHBondContact O-CG 3.45Å; L527-R531 PolarHBondContact O-N 3.01Å; L527-R531 VanDerWaalsContact O-N 3.08Å; A528-R531 PolarHBondContact O-N 3.32Å; Q529-R531 PolarHBondContact O-N 3.14Å; R531-H534 PolarHBondContact O-N 3.04Å; R531-M535 VanDerWaalsContact O-CB 3.28Å; R531-M535 WeakPolarHBondContact O-CB 3.08Å; R531-M535 PolarHBondContact O-N 3.09Å
532	L	73.7	Confident	64.8	Low	115 Å²	115	117.8 Å²	117.8	60%	0.602	61%	0.609	S	S	*	*	H	α-helix	trans	-65.1	-44.4	179.5	-155	75.8	0	0	0	111.1	A528 Q529 M535 Q536	A528-L532 WeakPolarHBondContact O-CB 3.32Å; A528-L532 PolarHBondContact O-N 3.25Å; Q529-L532 PolarHBondContact O-N 2.89Å; L532-M535 HydrophobicContact CD1-CE 4.42Å; L532-M535 PolarHBondContact O-N 3.12Å; L532-Q536 VanDerWaalsContact O-CB 3.28Å; L532-Q536 WeakPolarHBondContact O-CB 3.43Å; L532-Q536 PolarHBondContact O-N 3.15Å
533	Q	73.5	Confident	66.7	Low	127 Å²	127	118.6 Å²	118.6	59%	0.593	60%	0.6	S	S	*	*	H	α-helix	trans	-64.1	-43.8	175.1	-173.3	176.4	90	0	0	111.5	Q529 Q536 Q537	Q529-Q533 WeakPolarHBondContact O-CB 3.17Å; Q529-Q533 PolarHBondContact O-N 2.86Å; Q533-Q536 PolarHBondContact O-N 3.09Å; Q533-Q537 VanDerWaalsContact O-CB 3.28Å; Q533-Q537 WeakPolarHBondContact O-CB 3.37Å; Q533-Q537 PolarHBondContact O-N 2.98Å
534	H	77.4	Confident	68.9	Low	106 Å²	106	120.2 Å²	120.2	49%	0.491	59%	0.587	S	S	.	*	H	α-helix	trans	-67.1	-39.4	177.9	-161.6	103.2	0	0	0	112.1	L530 R531 Q537 Q538	L530-H534 VanDerWaalsContact O-CB 3.27Å; L530-H534 WeakPolarHBondContact O-CB 3.39Å; L530-H534 PolarHBondContact O-N 3.12Å; R531-H534 PolarHBondContact O-N 3.04Å; H534-Q537 PolarHBondContact O-N 3.43Å; H534-Q538 PolarHBondContact CD2-NE2 3.31Å; H534-Q538 PolarHBondContact NE2-NE2 2.81Å; H534-Q538 WeakPolarHBondContact O-CG 3.06Å; H534-Q538 PolarHBondContact O-N 2.83Å
535	M	79.1	Confident	70.6	Confident	112 Å²	112	116.1 Å²	116.1	55%	0.552	57%	0.568	S	S	*	*	H	α-helix	trans	-63.9	-47	173.8	-172.3	-172.7	80.2	0	0	111.2	R531 L532 Q537 Q538 V539	R531-M535 VanDerWaalsContact O-CB 3.28Å; R531-M535 WeakPolarHBondContact O-CB 3.08Å; R531-M535 PolarHBondContact O-N 3.09Å; L532-M535 HydrophobicContact CD1-CE 4.42Å; L532-M535 PolarHBondContact O-N 3.12Å; M535-Q537 VanDerWaalsContact C-N 3.28Å; M535-Q537 PolarHBondContact O-N 3.32Å; M535-Q538 PolarHBondContact O-N 3.05Å; M535-V539 WeakPolarHBondContact O-CG2 3.07Å; M535-V539 PolarHBondContact O-N 3.31Å
536	Q	80.5	Confident	71.8	Confident	138 Å²	138	116.6 Å²	116.6	65%	0.645	57%	0.567	S	S	*	*	H	α-helix	trans	-62	-37.4	177.4	-171.4	173.4	69.2	0	0	111.5	L532 Q533 V539 Y540	L532-Q536 VanDerWaalsContact O-CB 3.28Å; L532-Q536 WeakPolarHBondContact O-CB 3.43Å; L532-Q536 PolarHBondContact O-N 3.15Å; Q533-Q536 PolarHBondContact O-N 3.09Å; Q536-V539 PolarHBondContact O-N 3.49Å; Q536-Y540 WeakPolarHBondContact O-CB 3.5Å; Q536-Y540 PolarHBondContact O-N 2.89Å
537	Q	79.6	Confident	72.8	Confident	134 Å²	134	118 Å²	118	63%	0.626	57%	0.574	S	S	*	*	H	α-helix	trans	-71.2	-35.6	175.9	-166.7	165.1	60.5	0	0	112.7	Q533 H534 M535 Y540 A541	Q533-Q537 VanDerWaalsContact O-CB 3.28Å; Q533-Q537 WeakPolarHBondContact O-CB 3.37Å; Q533-Q537 PolarHBondContact O-N 2.98Å; H534-Q537 PolarHBondContact O-N 3.43Å; M535-Q537 VanDerWaalsContact C-N 3.28Å; M535-Q537 PolarHBondContact O-N 3.32Å; Q537-Y540 PolarHBondContact O-N 3.02Å; Q537-A541 WeakPolarHBondContact O-CB 3.19Å; Q537-A541 PolarHBondContact O-N 3.12Å
538	Q	74.9	Confident	72.9	Confident	118 Å²	118	118.4 Å²	118.4	55%	0.551	57%	0.574	S	S	*	*	H	α-helix	trans	-65	-43.2	170.4	-75.7	-175.3	6.5	0	0	112	H534 M535 Y540 A541 Q542	H534-Q538 PolarHBondContact CD2-NE2 3.31Å; H534-Q538 PolarHBondContact NE2-NE2 2.81Å; H534-Q538 WeakPolarHBondContact O-CG 3.06Å; H534-Q538 PolarHBondContact O-N 2.83Å; M535-Q538 PolarHBondContact O-N 3.05Å; Q538-Y540 VanDerWaalsContact C-N 3.34Å; Q538-Y540 PolarHBondContact O-N 3.3Å; Q538-A541 PolarHBondContact O-N 3.15Å; Q538-Q542 WeakPolarHBondContact O-CB 3.47Å; Q538-Q542 PolarHBondContact O-N 3.2Å
539	V	75.1	Confident	72.9	Confident	84 Å²	84	121.1 Å²	121.1	51%	0.509	58%	0.576	S	S	.	*	H	α-helix	trans	-61.8	-41.5	174.3	171.5	0	0	0	0	111.1	M535 Q536 K543	M535-V539 WeakPolarHBondContact O-CG2 3.07Å; M535-V539 PolarHBondContact O-N 3.31Å; Q536-V539 PolarHBondContact O-N 3.49Å; V539-K543 VanDerWaalsContact O-CB 3.25Å; V539-K543 WeakPolarHBondContact O-CB 3.38Å; V539-K543 PolarHBondContact O-N 3.04Å
540	Y	76.1	Confident	72.3	Confident	170 Å²	170	122.3 Å²	122.3	67%	0.667	58%	0.583	S	S	*	*	H	α-helix	trans	-65.3	-42.7	176.3	-132.2	-78.7	0	0	0	112.1	Q536 Q537 Q538 H544	Q536-Y540 WeakPolarHBondContact O-CB 3.5Å; Q536-Y540 PolarHBondContact O-N 2.89Å; Q537-Y540 PolarHBondContact O-N 3.02Å; Q538-Y540 VanDerWaalsContact C-N 3.34Å; Q538-Y540 PolarHBondContact O-N 3.3Å; Y540-H544 WeakPolarHBondContact O-CB 3.45Å; Y540-H544 PolarHBondContact O-N 2.73Å
541	A	76.6	Confident	71.5	Confident	60 Å²	60	128.6 Å²	128.6	50%	0.496	60%	0.601	S	S	.	*	H	α-helix	trans	-63.7	-45.8	176.4	0	0	0	0	0	111.9	Q537 Q538 H544 Q545	Q537-A541 WeakPolarHBondContact O-CB 3.19Å; Q537-A541 PolarHBondContact O-N 3.12Å; Q538-A541 PolarHBondContact O-N 3.15Å; A541-H544 PolarHBondContact O-N 3.43Å; A541-Q545 WeakPolarHBondContact O-CB 3.49Å; A541-Q545 PolarHBondContact O-N 3.19Å
542	Q	75.3	Confident	70.7	Confident	138 Å²	138	127.6 Å²	127.6	65%	0.645	61%	0.607	S	S	*	*	H	α-helix	trans	-64.9	-42.8	178.4	-167.4	176.1	50.7	0	0	111.5	Q538 H544 Q545 Q546	Q538-Q542 WeakPolarHBondContact O-CB 3.47Å; Q538-Q542 PolarHBondContact O-N 3.2Å; Q542-H544 VanDerWaalsContact C-N 3.35Å; Q542-H544 PolarHBondContact O-N 2.82Å; Q542-Q545 PolarHBondContact O-N 2.94Å; Q542-Q546 WeakPolarHBondContact O-CB 3.29Å; Q542-Q546 PolarHBondContact O-N 3.25Å
543	K	72.2	Confident	69.4	Low	144 Å²	144	130.2 Å²	130.2	63%	0.626	62%	0.617	S	S	*	*	H	α-helix	trans	-60.4	-42.9	173.3	-173.1	172.5	-176.2	174.4	0	111.7	V539 Q546 L547	V539-K543 VanDerWaalsContact O-CB 3.25Å; V539-K543 WeakPolarHBondContact O-CB 3.38Å; V539-K543 PolarHBondContact O-N 3.04Å; K543-Q546 PolarHBondContact O-N 2.99Å; K543-L547 WeakPolarHBondContact O-CB 3.26Å; K543-L547 PolarHBondContact O-N 3.48Å
544	H	75.6	Confident	67.8	Low	107 Å²	107	133 Å²	133	50%	0.495	63%	0.63	S	S	.	*	H	α-helix	trans	-69.6	-35	178.6	-157.2	-72.9	0	0	0	112.5	Y540 A541 Q542 Q548	Y540-H544 WeakPolarHBondContact O-CB 3.45Å; Y540-H544 PolarHBondContact O-N 2.73Å; A541-H544 PolarHBondContact O-N 3.43Å; Q542-H544 VanDerWaalsContact C-N 3.35Å; Q542-H544 PolarHBondContact O-N 2.82Å; H544-Q548 PolarHBondContact CE1-NE2 3.34Å; H544-Q548 WeakPolarHBondContact O-CG 3.14Å; H544-Q548 PolarHBondContact O-N 2.95Å
545	Q	73	Confident	66.4	Low	116 Å²	116	133.9 Å²	133.9	54%	0.542	65%	0.645	S	S	.	*	H	α-helix	trans	-70.1	-41.2	175.4	-165.9	174.2	28.1	0	0	111.6	A541 Q542 Q548 Q549	A541-Q545 WeakPolarHBondContact O-CB 3.49Å; A541-Q545 PolarHBondContact O-N 3.19Å; Q542-Q545 PolarHBondContact O-N 2.94Å; Q545-Q548 PolarHBondContact O-N 3.31Å; Q545-Q549 WeakPolarHBondContact O-CG 3.46Å; Q545-Q549 PolarHBondContact O-N 2.82Å
546	Q	67.2	Low	64.5	Low	134 Å²	134	134.7 Å²	134.7	63%	0.626	66%	0.658	S	S	*	*	H	α-helix	trans	-66	-39	175	-162.7	172.8	32.4	0	0	111.6	Q542 K543 Q548 Q549 M550	Q542-Q546 WeakPolarHBondContact O-CB 3.29Å; Q542-Q546 PolarHBondContact O-N 3.25Å; K543-Q546 PolarHBondContact O-N 2.99Å; Q546-Q548 VanDerWaalsContact C-N 3.3Å; Q546-Q548 PolarHBondContact O-N 2.92Å; Q546-Q549 PolarHBondContact O-N 3.3Å; Q546-M550 WeakPolarHBondContact O-CB 3.39Å; Q546-M550 WeakPolarHBondContact O-CG 3.37Å; Q546-M550 PolarHBondContact O-N 2.83Å
547	L	68	Low	62.6	Low	123 Å²	123	132.7 Å²	132.7	64%	0.644	67%	0.666	S	S	*	*	H	α-helix	trans	-66.5	-29.9	174.4	-144.6	81.5	0	0	0	113	K543 R551	K543-L547 WeakPolarHBondContact O-CB 3.26Å; K543-L547 PolarHBondContact O-N 3.48Å; L547-R551 WeakPolarHBondContact O-CB 3.33Å; L547-R551 PolarHBondContact O-N 3.34Å
548	Q	64.2	Low	60.8	Low	107 Å²	107	132 Å²	132	50%	0.5	67%	0.672	S	S	.	*	H	α-helix	trans	-76.8	-39.1	173.2	-78.5	-177.5	-13.8	0	0	112.7	H544 Q545 Q546 R551 L552	H544-Q548 PolarHBondContact CE1-NE2 3.34Å; H544-Q548 WeakPolarHBondContact O-CG 3.14Å; H544-Q548 PolarHBondContact O-N 2.95Å; Q545-Q548 PolarHBondContact O-N 3.31Å; Q546-Q548 VanDerWaalsContact C-N 3.3Å; Q546-Q548 PolarHBondContact O-N 2.92Å; Q548-R551 CarbonylContact O-C 3.49Å; Q548-R551 PolarHBondContact O-N 2.85Å; Q548-L552 PolarHBondContact O-N 3.17Å
549	Q	61.5	Low	59.1	Low	118 Å²	118	134 Å²	134	55%	0.551	69%	0.685	S	S	*	*	H	α-helix	trans	-65	-41.6	175.4	-71.7	179.2	10.5	0	0	111.6	Q545 Q546 R551 L552	Q545-Q549 WeakPolarHBondContact O-CG 3.46Å; Q545-Q549 PolarHBondContact O-N 2.82Å; Q546-Q549 PolarHBondContact O-N 3.3Å; Q549-R551 PolarHBondContact O-N 3.11Å; Q549-R551 VanDerWaalsContact O-N 3.11Å; Q549-L552 PolarHBondContact O-N 3Å
550	M	54.5	Low	57.6	Low	157 Å²	157	135 Å²	135	77%	0.773	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61	-15.1	170.2	-74.8	-70.4	-70.6	0	0	114.1	Q546	Q546-M550 WeakPolarHBondContact O-CB 3.39Å; Q546-M550 WeakPolarHBondContact O-CG 3.37Å; Q546-M550 PolarHBondContact O-N 2.83Å
551	R	54	Low	55.9	Low	223 Å²	223	132.4 Å²	132.4	84%	0.842	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108	1.4	-179	-158.6	170.7	-176.9	173.4	2	113.8	L547 Q548 Q549	L547-R551 WeakPolarHBondContact O-CB 3.33Å; L547-R551 PolarHBondContact O-N 3.34Å; Q548-R551 CarbonylContact O-C 3.49Å; Q548-R551 PolarHBondContact O-N 2.85Å; Q549-R551 PolarHBondContact O-N 3.11Å; Q549-R551 VanDerWaalsContact O-N 3.11Å
552	L	52.8	Low	54	Low	149 Å²	149	135.1 Å²	135.1	78%	0.78	71%	0.706	S	S	*	*	S	Bend	trans	-113.2	8.7	179.6	-92.6	158.6	0	0	0	113.8	Q548 Q549	Q548-L552 PolarHBondContact O-N 3.17Å; Q549-L552 PolarHBondContact O-N 3Å
553	Q	45.5	Very low	52.2	Low	170 Å²	170	135.3 Å²	135.3	79%	0.794	72%	0.717	S	S	*	*			trans	-118.3	72.3	174.5	-67.1	-178	-0	0	0	111.1
554	Q	41.1	Very low	50.6	Low	185 Å²	185	133.2 Å²	133.2	86%	0.864	73%	0.727	S	S	*	*			trans	-129.4	117.6	160.1	-88.3	-171.4	5	0	0	109.9
555	P	48.2	Very low	49.1	Very low	125 Å²	125	135.2 Å²	135.2	81%	0.812	75%	0.746	S	S	*	*			trans	-77.9	141.6	170.6	31.9	-32.8	0	0	0	110.8
556	P	37.8	Very low	47.6	Very low	129 Å²	129	135.5 Å²	135.5	84%	0.838	76%	0.757	S	S	*	*			trans	-93	133.3	178.3	34.2	-32.5	0	0	0	113
557	A	41.7	Very low	46.4	Very low	96 Å²	96	136.6 Å²	136.6	79%	0.793	76%	0.762	S	S	*	*			trans	156.1	167.1	155.7	0	0	0	0	0	110.6
558	P	42.5	Very low	45.2	Very low	119 Å²	119	138.6 Å²	138.6	77%	0.773	77%	0.768	S	S	*	*				-131.1	-176	-53	39.2	-24.4	0	0	0	112.5
559	I	38.9	Very low	44.1	Very low	159 Å²	159	142.3 Å²	142.3	82%	0.815	79%	0.785	S	S	*	*			trans	-83.7	136.9	177.4	-26.4	175.4	0	0	0	110.7
560	P	43.3	Very low	43.2	Very low	107 Å²	107	142.1 Å²	142.1	70%	0.695	79%	0.794	S	S	*	*				-143.5	152.1	110	36.9	-22.1	0	0	0	113.6
561	T	39.7	Very low	42.4	Very low	114 Å²	114	145.3 Å²	145.3	70%	0.699	80%	0.797	S	S	*	*				67.1	100.5	60.6	14.6	0	0	0	0	118.3
562	T	37	Very low	41.7	Very low	118 Å²	118	142.8 Å²	142.8	72%	0.724	80%	0.795	S	S	*	*			trans	74	134.4	137.3	42.4	0	0	0	0	124.2
563	T	38.3	Very low	41.1	Very low	141 Å²	141	140.3 Å²	140.3	87%	0.865	80%	0.796	S	S	*	*			trans	69.2	133.8	148.8	47.3	0	0	0	0	121.2
564	A	37.4	Very low	40.8	Very low	101 Å²	101	137 Å²	137	84%	0.835	80%	0.798	S	S	*	*			trans	-139.4	143.5	166.6	0	0	0	0	0	110.1
565	T	45.6	Very low	40.6	Very low	148 Å²	148	134.1 Å²	134.1	91%	0.908	80%	0.795	S	S	*	*			trans	-106.8	174.9	180	-15.8	0	0	0	0	111
566	T	40.7	Very low	40.1	Very low	123 Å²	123	137.3 Å²	137.3	76%	0.755	80%	0.799	S	S	*	*			trans	-107.7	146.8	-161	-29	0	0	0	0	115
567	Q	41.3	Very low	40	Very low	157 Å²	157	139.8 Å²	139.8	73%	0.734	80%	0.801	S	S	*	*			trans	96.5	140.7	136.2	-124.9	-176.7	91.6	0	0	122
568	Q	42.6	Very low	39.8	Very low	165 Å²	165	142 Å²	142	77%	0.771	80%	0.799	S	S	*	*			trans	97.2	154.3	156	-57.4	-177.4	17.9	0	0	120.7
569	H	41	Very low	39.6	Very low	185 Å²	185	143.5 Å²	143.5	86%	0.856	80%	0.796	S	S	*	*			trans	-117.5	-168.9	-159.9	-68.9	-81.5	0	0	0	111.4
570	P	43.1	Very low	39.3	Very low	114 Å²	114	145.1 Å²	145.1	74%	0.74	80%	0.8	S	S	*	*			cis	-145.2	171.9	2.6	44.7	-25.4	0	0	0	120.3
571	R	38.1	Very low	38.9	Very low	223 Å²	223	148 Å²	148	84%	0.842	80%	0.804	S	S	*	*			trans	94.2	132	135	-133.8	-176.8	178.2	-172.6	-1.1	123.4
572	Q	39.1	Very low	39.1	Very low	170 Å²	170	147.1 Å²	147.1	79%	0.794	80%	0.801	S	S	*	*			trans	108.9	143.5	149.4	-62.1	-162	-6.9	0	0	120.5
573	A	39.5	Very low	39.3	Very low	98 Å²	98	147.3 Å²	147.3	81%	0.81	80%	0.804	S	S	*	*			trans	84	100.7	163.2	0	0	0	0	0	122.1
574	A	39.1	Very low	39	Very low	100 Å²	100	151.9 Å²	151.9	83%	0.826	81%	0.805	S	S	*	*			trans	66.4	152.9	145	0	0	0	0	0	120.7
575	P	37.3	Very low	38.8	Very low	124 Å²	124	154.9 Å²	154.9	81%	0.805	81%	0.807	S	S	*	*			trans	-98	137.1	-156.9	36.1	-34.2	0	0	0	116.1
576	Q	37.3	Very low	38.5	Very low	193 Å²	193	155 Å²	155	90%	0.902	80%	0.8	S	S	*	*			trans	-130	141.5	151	-69.9	-173.2	-41	0	0	108
577	M	36.5	Very low	37.9	Very low	180 Å²	180	154.4 Å²	154.4	89%	0.887	80%	0.801	S	S	*	*			trans	-100.8	126.4	-180	-72.6	-98.1	61.6	0	0	110.5
578	L	37	Very low	37.7	Very low	143 Å²	143	152.8 Å²	152.8	75%	0.749	80%	0.801	S	S	*	*			trans	-150.6	147.9	178.9	-160	84.7	0	0	0	110.1
579	Q	38.1	Very low	37.4	Very low	150 Å²	150	153.1 Å²	153.1	70%	0.701	80%	0.803	S	S	*	*			trans	72.9	122.3	148.6	-151.4	154	67.1	0	0	120.1
580	Q	34.4	Very low	36.8	Very low	194 Å²	194	149.7 Å²	149.7	91%	0.907	80%	0.795	S	S	*	*				-127.6	152.4	128.4	-75.4	-162.6	50.9	0	0	109.2
581	Q	34.7	Very low	36.6	Very low	167 Å²	167	152.4 Å²	152.4	78%	0.78	80%	0.8	S	S	*	*			trans	-153.2	177.3	179.2	-127.3	-149.5	-0.4	0	0	108.9
582	P	42.2	Very low	36.3	Very low	96 Å²	96	149.8 Å²	149.8	62%	0.623	80%	0.797	S	S	*	*				-114.6	-172.2	-124.5	43.3	-29.6	0	0	0	112.9
583	P	41.3	Very low	36	Very low	122 Å²	122	153.9 Å²	153.9	79%	0.792	81%	0.805	S	S	*	*			trans	-96	156.9	153.5	34.8	-29.6	0	0	0	112.9
584	R	32.7	Very low	35.8	Very low	236 Å²	236	153 Å²	153	89%	0.891	81%	0.807	S	S	*	*			trans	-112.8	-170.4	167	-94.4	-168.6	172.4	-139.4	0.3	109.5
585	L	33.8	Very low	35.5	Very low	165 Å²	165	154.3 Å²	154.3	86%	0.864	80%	0.799	S	S	*	*			trans	94.4	142.4	-177.2	-53.7	169.6	0	0	0	111.6
586	I	38.1	Very low	35.6	Very low	149 Å²	149	157 Å²	157	76%	0.764	80%	0.804	S	S	*	*			cis	-127.9	171.7	11.6	-95.5	104.7	0	0	0	111.5	V588	I586-V588 HydrophobicContact CG2-CG2 4.5Å
587	S	28.9	Very low	35.6	Very low	111 Å²	111	154.5 Å²	154.5	78%	0.776	80%	0.796	S	S	*	*			trans	-117.3	129.4	169.7	-179.4	0	0	0	0	112.4
588	V	37.1	Very low	35.5	Very low	123 Å²	123	151.4 Å²	151.4	75%	0.745	79%	0.791	S	S	*	*			trans	-156.2	129.5	160.3	-89.7	0	0	0	0	106.3	I586	I586-V588 HydrophobicContact CG2-CG2 4.5Å
589	Q	35.7	Very low	35.5	Very low	172 Å²	172	147.3 Å²	147.3	80%	0.804	78%	0.784	S	S	*	*				77.6	91	54.2	-69.3	-165.3	-10	0	0	115.5
590	T	28.5	Very low	35.4	Very low	114 Å²	114	144.3 Å²	144.3	70%	0.699	78%	0.784	S	S	*	*			trans	46.5	104.7	133	56.6	0	0	0	0	121.3
591	M	39	Very low	35.5	Very low	170 Å²	170	143.4 Å²	143.4	84%	0.837	78%	0.778	S	S	*	*				-150.3	136.3	129.3	-78.3	-56.3	147.3	0	0	106
592	Q	32	Very low	35.6	Very low	169 Å²	169	143.5 Å²	143.5	79%	0.79	78%	0.778	S	S	*	*			cis	79.4	128.3	38.2	-68.7	-156.6	0.4	0	0	116.5
593	R	33.6	Very low	35.4	Very low	255 Å²	255	142.8 Å²	142.8	96%	0.962	78%	0.781	S	S	*	*			trans	77.2	118.6	170.1	-69.6	-172.6	165.9	-146.4	-3.4	119.8
594	G	33.9	Very low	35.1	Very low	81 Å²	81	144.8 Å²	144.8	84%	0.835	78%	0.779	S	S	*	*			trans	178.8	103	159.9	0	0	0	0	0	107.8
595	N	34.4	Very low	35.2	Very low	126 Å²	126	140.8 Å²	140.8	67%	0.674	77%	0.77	S	S	*	*			trans	-150.7	122.1	-159.6	173.2	105.6	0	0	0	113.8
596	M	39.3	Very low	35.5	Very low	182 Å²	182	138.8 Å²	138.8	90%	0.897	76%	0.758	S	S	*	*			trans	-138.2	100.8	160.3	-45.6	-65.4	162.4	0	0	105.3
597	N	37	Very low	35.5	Very low	139 Å²	139	141.6 Å²	141.6	74%	0.743	76%	0.759	S	S	*	*				58.5	127.9	77.6	-151.2	51.2	0	0	0	112.4
598	C	34	Very low	35.8	Very low	116 Å²	116	143.7 Å²	143.7	78%	0.784	76%	0.761	S	S	*	*			cis	-152	159.8	25.5	-171.3	0	0	0	0	109.7
599	G	36.5	Very low	35.8	Very low	57 Å²	57	142.9 Å²	142.9	59%	0.588	77%	0.767	S	S	*	*			cis	-162.7	153.2	-2.1	0	0	0	0	0	109.9
600	A	36.8	Very low	35.8	Very low	87 Å²	87	142.7 Å²	142.7	72%	0.719	77%	0.766	S	S	*	*				61.4	130	94.3	0	0	0	0	0	114.3
601	F	36.4	Very low	36.2	Very low	174 Å²	174	145.1 Å²	145.1	76%	0.763	78%	0.775	S	S	*	*			cis	-138.9	137.3	40.2	-85.9	-101.4	0	0	0	112.2
602	Q	36.8	Very low	35.9	Very low	170 Å²	170	141.6 Å²	141.6	79%	0.794	77%	0.772	S	S	*	*				67.4	142.6	90.3	-65.6	-169.6	8	0	0	116.9
603	A	37.3	Very low	36.3	Very low	81 Å²	81	137.9 Å²	137.9	67%	0.669	77%	0.77	S	S	*	*			cis	-168.7	168.7	-11.4	0	0	0	0	0	113.1
604	H	36.2	Very low	36.4	Very low	163 Å²	163	137 Å²	137	76%	0.755	77%	0.767	S	S	*	*			trans	61.8	127.3	164.4	-99.4	70.4	0	0	0	118.7
605	Q	34.4	Very low	36.6	Very low	153 Å²	153	140.8 Å²	140.8	72%	0.715	77%	0.766	S	S	*	*			cis	91.7	150.1	23.1	-146.1	-130.3	105.1	0	0	115.7
606	M	39.9	Very low	36.8	Very low	123 Å²	123	140.9 Å²	140.9	61%	0.606	77%	0.774	S	S	*	*			trans	83.8	141.9	-171.8	-59.4	-79.2	-81	0	0	115.9
607	R	37.1	Very low	36.8	Very low	207 Å²	207	135.6 Å²	135.6	78%	0.781	77%	0.766	S	S	*	*			cis	-160.7	156.5	-20.5	171.6	171.3	-86.5	-162.4	-4.6	109
608	L	35.4	Very low	36.8	Very low	156 Å²	156	136.6 Å²	136.6	82%	0.817	77%	0.77	S	S	*	*			trans	-63.2	151.8	177.2	-67.6	75.8	0	0	0	113.9
609	A	37	Very low	37	Very low	105 Å²	105	136.6 Å²	136.6	87%	0.868	77%	0.769	S	S	*	*			trans	-141.4	142.3	149.7	0	0	0	0	0	110
610	Q	36	Very low	37.1	Very low	169 Å²	169	144.6 Å²	144.6	79%	0.79	78%	0.781	S	S	*	*			trans	-112.4	145	178.8	-63.2	167.4	-46.8	0	0	110
611	N	37	Very low	37.2	Very low	165 Å²	165	147.8 Å²	147.8	88%	0.882	78%	0.781	S	S	*	*			trans	179.6	131.2	147.4	-89.7	-36.9	0	0	0	108.1
612	A	33.5	Very low	37.3	Very low	95 Å²	95	144.4 Å²	144.4	79%	0.785	78%	0.779	S	S	*	*			cis	93.6	71.6	18.2	0	0	0	0	0	116.9
613	A	40.2	Very low	37	Very low	91 Å²	91	141 Å²	141	75%	0.752	78%	0.779	S	S	*	*			trans	-140.1	133.2	155.9	0	0	0	0	0	107.5
614	R	35.3	Very low	37.1	Very low	238 Å²	238	142.2 Å²	142.2	90%	0.898	78%	0.781	S	S	*	*				63.8	131.5	60.4	-64.5	-174.1	174.5	-176	0.1	111
615	I	39.4	Very low	37.1	Very low	159 Å²	159	143.8 Å²	143.8	82%	0.815	79%	0.788	S	S	*	*			cis	-143.7	154.2	27.5	-66.8	177.3	0	0	0	111.2
616	P	37.7	Very low	36.8	Very low	129 Å²	129	146.7 Å²	146.7	84%	0.838	79%	0.794	S	S	*	*			trans	-107.7	168.3	178.2	40.7	-34.8	0	0	0	116.4
617	G	38.1	Very low	36.4	Very low	71 Å²	71	145.8 Å²	145.8	73%	0.732	80%	0.8	S	S	*	*			trans	163.2	162.5	166.6	0	0	0	0	0	113.1
618	I	38.3	Very low	36.3	Very low	160 Å²	160	143.2 Å²	143.2	82%	0.821	80%	0.799	S	S	*	*			cis	-153.7	147	-8.7	-100.4	162.7	0	0	0	108.4
619	P	37.5	Very low	36.4	Very low	116 Å²	116	143 Å²	143	75%	0.753	80%	0.796	S	S	*	*			trans	-105.4	156.3	-175	39	-35	0	0	0	116
620	R	39.3	Very low	36.4	Very low	225 Å²	225	146.2 Å²	146.2	85%	0.849	79%	0.793	S	S	*	*			trans	-160.7	154.4	167.1	-68.7	-160.7	158.7	165.6	-2.6	110.4
621	H	39.4	Very low	36.7	Very low	153 Å²	153	142.7 Å²	142.7	71%	0.708	78%	0.784	S	S	*	*			cis	-166.3	155	-27.1	-107.9	-55	0	0	0	109.6
622	S	36.8	Very low	36.5	Very low	104 Å²	104	142.3 Å²	142.3	73%	0.727	78%	0.777	S	S	*	*			trans	39.7	121.3	154.9	56	0	0	0	0	120.9
623	A	30.6	Very low	36.6	Very low	97 Å²	97	143.8 Å²	143.8	80%	0.802	77%	0.771	S	S	*	*			cis	87.3	173.9	49.2	0	0	0	0	0	113.9
624	P	39.6	Very low	36.4	Very low	108 Å²	108	145.1 Å²	145.1	70%	0.701	76%	0.762	S	S	*	*				-132	169	-99.1	38.8	-21.4	0	0	0	116.1
625	Q	35.8	Very low	36.3	Very low	195 Å²	195	141.2 Å²	141.2	91%	0.911	75%	0.747	S	S	*	*			trans	-158.2	179.6	157.3	-119.6	159.9	53.3	0	0	114.7
626	Y	29.3	Very low	36.2	Very low	214 Å²	214	140 Å²	140	84%	0.839	74%	0.737	S	S	*	*			trans	-122.1	167	-152.1	-63.3	-105.1	0	0	0	114.7
627	S	32.2	Very low	36.2	Very low	104 Å²	104	140.6 Å²	140.6	73%	0.727	73%	0.729	S	S	*	*			trans	91.1	111.3	138.7	-134.1	0	0	0	0	121.1
628	M	34.2	Very low	35.9	Very low	153 Å²	153	143 Å²	143	75%	0.754	73%	0.734	S	S	*	*				66.4	150.1	122	-66.1	-78.3	-87.2	0	0	123.3
629	M	37.5	Very low	35.4	Very low	153 Å²	153	142.5 Å²	142.5	75%	0.754	73%	0.733	S	S	*	*			trans	82.6	98.3	156.5	-121.4	68.5	83.7	0	0	121
630	Q	36.8	Very low	35.5	Very low	172 Å²	172	142.3 Å²	142.3	80%	0.804	73%	0.732	S	S	*	*				-5.7	172.2	113.8	-100	-164.4	13.6	0	0	119.5
631	P	42	Very low	35.2	Very low	95 Å²	95	135.2 Å²	135.2	62%	0.617	73%	0.729	S	S	*	*			cis	-142.3	-171.6	-9.8	29.7	-5.1	0	0	0	116.3
632	H	33.4	Very low	35	Very low	156 Å²	156	137 Å²	137	72%	0.722	74%	0.737	S	S	*	*				99.1	123.4	127.4	-130.2	49.2	0	0	0	123
633	L	35.5	Very low	35	Very low	126 Å²	126	136.5 Å²	136.5	66%	0.66	74%	0.739	S	S	*	*			trans	59.2	157.1	152.3	-68.3	-179.2	0	0	0	118.2
634	Q	35.7	Very low	35.1	Very low	120 Å²	120	135.3 Å²	135.3	56%	0.561	74%	0.736	S	S	*	*			cis	-156.7	130	34.2	-176.5	71.8	-56.5	0	0	112.4
635	R	33.2	Very low	35.2	Very low	156 Å²	156	135.3 Å²	135.3	59%	0.589	74%	0.736	S	S	*	*				34.4	136.4	127.1	-131.6	176	93.8	-123.1	7.3	118
636	Q	37.7	Very low	35.1	Very low	132 Å²	132	135.3 Å²	135.3	62%	0.617	73%	0.734	S	S	*	*				-178.1	141.4	76.4	-86.5	-174.3	-79.4	0	0	114.1
637	H	36.3	Very low	35.7	Very low	143 Å²	143	130.5 Å²	130.5	66%	0.662	73%	0.728	S	S	*	*			trans	53.6	150.3	141.5	-47.4	-45.2	0	0	0	120.5
638	S	33.4	Very low	35.8	Very low	120 Å²	120	131.4 Å²	131.4	84%	0.839	73%	0.729	S	S	*	*			cis	-154.9	172.7	17.2	-103.8	0	0	0	0	113.5
639	N	27.9	Very low	35.9	Very low	151 Å²	151	130 Å²	130	81%	0.807	73%	0.729	S	S	*	*			trans	-98.2	-173	166.8	-150.3	9.4	0	0	0	109
640	P	39.1	Very low	35.8	Very low	112 Å²	112	128.1 Å²	128.1	73%	0.727	73%	0.731	S	S	*	*			cis	-132.7	175.8	-24.6	41.5	-25.5	0	0	0	115.7
641	G	31.7	Very low	35.8	Very low	75 Å²	75	122.9 Å²	122.9	77%	0.773	72%	0.717	S	S	*	*			trans	103.7	131.2	130.4	0	0	0	0	0	123.4
642	H	36.1	Very low	35.6	Very low	192 Å²	192	127 Å²	127	89%	0.889	73%	0.727	S	S	*	*			trans	67.9	135.5	139.5	-150.7	-87.8	0	0	0	123.4
643	A	36.5	Very low	35.6	Very low	92 Å²	92	126.6 Å²	126.6	76%	0.76	73%	0.731	S	S	*	*			trans	69.1	152.4	170.8	0	0	0	0	0	119.3
644	G	33.4	Very low	35.9	Very low	72 Å²	72	125.2 Å²	125.2	74%	0.742	73%	0.729	S	S	*	*			trans	-109.7	-147.6	178.4	0	0	0	0	0	112.7
645	P	42.2	Very low	36	Very low	108 Å²	108	126.1 Å²	126.1	70%	0.701	74%	0.737	S	S	*	*			cis	-137.4	166.6	10	43.2	-26.7	0	0	0	117.2
646	F	32.7	Very low	36.1	Very low	196 Å²	196	125.7 Å²	125.7	86%	0.86	75%	0.746	S	S	*	*			trans	62.5	171	166.5	-64	-64.2	0	0	0	115.9
647	P	42.2	Very low	36.5	Very low	112 Å²	112	124.7 Å²	124.7	73%	0.727	75%	0.751	S	S	*	*				-128.3	-161.5	-85.4	33.2	-12.1	0	0	0	113.8
648	V	34.9	Very low	36.6	Very low	123 Å²	123	123.6 Å²	123.6	75%	0.745	76%	0.755	S	S	*	*			trans	98.2	92.8	161.1	-172.4	0	0	0	0	118.5
649	V	35.2	Very low	36.7	Very low	124 Å²	124	122.8 Å²	122.8	75%	0.752	75%	0.749	S	S	*	*				69.9	136.5	127.7	174.6	0	0	0	0	122
650	S	36.6	Very low	37.7	Very low	114 Å²	114	121 Å²	121	80%	0.797	75%	0.745	S	S	*	*			trans	72.2	153.9	159.5	-75.3	0	0	0	0	119.9
651	A	35.3	Very low	37.8	Very low	61 Å²	61	121.1 Å²	121.1	50%	0.504	74%	0.744	S	S	.	*			cis	-173.5	163.4	-25.6	0	0	0	0	0	110.4
652	H	38.6	Very low	38.1	Very low	181 Å²	181	123.8 Å²	123.8	84%	0.838	75%	0.746	S	S	*	*			trans	67	156.1	162	-50.5	-46.4	0	0	0	116
653	N	33	Very low	38.2	Very low	149 Å²	149	118.4 Å²	118.4	80%	0.797	73%	0.734	S	S	*	*			cis	-174.4	177.3	-30.2	-132.5	20.4	0	0	0	104.3
654	P	42.2	Very low	38.1	Very low	97 Å²	97	120.1 Å²	120.1	63%	0.63	74%	0.736	S	S	*	*			trans	-134.1	-153.8	-132.9	27.5	0.4	0	0	0	115.1
655	I	38.1	Very low	38.3	Very low	139 Å²	139	124.8 Å²	124.8	71%	0.713	74%	0.74	S	S	*	*			trans	108.2	125.8	146.7	-66.7	161.5	0	0	0	120.3
656	N	34.2	Very low	38.1	Very low	146 Å²	146	123.9 Å²	123.9	78%	0.781	74%	0.742	S	S	*	*			trans	67.9	159	157.5	-80	-13.5	0	0	0	121.5
657	P	46.8	Very low	38.1	Very low	111 Å²	111	122.3 Å²	122.3	72%	0.721	74%	0.743	S	S	*	*			cis	-128	-151	-16.7	28.7	-2.9	0	0	0	111.8
658	T	39.3	Very low	37.7	Very low	121 Å²	121	120.9 Å²	120.9	74%	0.742	74%	0.74	S	S	*	*			cis	-162.5	155.8	5.8	-16	0	0	0	0	113.5
659	S	35.1	Very low	37.8	Very low	103 Å²	103	121.9 Å²	121.9	72%	0.72	74%	0.741	S	S	*	*			trans	-4.2	172.7	141.1	-60.8	0	0	0	0	124.5
660	P	49.4	Very low	38	Very low	112 Å²	112	127.5 Å²	127.5	73%	0.727	75%	0.749	S	S	*	*			cis	-153.2	-179.6	-35.2	43.5	-23.8	0	0	0	119.3
661	T	41.1	Very low	37.8	Very low	115 Å²	115	125.6 Å²	125.6	71%	0.706	75%	0.747	S	S	*	*			trans	69.6	135	147.5	1.3	0	0	0	0	127.3
662	T	37.8	Very low	38.1	Very low	131 Å²	131	128.6 Å²	128.6	80%	0.804	76%	0.761	S	S	*	*			trans	63.7	150.8	145.4	41.8	0	0	0	0	122.5
663	A	37.1	Very low	38	Very low	79 Å²	79	127.1 Å²	127.1	65%	0.653	77%	0.765	S	S	*	*			cis	-174.6	159	-24.7	0	0	0	0	0	113.8
664	T	35.5	Very low	38	Very low	129 Å²	129	125.6 Å²	125.6	79%	0.791	77%	0.766	S	S	*	*			trans	85.7	145.8	154	-18.7	0	0	0	0	121.8
665	M	37.6	Very low	37.9	Very low	170 Å²	170	126.5 Å²	126.5	84%	0.837	77%	0.772	S	S	*	*			trans	101.8	98.8	155.8	-60.1	-61.9	-92.4	0	0	122
666	A	38.1	Very low	37.6	Very low	89 Å²	89	125.5 Å²	125.5	74%	0.736	78%	0.777	S	S	*	*				62.8	104.2	124.7	0	0	0	0	0	124.1
667	N	31.8	Very low	37.4	Very low	163 Å²	163	125.2 Å²	125.2	87%	0.872	78%	0.781	S	S	*	*				62.4	122.1	124.8	-109.1	24.9	0	0	0	124.8
668	A	34.7	Very low	36.5	Very low	82 Å²	82	126.7 Å²	126.7	68%	0.678	79%	0.788	S	S	*	*			trans	91.5	143.9	131.7	0	0	0	0	0	122.8
669	N	36.9	Very low	36.2	Very low	143 Å²	143	125.3 Å²	125.3	77%	0.765	79%	0.789	S	S	*	*			trans	82.7	116.2	163.2	-68.9	-49.9	0	0	0	121.8
670	R	38.2	Very low	35.9	Very low	243 Å²	243	128.2 Å²	128.2	92%	0.917	79%	0.794	S	S	*	*			trans	53.4	129.8	138.9	-63.6	-176.9	174.1	-166.1	-1.5	121.2
671	G	32.9	Very low	35.2	Very low	73 Å²	73	131.5 Å²	131.5	75%	0.753	80%	0.8	S	S	*	*			trans	131.2	129.8	143	0	0	0	0	0	115.1
672	P	40.8	Very low	34.9	Very low	124 Å²	124	133.9 Å²	133.9	81%	0.805	81%	0.808	S	S	*	*			trans	-112.4	136.2	-177.6	37.4	-28.3	0	0	0	114.9
673	T	37.2	Very low	34.7	Very low	150 Å²	150	134.9 Å²	134.9	92%	0.92	81%	0.806	S	S	*	*			trans	-159.3	138.7	144.8	30	0	0	0	0	109.4
674	S	33.2	Very low	34.9	Very low	117 Å²	117	136 Å²	136	82%	0.818	81%	0.807	S	S	*	*			trans	-100.9	-172	-178.4	-28	0	0	0	0	111.1
675	P	39.4	Very low	34.8	Very low	116 Å²	116	134.7 Å²	134.7	75%	0.753	80%	0.803	S	S	*	*			cis	-132.2	165.6	-20.8	38	-22.9	0	0	0	114.1
676	S	32	Very low	34.6	Very low	118 Å²	118	132.9 Å²	132.9	83%	0.825	80%	0.802	S	S	*	*			trans	-166.1	115.3	153.7	-83.3	0	0	0	0	114.6
677	V	31.2	Very low	34.6	Very low	140 Å²	140	134.3 Å²	134.3	85%	0.848	80%	0.801	S	S	*	*			trans	38.9	99.8	147.8	-165.6	0	0	0	0	120.4
678	T	26.9	Very low	34.6	Very low	143 Å²	143	133.4 Å²	133.4	88%	0.877	80%	0.796	S	S	*	*			trans	-157.2	104.9	138.3	37.4	0	0	0	0	110.7
679	A	33.1	Very low	34.9	Very low	92 Å²	92	134 Å²	134	76%	0.76	79%	0.793	S	S	*	*			trans	-175.5	128.6	158.5	0	0	0	0	0	110.9
680	I	30.3	Very low	34.8	Very low	163 Å²	163	135.3 Å²	135.3	84%	0.836	80%	0.795	S	S	*	*			trans	-140.5	72.6	151	-52.2	-177.9	0	0	0	107.9
681	E	33.7	Very low	34.7	Very low	182 Å²	182	130.9 Å²	130.9	85%	0.85	79%	0.789	S	S	*	*			trans	-107.5	139.2	146.2	-72.8	-169.6	132.3	0	0	106.3
682	L	33.8	Very low	34.9	Very low	165 Å²	165	134.8 Å²	134.8	86%	0.864	79%	0.792	S	S	*	*			trans	-123.9	92.9	-177	-76.3	175.8	0	0	0	112.3
683	I	34.9	Very low	34.6	Very low	151 Å²	151	133.8 Å²	133.8	77%	0.774	79%	0.786	S	S	*	*			trans	-115.8	170.8	147.4	21.8	171.9	0	0	0	106.1
684	P	40.5	Very low	34.4	Very low	103 Å²	103	131.3 Å²	131.3	67%	0.669	78%	0.775	S	S	*	*			cis	-133.1	-163	-34.3	36.7	-18.1	0	0	0	111.3
685	S	32.9	Very low	34.5	Very low	101 Å²	101	133.2 Å²	133.2	71%	0.706	78%	0.775	S	S	*	*			trans	65.9	124.8	144.4	-61.5	0	0	0	0	122.7
686	V	33.3	Very low	34.5	Very low	133 Å²	133	133.1 Å²	133.1	81%	0.806	77%	0.774	S	S	*	*			trans	-115.3	120.6	134	-75.7	0	0	0	0	106.2
687	T	38.4	Very low	34.5	Very low	118 Å²	118	135 Å²	135	72%	0.724	78%	0.775	S	S	*	*				58.3	125.8	67	69.1	0	0	0	0	113.3
688	N	31.7	Very low	34.8	Very low	144 Å²	144	135.6 Å²	135.6	77%	0.77	77%	0.772	S	S	*	*			cis	-158.4	148.7	-10.2	-174.5	81.7	0	0	0	107.8
689	P	40.9	Very low	35.3	Very low	95 Å²	95	133.8 Å²	133.8	62%	0.617	76%	0.762	S	S	*	*			trans	-89.6	-171.4	-173.6	36.8	-37.6	0	0	0	114.8
690	E	35	Very low	35.4	Very low	171 Å²	171	135.3 Å²	135.3	80%	0.799	77%	0.765	S	S	*	*			trans	81.6	105.7	161.7	-60.3	-177.7	132.7	0	0	119.3
691	N	36.7	Very low	35.6	Very low	150 Å²	150	135.1 Å²	135.1	80%	0.802	76%	0.764	S	S	*	*			trans	-158.9	91	139.3	-116.6	-92.6	0	0	0	112
692	L	36.3	Very low	35.5	Very low	155 Å²	155	133.8 Å²	133.8	81%	0.812	76%	0.757	S	S	*	*			trans	67.3	159	153.2	-57.7	172.3	0	0	0	119.4
693	P	35.2	Very low	35.6	Very low	103 Å²	103	134.4 Å²	134.4	67%	0.669	76%	0.76	S	S	*	*			cis	-139.4	154.5	-37.5	37.9	-21.7	0	0	0	116.3
694	S	34.1	Very low	35.5	Very low	98 Å²	98	133.7 Å²	133.7	69%	0.685	75%	0.754	S	S	*	*			trans	36.6	124.9	143	70	0	0	0	0	121.2
695	L	34	Very low	35.2	Very low	157 Å²	157	137.1 Å²	137.1	82%	0.822	77%	0.766	S	S	*	*				169.4	174.7	79.1	-83	179.6	0	0	0	108.6
696	P	39.5	Very low	35.4	Very low	113 Å²	113	137 Å²	137	73%	0.734	77%	0.772	S	S	*	*			cis	-124.1	-173.4	-32.9	37.9	-21.3	0	0	0	112.4
697	D	32.4	Very low	35.5	Very low	159 Å²	159	134 Å²	134	85%	0.85	77%	0.767	S	S	*	*			trans	-70.2	151.2	177	-71	-74.7	0	0	0	115.4
698	I	37	Very low	35.1	Very low	152 Å²	152	134.6 Å²	134.6	78%	0.779	78%	0.776	S	S	*	*			trans	-129.8	130.9	158	-61	-179.6	0	0	0	107.7
699	P	38.4	Very low	35.1	Very low	104 Å²	104	132.1 Å²	132.1	68%	0.675	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-73.3	162.7	-176.4	30.5	-36.2	0	0	0	113.3	I701	P699-I701 PolarHBondContact O-N 2.85Å
700	P	34.4	Very low	35.1	Very low	125 Å²	125	131.8 Å²	131.8	81%	0.812	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-68.6	125.9	-176.7	28.2	-35.1	0	0	0	112
701	I	34.4	Very low	35.1	Very low	159 Å²	159	129.5 Å²	129.5	82%	0.815	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-75.3	129	170.1	-63.9	173.7	0	0	0	108.6	P699	P699-I701 PolarHBondContact O-N 2.85Å
702	Q	32.4	Very low	35.1	Very low	153 Å²	153	126.5 Å²	126.5	72%	0.715	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-73.6	128.3	173.3	-72.2	170	-113.6	0	0	109.5	E704	Q702-E704 HydrophobicContact CB-CG 4.39Å; Q702-E704 WeakPolarHBondContact CB-OE1 3.38Å; Q702-E704 PolarHBondContact NE2-OE1 2.84Å
703	L	35.9	Very low	35.2	Very low	178 Å²	178	123.8 Å²	123.8	93%	0.932	73%	0.733	S	S	*	*			trans	-104.2	83.7	176.3	-170.1	71.7	0	0	0	109.6
704	E	32.7	Very low	35.4	Very low	137 Å²	137	124.6 Å²	124.6	64%	0.64	73%	0.732	S	S	*	*			trans	-138.4	144.4	173.7	47.1	-151.4	135.9	0	0	109.6	Q702	Q702-E704 HydrophobicContact CB-CG 4.39Å; Q702-E704 WeakPolarHBondContact CB-OE1 3.38Å; Q702-E704 PolarHBondContact NE2-OE1 2.84Å
705	D	33.9	Very low	35.6	Very low	174 Å²	174	125.8 Å²	125.8	93%	0.93	73%	0.729	S	S	*	*			trans	61.2	79.1	-174.1	-67.6	-19.9	0	0	0	119.3
706	A	36.5	Very low	35.8	Very low	100 Å²	100	120.7 Å²	120.7	83%	0.826	71%	0.707	S	S	*	*			trans	-153.9	85.3	154.5	0	0	0	0	0	115.1	S708	A706-S708 PolarHBondContact O-N 3.21Å
707	G	34.8	Very low	35.8	Very low	68 Å²	68	123.6 Å²	123.6	70%	0.701	70%	0.703	S	S	*	*			trans	56.1	52.8	138.4	0	0	0	0	0	121.1	S709	G707-S709 PolarHBondContact O-N 2.91Å
708	S	31	Very low	36.1	Very low	131 Å²	131	126.1 Å²	126.1	92%	0.916	70%	0.702	S	S	*	*			trans	-72.2	70.7	168.8	58.8	0	0	0	0	112.6	A706	A706-S708 PolarHBondContact O-N 3.21Å
709	S	31.2	Very low	36	Very low	92 Å²	92	125.7 Å²	125.7	64%	0.643	70%	0.7	S	S	*	*			trans	-155.5	55.6	-172.8	65	0	0	0	0	115	G707	G707-S709 PolarHBondContact O-N 2.91Å
710	S	40.5	Very low	35.6	Very low	89 Å²	89	126 Å²	126	62%	0.622	71%	0.705	S	S	*	*	S	Bend	trans	-141.7	-22.8	178.2	63.6	0	0	0	0	117.1
711	L	36.3	Very low	35.5	Very low	123 Å²	123	123.7 Å²	123.7	64%	0.644	70%	0.703	S	S	*	*	S	Bend	trans	-83.7	-45.7	-166.6	-161.5	142.6	0	0	0	113.8	N713 L714 L715	L711-N713 PolarHBondContact O-N 2.81Å; L711-L714 WeakPolarHBondContact O-CB 3.25Å; L711-L714 PolarHBondContact O-N 2.74Å; L711-L715 HydrophobicContact CD2-CD1 4.1Å
712	D	37.3	Very low	35.3	Very low	86 Å²	86	121.8 Å²	121.8	46%	0.46	71%	0.705	S	S	.	*	H	α-helix	trans	-60.3	-37	173.8	-47.9	-107.7	0	0	0	110.5	L714 L715 S716 T847	D712-L714 PolarHBondContact O-N 2.99Å; D712-L715 PolarHBondContact O-N 3.39Å; D712-S716 PolarHBondContact O-N 2.96Å; D712-S716 PolarHBondContact O-OG 2.99Å; D712-T847 PolarHBondContact OD1-OG1 3.47Å
713	N	37.9	Very low	35.3	Very low	98 Å²	98	122.5 Å²	122.5	52%	0.524	71%	0.708	S	S	.	*	H	α-helix	trans	-66	-5.2	174.8	-97.4	-55.1	0	0	0	115.3	L711 R717	L711-N713 PolarHBondContact O-N 2.81Å; N713-R717 PolarHBondContact O-NE 3.47Å; N713-R717 PolarHBondContact O-NH2 3.12Å
714	L	39.1	Very low	35.2	Very low	121 Å²	121	121.5 Å²	121.5	63%	0.634	70%	0.702	S	S	*	*	H	α-helix	trans	-103.8	-25.6	174.5	-135.1	79.2	0	0	0	112.9	L711 D712	L711-L714 WeakPolarHBondContact O-CB 3.25Å; L711-L714 PolarHBondContact O-N 2.74Å; D712-L714 PolarHBondContact O-N 2.99Å
715	L	39.1	Very low	35.6	Very low	122 Å²	122	120.5 Å²	120.5	64%	0.639	71%	0.708	S	S	*	*	H	α-helix	trans	-84.5	-45.1	179.6	-71.3	165.8	0	0	0	111.4	L711 D712 R717 Y718	L711-L715 HydrophobicContact CD2-CD1 4.1Å; D712-L715 PolarHBondContact O-N 3.39Å; L715-R717 PolarHBondContact O-N 3.37Å; L715-Y718 PolarHBondContact O-N 3.26Å
716	S	38.2	Very low	35.6	Very low	51 Å²	51	118.5 Å²	118.5	36%	0.357	70%	0.704	S	S	.	*	G	3₁₀ helix	trans	-63.7	-13.4	176.4	-52.3	0	0	0	0	114	D712 D844	D712-S716 PolarHBondContact O-N 2.96Å; D712-S716 PolarHBondContact O-OG 2.99Å; S716-D844 WeakPolarHBondContact CB-OD2 3.41Å; S716-D844 PolarHBondContact OG-OD2 3.27Å
717	R	39.3	Very low	35.2	Very low	173 Å²	173	122.7 Å²	122.7	65%	0.653	71%	0.707	S	S	*	*	G	3₁₀ helix	trans	-94.1	2.7	-174.4	-120.9	-173.2	-58.9	-170.9	2.3	115.7	N713 L715	N713-R717 PolarHBondContact O-NE 3.47Å; N713-R717 PolarHBondContact O-NH2 3.12Å; L715-R717 PolarHBondContact O-N 3.37Å
718	Y	37.1	Very low	35.2	Very low	212 Å²	212	125.1 Å²	125.1	83%	0.831	71%	0.71	S	S	*	*	G	3₁₀ helix	trans	-109.1	3.9	178.5	-101.8	-86	0	0	0	114.6	L715	L715-Y718 PolarHBondContact O-N 3.26Å
719	I	35.4	Very low	35.4	Very low	143 Å²	143	125 Å²	125	73%	0.733	70%	0.704	S	S	*	*	S	Bend	trans	-110.9	-4.5	-173.4	-61	179.4	0	0	0	112.7
720	S	31.3	Very low	35.5	Very low	112 Å²	112	125.3 Å²	125.3	78%	0.783	71%	0.706	S	S	*	*			trans	-138.6	114.9	177.6	-74.5	0	0	0	0	112.3
721	G	30.8	Very low	35	Very low	75 Å²	75	127 Å²	127	77%	0.773	71%	0.713	S	S	*	*			trans	170.5	51	-177.2	0	0	0	0	0	115.9
722	S	31.3	Very low	35	Very low	120 Å²	120	129.2 Å²	129.2	84%	0.839	72%	0.722	S	S	*	*			trans	-156.2	75	175.1	-78.9	0	0	0	0	114.6
723	H	32.3	Very low	34.8	Very low	168 Å²	168	132 Å²	132	78%	0.778	74%	0.737	S	S	*	*			trans	-166.7	124.5	137.8	57	-85.7	0	0	0	112.4
724	L	32.7	Very low	34.8	Very low	156 Å²	156	132.6 Å²	132.6	82%	0.817	75%	0.746	S	S	*	*			trans	168.2	133.1	130.5	-91.1	161.1	0	0	0	109.8
725	P	40.8	Very low	34.9	Very low	116 Å²	116	131.9 Å²	131.9	75%	0.753	75%	0.751	S	S	*	*			trans	-93.3	162.7	-177.8	37.3	-35	0	0	0	112.9
726	P	34.3	Very low	34.9	Very low	133 Å²	133	132.4 Å²	132.4	86%	0.864	76%	0.762	S	S	*	*			trans	-134.7	174.4	135.3	27.1	-9.3	0	0	0	115
727	Q	28.6	Very low	34.7	Very low	188 Å²	188	133.4 Å²	133.4	88%	0.879	78%	0.78	S	S	*	*			trans	-77.7	170	-170.5	-90.2	-173.2	-7.1	0	0	116
728	P	34.7	Very low	35	Very low	119 Å²	119	131 Å²	131	77%	0.773	79%	0.787	S	S	*	*			trans	-99.1	129.6	-171.5	36.3	-32.9	0	0	0	116.2
729	T	35.1	Very low	34.8	Very low	128 Å²	128	126.4 Å²	126.4	79%	0.785	79%	0.786	S	S	*	*			trans	-147	99.7	159.3	51.1	0	0	0	0	108.5
730	S	32.4	Very low	34.7	Very low	98 Å²	98	122.8 Å²	122.8	69%	0.685	78%	0.777	S	S	*	*				76	130.3	86.3	72.2	0	0	0	0	116.4
731	T	31.6	Very low	34.8	Very low	126 Å²	126	123.6 Å²	123.6	77%	0.773	77%	0.772	S	S	*	*			trans	92.3	119.5	160.4	67	0	0	0	0	121.7
732	M	36.6	Very low	34.9	Very low	168 Å²	168	122.6 Å²	122.6	83%	0.828	75%	0.754	S	S	*	*			trans	59.8	101.5	150	-47.7	-43.6	173.1	0	0	124.2
733	N	31.6	Very low	35.6	Very low	145 Å²	145	120.8 Å²	120.8	78%	0.775	74%	0.739	S	S	*	*				13.5	150.1	106.8	-152.2	41.9	0	0	0	119.2
734	P	37.5	Very low	35.8	Very low	110 Å²	110	116 Å²	116	71%	0.714	74%	0.735	S	S	*	*			cis	-135.3	-172.8	7.1	28.9	-3.3	0	0	0	117.7
735	S	41.2	Very low	36	Very low	107 Å²	107	114.1 Å²	114.1	75%	0.748	74%	0.735	S	S	*	*			trans	-64.9	-163.5	169.2	-30.7	0	0	0	0	114.9
736	P	39.4	Very low	35.8	Very low	132 Å²	132	114.2 Å²	114.2	86%	0.857	74%	0.738	S	S	*	*			cis	-142.3	-169.5	-0.5	44	-24.4	0	0	0	117.2
737	G	33.6	Very low	35.8	Very low	72 Å²	72	110.5 Å²	110.5	74%	0.742	72%	0.724	S	S	*	*			trans	152.4	122.7	152.3	0	0	0	0	0	119.4
738	P	45.7	Very low	36.2	Very low	123 Å²	123	109 Å²	109	80%	0.799	72%	0.721	S	S	*	*			trans	-135.9	-176.5	177.9	43.9	-29.7	0	0	0	116.7
739	S	34.3	Very low	36.2	Very low	116 Å²	116	106.4 Å²	106.4	81%	0.811	71%	0.706	S	S	*	*			trans	137.5	161.2	148.9	-59.3	0	0	0	0	114.7
740	A	32.7	Very low	36.2	Very low	66 Å²	66	106.1 Å²	106.1	55%	0.545	70%	0.7	S	S	.	*			cis	171	154.9	-37.8	0	0	0	0	0	113.1	D1095	A740-D1095 VanDerWaalsContact C-OD1 3.29Å; A740-D1095 VanDerWaalsContact CA-OD1 3.29Å; A740-D1095 WeakPolarHBondContact CA-OD1 3.25Å
741	L	33.3	Very low	36.4	Very low	129 Å²	129	105.7 Å²	105.7	68%	0.675	70%	0.697	S	S	*	*			trans	127.7	169.6	142.7	-68.6	167	0	0	0	120.8	E1094 D1095 D1096	L741-E1094 CarbonylContact C-O 3.53Å; L741-E1094 VanDerWaalsContact C-O 3.25Å; L741-D1095 PolarHBondContact N-OD1 3.11Å; L741-D1095 CarbonylContact O-C 3.52Å; L741-D1095 WeakPolarHBondContact O-CA 3.21Å; L741-D1096 PolarHBondContact O-N 3.28Å
742	S	33.1	Very low	36.7	Very low	55 Å²	55	106 Å²	106	39%	0.385	69%	0.689	S	S	.	*			trans	-130.8	-159.8	-143.3	-39.7	0	0	0	0	115.8	E1094 D1096	S742-E1094 WeakPolarHBondContact CA-O 3.32Å; S742-E1094 WeakPolarHBondContact CB-O 3.47Å; S742-E1094 PolarHBondContact N-O 2.8Å; S742-E1094 PolarHBondContact OG-O 2.93Å; S742-D1096 VanDerWaalsContact C-OD2 3.27Å; S742-D1096 WeakPolarHBondContact CA-OD2 2.86Å
743	P	46.7	Very low	36.7	Very low	81 Å²	81	103.7 Å²	103.7	53%	0.526	68%	0.684	S	S	.	*				-142.8	-168	-67.5	41.2	-21	0	0	0	117.4	E1094 D1096	P743-E1094 HydrophobicContact CB-CB 3.7Å; P743-E1094 HydrophobicContact CB-CG 4.02Å; P743-E1094 WeakPolarHBondContact CB-OE2 3.22Å; P743-D1096 VanDerWaalsContact CA-OD2 3.32Å; P743-D1096 WeakPolarHBondContact CA-OD2 3.33Å
744	G	36.7	Very low	37.2	Very low	67 Å²	67	101.9 Å²	101.9	69%	0.691	68%	0.681	S	S	*	*			trans	164	106.9	137.9	0	0	0	0	0	125.6
745	S	36	Very low	37.2	Very low	117 Å²	117	102.5 Å²	102.5	82%	0.818	68%	0.682	S	S	*	*			trans	71.6	166.3	144.9	-95.2	0	0	0	0	122.1
746	S	36.7	Very low	36.9	Very low	119 Å²	119	108.3 Å²	108.3	83%	0.832	69%	0.688	S	S	*	*			cis	-168.7	174.6	-15.7	-105.6	0	0	0	0	112.2
747	G	34.2	Very low	37.5	Very low	55 Å²	55	108 Å²	108	57%	0.567	69%	0.686	S	S	*	*			trans	-167.1	174.2	179.7	0	0	0	0	0	122.4	R1114	G747-R1114 PolarHBondContact O-NH1 2.84Å
748	L	37.2	Very low	37.9	Very low	155 Å²	155	110.4 Å²	110.4	81%	0.812	69%	0.688	S	S	*	*			trans	-150.4	163.5	-167.6	-61	176.1	0	0	0	113.2
749	S	35.8	Very low	37.6	Very low	66 Å²	66	109.8 Å²	109.8	46%	0.462	69%	0.687	S	S	.	*			cis	-176	158.2	-26.4	-88.1	0	0	0	0	112.8	R1114	S749-R1114 PolarHBondContact OG-NH1 3.09Å
750	N	35.1	Very low	37.8	Very low	122 Å²	122	110.6 Å²	110.6	65%	0.652	69%	0.687	S	S	*	*			trans	70.8	166.9	167.1	-69.3	-58.3	0	0	0	119.4	K1116	N750-K1116 VanDerWaalsContact OD1-CE 3.3Å; N750-K1116 WeakPolarHBondContact OD1-CE 3.26Å; N750-K1116 PolarHBondContact OD1-NZ 2.95Å
751	S	35.4	Very low	38.1	Very low	89 Å²	89	112.9 Å²	112.9	62%	0.622	70%	0.699	S	S	*	*			cis	-172.1	179.9	-37	67.5	0	0	0	0	110
752	H	38.5	Very low	38.5	Very low	133 Å²	133	111.3 Å²	111.3	62%	0.616	70%	0.699	S	S	*	*			cis	-153.8	-153.4	9.5	-131.6	-52.1	0	0	0	113.9	K1116	H752-K1116 PolarHBondContact CD2-NZ 2.66Å; H752-K1116 PolarHBondContact NE2-NZ 3.5Å
753	T	35.8	Very low	38.7	Very low	118 Å²	118	116 Å²	116	72%	0.724	73%	0.725	S	S	*	*			trans	-156	-166.5	-166	56.7	0	0	0	0	111.9
754	P	43.3	Very low	38.4	Very low	107 Å²	107	115.6 Å²	115.6	70%	0.695	74%	0.736	S	S	*	*			cis	-145.1	-162.8	-4.5	42.1	-19.2	0	0	0	118.4
755	V	36	Very low	38.6	Very low	123 Å²	123	118 Å²	118	75%	0.745	74%	0.743	S	S	*	*			trans	80.9	157.2	147.6	140.1	0	0	0	0	122.1
756	R	36.3	Very low	38.7	Very low	229 Å²	229	124.4 Å²	124.4	86%	0.864	75%	0.749	S	S	*	*			cis	-174.1	142.7	-44.5	-105.7	-173.1	-170.1	156.3	0.4	113.6
757	P	50.6	Low	38.7	Very low	126 Å²	126	122.3 Å²	122.3	82%	0.818	75%	0.746	S	S	*	*			trans	-136.4	167.1	175.9	42	-27.9	0	0	0	119.9
758	P	43	Very low	38.9	Very low	122 Å²	122	125.5 Å²	125.5	79%	0.792	76%	0.76	S	S	*	*			trans	-147.1	135.6	-176	40.3	-18.9	0	0	0	123.8
759	S	39.6	Very low	38.6	Very low	110 Å²	110	124.3 Å²	124.3	77%	0.769	76%	0.763	S	S	*	*			trans	41.8	135.5	133	-47	0	0	0	0	131
760	T	38.8	Very low	38.6	Very low	134 Å²	134	124.6 Å²	124.6	82%	0.822	78%	0.776	S	S	*	*				145.8	140	118.9	52.9	0	0	0	0	121.4
761	S	37.7	Very low	38.6	Very low	114 Å²	114	124 Å²	124	80%	0.797	78%	0.781	S	S	*	*			trans	63.9	169.8	148.3	-63.8	0	0	0	0	125.7
762	S	42.1	Very low	38.6	Very low	96 Å²	96	125.9 Å²	125.9	67%	0.671	80%	0.795	S	S	*	*				-174	160.6	-53.4	63	0	0	0	0	117.3
763	T	37.4	Very low	38.4	Very low	152 Å²	152	122.8 Å²	122.8	93%	0.933	80%	0.799	S	S	*	*			trans	82	147.7	160.2	70.8	0	0	0	0	125.6
764	G	40.1	Very low	38.2	Very low	74 Å²	74	128.3 Å²	128.3	76%	0.763	81%	0.806	S	S	*	*			trans	154.3	145.8	166.6	0	0	0	0	0	117.6
765	S	41.1	Very low	37.6	Very low	118 Å²	118	129.1 Å²	129.1	83%	0.825	81%	0.809	S	S	*	*			trans	-153.9	152.8	-168.8	-48.3	0	0	0	0	118.8
766	R	38.1	Very low	37.5	Very low	251 Å²	251	127.5 Å²	127.5	95%	0.947	81%	0.809	S	S	*	*			trans	141.4	133.9	133.2	-82.5	-177.6	159.8	-160.1	-4.9	119.8
767	G	37.6	Very low	37.3	Very low	74 Å²	74	124.2 Å²	124.2	76%	0.763	80%	0.804	S	S	*	*			trans	82	159.5	144	0	0	0	0	0	120.1
768	S	36.9	Very low	36.6	Very low	123 Å²	123	126.7 Å²	126.7	86%	0.86	80%	0.802	S	S	*	*			cis	-163.4	165.3	-16.7	-97.7	0	0	0	0	113.2
769	C	31.3	Very low	36.2	Very low	129 Å²	129	125.7 Å²	125.7	87%	0.872	80%	0.798	S	S	*	*			trans	-55.2	167.8	-167.4	54.5	0	0	0	0	123.2
770	G	35.6	Very low	35.9	Very low	72 Å²	72	124.4 Å²	124.4	74%	0.742	79%	0.794	S	S	*	*			trans	142.6	152.9	155.5	0	0	0	0	0	116.5
771	S	36.5	Very low	35.6	Very low	110 Å²	110	127.1 Å²	127.1	77%	0.769	80%	0.797	S	S	*	*				-169.8	147.4	-79.8	-83.8	0	0	0	0	112.5
772	S	34.1	Very low	35.3	Very low	129 Å²	129	125.8 Å²	125.8	90%	0.902	79%	0.787	S	S	*	*			trans	78.4	143.3	154.5	-57.3	0	0	0	0	123
773	G	33.8	Very low	34.9	Very low	68 Å²	68	131 Å²	131	70%	0.701	80%	0.798	S	S	*	*			trans	120.8	107.1	164.3	0	0	0	0	0	113.9
774	R	32.6	Very low	34.8	Very low	233 Å²	233	132 Å²	132	88%	0.879	79%	0.79	S	S	*	*			cis	71.2	133.4	49.4	-59.7	-174.6	-179.9	-100	2.1	113.5
775	T	30.6	Very low	34.5	Very low	124 Å²	124	134 Å²	134	76%	0.761	79%	0.791	S	S	*	*			cis	-170.6	172.6	-2.8	15.8	0	0	0	0	110.6
776	A	33.3	Very low	34.6	Very low	90 Å²	90	136.1 Å²	136.1	74%	0.744	79%	0.794	S	S	*	*			trans	80.7	156.6	147.7	0	0	0	0	0	121.1
777	E	32.4	Very low	34.3	Very low	160 Å²	160	131.8 Å²	131.8	75%	0.748	78%	0.784	S	S	*	*			cis	-179	176.1	-36.8	-136.5	178.2	-151.5	0	0	112.1
778	K	36.2	Very low	34.2	Very low	178 Å²	178	135.5 Å²	135.5	77%	0.774	79%	0.791	S	S	*	*			trans	75.9	148.7	164.9	-64.9	151.9	-171	174.5	0	117.2
779	S	33.8	Very low	33.8	Very low	101 Å²	101	137.9 Å²	137.9	71%	0.706	79%	0.786	S	S	*	*			cis	-156.2	139.6	-6.5	-103.8	0	0	0	0	107.9
780	A	33.4	Very low	34	Very low	83 Å²	83	138.6 Å²	138.6	69%	0.686	79%	0.786	S	S	*	*				93.1	155.4	57.7	0	0	0	0	0	114.3
781	H	33.5	Very low	33.8	Very low	191 Å²	191	142.2 Å²	142.2	88%	0.884	78%	0.782	S	S	*	*			trans	121.6	149.9	174.5	-71.9	92	0	0	0	114.8
782	S	31.1	Very low	33.6	Very low	85 Å²	85	143.6 Å²	143.6	59%	0.594	78%	0.776	S	S	*	*				-176.9	127	-82.4	178.9	0	0	0	0	113.1
783	F	33.8	Very low	33.7	Very low	205 Å²	205	144.7 Å²	144.7	90%	0.899	77%	0.767	S	S	*	*			trans	-155.8	128.4	155.3	-82.8	-81.1	0	0	0	106
784	K	34.9	Very low	33.8	Very low	175 Å²	175	146.9 Å²	146.9	76%	0.761	77%	0.769	S	S	*	*			cis	75.1	136.6	35.4	-65.4	-169.5	176.4	-175.9	0	115.2
785	S	34.2	Very low	33.8	Very low	114 Å²	114	138.9 Å²	138.9	80%	0.797	76%	0.759	S	S	*	*			cis	173.8	142.9	-26.1	-102.5	0	0	0	0	108.8
786	D	42.3	Very low	34	Very low	164 Å²	164	138.2 Å²	138.2	88%	0.877	76%	0.755	S	S	*	*			trans	-160.3	170.9	138.9	-137.9	-29	0	0	0	113.3
787	Q	32.7	Very low	33.9	Very low	160 Å²	160	141.6 Å²	141.6	75%	0.748	76%	0.755	S	S	*	*			trans	-135.3	149	-177.3	-60.6	-179.7	16.9	0	0	113.3
788	V	36.2	Very low	34	Very low	151 Å²	151	142.8 Å²	142.8	92%	0.915	76%	0.761	S	S	*	*			trans	-134	143.9	148.1	179.9	0	0	0	0	108.7
789	K	28.1	Very low	33.7	Very low	174 Å²	174	142.9 Å²	142.9	76%	0.757	76%	0.764	S	S	*	*			trans	-140	127.2	-164.8	170	-175.4	172.1	-178.5	0	112
790	V	34.9	Very low	33.7	Very low	143 Å²	143	146.1 Å²	146.1	87%	0.867	77%	0.772	S	S	*	*			trans	-121.9	174	170	-167.5	0	0	0	0	109.2
791	K	31.8	Very low	33.4	Very low	148 Å²	148	147.6 Å²	147.6	64%	0.643	78%	0.776	S	S	*	*			trans	-150.5	113.2	-141.8	166.2	-105.9	156.6	-160.1	0	115.6
792	Q	32.1	Very low	33.2	Very low	139 Å²	139	144.1 Å²	144.1	65%	0.65	77%	0.773	S	S	*	*			trans	65.8	167.4	151.5	-65.8	-176.7	-78	0	0	118.1
793	E	36.2	Very low	33.2	Very low	152 Å²	152	149.3 Å²	149.3	71%	0.71	79%	0.785	S	S	*	*			cis	-138.4	170.5	0.5	-108.4	-39.1	67.1	0	0	110.4
794	P	35.6	Very low	33.2	Very low	114 Å²	114	144.6 Å²	144.6	74%	0.74	78%	0.777	S	S	*	*			trans	-112.6	178.6	-176.9	42.5	-34	0	0	0	115.9
795	G	32.4	Very low	33	Very low	66 Å²	66	139.9 Å²	139.9	68%	0.68	78%	0.778	S	S	*	*			trans	132.8	150.2	169.2	0	0	0	0	0	113.1
796	T	34.4	Very low	32.9	Very low	110 Å²	110	139 Å²	139	68%	0.675	78%	0.778	S	S	*	*			cis	-164.3	158.8	-10.3	-22.8	0	0	0	0	108.8
797	E	31.2	Very low	32.3	Very low	161 Å²	161	137.8 Å²	137.8	75%	0.752	78%	0.777	S	S	*	*			trans	44.1	152.4	144.3	78.1	-143.5	143.8	0	0	122.1
798	E	35.2	Very low	32.3	Very low	184 Å²	184	138.6 Å²	138.6	86%	0.86	78%	0.778	S	S	*	*			cis	-139.6	-172	9	-78.2	-170.4	119.8	0	0	112.6
799	E	30.7	Very low	32.1	Very low	180 Å²	180	139.1 Å²	139.1	84%	0.841	77%	0.77	S	S	*	*			trans	-72.1	165.9	-176.6	-45.9	175.7	132.7	0	0	115.9
800	I	33.8	Very low	32.2	Very low	169 Å²	169	138.5 Å²	138.5	87%	0.867	77%	0.77	S	S	*	*				-175.9	143.2	120.3	-95.4	158.1	0	0	0	111.2
801	C	26	Very low	31.9	Very low	115 Å²	115	139.6 Å²	139.6	78%	0.777	76%	0.763	S	S	*	*			trans	-112.3	172.5	-178.2	-85.2	0	0	0	0	114
802	S	29.5	Very low	32	Very low	117 Å²	117	138.3 Å²	138.3	82%	0.818	77%	0.768	S	S	*	*			trans	87	156.4	170.7	-36.7	0	0	0	0	115.1
803	F	32.3	Very low	31.9	Very low	195 Å²	195	139 Å²	139	86%	0.855	77%	0.771	S	S	*	*			cis	-148.5	165.3	8.6	-167.4	-103.3	0	0	0	111.8
804	S	32.6	Very low	31.7	Very low	105 Å²	105	139.6 Å²	139.6	73%	0.734	78%	0.779	S	S	*	*			trans	-84.1	156.9	-176.5	-46.2	0	0	0	0	114.5
805	G	30.6	Very low	31.7	Very low	76 Å²	76	137.6 Å²	137.6	78%	0.784	78%	0.779	S	S	*	*			trans	169.3	81.2	165	0	0	0	0	0	121.2
806	A	32.1	Very low	31.6	Very low	96 Å²	96	144.4 Å²	144.4	79%	0.793	78%	0.784	S	S	*	*			trans	38.4	125.4	139.4	0	0	0	0	0	124.3
807	V	29.1	Very low	31.6	Very low	139 Å²	139	147.9 Å²	147.9	84%	0.842	79%	0.785	S	S	*	*			trans	61.9	118.8	133	-175.9	0	0	0	0	117.7
808	K	33.6	Very low	31.6	Very low	177 Å²	177	145.2 Å²	145.2	77%	0.77	78%	0.784	S	S	*	*				-169	137.7	74.8	-165.2	169.9	178.4	-175.5	0	115
809	Q	31.1	Very low	31.4	Very low	161 Å²	161	139.9 Å²	139.9	75%	0.752	77%	0.772	S	S	*	*			trans	-1.2	133.8	143.8	-165.1	176.5	7.6	0	0	116.8
810	E	32.2	Very low	31.4	Very low	161 Å²	161	135.7 Å²	135.7	75%	0.752	76%	0.761	S	S	*	*				-168.8	132.6	69.6	-173.4	167.7	156.7	0	0	116.3
811	K	28.4	Very low	31.1	Very low	166 Å²	166	135.1 Å²	135.1	72%	0.722	76%	0.757	S	S	*	*			trans	45.6	150.6	143.1	-153.4	-179.7	174.9	-171.3	0	124
812	T	34	Very low	31.6	Very low	121 Å²	121	136.3 Å²	136.3	74%	0.742	76%	0.755	S	S	*	*			trans	94.9	138.4	157.3	-33.2	0	0	0	0	115.1
813	E	29.7	Very low	31.5	Very low	153 Å²	153	134.3 Å²	134.3	72%	0.715	74%	0.741	S	S	*	*			cis	-166.8	150	-34.3	-169.1	155.4	112.3	0	0	107.4
814	D	31.6	Very low	31.1	Very low	166 Å²	166	129.3 Å²	129.3	89%	0.888	73%	0.73	S	S	*	*			trans	59.6	150.7	176.1	-83.5	-25.8	0	0	0	120.4
815	G	35.2	Very low	31.1	Very low	72 Å²	72	130.2 Å²	130.2	74%	0.742	73%	0.733	S	S	*	*			trans	-167.4	-48	-176.2	0	0	0	0	0	117.7
816	R	31.1	Very low	30.9	Very low	209 Å²	209	129.4 Å²	129.4	79%	0.789	71%	0.709	S	S	*	*			trans	68.8	146.3	162.7	-136.9	-175.5	-160.7	-85.8	3.1	119.7
817	R	33.8	Very low	30.7	Very low	182 Å²	182	129.5 Å²	129.5	69%	0.687	70%	0.704	S	S	*	*			trans	80.7	149	162.9	-56	166.6	178.3	-96	0.2	117.8
818	S	30.2	Very low	30.5	Very low	105 Å²	105	128 Å²	128	73%	0.734	70%	0.699	S	S	*	*			cis	-172.6	166.3	-25	-99.3	0	0	0	0	111.1
819	A	31.7	Very low	30.2	Very low	73 Å²	73	125.7 Å²	125.7	60%	0.603	70%	0.695	S	S	*	*			trans	72	148.7	171.9	0	0	0	0	0	116.1	T306	T306-A819 HydrophobicContact CG2-CB 4.32Å
820	C	31.2	Very low	30.3	Very low	91 Å²	91	123.5 Å²	123.5	62%	0.615	69%	0.692	S	S	*	*			cis	-152.1	126.1	-6.3	36.9	0	0	0	0	108
821	M	28.3	Very low	30.3	Very low	157 Å²	157	120.9 Å²	120.9	77%	0.773	69%	0.689	S	S	*	*				72.9	152.5	95.1	-69.2	-64.4	-173.5	0	0	116.3	P182	P182-M821 HydrophobicContact CB-CE 4.49Å; P182-M821 HydrophobicContact CG-CE 4.45Å
822	L	35.8	Very low	30.4	Very low	141 Å²	141	118.6 Å²	118.6	74%	0.738	69%	0.692	S	S	*	*			trans	72.4	108	-166.3	-50.3	179.6	0	0	0	112.9
823	S	26.6	Very low	30	Very low	75 Å²	75	119.7 Å²	119.7	52%	0.524	69%	0.692	S	S	.	*				90.9	128	56.9	-69.2	0	0	0	0	112.7	R205	R205-S823 PolarHBondContact NH2-OG 2.72Å
824	S	25.4	Very low	29.9	Very low	90 Å²	90	117.2 Å²	117.2	63%	0.629	69%	0.692	S	S	*	*			trans	-69.4	154.3	-162.4	-40.5	0	0	0	0	116.7
825	P	32	Very low	29.8	Very low	123 Å²	123	115 Å²	115	80%	0.799	69%	0.685	S	S	*	*				-82.3	125.3	125.7	33.4	-26.5	0	0	0	108.5
826	E	26.9	Very low	29.5	Very low	60 Å²	60	119.1 Å²	119.1	28%	0.28	69%	0.69	S	S	.	*			cis	67.2	76	48.8	-63.9	-150.4	82.3	0	0	115.3	Q202 E203 S828	Q202-E826 VanDerWaalsContact CG-CD 3.43Å; Q202-E826 WeakPolarHBondContact CG-OE1 3.42Å; Q202-E826 WeakPolarHBondContact CG-OE2 3.2Å; Q202-E826 PolarHBondContact NE2-OE2 2.8Å; E203-E826 PolarHBondContact N-OE1 2.7Å; E826-S828 PolarHBondContact O-N 2.83Å
827	S	26.4	Very low	29.5	Very low	97 Å²	97	116.8 Å²	116.8	68%	0.678	69%	0.692	S	S	*	*				30.8	76	112	-49.8	0	0	0	0	117.1
828	S	26.4	Very low	29.2	Very low	107 Å²	107	114.9 Å²	114.9	75%	0.748	69%	0.69	S	S	*	*			trans	-153.3	60.3	170.8	-81.7	0	0	0	0	113.9	E826	E826-S828 PolarHBondContact O-N 2.83Å
829	L	27.3	Very low	29.1	Very low	130 Å²	130	118.1 Å²	118.1	68%	0.681	70%	0.698	S	S	*	*			trans	-133.9	55.6	163.2	-75.8	-179.6	0	0	0	111.9	L926 F936	L829-L926 HydrophobicContact CD1-CD1 4Å; L829-F936 HydrophobicContact CD1-CE2 4.25Å
830	T	31.6	Very low	29	Very low	114 Å²	114	121.6 Å²	121.6	70%	0.699	70%	0.702	S	S	*	*			trans	-82.6	124.8	154.7	46.1	0	0	0	0	108.8
831	P	32.5	Very low	29	Very low	106 Å²	106	122 Å²	122	69%	0.688	71%	0.707	S	S	*	*			trans	-59.4	155.6	155.3	30.3	-34.2	0	0	0	108.6	L833	P831-L833 PolarHBondContact O-N 2.67Å
832	P	29.9	Very low	29.2	Very low	119 Å²	119	122.8 Å²	122.8	77%	0.773	71%	0.708	S	S	*	*			trans	-60.2	110.9	-170.6	23.5	-33.9	0	0	0	111.6	S834	P832-S834 PolarHBondContact O-N 3.13Å
833	L	26.8	Very low	28.9	Very low	144 Å²	144	124.3 Å²	124.3	75%	0.754	72%	0.716	S	S	*	*			trans	-71.1	84.9	163	-79.3	171.6	0	0	0	108	P831 T835	P831-L833 PolarHBondContact O-N 2.67Å; L833-T835 VanDerWaalsContact C-N 3.32Å; L833-T835 PolarHBondContact O-N 2.7Å; L833-T835 PolarHBondContact O-OG1 3Å
834	S	28	Very low	29	Very low	100 Å²	100	125.5 Å²	125.5	70%	0.699	72%	0.716	S	S	*	*			trans	-54.8	93.9	173.2	-63.6	0	0	0	0	110	P832 N836	P832-S834 PolarHBondContact O-N 3.13Å; S834-N836 PolarHBondContact O-N 3.24Å
835	T	28.3	Very low	29.3	Very low	121 Å²	121	126.8 Å²	126.8	74%	0.742	72%	0.721	S	S	*	*			trans	-84.3	65.4	-175.1	-12.2	0	0	0	0	109.1	L833 L837	L833-T835 VanDerWaalsContact C-N 3.32Å; L833-T835 PolarHBondContact O-N 2.7Å; L833-T835 PolarHBondContact O-OG1 3Å; T835-L837 VanDerWaalsContact C-N 3.25Å; T835-L837 PolarHBondContact O-N 3.31Å
836	N	29.3	Very low	29.3	Very low	158 Å²	158	128 Å²	128	85%	0.845	72%	0.72	S	S	*	*			trans	-69.5	88.6	168.9	-84.2	-10.4	0	0	0	108.6	S834 H838	S834-N836 PolarHBondContact O-N 3.24Å; N836-H838 PolarHBondContact O-N 3.07Å; N836-H838 VanDerWaalsContact O-N 3.09Å
837	L	31.7	Very low	29.3	Very low	160 Å²	160	130.1 Å²	130.1	84%	0.838	74%	0.737	S	S	*	*			trans	-71.5	96.5	165.1	-79.7	168.3	0	0	0	108.9	T835	T835-L837 VanDerWaalsContact C-N 3.25Å; T835-L837 PolarHBondContact O-N 3.31Å
838	H	26.8	Very low	29.4	Very low	142 Å²	142	129 Å²	129	66%	0.657	74%	0.741	S	S	*	*			trans	53.7	85.9	137	-162.5	-62	0	0	0	117.1	N836 E840	N836-H838 PolarHBondContact O-N 3.07Å; N836-H838 VanDerWaalsContact O-N 3.09Å; H838-E840 IonicContact CE1-OE2 2.6Å
839	L	28.8	Very low	29.6	Very low	172 Å²	172	132.3 Å²	132.3	90%	0.901	75%	0.749	S	S	*	*			trans	-135.3	138.2	141.6	-165.2	60.1	0	0	0	108.9
840	E	28.5	Very low	29.5	Very low	146 Å²	146	133.7 Å²	133.7	68%	0.682	75%	0.752	S	S	*	*			trans	-102.1	-179.6	-176	-60.3	179.8	109.3	0	0	110.8	H838	H838-E840 IonicContact CE1-OE2 2.6Å
841	S	30.9	Very low	29.4	Very low	101 Å²	101	134 Å²	134	71%	0.706	75%	0.749	S	S	*	*			trans	65.8	145.4	-171.7	-75.6	0	0	0	0	115.8
842	E	32.8	Very low	29.2	Very low	173 Å²	173	138 Å²	138	81%	0.808	76%	0.759	S	S	*	*			cis	-157.6	133.2	-11.1	-117.9	159.6	116.2	0	0	108.1
843	L	30.5	Very low	29.1	Very low	172 Å²	172	137.3 Å²	137.3	90%	0.901	75%	0.752	S	S	*	*			trans	-159.7	79.4	155.8	-169.1	61.6	0	0	0	111.6
844	D	28.3	Very low	29.3	Very low	100 Å²	100	139.6 Å²	139.6	54%	0.535	76%	0.756	S	S	.	*			trans	-145.6	97.5	163	-149.9	-14	0	0	0	109	S716	S716-D844 WeakPolarHBondContact CB-OD2 3.41Å; S716-D844 PolarHBondContact OG-OD2 3.27Å
845	T	31.5	Very low	29.4	Very low	118 Å²	118	138.6 Å²	138.6	72%	0.724	75%	0.746	S	S	*	*			trans	-164.5	104.3	170.1	2	0	0	0	0	112.9
846	L	31.9	Very low	29.5	Very low	147 Å²	147	140.7 Å²	140.7	77%	0.77	75%	0.747	S	S	*	*			trans	69.1	89.1	140.6	-59.1	174.4	0	0	0	119.6	G848	L846-G848 PolarHBondContact O-N 3.01Å
847	T	26.5	Very low	29.8	Very low	105 Å²	105	137.1 Å²	137.1	64%	0.644	73%	0.732	S	S	*	*				-14.4	118.4	110.8	31.6	0	0	0	0	114.9	D712	D712-T847 PolarHBondContact OD1-OG1 3.47Å
848	G	28.4	Very low	29.8	Very low	74 Å²	74	135 Å²	135	76%	0.763	73%	0.727	S	S	*	*			trans	-179.2	128.1	174.7	0	0	0	0	0	117.8	L846	L846-G848 PolarHBondContact O-N 3.01Å
849	L	30.5	Very low	30.1	Very low	177 Å²	177	134.4 Å²	134.4	93%	0.927	73%	0.728	S	S	*	*			trans	64.4	102.4	159.9	-112.6	67.2	0	0	0	122.1
850	E	25.9	Very low	30.3	Very low	158 Å²	158	133.5 Å²	133.5	74%	0.738	72%	0.723	S	S	*	*			trans	-38	159.4	147.4	-85	-178.1	88.4	0	0	119.2
851	N	28.7	Very low	30.4	Very low	120 Å²	120	130.6 Å²	130.6	64%	0.642	72%	0.718	S	S	*	*			trans	58.1	113.1	143.3	-58.9	-26.9	0	0	0	121.1
852	H	30.2	Very low	30.4	Very low	191 Å²	191	134.5 Å²	134.5	88%	0.884	73%	0.725	S	S	*	*				-164.3	168.7	100.5	-118.7	-92	0	0	0	114.6
853	V	27.5	Very low	30.4	Very low	105 Å²	105	130.7 Å²	130.7	64%	0.636	72%	0.718	S	S	*	*			trans	-124.1	138.3	-164	172.1	0	0	0	0	114.9	T855	V853-T855 HydrophobicContact CG1-CG2 4.49Å
854	K	30.2	Very low	30.2	Very low	191 Å²	191	127.6 Å²	127.6	83%	0.83	71%	0.709	S	S	*	*			trans	-161.8	117.8	147.4	-127.8	163.6	-179.3	177	0	109.4
855	T	30.4	Very low	30.3	Very low	79 Å²	79	130.6 Å²	130.6	49%	0.485	72%	0.718	S	S	.	*				57.8	131.5	67.1	55.3	0	0	0	0	113.7	V853	V853-T855 HydrophobicContact CG1-CG2 4.49Å
856	E	30.8	Very low	30.2	Very low	165 Å²	165	132.5 Å²	132.5	77%	0.771	72%	0.718	S	S	*	*			cis	-167	-171.5	5.7	-115.8	-148.5	144.1	0	0	109.5
857	P	35.2	Very low	30.1	Very low	83 Å²	83	131 Å²	131	54%	0.539	72%	0.72	S	S	.	*			cis	-138.8	-162.9	-45.9	39	-19.3	0	0	0	114.7
858	T	30.5	Very low	30.1	Very low	117 Å²	117	129.1 Å²	129.1	72%	0.718	72%	0.722	S	S	*	*			trans	70.4	147.9	155.7	43.9	0	0	0	0	119.2
859	D	33.9	Very low	30	Very low	129 Å²	129	133.7 Å²	133.7	69%	0.69	73%	0.728	S	S	*	*			cis	-155.3	153.6	10.8	-124.7	-17.7	0	0	0	114.9
860	I	33.9	Very low	29.9	Very low	153 Å²	153	129.3 Å²	129.3	79%	0.785	71%	0.712	S	S	*	*			trans	39.9	158.1	153.4	79.4	-176.5	0	0	0	122.9
861	S	30.9	Very low	29.9	Very low	84 Å²	84	128.6 Å²	128.6	59%	0.587	71%	0.713	S	S	*	*			cis	-156.5	150.3	-5.7	87.3	0	0	0	0	111.5
862	E	30.3	Very low	29.9	Very low	183 Å²	183	130.3 Å²	130.3	86%	0.855	72%	0.721	S	S	*	*			trans	52.3	158.1	138.4	-63.9	175.9	107.4	0	0	122.1
863	S	32.2	Very low	29.9	Very low	94 Å²	94	126.6 Å²	126.6	66%	0.657	71%	0.712	S	S	*	*			cis	-165.3	118.5	-14.1	154.5	0	0	0	0	106.8
864	C	27	Very low	29.9	Very low	106 Å²	106	128 Å²	128	72%	0.716	72%	0.716	S	S	*	*				85.1	147.1	79.9	-158.4	0	0	0	0	115.6
865	K	29.8	Very low	29.9	Very low	163 Å²	163	122.6 Å²	122.6	71%	0.709	71%	0.714	S	S	*	*			trans	79.9	143	167.1	-55	-174.2	-178.4	-177.9	0	118.2
866	Q	29.6	Very low	29.8	Very low	158 Å²	158	127.1 Å²	127.1	74%	0.738	73%	0.727	S	S	*	*			cis	-164.4	161.6	-18.2	-119.9	161.2	-14	0	0	110.8
867	S	28.9	Very low	29.8	Very low	116 Å²	116	125 Å²	125	81%	0.811	73%	0.73	S	S	*	*			trans	35.1	135.5	148.9	-50.1	0	0	0	0	121.7
868	G	27.3	Very low	29.6	Very low	65 Å²	65	126.9 Å²	126.9	67%	0.67	74%	0.743	S	S	*	*			cis	131	161.4	0	0	0	0	0	0	113.3
869	L	27.3	Very low	29.6	Very low	171 Å²	171	129.1 Å²	129.1	90%	0.895	75%	0.748	S	S	*	*			trans	69.6	147.1	170.1	-48.1	174.9	0	0	0	116.4
870	S	26.7	Very low	29.4	Very low	85 Å²	85	134.2 Å²	134.2	59%	0.594	76%	0.758	S	S	*	*			cis	-169.8	169.1	-19.5	-103.2	0	0	0	0	111.1
871	N	26.5	Very low	29.1	Very low	142 Å²	142	134 Å²	134	76%	0.759	76%	0.759	S	S	*	*			trans	76.4	124.7	159.9	-55	-25.1	0	0	0	117.1
872	L	28.6	Very low	29.2	Very low	156 Å²	156	137.4 Å²	137.4	82%	0.817	77%	0.769	S	S	*	*			cis	66	133.8	32.1	-61.8	170.9	0	0	0	113.7
873	V	29.7	Very low	29.1	Very low	114 Å²	114	137.2 Å²	137.2	69%	0.691	77%	0.77	S	S	*	*			cis	-151.2	168.6	-1.6	-148.4	0	0	0	0	110.1
874	N	28.2	Very low	29	Very low	135 Å²	135	140.7 Å²	140.7	72%	0.722	78%	0.776	S	S	*	*			trans	75.8	142.8	141.1	-95	-38.4	0	0	0	122.9
875	G	29.4	Very low	29.2	Very low	76 Å²	76	146.9 Å²	146.9	78%	0.784	78%	0.784	S	S	*	*			trans	-173.7	83.8	165.9	0	0	0	0	0	112.2
876	K	28.2	Very low	29.2	Very low	175 Å²	175	143.3 Å²	143.3	76%	0.761	78%	0.78	S	S	*	*			trans	-76.6	151.4	-177.1	-64.9	175.5	179.3	176.3	0	112.4
877	S	30.7	Very low	29.2	Very low	120 Å²	120	140.6 Å²	140.6	84%	0.839	79%	0.785	S	S	*	*			trans	-152.3	158.6	163.1	-83.7	0	0	0	0	111
878	P	32.8	Very low	29.5	Very low	123 Å²	123	146.4 Å²	146.4	80%	0.799	79%	0.789	S	S	*	*			trans	-97.3	162.3	-145.4	36.1	-37.2	0	0	0	116.5
879	I	29.4	Very low	29.9	Very low	163 Å²	163	152 Å²	152	84%	0.836	80%	0.801	S	S	*	*			trans	-53	136.8	167.1	-62.8	165.1	0	0	0	111.2
880	R	30.4	Very low	30.1	Very low	237 Å²	237	147.7 Å²	147.7	89%	0.894	80%	0.798	S	S	*	*			trans	-150.1	130.9	157	-158.2	174.6	-162.8	161.3	6.6	111.5
881	N	28.1	Very low	30.2	Very low	149 Å²	149	147.1 Å²	147.1	80%	0.797	81%	0.806	S	S	*	*			trans	-60.8	139.6	-175.8	-45.8	3.2	0	0	0	112.1
882	L	31.4	Very low	30.5	Very low	155 Å²	155	148.8 Å²	148.8	81%	0.812	82%	0.815	S	S	*	*			trans	-149.8	73.3	154.7	-169.3	59.1	0	0	0	112.3
883	M	28.8	Very low	30.9	Very low	178 Å²	178	144.6 Å²	144.6	88%	0.877	81%	0.81	S	S	*	*			trans	-102.3	88.4	157.7	-79	-72.6	174.5	0	0	107.8
884	H	30.5	Very low	31.1	Very low	168 Å²	168	147.2 Å²	147.2	78%	0.778	82%	0.82	S	S	*	*			trans	168.1	148.3	154.6	-91	-39.8	0	0	0	112.9
885	R	30.5	Very low	31.7	Very low	235 Å²	235	144.6 Å²	144.6	89%	0.887	81%	0.812	S	S	*	*			trans	68.6	144.8	166.4	-71.9	-176.4	176.8	-174.1	-1.8	116.3
886	S	30.2	Very low	32.1	Very low	89 Å²	89	150.1 Å²	150.1	62%	0.622	81%	0.814	S	S	*	*			cis	-155.7	145.8	0.9	-125.7	0	0	0	0	111.6
887	A	29.6	Very low	33	Very low	101 Å²	101	148.7 Å²	148.7	84%	0.835	82%	0.815	S	S	*	*			trans	-56.8	139.6	158.5	0	0	0	0	0	110.4
888	R	35.8	Very low	34.1	Very low	238 Å²	238	149.6 Å²	149.6	90%	0.898	81%	0.81	S	S	*	*			trans	-138.9	145	166.6	-74.8	-166.3	173.3	-167.6	-1.3	109.6
889	I	34.7	Very low	35.8	Very low	182 Å²	182	149.3 Å²	149.3	93%	0.933	80%	0.802	S	S	*	*			trans	-94.4	142	-168	-63	161.2	0	0	0	110.1
890	G	30.9	Very low	38.4	Very low	80 Å²	80	146.6 Å²	146.6	83%	0.825	80%	0.795	S	S	*	*			trans	115.7	120.2	157.5	0	0	0	0	0	115.5
891	G	30.7	Very low	41.1	Very low	74 Å²	74	136.8 Å²	136.8	76%	0.763	76%	0.761	S	S	*	*			trans	144.2	106	172.8	0	0	0	0	0	112
892	D	32.6	Very low	43.9	Very low	176 Å²	176	132.9 Å²	132.9	94%	0.941	74%	0.738	S	S	*	*			trans	-67.1	137.2	-176.5	-54.4	-88.7	0	0	0	113.3
893	G	35.5	Very low	46.6	Very low	69 Å²	69	131.6 Å²	131.6	71%	0.711	73%	0.731	S	S	*	*			trans	-179.2	90.6	179.2	0	0	0	0	0	112.7	S895	G893-S895 PolarHBondContact O-N 2.63Å
894	N	33.7	Very low	49.7	Very low	169 Å²	169	128.9 Å²	128.9	90%	0.904	71%	0.711	S	S	*	*			trans	-67.7	98.4	178.5	179.8	51.2	0	0	0	111.3
895	S	41.1	Very low	52.8	Low	79 Å²	79	120.9 Å²	120.9	55%	0.552	67%	0.674	S	S	*	*			trans	-122.4	149.3	173.1	-168.8	0	0	0	0	108.9	G893	G893-S895 PolarHBondContact O-N 2.63Å
896	K	37.9	Very low	55.8	Low	193 Å²	193	109.9 Å²	109.9	84%	0.839	63%	0.634	S	S	*	*			trans	-141.2	29.5	-168.1	-146.2	176.3	-176.9	-178.8	0	113.6
897	D	47.5	Very low	58.9	Low	145 Å²	145	106.5 Å²	106.5	78%	0.775	61%	0.609	S	S	*	*			trans	-135.3	19.4	-161.7	-56.3	-91.6	0	0	0	112.6
898	D	53.6	Low	61.9	Low	138 Å²	138	103.8 Å²	103.8	74%	0.738	58%	0.583	S	S	*	*			trans	-111.1	101.5	-176.3	-65.5	-88.8	0	0	0	111.2
899	D	69.5	Low	64.4	Low	117 Å²	117	97.7 Å²	97.7	63%	0.626	57%	0.565	S	S	*	*			trans	-73.8	130.7	163.8	-170.5	-40.6	0	0	0	108.8	N901	D899-N901 PolarHBondContact O-N 3.01Å; D899-N901 WeakPolarHBondContact OD1-CB 3.36Å; D899-N901 PolarHBondContact OD1-N 3.44Å
900	P	83.6	Confident	67	Low	106 Å²	106	93.6 Å²	93.6	69%	0.688	55%	0.545	S	S	*	.	S	Bend	trans	-72.4	-5.4	179.6	30.9	-37.6	0	0	0	114.9	P921	P900-P921 WeakPolarHBondContact O-CA 3.5Å; P900-P921 WeakPolarHBondContact O-CB 3.25Å
901	N	86.3	Confident	69.6	Low	32 Å²	32	91.4 Å²	91.4	17%	0.171	52%	0.522	C	S	.	.	S	Bend	trans	-95.8	154.3	-176.6	-75.8	100	0	0	0	114.4	D899 C916 C917 C920 P921 V923	D899-N901 PolarHBondContact O-N 3.01Å; D899-N901 WeakPolarHBondContact OD1-CB 3.36Å; D899-N901 PolarHBondContact OD1-N 3.44Å; N901-C916 HydrophobicContact CB-CB 4.31Å; N901-C917 PolarHBondContact ND2-O 2.82Å; N901-C917 VanDerWaalsContact ND2-O 3.12Å; N901-C920 PolarHBondContact ND2-O 3.2Å; N901-P921 CarbonylContact C-O 3.57Å; N901-P921 WeakPolarHBondContact CA-O 3.41Å; N901-P921 VanDerWaalsContact ND2-C 3.26Å; N901-P921 PolarHBondContact ND2-O 2.84Å; N901-P921 VanDerWaalsContact ND2-O 3.13Å; N901-V923 HydrophobicContact CB-CG1 3.72Å
902	E	87.8	Confident	72.3	Confident	67 Å²	67	90.6 Å²	90.6	31%	0.313	52%	0.515	S	S	.	.			trans	-72.9	133.9	177.3	-72.5	157.7	-170.3	0	0	110.9	W904 P921 K922 V923	E902-W904 PolarHBondContact O-N 3.17Å; E902-P921 WeakPolarHBondContact CB-O 3.4Å; E902-P921 HydrophobicContact CG-CB 4.16Å; E902-P921 PolarHBondContact N-O 2.76Å; E902-K922 IonicContact OE1-NZ 3.68Å; E902-K922 PolarHBondContact OE1-NZ 2.83Å; E902-K922 IonicContact OE2-NZ 4Å; E902-K922 PolarHBondContact OE2-NZ 3.14Å; E902-V923 VanDerWaalsContact O-CG1 3.22Å; E902-V923 WeakPolarHBondContact O-CG1 3.29Å; E902-V923 WeakPolarHBondContact O-CG2 3.22Å
903	D	88.7	Confident	75	Confident	127 Å²	127	88.4 Å²	88.4	68%	0.679	50%	0.503	S	S	*	.	S	Bend	trans	-66.8	-5.7	176.4	-59.1	-79.3	0	0	0	115	L914	D903-L914 VanDerWaalsContact O-CD1 3.26Å; D903-L914 WeakPolarHBondContact O-CD1 3.38Å
904	W	92.2	Very high	77.6	Confident	122 Å²	122	87 Å²	87	46%	0.462	48%	0.479	S	S	.	.	S	Bend	trans	-129.9	134.4	-164.7	-52.6	94.5	0	0	0	111.1	E902 A906 V923	E902-W904 PolarHBondContact O-N 3.17Å; W904-A906 PolarHBondContact O-N 3.48Å; W904-V923 VanDerWaalsContact O-CG2 3.29Å; W904-V923 WeakPolarHBondContact O-CG2 3.48Å
905	C	95.3	Very high	80.4	Confident	0 Å²	0	79.8 Å²	79.8	0%	0	44%	0.44	C	S	.	.	B	Isolated β-bridge	trans	-60.8	123.1	178.4	174.7	0	0	0	0	111.3	V907 C908 Q909 N910 L914 V923 H925	C905-V907 PolarHBondContact O-N 3.25Å; C905-C908 PolarHBondContact O-N 2.77Å; C905-Q909 WeakPolarHBondContact O-CA 3.19Å; C905-Q909 PolarHBondContact O-N 3.41Å; C905-N910 WeakPolarHBondContact CB-O 3.45Å; C905-N910 PolarHBondContact N-O 3.43Å; C905-L914 HydrophobicContact CB-CD2 3.67Å; C905-V923 WeakPolarHBondContact CA-O 3.41Å; C905-H925 WeakPolarHBondContact CB-ND1 3.29Å
906	A	94.3	Very high	82.9	Confident	4 Å²	4	78.8 Å²	78.8	3%	0.033	43%	0.432	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-1.6	-175.2	0	0	0	0	0	115.8	W904 K922 V923 F924 C990	W904-A906 PolarHBondContact O-N 3.48Å; A906-K922 HydrophobicContact CB-CB 4.25Å; A906-K922 HydrophobicContact CB-CD 3.79Å; A906-K922 HydrophobicContact CB-CG 4.47Å; A906-V923 PolarHBondContact N-O 3.12Å; A906-F924 HydrophobicContact CB-CE1 4.06Å; A906-F924 HydrophobicContact CB-CZ 4.22Å; A906-C990 WeakPolarHBondContact O-CA 3.27Å; A906-C990 WeakPolarHBondContact O-CB 3.46Å; A906-C990 PolarHBondContact O-SG 3.24Å; A906-C990 VanDerWaalsContact O-SG 3.37Å
907	V	94.4	Very high	85.5	Confident	17 Å²	17	69.7 Å²	69.7	10%	0.103	39%	0.393	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.8	-52.4	175.4	170.1	0	0	0	0	111.7	C905 F924 C928 L986 Y989 C990	C905-V907 PolarHBondContact O-N 3.25Å; V907-F924 HydrophobicContact CG2-CD1 4.12Å; V907-F924 HydrophobicContact CG2-CE1 4.14Å; V907-C928 HydrophobicContact CB-CB 4.07Å; V907-C928 HydrophobicContact CG1-CB 4.22Å; V907-L986 HydrophobicContact CG2-CD1 3.92Å; V907-Y989 HydrophobicContact CG1-CD1 3.92Å; V907-Y989 HydrophobicContact CG1-CG 4.32Å; V907-C990 VanDerWaalsContact CG2-SG 3.57Å
908	C	92.8	Very high	87.6	Confident	44 Å²	44	67.8 Å²	67.8	30%	0.297	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103	-5.1	-172.3	72.7	0	0	0	0	114.2	C905 N910 H925	C905-C908 PolarHBondContact O-N 2.77Å; C908-N910 PolarHBondContact O-N 3.48Å; C908-N910 PolarHBondContact O-ND2 3.15Å; C908-H925 VanDerWaalsContact SG-CE1 3.53Å; C908-H925 PolarHBondContact SG-ND1 3.01Å; C908-H925 VanDerWaalsContact SG-ND1 3.44Å
909	Q	89.7	Confident	89.5	Confident	110 Å²	110	66.9 Å²	66.9	51%	0.514	37%	0.369	S	S	.	.			trans	56.6	24.1	-178	-54	-67	2.4	0	0	114.9	C905	C905-Q909 WeakPolarHBondContact O-CA 3.19Å; C905-Q909 PolarHBondContact O-N 3.41Å
910	N	88.3	Confident	90.6	Very high	97 Å²	97	62.8 Å²	62.8	52%	0.519	35%	0.349	S	S	.	.			trans	-108.8	152.4	174.7	-65.1	-73.8	0	0	0	111.4	C905 C908 H925	C905-N910 WeakPolarHBondContact CB-O 3.45Å; C905-N910 PolarHBondContact N-O 3.43Å; C908-N910 PolarHBondContact O-N 3.48Å; C908-N910 PolarHBondContact O-ND2 3.15Å; N910-H925 PolarHBondContact O-CE1 3.37Å
911	G	87.1	Confident	91.2	Very high	33 Å²	33	60.6 Å²	60.6	34%	0.34	34%	0.335	S	S	.	.			trans	-78.3	-175.1	171	0	0	0	0	0	113.1	H925	G911-H925 PolarHBondContact O-CE1 2.85Å; G911-H925 PolarHBondContact O-NE2 3.18Å
912	G	86	Confident	91.5	Very high	58 Å²	58	62 Å²	62	60%	0.598	34%	0.34	S	S	*	.	S	Bend	trans	137	-150.9	173.1	0	0	0	0	0	112.7	L914	G912-L914 WeakPolarHBondContact O-CG 3.18Å; G912-L914 PolarHBondContact O-N 3.07Å; G912-L914 VanDerWaalsContact O-N 3.14Å
913	D	88.8	Confident	91.9	Very high	130 Å²	130	58.9 Å²	58.9	70%	0.695	33%	0.325	S	S	*	.	S	Bend	trans	-74.3	100.2	170.6	-57.7	-52.7	0	0	0	109.4	H925 F936	D913-H925 PolarHBondContact O-CD2 3.37Å; D913-F936 HydrophobicContact CB-CE1 4.48Å; D913-F936 HydrophobicContact CB-CZ 3.76Å
914	L	91.7	Very high	92.3	Very high	40 Å²	40	52.9 Å²	52.9	21%	0.209	29%	0.293	C	S	.	.			trans	-112.1	139.4	-169.3	-66.7	166.2	0	0	0	111.4	D903 C905 G912 V923 H925	D903-L914 VanDerWaalsContact O-CD1 3.26Å; D903-L914 WeakPolarHBondContact O-CD1 3.38Å; C905-L914 HydrophobicContact CB-CD2 3.67Å; G912-L914 WeakPolarHBondContact O-CG 3.18Å; G912-L914 PolarHBondContact O-N 3.07Å; G912-L914 VanDerWaalsContact O-N 3.14Å; L914-V923 HydrophobicContact CB-CB 4.17Å; L914-V923 HydrophobicContact CB-CG2 4.07Å; L914-V923 HydrophobicContact CD1-CG2 3.86Å; L914-V923 HydrophobicContact CD2-CG2 4.06Å; L914-V923 HydrophobicContact CG-CG2 4.21Å; L914-H925 WeakPolarHBondContact CD2-NE2 3.27Å
915	L	91.5	Very high	92.4	Very high	17 Å²	17	48.6 Å²	48.6	9%	0.089	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	108.8	178.3	-167.9	66.6	0	0	0	110	V923 F924 L926 L933 F936 P937 W941	L915-V923 WeakPolarHBondContact O-CA 3.05Å; L915-F924 VanDerWaalsContact CB-O 3.27Å; L915-F924 WeakPolarHBondContact CB-O 3.07Å; L915-F924 PolarHBondContact N-O 3.37Å; L915-F924 PolarHBondContact O-N 3.02Å; L915-F924 VanDerWaalsContact O-N 3.12Å; L915-L926 HydrophobicContact CD2-CD2 4.2Å; L915-L933 HydrophobicContact CD2-CD1 3.54Å; L915-F936 HydrophobicContact CD1-CD1 3.99Å; L915-P937 HydrophobicContact CD1-CG 3.89Å; L915-P937 HydrophobicContact CD2-CG 3.96Å; L915-W941 HydrophobicContact CB-CZ3 4.31Å; L915-W941 HydrophobicContact CD2-CD2 3.53Å; L915-W941 VanDerWaalsContact CD2-CE2 3.47Å; L915-W941 HydrophobicContact CD2-CE3 3.77Å; L915-W941 HydrophobicContact CD2-CG 4.1Å; L915-W941 HydrophobicContact CD2-CH2 3.84Å; L915-W941 HydrophobicContact CD2-CZ2 3.64Å; L915-W941 HydrophobicContact CD2-CZ3 3.91Å; L915-W941 HydrophobicContact CG-CD2 3.8Å; L915-W941 HydrophobicContact CG-CE3 3.59Å; L915-W941 HydrophobicContact CG-CG 4.37Å; L915-W941 HydrophobicContact CG-CH2 4.24Å; L915-W941 HydrophobicContact CG-CZ2 4.46Å; L915-W941 HydrophobicContact CG-CZ3 3.82Å
916	C	93.3	Very high	92.3	Very high	58 Å²	58	49.3 Å²	49.3	39%	0.392	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	130.9	-177.1	-60.9	0	0	0	0	112.2	N901 V923	N901-C916 HydrophobicContact CB-CB 4.31Å; C916-V923 HydrophobicContact CB-CG1 4.27Å
917	C	94.2	Very high	92.3	Very high	1 Å²	1	53.6 Å²	53.6	1%	0.007	31%	0.308	C	S	.	.			trans	-87.6	127.9	173.8	178.2	0	0	0	0	110.4	N901 K919 K922 W941 C943	N901-C917 PolarHBondContact ND2-O 2.82Å; N901-C917 VanDerWaalsContact ND2-O 3.12Å; C917-K919 VanDerWaalsContact C-N 3.31Å; C917-K919 PolarHBondContact O-N 3.07Å; C917-K922 VanDerWaalsContact CB-O 3.24Å; C917-K922 WeakPolarHBondContact CB-O 3.44Å; C917-K922 PolarHBondContact N-O 3.17Å; C917-W941 HydrophobicContact CB-CE3 4.32Å; C917-W941 HydrophobicContact CB-CZ3 4.05Å; C917-C943 HydrophobicContact CB-CB 4.15Å; C917-C943 PolarHBondContact SG-N 3.18Å; C917-C943 VanDerWaalsContact SG-N 3.39Å
918	E	91.4	Very high	92.3	Very high	105 Å²	105	53.9 Å²	53.9	49%	0.491	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-26.4	180	-62.2	-178.8	147.9	0	0	114.4	D940 W941 I942	E918-D940 VanDerWaalsContact OE1-CA 3.25Å; E918-D940 WeakPolarHBondContact OE1-CA 3.2Å; E918-D940 VanDerWaalsContact OE1-CB 3.28Å; E918-D940 WeakPolarHBondContact OE1-CB 3.5Å; E918-W941 PolarHBondContact N-O 2.69Å; E918-W941 VanDerWaalsContact N-O 3.1Å; E918-I942 HydrophobicContact CB-CG2 4.39Å
919	K	92.4	Very high	92.4	Very high	119 Å²	119	51.8 Å²	51.8	52%	0.517	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.3	-5.2	-170.4	-65.8	-169.8	-164.3	-22.2	0	114	C917 I942 C946	C917-K919 VanDerWaalsContact C-N 3.31Å; C917-K919 PolarHBondContact O-N 3.07Å; K919-I942 HydrophobicContact CB-CG2 4.29Å; K919-I942 HydrophobicContact CD-CD1 4.4Å; K919-I942 HydrophobicContact CD-CG2 3.86Å; K919-I942 HydrophobicContact CG-CG2 3.67Å; K919-C946 HydrophobicContact CB-CB 3.75Å; K919-C946 HydrophobicContact CD-CB 4.39Å
920	C	93.8	Very high	92.6	Very high	32 Å²	32	46.6 Å²	46.6	22%	0.216	27%	0.272	C	S	.	.	S	Bend	trans	-160.4	157	176.7	74.7	0	0	0	0	109.4	N901 K922 C946	N901-C920 PolarHBondContact ND2-O 3.2Å; C920-K922 PolarHBondContact O-N 2.92Å; C920-C946 PolarHBondContact SG-SG 2.72Å
921	P	94.4	Very high	92.9	Very high	60 Å²	60	42.9 Å²	42.9	39%	0.39	25%	0.253	S	S	.	.	S	Bend	trans	-65.4	-5.2	-174	29.5	-39.1	0	0	0	114.2	P900 N901 E902	P900-P921 WeakPolarHBondContact O-CA 3.5Å; P900-P921 WeakPolarHBondContact O-CB 3.25Å; N901-P921 CarbonylContact C-O 3.57Å; N901-P921 WeakPolarHBondContact CA-O 3.41Å; N901-P921 VanDerWaalsContact ND2-C 3.26Å; N901-P921 PolarHBondContact ND2-O 2.84Å; N901-P921 VanDerWaalsContact ND2-O 3.13Å; E902-P921 WeakPolarHBondContact CB-O 3.4Å; E902-P921 HydrophobicContact CG-CB 4.16Å; E902-P921 PolarHBondContact N-O 2.76Å
922	K	94.2	Very high	93.1	Very high	62 Å²	62	42.9 Å²	42.9	27%	0.27	25%	0.246	S	C	.	.			trans	-75.2	139.7	-169.7	-56.9	-139.6	145.8	-58.7	0	113.3	E902 A906 C917 C920 F924 F945	E902-K922 IonicContact OE1-NZ 3.68Å; E902-K922 PolarHBondContact OE1-NZ 2.83Å; E902-K922 IonicContact OE2-NZ 4Å; E902-K922 PolarHBondContact OE2-NZ 3.14Å; A906-K922 HydrophobicContact CB-CB 4.25Å; A906-K922 HydrophobicContact CB-CD 3.79Å; A906-K922 HydrophobicContact CB-CG 4.47Å; C917-K922 VanDerWaalsContact CB-O 3.24Å; C917-K922 WeakPolarHBondContact CB-O 3.44Å; C917-K922 PolarHBondContact N-O 3.17Å; C920-K922 PolarHBondContact O-N 2.92Å; K922-F924 HydrophobicContact CB-CE2 3.78Å; K922-F924 HydrophobicContact CB-CZ 3.97Å; K922-F945 HydrophobicContact CD-CD2 4.45Å; K922-F945 HydrophobicContact CD-CE2 4.32Å
923	V	95.7	Very high	93.4	Very high	1 Å²	1	40.6 Å²	40.6	1%	0.006	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	154.5	177.4	-48	0	0	0	0	111.7	N901 E902 W904 C905 A906 L914 L915 C916	N901-V923 HydrophobicContact CB-CG1 3.72Å; E902-V923 VanDerWaalsContact O-CG1 3.22Å; E902-V923 WeakPolarHBondContact O-CG1 3.29Å; E902-V923 WeakPolarHBondContact O-CG2 3.22Å; W904-V923 VanDerWaalsContact O-CG2 3.29Å; W904-V923 WeakPolarHBondContact O-CG2 3.48Å; C905-V923 WeakPolarHBondContact CA-O 3.41Å; A906-V923 PolarHBondContact N-O 3.12Å; L914-V923 HydrophobicContact CB-CB 4.17Å; L914-V923 HydrophobicContact CB-CG2 4.07Å; L914-V923 HydrophobicContact CD1-CG2 3.86Å; L914-V923 HydrophobicContact CD2-CG2 4.06Å; L914-V923 HydrophobicContact CG-CG2 4.21Å; L915-V923 WeakPolarHBondContact O-CA 3.05Å; C916-V923 HydrophobicContact CB-CG1 4.27Å
924	F	96.1	Very high	93.4	Very high	1 Å²	1	37.6 Å²	37.6	0%	0.004	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	138.6	-173.9	-56.6	-93.8	0	0	0	112.9	A906 V907 L915 K922 H929 W941 C943 F945 L986	A906-F924 HydrophobicContact CB-CE1 4.06Å; A906-F924 HydrophobicContact CB-CZ 4.22Å; V907-F924 HydrophobicContact CG2-CD1 4.12Å; V907-F924 HydrophobicContact CG2-CE1 4.14Å; L915-F924 VanDerWaalsContact CB-O 3.27Å; L915-F924 WeakPolarHBondContact CB-O 3.07Å; L915-F924 PolarHBondContact N-O 3.37Å; L915-F924 PolarHBondContact O-N 3.02Å; L915-F924 VanDerWaalsContact O-N 3.12Å; K922-F924 HydrophobicContact CB-CE2 3.78Å; K922-F924 HydrophobicContact CB-CZ 3.97Å; F924-H929 HydrophobicContact CB-CB 4.12Å; F924-H929 HydrophobicContact CG-CB 4.5Å; F924-H929 AromaticContact CG-CD2 3.92Å; F924-W941 AromaticContact CD2-CH2 3.87Å; F924-W941 HydrophobicContact CD2-CH2 3.87Å; F924-W941 HydrophobicContact CD2-CZ3 4.17Å; F924-C943 HydrophobicContact CD2-CB 3.98Å; F924-C943 HydrophobicContact CE2-CB 3.43Å; F924-C943 VanDerWaalsContact CE2-CB 3.43Å; F924-C943 HydrophobicContact CZ-CB 4.16Å; F924-F945 HydrophobicContact CE1-CE2 4.44Å; F924-F945 HydrophobicContact CZ-CD2 4.14Å; F924-F945 AromaticContact CZ-CE2 3.94Å; F924-F945 HydrophobicContact CZ-CE2 3.94Å; F924-L986 HydrophobicContact CD1-CD1 4.46Å; F924-L986 HydrophobicContact CE1-CD1 4Å; F924-L986 HydrophobicContact CE1-CD2 4.07Å; F924-L986 HydrophobicContact CE1-CG 4.36Å; F924-L986 HydrophobicContact CZ-CD2 4.2Å
925	H	94.5	Very high	93.2	Very high	32 Å²	32	38 Å²	38	15%	0.148	21%	0.21	C	C	.	.			trans	-68.4	148.5	157.9	-52	105.1	0	0	0	109.7	C905 C908 N910 G911 D913 L914 T927 C928 H929	C905-H925 WeakPolarHBondContact CB-ND1 3.29Å; C908-H925 VanDerWaalsContact SG-CE1 3.53Å; C908-H925 PolarHBondContact SG-ND1 3.01Å; C908-H925 VanDerWaalsContact SG-ND1 3.44Å; N910-H925 PolarHBondContact O-CE1 3.37Å; G911-H925 PolarHBondContact O-CE1 2.85Å; G911-H925 PolarHBondContact O-NE2 3.18Å; D913-H925 PolarHBondContact O-CD2 3.37Å; L914-H925 WeakPolarHBondContact CD2-NE2 3.27Å; H925-T927 PolarHBondContact O-N 2.94Å; H925-T927 VanDerWaalsContact O-N 3.15Å; H925-C928 HydrophobicContact CB-CB 4.15Å; H925-C928 PolarHBondContact O-N 2.73Å; H925-C928 VanDerWaalsContact O-N 3.09Å; H925-H929 PolarHBondContact O-N 3.22Å; H925-H929 VanDerWaalsContact O-N 3.09Å
926	L	94.1	Very high	92.9	Very high	14 Å²	14	41.4 Å²	41.4	7%	0.073	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.6	-38.9	-179.7	-58.9	-177.4	0	0	0	113.3	L829 L915 T932 L933 F936	L829-L926 HydrophobicContact CD1-CD1 4Å; L915-L926 HydrophobicContact CD2-CD2 4.2Å; L926-T932 WeakPolarHBondContact O-CA 3.4Å; L926-L933 HydrophobicContact CB-CB 4.17Å; L926-L933 HydrophobicContact CD2-CB 3.96Å; L926-L933 HydrophobicContact CD2-CD1 4.15Å; L926-L933 PolarHBondContact O-N 2.8Å; L926-F936 HydrophobicContact CD1-CD2 3.74Å; L926-F936 HydrophobicContact CD1-CE2 3.64Å; L926-F936 HydrophobicContact CD1-CG 4.3Å; L926-F936 HydrophobicContact CD1-CZ 4.12Å; L926-F936 HydrophobicContact CD2-CD1 4.11Å; L926-F936 HydrophobicContact CD2-CD2 4.46Å; L926-F936 HydrophobicContact CD2-CE1 4.17Å; L926-F936 HydrophobicContact CD2-CG 4.23Å; L926-F936 HydrophobicContact CD2-CZ 4.36Å; L926-F936 HydrophobicContact CG-CD2 4.36Å; L926-F936 HydrophobicContact CG-CE1 4.31Å; L926-F936 HydrophobicContact CG-CE2 4.06Å; L926-F936 HydrophobicContact CG-CZ 4.01Å
927	T	93.6	Very high	92.5	Very high	95 Å²	95	41.2 Å²	41.2	58%	0.583	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73	-41.4	179	49	0	0	0	0	113	H925 T932 K1022	H925-T927 PolarHBondContact O-N 2.94Å; H925-T927 VanDerWaalsContact O-N 3.15Å; T927-T932 PolarHBondContact O-OG1 3.43Å; T927-K1022 PolarHBondContact O-NZ 3.36Å
928	C	94.5	Very high	91.4	Very high	22 Å²	22	47.2 Å²	47.2	15%	0.149	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-35.2	-178.6	-70.6	0	0	0	0	112.8	V907 H925	V907-C928 HydrophobicContact CB-CB 4.07Å; V907-C928 HydrophobicContact CG1-CB 4.22Å; H925-C928 HydrophobicContact CB-CB 4.15Å; H925-C928 PolarHBondContact O-N 2.73Å; H925-C928 VanDerWaalsContact O-N 3.09Å
929	H	95	Very high	90.7	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	27%	0.271	C	S	.	.	S	Bend	trans	-56.6	157.6	175.9	-168.7	-101.3	0	0	0	112.6	F924 H925 P931 T932 L933 W941 T944 Y956 K1022	F924-H929 HydrophobicContact CB-CB 4.12Å; F924-H929 HydrophobicContact CG-CB 4.5Å; F924-H929 AromaticContact CG-CD2 3.92Å; H925-H929 PolarHBondContact O-N 3.22Å; H925-H929 VanDerWaalsContact O-N 3.09Å; H929-P931 CarbonylContact C-O 3.6Å; H929-P931 PolarHBondContact ND1-O 2.98Å; H929-P931 CarbonylContact O-C 3.58Å; H929-T932 PolarHBondContact O-N 3.36Å; H929-T932 PolarHBondContact O-OG1 3.35Å; H929-L933 HydrophobicContact CB-CG 4.46Å; H929-W941 AromaticContact CD2-CH2 3.82Å; H929-W941 AromaticContact CD2-CZ2 3.91Å; H929-W941 AromaticContact CE1-CZ2 3.97Å; H929-W941 AromaticContact NE2-CH2 3.86Å; H929-W941 AromaticContact NE2-CZ2 3.63Å; H929-T944 PolarHBondContact CE1-OG1 3.46Å; H929-T944 PolarHBondContact NE2-N 2.81Å; H929-T944 PolarHBondContact NE2-OG1 3.16Å; H929-Y956 AromaticContact CE1-CE2 3.72Å; H929-Y956 AromaticContact CE1-CZ 3.92Å; H929-K1022 PolarHBondContact O-NZ 3.47Å
930	V	94.8	Very high	90.3	Very high	2 Å²	2	45.4 Å²	45.4	1%	0.012	28%	0.278	C	S	.	.	S	Bend	trans	-128.4	117.6	175.7	-179.4	0	0	0	0	108.4	T944 E982 L985 L986 Y989 K1022	V930-T944 WeakPolarHBondContact O-CB 3.33Å; V930-T944 PolarHBondContact O-OG1 3.29Å; V930-E982 HydrophobicContact CG1-CB 4.24Å; V930-E982 HydrophobicContact CG1-CG 4.39Å; V930-E982 WeakPolarHBondContact CG1-O 3.29Å; V930-L985 HydrophobicContact CG1-CB 4.21Å; V930-L985 HydrophobicContact CG1-CD2 4.01Å; V930-L985 HydrophobicContact CG1-CG 4.24Å; V930-L986 HydrophobicContact CB-CB 4.07Å; V930-L986 HydrophobicContact CB-CD1 3.98Å; V930-L986 HydrophobicContact CG2-CB 4.47Å; V930-L986 HydrophobicContact CG2-CD1 3.89Å; V930-Y989 HydrophobicContact CG2-CD2 4Å; V930-Y989 HydrophobicContact CG2-CE2 4.39Å; V930-K1022 HydrophobicContact CG2-CD 4.25Å
931	P	93.3	Very high	90.1	Very high	18 Å²	18	44.4 Å²	44.4	12%	0.117	27%	0.27	C	S	.	.	S	Bend	cis	-65.8	155.8	-6.1	31.3	-35	0	0	0	111.4	H929 L933 Y956 C958	H929-P931 CarbonylContact C-O 3.6Å; H929-P931 PolarHBondContact ND1-O 2.98Å; H929-P931 CarbonylContact O-C 3.58Å; P931-L933 PolarHBondContact O-N 3.28Å; P931-Y956 HydrophobicContact CG-CD2 3.78Å; P931-Y956 HydrophobicContact CG-CE2 4.46Å; P931-C958 HydrophobicContact CB-CB 4.35Å; P931-C958 HydrophobicContact CG-CB 4.35Å
932	T	92.5	Very high	90.1	Very high	34 Å²	34	41.8 Å²	41.8	21%	0.209	25%	0.252	C	S	.	.	P	Polyproline II helix	trans	-61.7	132.2	173.1	-69.7	0	0	0	0	110	L926 T927 H929 C958 K1022	L926-T932 WeakPolarHBondContact O-CA 3.4Å; T927-T932 PolarHBondContact O-OG1 3.43Å; H929-T932 PolarHBondContact O-N 3.36Å; H929-T932 PolarHBondContact O-OG1 3.35Å; T932-C958 WeakPolarHBondContact O-CB 3.47Å; T932-K1022 WeakPolarHBondContact OG1-CE 3.39Å; T932-K1022 PolarHBondContact OG1-NZ 2.88Å
933	L	92.7	Very high	90.1	Very high	10 Å²	10	38.9 Å²	38.9	5%	0.052	24%	0.24	C	C	.	.	B	Isolated β-bridge	trans	-92.9	147	-178.4	-55	178.8	0	0	0	110.2	L915 L926 H929 P931 W941 Y956 D957	L915-L933 HydrophobicContact CD2-CD1 3.54Å; L926-L933 HydrophobicContact CB-CB 4.17Å; L926-L933 HydrophobicContact CD2-CB 3.96Å; L926-L933 HydrophobicContact CD2-CD1 4.15Å; L926-L933 PolarHBondContact O-N 2.8Å; H929-L933 HydrophobicContact CB-CG 4.46Å; P931-L933 PolarHBondContact O-N 3.28Å; L933-W941 HydrophobicContact CD1-CZ2 4Å; L933-Y956 HydrophobicContact CD2-CD1 4.3Å; L933-Y956 HydrophobicContact CD2-CD2 4.28Å; L933-Y956 HydrophobicContact CD2-CG 3.88Å; L933-D957 WeakPolarHBondContact CA-O 3.47Å
934	L	87.7	Confident	90.1	Very high	67 Å²	67	39 Å²	39	35%	0.351	24%	0.24	S	C	.	.	S	Bend	trans	-93	-25.5	-178.9	-65.2	175.5	0	0	0	113.3	D957	L934-D957 PolarHBondContact N-O 3.08Å
935	S	87.5	Confident	90.1	Very high	49 Å²	49	40.5 Å²	40.5	34%	0.343	25%	0.247	S	C	.	.	S	Bend	trans	-145.6	160	-175.5	58.4	0	0	0	0	111	P937 D957	S935-P937 WeakPolarHBondContact O-CD 3.32Å; S935-D957 PolarHBondContact OG-OD2 3.09Å
936	F	86.2	Confident	90.1	Very high	88 Å²	88	40.6 Å²	40.6	39%	0.386	25%	0.251	S	S	.	.	P	Polyproline II helix	trans	-73	119.4	168.2	-74.4	-90.4	0	0	0	108.7	L829 D913 L915 L926	L829-F936 HydrophobicContact CD1-CE2 4.25Å; D913-F936 HydrophobicContact CB-CE1 4.48Å; D913-F936 HydrophobicContact CB-CZ 3.76Å; L915-F936 HydrophobicContact CD1-CD1 3.99Å; L926-F936 HydrophobicContact CD1-CD2 3.74Å; L926-F936 HydrophobicContact CD1-CE2 3.64Å; L926-F936 HydrophobicContact CD1-CG 4.3Å; L926-F936 HydrophobicContact CD1-CZ 4.12Å; L926-F936 HydrophobicContact CD2-CD1 4.11Å; L926-F936 HydrophobicContact CD2-CD2 4.46Å; L926-F936 HydrophobicContact CD2-CE1 4.17Å; L926-F936 HydrophobicContact CD2-CG 4.23Å; L926-F936 HydrophobicContact CD2-CZ 4.36Å; L926-F936 HydrophobicContact CG-CD2 4.36Å; L926-F936 HydrophobicContact CG-CE1 4.31Å; L926-F936 HydrophobicContact CG-CE2 4.06Å; L926-F936 HydrophobicContact CG-CZ 4.01Å
937	P	83.4	Confident	90	Very high	53 Å²	53	40.9 Å²	40.9	34%	0.344	25%	0.251	S	S	.	.	P	Polyproline II helix	trans	-63.4	149.5	176.2	26.5	-33.9	0	0	0	111.1	L915 S935 W941	L915-P937 HydrophobicContact CD1-CG 3.89Å; L915-P937 HydrophobicContact CD2-CG 3.96Å; S935-P937 WeakPolarHBondContact O-CD 3.32Å; P937-W941 HydrophobicContact CG-CB 3.97Å; P937-W941 HydrophobicContact CG-CG 3.76Å
938	S	71.8	Confident	90	Very high	128 Å²	128	40.1 Å²	40.1	90%	0.895	24%	0.243	S	C	*	.	S	Bend	trans	-98.2	116.1	179.4	-58.8	0	0	0	0	110.5
939	G	77.1	Confident	89.8	Confident	60 Å²	60	40.5 Å²	40.5	62%	0.619	24%	0.243	S	C	*	.	S	Bend	trans	89.5	-163.5	-176.4	0	0	0	0	0	113.5	W941	G939-W941 PolarHBondContact O-N 2.85Å
940	D	82.5	Confident	89.5	Confident	125 Å²	125	42.9 Å²	42.9	67%	0.668	27%	0.268	S	S	*	.			trans	-46.2	115.7	-171.7	-53.2	26.7	0	0	0	113	E918	E918-D940 VanDerWaalsContact OE1-CA 3.25Å; E918-D940 WeakPolarHBondContact OE1-CA 3.2Å; E918-D940 VanDerWaalsContact OE1-CB 3.28Å; E918-D940 WeakPolarHBondContact OE1-CB 3.5Å
941	W	91.2	Very high	89.2	Confident	12 Å²	12	51.1 Å²	51.1	5%	0.045	30%	0.304	C	S	.	.			trans	-126.2	142.6	179.5	-175.7	79.9	0	0	0	114.4	L915 C917 E918 F924 H929 L933 P937 G939 C943 Y956	L915-W941 HydrophobicContact CB-CZ3 4.31Å; L915-W941 HydrophobicContact CD2-CD2 3.53Å; L915-W941 VanDerWaalsContact CD2-CE2 3.47Å; L915-W941 HydrophobicContact CD2-CE3 3.77Å; L915-W941 HydrophobicContact CD2-CG 4.1Å; L915-W941 HydrophobicContact CD2-CH2 3.84Å; L915-W941 HydrophobicContact CD2-CZ2 3.64Å; L915-W941 HydrophobicContact CD2-CZ3 3.91Å; L915-W941 HydrophobicContact CG-CD2 3.8Å; L915-W941 HydrophobicContact CG-CE3 3.59Å; L915-W941 HydrophobicContact CG-CG 4.37Å; L915-W941 HydrophobicContact CG-CH2 4.24Å; L915-W941 HydrophobicContact CG-CZ2 4.46Å; L915-W941 HydrophobicContact CG-CZ3 3.82Å; C917-W941 HydrophobicContact CB-CE3 4.32Å; C917-W941 HydrophobicContact CB-CZ3 4.05Å; E918-W941 PolarHBondContact N-O 2.69Å; E918-W941 VanDerWaalsContact N-O 3.1Å; F924-W941 AromaticContact CD2-CH2 3.87Å; F924-W941 HydrophobicContact CD2-CH2 3.87Å; F924-W941 HydrophobicContact CD2-CZ3 4.17Å; H929-W941 AromaticContact CD2-CH2 3.82Å; H929-W941 AromaticContact CD2-CZ2 3.91Å; H929-W941 AromaticContact CE1-CZ2 3.97Å; H929-W941 AromaticContact NE2-CH2 3.86Å; H929-W941 AromaticContact NE2-CZ2 3.63Å; L933-W941 HydrophobicContact CD1-CZ2 4Å; P937-W941 HydrophobicContact CG-CB 3.97Å; P937-W941 HydrophobicContact CG-CG 3.76Å; G939-W941 PolarHBondContact O-N 2.85Å; W941-C943 VanDerWaalsContact CH2-CA 3.45Å; W941-C943 HydrophobicContact CH2-CB 3.42Å; W941-C943 VanDerWaalsContact CH2-CB 3.42Å; W941-C943 HydrophobicContact CZ2-CB 4.1Å; W941-C943 HydrophobicContact CZ3-CB 3.78Å; W941-Y956 AromaticContact NE1-CD1 3.89Å; W941-Y956 AromaticContact NE1-CE1 3.45Å
942	I	93.6	Very high	88.8	Confident	5 Å²	5	52.2 Å²	52.2	3%	0.026	31%	0.311	C	S	.	.			trans	-134.4	131.5	179.1	60.4	-179.1	0	0	0	111.3	E918 K919 C946 R947 E953 V954 Y956	E918-I942 HydrophobicContact CB-CG2 4.39Å; K919-I942 HydrophobicContact CB-CG2 4.29Å; K919-I942 HydrophobicContact CD-CD1 4.4Å; K919-I942 HydrophobicContact CD-CG2 3.86Å; K919-I942 HydrophobicContact CG-CG2 3.67Å; I942-C946 HydrophobicContact CB-CB 4.25Å; I942-R947 HydrophobicContact CD1-CB 4.08Å; I942-R947 HydrophobicContact CD1-CG 4.33Å; I942-R947 HydrophobicContact CG1-CB 4.12Å; I942-E953 HydrophobicContact CD1-CB 4.15Å; I942-E953 HydrophobicContact CD1-CG 4.43Å; I942-V954 HydrophobicContact CD1-CG2 4.3Å; I942-V954 HydrophobicContact CG1-CG1 4.33Å; I942-V954 HydrophobicContact CG1-CG2 3.6Å; I942-Y956 PolarHBondContact O-OH 3.2Å
943	C	94.8	Very high	88.4	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	33%	0.325	C	S	.	.			trans	-70	167.1	-178.3	72	0	0	0	0	113.1	C917 F924 W941 F945 C946 R947	C917-C943 HydrophobicContact CB-CB 4.15Å; C917-C943 PolarHBondContact SG-N 3.18Å; C917-C943 VanDerWaalsContact SG-N 3.39Å; F924-C943 HydrophobicContact CD2-CB 3.98Å; F924-C943 HydrophobicContact CE2-CB 3.43Å; F924-C943 VanDerWaalsContact CE2-CB 3.43Å; F924-C943 HydrophobicContact CZ-CB 4.16Å; W941-C943 VanDerWaalsContact CH2-CA 3.45Å; W941-C943 HydrophobicContact CH2-CB 3.42Å; W941-C943 VanDerWaalsContact CH2-CB 3.42Å; W941-C943 HydrophobicContact CZ2-CB 4.1Å; W941-C943 HydrophobicContact CZ3-CB 3.78Å; C943-F945 PolarHBondContact O-N 2.87Å; C943-C946 PolarHBondContact O-N 2.95Å; C943-R947 PolarHBondContact O-N 3.29Å
944	T	95.2	Very high	87.9	Confident	3 Å²	3	56.6 Å²	56.6	2%	0.018	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-19.2	-179.1	-67.6	0	0	0	0	113.8	H929 V930 Y956 E982 R983 L986	H929-T944 PolarHBondContact CE1-OG1 3.46Å; H929-T944 PolarHBondContact NE2-N 2.81Å; H929-T944 PolarHBondContact NE2-OG1 3.16Å; V930-T944 WeakPolarHBondContact O-CB 3.33Å; V930-T944 PolarHBondContact O-OG1 3.29Å; T944-Y956 WeakPolarHBondContact CA-OH 3.31Å; T944-Y956 PolarHBondContact N-OH 3.43Å; T944-Y956 VanDerWaalsContact N-OH 3.11Å; T944-Y956 WeakPolarHBondContact OG1-CE2 3.48Å; T944-E982 HydrophobicContact CG2-CB 4.26Å; T944-R983 HydrophobicContact CG2-CB 3.91Å; T944-R983 VanDerWaalsContact O-CZ 3.24Å; T944-R983 PolarHBondContact O-NE 2.71Å; T944-R983 PolarHBondContact O-NH2 2.91Å; T944-L986 HydrophobicContact CG2-CD2 4.45Å
945	F	95.9	Very high	87.7	Confident	33 Å²	33	61.8 Å²	61.8	15%	0.145	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-32.7	170.7	-59.2	-49.6	0	0	0	113.7	K922 F924 C943 R983 L986 Y987 C990	K922-F945 HydrophobicContact CD-CD2 4.45Å; K922-F945 HydrophobicContact CD-CE2 4.32Å; F924-F945 HydrophobicContact CE1-CE2 4.44Å; F924-F945 HydrophobicContact CZ-CD2 4.14Å; F924-F945 AromaticContact CZ-CE2 3.94Å; F924-F945 HydrophobicContact CZ-CE2 3.94Å; C943-F945 PolarHBondContact O-N 2.87Å; F945-R983 HydrophobicContact CD1-CG 4.18Å; F945-R983 PolarHBondContact O-NH2 2.68Å; F945-L986 HydrophobicContact CD1-CD2 4.36Å; F945-L986 HydrophobicContact CD2-CD2 4.13Å; F945-L986 HydrophobicContact CE1-CB 3.93Å; F945-L986 HydrophobicContact CE1-CD2 4.01Å; F945-L986 HydrophobicContact CE1-CG 3.91Å; F945-L986 HydrophobicContact CE2-CD2 3.8Å; F945-L986 HydrophobicContact CE2-CG 3.95Å; F945-L986 HydrophobicContact CG-CD2 4.41Å; F945-L986 HydrophobicContact CZ-CB 3.98Å; F945-L986 HydrophobicContact CZ-CD2 3.75Å; F945-L986 HydrophobicContact CZ-CG 3.49Å; F945-L986 VanDerWaalsContact CZ-CG 3.49Å; F945-Y987 AromaticContact CD1-CD1 3.91Å; F945-Y987 HydrophobicContact CD1-CD1 3.91Å; F945-Y987 HydrophobicContact CD1-CD2 4.49Å; F945-Y987 AromaticContact CD1-CE1 3.63Å; F945-Y987 HydrophobicContact CD1-CE1 3.63Å; F945-Y987 HydrophobicContact CD1-CE2 4.29Å; F945-Y987 HydrophobicContact CD1-CG 4.33Å; F945-Y987 AromaticContact CD1-CZ 3.87Å; F945-Y987 AromaticContact CE1-CD1 3.22Å; F945-Y987 HydrophobicContact CE1-CD1 3.22Å; F945-Y987 HydrophobicContact CE1-CD2 4.08Å; F945-Y987 AromaticContact CE1-CE1 3.46Å; F945-Y987 HydrophobicContact CE1-CE1 3.46Å; F945-Y987 VanDerWaalsContact CE1-CE1 3.46Å; F945-Y987 HydrophobicContact CE1-CE2 4.31Å; F945-Y987 AromaticContact CE1-CG 3.56Å; F945-Y987 HydrophobicContact CE1-CG 3.56Å; F945-Y987 HydrophobicContact CG-CE1 4.5Å; F945-Y987 AromaticContact CZ-CD1 3.77Å; F945-Y987 HydrophobicContact CZ-CD1 3.77Å; F945-Y987 HydrophobicContact CZ-CE1 4.18Å; F945-Y987 HydrophobicContact CZ-CG 4.33Å; F945-C990 HydrophobicContact CZ-CB 4.26Å
946	C	95	Very high	87.8	Confident	34 Å²	34	60.1 Å²	60.1	23%	0.23	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.5	-20.2	-169.9	-69.3	0	0	0	0	115	K919 C920 I942 C943	K919-C946 HydrophobicContact CB-CB 3.75Å; K919-C946 HydrophobicContact CD-CB 4.39Å; C920-C946 PolarHBondContact SG-SG 2.72Å; I942-C946 HydrophobicContact CB-CB 4.25Å; C943-C946 PolarHBondContact O-N 2.95Å
947	R	92.9	Very high	87.6	Confident	20 Å²	20	59.7 Å²	59.7	8%	0.075	34%	0.341	C	S	.	.	S	Bend	trans	-66.4	144.9	172.5	-170.8	173.3	70.7	171.6	-7.6	111.6	I942 C943 P952 E953 V954 Y956 E982 R983	I942-R947 HydrophobicContact CD1-CB 4.08Å; I942-R947 HydrophobicContact CD1-CG 4.33Å; I942-R947 HydrophobicContact CG1-CB 4.12Å; C943-R947 PolarHBondContact O-N 3.29Å; R947-P952 HydrophobicContact CG-CB 3.73Å; R947-E953 WeakPolarHBondContact CA-OE2 3.29Å; R947-E953 WeakPolarHBondContact CG-OE2 3.44Å; R947-V954 WeakPolarHBondContact CD-O 3.49Å; R947-V954 HydrophobicContact CG-CG2 4.3Å; R947-V954 PolarHBondContact NH1-O 3.18Å; R947-Y956 VanDerWaalsContact NH1-CD2 3.32Å; R947-E982 IonicContact NH2-OE2 2.78Å; R947-R983 PolarHBondContact O-NH2 3.16Å
948	D	92.3	Very high	87.4	Confident	80 Å²	80	57.5 Å²	57.5	43%	0.428	33%	0.327	S	S	.	.			trans	-68.8	145.9	174.5	-171.6	-101.8	0	0	0	112.7	G950 K951 P952 E953	D948-G950 WeakPolarHBondContact OD1-CA 3.42Å; D948-G950 PolarHBondContact OD1-N 3.44Å; D948-K951 PolarHBondContact OD1-N 2.9Å; D948-P952 WeakPolarHBondContact O-CA 3Å; D948-E953 PolarHBondContact N-OE2 2.72Å
949	I	91.3	Very high	87.1	Confident	29 Å²	29	53.3 Å²	53.3	15%	0.149	30%	0.295	C	S	.	.	S	Bend	trans	-82	-35.7	-178	-74.7	174.2	0	0	0	111.9	V976 R979 K980	I949-V976 HydrophobicContact CG2-CG1 3.82Å; I949-R979 VanDerWaalsContact O-CZ 3.25Å; I949-R979 PolarHBondContact O-NE 3.07Å; I949-R979 PolarHBondContact O-NH2 2.78Å; I949-K980 HydrophobicContact CD1-CG 4.35Å; I949-K980 HydrophobicContact CG2-CG 3.85Å
950	G	88	Confident	86.6	Confident	51 Å²	51	51 Å²	51	53%	0.526	27%	0.269	S	S	.	.	S	Bend	trans	-84.7	-49.1	-179.2	0	0	0	0	0	112.5	D948 P952 R979	D948-G950 WeakPolarHBondContact OD1-CA 3.42Å; D948-G950 PolarHBondContact OD1-N 3.44Å; G950-P952 WeakPolarHBondContact O-CD 3.36Å; G950-R979 PolarHBondContact O-NH2 3.4Å
951	K	88.1	Confident	85.6	Confident	175 Å²	175	49.2 Å²	49.2	76%	0.761	26%	0.257	S	S	*	.	S	Bend	trans	-126.9	70.8	-173.4	-170.6	-160.6	174.8	-169.4	0	110.2	D948 E953	D948-K951 PolarHBondContact OD1-N 2.9Å; K951-E953 PolarHBondContact O-N 2.76Å
952	P	85.1	Confident	83.8	Confident	41 Å²	41	55.1 Å²	55.1	27%	0.266	29%	0.285	S	S	.	.			trans	-56.4	132.7	-177.1	24.1	-35.4	0	0	0	111.8	R947 D948 G950	R947-P952 HydrophobicContact CG-CB 3.73Å; D948-P952 WeakPolarHBondContact O-CA 3Å; G950-P952 WeakPolarHBondContact O-CD 3.36Å
953	E	83.8	Confident	81.9	Confident	106 Å²	106	60.8 Å²	60.8	50%	0.495	31%	0.311	S	S	.	.	S	Bend	trans	-78.3	-26.9	-178.8	-49.8	96.2	129.4	0	0	112.6	I942 R947 D948 K951	I942-E953 HydrophobicContact CD1-CB 4.15Å; I942-E953 HydrophobicContact CD1-CG 4.43Å; R947-E953 WeakPolarHBondContact CA-OE2 3.29Å; R947-E953 WeakPolarHBondContact CG-OE2 3.44Å; D948-E953 PolarHBondContact N-OE2 2.72Å; K951-E953 PolarHBondContact O-N 2.76Å
954	V	83.6	Confident	79.8	Confident	30 Å²	30	64.8 Å²	64.8	18%	0.182	34%	0.339	C	S	.	.	S	Bend	trans	-126.2	130.6	179.1	-61.7	0	0	0	0	111.3	I942 R947 Y956	I942-V954 HydrophobicContact CD1-CG2 4.3Å; I942-V954 HydrophobicContact CG1-CG1 4.33Å; I942-V954 HydrophobicContact CG1-CG2 3.6Å; R947-V954 WeakPolarHBondContact CD-O 3.49Å; R947-V954 HydrophobicContact CG-CG2 4.3Å; R947-V954 PolarHBondContact NH1-O 3.18Å; V954-Y956 HydrophobicContact CG2-CD1 4.24Å; V954-Y956 HydrophobicContact CG2-CE1 3.67Å
955	E	83.1	Confident	77.5	Confident	175 Å²	175	74.2 Å²	74.2	82%	0.818	38%	0.38	S	S	*	.			trans	-78.1	151.8	164.5	-63.8	-160.2	139.3	0	0	109.9
956	Y	88.2	Confident	74.8	Confident	15 Å²	15	82.5 Å²	82.5	6%	0.059	42%	0.416	C	S	.	.			trans	-110.7	123.4	179.2	-66.1	-24.9	0	0	0	109.8	H929 P931 L933 W941 I942 T944 R947 V954 C958	H929-Y956 AromaticContact CE1-CE2 3.72Å; H929-Y956 AromaticContact CE1-CZ 3.92Å; P931-Y956 HydrophobicContact CG-CD2 3.78Å; P931-Y956 HydrophobicContact CG-CE2 4.46Å; L933-Y956 HydrophobicContact CD2-CD1 4.3Å; L933-Y956 HydrophobicContact CD2-CD2 4.28Å; L933-Y956 HydrophobicContact CD2-CG 3.88Å; W941-Y956 AromaticContact NE1-CD1 3.89Å; W941-Y956 AromaticContact NE1-CE1 3.45Å; I942-Y956 PolarHBondContact O-OH 3.2Å; T944-Y956 WeakPolarHBondContact CA-OH 3.31Å; T944-Y956 PolarHBondContact N-OH 3.43Å; T944-Y956 VanDerWaalsContact N-OH 3.11Å; T944-Y956 WeakPolarHBondContact OG1-CE2 3.48Å; R947-Y956 VanDerWaalsContact NH1-CD2 3.32Å; V954-Y956 HydrophobicContact CG2-CD1 4.24Å; V954-Y956 HydrophobicContact CG2-CE1 3.67Å; Y956-C958 PolarHBondContact O-N 2.73Å; Y956-C958 PolarHBondContact O-SG 2.88Å
957	D	82.2	Confident	71.9	Confident	78 Å²	78	84.3 Å²	84.3	42%	0.417	44%	0.44	S	S	.	.			trans	-68.6	99.8	164.5	-177.4	30.4	0	0	0	109.1	L933 L934 S935	L933-D957 WeakPolarHBondContact CA-O 3.47Å; L934-D957 PolarHBondContact N-O 3.08Å; S935-D957 PolarHBondContact OG-OD2 3.09Å
958	C	80.8	Confident	69.2	Low	7 Å²	7	92.8 Å²	92.8	5%	0.047	48%	0.478	C	S	.	.	B	Isolated β-bridge	trans	-143.7	158.1	-174.5	62.9	0	0	0	0	110.3	P931 T932 Y956 N960 M961	P931-C958 HydrophobicContact CB-CB 4.35Å; P931-C958 HydrophobicContact CG-CB 4.35Å; T932-C958 WeakPolarHBondContact O-CB 3.47Å; Y956-C958 PolarHBondContact O-N 2.73Å; Y956-C958 PolarHBondContact O-SG 2.88Å; C958-N960 PolarHBondContact O-N 3.02Å; C958-M961 PolarHBondContact O-N 3.26Å
959	D	64.8	Low	66.5	Low	41 Å²	41	95.8 Å²	95.8	22%	0.219	50%	0.499	C	S	.	.	T	Hydrogen-bonded Turn	trans	-42.8	-30.4	174.5	-102.2	-36.3	0	0	0	114.4	M961 K1028	D959-M961 VanDerWaalsContact C-N 3.31Å; D959-M961 PolarHBondContact O-N 3.24Å; D959-K1028 IonicContact OD1-NZ 2.66Å; D959-K1028 PolarHBondContact OD1-NZ 3.41Å; D959-K1028 WeakPolarHBondContact OD2-CE 3.42Å; D959-K1028 IonicContact OD2-NZ 3.54Å; D959-K1028 PolarHBondContact OD2-NZ 3.47Å
960	N	66	Low	64.4	Low	12 Å²	12	99.3 Å²	99.3	6%	0.064	53%	0.532	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-9.7	-172.7	-137.5	17.7	0	0	0	114.6	C958 Q978 K1027	C958-N960 PolarHBondContact O-N 3.02Å; N960-Q978 PolarHBondContact ND2-NE2 2.89Å; N960-K1027 VanDerWaalsContact OD1-CB 3.27Å; N960-K1027 WeakPolarHBondContact OD1-CB 3.03Å; N960-K1027 WeakPolarHBondContact OD1-CD 3.48Å; N960-K1027 WeakPolarHBondContact OD1-CG 3.37Å; N960-K1027 PolarHBondContact OD1-N 3.37Å
961	M	60.8	Low	63.3	Low	87 Å²	87	104.9 Å²	104.9	43%	0.429	55%	0.545	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.7	-38.3	-178.8	-78.1	-65.9	105.9	0	0	113.7	C958 D959 H963 S964	C958-M961 PolarHBondContact O-N 3.26Å; D959-M961 VanDerWaalsContact C-N 3.31Å; D959-M961 PolarHBondContact O-N 3.24Å; M961-H963 VanDerWaalsContact C-N 3.25Å; M961-H963 PolarHBondContact O-N 3.34Å; M961-H963 VanDerWaalsContact O-N 3.16Å; M961-S964 WeakPolarHBondContact O-CB 3.41Å; M961-S964 PolarHBondContact O-N 3.3Å; M961-S964 VanDerWaalsContact O-N 3.14Å
962	Q	53.8	Low	62.8	Low	135 Å²	135	98 Å²	98	63%	0.631	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-28	-167.3	-60.3	-170.8	3.7	0	0	113.6	S964	Q962-S964 VanDerWaalsContact C-N 3.35Å; Q962-S964 PolarHBondContact O-N 2.82Å
963	H	53.5	Low	63.1	Low	124 Å²	124	96.9 Å²	96.9	57%	0.574	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-6.5	179.8	-70.2	-79.5	0	0	0	115.2	M961 K965	M961-H963 VanDerWaalsContact C-N 3.25Å; M961-H963 PolarHBondContact O-N 3.34Å; M961-H963 VanDerWaalsContact O-N 3.16Å; H963-K965 VanDerWaalsContact C-N 3.29Å; H963-K965 PolarHBondContact O-N 3.08Å; H963-K965 VanDerWaalsContact O-N 3.16Å
964	S	52.2	Low	63.4	Low	84 Å²	84	94 Å²	94	59%	0.587	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.8	9.6	-166.1	-154.4	0	0	0	0	116.1	M961 Q962	M961-S964 WeakPolarHBondContact O-CB 3.41Å; M961-S964 PolarHBondContact O-N 3.3Å; M961-S964 VanDerWaalsContact O-N 3.14Å; Q962-S964 VanDerWaalsContact C-N 3.35Å; Q962-S964 PolarHBondContact O-N 2.82Å
965	K	45.6	Very low	63.7	Low	202 Å²	202	97.1 Å²	97.1	88%	0.878	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.7	16.5	-166.2	-73.6	-174.3	175.6	177.7	0	116.8	H963	H963-K965 VanDerWaalsContact C-N 3.29Å; H963-K965 PolarHBondContact O-N 3.08Å; H963-K965 VanDerWaalsContact O-N 3.16Å
966	K	39.7	Very low	64.2	Low	206 Å²	206	91.4 Å²	91.4	90%	0.896	51%	0.505	S	S	*	.	S	Bend	trans	-125.9	130.7	171.5	-135.4	168.9	-173.7	173.8	0	110.5
967	G	33.2	Very low	64.5	Low	72 Å²	72	92.2 Å²	92.2	74%	0.742	51%	0.51	S	S	*	.			trans	-80.3	174.8	-162.2	0	0	0	0	0	116.6
968	K	36.3	Very low	65.1	Low	199 Å²	199	89 Å²	89	87%	0.865	49%	0.493	S	S	*	.	S	Bend	trans	81.5	92.6	-168.9	-60.4	-176.6	176.7	-179.2	0	114.7	A970	K968-A970 PolarHBondContact O-N 3.39Å
969	T	37.4	Very low	65.7	Low	142 Å²	142	90.6 Å²	90.6	87%	0.871	50%	0.498	S	S	*	.			trans	37.2	67.3	146.6	56.2	0	0	0	0	116	Q971	T969-Q971 PolarHBondContact O-N 2.71Å
970	A	46.9	Very low	67.2	Low	103 Å²	103	89.8 Å²	89.8	85%	0.851	49%	0.492	S	S	*	.			trans	-68.4	129.8	174.8	0	0	0	0	0	111.1	K968	K968-A970 PolarHBondContact O-N 3.39Å
971	Q	64.1	Low	68.7	Low	169 Å²	169	89.2 Å²	89.2	79%	0.79	49%	0.489	S	S	*	.			trans	-74.4	136.2	170.1	-63.4	160.4	-69.1	0	0	109	T969 Q1034	T969-Q971 PolarHBondContact O-N 2.71Å; Q971-Q1034 PolarHBondContact O-OE1 2.61Å
972	G	77.7	Confident	70.4	Confident	31 Å²	31	85.5 Å²	85.5	32%	0.32	47%	0.471	S	S	.	.	S	Bend	trans	167.5	175.4	178.6	0	0	0	0	0	111.6
973	L	90.6	Very high	72.5	Confident	16 Å²	16	80.8 Å²	80.8	8%	0.084	45%	0.447	C	S	.	.			trans	-52.9	146	172.3	-67.4	179.1	0	0	0	112	D977 Q978 C981 L1025 Y1033 P1036	L973-D977 HydrophobicContact CB-CB 4.32Å; L973-D977 HydrophobicContact CD2-CB 4.38Å; L973-Q978 HydrophobicContact CB-CB 4.3Å; L973-C981 HydrophobicContact CD1-CB 4.35Å; L973-L1025 HydrophobicContact CD1-CD1 3.72Å; L973-Y1033 PolarHBondContact N-O 3.07Å; L973-P1036 HydrophobicContact CD2-CG 4.15Å
974	S	91.2	Very high	74.6	Confident	46 Å²	46	74.9 Å²	74.9	32%	0.322	42%	0.42	S	S	.	.			trans	-61.1	152.6	170.1	89.4	0	0	0	0	110.3	V976 D977 Q978	S974-V976 PolarHBondContact O-N 3.1Å; S974-V976 PolarHBondContact OG-N 3.05Å; S974-D977 WeakPolarHBondContact CB-OD2 3.31Å; S974-D977 PolarHBondContact O-N 3.03Å; S974-D977 WeakPolarHBondContact OG-CB 3.42Å; S974-D977 VanDerWaalsContact OG-CG 3.32Å; S974-D977 PolarHBondContact OG-N 2.79Å; S974-D977 PolarHBondContact OG-OD2 3.29Å; S974-Q978 WeakPolarHBondContact O-CB 3.47Å; S974-Q978 PolarHBondContact O-N 2.87Å
975	P	90.4	Very high	76.8	Confident	96 Å²	96	70.9 Å²	70.9	62%	0.623	39%	0.392	S	S	*	.	H	α-helix	trans	-58.7	-24.3	178.3	-26.2	35.4	0	0	0	114.1	R979	P975-R979 WeakPolarHBondContact O-CG 3.2Å; P975-R979 PolarHBondContact O-NE 2.92Å; P975-R979 PolarHBondContact O-NH1 3.05Å; P975-R979 VanDerWaalsContact O-NH1 3.13Å
976	V	93	Very high	79.2	Confident	54 Å²	54	61.3 Å²	61.3	33%	0.327	35%	0.35	S	S	.	.	H	α-helix	trans	-77.4	-48.2	174.3	174.7	0	0	0	0	110.3	I949 S974 Q978 R979 K980	I949-V976 HydrophobicContact CG2-CG1 3.82Å; S974-V976 PolarHBondContact O-N 3.1Å; S974-V976 PolarHBondContact OG-N 3.05Å; V976-Q978 PolarHBondContact O-N 2.86Å; V976-R979 PolarHBondContact O-N 3.46Å; V976-R979 VanDerWaalsContact O-N 3.16Å; V976-K980 PolarHBondContact O-N 2.87Å
977	D	94.5	Very high	82	Confident	32 Å²	32	53.4 Å²	53.4	17%	0.171	32%	0.315	C	S	.	.	H	α-helix	trans	-64.4	-39.6	179.4	-72.5	-62.5	0	0	0	112.8	L973 S974 R979 K980 C981 P1036 Y1079	L973-D977 HydrophobicContact CB-CB 4.32Å; L973-D977 HydrophobicContact CD2-CB 4.38Å; S974-D977 WeakPolarHBondContact CB-OD2 3.31Å; S974-D977 PolarHBondContact O-N 3.03Å; S974-D977 WeakPolarHBondContact OG-CB 3.42Å; S974-D977 VanDerWaalsContact OG-CG 3.32Å; S974-D977 PolarHBondContact OG-N 2.79Å; S974-D977 PolarHBondContact OG-OD2 3.29Å; D977-R979 VanDerWaalsContact C-N 3.28Å; D977-R979 PolarHBondContact O-N 2.98Å; D977-K980 PolarHBondContact O-N 2.93Å; D977-K980 VanDerWaalsContact O-N 3.16Å; D977-C981 WeakPolarHBondContact O-CB 3.26Å; D977-C981 PolarHBondContact O-N 3.46Å; D977-C981 PolarHBondContact O-SG 2.92Å; D977-P1036 HydrophobicContact CB-CG 3.85Å; D977-P1036 VanDerWaalsContact OD1-CG 3.27Å; D977-P1036 WeakPolarHBondContact OD1-CG 3.42Å; D977-Y1079 WeakPolarHBondContact OD1-CE1 3.38Å; D977-Y1079 PolarHBondContact OD1-OH 3.21Å
978	Q	94.1	Very high	85.1	Confident	11 Å²	11	50 Å²	50	5%	0.051	28%	0.28	C	S	.	.	H	α-helix	trans	-52.4	-48.3	171.4	179.9	70	33	0	0	110.3	N960 L973 S974 V976 C981 E982 L1025	N960-Q978 PolarHBondContact ND2-NE2 2.89Å; L973-Q978 HydrophobicContact CB-CB 4.3Å; S974-Q978 WeakPolarHBondContact O-CB 3.47Å; S974-Q978 PolarHBondContact O-N 2.87Å; V976-Q978 PolarHBondContact O-N 2.86Å; Q978-C981 PolarHBondContact O-N 2.92Å; Q978-E982 WeakPolarHBondContact CG-OE1 3.21Å; Q978-E982 PolarHBondContact NE2-OE1 3.4Å; Q978-E982 WeakPolarHBondContact O-CB 3.48Å; Q978-E982 WeakPolarHBondContact O-CG 3.29Å; Q978-E982 PolarHBondContact O-N 3.21Å; Q978-L1025 PolarHBondContact NE2-O 2.72Å
979	R	94.7	Very high	88	Confident	41 Å²	41	41.2 Å²	41.2	16%	0.155	24%	0.241	C	C	.	.	H	α-helix	trans	-69.3	-35.4	178.2	-69	-173.7	-65.3	-101.3	9.6	113	I949 G950 P975 V976 D977 R983	I949-R979 VanDerWaalsContact O-CZ 3.25Å; I949-R979 PolarHBondContact O-NE 3.07Å; I949-R979 PolarHBondContact O-NH2 2.78Å; G950-R979 PolarHBondContact O-NH2 3.4Å; P975-R979 WeakPolarHBondContact O-CG 3.2Å; P975-R979 PolarHBondContact O-NE 2.92Å; P975-R979 PolarHBondContact O-NH1 3.05Å; P975-R979 VanDerWaalsContact O-NH1 3.13Å; V976-R979 PolarHBondContact O-N 3.46Å; V976-R979 VanDerWaalsContact O-N 3.16Å; D977-R979 VanDerWaalsContact C-N 3.28Å; D977-R979 PolarHBondContact O-N 2.98Å; R979-R983 WeakPolarHBondContact O-CB 3.4Å; R979-R983 PolarHBondContact O-N 3.12Å
980	K	96.3	Very high	90.8	Very high	23 Å²	23	35.9 Å²	35.9	10%	0.1	21%	0.209	C	C	.	.	H	α-helix	trans	-62.1	-46.6	172.4	-72.6	-169.1	173	-159.9	0	111.1	I949 V976 D977 R983 L984 I1078 Y1079 D1081	I949-K980 HydrophobicContact CD1-CG 4.35Å; I949-K980 HydrophobicContact CG2-CG 3.85Å; V976-K980 PolarHBondContact O-N 2.87Å; D977-K980 PolarHBondContact O-N 2.93Å; D977-K980 VanDerWaalsContact O-N 3.16Å; K980-R983 PolarHBondContact O-N 3.15Å; K980-L984 WeakPolarHBondContact O-CG 3.21Å; K980-L984 PolarHBondContact O-N 3.44Å; K980-I1078 HydrophobicContact CB-CG2 3.58Å; K980-I1078 HydrophobicContact CD-CG2 3.79Å; K980-I1078 WeakPolarHBondContact CE-O 3.44Å; K980-I1078 HydrophobicContact CG-CG2 3.6Å; K980-I1078 PolarHBondContact NZ-O 3.45Å; K980-Y1079 HydrophobicContact CB-CE2 3.74Å; K980-Y1079 WeakPolarHBondContact CB-OH 3.45Å; K980-Y1079 HydrophobicContact CD-CD1 3.87Å; K980-Y1079 HydrophobicContact CD-CD2 4.12Å; K980-Y1079 HydrophobicContact CD-CE1 3.37Å; K980-Y1079 HydrophobicContact CD-CE2 3.67Å; K980-Y1079 HydrophobicContact CD-CG 4.22Å; K980-Y1079 HydrophobicContact CG-CE2 4.33Å; K980-Y1079 VanDerWaalsContact NZ-CD1 3.35Å; K980-D1081 IonicContact NZ-OD1 3.53Å; K980-D1081 PolarHBondContact NZ-OD1 3.05Å
981	C	96.9	Very high	93.1	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-66.8	-41.8	177.3	-62.8	0	0	0	0	112.2	L973 D977 Q978 R983 L984 L985 L1025 F1039	L973-C981 HydrophobicContact CD1-CB 4.35Å; D977-C981 WeakPolarHBondContact O-CB 3.26Å; D977-C981 PolarHBondContact O-N 3.46Å; D977-C981 PolarHBondContact O-SG 2.92Å; Q978-C981 PolarHBondContact O-N 2.92Å; C981-R983 VanDerWaalsContact C-N 3.32Å; C981-R983 PolarHBondContact O-N 2.79Å; C981-L984 PolarHBondContact O-N 3.14Å; C981-L985 VanDerWaalsContact O-CB 3.31Å; C981-L985 WeakPolarHBondContact O-CB 3.32Å; C981-L985 PolarHBondContact O-N 3.16Å; C981-L1025 HydrophobicContact CB-CD1 3.73Å; C981-L1025 HydrophobicContact CB-CD2 4.19Å; C981-F1039 HydrophobicContact CB-CD1 4.03Å; C981-F1039 HydrophobicContact CB-CD2 4Å; C981-F1039 HydrophobicContact CB-CE1 4.03Å; C981-F1039 HydrophobicContact CB-CE2 3.99Å; C981-F1039 HydrophobicContact CB-CG 4.03Å; C981-F1039 HydrophobicContact CB-CZ 4.01Å; C981-F1039 VanDerWaalsContact O-CZ 3.32Å; C981-F1039 WeakPolarHBondContact O-CZ 3.46Å
982	E	96.4	Very high	94.5	Very high	9 Å²	9	32.1 Å²	32.1	4%	0.042	17%	0.174	C	C	.	.	H	α-helix	trans	-58.9	-41.2	173.9	-76.2	166.4	178.1	0	0	111.7	V930 T944 R947 Q978 L986 L1025	V930-E982 HydrophobicContact CG1-CB 4.24Å; V930-E982 HydrophobicContact CG1-CG 4.39Å; V930-E982 WeakPolarHBondContact CG1-O 3.29Å; T944-E982 HydrophobicContact CG2-CB 4.26Å; R947-E982 IonicContact NH2-OE2 2.78Å; Q978-E982 WeakPolarHBondContact CG-OE1 3.21Å; Q978-E982 PolarHBondContact NE2-OE1 3.4Å; Q978-E982 WeakPolarHBondContact O-CB 3.48Å; Q978-E982 WeakPolarHBondContact O-CG 3.29Å; Q978-E982 PolarHBondContact O-N 3.21Å; E982-L986 WeakPolarHBondContact O-CB 3.45Å; E982-L986 PolarHBondContact O-N 3.15Å; E982-L1025 HydrophobicContact CG-CD2 3.87Å; E982-L1025 HydrophobicContact CG-CG 4.38Å
983	R	97.3	Very high	95.3	Very high	36 Å²	36	34.7 Å²	34.7	14%	0.136	18%	0.18	C	C	.	.	H	α-helix	trans	-68.4	-45.3	175.4	-178.2	174.5	-68	-179.8	2.8	113	T944 F945 R947 R979 K980 C981 L985 L986 Y987 I1078	T944-R983 HydrophobicContact CG2-CB 3.91Å; T944-R983 VanDerWaalsContact O-CZ 3.24Å; T944-R983 PolarHBondContact O-NE 2.71Å; T944-R983 PolarHBondContact O-NH2 2.91Å; F945-R983 HydrophobicContact CD1-CG 4.18Å; F945-R983 PolarHBondContact O-NH2 2.68Å; R947-R983 PolarHBondContact O-NH2 3.16Å; R979-R983 WeakPolarHBondContact O-CB 3.4Å; R979-R983 PolarHBondContact O-N 3.12Å; K980-R983 PolarHBondContact O-N 3.15Å; C981-R983 VanDerWaalsContact C-N 3.32Å; C981-R983 PolarHBondContact O-N 2.79Å; R983-L985 VanDerWaalsContact C-N 3.28Å; R983-L985 PolarHBondContact O-N 3.33Å; R983-L986 PolarHBondContact O-N 3.21Å; R983-Y987 HydrophobicContact CG-CD2 3.96Å; R983-Y987 HydrophobicContact CG-CE2 3.77Å; R983-Y987 WeakPolarHBondContact O-CD2 3.47Å; R983-Y987 PolarHBondContact O-N 3.49Å; R983-I1078 HydrophobicContact CB-CD1 4.13Å; R983-I1078 HydrophobicContact CG-CD1 3.68Å
984	L	97.9	Very high	95.5	Very high	1 Å²	1	34 Å²	34	1%	0.005	18%	0.176	C	C	.	.	H	α-helix	trans	-57.3	-45.4	175.4	-76.4	165.7	0	0	0	110.8	K980 C981 Y987 L988 F1039 F1071 K1074 L1075 I1078 Y1079	K980-L984 WeakPolarHBondContact O-CG 3.21Å; K980-L984 PolarHBondContact O-N 3.44Å; C981-L984 PolarHBondContact O-N 3.14Å; L984-Y987 PolarHBondContact O-N 2.89Å; L984-L988 WeakPolarHBondContact O-CG 3.42Å; L984-L988 PolarHBondContact O-N 2.75Å; L984-F1039 HydrophobicContact CB-CE1 3.88Å; L984-F1039 HydrophobicContact CB-CZ 3.96Å; L984-F1039 HydrophobicContact CD1-CE1 3.95Å; L984-F1071 HydrophobicContact CB-CE2 4.45Å; L984-F1071 HydrophobicContact CD2-CE2 4.3Å; L984-K1074 HydrophobicContact CD2-CB 4.11Å; L984-L1075 HydrophobicContact CD1-CD1 3.74Å; L984-L1075 HydrophobicContact CD2-CB 4.36Å; L984-L1075 HydrophobicContact CD2-CD1 4.45Å; L984-I1078 HydrophobicContact CD1-CG2 4.36Å; L984-I1078 HydrophobicContact CD2-CB 4.44Å; L984-I1078 HydrophobicContact CD2-CD1 3.77Å; L984-I1078 HydrophobicContact CG-CD1 3.79Å; L984-I1078 HydrophobicContact CG-CG2 4.41Å; L984-Y1079 HydrophobicContact CD1-CD2 4.27Å; L984-Y1079 HydrophobicContact CD1-CE2 4.06Å
985	L	98.1	Very high	95.6	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-66	-41.6	178.5	-172.9	58.9	0	0	0	112	V930 C981 R983 Y987 L988 Y989 L1018 V1021 K1022 L1025 F1039	V930-L985 HydrophobicContact CG1-CB 4.21Å; V930-L985 HydrophobicContact CG1-CD2 4.01Å; V930-L985 HydrophobicContact CG1-CG 4.24Å; C981-L985 VanDerWaalsContact O-CB 3.31Å; C981-L985 WeakPolarHBondContact O-CB 3.32Å; C981-L985 PolarHBondContact O-N 3.16Å; R983-L985 VanDerWaalsContact C-N 3.28Å; R983-L985 PolarHBondContact O-N 3.33Å; L985-Y987 VanDerWaalsContact C-N 3.33Å; L985-Y987 PolarHBondContact O-N 3.29Å; L985-L988 PolarHBondContact O-N 3.03Å; L985-L988 VanDerWaalsContact O-N 3.16Å; L985-Y989 HydrophobicContact CD1-CD2 4.02Å; L985-Y989 HydrophobicContact CD1-CE2 3.75Å; L985-Y989 HydrophobicContact CD2-CE2 4.33Å; L985-Y989 HydrophobicContact CG-CD2 3.94Å; L985-Y989 HydrophobicContact CG-CE2 3.83Å; L985-Y989 WeakPolarHBondContact O-CD2 3.15Å; L985-Y989 PolarHBondContact O-N 3.47Å; L985-L1018 HydrophobicContact CD1-CB 4.36Å; L985-L1018 HydrophobicContact CD1-CD2 3.91Å; L985-V1021 HydrophobicContact CD1-CB 4.33Å; L985-V1021 HydrophobicContact CD1-CG1 3.92Å; L985-V1021 HydrophobicContact CD2-CG1 4.21Å; L985-K1022 HydrophobicContact CD2-CB 3.88Å; L985-K1022 HydrophobicContact CD2-CG 4.26Å; L985-L1025 HydrophobicContact CD2-CD2 3.84Å; L985-F1039 HydrophobicContact CB-CE2 4.19Å; L985-F1039 HydrophobicContact CB-CZ 4.14Å
986	L	97.6	Very high	95.6	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-62.6	-38.4	175.6	-166.8	59.9	0	0	0	112.2	V907 F924 V930 T944 F945 E982 R983 L988 Y989 C990	V907-L986 HydrophobicContact CG2-CD1 3.92Å; F924-L986 HydrophobicContact CD1-CD1 4.46Å; F924-L986 HydrophobicContact CE1-CD1 4Å; F924-L986 HydrophobicContact CE1-CD2 4.07Å; F924-L986 HydrophobicContact CE1-CG 4.36Å; F924-L986 HydrophobicContact CZ-CD2 4.2Å; V930-L986 HydrophobicContact CB-CB 4.07Å; V930-L986 HydrophobicContact CB-CD1 3.98Å; V930-L986 HydrophobicContact CG2-CB 4.47Å; V930-L986 HydrophobicContact CG2-CD1 3.89Å; T944-L986 HydrophobicContact CG2-CD2 4.45Å; F945-L986 HydrophobicContact CD1-CD2 4.36Å; F945-L986 HydrophobicContact CD2-CD2 4.13Å; F945-L986 HydrophobicContact CE1-CB 3.93Å; F945-L986 HydrophobicContact CE1-CD2 4.01Å; F945-L986 HydrophobicContact CE1-CG 3.91Å; F945-L986 HydrophobicContact CE2-CD2 3.8Å; F945-L986 HydrophobicContact CE2-CG 3.95Å; F945-L986 HydrophobicContact CG-CD2 4.41Å; F945-L986 HydrophobicContact CZ-CB 3.98Å; F945-L986 HydrophobicContact CZ-CD2 3.75Å; F945-L986 HydrophobicContact CZ-CG 3.49Å; F945-L986 VanDerWaalsContact CZ-CG 3.49Å; E982-L986 WeakPolarHBondContact O-CB 3.45Å; E982-L986 PolarHBondContact O-N 3.15Å; R983-L986 PolarHBondContact O-N 3.21Å; L986-L988 VanDerWaalsContact C-N 3.27Å; L986-L988 PolarHBondContact O-N 3.44Å; L986-Y989 PolarHBondContact O-N 3.45Å; L986-C990 WeakPolarHBondContact O-CB 3.34Å; L986-C990 PolarHBondContact O-N 3.09Å; L986-C990 PolarHBondContact O-SG 3.13Å
987	Y	97.9	Very high	95.8	Very high	40 Å²	40	36.7 Å²	36.7	16%	0.157	17%	0.174	C	C	.	.	H	α-helix	trans	-57.8	-40.5	174.1	-84.1	-51.3	0	0	0	111.7	F945 R983 L984 L985 C990 H991 Y1070 K1074 I1078	F945-Y987 AromaticContact CD1-CD1 3.91Å; F945-Y987 HydrophobicContact CD1-CD1 3.91Å; F945-Y987 HydrophobicContact CD1-CD2 4.49Å; F945-Y987 AromaticContact CD1-CE1 3.63Å; F945-Y987 HydrophobicContact CD1-CE1 3.63Å; F945-Y987 HydrophobicContact CD1-CE2 4.29Å; F945-Y987 HydrophobicContact CD1-CG 4.33Å; F945-Y987 AromaticContact CD1-CZ 3.87Å; F945-Y987 AromaticContact CE1-CD1 3.22Å; F945-Y987 HydrophobicContact CE1-CD1 3.22Å; F945-Y987 HydrophobicContact CE1-CD2 4.08Å; F945-Y987 AromaticContact CE1-CE1 3.46Å; F945-Y987 HydrophobicContact CE1-CE1 3.46Å; F945-Y987 VanDerWaalsContact CE1-CE1 3.46Å; F945-Y987 HydrophobicContact CE1-CE2 4.31Å; F945-Y987 AromaticContact CE1-CG 3.56Å; F945-Y987 HydrophobicContact CE1-CG 3.56Å; F945-Y987 HydrophobicContact CG-CE1 4.5Å; F945-Y987 AromaticContact CZ-CD1 3.77Å; F945-Y987 HydrophobicContact CZ-CD1 3.77Å; F945-Y987 HydrophobicContact CZ-CE1 4.18Å; F945-Y987 HydrophobicContact CZ-CG 4.33Å; R983-Y987 HydrophobicContact CG-CD2 3.96Å; R983-Y987 HydrophobicContact CG-CE2 3.77Å; R983-Y987 WeakPolarHBondContact O-CD2 3.47Å; R983-Y987 PolarHBondContact O-N 3.49Å; L984-Y987 PolarHBondContact O-N 2.89Å; L985-Y987 VanDerWaalsContact C-N 3.33Å; L985-Y987 PolarHBondContact O-N 3.29Å; Y987-C990 PolarHBondContact O-N 3.22Å; Y987-H991 PolarHBondContact O-N 2.89Å; Y987-Y1070 VanDerWaalsContact CD1-OH 3.29Å; Y987-Y1070 WeakPolarHBondContact CD1-OH 3.25Å; Y987-Y1070 WeakPolarHBondContact O-CE1 3.36Å; Y987-K1074 HydrophobicContact CD1-CD 4.15Å; Y987-K1074 HydrophobicContact CD2-CB 4.15Å; Y987-K1074 HydrophobicContact CD2-CD 3.67Å; Y987-K1074 HydrophobicContact CD2-CG 4.1Å; Y987-K1074 HydrophobicContact CE1-CD 4.05Å; Y987-K1074 HydrophobicContact CE2-CD 3.5Å; Y987-K1074 HydrophobicContact CE2-CG 4.41Å; Y987-K1074 HydrophobicContact CG-CD 3.98Å; Y987-K1074 HydrophobicContact CG-CG 4.28Å; Y987-I1078 HydrophobicContact CD2-CD1 4.19Å; Y987-I1078 HydrophobicContact CE2-CD1 3.97Å
988	L	98	Very high	95.9	Very high	1 Å²	1	36.9 Å²	36.9	1%	0.005	17%	0.174	C	C	.	.	H	α-helix	trans	-68.2	-44.7	177.3	-58.7	173.7	0	0	0	112.1	L984 L985 L986 C990 H991 S994 L1018 V1043 V1067 Y1070 F1071	L984-L988 WeakPolarHBondContact O-CG 3.42Å; L984-L988 PolarHBondContact O-N 2.75Å; L985-L988 PolarHBondContact O-N 3.03Å; L985-L988 VanDerWaalsContact O-N 3.16Å; L986-L988 VanDerWaalsContact C-N 3.27Å; L986-L988 PolarHBondContact O-N 3.44Å; L988-C990 PolarHBondContact O-N 3.12Å; L988-H991 PolarHBondContact O-N 2.77Å; L988-H991 VanDerWaalsContact O-N 3.14Å; L988-S994 WeakPolarHBondContact O-CB 3.39Å; L988-S994 PolarHBondContact O-OG 3.3Å; L988-L1018 HydrophobicContact CB-CD1 4.06Å; L988-L1018 HydrophobicContact CB-CD2 4.11Å; L988-L1018 HydrophobicContact CD1-CD2 3.69Å; L988-V1043 HydrophobicContact CD1-CG1 3.72Å; L988-V1043 HydrophobicContact CD1-CG2 4.43Å; L988-V1067 HydrophobicContact CD2-CG1 3.8Å; L988-Y1070 HydrophobicContact CD2-CD1 4.48Å; L988-F1071 HydrophobicContact CD1-CD2 3.98Å; L988-F1071 HydrophobicContact CD1-CE2 4.5Å; L988-F1071 HydrophobicContact CD2-CB 3.94Å; L988-F1071 HydrophobicContact CD2-CD2 4.17Å; L988-F1071 HydrophobicContact CD2-CG 4.47Å; L988-F1071 HydrophobicContact CG-CD2 4.44Å
989	Y	97.5	Very high	95.9	Very high	15 Å²	15	42.1 Å²	42.1	6%	0.059	20%	0.199	C	C	.	.	H	α-helix	trans	-61	-31.6	175.4	-88.4	-79.3	0	0	0	113.1	V907 V930 L985 L986 Q998 L1018 S1019 K1022	V907-Y989 HydrophobicContact CG1-CD1 3.92Å; V907-Y989 HydrophobicContact CG1-CG 4.32Å; V930-Y989 HydrophobicContact CG2-CD2 4Å; V930-Y989 HydrophobicContact CG2-CE2 4.39Å; L985-Y989 HydrophobicContact CD1-CD2 4.02Å; L985-Y989 HydrophobicContact CD1-CE2 3.75Å; L985-Y989 HydrophobicContact CD2-CE2 4.33Å; L985-Y989 HydrophobicContact CG-CD2 3.94Å; L985-Y989 HydrophobicContact CG-CE2 3.83Å; L985-Y989 WeakPolarHBondContact O-CD2 3.15Å; L985-Y989 PolarHBondContact O-N 3.47Å; L986-Y989 PolarHBondContact O-N 3.45Å; Y989-Q998 HydrophobicContact CD1-CG 4.24Å; Y989-Q998 HydrophobicContact CE1-CB 4.41Å; Y989-Q998 HydrophobicContact CE1-CG 4.21Å; Y989-L1018 HydrophobicContact CE2-CB 3.92Å; Y989-L1018 PolarHBondContact OH-O 2.96Å; Y989-S1019 WeakPolarHBondContact OH-CA 3.45Å; Y989-S1019 PolarHBondContact OH-N 2.96Å; Y989-K1022 HydrophobicContact CE2-CB 4.31Å; Y989-K1022 HydrophobicContact CE2-CD 4Å
990	C	96	Very high	95.9	Very high	29 Å²	29	43 Å²	43	20%	0.196	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.6	-1.5	176.9	-62.7	0	0	0	0	114.8	A906 V907 F945 L986 Y987 L988	A906-C990 WeakPolarHBondContact O-CA 3.27Å; A906-C990 WeakPolarHBondContact O-CB 3.46Å; A906-C990 PolarHBondContact O-SG 3.24Å; A906-C990 VanDerWaalsContact O-SG 3.37Å; V907-C990 VanDerWaalsContact CG2-SG 3.57Å; F945-C990 HydrophobicContact CZ-CB 4.26Å; L986-C990 WeakPolarHBondContact O-CB 3.34Å; L986-C990 PolarHBondContact O-N 3.09Å; L986-C990 PolarHBondContact O-SG 3.13Å; Y987-C990 PolarHBondContact O-N 3.22Å; L988-C990 PolarHBondContact O-N 3.12Å
991	H	95.6	Very high	95.8	Very high	39 Å²	39	43.8 Å²	43.8	18%	0.181	22%	0.217	C	C	.	.	S	Bend	trans	-91.8	119.6	-177.7	-176	-72.9	0	0	0	111.1	Y987 L988 L993 S994 Y1070	Y987-H991 PolarHBondContact O-N 2.89Å; L988-H991 PolarHBondContact O-N 2.77Å; L988-H991 VanDerWaalsContact O-N 3.14Å; H991-L993 VanDerWaalsContact C-N 3.25Å; H991-L993 PolarHBondContact ND1-N 2.85Å; H991-L993 PolarHBondContact O-N 3.22Å; H991-S994 VanDerWaalsContact O-CB 3.23Å; H991-S994 WeakPolarHBondContact O-CB 3.47Å; H991-S994 PolarHBondContact O-N 3.03Å; H991-S994 PolarHBondContact O-OG 2.88Å; H991-Y1070 HydrophobicContact CB-CD1 4.21Å; H991-Y1070 HydrophobicContact CB-CE1 4.09Å; H991-Y1070 AromaticContact CD2-CD1 3.44Å; H991-Y1070 VanDerWaalsContact CD2-CD1 3.44Å; H991-Y1070 WeakPolarHBondContact CD2-CD1 3.39Å; H991-Y1070 AromaticContact CD2-CE1 3.81Å; H991-Y1070 AromaticContact CD2-CG 3.56Å
992	E	93.9	Very high	95.6	Very high	155 Å²	155	47.4 Å²	47.4	72%	0.724	24%	0.24	S	C	*	.	G	3₁₀ helix	trans	-47.5	-40.2	-172.5	-61.8	175	172.6	0	0	114.9	S994	E992-S994 VanDerWaalsContact C-N 3.29Å; E992-S994 PolarHBondContact O-N 3.44Å
993	L	94.4	Very high	95.2	Very high	84 Å²	84	53.1 Å²	53.1	44%	0.44	28%	0.275	S	S	.	.	G	3₁₀ helix	trans	-83.1	9.3	-179.9	-51.5	179.8	0	0	0	114.8	H991 A1063 A1066 V1067	H991-L993 VanDerWaalsContact C-N 3.25Å; H991-L993 PolarHBondContact ND1-N 2.85Å; H991-L993 PolarHBondContact O-N 3.22Å; L993-A1063 HydrophobicContact CB-CB 4.12Å; L993-A1066 HydrophobicContact CD1-CB 3.91Å; L993-V1067 HydrophobicContact CB-CG2 3.99Å; L993-V1067 WeakPolarHBondContact O-CG2 3.43Å
994	S	95.1	Very high	94.8	Very high	1 Å²	1	55.7 Å²	55.7	1%	0.007	30%	0.299	C	S	.	.	G	3₁₀ helix	trans	-84.5	-13	-178.1	75.1	0	0	0	0	114.6	L988 H991 E992 E996 F997 Q998	L988-S994 WeakPolarHBondContact O-CB 3.39Å; L988-S994 PolarHBondContact O-OG 3.3Å; H991-S994 VanDerWaalsContact O-CB 3.23Å; H991-S994 WeakPolarHBondContact O-CB 3.47Å; H991-S994 PolarHBondContact O-N 3.03Å; H991-S994 PolarHBondContact O-OG 2.88Å; E992-S994 VanDerWaalsContact C-N 3.29Å; E992-S994 PolarHBondContact O-N 3.44Å; S994-E996 VanDerWaalsContact C-N 3.34Å; S994-E996 PolarHBondContact O-N 3.45Å; S994-F997 CarbonylContact O-C 3.47Å; S994-F997 WeakPolarHBondContact O-CA 3.5Å; S994-F997 WeakPolarHBondContact O-CB 3.21Å; S994-F997 PolarHBondContact O-N 2.85Å; S994-Q998 PolarHBondContact O-N 3.24Å; S994-Q998 PolarHBondContact OG-NE2 3.41Å
995	I	92.3	Very high	94.4	Very high	118 Å²	118	58.7 Å²	58.7	61%	0.605	31%	0.314	S	S	*	.	G	3₁₀ helix	trans	-51.2	-48.2	-170.1	-61.2	169.8	0	0	0	112.4	F997 Q998	I995-F997 PolarHBondContact O-N 2.86Å; I995-Q998 PolarHBondContact O-N 2.87Å; I995-Q998 VanDerWaalsContact O-N 3.08Å
996	E	91.4	Very high	93.9	Very high	122 Å²	122	63.3 Å²	63.3	57%	0.57	34%	0.344	S	S	*	.	G	3₁₀ helix	trans	-61.1	-6.3	177.7	-58.1	-60.9	148.9	0	0	114.7	S994 V1060	S994-E996 VanDerWaalsContact C-N 3.34Å; S994-E996 PolarHBondContact O-N 3.45Å; E996-V1060 HydrophobicContact CB-CG1 4.44Å
997	F	96.4	Very high	93.5	Very high	13 Å²	13	67.3 Å²	67.3	6%	0.057	37%	0.365	C	S	.	.	G	3₁₀ helix	trans	-123.2	0.2	-178	-49	-66.4	0	0	0	113	S994 I995 L1018 I1046 F1047 C1050 V1060 A1063	S994-F997 CarbonylContact O-C 3.47Å; S994-F997 WeakPolarHBondContact O-CA 3.5Å; S994-F997 WeakPolarHBondContact O-CB 3.21Å; S994-F997 PolarHBondContact O-N 2.85Å; I995-F997 PolarHBondContact O-N 2.86Å; F997-L1018 HydrophobicContact CB-CD1 4.47Å; F997-L1018 WeakPolarHBondContact O-CG 3.41Å; F997-L1018 PolarHBondContact O-N 2.87Å; F997-I1046 HydrophobicContact CB-CG2 3.73Å; F997-I1046 HydrophobicContact CD1-CG2 3.69Å; F997-I1046 HydrophobicContact CG-CG2 3.91Å; F997-F1047 HydrophobicContact CD2-CE1 4.32Å; F997-F1047 HydrophobicContact CG-CE1 4.41Å; F997-C1050 HydrophobicContact CE1-CB 3.84Å; F997-C1050 HydrophobicContact CZ-CB 4.43Å; F997-V1060 HydrophobicContact CE1-CG1 4.17Å; F997-V1060 HydrophobicContact CZ-CG1 4.02Å; F997-A1063 HydrophobicContact CE2-CB 4.15Å
998	Q	95.3	Very high	93.3	Very high	37 Å²	37	66 Å²	66	17%	0.173	36%	0.361	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73	-42.3	-177.5	-68.6	-168.5	20.8	0	0	112.2	Y989 S994 I995 L1018 S1019	Y989-Q998 HydrophobicContact CD1-CG 4.24Å; Y989-Q998 HydrophobicContact CE1-CB 4.41Å; Y989-Q998 HydrophobicContact CE1-CG 4.21Å; S994-Q998 PolarHBondContact O-N 3.24Å; S994-Q998 PolarHBondContact OG-NE2 3.41Å; I995-Q998 PolarHBondContact O-N 2.87Å; I995-Q998 VanDerWaalsContact O-N 3.08Å; Q998-L1018 HydrophobicContact CG-CD1 4.18Å; Q998-S1019 WeakPolarHBondContact O-CB 3.06Å; Q998-S1019 PolarHBondContact O-N 3.39Å
999	E	94.2	Very high	93.1	Very high	120 Å²	120	70.9 Å²	70.9	56%	0.561	38%	0.38	S	S	*	.	S	Bend	trans	-113.3	163.4	-179.2	-69.7	-60.9	149.6	0	0	112.3
1000	P	95.3	Very high	92.9	Very high	59 Å²	59	77 Å²	77	38%	0.383	41%	0.406	S	S	.	.	P	Polyproline II helix	trans	-60.5	136.9	176.7	-21.7	32.3	0	0	0	112.9
1001	V	93.6	Very high	92.7	Very high	41 Å²	41	79 Å²	79	25%	0.248	41%	0.414	C	S	.	.	P	Polyproline II helix	trans	-60	126.2	178.2	179.4	0	0	0	0	110.7	I1005 Y1008 Y1009	V1001-I1005 HydrophobicContact CG1-CB 4.1Å; V1001-I1005 HydrophobicContact CG1-CG1 3.76Å; V1001-I1005 HydrophobicContact CG1-CG2 4.42Å; V1001-Y1008 HydrophobicContact CB-CD1 4.09Å; V1001-Y1008 HydrophobicContact CB-CE1 3.77Å; V1001-Y1008 HydrophobicContact CB-CE2 4.21Å; V1001-Y1008 HydrophobicContact CB-CG 4.47Å; V1001-Y1008 HydrophobicContact CG1-CD1 3.96Å; V1001-Y1008 HydrophobicContact CG1-CD2 3.87Å; V1001-Y1008 HydrophobicContact CG1-CE1 4.08Å; V1001-Y1008 HydrophobicContact CG1-CE2 3.98Å; V1001-Y1008 HydrophobicContact CG1-CG 3.87Å; V1001-Y1008 HydrophobicContact CG2-CE1 4.1Å; V1001-Y1008 HydrophobicContact CG2-CE2 3.98Å; V1001-Y1009 PolarHBondContact O-OH 3.04Å
1002	P	93	Very high	92.7	Very high	75 Å²	75	77.2 Å²	77.2	49%	0.487	41%	0.406	S	S	.	.	P	Polyproline II helix	trans	-60.4	146.2	-175	-28.2	36.1	0	0	0	115.1	S1004 I1005	P1002-S1004 WeakPolarHBondContact CB-OG 3.31Å; P1002-S1004 PolarHBondContact O-N 3.37Å; P1002-S1004 VanDerWaalsContact O-N 3.11Å; P1002-I1005 HydrophobicContact CB-CG1 4.41Å; P1002-I1005 WeakPolarHBondContact O-CB 3.43Å; P1002-I1005 WeakPolarHBondContact O-CG1 3.49Å; P1002-I1005 PolarHBondContact O-N 3.38Å
1003	V	89.4	Confident	92.7	Very high	129 Å²	129	77.3 Å²	77.3	78%	0.782	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-16.4	174.8	-64.2	0	0	0	0	114.1	I1005 Y1009	V1003-I1005 VanDerWaalsContact C-N 3.28Å; V1003-I1005 PolarHBondContact O-N 3.44Å; V1003-Y1009 HydrophobicContact CB-CE2 4.42Å; V1003-Y1009 HydrophobicContact CG1-CE2 3.85Å
1004	S	88.9	Confident	92.7	Very high	91 Å²	91	79.6 Å²	79.6	64%	0.636	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.6	-13.1	173.3	51.5	0	0	0	0	114.1	P1002 P1006	P1002-S1004 WeakPolarHBondContact CB-OG 3.31Å; P1002-S1004 PolarHBondContact O-N 3.37Å; P1002-S1004 VanDerWaalsContact O-N 3.11Å; S1004-P1006 VanDerWaalsContact O-CD 3.25Å; S1004-P1006 WeakPolarHBondContact O-CD 3.33Å
1005	I	87.8	Confident	92.7	Very high	63 Å²	63	82.3 Å²	82.3	32%	0.323	43%	0.428	S	S	.	.	S	Bend	trans	-75	112.9	178.4	-57.4	-56.4	0	0	0	109.8	V1001 P1002 V1003 N1007 Y1008 F1053	V1001-I1005 HydrophobicContact CG1-CB 4.1Å; V1001-I1005 HydrophobicContact CG1-CG1 3.76Å; V1001-I1005 HydrophobicContact CG1-CG2 4.42Å; P1002-I1005 HydrophobicContact CB-CG1 4.41Å; P1002-I1005 WeakPolarHBondContact O-CB 3.43Å; P1002-I1005 WeakPolarHBondContact O-CG1 3.49Å; P1002-I1005 PolarHBondContact O-N 3.38Å; V1003-I1005 VanDerWaalsContact C-N 3.28Å; V1003-I1005 PolarHBondContact O-N 3.44Å; I1005-N1007 PolarHBondContact O-N 2.89Å; I1005-Y1008 PolarHBondContact O-N 3.44Å; I1005-F1053 HydrophobicContact CG2-CE1 3.67Å; I1005-F1053 HydrophobicContact CG2-CZ 3.59Å
1006	P	88.2	Confident	92.9	Very high	98 Å²	98	77.9 Å²	77.9	64%	0.636	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	132	-168.8	-26.9	36.5	0	0	0	113.3	S1004 Y1008	S1004-P1006 VanDerWaalsContact O-CD 3.25Å; S1004-P1006 WeakPolarHBondContact O-CD 3.33Å; P1006-Y1008 PolarHBondContact O-N 3.2Å
1007	N	89.5	Confident	93.2	Very high	83 Å²	83	72.6 Å²	72.6	44%	0.444	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.7	5	177.9	-54.4	-50.9	0	0	0	116.5	I1005 Y1009 K1010 I1011	I1005-N1007 PolarHBondContact O-N 2.89Å; N1007-Y1009 PolarHBondContact O-N 3.11Å; N1007-K1010 HydrophobicContact CB-CB 4.42Å; N1007-K1010 HydrophobicContact CB-CD 4.37Å; N1007-K1010 WeakPolarHBondContact O-CA 3.25Å; N1007-K1010 WeakPolarHBondContact O-CB 3.24Å; N1007-K1010 PolarHBondContact O-N 3.31Å; N1007-K1010 WeakPolarHBondContact OD1-CD 3.23Å; N1007-K1010 WeakPolarHBondContact OD1-CE 3.45Å; N1007-K1010 PolarHBondContact OD1-NZ 2.67Å; N1007-I1011 HydrophobicContact CB-CD1 4.19Å; N1007-I1011 WeakPolarHBondContact O-CG1 3.33Å; N1007-I1011 PolarHBondContact O-N 3.27Å
1008	Y	93.2	Very high	93.3	Very high	14 Å²	14	72 Å²	72	6%	0.055	38%	0.378	C	S	.	.	H	α-helix	trans	-53.4	-56.9	-178.7	-177.5	-94.5	0	0	0	112.1	V1001 I1005 P1006 K1010 I1011 I1012 P1015 F1053	V1001-Y1008 HydrophobicContact CB-CD1 4.09Å; V1001-Y1008 HydrophobicContact CB-CE1 3.77Å; V1001-Y1008 HydrophobicContact CB-CE2 4.21Å; V1001-Y1008 HydrophobicContact CB-CG 4.47Å; V1001-Y1008 HydrophobicContact CG1-CD1 3.96Å; V1001-Y1008 HydrophobicContact CG1-CD2 3.87Å; V1001-Y1008 HydrophobicContact CG1-CE1 4.08Å; V1001-Y1008 HydrophobicContact CG1-CE2 3.98Å; V1001-Y1008 HydrophobicContact CG1-CG 3.87Å; V1001-Y1008 HydrophobicContact CG2-CE1 4.1Å; V1001-Y1008 HydrophobicContact CG2-CE2 3.98Å; I1005-Y1008 PolarHBondContact O-N 3.44Å; P1006-Y1008 PolarHBondContact O-N 3.2Å; Y1008-K1010 PolarHBondContact O-N 3.01Å; Y1008-I1011 PolarHBondContact O-N 2.75Å; Y1008-I1011 VanDerWaalsContact O-N 3.11Å; Y1008-I1012 HydrophobicContact CD1-CB 4.47Å; Y1008-I1012 HydrophobicContact CD2-CG1 4.15Å; Y1008-I1012 HydrophobicContact CE1-CB 4.1Å; Y1008-I1012 HydrophobicContact CE1-CG1 4.34Å; Y1008-I1012 HydrophobicContact CE1-CG2 4.16Å; Y1008-I1012 HydrophobicContact CE2-CB 4.47Å; Y1008-I1012 HydrophobicContact CE2-CG1 3.81Å; Y1008-I1012 WeakPolarHBondContact O-CB 3.31Å; Y1008-I1012 PolarHBondContact O-N 3.06Å; Y1008-P1015 HydrophobicContact CE1-CB 4.26Å; Y1008-F1053 VanDerWaalsContact CA-CE2 3.49Å; Y1008-F1053 HydrophobicContact CD2-CB 4.23Å; Y1008-F1053 AromaticContact CD2-CD1 3.77Å; Y1008-F1053 HydrophobicContact CD2-CD1 3.77Å; Y1008-F1053 AromaticContact CD2-CD2 3.73Å; Y1008-F1053 HydrophobicContact CD2-CD2 3.73Å; Y1008-F1053 HydrophobicContact CD2-CE1 4.03Å; Y1008-F1053 HydrophobicContact CD2-CE2 4.01Å; Y1008-F1053 AromaticContact CD2-CG 3.61Å; Y1008-F1053 HydrophobicContact CD2-CG 3.61Å; Y1008-F1053 HydrophobicContact CD2-CZ 4.15Å; Y1008-F1053 HydrophobicContact CE2-CB 4.19Å; Y1008-F1053 HydrophobicContact CE2-CD1 4.25Å; Y1008-F1053 HydrophobicContact CE2-CG 4.06Å; Y1008-F1053 HydrophobicContact CG-CD2 4.47Å; Y1008-F1053 HydrophobicContact CG-CE2 4.46Å
1009	Y	94.4	Very high	93.3	Very high	103 Å²	103	70.4 Å²	70.4	40%	0.404	37%	0.371	S	S	.	.	H	α-helix	trans	-69.1	-13.8	178.1	-67.5	-86.8	0	0	0	114.3	V1001 V1003 N1007 P1015	V1001-Y1009 PolarHBondContact O-OH 3.04Å; V1003-Y1009 HydrophobicContact CB-CE2 4.42Å; V1003-Y1009 HydrophobicContact CG1-CE2 3.85Å; N1007-Y1009 PolarHBondContact O-N 3.11Å; Y1009-P1015 HydrophobicContact CD1-CG 4.4Å; Y1009-P1015 HydrophobicContact CE1-CB 4.32Å; Y1009-P1015 HydrophobicContact CE1-CG 4.05Å
1010	K	92.5	Very high	93.5	Very high	143 Å²	143	66.6 Å²	66.6	62%	0.622	36%	0.356	S	S	*	.	H	α-helix	trans	-76.4	-40	169.7	-60.1	-172.4	-171	165.9	0	111	N1007 Y1008 K1013	N1007-K1010 HydrophobicContact CB-CB 4.42Å; N1007-K1010 HydrophobicContact CB-CD 4.37Å; N1007-K1010 WeakPolarHBondContact O-CA 3.25Å; N1007-K1010 WeakPolarHBondContact O-CB 3.24Å; N1007-K1010 PolarHBondContact O-N 3.31Å; N1007-K1010 WeakPolarHBondContact OD1-CD 3.23Å; N1007-K1010 WeakPolarHBondContact OD1-CE 3.45Å; N1007-K1010 PolarHBondContact OD1-NZ 2.67Å; Y1008-K1010 PolarHBondContact O-N 3.01Å; K1010-K1013 WeakPolarHBondContact O-CE 3.24Å; K1010-K1013 PolarHBondContact O-NZ 3.41Å
1011	I	93	Very high	93.6	Very high	71 Å²	71	63.8 Å²	63.8	36%	0.364	34%	0.338	S	S	.	.	H	α-helix	trans	-86.3	-38.8	-174.9	-64.7	168	0	0	0	112.3	N1007 Y1008 R1052 F1053	N1007-I1011 HydrophobicContact CB-CD1 4.19Å; N1007-I1011 WeakPolarHBondContact O-CG1 3.33Å; N1007-I1011 PolarHBondContact O-N 3.27Å; Y1008-I1011 PolarHBondContact O-N 2.75Å; Y1008-I1011 VanDerWaalsContact O-N 3.11Å; I1011-R1052 HydrophobicContact CG2-CG 4.3Å; I1011-R1052 PolarHBondContact O-NE 3.2Å; I1011-F1053 HydrophobicContact CB-CD2 4.43Å; I1011-F1053 HydrophobicContact CD1-CD2 4.06Å; I1011-F1053 HydrophobicContact CD1-CE2 4.07Å
1012	I	94.8	Very high	93.7	Very high	2 Å²	2	63.4 Å²	63.4	1%	0.01	33%	0.333	C	S	.	.			trans	-101.9	99.8	-177.2	-57.7	-55.9	0	0	0	109.4	Y1008 P1015 N1049 R1052 F1053	Y1008-I1012 HydrophobicContact CD1-CB 4.47Å; Y1008-I1012 HydrophobicContact CD2-CG1 4.15Å; Y1008-I1012 HydrophobicContact CE1-CB 4.1Å; Y1008-I1012 HydrophobicContact CE1-CG1 4.34Å; Y1008-I1012 HydrophobicContact CE1-CG2 4.16Å; Y1008-I1012 HydrophobicContact CE2-CB 4.47Å; Y1008-I1012 HydrophobicContact CE2-CG1 3.81Å; Y1008-I1012 WeakPolarHBondContact O-CB 3.31Å; Y1008-I1012 PolarHBondContact O-N 3.06Å; I1012-P1015 HydrophobicContact CG2-CB 4.46Å; I1012-N1049 HydrophobicContact CD1-CB 4.19Å; I1012-N1049 HydrophobicContact CG2-CB 4.09Å; I1012-R1052 HydrophobicContact CD1-CB 3.8Å; I1012-R1052 HydrophobicContact CD1-CG 3.72Å; I1012-F1053 HydrophobicContact CD1-CB 4.21Å; I1012-F1053 HydrophobicContact CG1-CB 4.21Å
1013	K	93.8	Very high	93.8	Very high	157 Å²	157	64.4 Å²	64.4	68%	0.683	33%	0.33	S	S	*	.	S	Bend	trans	-78.4	-16.1	-177.5	-54.5	-54.7	-165.6	-171.3	0	114.4	K1010	K1010-K1013 WeakPolarHBondContact O-CE 3.24Å; K1010-K1013 PolarHBondContact O-NZ 3.41Å
1014	K	94.1	Very high	94.1	Very high	132 Å²	132	59.4 Å²	59.4	57%	0.574	30%	0.298	S	S	*	.	S	Bend	trans	-136	75.2	-179.1	-68.4	-175.8	-179.4	178.6	0	109.7	L1045 N1049	K1014-L1045 HydrophobicContact CB-CD1 4.29Å; K1014-L1045 HydrophobicContact CB-CD2 4.43Å; K1014-N1049 PolarHBondContact O-ND2 2.85Å
1015	P	95.5	Very high	94.3	Very high	58 Å²	58	55.4 Å²	55.4	38%	0.377	27%	0.269	S	S	.	.			trans	-61.5	149.6	176.9	28.1	-35.9	0	0	0	111.2	Y1008 Y1009 I1012	Y1008-P1015 HydrophobicContact CE1-CB 4.26Å; Y1009-P1015 HydrophobicContact CD1-CG 4.4Å; Y1009-P1015 HydrophobicContact CE1-CB 4.32Å; Y1009-P1015 HydrophobicContact CE1-CG 4.05Å; I1012-P1015 HydrophobicContact CG2-CB 4.46Å
1016	M	97.2	Very high	94.5	Very high	25 Å²	25	54.6 Å²	54.6	12%	0.123	26%	0.264	C	S	.	.			trans	-158.6	146.4	179.8	-170.3	54	59.8	0	0	110	T1020 V1021 D1042 L1045 I1046	M1016-T1020 HydrophobicContact CE-CG2 4.03Å; M1016-T1020 HydrophobicContact SD-CG2 3.57Å; M1016-T1020 VanDerWaalsContact SD-CG2 3.57Å; M1016-V1021 HydrophobicContact CG-CG2 4.22Å; M1016-V1021 HydrophobicContact SD-CG2 3.93Å; M1016-D1042 HydrophobicContact CE-CB 4.33Å; M1016-D1042 HydrophobicContact CG-CB 4.09Å; M1016-D1042 VanDerWaalsContact CG-O 3.31Å; M1016-D1042 WeakPolarHBondContact CG-O 3.46Å; M1016-D1042 HydrophobicContact SD-CB 4.15Å; M1016-L1045 HydrophobicContact CB-CD2 4.04Å; M1016-I1046 HydrophobicContact CB-CG1 4.15Å; M1016-I1046 HydrophobicContact CG-CG1 3.84Å
1017	D	97.7	Very high	94.4	Very high	10 Å²	10	54.1 Å²	54.1	5%	0.053	25%	0.252	C	S	.	.			trans	-153.6	163.3	-174	64.1	92.8	0	0	0	110.6	S1019 T1020 V1021	D1017-S1019 VanDerWaalsContact C-N 3.3Å; D1017-S1019 PolarHBondContact O-N 2.98Å; D1017-S1019 WeakPolarHBondContact OD1-CA 3.49Å; D1017-S1019 WeakPolarHBondContact OD1-CB 3.29Å; D1017-S1019 PolarHBondContact OD1-N 3.18Å; D1017-S1019 PolarHBondContact OD1-OG 3.07Å; D1017-T1020 PolarHBondContact O-N 3.02Å; D1017-T1020 PolarHBondContact OD1-N 3.42Å; D1017-T1020 PolarHBondContact OD1-OG1 3.42Å; D1017-T1020 WeakPolarHBondContact OD2-CB 3.4Å; D1017-T1020 PolarHBondContact OD2-OG1 2.75Å; D1017-V1021 WeakPolarHBondContact O-CG2 3.41Å; D1017-V1021 PolarHBondContact O-N 2.86Å
1018	L	97.8	Very high	94.1	Very high	0 Å²	0	55 Å²	55	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-70.5	-22	-175.5	-58.2	168.7	0	0	0	113.2	L985 L988 Y989 F997 Q998 K1022 I1046	L985-L1018 HydrophobicContact CD1-CB 4.36Å; L985-L1018 HydrophobicContact CD1-CD2 3.91Å; L988-L1018 HydrophobicContact CB-CD1 4.06Å; L988-L1018 HydrophobicContact CB-CD2 4.11Å; L988-L1018 HydrophobicContact CD1-CD2 3.69Å; Y989-L1018 HydrophobicContact CE2-CB 3.92Å; Y989-L1018 PolarHBondContact OH-O 2.96Å; F997-L1018 HydrophobicContact CB-CD1 4.47Å; F997-L1018 WeakPolarHBondContact O-CG 3.41Å; F997-L1018 PolarHBondContact O-N 2.87Å; Q998-L1018 HydrophobicContact CG-CD1 4.18Å; L1018-K1022 VanDerWaalsContact O-CB 3.25Å; L1018-K1022 WeakPolarHBondContact O-CB 3.4Å; L1018-K1022 PolarHBondContact O-N 3.25Å; L1018-I1046 HydrophobicContact CD2-CD1 3.51Å; L1018-I1046 HydrophobicContact CG-CD1 3.9Å
1019	S	96.5	Very high	93.8	Very high	5 Å²	5	57.2 Å²	57.2	4%	0.035	26%	0.262	C	S	.	.	H	α-helix	trans	-69.4	-41.7	171.7	91.1	0	0	0	0	110	Y989 Q998 D1017 K1022 K1023	Y989-S1019 WeakPolarHBondContact OH-CA 3.45Å; Y989-S1019 PolarHBondContact OH-N 2.96Å; Q998-S1019 WeakPolarHBondContact O-CB 3.06Å; Q998-S1019 PolarHBondContact O-N 3.39Å; D1017-S1019 VanDerWaalsContact C-N 3.3Å; D1017-S1019 PolarHBondContact O-N 2.98Å; D1017-S1019 WeakPolarHBondContact OD1-CA 3.49Å; D1017-S1019 WeakPolarHBondContact OD1-CB 3.29Å; D1017-S1019 PolarHBondContact OD1-N 3.18Å; D1017-S1019 PolarHBondContact OD1-OG 3.07Å; S1019-K1022 CarbonylContact O-C 3.46Å; S1019-K1022 WeakPolarHBondContact O-CB 3.47Å; S1019-K1022 PolarHBondContact O-N 2.89Å; S1019-K1023 WeakPolarHBondContact O-CB 3.39Å; S1019-K1023 VanDerWaalsContact O-CD 3.27Å; S1019-K1023 WeakPolarHBondContact O-CD 3.44Å; S1019-K1023 WeakPolarHBondContact O-CG 3.49Å; S1019-K1023 PolarHBondContact O-N 3.47Å; S1019-K1023 PolarHBondContact OG-NZ 2.59Å
1020	T	96.8	Very high	93.6	Very high	39 Å²	39	58 Å²	58	24%	0.239	28%	0.282	C	S	.	.	H	α-helix	trans	-67.4	-41.1	176.7	-63.3	0	0	0	0	111.1	M1016 D1017 K1023 K1024	M1016-T1020 HydrophobicContact CE-CG2 4.03Å; M1016-T1020 HydrophobicContact SD-CG2 3.57Å; M1016-T1020 VanDerWaalsContact SD-CG2 3.57Å; D1017-T1020 PolarHBondContact O-N 3.02Å; D1017-T1020 PolarHBondContact OD1-N 3.42Å; D1017-T1020 PolarHBondContact OD1-OG1 3.42Å; D1017-T1020 WeakPolarHBondContact OD2-CB 3.4Å; D1017-T1020 PolarHBondContact OD2-OG1 2.75Å; T1020-K1023 PolarHBondContact O-N 3.07Å; T1020-K1024 HydrophobicContact CG2-CD 4.28Å; T1020-K1024 WeakPolarHBondContact O-CG 3.47Å; T1020-K1024 PolarHBondContact O-N 3.37Å
1021	V	97.7	Very high	93.4	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-61.5	-42.8	170.2	177.9	0	0	0	0	111.2	L985 M1016 D1017 K1023 K1024 L1025 Y1033 F1039 D1042 V1043 I1046	L985-V1021 HydrophobicContact CD1-CB 4.33Å; L985-V1021 HydrophobicContact CD1-CG1 3.92Å; L985-V1021 HydrophobicContact CD2-CG1 4.21Å; M1016-V1021 HydrophobicContact CG-CG2 4.22Å; M1016-V1021 HydrophobicContact SD-CG2 3.93Å; D1017-V1021 WeakPolarHBondContact O-CG2 3.41Å; D1017-V1021 PolarHBondContact O-N 2.86Å; V1021-K1023 VanDerWaalsContact C-N 3.32Å; V1021-K1023 PolarHBondContact O-N 3.45Å; V1021-K1024 PolarHBondContact O-N 2.97Å; V1021-L1025 WeakPolarHBondContact O-CB 3.31Å; V1021-L1025 PolarHBondContact O-N 3.34Å; V1021-Y1033 HydrophobicContact CG1-CE2 4.33Å; V1021-F1039 HydrophobicContact CG1-CD2 3.67Å; V1021-F1039 HydrophobicContact CG1-CE2 3.45Å; V1021-F1039 VanDerWaalsContact CG1-CE2 3.45Å; V1021-F1039 HydrophobicContact CG1-CZ 4.47Å; V1021-D1042 HydrophobicContact CG2-CB 4.12Å; V1021-V1043 HydrophobicContact CG1-CG2 4.01Å; V1021-V1043 HydrophobicContact CG2-CG2 4.23Å; V1021-I1046 HydrophobicContact CG2-CD1 4.24Å
1022	K	96.4	Very high	93.4	Very high	33 Å²	33	54.8 Å²	54.8	14%	0.143	27%	0.268	C	S	.	.	H	α-helix	trans	-61.8	-36.6	175.5	-168.8	170.5	-180	171.1	0	112.4	T927 H929 V930 T932 L985 Y989 L1018 S1019	T927-K1022 PolarHBondContact O-NZ 3.36Å; H929-K1022 PolarHBondContact O-NZ 3.47Å; V930-K1022 HydrophobicContact CG2-CD 4.25Å; T932-K1022 WeakPolarHBondContact OG1-CE 3.39Å; T932-K1022 PolarHBondContact OG1-NZ 2.88Å; L985-K1022 HydrophobicContact CD2-CB 3.88Å; L985-K1022 HydrophobicContact CD2-CG 4.26Å; Y989-K1022 HydrophobicContact CE2-CB 4.31Å; Y989-K1022 HydrophobicContact CE2-CD 4Å; L1018-K1022 VanDerWaalsContact O-CB 3.25Å; L1018-K1022 WeakPolarHBondContact O-CB 3.4Å; L1018-K1022 PolarHBondContact O-N 3.25Å; S1019-K1022 CarbonylContact O-C 3.46Å; S1019-K1022 WeakPolarHBondContact O-CB 3.47Å; S1019-K1022 PolarHBondContact O-N 2.89Å
1023	K	94.3	Very high	93.4	Very high	96 Å²	96	54.8 Å²	54.8	42%	0.417	27%	0.268	S	S	.	.	H	α-helix	trans	-69.2	-50.4	174.9	-68.7	154	-169	159.3	0	111.2	S1019 T1020 V1021 L1025 Q1026 H1029	S1019-K1023 WeakPolarHBondContact O-CB 3.39Å; S1019-K1023 VanDerWaalsContact O-CD 3.27Å; S1019-K1023 WeakPolarHBondContact O-CD 3.44Å; S1019-K1023 WeakPolarHBondContact O-CG 3.49Å; S1019-K1023 PolarHBondContact O-N 3.47Å; S1019-K1023 PolarHBondContact OG-NZ 2.59Å; T1020-K1023 PolarHBondContact O-N 3.07Å; V1021-K1023 VanDerWaalsContact C-N 3.32Å; V1021-K1023 PolarHBondContact O-N 3.45Å; K1023-L1025 PolarHBondContact O-N 2.99Å; K1023-Q1026 WeakPolarHBondContact O-CB 3.16Å; K1023-Q1026 PolarHBondContact O-N 2.93Å; K1023-Q1026 VanDerWaalsContact O-N 3.07Å; K1023-H1029 WeakPolarHBondContact O-CB 3.49Å
1024	K	95.4	Very high	93.4	Very high	25 Å²	25	51.6 Å²	51.6	11%	0.109	26%	0.255	C	S	.	.	H	α-helix	trans	-62.6	-27	178.2	-71	-178.1	69.9	173.8	0	113.8	T1020 V1021 Q1026 Q1031 H1032 Y1033 D1042	T1020-K1024 HydrophobicContact CG2-CD 4.28Å; T1020-K1024 WeakPolarHBondContact O-CG 3.47Å; T1020-K1024 PolarHBondContact O-N 3.37Å; V1021-K1024 PolarHBondContact O-N 2.97Å; K1024-Q1026 PolarHBondContact O-N 2.75Å; K1024-Q1031 WeakPolarHBondContact CE-O 3.35Å; K1024-H1032 WeakPolarHBondContact O-CA 3.46Å; K1024-H1032 PolarHBondContact O-ND1 3.42Å; K1024-Y1033 HydrophobicContact CB-CD2 4.1Å; K1024-Y1033 HydrophobicContact CB-CE1 4.13Å; K1024-Y1033 HydrophobicContact CB-CE2 3.45Å; K1024-Y1033 VanDerWaalsContact CB-CE2 3.45Å; K1024-Y1033 VanDerWaalsContact CB-CZ 3.47Å; K1024-Y1033 HydrophobicContact CD-CE1 4.28Å; K1024-Y1033 PolarHBondContact O-N 3.5Å; K1024-D1042 WeakPolarHBondContact CD-OD2 3.47Å; K1024-D1042 VanDerWaalsContact CE-OD2 3.23Å; K1024-D1042 WeakPolarHBondContact CE-OD2 3.4Å; K1024-D1042 IonicContact NZ-OD1 2.65Å; K1024-D1042 IonicContact NZ-OD2 3.48Å; K1024-D1042 PolarHBondContact NZ-OD2 3.48Å
1025	L	94.4	Very high	93.4	Very high	7 Å²	7	49.3 Å²	49.3	4%	0.037	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-6.9	175.5	-167.9	55.7	0	0	0	114	L973 Q978 C981 E982 L985 V1021 K1023 H1032 Y1033 F1039	L973-L1025 HydrophobicContact CD1-CD1 3.72Å; Q978-L1025 PolarHBondContact NE2-O 2.72Å; C981-L1025 HydrophobicContact CB-CD1 3.73Å; C981-L1025 HydrophobicContact CB-CD2 4.19Å; E982-L1025 HydrophobicContact CG-CD2 3.87Å; E982-L1025 HydrophobicContact CG-CG 4.38Å; L985-L1025 HydrophobicContact CD2-CD2 3.84Å; V1021-L1025 WeakPolarHBondContact O-CB 3.31Å; V1021-L1025 PolarHBondContact O-N 3.34Å; K1023-L1025 PolarHBondContact O-N 2.99Å; L1025-H1032 PolarHBondContact O-CE1 2.86Å; L1025-Y1033 HydrophobicContact CB-CD2 4.28Å; L1025-Y1033 HydrophobicContact CB-CE2 4.3Å; L1025-Y1033 HydrophobicContact CD1-CD2 4.15Å; L1025-F1039 HydrophobicContact CD2-CE2 4.23Å
1026	Q	90.4	Very high	93.4	Very high	45 Å²	45	46.9 Å²	46.9	21%	0.21	23%	0.233	C	C	.	.	S	Bend	trans	-89	134.6	172.6	-56.2	-174.6	-18.3	0	0	111.7	K1023 K1024 K1028 H1029 H1032	K1023-Q1026 WeakPolarHBondContact O-CB 3.16Å; K1023-Q1026 PolarHBondContact O-N 2.93Å; K1023-Q1026 VanDerWaalsContact O-N 3.07Å; K1024-Q1026 PolarHBondContact O-N 2.75Å; Q1026-K1028 HydrophobicContact CB-CG 4.16Å; Q1026-K1028 PolarHBondContact O-N 2.93Å; Q1026-K1028 VanDerWaalsContact O-N 3.13Å; Q1026-H1029 VanDerWaalsContact O-CB 3.25Å; Q1026-H1029 WeakPolarHBondContact O-CB 3.37Å; Q1026-H1029 PolarHBondContact O-N 3.16Å; Q1026-H1032 PolarHBondContact O-ND1 3.16Å
1027	K	86.4	Confident	93.3	Very high	89 Å²	89	47.5 Å²	47.5	39%	0.387	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-20.2	177.4	-69.3	167.6	-172.9	172.5	0	114.6	N960 H1029	N960-K1027 VanDerWaalsContact OD1-CB 3.27Å; N960-K1027 WeakPolarHBondContact OD1-CB 3.03Å; N960-K1027 WeakPolarHBondContact OD1-CD 3.48Å; N960-K1027 WeakPolarHBondContact OD1-CG 3.37Å; N960-K1027 PolarHBondContact OD1-N 3.37Å; K1027-H1029 VanDerWaalsContact C-N 3.26Å
1028	K	83.4	Confident	93.1	Very high	100 Å²	100	50 Å²	50	44%	0.435	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-6.9	175.4	65.6	177.4	176.9	-179	0	113.5	D959 Q1026	D959-K1028 IonicContact OD1-NZ 2.66Å; D959-K1028 PolarHBondContact OD1-NZ 3.41Å; D959-K1028 WeakPolarHBondContact OD2-CE 3.42Å; D959-K1028 IonicContact OD2-NZ 3.54Å; D959-K1028 PolarHBondContact OD2-NZ 3.47Å; Q1026-K1028 HydrophobicContact CB-CG 4.16Å; Q1026-K1028 PolarHBondContact O-N 2.93Å; Q1026-K1028 VanDerWaalsContact O-N 3.13Å
1029	H	88.2	Confident	93.1	Very high	62 Å²	62	50 Å²	50	29%	0.287	25%	0.25	S	C	.	.	S	Bend	trans	-79.4	136.5	177.8	-163.6	-105.2	0	0	0	111.3	K1023 Q1026 K1027 Q1031 H1032	K1023-H1029 WeakPolarHBondContact O-CB 3.49Å; Q1026-H1029 VanDerWaalsContact O-CB 3.25Å; Q1026-H1029 WeakPolarHBondContact O-CB 3.37Å; Q1026-H1029 PolarHBondContact O-N 3.16Å; K1027-H1029 VanDerWaalsContact C-N 3.26Å; H1029-Q1031 PolarHBondContact ND1-N 2.85Å; H1029-Q1031 PolarHBondContact ND1-O 2.83Å; H1029-Q1031 VanDerWaalsContact ND1-O 3.15Å; H1029-Q1031 PolarHBondContact O-N 3.31Å; H1029-H1032 WeakPolarHBondContact O-CB 3.48Å; H1029-H1032 PolarHBondContact O-N 3.2Å; H1029-H1032 VanDerWaalsContact O-N 3.14Å
1030	S	88.9	Confident	93.2	Very high	118 Å²	118	49.8 Å²	49.8	83%	0.825	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-29.3	-179.2	55.3	0	0	0	0	113.3
1031	Q	89.3	Confident	93.1	Very high	125 Å²	125	49.5 Å²	49.5	58%	0.584	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.2	59	169.6	-58	179.7	2.4	0	0	109.7	K1024 H1029	K1024-Q1031 WeakPolarHBondContact CE-O 3.35Å; H1029-Q1031 PolarHBondContact ND1-N 2.85Å; H1029-Q1031 PolarHBondContact ND1-O 2.83Å; H1029-Q1031 VanDerWaalsContact ND1-O 3.15Å; H1029-Q1031 PolarHBondContact O-N 3.31Å
1032	H	92.5	Very high	93.1	Very high	22 Å²	22	50.5 Å²	50.5	10%	0.102	26%	0.256	C	S	.	.			trans	-68.1	142	171.3	-177.4	50.9	0	0	0	110.3	K1024 L1025 Q1026 H1029 Q1034	K1024-H1032 WeakPolarHBondContact O-CA 3.46Å; K1024-H1032 PolarHBondContact O-ND1 3.42Å; L1025-H1032 PolarHBondContact O-CE1 2.86Å; Q1026-H1032 PolarHBondContact O-ND1 3.16Å; H1029-H1032 WeakPolarHBondContact O-CB 3.48Å; H1029-H1032 PolarHBondContact O-N 3.2Å; H1029-H1032 VanDerWaalsContact O-N 3.14Å; H1032-Q1034 PolarHBondContact O-N 3.06Å
1033	Y	95.5	Very high	93.2	Very high	3 Å²	3	49 Å²	49	1%	0.012	25%	0.249	C	C	.	.			trans	-62.1	133.1	176.9	-63.9	-57	0	0	0	111.4	L973 V1021 K1024 L1025 D1038 F1039 D1042	L973-Y1033 PolarHBondContact N-O 3.07Å; V1021-Y1033 HydrophobicContact CG1-CE2 4.33Å; K1024-Y1033 HydrophobicContact CB-CD2 4.1Å; K1024-Y1033 HydrophobicContact CB-CE1 4.13Å; K1024-Y1033 HydrophobicContact CB-CE2 3.45Å; K1024-Y1033 VanDerWaalsContact CB-CE2 3.45Å; K1024-Y1033 VanDerWaalsContact CB-CZ 3.47Å; K1024-Y1033 HydrophobicContact CD-CE1 4.28Å; K1024-Y1033 PolarHBondContact O-N 3.5Å; L1025-Y1033 HydrophobicContact CB-CD2 4.28Å; L1025-Y1033 HydrophobicContact CB-CE2 4.3Å; L1025-Y1033 HydrophobicContact CD1-CD2 4.15Å; Y1033-D1038 HydrophobicContact CD1-CB 3.52Å; Y1033-D1038 HydrophobicContact CE1-CB 4.14Å; Y1033-D1038 HydrophobicContact CG-CB 4.45Å; Y1033-F1039 HydrophobicContact CD1-CB 4.28Å; Y1033-F1039 HydrophobicContact CD2-CB 4.01Å; Y1033-F1039 HydrophobicContact CD2-CD2 4.19Å; Y1033-F1039 HydrophobicContact CE1-CB 4.33Å; Y1033-F1039 HydrophobicContact CE2-CB 4.09Å; Y1033-F1039 AromaticContact CE2-CD2 3.82Å; Y1033-F1039 HydrophobicContact CE2-CD2 3.82Å; Y1033-F1039 HydrophobicContact CE2-CG 4.46Å; Y1033-F1039 HydrophobicContact CG-CB 4.11Å; Y1033-D1042 HydrophobicContact CE1-CB 4.41Å; Y1033-D1042 WeakPolarHBondContact CE1-OD2 3.23Å; Y1033-D1042 WeakPolarHBondContact OH-CB 3.44Å; Y1033-D1042 PolarHBondContact OH-OD2 3.48Å
1034	Q	93.2	Very high	93.3	Very high	89 Å²	89	46.1 Å²	46.1	42%	0.416	24%	0.236	S	C	.	.	S	Bend	trans	-100.6	-35.9	-179.8	-56.4	-66.6	4.1	0	0	110.8	Q971 H1032 D1038	Q971-Q1034 PolarHBondContact O-OE1 2.61Å; H1032-Q1034 PolarHBondContact O-N 3.06Å; Q1034-D1038 PolarHBondContact N-OD2 2.62Å
1035	I	93.9	Very high	93.4	Very high	85 Å²	85	45.6 Å²	45.6	44%	0.436	23%	0.234	S	C	.	.	S	Bend	trans	-130.3	153.2	175	57.7	176.7	0	0	0	110.8	D1037 D1038	I1035-D1037 WeakPolarHBondContact CB-OD2 3.48Å; I1035-D1037 HydrophobicContact CD1-CB 3.94Å; I1035-D1037 HydrophobicContact CG1-CB 4.09Å; I1035-D1037 PolarHBondContact O-N 2.87Å; I1035-D1037 VanDerWaalsContact O-N 3.15Å; I1035-D1038 WeakPolarHBondContact CG1-OD2 3.45Å; I1035-D1038 PolarHBondContact N-OD2 2.72Å; I1035-D1038 VanDerWaalsContact N-OD2 3.15Å; I1035-D1038 WeakPolarHBondContact O-CB 3.5Å; I1035-D1038 PolarHBondContact O-N 2.88Å; I1035-D1038 VanDerWaalsContact O-N 3.12Å
1036	P	95.2	Very high	93.6	Very high	6 Å²	6	45.4 Å²	45.4	4%	0.039	23%	0.233	C	C	.	.	H	α-helix	trans	-62.6	-23.6	-178.1	-19.3	31.1	0	0	0	113.1	L973 D977 D1038 F1039 V1040 Y1079 F1084	L973-P1036 HydrophobicContact CD2-CG 4.15Å; D977-P1036 HydrophobicContact CB-CG 3.85Å; D977-P1036 VanDerWaalsContact OD1-CG 3.27Å; D977-P1036 WeakPolarHBondContact OD1-CG 3.42Å; P1036-D1038 VanDerWaalsContact C-N 3.26Å; P1036-D1038 PolarHBondContact O-N 3.43Å; P1036-F1039 WeakPolarHBondContact O-CB 3.27Å; P1036-F1039 PolarHBondContact O-N 3.2Å; P1036-V1040 WeakPolarHBondContact O-CG2 3.36Å; P1036-V1040 PolarHBondContact O-N 3.49Å; P1036-Y1079 WeakPolarHBondContact CB-OH 3.49Å; P1036-Y1079 WeakPolarHBondContact CG-OH 3.39Å; P1036-F1084 HydrophobicContact CB-CE1 3.94Å; P1036-F1084 HydrophobicContact CB-CZ 4.07Å
1037	D	95.2	Very high	93.9	Very high	38 Å²	38	44.1 Å²	44.1	20%	0.203	23%	0.227	C	C	.	.	H	α-helix	trans	-60.8	-35.4	176.9	-41.4	-104.3	0	0	0	111.6	I1035 V1040 A1041 R1082 F1084	I1035-D1037 WeakPolarHBondContact CB-OD2 3.48Å; I1035-D1037 HydrophobicContact CD1-CB 3.94Å; I1035-D1037 HydrophobicContact CG1-CB 4.09Å; I1035-D1037 PolarHBondContact O-N 2.87Å; I1035-D1037 VanDerWaalsContact O-N 3.15Å; D1037-V1040 PolarHBondContact O-N 3.41Å; D1037-A1041 WeakPolarHBondContact O-CB 3.35Å; D1037-A1041 PolarHBondContact O-N 3.45Å; D1037-R1082 IonicContact OD1-CZ 3.96Å; D1037-R1082 IonicContact OD1-NE 2.66Å; D1037-R1082 IonicContact OD1-NH2 2.7Å; D1037-R1082 PolarHBondContact OD1-NH2 3.4Å; D1037-R1082 IonicContact OD2-CZ 2.74Å; D1037-R1082 IonicContact OD2-NH1 3.26Å; D1037-R1082 IonicContact OD2-NH2 2.72Å; D1037-R1082 PolarHBondContact OD2-NH2 2.79Å; D1037-F1084 HydrophobicContact CB-CD1 4.37Å
1038	D	94.9	Very high	94.3	Very high	62 Å²	62	42.5 Å²	42.5	33%	0.332	22%	0.22	S	C	.	.	H	α-helix	trans	-65	-42.9	176	-56.1	-35.6	0	0	0	111	Y1033 Q1034 I1035 P1036 A1041 D1042	Y1033-D1038 HydrophobicContact CD1-CB 3.52Å; Y1033-D1038 HydrophobicContact CE1-CB 4.14Å; Y1033-D1038 HydrophobicContact CG-CB 4.45Å; Q1034-D1038 PolarHBondContact N-OD2 2.62Å; I1035-D1038 WeakPolarHBondContact CG1-OD2 3.45Å; I1035-D1038 PolarHBondContact N-OD2 2.72Å; I1035-D1038 VanDerWaalsContact N-OD2 3.15Å; I1035-D1038 WeakPolarHBondContact O-CB 3.5Å; I1035-D1038 PolarHBondContact O-N 2.88Å; I1035-D1038 VanDerWaalsContact O-N 3.12Å; P1036-D1038 VanDerWaalsContact C-N 3.26Å; P1036-D1038 PolarHBondContact O-N 3.43Å; D1038-A1041 PolarHBondContact O-N 2.96Å; D1038-D1042 PolarHBondContact O-N 3.16Å
1039	F	97.1	Very high	94.9	Very high	0 Å²	0	38 Å²	38	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-66.2	-45.2	176.7	166.4	-89.8	0	0	0	111	C981 L984 L985 V1021 L1025 Y1033 P1036 A1041 D1042 V1043 F1071	C981-F1039 HydrophobicContact CB-CD1 4.03Å; C981-F1039 HydrophobicContact CB-CD2 4Å; C981-F1039 HydrophobicContact CB-CE1 4.03Å; C981-F1039 HydrophobicContact CB-CE2 3.99Å; C981-F1039 HydrophobicContact CB-CG 4.03Å; C981-F1039 HydrophobicContact CB-CZ 4.01Å; C981-F1039 VanDerWaalsContact O-CZ 3.32Å; C981-F1039 WeakPolarHBondContact O-CZ 3.46Å; L984-F1039 HydrophobicContact CB-CE1 3.88Å; L984-F1039 HydrophobicContact CB-CZ 3.96Å; L984-F1039 HydrophobicContact CD1-CE1 3.95Å; L985-F1039 HydrophobicContact CB-CE2 4.19Å; L985-F1039 HydrophobicContact CB-CZ 4.14Å; V1021-F1039 HydrophobicContact CG1-CD2 3.67Å; V1021-F1039 HydrophobicContact CG1-CE2 3.45Å; V1021-F1039 VanDerWaalsContact CG1-CE2 3.45Å; V1021-F1039 HydrophobicContact CG1-CZ 4.47Å; L1025-F1039 HydrophobicContact CD2-CE2 4.23Å; Y1033-F1039 HydrophobicContact CD1-CB 4.28Å; Y1033-F1039 HydrophobicContact CD2-CB 4.01Å; Y1033-F1039 HydrophobicContact CD2-CD2 4.19Å; Y1033-F1039 HydrophobicContact CE1-CB 4.33Å; Y1033-F1039 HydrophobicContact CE2-CB 4.09Å; Y1033-F1039 AromaticContact CE2-CD2 3.82Å; Y1033-F1039 HydrophobicContact CE2-CD2 3.82Å; Y1033-F1039 HydrophobicContact CE2-CG 4.46Å; Y1033-F1039 HydrophobicContact CG-CB 4.11Å; P1036-F1039 WeakPolarHBondContact O-CB 3.27Å; P1036-F1039 PolarHBondContact O-N 3.2Å; F1039-A1041 VanDerWaalsContact C-N 3.32Å; F1039-A1041 PolarHBondContact O-N 3.13Å; F1039-D1042 PolarHBondContact O-N 2.86Å; F1039-V1043 HydrophobicContact CE1-CG2 4.3Å; F1039-V1043 HydrophobicContact CE2-CG2 4.27Å; F1039-V1043 HydrophobicContact CZ-CG2 4.1Å; F1039-V1043 WeakPolarHBondContact O-CG2 3.34Å; F1039-V1043 PolarHBondContact O-N 2.75Å; F1039-F1071 HydrophobicContact CE1-CE2 4.46Å
1040	V	97.3	Very high	95.2	Very high	2 Å²	2	35.4 Å²	35.4	1%	0.012	19%	0.189	C	C	.	.	H	α-helix	trans	-64.5	-37.6	176.3	173	0	0	0	0	111.3	P1036 D1037 R1044 F1071 L1075 F1084	P1036-V1040 WeakPolarHBondContact O-CG2 3.36Å; P1036-V1040 PolarHBondContact O-N 3.49Å; D1037-V1040 PolarHBondContact O-N 3.41Å; V1040-R1044 HydrophobicContact CG1-CG 4.42Å; V1040-R1044 WeakPolarHBondContact O-CB 3.43Å; V1040-R1044 VanDerWaalsContact O-CG 3.25Å; V1040-R1044 WeakPolarHBondContact O-CG 3.46Å; V1040-R1044 PolarHBondContact O-N 3.1Å; V1040-F1071 HydrophobicContact CG1-CE1 4.28Å; V1040-F1071 HydrophobicContact CG1-CZ 4.37Å; V1040-F1071 HydrophobicContact CG2-CZ 4.3Å; V1040-L1075 HydrophobicContact CG1-CD2 3.87Å; V1040-L1075 HydrophobicContact CG2-CD1 3.66Å; V1040-L1075 HydrophobicContact CG2-CD2 4.28Å; V1040-F1084 HydrophobicContact CB-CD1 4.24Å; V1040-F1084 HydrophobicContact CB-CG 4.34Å; V1040-F1084 HydrophobicContact CG1-CB 3.89Å; V1040-F1084 HydrophobicContact CG1-CD1 4.41Å; V1040-F1084 HydrophobicContact CG1-CG 4.05Å; V1040-F1084 HydrophobicContact CG2-CD1 3.99Å; V1040-F1084 HydrophobicContact CG2-CD2 4.18Å; V1040-F1084 HydrophobicContact CG2-CE1 4.03Å; V1040-F1084 HydrophobicContact CG2-CE2 4.2Å; V1040-F1084 HydrophobicContact CG2-CG 4.05Å; V1040-F1084 HydrophobicContact CG2-CZ 4.12Å
1041	A	96.1	Very high	95.5	Very high	33 Å²	33	35.6 Å²	35.6	27%	0.273	18%	0.177	S	C	.	.	H	α-helix	trans	-64.6	-44.5	175.5	0	0	0	0	0	112.2	D1037 D1038 F1039 L1045 L1087	D1037-A1041 WeakPolarHBondContact O-CB 3.35Å; D1037-A1041 PolarHBondContact O-N 3.45Å; D1038-A1041 PolarHBondContact O-N 2.96Å; F1039-A1041 VanDerWaalsContact C-N 3.32Å; F1039-A1041 PolarHBondContact O-N 3.13Å; A1041-L1045 PolarHBondContact O-N 2.99Å; A1041-L1087 HydrophobicContact CB-CD2 3.87Å
1042	D	97.4	Very high	95.8	Very high	21 Å²	21	36 Å²	36	11%	0.112	17%	0.173	C	C	.	.	H	α-helix	trans	-67	-39.7	176.1	-84.1	-7.3	0	0	0	112.7	M1016 V1021 K1024 Y1033 D1038 F1039 L1045 I1046	M1016-D1042 HydrophobicContact CE-CB 4.33Å; M1016-D1042 HydrophobicContact CG-CB 4.09Å; M1016-D1042 VanDerWaalsContact CG-O 3.31Å; M1016-D1042 WeakPolarHBondContact CG-O 3.46Å; M1016-D1042 HydrophobicContact SD-CB 4.15Å; V1021-D1042 HydrophobicContact CG2-CB 4.12Å; K1024-D1042 WeakPolarHBondContact CD-OD2 3.47Å; K1024-D1042 VanDerWaalsContact CE-OD2 3.23Å; K1024-D1042 WeakPolarHBondContact CE-OD2 3.4Å; K1024-D1042 IonicContact NZ-OD1 2.65Å; K1024-D1042 IonicContact NZ-OD2 3.48Å; K1024-D1042 PolarHBondContact NZ-OD2 3.48Å; Y1033-D1042 HydrophobicContact CE1-CB 4.41Å; Y1033-D1042 WeakPolarHBondContact CE1-OD2 3.23Å; Y1033-D1042 WeakPolarHBondContact OH-CB 3.44Å; Y1033-D1042 PolarHBondContact OH-OD2 3.48Å; D1038-D1042 PolarHBondContact O-N 3.16Å; F1039-D1042 PolarHBondContact O-N 2.86Å; D1042-L1045 WeakPolarHBondContact O-CA 3.39Å; D1042-L1045 PolarHBondContact O-N 3.19Å; D1042-I1046 PolarHBondContact O-N 3.33Å
1043	V	98	Very high	95.8	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-66.9	-42.1	176.8	173.7	0	0	0	0	111.1	L988 V1021 F1039 L1045 I1046 F1047 F1071	L988-V1043 HydrophobicContact CD1-CG1 3.72Å; L988-V1043 HydrophobicContact CD1-CG2 4.43Å; V1021-V1043 HydrophobicContact CG1-CG2 4.01Å; V1021-V1043 HydrophobicContact CG2-CG2 4.23Å; F1039-V1043 HydrophobicContact CE1-CG2 4.3Å; F1039-V1043 HydrophobicContact CE2-CG2 4.27Å; F1039-V1043 HydrophobicContact CZ-CG2 4.1Å; F1039-V1043 WeakPolarHBondContact O-CG2 3.34Å; F1039-V1043 PolarHBondContact O-N 2.75Å; V1043-L1045 PolarHBondContact O-N 3.21Å; V1043-I1046 WeakPolarHBondContact O-CB 3.49Å; V1043-I1046 PolarHBondContact O-N 3.13Å; V1043-F1047 HydrophobicContact CG1-CE2 3.78Å; V1043-F1047 VanDerWaalsContact O-CD2 3.29Å; V1043-F1047 WeakPolarHBondContact O-CD2 3.41Å; V1043-F1047 WeakPolarHBondContact O-CE2 3.22Å; V1043-F1071 HydrophobicContact CB-CE1 4.14Å; V1043-F1071 HydrophobicContact CB-CE2 4.14Å; V1043-F1071 HydrophobicContact CB-CZ 3.84Å; V1043-F1071 HydrophobicContact CG1-CD1 3.79Å; V1043-F1071 HydrophobicContact CG1-CD2 3.66Å; V1043-F1071 HydrophobicContact CG1-CE1 3.71Å; V1043-F1071 HydrophobicContact CG1-CE2 3.58Å; V1043-F1071 HydrophobicContact CG1-CG 3.76Å; V1043-F1071 HydrophobicContact CG1-CZ 3.6Å; V1043-F1071 HydrophobicContact CG2-CE2 4.46Å; V1043-F1071 HydrophobicContact CG2-CZ 4.48Å
1044	R	97.6	Very high	95.6	Very high	36 Å²	36	39.7 Å²	39.7	14%	0.136	19%	0.191	C	C	.	.	H	α-helix	trans	-62.7	-30.3	169.3	-70.1	171.5	170.9	171.9	-3.5	111.5	V1040 F1047 K1048 F1071 E1072 F1084 T1085 L1087	V1040-R1044 HydrophobicContact CG1-CG 4.42Å; V1040-R1044 WeakPolarHBondContact O-CB 3.43Å; V1040-R1044 VanDerWaalsContact O-CG 3.25Å; V1040-R1044 WeakPolarHBondContact O-CG 3.46Å; V1040-R1044 PolarHBondContact O-N 3.1Å; R1044-F1047 PolarHBondContact O-N 3Å; R1044-K1048 VanDerWaalsContact O-CB 3.28Å; R1044-K1048 WeakPolarHBondContact O-CB 3.44Å; R1044-K1048 PolarHBondContact O-N 3.31Å; R1044-F1071 HydrophobicContact CG-CE1 4.17Å; R1044-E1072 IonicContact CZ-OE1 3.79Å; R1044-E1072 IonicContact CZ-OE2 3.4Å; R1044-E1072 IonicContact NE-OE1 2.72Å; R1044-E1072 PolarHBondContact NE-OE1 3.04Å; R1044-E1072 IonicContact NE-OE2 3.73Å; R1044-E1072 VanDerWaalsContact NH2-CD 3.35Å; R1044-E1072 IonicContact NH2-OE1 2.62Å; R1044-E1072 PolarHBondContact NH2-OE1 3.15Å; R1044-E1072 IonicContact NH2-OE2 3.49Å; R1044-E1072 PolarHBondContact NH2-OE2 2.79Å; R1044-F1084 PolarHBondContact NH1-O 3.36Å; R1044-T1085 PolarHBondContact NH1-O 3.39Å; R1044-L1087 VanDerWaalsContact C-CD1 3.45Å; R1044-L1087 HydrophobicContact CB-CD1 3.47Å; R1044-L1087 VanDerWaalsContact CB-CD1 3.47Å; R1044-L1087 HydrophobicContact CB-CG 3.84Å
1045	L	97.3	Very high	95.3	Very high	14 Å²	14	41.2 Å²	41.2	7%	0.073	20%	0.198	C	C	.	.	H	α-helix	trans	-40.3	-62	166.1	163.9	167.6	0	0	0	112.5	K1014 M1016 A1041 D1042 V1043 F1047 K1048 N1049 L1087 F1090	K1014-L1045 HydrophobicContact CB-CD1 4.29Å; K1014-L1045 HydrophobicContact CB-CD2 4.43Å; M1016-L1045 HydrophobicContact CB-CD2 4.04Å; A1041-L1045 PolarHBondContact O-N 2.99Å; D1042-L1045 WeakPolarHBondContact O-CA 3.39Å; D1042-L1045 PolarHBondContact O-N 3.19Å; V1043-L1045 PolarHBondContact O-N 3.21Å; L1045-F1047 PolarHBondContact O-N 3.02Å; L1045-K1048 HydrophobicContact CB-CB 4.29Å; L1045-K1048 PolarHBondContact O-N 3.5Å; L1045-N1049 WeakPolarHBondContact O-CB 3.46Å; L1045-N1049 VanDerWaalsContact O-CG 3.29Å; L1045-N1049 PolarHBondContact O-N 2.92Å; L1045-N1049 PolarHBondContact O-ND2 3.19Å; L1045-L1087 HydrophobicContact CB-CD1 3.4Å; L1045-L1087 VanDerWaalsContact CB-CD1 3.4Å; L1045-F1090 HydrophobicContact CD1-CE2 4.15Å
1046	I	97.8	Very high	94.7	Very high	4 Å²	4	39.9 Å²	39.9	2%	0.021	21%	0.205	C	C	.	.	H	α-helix	trans	-50.8	-54.2	-177.9	-57.4	175.5	0	0	0	110.9	F997 M1016 L1018 V1021 D1042 V1043 N1049 C1050	F997-I1046 HydrophobicContact CB-CG2 3.73Å; F997-I1046 HydrophobicContact CD1-CG2 3.69Å; F997-I1046 HydrophobicContact CG-CG2 3.91Å; M1016-I1046 HydrophobicContact CB-CG1 4.15Å; M1016-I1046 HydrophobicContact CG-CG1 3.84Å; L1018-I1046 HydrophobicContact CD2-CD1 3.51Å; L1018-I1046 HydrophobicContact CG-CD1 3.9Å; V1021-I1046 HydrophobicContact CG2-CD1 4.24Å; D1042-I1046 PolarHBondContact O-N 3.33Å; V1043-I1046 WeakPolarHBondContact O-CB 3.49Å; V1043-I1046 PolarHBondContact O-N 3.13Å; I1046-N1049 PolarHBondContact O-N 3.42Å; I1046-C1050 WeakPolarHBondContact O-CB 3.39Å; I1046-C1050 PolarHBondContact O-N 2.83Å
1047	F	96.5	Very high	94.2	Very high	18 Å²	18	45.4 Å²	45.4	8%	0.079	24%	0.235	C	C	.	.	H	α-helix	trans	-75.4	-30.9	-174.3	-50.4	-55.1	0	0	0	112.9	F997 V1043 R1044 L1045 C1050 E1051 G1064 V1067 A1068 F1071	F997-F1047 HydrophobicContact CD2-CE1 4.32Å; F997-F1047 HydrophobicContact CG-CE1 4.41Å; V1043-F1047 HydrophobicContact CG1-CE2 3.78Å; V1043-F1047 VanDerWaalsContact O-CD2 3.29Å; V1043-F1047 WeakPolarHBondContact O-CD2 3.41Å; V1043-F1047 WeakPolarHBondContact O-CE2 3.22Å; R1044-F1047 PolarHBondContact O-N 3Å; L1045-F1047 PolarHBondContact O-N 3.02Å; F1047-C1050 WeakPolarHBondContact O-CB 3.48Å; F1047-C1050 PolarHBondContact O-N 3.23Å; F1047-E1051 PolarHBondContact O-N 2.94Å; F1047-G1064 WeakPolarHBondContact CD1-O 3.41Å; F1047-V1067 HydrophobicContact CE1-CB 3.75Å; F1047-V1067 HydrophobicContact CE1-CG1 3.66Å; F1047-V1067 HydrophobicContact CZ-CB 4.01Å; F1047-V1067 HydrophobicContact CZ-CG1 3.47Å; F1047-V1067 VanDerWaalsContact CZ-CG1 3.47Å; F1047-A1068 HydrophobicContact CB-CB 3.84Å; F1047-A1068 HydrophobicContact CD1-CB 4.29Å; F1047-A1068 HydrophobicContact CD2-CB 3.7Å; F1047-A1068 HydrophobicContact CE2-CB 4.37Å; F1047-A1068 HydrophobicContact CG-CB 3.66Å; F1047-F1071 HydrophobicContact CE2-CB 4.25Å
1048	K	95.3	Very high	94	Very high	54 Å²	54	45.3 Å²	45.3	24%	0.235	24%	0.237	C	C	.	.	H	α-helix	trans	-69.3	-37.2	173.3	-162.3	167.9	-162.6	165.1	0	111.8	R1044 L1045 R1052 L1087 P1088	R1044-K1048 VanDerWaalsContact O-CB 3.28Å; R1044-K1048 WeakPolarHBondContact O-CB 3.44Å; R1044-K1048 PolarHBondContact O-N 3.31Å; L1045-K1048 HydrophobicContact CB-CB 4.29Å; L1045-K1048 PolarHBondContact O-N 3.5Å; K1048-R1052 VanDerWaalsContact O-CB 3.28Å; K1048-R1052 WeakPolarHBondContact O-CB 3.36Å; K1048-R1052 PolarHBondContact O-N 3.07Å; K1048-L1087 HydrophobicContact CB-CD1 4.38Å; K1048-L1087 HydrophobicContact CD-CB 4.12Å; K1048-L1087 HydrophobicContact CD-CD1 3.84Å; K1048-L1087 PolarHBondContact NZ-O 3.11Å; K1048-P1088 VanDerWaalsContact NZ-C 3.26Å; K1048-P1088 PolarHBondContact NZ-O 3.37Å
1049	N	95.6	Very high	93.8	Very high	7 Å²	7	50.1 Å²	50.1	4%	0.037	26%	0.257	C	S	.	.	H	α-helix	trans	-65	-42.5	170.3	-72.6	-19.6	0	0	0	111.4	I1012 K1014 L1045 I1046 E1051 R1052 F1053	I1012-N1049 HydrophobicContact CD1-CB 4.19Å; I1012-N1049 HydrophobicContact CG2-CB 4.09Å; K1014-N1049 PolarHBondContact O-ND2 2.85Å; L1045-N1049 WeakPolarHBondContact O-CB 3.46Å; L1045-N1049 VanDerWaalsContact O-CG 3.29Å; L1045-N1049 PolarHBondContact O-N 2.92Å; L1045-N1049 PolarHBondContact O-ND2 3.19Å; I1046-N1049 PolarHBondContact O-N 3.42Å; N1049-E1051 PolarHBondContact O-N 3.27Å; N1049-R1052 PolarHBondContact O-N 2.86Å; N1049-F1053 PolarHBondContact O-N 3.05Å
1050	C	95.5	Very high	93.6	Very high	7 Å²	7	52.1 Å²	52.1	5%	0.047	27%	0.27	C	S	.	.	H	α-helix	trans	-56.8	-48	175.2	179.9	0	0	0	0	112.2	F997 I1046 F1047 N1054 V1060	F997-C1050 HydrophobicContact CE1-CB 3.84Å; F997-C1050 HydrophobicContact CZ-CB 4.43Å; I1046-C1050 WeakPolarHBondContact O-CB 3.39Å; I1046-C1050 PolarHBondContact O-N 2.83Å; F1047-C1050 WeakPolarHBondContact O-CB 3.48Å; F1047-C1050 PolarHBondContact O-N 3.23Å; C1050-N1054 WeakPolarHBondContact O-CB 3.46Å; C1050-N1054 PolarHBondContact O-N 3.23Å; C1050-N1054 PolarHBondContact O-ND2 2.85Å; C1050-V1060 PolarHBondContact SG-O 3.21Å
1051	E	94.5	Very high	93.4	Very high	121 Å²	121	52.7 Å²	52.7	57%	0.565	27%	0.274	S	S	*	.	H	α-helix	trans	-71.1	-28.1	177.2	179.3	163.5	-147.5	0	0	113.3	F1047 N1049 K1113	F1047-E1051 PolarHBondContact O-N 2.94Å; N1049-E1051 PolarHBondContact O-N 3.27Å; E1051-K1113 IonicContact OE1-NZ 3.59Å; E1051-K1113 PolarHBondContact OE1-NZ 2.92Å
1052	R	94.4	Very high	93.3	Very high	135 Å²	135	55.8 Å²	55.8	51%	0.509	28%	0.281	S	S	.	.	H	α-helix	trans	-74.3	-29.1	177.4	-178.6	173	174.5	132.5	3	113.2	I1011 I1012 K1048 N1049	I1011-R1052 HydrophobicContact CG2-CG 4.3Å; I1011-R1052 PolarHBondContact O-NE 3.2Å; I1012-R1052 HydrophobicContact CD1-CB 3.8Å; I1012-R1052 HydrophobicContact CD1-CG 3.72Å; K1048-R1052 VanDerWaalsContact O-CB 3.28Å; K1048-R1052 WeakPolarHBondContact O-CB 3.36Å; K1048-R1052 PolarHBondContact O-N 3.07Å; N1049-R1052 PolarHBondContact O-N 2.86Å
1053	F	94.2	Very high	93.1	Very high	59 Å²	59	55.3 Å²	55.3	26%	0.259	28%	0.281	S	S	.	.	H	α-helix	trans	-97.4	-40.7	-178.7	-174.6	-103.3	0	0	0	114.2	I1005 Y1008 I1011 I1012 N1049	I1005-F1053 HydrophobicContact CG2-CE1 3.67Å; I1005-F1053 HydrophobicContact CG2-CZ 3.59Å; Y1008-F1053 VanDerWaalsContact CA-CE2 3.49Å; Y1008-F1053 HydrophobicContact CD2-CB 4.23Å; Y1008-F1053 AromaticContact CD2-CD1 3.77Å; Y1008-F1053 HydrophobicContact CD2-CD1 3.77Å; Y1008-F1053 AromaticContact CD2-CD2 3.73Å; Y1008-F1053 HydrophobicContact CD2-CD2 3.73Å; Y1008-F1053 HydrophobicContact CD2-CE1 4.03Å; Y1008-F1053 HydrophobicContact CD2-CE2 4.01Å; Y1008-F1053 AromaticContact CD2-CG 3.61Å; Y1008-F1053 HydrophobicContact CD2-CG 3.61Å; Y1008-F1053 HydrophobicContact CD2-CZ 4.15Å; Y1008-F1053 HydrophobicContact CE2-CB 4.19Å; Y1008-F1053 HydrophobicContact CE2-CD1 4.25Å; Y1008-F1053 HydrophobicContact CE2-CG 4.06Å; Y1008-F1053 HydrophobicContact CG-CD2 4.47Å; Y1008-F1053 HydrophobicContact CG-CE2 4.46Å; I1011-F1053 HydrophobicContact CB-CD2 4.43Å; I1011-F1053 HydrophobicContact CD1-CD2 4.06Å; I1011-F1053 HydrophobicContact CD1-CE2 4.07Å; I1012-F1053 HydrophobicContact CD1-CB 4.21Å; I1012-F1053 HydrophobicContact CG1-CB 4.21Å; N1049-F1053 PolarHBondContact O-N 3.05Å
1054	N	91.1	Very high	93	Very high	42 Å²	42	55.4 Å²	55.4	23%	0.225	28%	0.282	C	S	.	.	S	Bend	trans	-94.3	143.5	-169.8	-61.6	-81.3	0	0	0	112.9	C1050 A1061	C1050-N1054 WeakPolarHBondContact O-CB 3.46Å; C1050-N1054 PolarHBondContact O-N 3.23Å; C1050-N1054 PolarHBondContact O-ND2 2.85Å; N1054-A1061 HydrophobicContact CB-CB 4.09Å
1055	E	87	Confident	92.9	Very high	121 Å²	121	60.6 Å²	60.6	57%	0.565	31%	0.305	S	S	*	.			trans	-61.4	138.7	170.2	-65.4	-167	141.9	0	0	110.4	D1057 S1058 A1061	E1055-D1057 PolarHBondContact O-N 3.16Å; E1055-S1058 WeakPolarHBondContact O-CB 3.17Å; E1055-S1058 PolarHBondContact O-N 2.87Å; E1055-S1058 PolarHBondContact O-OG 3.04Å; E1055-A1061 VanDerWaalsContact O-CB 3.28Å; E1055-A1061 WeakPolarHBondContact O-CB 3.36Å
1056	G	81.3	Confident	92.9	Very high	57 Å²	57	61.7 Å²	61.7	59%	0.588	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-9.9	-165.3	0	0	0	0	0	116
1057	D	84.1	Confident	92.9	Very high	123 Å²	123	61.5 Å²	61.5	66%	0.658	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.3	7.7	173.7	67	-38.8	0	0	0	113.5	E1055 K1062	E1055-D1057 PolarHBondContact O-N 3.16Å; D1057-K1062 WeakPolarHBondContact O-CE 3.44Å; D1057-K1062 PolarHBondContact O-NZ 3.48Å
1058	S	90.9	Very high	92.9	Very high	35 Å²	35	61.8 Å²	61.8	25%	0.245	32%	0.321	C	S	.	.	S	Bend	trans	-63.1	165	164.2	68	0	0	0	0	111.8	E1055 A1061 K1062	E1055-S1058 WeakPolarHBondContact O-CB 3.17Å; E1055-S1058 PolarHBondContact O-N 2.87Å; E1055-S1058 PolarHBondContact O-OG 3.04Å; S1058-A1061 WeakPolarHBondContact OG-CB 3.45Å; S1058-A1061 PolarHBondContact OG-N 2.87Å; S1058-A1061 VanDerWaalsContact OG-N 3.12Å; S1058-K1062 WeakPolarHBondContact O-CG 3.49Å; S1058-K1062 PolarHBondContact O-N 3.25Å; S1058-K1062 PolarHBondContact O-NZ 2.77Å
1059	E	91.2	Very high	93	Very high	164 Å²	164	64.8 Å²	64.8	77%	0.766	34%	0.339	S	S	*	.	H	α-helix	trans	-76.4	-39.3	179.4	-54.1	-157.1	134.8	0	0	111.5	A1061 K1062 A1063	E1059-A1061 PolarHBondContact O-N 2.64Å; E1059-K1062 WeakPolarHBondContact O-CB 3.47Å; E1059-K1062 PolarHBondContact O-N 3.21Å; E1059-K1062 VanDerWaalsContact O-N 3.15Å; E1059-A1063 PolarHBondContact O-N 2.88Å
1060	V	91.9	Very high	93.1	Very high	42 Å²	42	67.4 Å²	67.4	26%	0.255	35%	0.349	S	S	.	.	H	α-helix	trans	-59.5	-44	173.8	-173.4	0	0	0	0	111.8	E996 F997 C1050 K1062 A1063 G1064	E996-V1060 HydrophobicContact CB-CG1 4.44Å; F997-V1060 HydrophobicContact CE1-CG1 4.17Å; F997-V1060 HydrophobicContact CZ-CG1 4.02Å; C1050-V1060 PolarHBondContact SG-O 3.21Å; V1060-K1062 VanDerWaalsContact C-N 3.32Å; V1060-K1062 PolarHBondContact O-N 3.34Å; V1060-A1063 PolarHBondContact O-N 3Å; V1060-G1064 PolarHBondContact O-N 2.78Å
1061	A	93	Very high	93.2	Very high	13 Å²	13	67.1 Å²	67.1	11%	0.107	35%	0.347	C	S	.	.	H	α-helix	trans	-64.3	-34.4	176.5	0	0	0	0	0	113.2	N1054 E1055 S1058 E1059 K1065	N1054-A1061 HydrophobicContact CB-CB 4.09Å; E1055-A1061 VanDerWaalsContact O-CB 3.28Å; E1055-A1061 WeakPolarHBondContact O-CB 3.36Å; S1058-A1061 WeakPolarHBondContact OG-CB 3.45Å; S1058-A1061 PolarHBondContact OG-N 2.87Å; S1058-A1061 VanDerWaalsContact OG-N 3.12Å; E1059-A1061 PolarHBondContact O-N 2.64Å; A1061-K1065 WeakPolarHBondContact O-CB 3.32Å; A1061-K1065 PolarHBondContact O-N 2.91Å
1062	K	94.1	Very high	93.3	Very high	98 Å²	98	64.8 Å²	64.8	43%	0.426	34%	0.336	S	S	.	.	H	α-helix	trans	-69.6	-43.1	173.9	-66.8	179.4	-146.5	87.9	0	111.4	D1057 S1058 E1059 V1060 K1065 A1066	D1057-K1062 WeakPolarHBondContact O-CE 3.44Å; D1057-K1062 PolarHBondContact O-NZ 3.48Å; S1058-K1062 WeakPolarHBondContact O-CG 3.49Å; S1058-K1062 PolarHBondContact O-N 3.25Å; S1058-K1062 PolarHBondContact O-NZ 2.77Å; E1059-K1062 WeakPolarHBondContact O-CB 3.47Å; E1059-K1062 PolarHBondContact O-N 3.21Å; E1059-K1062 VanDerWaalsContact O-N 3.15Å; V1060-K1062 VanDerWaalsContact C-N 3.32Å; V1060-K1062 PolarHBondContact O-N 3.34Å; K1062-K1065 PolarHBondContact O-N 2.86Å; K1062-A1066 WeakPolarHBondContact O-CB 3.37Å; K1062-A1066 PolarHBondContact O-N 3.49Å
1063	A	94.3	Very high	93.4	Very high	12 Å²	12	62.4 Å²	62.4	10%	0.099	33%	0.333	C	S	.	.	H	α-helix	trans	-60.1	-53.5	175.6	0	0	0	0	0	110.7	L993 F997 E1059 V1060 K1065 A1066 V1067	L993-A1063 HydrophobicContact CB-CB 4.12Å; F997-A1063 HydrophobicContact CE2-CB 4.15Å; E1059-A1063 PolarHBondContact O-N 2.88Å; V1060-A1063 PolarHBondContact O-N 3Å; A1063-K1065 VanDerWaalsContact C-N 3.29Å; A1063-K1065 PolarHBondContact O-N 3.45Å; A1063-A1066 WeakPolarHBondContact O-CB 3.34Å; A1063-A1066 PolarHBondContact O-N 3.01Å; A1063-V1067 WeakPolarHBondContact O-CG2 3.21Å; A1063-V1067 PolarHBondContact O-N 2.86Å
1064	G	96.2	Very high	93.5	Very high	2 Å²	2	60.9 Å²	60.9	2%	0.021	33%	0.326	C	S	.	.	H	α-helix	trans	-56.9	-40.6	177.8	0	0	0	0	0	112.7	F1047 V1060 A1068	F1047-G1064 WeakPolarHBondContact CD1-O 3.41Å; V1060-G1064 PolarHBondContact O-N 2.78Å; G1064-A1068 WeakPolarHBondContact O-CB 3.5Å; G1064-A1068 PolarHBondContact O-N 3.04Å
1065	K	95.7	Very high	93.8	Very high	144 Å²	144	59.2 Å²	59.2	63%	0.626	32%	0.317	S	S	*	.	H	α-helix	trans	-67.5	-36.8	174.3	-175.1	165.2	-176.2	164.2	0	113.5	A1061 K1062 A1063 L1069	A1061-K1065 WeakPolarHBondContact O-CB 3.32Å; A1061-K1065 PolarHBondContact O-N 2.91Å; K1062-K1065 PolarHBondContact O-N 2.86Å; A1063-K1065 VanDerWaalsContact C-N 3.29Å; A1063-K1065 PolarHBondContact O-N 3.45Å; K1065-L1069 HydrophobicContact CG-CD1 4.35Å; K1065-L1069 VanDerWaalsContact O-CG 3.32Å; K1065-L1069 WeakPolarHBondContact O-CG 3.35Å; K1065-L1069 PolarHBondContact O-N 3.22Å; K1065-L1069 VanDerWaalsContact O-N 3.12Å
1066	A	96.6	Very high	94.2	Very high	37 Å²	37	57 Å²	57	31%	0.306	32%	0.315	S	S	.	.	H	α-helix	trans	-68.3	-47.1	176.6	0	0	0	0	0	111.5	L993 K1062 A1063 A1068 L1069 Y1070	L993-A1066 HydrophobicContact CD1-CB 3.91Å; K1062-A1066 WeakPolarHBondContact O-CB 3.37Å; K1062-A1066 PolarHBondContact O-N 3.49Å; A1063-A1066 WeakPolarHBondContact O-CB 3.34Å; A1063-A1066 PolarHBondContact O-N 3.01Å; A1066-A1068 VanDerWaalsContact C-N 3.35Å; A1066-A1068 PolarHBondContact O-N 3.42Å; A1066-L1069 PolarHBondContact O-N 3.37Å; A1066-Y1070 PolarHBondContact O-N 3.47Å
1067	V	97.1	Very high	94.8	Very high	0 Å²	0	59.2 Å²	59.2	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-65.5	-37.4	177.2	-173.6	0	0	0	0	111	L988 L993 F1047 A1063 Y1070 F1071	L988-V1067 HydrophobicContact CD2-CG1 3.8Å; L993-V1067 HydrophobicContact CB-CG2 3.99Å; L993-V1067 WeakPolarHBondContact O-CG2 3.43Å; F1047-V1067 HydrophobicContact CE1-CB 3.75Å; F1047-V1067 HydrophobicContact CE1-CG1 3.66Å; F1047-V1067 HydrophobicContact CZ-CB 4.01Å; F1047-V1067 HydrophobicContact CZ-CG1 3.47Å; F1047-V1067 VanDerWaalsContact CZ-CG1 3.47Å; A1063-V1067 WeakPolarHBondContact O-CG2 3.21Å; A1063-V1067 PolarHBondContact O-N 2.86Å; V1067-Y1070 PolarHBondContact O-N 3.27Å; V1067-F1071 WeakPolarHBondContact O-CB 3.35Å; V1067-F1071 PolarHBondContact O-N 3.13Å
1068	A	96.9	Very high	95.3	Very high	24 Å²	24	54 Å²	54	20%	0.198	28%	0.283	C	S	.	.	H	α-helix	trans	-61.6	-43.9	173.7	0	0	0	0	0	112.7	F1047 G1064 A1066 Y1070 F1071 E1072	F1047-A1068 HydrophobicContact CB-CB 3.84Å; F1047-A1068 HydrophobicContact CD1-CB 4.29Å; F1047-A1068 HydrophobicContact CD2-CB 3.7Å; F1047-A1068 HydrophobicContact CE2-CB 4.37Å; F1047-A1068 HydrophobicContact CG-CB 3.66Å; G1064-A1068 WeakPolarHBondContact O-CB 3.5Å; G1064-A1068 PolarHBondContact O-N 3.04Å; A1066-A1068 VanDerWaalsContact C-N 3.35Å; A1066-A1068 PolarHBondContact O-N 3.42Å; A1068-Y1070 VanDerWaalsContact C-N 3.33Å; A1068-F1071 WeakPolarHBondContact O-CB 3.28Å; A1068-F1071 PolarHBondContact O-N 3.47Å; A1068-E1072 WeakPolarHBondContact O-CG 3.36Å; A1068-E1072 PolarHBondContact O-N 3.31Å
1069	L	97	Very high	95.4	Very high	117 Å²	117	52.8 Å²	52.8	61%	0.613	27%	0.272	S	S	*	.	H	α-helix	trans	-65	-38.6	176.3	-73.1	168.6	0	0	0	111.8	K1065 A1066 D1073	K1065-L1069 HydrophobicContact CG-CD1 4.35Å; K1065-L1069 VanDerWaalsContact O-CG 3.32Å; K1065-L1069 WeakPolarHBondContact O-CG 3.35Å; K1065-L1069 PolarHBondContact O-N 3.22Å; K1065-L1069 VanDerWaalsContact O-N 3.12Å; A1066-L1069 PolarHBondContact O-N 3.37Å; L1069-D1073 WeakPolarHBondContact O-CB 3.39Å; L1069-D1073 PolarHBondContact O-N 2.58Å; L1069-D1073 VanDerWaalsContact O-N 3.09Å
1070	Y	97.7	Very high	95.4	Very high	62 Å²	62	50 Å²	50	24%	0.243	27%	0.272	C	S	.	.	H	α-helix	trans	-66.6	-36.2	173.9	-179.3	-106.5	0	0	0	112.6	Y987 L988 H991 A1066 V1067 A1068 K1074	Y987-Y1070 VanDerWaalsContact CD1-OH 3.29Å; Y987-Y1070 WeakPolarHBondContact CD1-OH 3.25Å; Y987-Y1070 WeakPolarHBondContact O-CE1 3.36Å; L988-Y1070 HydrophobicContact CD2-CD1 4.48Å; H991-Y1070 HydrophobicContact CB-CD1 4.21Å; H991-Y1070 HydrophobicContact CB-CE1 4.09Å; H991-Y1070 AromaticContact CD2-CD1 3.44Å; H991-Y1070 VanDerWaalsContact CD2-CD1 3.44Å; H991-Y1070 WeakPolarHBondContact CD2-CD1 3.39Å; H991-Y1070 AromaticContact CD2-CE1 3.81Å; H991-Y1070 AromaticContact CD2-CG 3.56Å; A1066-Y1070 PolarHBondContact O-N 3.47Å; V1067-Y1070 PolarHBondContact O-N 3.27Å; A1068-Y1070 VanDerWaalsContact C-N 3.33Å; Y1070-K1074 HydrophobicContact CD2-CG 4.42Å; Y1070-K1074 HydrophobicContact CE1-CG 4.28Å; Y1070-K1074 HydrophobicContact CE2-CD 4.47Å; Y1070-K1074 HydrophobicContact CE2-CG 4.09Å; Y1070-K1074 WeakPolarHBondContact O-CB 3.28Å; Y1070-K1074 VanDerWaalsContact O-CG 3.31Å; Y1070-K1074 WeakPolarHBondContact O-CG 3.28Å; Y1070-K1074 PolarHBondContact O-N 2.86Å; Y1070-K1074 VanDerWaalsContact O-N 3.08Å
1071	F	97.9	Very high	95.2	Very high	2 Å²	2	54 Å²	54	1%	0.009	29%	0.291	C	S	.	.	H	α-helix	trans	-62.2	-51.4	173	176.9	-114.1	0	0	0	111.7	L984 L988 F1039 V1040 V1043 R1044 F1047 V1067 A1068 D1073 K1074 L1075	L984-F1071 HydrophobicContact CB-CE2 4.45Å; L984-F1071 HydrophobicContact CD2-CE2 4.3Å; L988-F1071 HydrophobicContact CD1-CD2 3.98Å; L988-F1071 HydrophobicContact CD1-CE2 4.5Å; L988-F1071 HydrophobicContact CD2-CB 3.94Å; L988-F1071 HydrophobicContact CD2-CD2 4.17Å; L988-F1071 HydrophobicContact CD2-CG 4.47Å; L988-F1071 HydrophobicContact CG-CD2 4.44Å; F1039-F1071 HydrophobicContact CE1-CE2 4.46Å; V1040-F1071 HydrophobicContact CG1-CE1 4.28Å; V1040-F1071 HydrophobicContact CG1-CZ 4.37Å; V1040-F1071 HydrophobicContact CG2-CZ 4.3Å; V1043-F1071 HydrophobicContact CB-CE1 4.14Å; V1043-F1071 HydrophobicContact CB-CE2 4.14Å; V1043-F1071 HydrophobicContact CB-CZ 3.84Å; V1043-F1071 HydrophobicContact CG1-CD1 3.79Å; V1043-F1071 HydrophobicContact CG1-CD2 3.66Å; V1043-F1071 HydrophobicContact CG1-CE1 3.71Å; V1043-F1071 HydrophobicContact CG1-CE2 3.58Å; V1043-F1071 HydrophobicContact CG1-CG 3.76Å; V1043-F1071 HydrophobicContact CG1-CZ 3.6Å; V1043-F1071 HydrophobicContact CG2-CE2 4.46Å; V1043-F1071 HydrophobicContact CG2-CZ 4.48Å; R1044-F1071 HydrophobicContact CG-CE1 4.17Å; F1047-F1071 HydrophobicContact CE2-CB 4.25Å; V1067-F1071 WeakPolarHBondContact O-CB 3.35Å; V1067-F1071 PolarHBondContact O-N 3.13Å; A1068-F1071 WeakPolarHBondContact O-CB 3.28Å; A1068-F1071 PolarHBondContact O-N 3.47Å; F1071-D1073 VanDerWaalsContact C-N 3.33Å; F1071-D1073 PolarHBondContact O-N 2.91Å; F1071-K1074 PolarHBondContact O-N 3.05Å; F1071-L1075 HydrophobicContact CE1-CD2 3.99Å; F1071-L1075 HydrophobicContact CZ-CD1 4.22Å; F1071-L1075 HydrophobicContact CZ-CD2 4.17Å; F1071-L1075 WeakPolarHBondContact O-CB 3.48Å; F1071-L1075 PolarHBondContact O-N 3.2Å
1072	E	96.6	Very high	95	Very high	71 Å²	71	58 Å²	58	33%	0.332	30%	0.304	S	S	.	.	H	α-helix	trans	-64.7	-36.2	-178.5	-64.3	-64.6	151.7	0	0	112.2	R1044 A1068 L1075 S1076	R1044-E1072 IonicContact CZ-OE1 3.79Å; R1044-E1072 IonicContact CZ-OE2 3.4Å; R1044-E1072 IonicContact NE-OE1 2.72Å; R1044-E1072 PolarHBondContact NE-OE1 3.04Å; R1044-E1072 IonicContact NE-OE2 3.73Å; R1044-E1072 VanDerWaalsContact NH2-CD 3.35Å; R1044-E1072 IonicContact NH2-OE1 2.62Å; R1044-E1072 PolarHBondContact NH2-OE1 3.15Å; R1044-E1072 IonicContact NH2-OE2 3.49Å; R1044-E1072 PolarHBondContact NH2-OE2 2.79Å; A1068-E1072 WeakPolarHBondContact O-CG 3.36Å; A1068-E1072 PolarHBondContact O-N 3.31Å; E1072-L1075 PolarHBondContact O-N 2.93Å; E1072-S1076 PolarHBondContact O-N 3.3Å
1073	D	96.6	Very high	94.7	Very high	85 Å²	85	59.9 Å²	59.9	46%	0.455	32%	0.323	S	S	.	.	H	α-helix	trans	-58	-54.5	171.3	176.1	84.9	0	0	0	111.1	L1069 F1071 L1075 S1076 E1077	L1069-D1073 WeakPolarHBondContact O-CB 3.39Å; L1069-D1073 PolarHBondContact O-N 2.58Å; L1069-D1073 VanDerWaalsContact O-N 3.09Å; F1071-D1073 VanDerWaalsContact C-N 3.33Å; F1071-D1073 PolarHBondContact O-N 2.91Å; D1073-L1075 VanDerWaalsContact C-N 3.32Å; D1073-L1075 PolarHBondContact O-N 2.78Å; D1073-S1076 PolarHBondContact O-N 3.36Å; D1073-S1076 PolarHBondContact O-OG 3.44Å; D1073-E1077 PolarHBondContact O-N 2.89Å
1074	K	97.1	Very high	94.6	Very high	27 Å²	27	60.2 Å²	60.2	12%	0.117	32%	0.323	C	S	.	.	H	α-helix	trans	-69	-28.8	-179.7	-66.1	-77.9	149.4	-83.1	0	113	L984 Y987 Y1070 F1071 E1077 I1078	L984-K1074 HydrophobicContact CD2-CB 4.11Å; Y987-K1074 HydrophobicContact CD1-CD 4.15Å; Y987-K1074 HydrophobicContact CD2-CB 4.15Å; Y987-K1074 HydrophobicContact CD2-CD 3.67Å; Y987-K1074 HydrophobicContact CD2-CG 4.1Å; Y987-K1074 HydrophobicContact CE1-CD 4.05Å; Y987-K1074 HydrophobicContact CE2-CD 3.5Å; Y987-K1074 HydrophobicContact CE2-CG 4.41Å; Y987-K1074 HydrophobicContact CG-CD 3.98Å; Y987-K1074 HydrophobicContact CG-CG 4.28Å; Y1070-K1074 HydrophobicContact CD2-CG 4.42Å; Y1070-K1074 HydrophobicContact CE1-CG 4.28Å; Y1070-K1074 HydrophobicContact CE2-CD 4.47Å; Y1070-K1074 HydrophobicContact CE2-CG 4.09Å; Y1070-K1074 WeakPolarHBondContact O-CB 3.28Å; Y1070-K1074 VanDerWaalsContact O-CG 3.31Å; Y1070-K1074 WeakPolarHBondContact O-CG 3.28Å; Y1070-K1074 PolarHBondContact O-N 2.86Å; Y1070-K1074 VanDerWaalsContact O-N 3.08Å; F1071-K1074 PolarHBondContact O-N 3.05Å; K1074-E1077 WeakPolarHBondContact CE-OE2 3.4Å; K1074-E1077 IonicContact NZ-OE2 2.82Å; K1074-E1077 PolarHBondContact NZ-OE2 3.3Å; K1074-E1077 PolarHBondContact O-N 2.99Å; K1074-I1078 WeakPolarHBondContact O-CB 3.12Å; K1074-I1078 WeakPolarHBondContact O-CG1 3.5Å; K1074-I1078 PolarHBondContact O-N 2.9Å
1075	L	96.9	Very high	94.1	Very high	7 Å²	7	65.6 Å²	65.6	4%	0.037	36%	0.355	C	S	.	.	H	α-helix	trans	-63.9	-45.9	171.5	-174.1	65.8	0	0	0	110.6	L984 V1040 F1071 E1072 D1073 E1077 I1078 Y1079 F1084	L984-L1075 HydrophobicContact CD1-CD1 3.74Å; L984-L1075 HydrophobicContact CD2-CB 4.36Å; L984-L1075 HydrophobicContact CD2-CD1 4.45Å; V1040-L1075 HydrophobicContact CG1-CD2 3.87Å; V1040-L1075 HydrophobicContact CG2-CD1 3.66Å; V1040-L1075 HydrophobicContact CG2-CD2 4.28Å; F1071-L1075 HydrophobicContact CE1-CD2 3.99Å; F1071-L1075 HydrophobicContact CZ-CD1 4.22Å; F1071-L1075 HydrophobicContact CZ-CD2 4.17Å; F1071-L1075 WeakPolarHBondContact O-CB 3.48Å; F1071-L1075 PolarHBondContact O-N 3.2Å; E1072-L1075 PolarHBondContact O-N 2.93Å; D1073-L1075 VanDerWaalsContact C-N 3.32Å; D1073-L1075 PolarHBondContact O-N 2.78Å; L1075-E1077 VanDerWaalsContact C-N 3.33Å; L1075-E1077 PolarHBondContact O-N 3.03Å; L1075-I1078 PolarHBondContact O-N 3.22Å; L1075-Y1079 HydrophobicContact CD1-CD2 4.05Å; L1075-Y1079 WeakPolarHBondContact O-CB 3.48Å; L1075-Y1079 PolarHBondContact O-N 3.02Å; L1075-F1084 HydrophobicContact CD1-CD2 3.86Å; L1075-F1084 HydrophobicContact CD1-CE2 3.67Å; L1075-F1084 HydrophobicContact CD2-CD2 3.88Å; L1075-F1084 HydrophobicContact CG-CD2 3.95Å; L1075-F1084 HydrophobicContact CG-CE2 4.18Å
1076	S	94.6	Very high	93.4	Very high	74 Å²	74	63.5 Å²	63.5	52%	0.517	36%	0.356	S	S	.	.	H	α-helix	trans	-67.2	-31.1	176.6	77.7	0	0	0	0	113.5	E1072 D1073 S1080	E1072-S1076 PolarHBondContact O-N 3.3Å; D1073-S1076 PolarHBondContact O-N 3.36Å; D1073-S1076 PolarHBondContact O-OG 3.44Å; S1076-S1080 WeakPolarHBondContact O-CA 3.35Å; S1076-S1080 PolarHBondContact O-N 2.75Å
1077	E	94.3	Very high	92.6	Very high	105 Å²	105	63.7 Å²	63.7	49%	0.491	35%	0.352	S	S	.	.	H	α-helix	trans	-68.4	-41.3	174.1	-172.1	-172	131.7	0	0	112.1	D1073 K1074 L1075	D1073-E1077 PolarHBondContact O-N 2.89Å; K1074-E1077 WeakPolarHBondContact CE-OE2 3.4Å; K1074-E1077 IonicContact NZ-OE2 2.82Å; K1074-E1077 PolarHBondContact NZ-OE2 3.3Å; K1074-E1077 PolarHBondContact O-N 2.99Å; L1075-E1077 VanDerWaalsContact C-N 3.33Å; L1075-E1077 PolarHBondContact O-N 3.03Å
1078	I	94.5	Very high	91.3	Very high	14 Å²	14	68.5 Å²	68.5	7%	0.072	38%	0.383	C	S	.	.	H	α-helix	trans	-88	-25	-174.4	-72.7	171.5	0	0	0	112.7	K980 R983 L984 Y987 K1074 L1075	K980-I1078 HydrophobicContact CB-CG2 3.58Å; K980-I1078 HydrophobicContact CD-CG2 3.79Å; K980-I1078 WeakPolarHBondContact CE-O 3.44Å; K980-I1078 HydrophobicContact CG-CG2 3.6Å; K980-I1078 PolarHBondContact NZ-O 3.45Å; R983-I1078 HydrophobicContact CB-CD1 4.13Å; R983-I1078 HydrophobicContact CG-CD1 3.68Å; L984-I1078 HydrophobicContact CD1-CG2 4.36Å; L984-I1078 HydrophobicContact CD2-CB 4.44Å; L984-I1078 HydrophobicContact CD2-CD1 3.77Å; L984-I1078 HydrophobicContact CG-CD1 3.79Å; L984-I1078 HydrophobicContact CG-CG2 4.41Å; Y987-I1078 HydrophobicContact CD2-CD1 4.19Å; Y987-I1078 HydrophobicContact CE2-CD1 3.97Å; K1074-I1078 WeakPolarHBondContact O-CB 3.12Å; K1074-I1078 WeakPolarHBondContact O-CG1 3.5Å; K1074-I1078 PolarHBondContact O-N 2.9Å; L1075-I1078 PolarHBondContact O-N 3.22Å
1079	Y	94.1	Very high	89.5	Confident	8 Å²	8	75 Å²	75	3%	0.031	41%	0.41	C	S	.	.			trans	-125.3	50.5	177.9	-76.3	-82.2	0	0	0	111.4	D977 K980 L984 P1036 L1075 D1081 R1082 F1084	D977-Y1079 WeakPolarHBondContact OD1-CE1 3.38Å; D977-Y1079 PolarHBondContact OD1-OH 3.21Å; K980-Y1079 HydrophobicContact CB-CE2 3.74Å; K980-Y1079 WeakPolarHBondContact CB-OH 3.45Å; K980-Y1079 HydrophobicContact CD-CD1 3.87Å; K980-Y1079 HydrophobicContact CD-CD2 4.12Å; K980-Y1079 HydrophobicContact CD-CE1 3.37Å; K980-Y1079 HydrophobicContact CD-CE2 3.67Å; K980-Y1079 HydrophobicContact CD-CG 4.22Å; K980-Y1079 HydrophobicContact CG-CE2 4.33Å; K980-Y1079 VanDerWaalsContact NZ-CD1 3.35Å; L984-Y1079 HydrophobicContact CD1-CD2 4.27Å; L984-Y1079 HydrophobicContact CD1-CE2 4.06Å; P1036-Y1079 WeakPolarHBondContact CB-OH 3.49Å; P1036-Y1079 WeakPolarHBondContact CG-OH 3.39Å; L1075-Y1079 HydrophobicContact CD1-CD2 4.05Å; L1075-Y1079 WeakPolarHBondContact O-CB 3.48Å; L1075-Y1079 PolarHBondContact O-N 3.02Å; Y1079-D1081 PolarHBondContact O-N 3.31Å; Y1079-R1082 HydrophobicContact CD1-CB 4.2Å; Y1079-R1082 PolarHBondContact O-N 2.98Å; Y1079-R1082 VanDerWaalsContact O-O 3.05Å; Y1079-F1084 HydrophobicContact CD1-CE2 4.09Å; Y1079-F1084 AromaticContact CD1-CZ 3.91Å; Y1079-F1084 HydrophobicContact CD1-CZ 3.91Å; Y1079-F1084 AromaticContact CD2-CE2 3.67Å; Y1079-F1084 HydrophobicContact CD2-CE2 3.67Å; Y1079-F1084 AromaticContact CD2-CZ 3.86Å; Y1079-F1084 HydrophobicContact CD2-CZ 3.86Å; Y1079-F1084 HydrophobicContact CE1-CZ 4.05Å; Y1079-F1084 HydrophobicContact CE2-CE2 4.25Å; Y1079-F1084 AromaticContact CE2-CZ 3.99Å; Y1079-F1084 HydrophobicContact CE2-CZ 3.99Å; Y1079-F1084 AromaticContact CG-CE2 3.57Å; Y1079-F1084 HydrophobicContact CG-CE2 3.57Å; Y1079-F1084 AromaticContact CG-CZ 3.81Å; Y1079-F1084 HydrophobicContact CG-CZ 3.81Å
1080	S	90.2	Very high	87.1	Confident	107 Å²	107	74.5 Å²	74.5	75%	0.748	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	-19.4	175.3	60.7	0	0	0	0	114.2	S1076	S1076-S1080 WeakPolarHBondContact O-CA 3.35Å; S1076-S1080 PolarHBondContact O-N 2.75Å
1081	D	88.5	Confident	84.3	Confident	125 Å²	125	79.6 Å²	79.6	67%	0.668	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.1	-8.2	179.7	60.5	-44.9	0	0	0	114.3	K980 Y1079	K980-D1081 IonicContact NZ-OD1 3.53Å; K980-D1081 PolarHBondContact NZ-OD1 3.05Å; Y1079-D1081 PolarHBondContact O-N 3.31Å
1082	R	89	Confident	81.3	Confident	97 Å²	97	85.4 Å²	85.4	37%	0.366	46%	0.456	S	S	.	.			trans	-142.8	126.6	-168.4	-176.8	177.3	-175.3	167.3	5.9	113.4	D1037 Y1079 F1084	D1037-R1082 IonicContact OD1-CZ 3.96Å; D1037-R1082 IonicContact OD1-NE 2.66Å; D1037-R1082 IonicContact OD1-NH2 2.7Å; D1037-R1082 PolarHBondContact OD1-NH2 3.4Å; D1037-R1082 IonicContact OD2-CZ 2.74Å; D1037-R1082 IonicContact OD2-NH1 3.26Å; D1037-R1082 IonicContact OD2-NH2 2.72Å; D1037-R1082 PolarHBondContact OD2-NH2 2.79Å; Y1079-R1082 HydrophobicContact CD1-CB 4.2Å; Y1079-R1082 PolarHBondContact O-N 2.98Å; Y1079-R1082 VanDerWaalsContact O-O 3.05Å; R1082-F1084 HydrophobicContact CG-CE2 4.45Å; R1082-F1084 HydrophobicContact CG-CZ 4.29Å
1083	T	87.9	Confident	78.4	Confident	137 Å²	137	88.8 Å²	88.8	84%	0.84	48%	0.476	S	S	*	.			trans	-87.3	140.3	167.5	47.2	0	0	0	0	111.2
1084	F	91.4	Very high	75.5	Confident	19 Å²	19	88.2 Å²	88.2	8%	0.083	47%	0.471	C	S	.	.			trans	-109.6	124.1	176.7	-70.7	-78	0	0	0	111	P1036 D1037 V1040 R1044 L1075 Y1079 R1082	P1036-F1084 HydrophobicContact CB-CE1 3.94Å; P1036-F1084 HydrophobicContact CB-CZ 4.07Å; D1037-F1084 HydrophobicContact CB-CD1 4.37Å; V1040-F1084 HydrophobicContact CB-CD1 4.24Å; V1040-F1084 HydrophobicContact CB-CG 4.34Å; V1040-F1084 HydrophobicContact CG1-CB 3.89Å; V1040-F1084 HydrophobicContact CG1-CD1 4.41Å; V1040-F1084 HydrophobicContact CG1-CG 4.05Å; V1040-F1084 HydrophobicContact CG2-CD1 3.99Å; V1040-F1084 HydrophobicContact CG2-CD2 4.18Å; V1040-F1084 HydrophobicContact CG2-CE1 4.03Å; V1040-F1084 HydrophobicContact CG2-CE2 4.2Å; V1040-F1084 HydrophobicContact CG2-CG 4.05Å; V1040-F1084 HydrophobicContact CG2-CZ 4.12Å; R1044-F1084 PolarHBondContact NH1-O 3.36Å; L1075-F1084 HydrophobicContact CD1-CD2 3.86Å; L1075-F1084 HydrophobicContact CD1-CE2 3.67Å; L1075-F1084 HydrophobicContact CD2-CD2 3.88Å; L1075-F1084 HydrophobicContact CG-CD2 3.95Å; L1075-F1084 HydrophobicContact CG-CE2 4.18Å; Y1079-F1084 HydrophobicContact CD1-CE2 4.09Å; Y1079-F1084 AromaticContact CD1-CZ 3.91Å; Y1079-F1084 HydrophobicContact CD1-CZ 3.91Å; Y1079-F1084 AromaticContact CD2-CE2 3.67Å; Y1079-F1084 HydrophobicContact CD2-CE2 3.67Å; Y1079-F1084 AromaticContact CD2-CZ 3.86Å; Y1079-F1084 HydrophobicContact CD2-CZ 3.86Å; Y1079-F1084 HydrophobicContact CE1-CZ 4.05Å; Y1079-F1084 HydrophobicContact CE2-CE2 4.25Å; Y1079-F1084 AromaticContact CE2-CZ 3.99Å; Y1079-F1084 HydrophobicContact CE2-CZ 3.99Å; Y1079-F1084 AromaticContact CG-CE2 3.57Å; Y1079-F1084 HydrophobicContact CG-CE2 3.57Å; Y1079-F1084 AromaticContact CG-CZ 3.81Å; Y1079-F1084 HydrophobicContact CG-CZ 3.81Å; R1082-F1084 HydrophobicContact CG-CE2 4.45Å; R1082-F1084 HydrophobicContact CG-CZ 4.29Å
1085	T	86.3	Confident	72.7	Confident	116 Å²	116	92.2 Å²	92.2	71%	0.712	49%	0.494	S	S	*	.	P	Polyproline II helix	trans	-48.1	125.9	177.4	-47.6	0	0	0	0	110.9	R1044	R1044-T1085 PolarHBondContact NH1-O 3.39Å
1086	P	80.3	Confident	69.7	Low	99 Å²	99	97.4 Å²	97.4	64%	0.643	52%	0.521	S	S	*	.	P	Polyproline II helix	trans	-54.9	144.4	171.5	-24.4	34.5	0	0	0	110.2	P1088	P1086-P1088 WeakPolarHBondContact O-CD 3.37Å; P1086-P1088 VanDerWaalsContact O-N 3.15Å
1087	L	79.9	Confident	66.8	Low	41 Å²	41	96.6 Å²	96.6	22%	0.215	53%	0.525	C	S	.	.	P	Polyproline II helix	trans	-55.2	124.2	170.5	-86.4	177.8	0	0	0	108.7	A1041 R1044 L1045 K1048 E1089	A1041-L1087 HydrophobicContact CB-CD2 3.87Å; R1044-L1087 VanDerWaalsContact C-CD1 3.45Å; R1044-L1087 HydrophobicContact CB-CD1 3.47Å; R1044-L1087 VanDerWaalsContact CB-CD1 3.47Å; R1044-L1087 HydrophobicContact CB-CG 3.84Å; L1045-L1087 HydrophobicContact CB-CD1 3.4Å; L1045-L1087 VanDerWaalsContact CB-CD1 3.4Å; K1048-L1087 HydrophobicContact CB-CD1 4.38Å; K1048-L1087 HydrophobicContact CD-CB 4.12Å; K1048-L1087 HydrophobicContact CD-CD1 3.84Å; K1048-L1087 PolarHBondContact NZ-O 3.11Å; L1087-E1089 PolarHBondContact O-N 3.4Å
1088	P	70.2	Confident	64	Low	101 Å²	101	101 Å²	101	66%	0.656	55%	0.545	S	S	*	.	P	Polyproline II helix	trans	-46	129.4	171.8	-28.4	35.2	0	0	0	109.4	K1048 P1086 F1090	K1048-P1088 VanDerWaalsContact NZ-C 3.26Å; K1048-P1088 PolarHBondContact NZ-O 3.37Å; P1086-P1088 WeakPolarHBondContact O-CD 3.37Å; P1086-P1088 VanDerWaalsContact O-N 3.15Å; P1088-F1090 PolarHBondContact O-N 3.33Å
1089	E	57.8	Low	61.3	Low	161 Å²	161	106.4 Å²	106.4	75%	0.752	58%	0.579	S	S	*	*	P	Polyproline II helix	trans	-56.5	131.3	162.5	-63.1	-152.4	115.9	0	0	106.6	L1087 E1091	L1087-E1089 PolarHBondContact O-N 3.4Å; E1089-E1091 PolarHBondContact O-N 3.02Å
1090	F	48.2	Very low	58.7	Low	107 Å²	107	111.8 Å²	111.8	47%	0.469	61%	0.612	S	S	.	*			trans	-68.1	93.5	164.2	-69	-79.2	0	0	0	104.2	L1045 P1088	L1045-F1090 HydrophobicContact CD1-CE2 4.15Å; P1088-F1090 PolarHBondContact O-N 3.33Å
1091	E	37.4	Very low	56	Low	168 Å²	168	115.8 Å²	115.8	79%	0.785	62%	0.619	S	S	*	*			trans	-48.9	153.1	158.7	-63.5	-173	107.7	0	0	107.6	E1089 D1093	E1089-E1091 PolarHBondContact O-N 3.02Å; E1091-D1093 VanDerWaalsContact C-N 3.32Å; E1091-D1093 PolarHBondContact O-N 3.23Å
1092	Q	36.5	Very low	53.5	Low	124 Å²	124	117.8 Å²	117.8	58%	0.579	63%	0.63	S	S	*	*			trans	-71.9	98.1	179.3	-75.7	172.4	-141.2	0	0	107.4	E1094	Q1092-E1094 HydrophobicContact CB-CG 4.02Å; Q1092-E1094 PolarHBondContact NE2-OE1 3.35Å; Q1092-E1094 VanDerWaalsContact NE2-OE1 3.15Å; Q1092-E1094 PolarHBondContact O-N 2.74Å
1093	D	34.9	Very low	51.2	Low	143 Å²	143	118.6 Å²	118.6	77%	0.765	65%	0.651	S	S	*	*			trans	-63.6	70.9	156.8	-63.7	-50	0	0	0	107.4	E1091 D1095	E1091-D1093 VanDerWaalsContact C-N 3.32Å; E1091-D1093 PolarHBondContact O-N 3.23Å; D1093-D1095 PolarHBondContact O-N 3.33Å
1094	E	35	Very low	48.8	Very low	72 Å²	72	119.7 Å²	119.7	34%	0.336	65%	0.651	S	S	.	*			trans	-67.1	115.8	158.8	-76.1	155.2	145.1	0	0	105.2	L741 S742 P743 Q1092	L741-E1094 CarbonylContact C-O 3.53Å; L741-E1094 VanDerWaalsContact C-O 3.25Å; S742-E1094 WeakPolarHBondContact CA-O 3.32Å; S742-E1094 WeakPolarHBondContact CB-O 3.47Å; S742-E1094 PolarHBondContact N-O 2.8Å; S742-E1094 PolarHBondContact OG-O 2.93Å; P743-E1094 HydrophobicContact CB-CB 3.7Å; P743-E1094 HydrophobicContact CB-CG 4.02Å; P743-E1094 WeakPolarHBondContact CB-OE2 3.22Å; Q1092-E1094 HydrophobicContact CB-CG 4.02Å; Q1092-E1094 PolarHBondContact NE2-OE1 3.35Å; Q1092-E1094 VanDerWaalsContact NE2-OE1 3.15Å; Q1092-E1094 PolarHBondContact O-N 2.74Å
1095	D	38	Very low	46.5	Very low	112 Å²	112	127.9 Å²	127.9	60%	0.599	69%	0.69	S	S	*	*			trans	-118.1	84.1	-174.8	-156.3	50.9	0	0	0	107.4	A740 L741 D1093 G1097	A740-D1095 VanDerWaalsContact C-OD1 3.29Å; A740-D1095 VanDerWaalsContact CA-OD1 3.29Å; A740-D1095 WeakPolarHBondContact CA-OD1 3.25Å; L741-D1095 PolarHBondContact N-OD1 3.11Å; L741-D1095 CarbonylContact O-C 3.52Å; L741-D1095 WeakPolarHBondContact O-CA 3.21Å; D1093-D1095 PolarHBondContact O-N 3.33Å; D1095-G1097 PolarHBondContact O-N 3.1Å
1096	D	34.2	Very low	44.4	Very low	116 Å²	116	129.3 Å²	129.3	62%	0.62	69%	0.693	S	S	*	*			trans	-73.7	63.4	-179.7	-73.8	-73.9	0	0	0	110.4	L741 S742 P743 E1098	L741-D1096 PolarHBondContact O-N 3.28Å; S742-D1096 VanDerWaalsContact C-OD2 3.27Å; S742-D1096 WeakPolarHBondContact CA-OD2 2.86Å; P743-D1096 VanDerWaalsContact CA-OD2 3.32Å; P743-D1096 WeakPolarHBondContact CA-OD2 3.33Å; D1096-E1098 PolarHBondContact O-N 3.18Å
1097	G	35.2	Very low	42.2	Very low	57 Å²	57	133.1 Å²	133.1	59%	0.588	70%	0.7	S	S	*	*			trans	-86.1	100.7	177.6	0	0	0	0	0	112.8	D1095 V1099	D1095-G1097 PolarHBondContact O-N 3.1Å; G1097-V1099 PolarHBondContact O-N 3.04Å
1098	E	34.4	Very low	40.5	Very low	198 Å²	198	138 Å²	138	93%	0.925	72%	0.724	S	S	*	*			trans	-56.1	102.2	179.7	-176.6	179.5	-135	0	0	113.6	D1096	D1096-E1098 PolarHBondContact O-N 3.18Å
1099	V	38.6	Very low	38.8	Very low	127 Å²	127	140.4 Å²	140.4	77%	0.77	73%	0.727	S	S	*	*			trans	-137.2	106.7	168.4	-175.6	0	0	0	0	110.6	G1097	G1097-V1099 PolarHBondContact O-N 3.04Å
1100	T	38.7	Very low	37.8	Very low	120 Å²	120	138.2 Å²	138.2	74%	0.736	73%	0.727	S	S	*	*			trans	4.2	113	162.8	55.6	0	0	0	0	119.2
1101	E	33.6	Very low	37.3	Very low	192 Å²	192	143.8 Å²	143.8	90%	0.897	75%	0.745	S	S	*	*			trans	23.9	136.3	131	-55.2	-178.5	134.7	0	0	120.4
1102	D	36.2	Very low	37.4	Very low	167 Å²	167	146 Å²	146	89%	0.893	75%	0.746	S	S	*	*			trans	92.5	85.4	166	-155.9	34.7	0	0	0	118.6
1103	S	39.7	Very low	37.2	Very low	114 Å²	114	147.1 Å²	147.1	80%	0.797	75%	0.749	S	S	*	*			trans	177.2	119.2	141.7	-178.3	0	0	0	0	111.5
1104	D	39.1	Very low	37.2	Very low	160 Å²	160	148.2 Å²	148.2	86%	0.856	74%	0.742	S	S	*	*			trans	-97.3	115.6	178	-76.8	-62.3	0	0	0	113.2
1105	E	41.5	Very low	37.2	Very low	191 Å²	191	152.2 Å²	152.2	89%	0.893	77%	0.765	S	S	*	*			trans	-151	137.8	153.7	-81.4	-149.4	118.6	0	0	114.1
1106	D	44.1	Very low	37	Very low	145 Å²	145	152.6 Å²	152.6	78%	0.775	76%	0.761	S	S	*	*			trans	29.5	103.4	165.5	-104.4	-38.5	0	0	0	122.4
1107	F	34	Very low	37.1	Very low	179 Å²	179	152 Å²	152	79%	0.785	77%	0.767	S	S	*	*			trans	-98.5	101.4	172	-174.4	-96.5	0	0	0	113.2	Q1109	F1107-Q1109 HydrophobicContact CD1-CG 4.17Å; F1107-Q1109 HydrophobicContact CE1-CG 3.62Å
1108	I	42.5	Very low	37.2	Very low	143 Å²	143	156.5 Å²	156.5	73%	0.733	78%	0.777	S	S	*	*			trans	-104.2	111.5	179.4	-56.9	179.6	0	0	0	111.5
1109	Q	36.4	Very low	37.4	Very low	153 Å²	153	153.7 Å²	153.7	72%	0.715	76%	0.764	S	S	*	*			trans	-68	130.4	-174.6	-73.3	-173.9	-1.7	0	0	114.9	F1107 R1111	F1107-Q1109 HydrophobicContact CD1-CG 4.17Å; F1107-Q1109 HydrophobicContact CE1-CG 3.62Å; Q1109-R1111 PolarHBondContact O-N 3.2Å
1110	P	36.7	Very low	37.3	Very low	115 Å²	115	157.9 Å²	157.9	75%	0.747	77%	0.766	S	S	*	*			trans	-71.7	118.5	167.5	-17.4	31.8	0	0	0	112.5	R1112	P1110-R1112 PolarHBondContact O-N 3.32Å
1111	R	37.4	Very low	37.4	Very low	223 Å²	223	157.3 Å²	157.3	84%	0.842	76%	0.764	S	S	*	*			trans	-68.8	108.4	174.3	-81.9	-179	157.9	175.2	-3.3	111.8	Q1109	Q1109-R1111 PolarHBondContact O-N 3.2Å
1112	R	38.6	Very low	37.7	Very low	215 Å²	215	154.5 Å²	154.5	81%	0.811	76%	0.76	S	S	*	*			trans	-106.9	151.3	168	-74.3	-174.7	72.7	148.5	-3	113	P1110	P1110-R1112 PolarHBondContact O-N 3.32Å
1113	K	33.7	Very low	37.7	Very low	148 Å²	148	154.7 Å²	154.7	64%	0.643	76%	0.755	S	S	*	*			trans	-52.7	146.3	-175.7	-58.7	163.7	-179	166	0	113	E1051	E1051-K1113 IonicContact OE1-NZ 3.59Å; E1051-K1113 PolarHBondContact OE1-NZ 2.92Å
1114	R	33.2	Very low	37.7	Very low	166 Å²	166	157 Å²	157	63%	0.626	76%	0.757	S	S	*	*			trans	-137	114.7	152.9	-160.5	170.8	-170.9	154.1	5.3	111.4	G747 S749	G747-R1114 PolarHBondContact O-NH1 2.84Å; S749-R1114 PolarHBondContact OG-NH1 3.09Å
1115	L	35.3	Very low	37.7	Very low	156 Å²	156	162 Å²	162	82%	0.817	77%	0.771	S	S	*	*			trans	-66.5	155.6	167.6	-90.9	66	0	0	0	110
1116	K	33.6	Very low	37.5	Very low	119 Å²	119	160.6 Å²	160.6	52%	0.517	77%	0.765	S	S	.	*			trans	-133.3	132.2	166	-173.7	175.6	178.9	-177.7	0	110	N750 H752	N750-K1116 VanDerWaalsContact OD1-CE 3.3Å; N750-K1116 WeakPolarHBondContact OD1-CE 3.26Å; N750-K1116 PolarHBondContact OD1-NZ 2.95Å; H752-K1116 PolarHBondContact CD2-NZ 2.66Å; H752-K1116 PolarHBondContact NE2-NZ 3.5Å
1117	S	36.3	Very low	37.1	Very low	105 Å²	105	161.4 Å²	161.4	73%	0.734	76%	0.764	S	S	*	*			trans	-131.5	134.7	177.2	51.2	0	0	0	0	111
1118	D	38.5	Very low	37.3	Very low	151 Å²	151	160.4 Å²	160.4	81%	0.807	76%	0.763	S	S	*	*			trans	76	160	155.6	-107.6	-65.3	0	0	0	123.8
1119	E	36.8	Very low	37	Very low	138 Å²	138	161.5 Å²	161.5	65%	0.645	77%	0.765	S	S	*	*			trans	-83.1	172.6	-173.5	-107.6	171.6	80.7	0	0	111.4
1120	R	38.2	Very low	37	Very low	215 Å²	215	162 Å²	162	81%	0.811	77%	0.768	S	S	*	*			cis	-154.2	-164.2	22.8	-129.7	178.6	-156.1	-170.6	6.9	110.9
1121	P	40.7	Very low	37.1	Very low	108 Å²	108	165.1 Å²	165.1	70%	0.701	77%	0.77	S	S	*	*			trans	-126.4	-172.8	-143.4	34.8	-9.5	0	0	0	114.8
1122	V	38.9	Very low	37	Very low	133 Å²	133	161 Å²	161	81%	0.806	77%	0.765	S	S	*	*				170.1	151.3	123	153.6	0	0	0	0	110.5
1123	H	35.8	Very low	36.9	Very low	172 Å²	172	156.8 Å²	156.8	80%	0.796	76%	0.761	S	S	*	*			trans	-65.4	156.7	178.7	-76.5	-91.3	0	0	0	114.7
1124	I	40.3	Very low	37.2	Very low	161 Å²	161	157.6 Å²	157.6	83%	0.826	77%	0.771	S	S	*	*				178	134.9	115.6	-87.8	152.8	0	0	0	105.4
1125	K	38.8	Very low	37.6	Very low	267 Å²	267	156.8 Å²	156.8	100%	1.161	78%	0.784	S	S	*	*			cis	-143	0	34.4	-164.3	170.6	-175.6	174.5	0	112.6

Retrieved 1,125 of 1,125 residues in 689.8 ms (Link to these results)

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