A0A5K4FAL2_SCHMA Loading...

Cyclic nucleotide-binding domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4FAL2, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,204 aa.

						>A0A5K4FAL2_SCHMA|A0A5K4FAL2
MEQFNVNLLKPTNELSKDDNEIECIQDHPCSSSSSTSSQNAMSSKQKSNEVNNSNKGDLIINNLQISNSKLNTISNEDVRRQSSVHSDQTLNVTHHLYPTTSLSHTASAFSSYLRIPSIYEQMNDTVASTHSADWSKSLHRSSCFNTPQSLSEEDQKFTQATVRAVLAASARESRTALTDLPLDFFINHSDIDNKLSSLSVQQLYHRNLSTESAFNVNRLNIPSSKYHDECKERRTNRKFSTLYTHSFDDTIHDSVLLYKRDKSPIPMTSNHSNNLILNSTTNLSNFTQLTRIPSSNKNIIVTTKQNPKSLKNLARQTSHSINRPLKRLAASFRLTKTIDHSASVNYKHHCSRTNMNLKSDHTVSSWNSVTNCIDSIQTTSNTTITTNTTTYNNNSSSNNNGKNIRTRSVILQTDHDFINEFKHEKGLHKGHLLVNDNTNLIDKRIKNELSDSMDYDINSLLSQDDNKPNNSSFHLKEQFFAFFQPTGNKLAMKLFGTKLALDRERLRQEQQGDWIIHPCSNFRFYWDLVMLLLLIANLIILPVAISFFNDDLSIHWIVFNCVSDTVFLIDIGVNFRTGIIKNNFADEIMLNPKEIARQYLKTWFLLDLLSSLPLDYIYLILHDNENFTQFVHAGRALRFLRFVKLLSLIRLLRLSRLVRYVSEWEEFINLASKFIGIFNLVLLLLLLGHWNACLQFLIPMLHDYPVESWVAKGKLQNAYWFDQYTWALFKAMSHMLTIGYGRYPPTSLSEAWVTVISMVTGATGYALFVGHAAALIQSFDCSKRLYREKFKQVDEYMAYRKLPRGLRKRIASYYEHRYQGKMFNENEILNELSECLKEQIINYNCRALVAAVPFFTFADQNFVSEVVVKLRYEVFQPGDLIIKEGTIGTKMYFIQEGIVDIVTRDGEVATSLSDGSYFGEICLLTNARRVASVRAETYCNVYSLDRASFLEVLDNYPLMRRTMESVAAERLNKIGRDPLVVSNRKDLYDDLKLVNEIVNQAIREADDVQIEGETENSADEDGVDGYKTNDNTNTTNGRASGNHKRHHDERNYQPCKKNNKFSHPVNYFKQRKLSHWNPLILRKSSEPEWLHHSANDRSSATSTLFNTGIRKWYHIKHGKSNISKVINKTKSVDNLTMFKLSPNLSNNWHITKSTPVNVTVSVINEHDDDDDDDVTPKESITSNTSIKINKQSDENNLSINNNQ
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	27.6	Very low	30.5	Very low	199 Å²	199	153.5 Å²	153.5	98%	0.98	78%	0.782	S	S	*	*				0	95.2	0	-71.2	175.8	171.6	0	0	107.7
2	E	30	Very low	30.6	Very low	115 Å²	115	149.8 Å²	149.8	54%	0.537	77%	0.773	S	S	.	*			cis	-136.7	142.8	-3.8	-63.4	139	129.6	0	0	106.3	F4 R115	E2-F4 HydrophobicContact CB-CB 4.46Å; E2-F4 HydrophobicContact CG-CB 4.39Å; E2-R115 IonicContact OE2-CZ 3.51Å; E2-R115 VanDerWaalsContact OE2-CZ 3.3Å; E2-R115 IonicContact OE2-NH1 2.88Å; E2-R115 PolarHBondContact OE2-NH1 2.88Å; E2-R115 IonicContact OE2-NH2 3.13Å; E2-R115 PolarHBondContact OE2-NH2 2.94Å
3	Q	27.1	Very low	30.8	Very low	185 Å²	185	147.8 Å²	147.8	86%	0.864	76%	0.764	S	S	*	*			cis	12.7	91.8	6.3	-69.6	-173.4	-13.9	0	0	117.3
4	F	29.8	Very low	30.6	Very low	187 Å²	187	146.8 Å²	146.8	82%	0.82	75%	0.754	S	S	*	*			trans	-138.7	148.4	142	-131.2	-95.3	0	0	0	107.6	E2	E2-F4 HydrophobicContact CB-CB 4.46Å; E2-F4 HydrophobicContact CG-CB 4.39Å
5	N	32.1	Very low	30.6	Very low	146 Å²	146	148.5 Å²	148.5	78%	0.781	76%	0.764	S	S	*	*			trans	-85.5	142.4	-162.3	-68.8	-42.1	0	0	0	113.7
6	V	30.8	Very low	30.5	Very low	142 Å²	142	144.8 Å²	144.8	86%	0.861	76%	0.755	S	S	*	*			trans	-84	124.1	155.7	175.4	0	0	0	0	108.2
7	N	29.6	Very low	30.4	Very low	145 Å²	145	146.9 Å²	146.9	78%	0.775	76%	0.757	S	S	*	*			trans	-170	160.1	162.2	-103.6	-40.2	0	0	0	108.7
8	L	30.1	Very low	30.4	Very low	157 Å²	157	145.6 Å²	145.6	82%	0.822	75%	0.752	S	S	*	*			trans	77.2	120.8	-165.3	-57.9	160.6	0	0	0	111.8
9	L	32.9	Very low	30.3	Very low	162 Å²	162	145.1 Å²	145.1	85%	0.848	75%	0.75	S	S	*	*			cis	-140.1	147.1	5.4	-94.9	151.2	0	0	0	113.1
10	K	31.9	Very low	30.3	Very low	146 Å²	146	145 Å²	145	64%	0.635	75%	0.751	S	S	*	*			trans	-81.2	-174.2	163.2	-113.4	-162.3	173.3	-159.6	0	109.4	E14	K10-E14 VanDerWaalsContact NZ-CD 3.33Å; K10-E14 IonicContact NZ-OE1 3.64Å; K10-E14 PolarHBondContact NZ-OE1 2.72Å; K10-E14 IonicContact NZ-OE2 3.3Å; K10-E14 PolarHBondContact NZ-OE2 2.93Å; K10-E14 VanDerWaalsContact NZ-OE2 3.14Å
11	P	33.1	Very low	30.3	Very low	104 Å²	104	146.7 Å²	146.7	68%	0.675	76%	0.756	S	S	*	*			cis	-115.2	-151	4.5	45.1	-31.9	0	0	0	111.1
12	T	31.7	Very low	30.3	Very low	110 Å²	110	145.6 Å²	145.6	68%	0.675	75%	0.752	S	S	*	*			cis	-158.5	145.2	1.1	17	0	0	0	0	104.6
13	N	33.2	Very low	30.3	Very low	124 Å²	124	148.5 Å²	148.5	66%	0.663	77%	0.765	S	S	*	*			cis	-113	-146.5	-8	-76.5	-22.1	0	0	0	106.5
14	E	28.5	Very low	30.2	Very low	133 Å²	133	144.4 Å²	144.4	62%	0.621	76%	0.756	S	S	*	*			cis	68.2	152	5.9	-56.8	75	-147.8	0	0	115.2	K10	K10-E14 VanDerWaalsContact NZ-CD 3.33Å; K10-E14 IonicContact NZ-OE1 3.64Å; K10-E14 PolarHBondContact NZ-OE1 2.72Å; K10-E14 IonicContact NZ-OE2 3.3Å; K10-E14 PolarHBondContact NZ-OE2 2.93Å; K10-E14 VanDerWaalsContact NZ-OE2 3.14Å
15	L	30.9	Very low	30.3	Very low	172 Å²	172	141.7 Å²	141.7	90%	0.901	75%	0.749	S	S	*	*			cis	-124.3	158.9	1.6	-160.1	74.2	0	0	0	111.3
16	S	28.7	Very low	30.1	Very low	89 Å²	89	140 Å²	140	62%	0.622	74%	0.736	S	S	*	*			trans	-111.3	152.5	-178.9	60	0	0	0	0	113
17	K	28.6	Very low	30.1	Very low	182 Å²	182	139 Å²	139	79%	0.791	73%	0.726	S	S	*	*			trans	64.7	146.1	153.4	-79.6	-176.7	164.4	-147.3	0	116.1
18	D	30.2	Very low	30.2	Very low	123 Å²	123	140 Å²	140	66%	0.658	73%	0.725	S	S	*	*			cis	-147.1	175.6	32.3	-85	-54.8	0	0	0	111.6
19	D	29.7	Very low	30.4	Very low	136 Å²	136	137.8 Å²	137.8	73%	0.727	72%	0.721	S	S	*	*			trans	55.9	137.4	149.1	-61.3	-13.6	0	0	0	124.5
20	N	29	Very low	30	Very low	143 Å²	143	135.1 Å²	135.1	77%	0.765	71%	0.714	S	S	*	*			trans	84.7	153.2	148	-63.3	-25.1	0	0	0	123.1
21	E	30.9	Very low	29.7	Very low	181 Å²	181	133.2 Å²	133.2	85%	0.846	72%	0.719	S	S	*	*			trans	66.6	90.6	157.2	-76.9	158.7	-164.6	0	0	120.1	E23	E21-E23 PolarHBondContact O-N 3.07Å
22	I	27	Very low	29.6	Very low	176 Å²	176	133.8 Å²	133.8	90%	0.903	73%	0.726	S	S	*	*			trans	-74.5	103.4	149.6	-59.5	168.2	0	0	0	108.7
23	E	29.9	Very low	29.4	Very low	175 Å²	175	133 Å²	133	82%	0.818	73%	0.725	S	S	*	*			trans	-157.1	160	155.2	-85.7	-149.2	146.9	0	0	108.7	E21	E21-E23 PolarHBondContact O-N 3.07Å
24	C	26	Very low	29.2	Very low	99 Å²	99	132.5 Å²	132.5	67%	0.669	73%	0.731	S	S	*	*			cis	-170.9	175.1	-39.3	-144.5	0	0	0	0	106.5
25	I	31.3	Very low	29.3	Very low	131 Å²	131	131.3 Å²	131.3	67%	0.672	74%	0.737	S	S	*	*			trans	59	102	155.2	-64.4	161.8	0	0	0	115.6
26	Q	28.5	Very low	29	Very low	110 Å²	110	129.3 Å²	129.3	51%	0.514	73%	0.733	S	S	.	*				67.5	144.3	81.9	-70.7	-175.9	-67.5	0	0	116.8	H1044 K1045	Q26-H1044 PolarHBondContact NE2-O 2.69Å; Q26-K1045 PolarHBondContact NE2-O 2.96Å
27	D	29.9	Very low	29.1	Very low	120 Å²	120	130.4 Å²	130.4	64%	0.642	74%	0.74	S	S	*	*			trans	109.8	117.2	143.8	-83.2	-33.5	0	0	0	123.4
28	H	31.4	Very low	29	Very low	166 Å²	166	126.7 Å²	126.7	77%	0.769	74%	0.737	S	S	*	*			trans	94.3	148.9	139.5	-71.1	6.7	0	0	0	121.3
29	P	34.5	Very low	28.9	Very low	112 Å²	112	129 Å²	129	73%	0.727	74%	0.744	S	S	*	*			trans	-128.6	-147.5	-161.9	37	-13.1	0	0	0	112.1
30	C	26.1	Very low	29	Very low	105 Å²	105	129.5 Å²	129.5	71%	0.709	75%	0.747	S	S	*	*			trans	80.6	96.2	164.1	-64.4	0	0	0	0	118.8
31	S	25.6	Very low	29	Very low	106 Å²	106	126.1 Å²	126.1	74%	0.741	74%	0.739	S	S	*	*				43.4	111.4	120.7	64	0	0	0	0	120.7
32	S	29.5	Very low	28.9	Very low	116 Å²	116	126.5 Å²	126.5	81%	0.811	74%	0.743	S	S	*	*			trans	168.6	159.3	138.2	41	0	0	0	0	108.4
33	S	28.6	Very low	29.1	Very low	95 Å²	95	122.6 Å²	122.6	66%	0.664	73%	0.732	S	S	*	*			cis	-179.1	151.1	-32.6	51.5	0	0	0	0	106.2
34	S	27.7	Very low	29.3	Very low	113 Å²	113	119 Å²	119	79%	0.79	73%	0.726	S	S	*	*			trans	60.5	163.9	167.1	32.3	0	0	0	0	116.5
35	S	30.3	Very low	29.7	Very low	107 Å²	107	122.3 Å²	122.3	75%	0.748	73%	0.729	S	S	*	*			cis	-157.5	162.2	-17	40	0	0	0	0	111.1
36	T	25.8	Very low	29.8	Very low	131 Å²	131	123 Å²	123	80%	0.804	73%	0.729	S	S	*	*			trans	-47	129.8	165.8	48.5	0	0	0	0	116.1
37	S	29.8	Very low	30	Very low	111 Å²	111	125.8 Å²	125.8	78%	0.776	74%	0.739	S	S	*	*			trans	-170.6	129.5	134.3	43.3	0	0	0	0	108.3
38	S	26.7	Very low	30.1	Very low	105 Å²	105	124.4 Å²	124.4	73%	0.734	74%	0.739	S	S	*	*			cis	90.9	126.5	42.3	-68.3	0	0	0	0	113.8
39	Q	28.5	Very low	30.1	Very low	171 Å²	171	122.4 Å²	122.4	80%	0.799	73%	0.734	S	S	*	*			trans	77.8	134.6	153	-69.2	178.7	-12.5	0	0	121.4
40	N	31	Very low	30	Very low	146 Å²	146	124.9 Å²	124.9	78%	0.781	74%	0.736	S	S	*	*			trans	100.3	145.4	145.4	-59.8	-31.7	0	0	0	120.3
41	A	29.8	Very low	30.3	Very low	73 Å²	73	125 Å²	125	60%	0.603	73%	0.734	S	S	*	*			cis	-173.8	138.3	-29.2	0	0	0	0	0	110.4
42	M	28.9	Very low	30.6	Very low	188 Å²	188	126.1 Å²	126.1	93%	0.926	73%	0.731	S	S	*	*			trans	61.8	172.9	158.8	-62.6	-177.2	168.9	0	0	115
43	S	31.5	Very low	30.8	Very low	95 Å²	95	127.5 Å²	127.5	66%	0.664	73%	0.729	S	S	*	*			cis	-151.2	148.1	8.9	-158.4	0	0	0	0	113.9
44	S	33.3	Very low	31	Very low	99 Å²	99	127.2 Å²	127.2	69%	0.692	73%	0.727	S	S	*	*			trans	71.2	151.9	146.6	80.2	0	0	0	0	119.4
45	K	34	Very low	31.3	Very low	169 Å²	169	128.1 Å²	128.1	74%	0.735	72%	0.723	S	S	*	*			cis	-167	144	-17.6	-113.7	174.8	177.2	179	0	109.5
46	Q	34	Very low	31.4	Very low	144 Å²	144	132.6 Å²	132.6	67%	0.673	73%	0.729	S	S	*	*			trans	66	150.5	141.1	-71.2	177.2	-40.6	0	0	118.6
47	K	32.7	Very low	31.7	Very low	170 Å²	170	130 Å²	130	74%	0.739	73%	0.728	S	S	*	*			cis	-165.5	156.8	-6.3	-135.9	178.9	176.3	-170.1	0	111.1
48	S	32.2	Very low	31.8	Very low	91 Å²	91	132 Å²	132	64%	0.636	73%	0.73	S	S	*	*			trans	57.7	150.8	143.7	59.2	0	0	0	0	122.1
49	N	32.3	Very low	31.9	Very low	124 Å²	124	134.3 Å²	134.3	66%	0.663	73%	0.734	S	S	*	*			cis	-164.6	153.3	-10.1	-107.8	25.8	0	0	0	108.9
50	E	30.6	Very low	32	Very low	163 Å²	163	133.9 Å²	133.9	76%	0.762	74%	0.735	S	S	*	*				51	153.2	129.5	-58.5	178	147.1	0	0	121.6
51	V	33.3	Very low	32	Very low	109 Å²	109	134.6 Å²	134.6	66%	0.661	74%	0.737	S	S	*	*			cis	-161.5	147	6.4	106.3	0	0	0	0	114.3
52	N	32.2	Very low	31.9	Very low	128 Å²	128	137.5 Å²	137.5	68%	0.684	74%	0.743	S	S	*	*			trans	44.7	143.1	148.8	-55.6	-15.9	0	0	0	127.7
53	N	33	Very low	31.9	Very low	146 Å²	146	135.7 Å²	135.7	78%	0.781	74%	0.737	S	S	*	*			trans	72.9	133.2	136.6	-71.7	-5.5	0	0	0	121.1
54	S	33.4	Very low	31.7	Very low	89 Å²	89	138.2 Å²	138.2	62%	0.622	74%	0.742	S	S	*	*			cis	176.1	166.2	10.5	50.9	0	0	0	0	111.5
55	N	33.6	Very low	31.4	Very low	131 Å²	131	141.8 Å²	141.8	70%	0.701	75%	0.748	S	S	*	*			trans	75.7	108.3	152.5	-69	-41.9	0	0	0	123.2
56	K	33.1	Very low	31.1	Very low	202 Å²	202	141.1 Å²	141.1	88%	0.878	75%	0.751	S	S	*	*			trans	64.4	132.1	132.6	-60.5	-178.3	177.5	-177.3	0	120.9
57	G	31.3	Very low	30.9	Very low	76 Å²	76	139.3 Å²	139.3	78%	0.784	75%	0.754	S	S	*	*			trans	151.9	103.3	161.4	0	0	0	0	0	112.9
58	D	31.8	Very low	30.6	Very low	153 Å²	153	139 Å²	139	82%	0.818	76%	0.761	S	S	*	*			trans	-64.8	151	-169.7	-62.3	-70.5	0	0	0	116.8
59	L	28.6	Very low	30.6	Very low	154 Å²	154	139.4 Å²	139.4	81%	0.806	76%	0.763	S	S	*	*			trans	25.7	103	153.9	-77.9	71.6	0	0	0	118.8
60	I	30.4	Very low	30.6	Very low	161 Å²	161	142.6 Å²	142.6	83%	0.826	77%	0.771	S	S	*	*				-175.6	121.7	126.6	-91.2	147	0	0	0	106.4
61	I	32.5	Very low	30.5	Very low	161 Å²	161	142.6 Å²	142.6	83%	0.826	78%	0.776	S	S	*	*			trans	-133	110.5	178.9	-59.8	-177.3	0	0	0	111
62	N	28.3	Very low	30.4	Very low	134 Å²	134	144.3 Å²	144.3	72%	0.717	78%	0.781	S	S	*	*			trans	-97.8	152.5	154.3	-79.6	-51.3	0	0	0	109
63	N	27.1	Very low	30.4	Very low	151 Å²	151	144.5 Å²	144.5	81%	0.807	79%	0.787	S	S	*	*			trans	53.8	99.6	153.2	-60	-18.8	0	0	0	120.3
64	L	27.7	Very low	30.4	Very low	147 Å²	147	144.9 Å²	144.9	77%	0.77	79%	0.787	S	S	*	*			trans	-149.8	123.4	146.7	-91.2	157.2	0	0	0	104.4	I66	L64-I66 HydrophobicContact CD2-CD1 4.15Å
65	Q	27.3	Very low	30.3	Very low	175 Å²	175	145 Å²	145	82%	0.818	79%	0.788	S	S	*	*			cis	71.6	144.6	29.8	-148.6	-179	10.5	0	0	114.1
66	I	27.4	Very low	30	Very low	154 Å²	154	146.7 Å²	146.7	79%	0.79	80%	0.797	S	S	*	*			trans	82.8	137.2	-172.5	-54.5	161.3	0	0	0	111.5	L64	L64-I66 HydrophobicContact CD2-CD1 4.15Å
67	S	30.3	Very low	29.9	Very low	107 Å²	107	141.4 Å²	141.4	75%	0.748	78%	0.776	S	S	*	*			cis	-135.8	146.9	11.6	51.4	0	0	0	0	114.9
68	N	26.7	Very low	30	Very low	164 Å²	164	145.1 Å²	145.1	88%	0.877	78%	0.777	S	S	*	*			trans	-78.7	156.5	164.6	-62.9	-38.8	0	0	0	112.3
69	S	31.2	Very low	30	Very low	98 Å²	98	144.8 Å²	144.8	69%	0.685	78%	0.78	S	S	*	*				-172.8	146.4	127.9	63.2	0	0	0	0	113.3
70	K	32.1	Very low	30	Very low	191 Å²	191	147.6 Å²	147.6	83%	0.83	78%	0.781	S	S	*	*			trans	68	142	171.2	-51.4	173.9	-173.2	175.2	0	115.1
71	L	30.2	Very low	29.9	Very low	164 Å²	164	149 Å²	149	86%	0.859	78%	0.775	S	S	*	*			cis	-124.3	157.2	-1.7	-93.3	106.9	0	0	0	111.7
72	N	29.7	Very low	29.7	Very low	145 Å²	145	151 Å²	151	78%	0.775	78%	0.781	S	S	*	*			trans	-82.1	145.4	166.5	-66	-24.8	0	0	0	110.8
73	T	32.2	Very low	29.7	Very low	132 Å²	132	148.1 Å²	148.1	81%	0.81	77%	0.772	S	S	*	*				157.8	167.1	125.5	42.3	0	0	0	0	111.4
74	I	33.3	Very low	29.7	Very low	154 Å²	154	146.4 Å²	146.4	79%	0.79	77%	0.771	S	S	*	*			trans	75.5	85.6	173.5	-50.7	-177.6	0	0	0	115.4
75	S	31.6	Very low	29.9	Very low	90 Å²	90	145.9 Å²	145.9	63%	0.629	77%	0.774	S	S	*	*			trans	40.3	130.5	140.9	51.1	0	0	0	0	122.8	E77	S75-E77 PolarHBondContact O-N 3.35Å
76	N	26.5	Very low	30.1	Very low	168 Å²	168	146.1 Å²	146.1	90%	0.898	78%	0.775	S	S	*	*			trans	-66.6	117.1	166	-49.8	-83.5	0	0	0	112.1
77	E	32.2	Very low	30.2	Very low	91 Å²	91	142.5 Å²	142.5	43%	0.425	76%	0.763	S	S	.	*			trans	-131.1	-37.4	175.8	-149.9	75.8	-159.5	0	0	113.7	S75 R81	S75-E77 PolarHBondContact O-N 3.35Å; E77-R81 IonicContact OE1-CZ 3.38Å; E77-R81 IonicContact OE1-NH1 2.67Å; E77-R81 PolarHBondContact OE1-NH1 3.48Å; E77-R81 IonicContact OE1-NH2 3.05Å; E77-R81 PolarHBondContact OE1-NH2 3.36Å
78	D	32.3	Very low	30.2	Very low	153 Å²	153	144 Å²	144	82%	0.818	76%	0.763	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.6	2.9	-160.6	-69	-54	0	0	0	118
79	V	32.3	Very low	30.3	Very low	146 Å²	146	145.7 Å²	145.7	89%	0.885	77%	0.765	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.2	14.7	-178.6	-165.4	0	0	0	0	112.9
80	R	28.1	Very low	30.1	Very low	214 Å²	214	147.5 Å²	147.5	81%	0.808	77%	0.773	S	S	*	*	S	Bend	trans	-144.8	12.7	178.5	-120.8	173.9	-166.5	148.3	5.3	117.8	Q82	R80-Q82 PolarHBondContact O-N 3.45Å
81	R	29.1	Very low	30	Very low	189 Å²	189	145.9 Å²	145.9	71%	0.713	77%	0.772	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.8	59.2	176	-82.3	-165.6	170.3	125.8	9.8	114.7	E77	E77-R81 IonicContact OE1-CZ 3.38Å; E77-R81 IonicContact OE1-NH1 2.67Å; E77-R81 PolarHBondContact OE1-NH1 3.48Å; E77-R81 IonicContact OE1-NH2 3.05Å; E77-R81 PolarHBondContact OE1-NH2 3.36Å
82	Q	28.8	Very low	29.7	Very low	205 Å²	205	145 Å²	145	96%	0.958	77%	0.768	S	S	*	*	T	Hydrogen-bonded Turn	trans	-154.1	40	147.1	-118.3	173.5	38.2	0	0	112.7	R80	R80-Q82 PolarHBondContact O-N 3.45Å
83	S	27.3	Very low	29.8	Very low	73 Å²	73	144.8 Å²	144.8	51%	0.51	77%	0.772	S	S	.	*	S	Bend	trans	-145.3	129.3	173.1	56.7	0	0	0	0	111.5
84	S	27.9	Very low	29.5	Very low	114 Å²	114	143.8 Å²	143.8	80%	0.797	77%	0.766	S	S	*	*			trans	53.6	83.1	162.7	64.4	0	0	0	0	119.9
85	V	31.8	Very low	29.3	Very low	137 Å²	137	143.6 Å²	143.6	83%	0.83	76%	0.761	S	S	*	*				-148.1	123.8	125.4	-175.9	0	0	0	0	103.8
86	H	31.1	Very low	29.1	Very low	180 Å²	180	146.8 Å²	146.8	83%	0.833	77%	0.766	S	S	*	*			cis	-129.1	140.2	45.6	-115.8	-76.6	0	0	0	113.3
87	S	28.8	Very low	29.4	Very low	78 Å²	78	147.1 Å²	147.1	55%	0.545	77%	0.766	S	S	.	*			trans	-84.4	162.4	142.1	67	0	0	0	0	108
88	D	30.2	Very low	29.2	Very low	139 Å²	139	152.6 Å²	152.6	74%	0.743	79%	0.785	S	S	*	*			cis	-145.3	142.3	17	-72.9	-87.7	0	0	0	109.8
89	Q	30.1	Very low	29.2	Very low	199 Å²	199	150.1 Å²	150.1	93%	0.93	78%	0.777	S	S	*	*			trans	-175.3	89.3	136.7	-105.1	171	22.1	0	0	110.1	L91	Q89-L91 PolarHBondContact O-N 3.47Å
90	T	27	Very low	28.9	Very low	136 Å²	136	148.9 Å²	148.9	83%	0.834	77%	0.77	S	S	*	*			trans	-74.9	114.8	166.7	49.5	0	0	0	0	110
91	L	28.8	Very low	29	Very low	157 Å²	157	145.4 Å²	145.4	82%	0.822	77%	0.773	S	S	*	*			trans	-163.6	152.2	143.4	-111.1	161.4	0	0	0	112.5	Q89	Q89-L91 PolarHBondContact O-N 3.47Å
92	N	25.5	Very low	28.9	Very low	145 Å²	145	141.7 Å²	141.7	78%	0.775	78%	0.776	S	S	*	*			trans	-57.6	146.9	-178.4	-49.2	-48.5	0	0	0	112.6
93	V	30.4	Very low	29	Very low	140 Å²	140	139.1 Å²	139.1	85%	0.848	77%	0.768	S	S	*	*				-164.7	148.1	110.1	138.9	0	0	0	0	110.4
94	T	27.5	Very low	29.2	Very low	111 Å²	111	139 Å²	139	68%	0.681	77%	0.767	S	S	*	*			trans	-83.2	175.6	178.6	40.1	0	0	0	0	112.6
95	H	28.2	Very low	29.4	Very low	150 Å²	150	141 Å²	141	69%	0.694	76%	0.764	S	S	*	*			trans	94.1	134.4	165.4	-72.8	-95.2	0	0	0	120.7
96	H	28.3	Very low	29.5	Very low	157 Å²	157	139.5 Å²	139.5	73%	0.727	76%	0.755	S	S	*	*			trans	51.8	102.9	146.2	-60.7	-51.1	0	0	0	120.4
97	L	31.1	Very low	29.4	Very low	175 Å²	175	133.6 Å²	133.6	92%	0.916	74%	0.737	S	S	*	*				175.9	139.6	98.5	-92	152.5	0	0	0	113.6
98	Y	27.7	Very low	29.5	Very low	206 Å²	206	132 Å²	132	81%	0.808	73%	0.725	S	S	*	*			trans	-86.6	174.8	158.5	-86	-81.6	0	0	0	108.6
99	P	33	Very low	29.5	Very low	101 Å²	101	128 Å²	128	66%	0.656	71%	0.712	S	S	*	*			cis	-144.3	-165.6	20	43.9	-22.9	0	0	0	116.7
100	T	27.3	Very low	29.6	Very low	120 Å²	120	124.7 Å²	124.7	74%	0.736	70%	0.695	S	S	*	*			trans	58.3	109.3	156.9	53.9	0	0	0	0	120.3
101	T	29.7	Very low	29.8	Very low	142 Å²	142	121.4 Å²	121.4	87%	0.871	68%	0.677	S	S	*	*				175.8	92.6	123.5	26.2	0	0	0	0	111.4
102	S	26.9	Very low	30	Very low	110 Å²	110	117.1 Å²	117.1	77%	0.769	66%	0.661	S	S	*	*			trans	-136.7	65.2	-178	58.6	0	0	0	0	113.2
103	L	30.3	Very low	30.4	Very low	151 Å²	151	119.6 Å²	119.6	79%	0.791	66%	0.661	S	S	*	*	S	Bend	trans	-145.3	3.6	173	-141.3	81	0	0	0	115.5
104	S	31.5	Very low	30.6	Very low	71 Å²	71	120 Å²	120	50%	0.497	66%	0.657	S	S	.	*	S	Bend	trans	-96.1	-41.6	-174.4	48.8	0	0	0	0	114.3	T106 A107 S108	S104-T106 PolarHBondContact O-N 3.47Å; S104-A107 PolarHBondContact O-N 2.81Å; S104-S108 PolarHBondContact O-N 3.09Å
105	H	32.5	Very low	30.7	Very low	157 Å²	157	121 Å²	121	73%	0.727	65%	0.649	S	S	*	*	H	α-helix	trans	-77	-16.6	-169.6	-80.1	-89.6	0	0	0	115.5	S108	H105-S108 PolarHBondContact O-OG 3.45Å
106	T	33.4	Very low	30.8	Very low	105 Å²	105	118.3 Å²	118.3	64%	0.644	64%	0.638	S	S	*	*	H	α-helix	trans	-84.8	-30	169.6	46.5	0	0	0	0	112	S104 F110	S104-T106 PolarHBondContact O-N 3.47Å; T106-F110 PolarHBondContact O-N 2.82Å
107	A	29.8	Very low	30.9	Very low	56 Å²	56	116.5 Å²	116.5	46%	0.463	64%	0.641	S	S	.	*	H	α-helix	trans	-71.9	-34.5	178	0	0	0	0	0	112.7	S104 F110 S111	S104-A107 PolarHBondContact O-N 2.81Å; A107-F110 PolarHBondContact O-N 3.29Å; A107-S111 WeakPolarHBondContact O-CB 2.98Å; A107-S111 PolarHBondContact O-N 3.19Å
108	S	29.5	Very low	31.1	Very low	43 Å²	43	112 Å²	112	30%	0.301	62%	0.624	S	S	.	*	H	α-helix	trans	-64.6	-39.6	175.2	56.8	0	0	0	0	112.4	S104 H105 F110 S111 S112	S104-S108 PolarHBondContact O-N 3.09Å; H105-S108 PolarHBondContact O-OG 3.45Å; S108-F110 VanDerWaalsContact C-N 3.35Å; S108-F110 PolarHBondContact O-N 3Å; S108-S111 PolarHBondContact O-N 2.94Å; S108-S111 VanDerWaalsContact O-N 3.16Å; S108-S112 PolarHBondContact O-N 2.99Å; S108-S112 VanDerWaalsContact O-N 3.11Å; S108-S112 PolarHBondContact O-OG 3.04Å
109	A	31.2	Very low	31.5	Very low	56 Å²	56	105.4 Å²	105.4	46%	0.463	60%	0.602	S	S	.	*	H	α-helix	trans	-59.8	-42.6	176	0	0	0	0	0	112.4	Y113	A109-Y113 PolarHBondContact O-N 2.95Å
110	F	32	Very low	31.5	Very low	129 Å²	129	109.6 Å²	109.6	57%	0.566	61%	0.606	S	S	*	*	H	α-helix	trans	-68.4	-36.1	173.7	-96.7	-95	0	0	0	113	T106 A107 S108 S112 Y113 L114	T106-F110 PolarHBondContact O-N 2.82Å; A107-F110 PolarHBondContact O-N 3.29Å; S108-F110 VanDerWaalsContact C-N 3.35Å; S108-F110 PolarHBondContact O-N 3Å; F110-S112 VanDerWaalsContact C-N 3.31Å; F110-S112 PolarHBondContact O-N 3.41Å; F110-Y113 PolarHBondContact O-N 2.67Å; F110-L114 PolarHBondContact O-N 3.32Å
111	S	31.5	Very low	31.9	Very low	67 Å²	67	111.4 Å²	111.4	47%	0.469	61%	0.606	S	S	.	*	H	α-helix	trans	-66.5	-29.3	179.1	-172.7	0	0	0	0	113.5	A107 S108	A107-S111 WeakPolarHBondContact O-CB 2.98Å; A107-S111 PolarHBondContact O-N 3.19Å; S108-S111 PolarHBondContact O-N 2.94Å; S108-S111 VanDerWaalsContact O-N 3.16Å
112	S	32.8	Very low	32	Very low	68 Å²	68	112 Å²	112	48%	0.476	60%	0.599	S	S	.	*	H	α-helix	trans	-81.1	-35.3	175	-61.9	0	0	0	0	113.1	S108 F110	S108-S112 PolarHBondContact O-N 2.99Å; S108-S112 VanDerWaalsContact O-N 3.11Å; S108-S112 PolarHBondContact O-OG 3.04Å; F110-S112 VanDerWaalsContact C-N 3.31Å; F110-S112 PolarHBondContact O-N 3.41Å
113	Y	34.7	Very low	32.2	Very low	197 Å²	197	112.8 Å²	112.8	77%	0.773	59%	0.592	S	S	*	*	H	α-helix	trans	-70.2	-31.3	178.5	-104.9	-89.5	0	0	0	113.7	A109 F110 R115	A109-Y113 PolarHBondContact O-N 2.95Å; F110-Y113 PolarHBondContact O-N 2.67Å; Y113-R115 PolarHBondContact O-N 3.46Å
114	L	34.2	Very low	32.5	Very low	149 Å²	149	111.5 Å²	111.5	78%	0.78	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.1	12.6	-180	-73.3	168.7	0	0	0	114.6	F110	F110-L114 PolarHBondContact O-N 3.32Å
115	R	30.1	Very low	32.6	Very low	132 Å²	132	115.7 Å²	115.7	50%	0.498	60%	0.602	S	S	.	*	T	Hydrogen-bonded Turn	trans	-108.9	11.2	-174.8	-140.9	-175.5	-64.4	170	3.5	114.8	E2 Y113 P117	E2-R115 IonicContact OE2-CZ 3.51Å; E2-R115 VanDerWaalsContact OE2-CZ 3.3Å; E2-R115 IonicContact OE2-NH1 2.88Å; E2-R115 PolarHBondContact OE2-NH1 2.88Å; E2-R115 IonicContact OE2-NH2 3.13Å; E2-R115 PolarHBondContact OE2-NH2 2.94Å; Y113-R115 PolarHBondContact O-N 3.46Å; R115-P117 WeakPolarHBondContact O-CD 3.41Å
116	I	30.2	Very low	32.6	Very low	93 Å²	93	113.5 Å²	113.5	48%	0.477	60%	0.601	S	S	.	*			trans	-108.8	87.1	-174.6	-50.7	177.4	0	0	0	112.2	I119	I116-I119 HydrophobicContact CD1-CD1 4.13Å; I116-I119 HydrophobicContact CG1-CD1 4.07Å; I116-I119 HydrophobicContact CG2-CB 3.8Å; I116-I119 HydrophobicContact CG2-CD1 4.32Å; I116-I119 HydrophobicContact CG2-CG1 4.08Å
117	P	30.5	Very low	32.5	Very low	119 Å²	119	113.3 Å²	113.3	77%	0.773	60%	0.599	S	S	*	*	S	Bend	trans	-102.8	-8.6	143.1	-16.7	33.6	0	0	0	114.2	R115	R115-P117 WeakPolarHBondContact O-CD 3.41Å
118	S	35.4	Very low	32.5	Very low	81 Å²	81	115.7 Å²	115.7	57%	0.566	62%	0.618	S	S	*	*	S	Bend	trans	-103.2	-13.2	-167.8	54.3	0	0	0	0	116.6
119	I	35.7	Very low	32.5	Very low	67 Å²	67	117.8 Å²	117.8	34%	0.344	63%	0.633	S	S	.	*	S	Bend	trans	-87.8	-23.3	-177	-56	179.2	0	0	0	111.8	I116 E121 Q122 M123	I116-I119 HydrophobicContact CD1-CD1 4.13Å; I116-I119 HydrophobicContact CG1-CD1 4.07Å; I116-I119 HydrophobicContact CG2-CB 3.8Å; I116-I119 HydrophobicContact CG2-CD1 4.32Å; I116-I119 HydrophobicContact CG2-CG1 4.08Å; I119-E121 PolarHBondContact O-N 2.84Å; I119-Q122 PolarHBondContact O-N 3.19Å; I119-M123 HydrophobicContact CG2-CE 3.91Å; I119-M123 HydrophobicContact CG2-CG 4Å; I119-M123 HydrophobicContact CG2-SD 3.92Å; I119-M123 PolarHBondContact O-N 3.28Å; I119-M123 VanDerWaalsContact O-N 3.16Å
120	Y	33.3	Very low	32.3	Very low	188 Å²	188	120.4 Å²	120.4	74%	0.737	64%	0.643	S	S	*	*	H	α-helix	trans	-63.7	-25.6	178.4	-145.6	-83	0	0	0	112.7	Q122	Y120-Q122 VanDerWaalsContact C-N 3.33Å
121	E	34.9	Very low	32.3	Very low	159 Å²	159	120.7 Å²	120.7	74%	0.743	65%	0.646	S	S	*	*	H	α-helix	trans	-82.7	-9.7	177.2	-135.7	151.4	-133.2	0	0	112.6	I119	I119-E121 PolarHBondContact O-N 2.84Å
122	Q	32.1	Very low	32.3	Very low	155 Å²	155	123.9 Å²	123.9	72%	0.724	67%	0.669	S	S	*	*	H	α-helix	trans	-113.5	-12.5	-178.2	-156.1	175	22.4	0	0	113.9	I119 Y120	I119-Q122 PolarHBondContact O-N 3.19Å; Y120-Q122 VanDerWaalsContact C-N 3.33Å
123	M	31.4	Very low	32.3	Very low	125 Å²	125	123.2 Å²	123.2	62%	0.616	67%	0.667	S	S	*	*	H	α-helix	trans	-92.1	-19	177.3	-76.7	-175.4	161.3	0	0	114.3	I119 V127	I119-M123 HydrophobicContact CG2-CE 3.91Å; I119-M123 HydrophobicContact CG2-CG 4Å; I119-M123 HydrophobicContact CG2-SD 3.92Å; I119-M123 PolarHBondContact O-N 3.28Å; I119-M123 VanDerWaalsContact O-N 3.16Å; M123-V127 WeakPolarHBondContact O-CG2 3.25Å
124	N	36.1	Very low	32.3	Very low	125 Å²	125	116.6 Å²	116.6	67%	0.668	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.8	-22	-166.6	-136.8	44.1	0	0	0	114.3
125	D	33.5	Very low	32.1	Very low	158 Å²	158	120 Å²	120	85%	0.845	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.5	-4.3	-177.6	-73.9	-14.8	0	0	0	114
126	T	32.1	Very low	32	Very low	112 Å²	112	117.3 Å²	117.3	69%	0.687	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.6	-9.5	-167.6	-22.7	0	0	0	0	114.8
127	V	31.2	Very low	32	Very low	101 Å²	101	118.9 Å²	118.9	61%	0.612	65%	0.653	S	S	*	*			trans	-113.5	29.3	-169.9	-162.5	0	0	0	0	112.4	M123 S129	M123-V127 WeakPolarHBondContact O-CG2 3.25Å; V127-S129 PolarHBondContact O-N 3.11Å; V127-S129 VanDerWaalsContact O-N 3.13Å
128	A	30.5	Very low	32.1	Very low	105 Å²	105	117.4 Å²	117.4	87%	0.868	65%	0.645	S	S	*	*	S	Bend	trans	-72.1	4.5	174	0	0	0	0	0	114.1
129	S	28.5	Very low	31.8	Very low	87 Å²	87	119.6 Å²	119.6	61%	0.608	65%	0.65	S	S	*	*	S	Bend	trans	-155.4	151.4	174	64.9	0	0	0	0	111.6	V127	V127-S129 PolarHBondContact O-N 3.11Å; V127-S129 VanDerWaalsContact O-N 3.13Å
130	T	27.9	Very low	31.7	Very low	111 Å²	111	123.9 Å²	123.9	68%	0.681	67%	0.668	S	S	*	*	S	Bend	trans	77.9	158.2	-177.5	75.8	0	0	0	0	117.3
131	H	31.9	Very low	31.6	Very low	136 Å²	136	126 Å²	126	63%	0.63	68%	0.675	S	S	*	*			trans	66.3	45.2	175.9	-59.1	-66.5	0	0	0	120.1	A133 D134	H131-A133 VanDerWaalsContact C-N 3.25Å; H131-D134 IonicContact CE1-OD2 3.55Å; H131-D134 PolarHBondContact CE1-OD2 3.39Å; H131-D134 IonicContact ND1-OD2 2.82Å; H131-D134 PolarHBondContact ND1-OD2 2.98Å
132	S	31.3	Very low	31.4	Very low	134 Å²	134	123 Å²	123	94%	0.937	67%	0.671	S	S	*	*	S	Bend	trans	-80.2	-0.2	153.7	56.6	0	0	0	0	114.1
133	A	33.2	Very low	31.3	Very low	54 Å²	54	119 Å²	119	45%	0.446	66%	0.661	S	S	.	*	S	Bend	trans	-116.5	-19.4	-163.1	0	0	0	0	0	117.1	H131 S136	H131-A133 VanDerWaalsContact C-N 3.25Å; A133-S136 PolarHBondContact O-OG 2.96Å; A133-S136 VanDerWaalsContact O-OG 3.08Å
134	D	33.9	Very low	31.3	Very low	58 Å²	58	118.8 Å²	118.8	31%	0.31	67%	0.67	S	S	.	*	S	Bend	trans	-104.2	-13.7	-165.9	-63.7	-63.1	0	0	0	115.7	H131 S136 K137 S138	H131-D134 IonicContact CE1-OD2 3.55Å; H131-D134 PolarHBondContact CE1-OD2 3.39Å; H131-D134 IonicContact ND1-OD2 2.82Å; H131-D134 PolarHBondContact ND1-OD2 2.98Å; D134-S136 PolarHBondContact O-N 3.1Å; D134-K137 PolarHBondContact O-N 3.12Å; D134-K137 WeakPolarHBondContact OD1-CD 3.41Å; D134-K137 IonicContact OD1-NZ 3.98Å; D134-K137 PolarHBondContact OD1-NZ 3.37Å; D134-S138 PolarHBondContact O-N 2.67Å
135	W	30.7	Very low	31	Very low	220 Å²	220	120.6 Å²	120.6	83%	0.833	67%	0.672	S	S	*	*	H	α-helix	trans	-61.7	-31.1	173.4	-98.4	63.3	0	0	0	112.6
136	S	28.5	Very low	30.9	Very low	75 Å²	75	120.6 Å²	120.6	52%	0.524	67%	0.672	S	S	.	*	H	α-helix	trans	-66.3	-33.1	172.7	59.5	0	0	0	0	113.2	A133 D134	A133-S136 PolarHBondContact O-OG 2.96Å; A133-S136 VanDerWaalsContact O-OG 3.08Å; D134-S136 PolarHBondContact O-N 3.1Å
137	K	29.4	Very low	30.7	Very low	127 Å²	127	121.8 Å²	121.8	55%	0.552	68%	0.679	S	S	*	*	H	α-helix	trans	-78.8	-29.8	-179.9	-62.4	178.8	-165.2	152.2	0	112.9	D134 H140	D134-K137 PolarHBondContact O-N 3.12Å; D134-K137 WeakPolarHBondContact OD1-CD 3.41Å; D134-K137 IonicContact OD1-NZ 3.98Å; D134-K137 PolarHBondContact OD1-NZ 3.37Å; K137-H140 PolarHBondContact O-N 3.34Å
138	S	32.2	Very low	30.7	Very low	88 Å²	88	122.3 Å²	122.3	62%	0.615	69%	0.685	S	S	*	*	H	α-helix	trans	-67.9	-48.2	178.4	-163.7	0	0	0	0	111.4	D134 H140 R141	D134-S138 PolarHBondContact O-N 2.67Å; S138-H140 PolarHBondContact O-N 3.36Å; S138-H140 VanDerWaalsContact O-N 3.17Å; S138-R141 PolarHBondContact O-N 2.85Å
139	L	30.7	Very low	31	Very low	126 Å²	126	125.9 Å²	125.9	66%	0.66	68%	0.683	S	S	*	*	H	α-helix	trans	-58.5	-27.3	175.1	-87.4	159	0	0	0	113.4	R141 S142	L139-R141 VanDerWaalsContact C-N 3.3Å; L139-R141 PolarHBondContact O-N 3.28Å; L139-S142 PolarHBondContact O-OG 3.44Å
140	H	32.7	Very low	31.5	Very low	158 Å²	158	127.1 Å²	127.1	73%	0.731	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78	-3.3	176.5	-101.7	-66.3	0	0	0	115.3	K137 S138	K137-H140 PolarHBondContact O-N 3.34Å; S138-H140 PolarHBondContact O-N 3.36Å; S138-H140 VanDerWaalsContact O-N 3.17Å
141	R	31.4	Very low	32.4	Very low	233 Å²	233	127.3 Å²	127.3	88%	0.879	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.5	-11.1	177	-77.7	-169.3	169.5	-159.6	-2.8	114.9	S138 L139 S143	S138-R141 PolarHBondContact O-N 2.85Å; L139-R141 VanDerWaalsContact C-N 3.3Å; L139-R141 PolarHBondContact O-N 3.28Å; R141-S143 PolarHBondContact O-N 2.98Å
142	S	30	Very low	34.1	Very low	95 Å²	95	123.1 Å²	123.1	66%	0.664	67%	0.674	S	S	*	*			trans	-96.5	58.6	178.8	57.6	0	0	0	0	112.3	L139	L139-S142 PolarHBondContact O-OG 3.44Å
143	S	31.2	Very low	35.7	Very low	72 Å²	72	123.2 Å²	123.2	50%	0.503	66%	0.66	S	S	.	*			trans	-134.7	107.2	178.9	61.6	0	0	0	0	112.5	R141 F145	R141-S143 PolarHBondContact O-N 2.98Å; S143-F145 PolarHBondContact O-N 3.14Å
144	C	30.5	Very low	37.4	Very low	119 Å²	119	127.9 Å²	127.9	80%	0.804	67%	0.673	S	S	*	*			trans	-74.3	29.8	166	-64.5	0	0	0	0	112.8
145	F	30	Very low	38.8	Very low	163 Å²	163	128.7 Å²	128.7	72%	0.715	68%	0.677	S	S	*	*			trans	-98.3	111.9	171.3	-84.3	-88.1	0	0	0	108.7	S143 T147	S143-F145 PolarHBondContact O-N 3.14Å; F145-T147 PolarHBondContact O-N 3.45Å
146	N	31.7	Very low	40.2	Very low	158 Å²	158	124 Å²	124	85%	0.845	66%	0.664	S	S	*	*	P	Polyproline II helix	trans	-58.4	132.8	159.6	-73.9	-26.9	0	0	0	108.3	P148	N146-P148 VanDerWaalsContact O-CD 3.23Å; N146-P148 WeakPolarHBondContact O-CD 3.49Å
147	T	27.7	Very low	42	Very low	138 Å²	138	125.9 Å²	125.9	85%	0.847	66%	0.663	S	S	*	*	P	Polyproline II helix	trans	-62.6	125	-176.2	49	0	0	0	0	113.3	F145	F145-T147 PolarHBondContact O-N 3.45Å
148	P	30.7	Very low	43.9	Very low	111 Å²	111	126.8 Å²	126.8	72%	0.721	67%	0.667	S	S	*	*	P	Polyproline II helix	trans	-97	166.7	151.5	4	19.5	0	0	0	109.8	N146	N146-P148 VanDerWaalsContact O-CD 3.23Å; N146-P148 WeakPolarHBondContact O-CD 3.49Å
149	Q	38	Very low	44.8	Very low	181 Å²	181	126.2 Å²	126.2	85%	0.846	66%	0.66	S	S	*	*	S	Bend	trans	-71.7	149	177.7	-66	125	-57.3	0	0	112.7
150	S	38.9	Very low	46.2	Very low	113 Å²	113	125.2 Å²	125.2	79%	0.79	65%	0.652	S	S	*	*			trans	36.5	90.1	159.5	57.3	0	0	0	0	116.9
151	L	46.7	Very low	47.5	Very low	115 Å²	115	120.2 Å²	120.2	60%	0.602	64%	0.638	S	S	*	*			trans	-54.6	141.2	158.1	-129.2	77.5	0	0	0	109.5	D155	L151-D155 HydrophobicContact CB-CB 4.41Å; L151-D155 HydrophobicContact CD2-CB 3.6Å; L151-D155 HydrophobicContact CG-CB 3.59Å
152	S	66.6	Low	48.6	Very low	48 Å²	48	112.3 Å²	112.3	34%	0.336	62%	0.615	S	S	.	*			trans	-72.3	162.4	179.8	75.4	0	0	0	0	112	E154 D155 Q156	S152-E154 PolarHBondContact O-N 2.89Å; S152-E154 PolarHBondContact OG-N 3.38Å; S152-D155 VanDerWaalsContact CB-OD2 3.24Å; S152-D155 WeakPolarHBondContact CB-OD2 3.3Å; S152-D155 PolarHBondContact N-OD2 2.92Å; S152-D155 PolarHBondContact O-N 3.08Å; S152-D155 PolarHBondContact OG-N 3.03Å; S152-D155 PolarHBondContact OG-OD2 3.42Å; S152-Q156 PolarHBondContact O-N 2.87Å; S152-Q156 VanDerWaalsContact O-N 3.15Å
153	E	65.3	Low	49.9	Very low	135 Å²	135	111.7 Å²	111.7	63%	0.631	61%	0.607	S	S	*	*	H	α-helix	trans	-64.1	-23.7	173.8	-144.6	-170.9	-109.9	0	0	111.7	K157	E153-K157 VanDerWaalsContact O-CD 3.24Å; E153-K157 WeakPolarHBondContact O-CD 3.27Å; E153-K157 WeakPolarHBondContact O-CE 3.2Å; E153-K157 WeakPolarHBondContact O-CG 3.18Å; E153-K157 PolarHBondContact O-N 3.27Å; E153-K157 WeakPolarHBondContact OE2-CE 3.38Å; E153-K157 IonicContact OE2-NZ 3.61Å; E153-K157 PolarHBondContact OE2-NZ 3.16Å
154	E	68	Low	50.7	Low	153 Å²	153	115.3 Å²	115.3	72%	0.715	61%	0.61	S	S	*	*	H	α-helix	trans	-76.2	-40.2	173.4	-60.9	-164.7	127.1	0	0	112.2	S152 Q156 K157 F158	S152-E154 PolarHBondContact O-N 2.89Å; S152-E154 PolarHBondContact OG-N 3.38Å; E154-Q156 VanDerWaalsContact C-N 3.3Å; E154-Q156 PolarHBondContact O-N 3.33Å; E154-K157 PolarHBondContact O-N 2.81Å; E154-K157 VanDerWaalsContact O-N 3.17Å; E154-F158 WeakPolarHBondContact O-CB 3.5Å; E154-F158 PolarHBondContact O-N 2.99Å
155	D	64	Low	51.7	Low	74 Å²	74	112.6 Å²	112.6	40%	0.396	60%	0.596	S	S	.	*	H	α-helix	trans	-62.8	-37.1	175.2	-62.5	-58.7	0	0	0	112	L151 S152 T159	L151-D155 HydrophobicContact CB-CB 4.41Å; L151-D155 HydrophobicContact CD2-CB 3.6Å; L151-D155 HydrophobicContact CG-CB 3.59Å; S152-D155 VanDerWaalsContact CB-OD2 3.24Å; S152-D155 WeakPolarHBondContact CB-OD2 3.3Å; S152-D155 PolarHBondContact N-OD2 2.92Å; S152-D155 PolarHBondContact O-N 3.08Å; S152-D155 PolarHBondContact OG-N 3.03Å; S152-D155 PolarHBondContact OG-OD2 3.42Å; D155-T159 VanDerWaalsContact O-CB 3.3Å; D155-T159 WeakPolarHBondContact O-CB 3.43Å; D155-T159 PolarHBondContact O-N 3.36Å; D155-T159 PolarHBondContact O-OG1 2.97Å
156	Q	60.9	Low	52.5	Low	122 Å²	122	109.1 Å²	109.1	57%	0.57	59%	0.588	S	S	*	*	H	α-helix	trans	-64.9	-45.5	172.9	-69.3	-169.3	5	0	0	111.3	S152 E154 T159 Q160	S152-Q156 PolarHBondContact O-N 2.87Å; S152-Q156 VanDerWaalsContact O-N 3.15Å; E154-Q156 VanDerWaalsContact C-N 3.3Å; E154-Q156 PolarHBondContact O-N 3.33Å; Q156-T159 PolarHBondContact O-N 3.41Å; Q156-Q160 WeakPolarHBondContact O-CB 3.42Å; Q156-Q160 PolarHBondContact O-N 3.3Å
157	K	66.2	Low	53.1	Low	114 Å²	114	106.9 Å²	106.9	50%	0.496	58%	0.575	S	S	.	*	H	α-helix	trans	-62.5	-42.2	176.3	-71.4	162.6	-165.8	165.9	0	111.8	E153 E154 Q160 A161	E153-K157 VanDerWaalsContact O-CD 3.24Å; E153-K157 WeakPolarHBondContact O-CD 3.27Å; E153-K157 WeakPolarHBondContact O-CE 3.2Å; E153-K157 WeakPolarHBondContact O-CG 3.18Å; E153-K157 PolarHBondContact O-N 3.27Å; E153-K157 WeakPolarHBondContact OE2-CE 3.38Å; E153-K157 IonicContact OE2-NZ 3.61Å; E153-K157 PolarHBondContact OE2-NZ 3.16Å; E154-K157 PolarHBondContact O-N 2.81Å; E154-K157 VanDerWaalsContact O-N 3.17Å; K157-Q160 PolarHBondContact O-N 2.98Å; K157-A161 VanDerWaalsContact O-CB 3.24Å; K157-A161 WeakPolarHBondContact O-CB 3.48Å; K157-A161 PolarHBondContact O-N 3.05Å
158	F	67.7	Low	53.7	Low	147 Å²	147	103.3 Å²	103.3	65%	0.645	56%	0.56	S	S	*	*	H	α-helix	trans	-64.3	-43.9	176.8	-178.7	-98.4	0	0	0	111.9	E154 A161 T162	E154-F158 WeakPolarHBondContact O-CB 3.5Å; E154-F158 PolarHBondContact O-N 2.99Å; F158-A161 PolarHBondContact O-N 2.93Å; F158-T162 WeakPolarHBondContact O-CB 3.41Å; F158-T162 PolarHBondContact O-N 3.2Å; F158-T162 PolarHBondContact O-OG1 3.23Å
159	T	52.9	Low	54.1	Low	75 Å²	75	100.8 Å²	100.8	46%	0.46	55%	0.548	S	S	.	.	H	α-helix	trans	-64	-45.9	176.6	-58.1	0	0	0	0	111	D155 Q156 A161 T162 V163	D155-T159 VanDerWaalsContact O-CB 3.3Å; D155-T159 WeakPolarHBondContact O-CB 3.43Å; D155-T159 PolarHBondContact O-N 3.36Å; D155-T159 PolarHBondContact O-OG1 2.97Å; Q156-T159 PolarHBondContact O-N 3.41Å; T159-A161 PolarHBondContact O-N 3.32Å; T159-T162 PolarHBondContact O-N 2.99Å; T159-V163 WeakPolarHBondContact O-CG2 3.46Å; T159-V163 PolarHBondContact O-N 2.97Å
160	Q	58.1	Low	54	Low	106 Å²	106	95.2 Å²	95.2	50%	0.495	53%	0.529	S	S	.	.	H	α-helix	trans	-65.3	-37.5	177.4	-166.2	-176.9	76.7	0	0	112	Q156 K157 R164	Q156-Q160 WeakPolarHBondContact O-CB 3.42Å; Q156-Q160 PolarHBondContact O-N 3.3Å; K157-Q160 PolarHBondContact O-N 2.98Å; Q160-R164 WeakPolarHBondContact O-CB 3.47Å; Q160-R164 WeakPolarHBondContact O-CG 3.31Å; Q160-R164 PolarHBondContact O-N 3.3Å
161	A	61.1	Low	53.8	Low	53 Å²	53	91.5 Å²	91.5	44%	0.438	51%	0.505	S	S	.	.	H	α-helix	trans	-65.3	-41.4	173.1	0	0	0	0	0	112	K157 F158 T159 R164 A165	K157-A161 VanDerWaalsContact O-CB 3.24Å; K157-A161 WeakPolarHBondContact O-CB 3.48Å; K157-A161 PolarHBondContact O-N 3.05Å; F158-A161 PolarHBondContact O-N 2.93Å; T159-A161 PolarHBondContact O-N 3.32Å; A161-R164 PolarHBondContact O-N 2.68Å; A161-A165 WeakPolarHBondContact O-CB 3.41Å; A161-A165 PolarHBondContact O-N 2.88Å
162	T	54.1	Low	53.3	Low	66 Å²	66	96 Å²	96	41%	0.405	52%	0.515	S	S	.	.	H	α-helix	trans	-63.9	-44.9	177.2	-59.9	0	0	0	0	111.5	F158 T159 A165 V166	F158-T162 WeakPolarHBondContact O-CB 3.41Å; F158-T162 PolarHBondContact O-N 3.2Å; F158-T162 PolarHBondContact O-OG1 3.23Å; T159-T162 PolarHBondContact O-N 2.99Å; T162-A165 PolarHBondContact O-N 3.19Å; T162-V166 WeakPolarHBondContact O-CG2 3.3Å; T162-V166 PolarHBondContact O-N 3.45Å
163	V	57	Low	51.9	Low	82 Å²	82	101.4 Å²	101.4	50%	0.497	54%	0.535	S	S	.	.	H	α-helix	trans	-62.8	-42.5	174.7	172.3	0	0	0	0	111.5	T159 A165 V166 L167	T159-V163 WeakPolarHBondContact O-CG2 3.46Å; T159-V163 PolarHBondContact O-N 2.97Å; V163-A165 VanDerWaalsContact C-N 3.34Å; V163-A165 PolarHBondContact O-N 3.1Å; V163-V166 PolarHBondContact O-N 2.97Å; V163-L167 HydrophobicContact CG1-CD1 3.96Å; V163-L167 WeakPolarHBondContact O-CB 3.33Å; V163-L167 WeakPolarHBondContact O-CG 3.48Å; V163-L167 PolarHBondContact O-N 2.84Å
164	R	48.5	Very low	50.3	Low	149 Å²	149	96.5 Å²	96.5	56%	0.562	52%	0.515	S	S	*	.	H	α-helix	trans	-60.8	-40.2	173.4	-78.9	-179.9	176.9	127.1	2	112.4	Q160 A161 L167 A168	Q160-R164 WeakPolarHBondContact O-CB 3.47Å; Q160-R164 WeakPolarHBondContact O-CG 3.31Å; Q160-R164 PolarHBondContact O-N 3.3Å; A161-R164 PolarHBondContact O-N 2.68Å; R164-L167 PolarHBondContact O-N 2.89Å; R164-A168 VanDerWaalsContact O-CB 3.23Å; R164-A168 WeakPolarHBondContact O-CB 3.34Å; R164-A168 PolarHBondContact O-N 2.92Å
165	A	52.1	Low	48.5	Very low	61 Å²	61	97.7 Å²	97.7	50%	0.504	51%	0.513	S	S	.	.	H	α-helix	trans	-66.4	-41.8	178.8	0	0	0	0	0	112.3	A161 T162 V163 A168 A169	A161-A165 WeakPolarHBondContact O-CB 3.41Å; A161-A165 PolarHBondContact O-N 2.88Å; T162-A165 PolarHBondContact O-N 3.19Å; V163-A165 VanDerWaalsContact C-N 3.34Å; V163-A165 PolarHBondContact O-N 3.1Å; A165-A168 PolarHBondContact O-N 3.28Å; A165-A169 WeakPolarHBondContact O-CB 3.45Å; A165-A169 PolarHBondContact O-N 3.25Å
166	V	45.8	Very low	47.2	Very low	90 Å²	90	98.5 Å²	98.5	55%	0.545	52%	0.521	S	S	.	.	H	α-helix	trans	-65.6	-43.1	175.3	173.7	0	0	0	0	111.3	T162 V163 A169 S170	T162-V166 WeakPolarHBondContact O-CG2 3.3Å; T162-V166 PolarHBondContact O-N 3.45Å; V163-V166 PolarHBondContact O-N 2.97Å; V166-A169 PolarHBondContact O-N 2.8Å; V166-S170 WeakPolarHBondContact O-CB 3.4Å; V166-S170 PolarHBondContact O-N 3.06Å
167	L	44.4	Very low	45.9	Very low	111 Å²	111	95.1 Å²	95.1	58%	0.581	51%	0.514	S	S	*	.	H	α-helix	trans	-63.4	-42.5	174.5	-76.6	168.2	0	0	0	112.1	V163 R164 S170 A171	V163-L167 HydrophobicContact CG1-CD1 3.96Å; V163-L167 WeakPolarHBondContact O-CB 3.33Å; V163-L167 WeakPolarHBondContact O-CG 3.48Å; V163-L167 PolarHBondContact O-N 2.84Å; R164-L167 PolarHBondContact O-N 2.89Å; L167-S170 PolarHBondContact O-N 2.81Å; L167-A171 VanDerWaalsContact O-CB 3.3Å; L167-A171 WeakPolarHBondContact O-CB 3.27Å; L167-A171 PolarHBondContact O-N 2.98Å
168	A	41.2	Very low	44.2	Very low	63 Å²	63	95.2 Å²	95.2	52%	0.521	52%	0.519	S	S	.	.	H	α-helix	trans	-65.9	-37.5	177.7	0	0	0	0	0	112.4	R164 A165 R172	R164-A168 VanDerWaalsContact O-CB 3.23Å; R164-A168 WeakPolarHBondContact O-CB 3.34Å; R164-A168 PolarHBondContact O-N 2.92Å; A165-A168 PolarHBondContact O-N 3.28Å; A168-R172 WeakPolarHBondContact O-CB 3.41Å; A168-R172 PolarHBondContact O-N 3.05Å
169	A	38.5	Very low	42.7	Very low	58 Å²	58	93.9 Å²	93.9	48%	0.479	52%	0.523	S	S	.	.	H	α-helix	trans	-63.1	-49.9	172.7	0	0	0	0	0	111.4	A165 V166 A171 R172 E173	A165-A169 WeakPolarHBondContact O-CB 3.45Å; A165-A169 PolarHBondContact O-N 3.25Å; V166-A169 PolarHBondContact O-N 2.8Å; A169-A171 PolarHBondContact O-N 2.86Å; A169-R172 WeakPolarHBondContact O-CB 3.49Å; A169-R172 PolarHBondContact O-N 3.11Å; A169-R172 VanDerWaalsContact O-N 3.1Å; A169-E173 PolarHBondContact O-N 2.69Å
170	S	35.3	Very low	41.9	Very low	64 Å²	64	96.3 Å²	96.3	45%	0.448	53%	0.533	S	S	.	.	H	α-helix	trans	-60.1	-41.3	177.5	-174.8	0	0	0	0	112.7	V166 L167 R172 E173 S174	V166-S170 WeakPolarHBondContact O-CB 3.4Å; V166-S170 PolarHBondContact O-N 3.06Å; L167-S170 PolarHBondContact O-N 2.81Å; S170-R172 VanDerWaalsContact C-N 3.32Å; S170-R172 PolarHBondContact O-N 2.79Å; S170-E173 PolarHBondContact O-N 3.27Å; S170-S174 PolarHBondContact O-N 2.69Å; S170-S174 PolarHBondContact O-OG 2.97Å
171	A	35.5	Very low	40.7	Very low	35 Å²	35	95.1 Å²	95.1	29%	0.289	53%	0.53	S	S	.	.	H	α-helix	trans	-65.7	-32.6	175.1	0	0	0	0	0	112.9	L167 A169 E173 S174	L167-A171 VanDerWaalsContact O-CB 3.3Å; L167-A171 WeakPolarHBondContact O-CB 3.27Å; L167-A171 PolarHBondContact O-N 2.98Å; A169-A171 PolarHBondContact O-N 2.86Å; A171-E173 VanDerWaalsContact C-N 3.27Å; A171-E173 PolarHBondContact O-N 3.04Å; A171-S174 WeakPolarHBondContact CA-OG 3.34Å; A171-S174 CarbonylContact O-C 3.53Å; A171-S174 PolarHBondContact O-N 3.46Å
172	R	35.9	Very low	39.3	Very low	210 Å²	210	96.6 Å²	96.6	79%	0.792	54%	0.535	S	S	*	.	H	α-helix	trans	-69.2	-25.5	-180	-158.5	173	-168.2	174.5	3.5	113	A168 A169 S170	A168-R172 WeakPolarHBondContact O-CB 3.41Å; A168-R172 PolarHBondContact O-N 3.05Å; A169-R172 WeakPolarHBondContact O-CB 3.49Å; A169-R172 PolarHBondContact O-N 3.11Å; A169-R172 VanDerWaalsContact O-N 3.1Å; S170-R172 VanDerWaalsContact C-N 3.32Å; S170-R172 PolarHBondContact O-N 2.79Å
173	E	37.9	Very low	38.4	Very low	162 Å²	162	100.2 Å²	100.2	76%	0.757	55%	0.551	S	S	*	*	H	α-helix	trans	-90.3	-18.1	173.9	-63.8	-177.8	162.2	0	0	112.8	A169 S170 A171	A169-E173 PolarHBondContact O-N 2.69Å; S170-E173 PolarHBondContact O-N 3.27Å; A171-E173 VanDerWaalsContact C-N 3.27Å; A171-E173 PolarHBondContact O-N 3.04Å
174	S	31.6	Very low	37.6	Very low	32 Å²	32	102.8 Å²	102.8	22%	0.224	56%	0.562	C	S	.	*			trans	-113.2	68.2	-176.6	54.7	0	0	0	0	113.2	S170 A171 T176 A177	S170-S174 PolarHBondContact O-N 2.69Å; S170-S174 PolarHBondContact O-OG 2.97Å; A171-S174 WeakPolarHBondContact CA-OG 3.34Å; A171-S174 CarbonylContact O-C 3.53Å; A171-S174 PolarHBondContact O-N 3.46Å; S174-T176 PolarHBondContact O-N 2.65Å; S174-A177 PolarHBondContact O-N 2.96Å; S174-A177 VanDerWaalsContact O-N 3.13Å
175	R	30.1	Very low	37	Very low	178 Å²	178	103.2 Å²	103.2	67%	0.672	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.9	-6.9	-176.3	-83.9	-161.1	-174.9	173.9	13	117.3	H253	R175-H253 VanDerWaalsContact CZ-CD2 3.45Å; R175-H253 PolarHBondContact NH1-CD2 3.14Å; R175-H253 PolarHBondContact NH1-NE2 3.43Å; R175-H253 PolarHBondContact NH2-CD2 2.75Å; R175-H253 PolarHBondContact NH2-NE2 3.42Å
176	T	36.1	Very low	36.2	Very low	90 Å²	90	107.5 Å²	107.5	55%	0.552	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.6	5.5	179.8	53.7	0	0	0	0	114.6	S174	S174-T176 PolarHBondContact O-N 2.65Å
177	A	33.6	Very low	35.6	Very low	51 Å²	51	108.5 Å²	108.5	42%	0.421	58%	0.577	S	S	.	*	S	Bend	trans	-97.4	-6.6	-175.5	0	0	0	0	0	115.2	S174	S174-A177 PolarHBondContact O-N 2.96Å; S174-A177 VanDerWaalsContact O-N 3.13Å
178	L	31	Very low	35.1	Very low	116 Å²	116	110.7 Å²	110.7	61%	0.607	59%	0.589	S	S	*	*	S	Bend	trans	-89.4	-1.1	-168.9	-95.9	161.1	0	0	0	115.5
179	T	36.9	Very low	34.7	Very low	120 Å²	120	115.1 Å²	115.1	74%	0.736	60%	0.599	S	S	*	*	S	Bend	trans	-92.6	-17.5	-175.2	47.3	0	0	0	0	115.3
180	D	36.2	Very low	34.4	Very low	125 Å²	125	117 Å²	117	67%	0.668	61%	0.609	S	S	*	*	S	Bend	trans	-109	8.9	-174.2	-76.3	-63.6	0	0	0	114.1
181	L	31.7	Very low	34.5	Very low	82 Å²	82	119.8 Å²	119.8	43%	0.429	62%	0.619	S	S	.	*	S	Bend	trans	-77.8	127.6	172	-87.6	166.4	0	0	0	110.8	L183 F186	L181-L183 PolarHBondContact O-N 3.2Å; L181-F186 HydrophobicContact CD1-CE2 4.36Å
182	P	32.8	Very low	34.5	Very low	84 Å²	84	122.8 Å²	122.8	55%	0.545	63%	0.629	S	S	.	*			trans	-61.4	133.7	174.5	-21.2	32.4	0	0	0	111.3	D184 F185	P182-D184 PolarHBondContact O-N 3.17Å; P182-D184 VanDerWaalsContact O-N 3.12Å; P182-F185 WeakPolarHBondContact O-CB 3.45Å; P182-F185 PolarHBondContact O-N 3.22Å
183	L	34.5	Very low	34.5	Very low	142 Å²	142	118.7 Å²	118.7	74%	0.743	62%	0.623	S	S	*	*	G	3₁₀ helix	trans	-56	-31.3	178	-90.7	84.1	0	0	0	112.6	L181 F185 F186	L181-L183 PolarHBondContact O-N 3.2Å; L183-F185 PolarHBondContact O-N 2.98Å; L183-F185 VanDerWaalsContact O-N 3.07Å; L183-F186 PolarHBondContact O-N 3.41Å; L183-F186 VanDerWaalsContact O-N 3.09Å
184	D	40.2	Very low	34.4	Very low	136 Å²	136	117.5 Å²	117.5	73%	0.727	62%	0.621	S	S	*	*	G	3₁₀ helix	trans	-59.1	-19	177.7	-59.1	-35.9	0	0	0	113.5	P182 F186	P182-D184 PolarHBondContact O-N 3.17Å; P182-D184 VanDerWaalsContact O-N 3.12Å; D184-F186 VanDerWaalsContact C-N 3.27Å; D184-F186 PolarHBondContact O-N 2.89Å
185	F	35.4	Very low	34.6	Very low	157 Å²	157	124 Å²	124	69%	0.689	65%	0.646	S	S	*	*	G	3₁₀ helix	trans	-71	-19.9	176.9	-164.3	-97.6	0	0	0	113.6	P182 L183	P182-F185 WeakPolarHBondContact O-CB 3.45Å; P182-F185 PolarHBondContact O-N 3.22Å; L183-F185 PolarHBondContact O-N 2.98Å; L183-F185 VanDerWaalsContact O-N 3.07Å
186	F	35.3	Very low	34.8	Very low	151 Å²	151	121.6 Å²	121.6	66%	0.662	65%	0.646	S	S	*	*	G	3₁₀ helix	trans	-101.4	-5.7	-178.6	-75	-85.4	0	0	0	114.1	L181 L183 D184 N188	L181-F186 HydrophobicContact CD1-CE2 4.36Å; L183-F186 PolarHBondContact O-N 3.41Å; L183-F186 VanDerWaalsContact O-N 3.09Å; D184-F186 VanDerWaalsContact C-N 3.27Å; D184-F186 PolarHBondContact O-N 2.89Å; F186-N188 PolarHBondContact O-N 2.78Å
187	I	33.9	Very low	34.7	Very low	112 Å²	112	121.9 Å²	121.9	57%	0.574	65%	0.651	S	S	*	*			trans	-105.1	72.8	-172.3	-51.5	173.9	0	0	0	110.4
188	N	33.2	Very low	34.8	Very low	156 Å²	156	124.1 Å²	124.1	83%	0.834	66%	0.663	S	S	*	*	S	Bend	trans	-173.2	68.2	161.1	-96.9	-37.5	0	0	0	113.5	F186	F186-N188 PolarHBondContact O-N 2.78Å
189	H	32.3	Very low	34.7	Very low	156 Å²	156	125.4 Å²	125.4	72%	0.722	67%	0.67	S	S	*	*			trans	-178.1	112.8	144	-107.4	-71.2	0	0	0	110.7	D191	H189-D191 PolarHBondContact O-N 3.11Å
190	S	33.5	Very low	34.4	Very low	99 Å²	99	122.9 Å²	122.9	69%	0.692	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.2	8.8	-168.8	48.5	0	0	0	0	116.5
191	D	36.7	Very low	34	Very low	122 Å²	122	123.5 Å²	123.5	65%	0.652	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.7	0.4	-169.6	-65.3	-62.2	0	0	0	114.9	H189	H189-D191 PolarHBondContact O-N 3.11Å
192	I	36.2	Very low	34	Very low	98 Å²	98	127.9 Å²	127.9	50%	0.503	68%	0.684	S	S	.	*	S	Bend	trans	-96.3	-34.7	-173.1	-64.1	179.3	0	0	0	112.4	N194 K195 L196	I192-N194 VanDerWaalsContact C-N 3.27Å; I192-N194 PolarHBondContact O-N 2.89Å; I192-K195 PolarHBondContact O-N 2.92Å; I192-L196 HydrophobicContact CG2-CD1 3.7Å
193	D	36.3	Very low	34.1	Very low	124 Å²	124	131.8 Å²	131.8	66%	0.663	70%	0.695	S	S	*	*	H	α-helix	trans	-61	-33.8	-173.8	-60.2	-43.6	0	0	0	113.2	K195	D193-K195 PolarHBondContact O-N 2.97Å
194	N	34.7	Very low	33.8	Very low	137 Å²	137	132.8 Å²	132.8	73%	0.733	70%	0.7	S	S	*	*	H	α-helix	trans	-76.7	2.9	178.6	-73.5	-36.9	0	0	0	114.7	I192	I192-N194 VanDerWaalsContact C-N 3.27Å; I192-N194 PolarHBondContact O-N 2.89Å
195	K	35.9	Very low	33.1	Very low	169 Å²	169	136.1 Å²	136.1	74%	0.735	70%	0.704	S	S	*	*	H	α-helix	trans	-119.7	-9.9	175.3	-89.1	-176.2	175.4	176	0	115.4	I192 D193	I192-K195 PolarHBondContact O-N 2.92Å; D193-K195 PolarHBondContact O-N 2.97Å
196	L	34.2	Very low	32.7	Very low	127 Å²	127	137.4 Å²	137.4	67%	0.665	71%	0.711	S	S	*	*	H	α-helix	trans	-90.4	-18.8	170	-84.7	82	0	0	0	113	I192 S198	I192-L196 HydrophobicContact CG2-CD1 3.7Å; L196-S198 PolarHBondContact O-N 3.44Å
197	S	35	Very low	32.4	Very low	96 Å²	96	141.3 Å²	141.3	67%	0.671	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.9	-10.2	-179.7	53.5	0	0	0	0	115.1
198	S	34.4	Very low	32	Very low	97 Å²	97	142.7 Å²	142.7	68%	0.678	73%	0.731	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.4	10	-174.4	67.5	0	0	0	0	115.5	L196	L196-S198 PolarHBondContact O-N 3.44Å
199	L	29.1	Very low	31.7	Very low	144 Å²	144	144 Å²	144	75%	0.754	74%	0.736	S	S	*	*	S	Bend	trans	-104.9	113	175.4	-87	164.3	0	0	0	111.1
200	S	30.2	Very low	31.5	Very low	67 Å²	67	141.6 Å²	141.6	47%	0.469	74%	0.737	S	S	.	*			trans	-65.5	134.3	-167.6	58.1	0	0	0	0	114.2	Q202	S200-Q202 PolarHBondContact O-N 3.17Å
201	V	29.6	Very low	31.3	Very low	137 Å²	137	142.2 Å²	142.2	83%	0.83	74%	0.737	S	S	*	*	G	3₁₀ helix	trans	-59.5	-10.8	175.6	177.3	0	0	0	0	113.8	Q203	V201-Q203 PolarHBondContact O-N 3.13Å
202	Q	31.3	Very low	30.8	Very low	175 Å²	175	144.8 Å²	144.8	82%	0.818	75%	0.745	S	S	*	*	G	3₁₀ helix	trans	-81.9	0.2	-172	-69.4	178.2	-48.7	0	0	116.2	S200	S200-Q202 PolarHBondContact O-N 3.17Å
203	Q	34.5	Very low	30.5	Very low	166 Å²	166	145.9 Å²	145.9	78%	0.776	76%	0.761	S	S	*	*	G	3₁₀ helix	trans	-106.1	0.7	-177.2	-71.2	-174.2	-19.5	0	0	115.7	V201	V201-Q203 PolarHBondContact O-N 3.13Å
204	L	29	Very low	30.1	Very low	162 Å²	162	143.8 Å²	143.8	85%	0.848	76%	0.761	S	S	*	*	S	Bend	trans	-106	16.1	179.3	-78.5	170	0	0	0	114.4
205	Y	24.3	Very low	29.7	Very low	207 Å²	207	146 Å²	146	81%	0.812	77%	0.765	S	S	*	*	S	Bend	trans	-115.4	20.9	-169.6	-141.1	-95.1	0	0	0	115.7
206	H	28.3	Very low	29.3	Very low	183 Å²	183	144.3 Å²	144.3	85%	0.847	76%	0.764	S	S	*	*			trans	-138.8	137.4	174.6	-89.1	-81.7	0	0	0	112.8
207	R	27.2	Very low	28.9	Very low	233 Å²	233	145.1 Å²	145.1	88%	0.879	77%	0.774	S	S	*	*	S	Bend	trans	77.7	117.7	-167.2	-58.9	176.1	169.3	173.1	-3.2	114.2
208	N	26.8	Very low	28.4	Very low	142 Å²	142	147.4 Å²	147.4	76%	0.759	78%	0.778	S	S	*	*	S	Bend	cis	-139	106.9	-8.4	-77.4	-32.9	0	0	0	108.7
209	L	26.1	Very low	28.1	Very low	183 Å²	183	153.6 Å²	153.6	96%	0.958	79%	0.787	S	S	*	*			trans	-139.4	105	163.4	-141.5	78.3	0	0	0	108.4
210	S	28.8	Very low	28.1	Very low	106 Å²	106	154.1 Å²	154.1	74%	0.741	79%	0.79	S	S	*	*			trans	-165.5	129.6	-179	58.6	0	0	0	0	107
211	T	29.5	Very low	28	Very low	112 Å²	112	158 Å²	158	69%	0.687	81%	0.805	S	S	*	*			cis	-130.3	145.6	16.5	48.7	0	0	0	0	110.1
212	E	25.8	Very low	27.9	Very low	176 Å²	176	159.4 Å²	159.4	82%	0.822	81%	0.806	S	S	*	*				35.9	126.5	97.5	-50.7	-177.1	119.2	0	0	113.3
213	S	29.4	Very low	27.8	Very low	120 Å²	120	156.8 Å²	156.8	84%	0.839	80%	0.804	S	S	*	*			cis	-172.9	163.6	49.3	57.8	0	0	0	0	109.6
214	A	27.5	Very low	27.4	Very low	81 Å²	81	154.5 Å²	154.5	67%	0.669	81%	0.807	S	S	*	*			cis	-151.6	165.3	-1.2	0	0	0	0	0	106.8
215	F	26.9	Very low	27.4	Very low	182 Å²	182	152.3 Å²	152.3	80%	0.798	81%	0.805	S	S	*	*				-167.5	154.8	68.3	-127.9	-92.4	0	0	0	113.3
216	N	27.7	Very low	27.6	Very low	135 Å²	135	152.1 Å²	152.1	72%	0.722	81%	0.809	S	S	*	*			trans	46.6	75.3	163.6	-77	-10.6	0	0	0	119.6	N218	N216-N218 PolarHBondContact O-N 3.41Å
217	V	24.8	Very low	27.6	Very low	144 Å²	144	154 Å²	154	87%	0.873	81%	0.81	S	S	*	*			trans	-69.8	113.3	142.5	173.4	0	0	0	0	108.7
218	N	26.2	Very low	27.7	Very low	143 Å²	143	150.7 Å²	150.7	77%	0.765	80%	0.804	S	S	*	*			trans	-164.1	134.3	158.6	-115.9	-46.9	0	0	0	111.4	N216	N216-N218 PolarHBondContact O-N 3.41Å
219	R	26.5	Very low	27.7	Very low	228 Å²	228	151 Å²	151	86%	0.86	81%	0.805	S	S	*	*			trans	72.8	135.2	-168.8	-53.6	-178.7	178.3	-161	-2.3	114
220	L	28.9	Very low	27.8	Very low	155 Å²	155	151.8 Å²	151.8	81%	0.812	80%	0.804	S	S	*	*			cis	-151.7	148.2	-4.1	-118.1	166	0	0	0	110.8
221	N	28.4	Very low	27.7	Very low	148 Å²	148	153 Å²	153	79%	0.791	81%	0.812	S	S	*	*			trans	-74.6	143.3	178.5	-59.6	-29.3	0	0	0	112.3
222	I	29.2	Very low	27.5	Very low	167 Å²	167	157.8 Å²	157.8	86%	0.856	82%	0.823	S	S	*	*			trans	-137.6	138.3	138.5	-61.3	-173	0	0	0	107.8
223	P	28.7	Very low	27.6	Very low	119 Å²	119	156.1 Å²	156.1	77%	0.773	82%	0.815	S	S	*	*			trans	-95.4	171.6	-168.1	-0.8	23	0	0	0	114.8
224	S	25.6	Very low	27.5	Very low	119 Å²	119	159.7 Å²	159.7	83%	0.832	81%	0.81	S	S	*	*			trans	-94.7	127	179.5	48.1	0	0	0	0	113.9
225	S	27.9	Very low	27.4	Very low	116 Å²	116	167 Å²	167	81%	0.811	82%	0.82	S	S	*	*			trans	-167.3	99.2	151.1	51.1	0	0	0	0	113.8
226	K	29.8	Very low	27.6	Very low	203 Å²	203	164.3 Å²	164.3	88%	0.883	82%	0.819	S	S	*	*			trans	172.5	101.5	137.6	-99.8	-174.9	175.2	-171.2	0	110.2
227	Y	28.5	Very low	27.6	Very low	223 Å²	223	164.3 Å²	164.3	88%	0.875	82%	0.819	S	S	*	*			trans	-107	154	155.7	-112.8	-105	0	0	0	106.5
228	H	28.6	Very low	27.8	Very low	163 Å²	163	167.9 Å²	167.9	76%	0.755	82%	0.817	S	S	*	*			trans	65.1	121.7	-166.5	-62.9	-90.1	0	0	0	112.3
229	D	26.8	Very low	27.8	Very low	148 Å²	148	169.9 Å²	169.9	79%	0.791	82%	0.819	S	S	*	*			cis	-149.1	129.1	35.3	-80.8	-48.6	0	0	0	112.5
230	E	28.7	Very low	27.8	Very low	199 Å²	199	166.4 Å²	166.4	93%	0.93	81%	0.81	S	S	*	*			trans	-173.1	85	151.3	-117.3	175.3	-160	0	0	110.8
231	C	26.2	Very low	27.5	Very low	133 Å²	133	161.8 Å²	161.8	90%	0.899	79%	0.79	S	S	*	*			trans	-156.5	48.8	177.8	-149.8	0	0	0	0	113.5
232	K	25.4	Very low	27.4	Very low	211 Å²	211	159.9 Å²	159.9	92%	0.917	78%	0.784	S	S	*	*			trans	-157.1	35.5	-178.1	-138.5	174.2	-173.4	175.2	0	118.9
233	E	28	Very low	27.2	Very low	142 Å²	142	158.4 Å²	158.4	66%	0.664	78%	0.778	S	S	*	*			trans	-134.2	138.7	176.2	-170.2	87.6	-89	0	0	112.3
234	R	27.3	Very low	27	Very low	195 Å²	195	162.4 Å²	162.4	74%	0.736	78%	0.779	S	S	*	*			trans	22.5	105.4	160.1	-62.8	162.2	-140	-175.8	16.9	116.2
235	R	26.2	Very low	27.1	Very low	234 Å²	234	161.6 Å²	161.6	88%	0.883	77%	0.769	S	S	*	*			cis	49.8	119.4	49.7	-122	-178	-169.3	179.4	4.5	113.2
236	T	29.4	Very low	27	Very low	126 Å²	126	163.5 Å²	163.5	77%	0.773	77%	0.765	S	S	*	*			trans	88.3	147.7	174.5	76.1	0	0	0	0	118.5
237	N	29.3	Very low	26.7	Very low	135 Å²	135	159.2 Å²	159.2	72%	0.722	76%	0.76	S	S	*	*			trans	56.9	100.5	178.3	-63.7	-35.3	0	0	0	117.3
238	R	27	Very low	26.7	Very low	219 Å²	219	153.8 Å²	153.8	83%	0.826	74%	0.741	S	S	*	*				82.4	113	65.7	-79.2	-177.9	166.3	-179.3	-0.4	114.8
239	K	26.5	Very low	26.6	Very low	185 Å²	185	151.6 Å²	151.6	80%	0.804	74%	0.735	S	S	*	*			trans	84.6	128.4	145.7	-72.1	-177.1	176.5	179.8	0	120.3
240	F	26.9	Very low	26.6	Very low	155 Å²	155	152.8 Å²	152.8	68%	0.68	74%	0.742	S	S	*	*			trans	77	98.3	144.2	-91.7	-103.8	0	0	0	120
241	S	23	Very low	26.5	Very low	57 Å²	57	148.4 Å²	148.4	40%	0.399	73%	0.729	S	S	.	*				86.6	150.2	121.8	-168	0	0	0	0	119.2
242	T	25.6	Very low	26.5	Very low	108 Å²	108	147.9 Å²	147.9	66%	0.663	72%	0.715	S	S	*	*			trans	88.2	119	147.7	-2.8	0	0	0	0	118.5
243	L	25.1	Very low	26.7	Very low	137 Å²	137	143.7 Å²	143.7	72%	0.717	70%	0.699	S	S	*	*			trans	101.5	117	148.9	-55.7	168	0	0	0	118.5
244	Y	26	Very low	26.7	Very low	202 Å²	202	143.9 Å²	143.9	79%	0.792	70%	0.704	S	S	*	*			trans	60.4	150.7	134.1	-75.9	-124.2	0	0	0	118.9
245	T	26	Very low	26.7	Very low	103 Å²	103	139.8 Å²	139.8	63%	0.632	71%	0.706	S	S	*	*			cis	-164.2	126.8	-24.5	18.6	0	0	0	0	106.4
246	H	26.1	Very low	26.7	Very low	156 Å²	156	135.4 Å²	135.4	72%	0.722	71%	0.705	S	S	*	*				177	128.5	128.9	-109.3	-85.8	0	0	0	111.1	F248	H246-F248 AromaticContact ND1-CD2 3.67Å
247	S	24.8	Very low	26.5	Very low	112 Å²	112	136.1 Å²	136.1	78%	0.783	70%	0.703	S	S	*	*			trans	-99.7	114.4	164.9	163.9	0	0	0	0	107.5
248	F	27.5	Very low	26.3	Very low	109 Å²	109	137.4 Å²	137.4	48%	0.478	71%	0.709	S	S	.	*			trans	-146.4	128.2	166.2	-102.7	-83.2	0	0	0	111.8	H246 R261	H246-F248 AromaticContact ND1-CD2 3.67Å; F248-R261 VanDerWaalsContact CE1-NH1 3.29Å
249	D	27.6	Very low	26.3	Very low	117 Å²	117	136.7 Å²	136.7	63%	0.626	71%	0.708	S	S	*	*			trans	52.6	103.9	156.3	-52.3	-10.2	0	0	0	121.1
250	D	25.2	Very low	26.4	Very low	174 Å²	174	136.1 Å²	136.1	93%	0.93	71%	0.706	S	S	*	*			trans	-111.1	60.9	161.4	-135.6	-16.1	0	0	0	109.7
251	T	27.2	Very low	26.4	Very low	107 Å²	107	136.4 Å²	136.4	66%	0.656	70%	0.702	S	S	*	*			trans	-143	125	173.5	42	0	0	0	0	111
252	I	27.4	Very low	26.7	Very low	121 Å²	121	138.4 Å²	138.4	62%	0.621	71%	0.708	S	S	*	*			trans	175	105.3	150	-93.3	152.3	0	0	0	110.1	L257	I252-L257 HydrophobicContact CD1-CD2 4.31Å
253	H	29.4	Very low	26.9	Very low	124 Å²	124	141.4 Å²	141.4	57%	0.574	71%	0.712	S	S	*	*	S	Bend	trans	164.9	103.3	150.8	-93.4	-59.7	0	0	0	106.6	R175	R175-H253 VanDerWaalsContact CZ-CD2 3.45Å; R175-H253 PolarHBondContact NH1-CD2 3.14Å; R175-H253 PolarHBondContact NH1-NE2 3.43Å; R175-H253 PolarHBondContact NH2-CD2 2.75Å; R175-H253 PolarHBondContact NH2-NE2 3.42Å
254	D	27.5	Very low	27.1	Very low	145 Å²	145	139.9 Å²	139.9	78%	0.775	71%	0.713	S	S	*	*	S	Bend	cis	-141.4	105.1	7	-72.5	-58.1	0	0	0	112.3
255	S	26.7	Very low	27.3	Very low	109 Å²	109	135.7 Å²	135.7	76%	0.762	71%	0.71	S	S	*	*	S	Bend	trans	-167.6	112.5	153.7	54.3	0	0	0	0	112.1
256	V	26.2	Very low	27.3	Very low	143 Å²	143	137.7 Å²	137.7	87%	0.867	72%	0.716	S	S	*	*			trans	25.6	114.6	152.2	-173.3	0	0	0	0	119.2
257	L	25.4	Very low	27.5	Very low	141 Å²	141	136.3 Å²	136.3	74%	0.738	72%	0.721	S	S	*	*			trans	-47.2	133.7	161	-67.5	156.4	0	0	0	113.5	I252	I252-L257 HydrophobicContact CD1-CD2 4.31Å
258	L	26	Very low	27.6	Very low	162 Å²	162	139.3 Å²	139.3	85%	0.848	73%	0.725	S	S	*	*			trans	-175.6	66.7	134	-104.9	169.3	0	0	0	113.7	K260	L258-K260 PolarHBondContact O-N 3.38Å
259	Y	26.5	Very low	27.7	Very low	203 Å²	203	140.3 Å²	140.3	80%	0.796	74%	0.74	S	S	*	*			trans	-82.4	97.4	166.9	-154.7	-84.6	0	0	0	111.2	R261	Y259-R261 PolarHBondContact O-N 3.03Å
260	K	28	Very low	27.8	Very low	174 Å²	174	139.1 Å²	139.1	76%	0.757	74%	0.741	S	S	*	*			trans	-78	84.9	-177.6	-171.6	179.6	179.3	-179.1	0	111.3	L258 D262	L258-K260 PolarHBondContact O-N 3.38Å; K260-D262 PolarHBondContact O-N 3.25Å
261	R	27.8	Very low	28	Very low	160 Å²	160	137.5 Å²	137.5	60%	0.604	73%	0.732	S	S	*	*			trans	-74.9	105.4	179.9	-166.3	-169.3	-157.7	105.8	6.5	111.9	F248 Y259	F248-R261 VanDerWaalsContact CE1-NH1 3.29Å; Y259-R261 PolarHBondContact O-N 3.03Å
262	D	29.8	Very low	28.3	Very low	99 Å²	99	140.6 Å²	140.6	53%	0.529	74%	0.739	S	S	.	*			trans	-111.2	114.9	-176.2	-144.1	-8.1	0	0	0	112.1	K260	K260-D262 PolarHBondContact O-N 3.25Å
263	K	29.4	Very low	28.4	Very low	171 Å²	171	138.9 Å²	138.9	74%	0.743	74%	0.737	S	S	*	*			trans	62.2	154.8	159.7	-64.3	161	-172.3	102.5	0	117.4
264	S	28.9	Very low	28.5	Very low	106 Å²	106	139.4 Å²	139.4	74%	0.741	74%	0.744	S	S	*	*			cis	-174.8	-169.8	-13.6	55.5	0	0	0	0	107.3
265	P	30	Very low	28.6	Very low	113 Å²	113	139.2 Å²	139.2	73%	0.734	74%	0.743	S	S	*	*			cis	-115.4	-174	-42.5	37.4	-23	0	0	0	112.6
266	I	27.1	Very low	28.7	Very low	146 Å²	146	141.8 Å²	141.8	75%	0.749	75%	0.747	S	S	*	*			trans	-100.1	147.4	178.8	-62.1	157.3	0	0	0	111.1	M268	I266-M268 HydrophobicContact CG2-CG 3.81Å
267	P	30.3	Very low	28.6	Very low	127 Å²	127	141.5 Å²	141.5	83%	0.825	74%	0.74	S	S	*	*			trans	-102	132.6	148.7	31.2	-20.5	0	0	0	111.2
268	M	25.4	Very low	28.8	Very low	175 Å²	175	142.8 Å²	142.8	86%	0.862	75%	0.747	S	S	*	*			trans	-109.3	146.9	179	-67.6	-177.9	102.5	0	0	112.3	I266	I266-M268 HydrophobicContact CG2-CG 3.81Å
269	T	29.6	Very low	28.7	Very low	130 Å²	130	142.2 Å²	142.2	80%	0.798	74%	0.744	S	S	*	*			trans	-140.9	111.2	154.3	38	0	0	0	0	105.4
270	S	30.1	Very low	28.8	Very low	92 Å²	92	138.4 Å²	138.4	64%	0.643	75%	0.747	S	S	*	*				61.5	132.8	95.1	68.9	0	0	0	0	113.7
271	N	29.3	Very low	28.7	Very low	140 Å²	140	136.7 Å²	136.7	75%	0.749	75%	0.752	S	S	*	*			cis	-157	-173.6	8.5	-125.9	-0.5	0	0	0	112.5
272	H	33.8	Very low	28.8	Very low	172 Å²	172	136 Å²	136	80%	0.796	77%	0.765	S	S	*	*			trans	76.8	144.4	173.1	-53.9	-77.6	0	0	0	118.2
273	S	29.5	Very low	28.6	Very low	85 Å²	85	139 Å²	139	59%	0.594	78%	0.781	S	S	*	*			cis	-179.7	151.2	-45.2	41.6	0	0	0	0	110
274	N	31.8	Very low	28.5	Very low	135 Å²	135	139.3 Å²	139.3	72%	0.722	79%	0.79	S	S	*	*			trans	105.7	84.8	159.3	-54.9	-26.2	0	0	0	120.8
275	N	28.5	Very low	28.4	Very low	140 Å²	140	138.5 Å²	138.5	75%	0.749	78%	0.784	S	S	*	*				62	158.6	115.6	-63.4	-17.4	0	0	0	124.5
276	L	29.2	Very low	28.2	Very low	163 Å²	163	139.6 Å²	139.6	85%	0.853	78%	0.784	S	S	*	*			trans	81.3	99.7	-179.8	-58.3	162.3	0	0	0	114.3
277	I	24.7	Very low	28.3	Very low	137 Å²	137	141.5 Å²	141.5	70%	0.703	79%	0.787	S	S	*	*			cis	69.7	105.8	33.6	-49.1	177.8	0	0	0	114.9
278	L	29.1	Very low	28.2	Very low	169 Å²	169	140.8 Å²	140.8	89%	0.885	78%	0.781	S	S	*	*			trans	-165.7	149.7	131.4	-111.2	164.6	0	0	0	111.9
279	N	24.6	Very low	28.5	Very low	149 Å²	149	140.3 Å²	140.3	80%	0.797	78%	0.777	S	S	*	*			trans	-114.6	154.1	-174.1	-64.8	-56	0	0	0	112
280	S	28.9	Very low	28.3	Very low	123 Å²	123	140.8 Å²	140.8	86%	0.86	77%	0.774	S	S	*	*			trans	-169.8	141.2	138.3	58.4	0	0	0	0	112.7
281	T	25.2	Very low	28.3	Very low	138 Å²	138	142.6 Å²	142.6	85%	0.847	78%	0.781	S	S	*	*			trans	-121.6	139.7	178.4	52.9	0	0	0	0	112
282	T	30	Very low	28.1	Very low	146 Å²	146	146.4 Å²	146.4	90%	0.896	79%	0.785	S	S	*	*			trans	-146.6	135.6	161.9	43.9	0	0	0	0	112.2
283	N	24.6	Very low	28	Very low	161 Å²	161	146.5 Å²	146.5	86%	0.861	79%	0.789	S	S	*	*			trans	-77.1	158.4	170	-71.7	-55.4	0	0	0	111.6
284	L	28.7	Very low	28	Very low	179 Å²	179	148 Å²	148	94%	0.937	80%	0.797	S	S	*	*			trans	-151.2	148.8	137.9	-139.4	84.8	0	0	0	111
285	S	25.5	Very low	27.8	Very low	88 Å²	88	147.2 Å²	147.2	62%	0.615	80%	0.802	S	S	*	*			trans	-124.4	159.3	175.2	61.4	0	0	0	0	110.5
286	N	27.7	Very low	28	Very low	137 Å²	137	145.2 Å²	145.2	73%	0.733	80%	0.799	S	S	*	*			trans	157.5	168.9	133.4	-76.6	-14.6	0	0	0	113.1
287	F	28.2	Very low	27.9	Very low	185 Å²	185	143.1 Å²	143.1	81%	0.811	79%	0.789	S	S	*	*			trans	75.5	131.3	170.9	-75.9	-84.5	0	0	0	118.6
288	T	28.5	Very low	28	Very low	112 Å²	112	144.6 Å²	144.6	69%	0.687	79%	0.79	S	S	*	*			cis	157.1	155.3	-44.2	-71	0	0	0	0	109.2
289	Q	30.9	Very low	27.8	Very low	166 Å²	166	142.6 Å²	142.6	78%	0.776	78%	0.78	S	S	*	*			trans	91.4	121.2	178.2	-49.9	-171.8	10.4	0	0	113.9
290	L	26.2	Very low	28	Very low	140 Å²	140	143 Å²	143	73%	0.733	78%	0.78	S	S	*	*				73.8	135.6	50.9	-66.7	160.9	0	0	0	112	R292	L290-R292 HydrophobicContact CD2-CG 4.46Å
291	T	30.1	Very low	27.7	Very low	129 Å²	129	144.3 Å²	144.3	79%	0.791	78%	0.776	S	S	*	*			cis	-133.7	143	33.5	49.6	0	0	0	0	113.5
292	R	25.6	Very low	27.9	Very low	220 Å²	220	144.1 Å²	144.1	83%	0.83	78%	0.775	S	S	*	*				54.6	119.5	74.8	-89	-167.4	-177.7	-177.5	2.9	117	L290	L290-R292 HydrophobicContact CD2-CG 4.46Å
293	I	30.7	Very low	27.6	Very low	174 Å²	174	142.9 Å²	142.9	89%	0.892	77%	0.767	S	S	*	*				-169.7	151.1	128.7	-100.6	159.2	0	0	0	109.4
294	P	30.5	Very low	27.7	Very low	117 Å²	117	141.2 Å²	141.2	76%	0.76	76%	0.763	S	S	*	*			trans	-123.2	-179.5	-144.4	42.8	-30.7	0	0	0	118.3
295	S	27.4	Very low	27.5	Very low	118 Å²	118	140.9 Å²	140.9	83%	0.825	75%	0.754	S	S	*	*			trans	-60	156.7	178.8	55.9	0	0	0	0	117.7
296	S	31.6	Very low	27.6	Very low	98 Å²	98	144.4 Å²	144.4	69%	0.685	76%	0.761	S	S	*	*			trans	-155.7	120.7	160.1	164.1	0	0	0	0	113.1
297	N	28.2	Very low	27.5	Very low	119 Å²	119	145.2 Å²	145.2	64%	0.636	77%	0.765	S	S	*	*			trans	49.1	151.9	139.9	-56.9	-68	0	0	0	121.6
298	K	27.2	Very low	27.6	Very low	169 Å²	169	141.4 Å²	141.4	74%	0.735	76%	0.759	S	S	*	*			cis	-165.8	152.5	-18.7	-114.2	167.2	-174.2	152.4	0	109.7
299	N	24.3	Very low	27.4	Very low	127 Å²	127	143.5 Å²	143.5	68%	0.679	76%	0.759	S	S	*	*			trans	10.8	121.4	152.1	-50.8	-0.3	0	0	0	121
300	I	27.7	Very low	27.1	Very low	156 Å²	156	141.2 Å²	141.2	80%	0.8	76%	0.761	S	S	*	*			trans	-169	112.4	133	-89.7	144.2	0	0	0	102.7	V302	I300-V302 HydrophobicContact CG2-CG2 4.42Å
301	I	24.2	Very low	27.1	Very low	151 Å²	151	141.7 Å²	141.7	77%	0.774	76%	0.763	S	S	*	*			cis	65.3	70.5	47	-44.3	-178	0	0	0	113.2
302	V	27.4	Very low	26.9	Very low	134 Å²	134	142.7 Å²	142.7	81%	0.812	76%	0.757	S	S	*	*			trans	-138.8	130.7	146.7	177.6	0	0	0	0	108.9	I300	I300-V302 HydrophobicContact CG2-CG2 4.42Å
303	T	24.9	Very low	26.8	Very low	120 Å²	120	139 Å²	139	74%	0.736	75%	0.753	S	S	*	*			trans	-82	144.2	168.4	50.2	0	0	0	0	109.8
304	T	26.4	Very low	26.6	Very low	126 Å²	126	139.6 Å²	139.6	77%	0.773	76%	0.757	S	S	*	*				-157.5	156.6	69.4	42.6	0	0	0	0	110
305	K	25.1	Very low	26.3	Very low	172 Å²	172	137.3 Å²	137.3	75%	0.748	75%	0.748	S	S	*	*			cis	82.9	107.7	41.4	-126.9	-167.6	-171.1	-175.1	0	115.5
306	Q	26	Very low	26.2	Very low	162 Å²	162	143.5 Å²	143.5	76%	0.757	75%	0.754	S	S	*	*			trans	73	125.3	157.7	-70.9	166.2	-39.2	0	0	117.6
307	N	25.9	Very low	25.9	Very low	154 Å²	154	147.4 Å²	147.4	82%	0.824	76%	0.761	S	S	*	*				98.3	155.4	59.9	-112.6	6.4	0	0	0	111.7
308	P	31	Very low	25.9	Very low	105 Å²	105	149.2 Å²	149.2	68%	0.682	78%	0.776	S	S	*	*			trans	-118.3	177.5	-138.8	29.8	-10.4	0	0	0	115.4
309	K	24.2	Very low	25.7	Very low	157 Å²	157	145.9 Å²	145.9	68%	0.683	77%	0.774	S	S	*	*			trans	91.2	91.2	173.5	-53.5	174	-176.8	175.9	0	116.3	T1137	K309-T1137 PolarHBondContact NZ-OG1 2.88Å
310	S	25.6	Very low	25.8	Very low	117 Å²	117	148.7 Å²	148.7	82%	0.818	78%	0.783	S	S	*	*			trans	-144.4	150.7	144.9	66.4	0	0	0	0	108.7
311	L	25.5	Very low	25.7	Very low	151 Å²	151	146.6 Å²	146.6	79%	0.791	78%	0.783	S	S	*	*			cis	-141.4	146	-28.7	-152.7	80	0	0	0	108.9	N313	L311-N313 PolarHBondContact O-N 2.87Å
312	K	26	Very low	25.9	Very low	150 Å²	150	146.6 Å²	146.6	65%	0.652	78%	0.783	S	S	*	*			trans	-76.5	98.3	164.4	-72.8	173.5	178.3	170.7	0	108.1	N1135	K312-N1135 VanDerWaalsContact NZ-CG 3.26Å; K312-N1135 PolarHBondContact NZ-ND2 3Å
313	N	24.1	Very low	26	Very low	141 Å²	141	146.9 Å²	146.9	75%	0.754	78%	0.779	S	S	*	*			trans	179	51.3	152.1	-92.4	-14.3	0	0	0	114.6	L311 A315	L311-N313 PolarHBondContact O-N 2.87Å; N313-A315 PolarHBondContact O-N 3.11Å
314	L	25.7	Very low	26.2	Very low	187 Å²	187	151.1 Å²	151.1	98%	0.979	78%	0.782	S	S	*	*			trans	-89.4	92	150.6	-153.1	77	0	0	0	108.2
315	A	24.6	Very low	26.4	Very low	69 Å²	69	151 Å²	151	57%	0.57	78%	0.783	S	S	*	*			trans	-88.1	134.8	-169.3	0	0	0	0	0	112.8	N313 Q317	N313-A315 PolarHBondContact O-N 3.11Å; A315-Q317 PolarHBondContact O-N 3.46Å
316	R	24.6	Very low	26.5	Very low	248 Å²	248	149.5 Å²	149.5	94%	0.936	78%	0.783	S	S	*	*	S	Bend	trans	41.8	50.4	137.8	-58.8	178.2	170.8	171.1	-3	119
317	Q	24.6	Very low	26.7	Very low	181 Å²	181	151 Å²	151	85%	0.846	79%	0.787	S	S	*	*			trans	-158.5	96.2	159.2	-115.6	160.8	12.8	0	0	113.7	A315	A315-Q317 PolarHBondContact O-N 3.46Å
318	T	28.6	Very low	26.9	Very low	156 Å²	156	155 Å²	155	96%	0.957	79%	0.79	S	S	*	*			trans	-172.1	69.3	155.7	11.3	0	0	0	0	108.9
319	S	23.6	Very low	26.8	Very low	99 Å²	99	157 Å²	157	69%	0.692	80%	0.795	S	S	*	*			trans	-86.6	141.2	173.4	52.2	0	0	0	0	111.5
320	H	25.7	Very low	27	Very low	186 Å²	186	154 Å²	154	86%	0.861	80%	0.799	S	S	*	*			trans	73.8	146.5	168.6	-66.7	-66.6	0	0	0	119.3
321	S	25.3	Very low	27.1	Very low	113 Å²	113	152.5 Å²	152.5	79%	0.79	79%	0.794	S	S	*	*			trans	66.6	135.2	173.1	-119.6	0	0	0	0	114.7
322	I	29.4	Very low	27.3	Very low	151 Å²	151	150.4 Å²	150.4	77%	0.774	79%	0.792	S	S	*	*			cis	-135.4	151.6	27	-74.6	170.7	0	0	0	113
323	N	28.5	Very low	27.4	Very low	139 Å²	139	152.6 Å²	152.6	74%	0.743	80%	0.801	S	S	*	*			trans	-17.8	142.7	174.1	-63.3	-47.8	0	0	0	123.4
324	R	28.9	Very low	27.5	Very low	210 Å²	210	157.4 Å²	157.4	79%	0.792	81%	0.809	S	S	*	*			trans	-16.5	146.6	133.1	-62.4	170.5	178.6	-179.2	-1.8	114.3
325	P	30.8	Very low	27.6	Very low	123 Å²	123	156.4 Å²	156.4	80%	0.799	80%	0.804	S	S	*	*			cis	-151.9	119.4	49.1	37.2	-14.8	0	0	0	118.2
326	L	28.5	Very low	27.7	Very low	140 Å²	140	160.2 Å²	160.2	73%	0.733	82%	0.82	S	S	*	*			trans	-134.1	5.8	151.9	-113.4	165.7	0	0	0	114.2	R328 L329	L326-R328 PolarHBondContact O-N 3.1Å; L326-L329 HydrophobicContact CD2-CB 4.45Å; L326-L329 HydrophobicContact CD2-CD1 4.33Å
327	K	29.8	Very low	27.8	Very low	194 Å²	194	157.7 Å²	157.7	84%	0.843	82%	0.816	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76	39.8	173.4	-75	-171.1	170.1	-177.9	0	113.7
328	R	29.5	Very low	28	Very low	238 Å²	238	155.5 Å²	155.5	90%	0.898	82%	0.815	S	S	*	*	T	Hydrogen-bonded Turn	trans	-133.2	-7.4	174.1	-90.9	-172.7	170.9	175	-3.6	115.3	L326	L326-R328 PolarHBondContact O-N 3.1Å
329	L	28.5	Very low	28	Very low	148 Å²	148	156.1 Å²	156.1	78%	0.775	81%	0.811	S	S	*	*	S	Bend	trans	-107.4	-10.1	175.1	-85.8	163	0	0	0	114.6	L326 A331	L326-L329 HydrophobicContact CD2-CB 4.45Å; L326-L329 HydrophobicContact CD2-CD1 4.33Å; L329-A331 PolarHBondContact O-N 2.98Å
330	A	29.5	Very low	28	Very low	94 Å²	94	158.7 Å²	158.7	78%	0.777	82%	0.817	S	S	*	*			trans	-82.8	39.9	175.5	0	0	0	0	0	113.1
331	A	26.9	Very low	28.1	Very low	85 Å²	85	157.9 Å²	157.9	70%	0.702	81%	0.813	S	S	*	*			trans	-111.2	1.6	-166.1	0	0	0	0	0	115.5	L329	L329-A331 PolarHBondContact O-N 2.98Å
332	S	29.5	Very low	28	Very low	107 Å²	107	157.3 Å²	157.3	75%	0.748	81%	0.809	S	S	*	*	S	Bend	trans	-125.2	-4.4	-175.2	-54.1	0	0	0	0	116.1
333	F	28.7	Very low	27.9	Very low	195 Å²	195	154.7 Å²	154.7	86%	0.855	81%	0.81	S	S	*	*			trans	-132.7	73.8	177.9	-96.3	-88	0	0	0	112.7
334	R	26.1	Very low	27.7	Very low	242 Å²	242	153.3 Å²	153.3	91%	0.913	81%	0.811	S	S	*	*			trans	-149.1	84.2	162.2	-86.5	-163.9	171.4	-162	-3.7	110.3
335	L	27.9	Very low	27.5	Very low	167 Å²	167	149.5 Å²	149.5	87%	0.874	81%	0.811	S	S	*	*			trans	-155	76.5	175.5	-125.8	169.8	0	0	0	112.2
336	T	27.3	Very low	27.2	Very low	148 Å²	148	149.6 Å²	149.6	91%	0.908	81%	0.805	S	S	*	*	S	Bend	trans	-178.7	44	154.1	20.6	0	0	0	0	112.5
337	K	26.3	Very low	27	Very low	196 Å²	196	154.7 Å²	154.7	85%	0.852	82%	0.816	S	S	*	*	S	Bend	trans	-155.2	77.6	164.7	-157.6	171.1	-171.8	174.6	0	114.5
338	T	28	Very low	26.8	Very low	134 Å²	134	152.6 Å²	152.6	82%	0.822	81%	0.807	S	S	*	*			trans	174.2	110.3	152.2	35	0	0	0	0	109.6
339	I	28.5	Very low	26.6	Very low	170 Å²	170	148 Å²	148	87%	0.872	80%	0.795	S	S	*	*			trans	-143.3	78.2	131.6	-53.1	-175.2	0	0	0	106.9
340	D	24.5	Very low	26.4	Very low	152 Å²	152	149.1 Å²	149.1	81%	0.813	80%	0.796	S	S	*	*			trans	-93.8	115.7	142.8	-80.5	-59	0	0	0	105.4
341	H	27.7	Very low	26.1	Very low	170 Å²	170	149.4 Å²	149.4	79%	0.787	79%	0.791	S	S	*	*			trans	170	117.6	138.4	-101.8	-76.9	0	0	0	113.6
342	S	24.2	Very low	26	Very low	101 Å²	101	150.5 Å²	150.5	71%	0.706	79%	0.794	S	S	*	*			trans	42.3	104.5	141	58.9	0	0	0	0	121.4
343	A	26.6	Very low	25.7	Very low	96 Å²	96	157 Å²	157	79%	0.793	80%	0.802	S	S	*	*				-147.8	126.8	124.3	0	0	0	0	0	107.3
344	S	24.1	Very low	25.7	Very low	109 Å²	109	154 Å²	154	76%	0.762	80%	0.8	S	S	*	*			cis	77.9	60.6	23.2	92	0	0	0	0	116.5
345	V	25.2	Very low	25.6	Very low	131 Å²	131	150 Å²	150	79%	0.794	80%	0.796	S	S	*	*			trans	-139.8	122.3	151.6	177.3	0	0	0	0	110.4
346	N	24.3	Very low	25.5	Very low	125 Å²	125	150.4 Å²	150.4	67%	0.668	80%	0.796	S	S	*	*			trans	22.5	112.7	156.9	-54.9	-23	0	0	0	120.8
347	Y	24.7	Very low	25.3	Very low	246 Å²	246	149.5 Å²	149.5	97%	0.965	79%	0.786	S	S	*	*				-110.2	138.3	115.4	-104.9	-96.1	0	0	0	107.5
348	K	24.6	Very low	25.2	Very low	150 Å²	150	146.3 Å²	146.3	65%	0.652	78%	0.777	S	S	*	*			trans	-148.1	120.2	-165.5	-156.3	-156	-178.6	-148.1	0	112.2
349	H	26.3	Very low	25.1	Very low	141 Å²	141	148.3 Å²	148.3	65%	0.653	77%	0.774	S	S	*	*			trans	63.1	155.6	-175.9	-48.5	-76.8	0	0	0	113.6
350	H	24.4	Very low	24.9	Very low	173 Å²	173	144.4 Å²	144.4	80%	0.801	76%	0.762	S	S	*	*			cis	-106.5	175.5	-0.3	-90.5	-104.4	0	0	0	111.3
351	C	23.3	Very low	24.9	Very low	100 Å²	100	143.3 Å²	143.3	68%	0.676	76%	0.756	S	S	*	*			cis	-143.5	158.7	6.1	-145.1	0	0	0	0	113.1
352	S	24	Very low	24.9	Very low	107 Å²	107	143.3 Å²	143.3	75%	0.748	76%	0.756	S	S	*	*			trans	10	112.3	157	-54.5	0	0	0	0	120.1
353	R	23.2	Very low	25.1	Very low	244 Å²	244	144.3 Å²	144.3	92%	0.921	76%	0.758	S	S	*	*				-112.8	137	126.1	-157.8	169.8	-169.2	160.1	4.7	107.5
354	T	28.3	Very low	25	Very low	132 Å²	132	146.1 Å²	146.1	81%	0.81	76%	0.759	S	S	*	*			trans	-67	150.3	-168.7	33.9	0	0	0	0	113.2
355	N	24	Very low	25	Very low	158 Å²	158	146.1 Å²	146.1	85%	0.845	76%	0.759	S	S	*	*			trans	-64	167.1	167.2	-78.5	-32.7	0	0	0	111.6
356	M	25.2	Very low	25.1	Very low	175 Å²	175	145 Å²	145	86%	0.862	76%	0.757	S	S	*	*			trans	106.3	131	168.9	-63.1	-170.5	-179.2	0	0	115.3
357	N	23.9	Very low	25.2	Very low	130 Å²	130	151.2 Å²	151.2	70%	0.695	77%	0.771	S	S	*	*			cis	-161	164.5	-25	-140.3	-9.6	0	0	0	111.5
358	L	24.2	Very low	25.2	Very low	128 Å²	128	144.8 Å²	144.8	67%	0.67	75%	0.754	S	S	*	*			trans	58.5	141.5	152.1	-68.9	161.2	0	0	0	121.7
359	K	26	Very low	25.3	Very low	177 Å²	177	142.9 Å²	142.9	77%	0.77	76%	0.76	S	S	*	*			trans	49.9	114.1	143.8	-64.2	177.2	176.1	-178.7	0	118.6
360	S	24.2	Very low	25.5	Very low	87 Å²	87	143.5 Å²	143.5	61%	0.608	77%	0.773	S	S	*	*				83.3	133.1	55.1	84.5	0	0	0	0	113.9
361	D	24.5	Very low	25.7	Very low	130 Å²	130	139.4 Å²	139.4	70%	0.695	76%	0.76	S	S	*	*			trans	64.1	111.6	166.9	-40.8	-57.8	0	0	0	114.9
362	H	28.1	Very low	25.8	Very low	170 Å²	170	140.4 Å²	140.4	79%	0.787	76%	0.759	S	S	*	*				-166.8	174.2	70.9	-96	-90.5	0	0	0	113.3
363	T	27.6	Very low	25.9	Very low	122 Å²	122	141 Å²	141	75%	0.748	76%	0.761	S	S	*	*			trans	43.5	98.7	159.9	51	0	0	0	0	118.2
364	V	25	Very low	26.2	Very low	133 Å²	133	136.8 Å²	136.8	81%	0.806	76%	0.755	S	S	*	*				69.9	122.9	71.6	-178.2	0	0	0	0	114.7
365	S	24.5	Very low	26.1	Very low	110 Å²	110	137.4 Å²	137.4	77%	0.769	75%	0.754	S	S	*	*			trans	55.5	94.3	164.3	62.9	0	0	0	0	120.6
366	S	27.5	Very low	26.2	Very low	108 Å²	108	134.2 Å²	134.2	76%	0.755	74%	0.744	S	S	*	*			trans	-152.5	94.1	132.1	-167.2	0	0	0	0	111.5
367	W	26.4	Very low	26.4	Very low	254 Å²	254	133.9 Å²	133.9	96%	0.962	74%	0.744	S	S	*	*			trans	-130.8	71.6	174.1	-96.8	70.7	0	0	0	108.6
368	N	24.7	Very low	26.4	Very low	112 Å²	112	136.5 Å²	136.5	60%	0.599	75%	0.752	S	S	*	*			trans	-160.6	48	-177.9	-110.5	-16.8	0	0	0	115.1
369	S	27.3	Very low	26.5	Very low	110 Å²	110	137 Å²	137	77%	0.769	76%	0.761	S	S	*	*	S	Bend	trans	-144.9	46.1	179.3	-67.5	0	0	0	0	116.8
370	V	28.5	Very low	26.7	Very low	153 Å²	153	134.9 Å²	134.9	93%	0.927	76%	0.763	S	S	*	*	S	Bend	trans	-145.5	31.3	143.2	-154.2	0	0	0	0	111.2
371	T	29.2	Very low	26.8	Very low	87 Å²	87	135.3 Å²	135.3	53%	0.534	77%	0.766	S	S	.	*	S	Bend	trans	-120.6	-7.5	-176	33.2	0	0	0	0	113.6	C373	T371-C373 PolarHBondContact O-N 3.36Å
372	N	25.3	Very low	26.8	Very low	121 Å²	121	136.8 Å²	136.8	65%	0.647	77%	0.774	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.3	61.4	-169.1	-63.7	-1.9	0	0	0	112.6
373	C	26.9	Very low	26.8	Very low	120 Å²	120	135.3 Å²	135.3	81%	0.811	78%	0.777	S	S	*	*	T	Hydrogen-bonded Turn	trans	-145.7	9.6	168.6	-93.9	0	0	0	0	114.2	T371	T371-C373 PolarHBondContact O-N 3.36Å
374	I	29.9	Very low	26.7	Very low	155 Å²	155	135 Å²	135	80%	0.795	78%	0.775	S	S	*	*	S	Bend	trans	-126.7	-26.6	-177.6	-67.8	-179.3	0	0	0	113
375	D	25.8	Very low	26.7	Very low	145 Å²	145	135.8 Å²	135.8	78%	0.775	77%	0.773	S	S	*	*	S	Bend	trans	-94.9	9	-175.4	-73.1	-32.3	0	0	0	115.1	I377	D375-I377 PolarHBondContact O-N 3.47Å
376	S	26.7	Very low	26.8	Very low	92 Å²	92	136.6 Å²	136.6	64%	0.643	77%	0.773	S	S	*	*	S	Bend	trans	-101.3	68.5	-178	61.4	0	0	0	0	113.6
377	I	27.4	Very low	26.7	Very low	168 Å²	168	138 Å²	138	86%	0.862	78%	0.777	S	S	*	*	S	Bend	trans	-173.4	50.6	156	-95.1	148	0	0	0	110.2	D375	D375-I377 PolarHBondContact O-N 3.47Å
378	Q	25.9	Very low	26.9	Very low	184 Å²	184	133.3 Å²	133.3	86%	0.86	77%	0.772	S	S	*	*			trans	-137.5	26.2	178.6	-77.1	-154.1	-12.4	0	0	117.1
379	T	25.9	Very low	26.9	Very low	139 Å²	139	134.1 Å²	134.1	85%	0.853	78%	0.781	S	S	*	*			trans	-148.4	62.2	176.8	28	0	0	0	0	115.8
380	T	29.4	Very low	27.1	Very low	133 Å²	133	135.6 Å²	135.6	82%	0.816	79%	0.785	S	S	*	*			trans	-145.6	92.1	152.4	43.4	0	0	0	0	109
381	S	26.6	Very low	27	Very low	95 Å²	95	133.6 Å²	133.6	66%	0.664	77%	0.773	S	S	*	*				74.4	79.4	72.6	76.7	0	0	0	0	114.5
382	N	23.8	Very low	26.9	Very low	162 Å²	162	138.7 Å²	138.7	87%	0.866	78%	0.784	S	S	*	*			trans	24.8	106.6	148.3	-55.7	-9	0	0	0	119.1
383	T	28.5	Very low	27	Very low	139 Å²	139	138.4 Å²	138.4	85%	0.853	78%	0.782	S	S	*	*			trans	-143	80	159.1	5.2	0	0	0	0	112.9
384	T	25.9	Very low	27.1	Very low	116 Å²	116	138.8 Å²	138.8	71%	0.712	78%	0.776	S	S	*	*			trans	23.4	111.8	132.9	-40.9	0	0	0	0	119.9
385	I	24.8	Very low	27	Very low	149 Å²	149	138 Å²	138	76%	0.764	77%	0.774	S	S	*	*			trans	38.7	112.2	135.3	-46.3	169.7	0	0	0	118.3
386	T	26.4	Very low	27	Very low	126 Å²	126	136.2 Å²	136.2	77%	0.773	77%	0.773	S	S	*	*				-169.7	130.5	118.6	14.6	0	0	0	0	111.2
387	T	25.5	Very low	27	Very low	137 Å²	137	137.3 Å²	137.3	84%	0.84	78%	0.78	S	S	*	*			trans	-133.7	93.4	169.7	45.8	0	0	0	0	109.4
388	N	30.8	Very low	27	Very low	157 Å²	157	133.8 Å²	133.8	84%	0.84	77%	0.771	S	S	*	*			trans	-85.9	119.1	170.6	-83.1	-1.8	0	0	0	109.5
389	T	25.4	Very low	27.1	Very low	129 Å²	129	131.4 Å²	131.4	79%	0.791	76%	0.764	S	S	*	*			trans	-77.6	130.7	169.6	48.5	0	0	0	0	110.7
390	T	31.3	Very low	27.2	Very low	141 Å²	141	131.1 Å²	131.1	87%	0.865	76%	0.757	S	S	*	*			trans	-139	116.1	157.2	-1.7	0	0	0	0	110.5
391	T	26	Very low	27	Very low	110 Å²	110	132.5 Å²	132.5	68%	0.675	76%	0.759	S	S	*	*			trans	-82.6	136.7	176.3	-34.4	0	0	0	0	109.6
392	Y	26.7	Very low	27.1	Very low	195 Å²	195	131.7 Å²	131.7	77%	0.765	77%	0.766	S	S	*	*				163.5	148.1	114.6	-97.3	-67	0	0	0	115.7
393	N	28.1	Very low	27.2	Very low	114 Å²	114	133.3 Å²	133.3	61%	0.61	77%	0.765	S	S	*	*			trans	58.7	103.2	144.8	-71.6	-14.5	0	0	0	121.9
394	N	27.4	Very low	27.1	Very low	128 Å²	128	133.3 Å²	133.3	68%	0.684	76%	0.76	S	S	*	*				83.1	148.7	109.9	-63	-9.2	0	0	0	121.8
395	N	29	Very low	27.2	Very low	140 Å²	140	134.6 Å²	134.6	75%	0.749	76%	0.761	S	S	*	*			trans	72.5	79.9	151	-64.6	1	0	0	0	119
396	S	26.5	Very low	27.2	Very low	107 Å²	107	139 Å²	139	75%	0.748	77%	0.769	S	S	*	*				79.3	132.1	108	69.4	0	0	0	0	120.9
397	S	26.6	Very low	27.2	Very low	114 Å²	114	139.2 Å²	139.2	80%	0.797	77%	0.77	S	S	*	*			trans	94.1	104.5	140.7	-142.5	0	0	0	0	119
398	S	26.8	Very low	27.3	Very low	94 Å²	94	141 Å²	141	66%	0.657	76%	0.761	S	S	*	*				98.7	129.8	129.7	-149.3	0	0	0	0	120.3
399	N	27.5	Very low	27.1	Very low	134 Å²	134	138.7 Å²	138.7	72%	0.717	76%	0.757	S	S	*	*			trans	71.5	116.5	150.4	-71	-11.7	0	0	0	122.5
400	N	27.8	Very low	27.1	Very low	133 Å²	133	138.7 Å²	138.7	71%	0.711	76%	0.757	S	S	*	*			trans	91	131.7	135.9	-63.1	-17.4	0	0	0	121.2
401	N	25.8	Very low	26.9	Very low	162 Å²	162	139.1 Å²	139.1	87%	0.866	75%	0.752	S	S	*	*			trans	66.6	96.9	153.5	-60.4	-20.4	0	0	0	118.9
402	G	29.5	Very low	26.8	Very low	78 Å²	78	140.5 Å²	140.5	80%	0.804	76%	0.755	S	S	*	*			trans	-151.5	98.4	163.4	0	0	0	0	0	112.2
403	K	25.7	Very low	26.9	Very low	196 Å²	196	138.9 Å²	138.9	85%	0.852	75%	0.754	S	S	*	*			trans	-72.3	140.9	165	-62.3	172.5	-180	173.4	0	108.6
404	N	26.4	Very low	27	Very low	139 Å²	139	139 Å²	139	74%	0.743	76%	0.759	S	S	*	*				175.3	155.8	113.8	-97.2	-18.8	0	0	0	116.2
405	I	27.2	Very low	27.1	Very low	144 Å²	144	139.2 Å²	139.2	74%	0.738	76%	0.76	S	S	*	*			trans	57.1	115.2	150.2	-62.2	159.8	0	0	0	117.2
406	R	25	Very low	27	Very low	242 Å²	242	139.2 Å²	139.2	91%	0.913	76%	0.756	S	S	*	*			trans	-126.1	81.7	177.8	-169	-176	-165.6	178.9	5.8	110.4	R408	R406-R408 PolarHBondContact O-N 2.94Å
407	T	27.3	Very low	27.1	Very low	130 Å²	130	140.5 Å²	140.5	80%	0.798	75%	0.754	S	S	*	*			trans	-71.2	114.9	175.9	1	0	0	0	0	110.3	S409	T407-S409 PolarHBondContact O-N 3.26Å
408	R	25.7	Very low	27.3	Very low	173 Å²	173	145 Å²	145	65%	0.653	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-71.3	120	171.4	-87.7	176.5	156.3	148.9	-5.9	109.5	R406 N956	R406-R408 PolarHBondContact O-N 2.94Å; R408-N956 PolarHBondContact NH1-OD1 3.48Å; R408-N956 VanDerWaalsContact NH1-OD1 3.09Å; R408-N956 PolarHBondContact NH2-OD1 3.16Å
409	S	27	Very low	27.5	Very low	109 Å²	109	147.3 Å²	147.3	76%	0.762	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-98.9	135.9	160.7	47.4	0	0	0	0	109.6	T407	T407-S409 PolarHBondContact O-N 3.26Å
410	V	25.5	Very low	27.5	Very low	129 Å²	129	147 Å²	147	78%	0.782	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-75.6	126.1	-178.1	177.5	0	0	0	0	109.9	L412	V410-L412 PolarHBondContact O-N 3.48Å
411	I	26.5	Very low	27.5	Very low	150 Å²	150	149.7 Å²	149.7	77%	0.769	77%	0.77	S	S	*	*			trans	-87.2	98	175	-59.3	176.4	0	0	0	108.1	Q413	I411-Q413 PolarHBondContact O-N 2.93Å
412	L	25.8	Very low	27.7	Very low	140 Å²	140	151.8 Å²	151.8	73%	0.733	77%	0.772	S	S	*	*			trans	-75.9	101.6	162.5	-79	171.6	0	0	0	108.4	V410 T414	V410-L412 PolarHBondContact O-N 3.48Å; L412-T414 PolarHBondContact O-N 3.24Å
413	Q	27.9	Very low	27.6	Very low	161 Å²	161	156.8 Å²	156.8	75%	0.752	77%	0.771	S	S	*	*			trans	-75.8	101.1	177.2	-173.6	164.5	-50.6	0	0	109.9	I411	I411-Q413 PolarHBondContact O-N 2.93Å
414	T	30.5	Very low	27.8	Very low	116 Å²	116	156.5 Å²	156.5	71%	0.712	77%	0.772	S	S	*	*			trans	-81.3	115.9	165.7	53.6	0	0	0	0	108.8	L412 H416	L412-T414 PolarHBondContact O-N 3.24Å; T414-H416 PolarHBondContact O-N 3.08Å
415	D	28.7	Very low	27.9	Very low	133 Å²	133	157.9 Å²	157.9	71%	0.711	77%	0.774	S	S	*	*			trans	-58.1	136.3	-176.7	-70.5	-45.8	0	0	0	112.6
416	H	27.9	Very low	28.1	Very low	140 Å²	140	159.6 Å²	159.6	65%	0.648	78%	0.776	S	S	*	*			trans	-106.7	10.5	-163.8	-147	-59.1	0	0	0	113.3	T414	T414-H416 PolarHBondContact O-N 3.08Å
417	D	28.6	Very low	28.2	Very low	134 Å²	134	151 Å²	151	72%	0.717	76%	0.764	S	S	*	*	G	3₁₀ helix	trans	-82.6	-19.9	-165.3	-71.2	-7.8	0	0	0	114.1	I419	D417-I419 PolarHBondContact O-N 2.64Å
418	F	30.6	Very low	28.1	Very low	209 Å²	209	152.4 Å²	152.4	92%	0.917	77%	0.765	S	S	*	*	G	3₁₀ helix	trans	-77.7	12.6	-171.2	-134.1	-92.1	0	0	0	116
419	I	30	Very low	28.4	Very low	141 Å²	141	152.2 Å²	152.2	72%	0.723	77%	0.772	S	S	*	*	G	3₁₀ helix	trans	-126	-10.1	-175	-72.3	179.6	0	0	0	113.6	D417	D417-I419 PolarHBondContact O-N 2.64Å
420	N	28.2	Very low	28.4	Very low	128 Å²	128	156.3 Å²	156.3	68%	0.684	78%	0.776	S	S	*	*	S	Bend	trans	-99	-8.4	-174	-75.6	-34.9	0	0	0	115.7	F422	N420-F422 PolarHBondContact O-N 3.43Å
421	E	28.6	Very low	28.5	Very low	190 Å²	190	153.7 Å²	153.7	89%	0.888	78%	0.775	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.9	14.8	-170.9	-154.9	163.5	-152.2	0	0	115.5
422	F	30.1	Very low	28.5	Very low	206 Å²	206	154.7 Å²	154.7	90%	0.904	78%	0.776	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.6	19.5	177.2	-118.1	-85.7	0	0	0	115.1	N420	N420-F422 PolarHBondContact O-N 3.43Å
423	K	27.1	Very low	28.5	Very low	183 Å²	183	155.1 Å²	155.1	80%	0.796	78%	0.778	S	S	*	*			trans	-149.7	85.6	175.1	-69	-176.8	-179	173.5	0	113
424	H	29.3	Very low	28.5	Very low	190 Å²	190	154.7 Å²	154.7	88%	0.88	78%	0.78	S	S	*	*			trans	-169.9	72.3	142.2	-115.4	-75.9	0	0	0	116.2
425	E	28.3	Very low	28.2	Very low	168 Å²	168	154.7 Å²	154.7	79%	0.785	78%	0.78	S	S	*	*	S	Bend	trans	-156.7	132.6	145.9	-112.7	-157.8	-169.3	0	0	107.6
426	K	31.2	Very low	28.2	Very low	179 Å²	179	155.9 Å²	155.9	78%	0.778	79%	0.786	S	S	*	*			cis	-127.7	158.8	9.3	-66.8	170.7	-179.4	173.6	0	110.6
427	G	27.5	Very low	28.1	Very low	63 Å²	63	155.6 Å²	155.6	65%	0.649	79%	0.79	S	S	*	*			trans	-98.7	-171.6	-174.1	0	0	0	0	0	116.1
428	L	26.1	Very low	28	Very low	159 Å²	159	156.3 Å²	156.3	83%	0.832	79%	0.793	S	S	*	*			trans	67.3	129.2	-176.3	-87.9	65.5	0	0	0	114.1
429	H	31.4	Very low	28	Very low	169 Å²	169	151.3 Å²	151.3	78%	0.782	78%	0.78	S	S	*	*			cis	-135.2	-177.3	41.3	-130.7	-103.8	0	0	0	115.7
430	K	25.9	Very low	27.9	Very low	194 Å²	194	152.8 Å²	152.8	84%	0.843	79%	0.789	S	S	*	*			trans	-87.3	158.5	-164.8	-57.8	172.9	179	176.4	0	115.7
431	G	28.7	Very low	28	Very low	74 Å²	74	154 Å²	154	76%	0.763	80%	0.795	S	S	*	*			trans	128.9	91.9	166.8	0	0	0	0	0	112
432	H	25.5	Very low	28.1	Very low	171 Å²	171	149.2 Å²	149.2	79%	0.792	77%	0.774	S	S	*	*			cis	71	80.2	44.1	-161.5	-71.6	0	0	0	114.9
433	L	26	Very low	28.2	Very low	150 Å²	150	145 Å²	145	79%	0.785	76%	0.761	S	S	*	*			trans	-153.1	115.3	143.8	-141.5	74.9	0	0	0	113.6
434	L	27.8	Very low	28.5	Very low	151 Å²	151	145.3 Å²	145.3	79%	0.791	76%	0.763	S	S	*	*			trans	36.5	126.7	145.8	-57.5	175.5	0	0	0	122.3
435	V	25.6	Very low	28.4	Very low	117 Å²	117	144.3 Å²	144.3	71%	0.709	75%	0.751	S	S	*	*			trans	-63.3	149.8	160.3	175.1	0	0	0	0	111.2
436	N	27.3	Very low	28.7	Very low	157 Å²	157	140.8 Å²	140.8	84%	0.84	74%	0.737	S	S	*	*			trans	-149.2	125.5	142.7	-146.6	-4.1	0	0	0	111
437	D	26.8	Very low	28.8	Very low	135 Å²	135	138.2 Å²	138.2	72%	0.722	73%	0.726	S	S	*	*			trans	-83.6	121.9	-173.1	-74	-63.3	0	0	0	112.3
438	N	26.8	Very low	28.9	Very low	149 Å²	149	140.6 Å²	140.6	80%	0.797	72%	0.724	S	S	*	*			trans	-166	115.7	164.3	-101.9	-55.9	0	0	0	110.8
439	T	29.8	Very low	29.2	Very low	103 Å²	103	138.6 Å²	138.6	63%	0.632	71%	0.71	S	S	*	*			trans	169.9	51.4	144.1	34.4	0	0	0	0	114.5	L441 I442	T439-L441 PolarHBondContact O-N 2.95Å; T439-I442 HydrophobicContact CG2-CD1 3.47Å; T439-I442 VanDerWaalsContact CG2-CD1 3.47Å; T439-I442 HydrophobicContact CG2-CG1 3.98Å
440	N	28.1	Very low	29.2	Very low	172 Å²	172	135.7 Å²	135.7	92%	0.92	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.6	27.5	165.3	-86.9	-29.9	0	0	0	113.6
441	L	31.2	Very low	29.5	Very low	154 Å²	154	129.8 Å²	129.8	81%	0.806	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-135.2	-1.9	-163.6	-104.9	160.1	0	0	0	115.2	T439	T439-L441 PolarHBondContact O-N 2.95Å
442	I	29.8	Very low	29.6	Very low	89 Å²	89	132.8 Å²	132.8	46%	0.456	68%	0.681	S	S	.	*	S	Bend	trans	-98.8	-34.9	-175.6	-66.7	-178	0	0	0	112.7	T439 K444 R445 I446	T439-I442 HydrophobicContact CG2-CD1 3.47Å; T439-I442 VanDerWaalsContact CG2-CD1 3.47Å; T439-I442 HydrophobicContact CG2-CG1 3.98Å; I442-K444 PolarHBondContact O-N 3.48Å; I442-R445 PolarHBondContact O-N 3.06Å; I442-R445 VanDerWaalsContact O-N 3.16Å; I442-I446 HydrophobicContact CG2-CD1 3.41Å; I442-I446 VanDerWaalsContact CG2-CD1 3.41Å; I442-I446 HydrophobicContact CG2-CG1 4.02Å; I442-I446 PolarHBondContact O-N 3.05Å
443	D	31.2	Very low	29.9	Very low	118 Å²	118	128.3 Å²	128.3	63%	0.631	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70	-7.3	-170	-167.5	54.2	0	0	0	115.3	K447	D443-K447 PolarHBondContact O-NZ 3.49Å; D443-K447 IonicContact OD1-NZ 3.89Å; D443-K447 PolarHBondContact OD1-NZ 3.35Å; D443-K447 IonicContact OD2-NZ 3.58Å; D443-K447 PolarHBondContact OD2-NZ 2.88Å
444	K	33.4	Very low	30.1	Very low	189 Å²	189	126.7 Å²	126.7	82%	0.822	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.9	-17.6	173.1	-84.9	-174	173.4	-179.1	0	115.1	I442	I442-K444 PolarHBondContact O-N 3.48Å
445	R	28.6	Very low	30.3	Very low	170 Å²	170	125.6 Å²	125.6	64%	0.642	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.8	-44.9	-178.2	-150.5	176.6	-172.6	138.6	6.7	111.7	I442 K447 N448 E449	I442-R445 PolarHBondContact O-N 3.06Å; I442-R445 VanDerWaalsContact O-N 3.16Å; R445-K447 PolarHBondContact O-N 3.38Å; R445-K447 VanDerWaalsContact O-N 3.16Å; R445-N448 PolarHBondContact O-N 2.86Å; R445-E449 WeakPolarHBondContact CD-OE1 3.44Å; R445-E449 WeakPolarHBondContact CG-OE1 3.44Å; R445-E449 IonicContact CZ-OE1 2.94Å; R445-E449 IonicContact NE-OE1 2.76Å; R445-E449 PolarHBondContact NE-OE1 3.46Å; R445-E449 IonicContact NH2-OE1 2.59Å; R445-E449 PolarHBondContact O-N 3.42Å
446	I	33.7	Very low	30.6	Very low	94 Å²	94	129.7 Å²	129.7	48%	0.482	66%	0.658	S	S	.	*	H	α-helix	trans	-60.6	-25.2	176.2	-63.1	-174.6	0	0	0	112.5	I442 N448 L450	I442-I446 HydrophobicContact CG2-CD1 3.41Å; I442-I446 VanDerWaalsContact CG2-CD1 3.41Å; I442-I446 HydrophobicContact CG2-CG1 4.02Å; I442-I446 PolarHBondContact O-N 3.05Å; I446-N448 VanDerWaalsContact C-N 3.34Å; I446-L450 HydrophobicContact CG2-CD1 4.13Å
447	K	33.8	Very low	31	Very low	124 Å²	124	127.7 Å²	127.7	54%	0.539	65%	0.648	S	S	.	*	H	α-helix	trans	-76.1	-17.3	176.6	-71.6	-167.3	-177.3	71.4	0	114.8	D443 R445	D443-K447 PolarHBondContact O-NZ 3.49Å; D443-K447 IonicContact OD1-NZ 3.89Å; D443-K447 PolarHBondContact OD1-NZ 3.35Å; D443-K447 IonicContact OD2-NZ 3.58Å; D443-K447 PolarHBondContact OD2-NZ 2.88Å; R445-K447 PolarHBondContact O-N 3.38Å; R445-K447 VanDerWaalsContact O-N 3.16Å
448	N	30.4	Very low	31.3	Very low	114 Å²	114	126.2 Å²	126.2	61%	0.61	64%	0.638	S	S	*	*	H	α-helix	trans	-107.2	-38.6	-179.6	-68.5	27	0	0	0	110.9	R445 I446 L450 S451	R445-N448 PolarHBondContact O-N 2.86Å; I446-N448 VanDerWaalsContact C-N 3.34Å; N448-L450 VanDerWaalsContact C-N 3.27Å; N448-L450 PolarHBondContact O-N 3.48Å; N448-S451 VanDerWaalsContact O-CB 3.27Å; N448-S451 WeakPolarHBondContact O-CB 3.35Å; N448-S451 PolarHBondContact O-N 2.96Å; N448-S451 VanDerWaalsContact O-N 3.12Å
449	E	30.7	Very low	31.5	Very low	116 Å²	116	124.8 Å²	124.8	54%	0.542	63%	0.631	S	S	.	*	H	α-helix	trans	-73.4	-13.9	179.4	-70.3	167.1	-174.5	0	0	113.4	R445	R445-E449 WeakPolarHBondContact CD-OE1 3.44Å; R445-E449 WeakPolarHBondContact CG-OE1 3.44Å; R445-E449 IonicContact CZ-OE1 2.94Å; R445-E449 IonicContact NE-OE1 2.76Å; R445-E449 PolarHBondContact NE-OE1 3.46Å; R445-E449 IonicContact NH2-OE1 2.59Å; R445-E449 PolarHBondContact O-N 3.42Å
450	L	32	Very low	31.8	Very low	108 Å²	108	123.8 Å²	123.8	57%	0.565	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.4	-3.8	168.4	-93.7	70	0	0	0	114.3	I446 N448	I446-L450 HydrophobicContact CG2-CD1 4.13Å; N448-L450 VanDerWaalsContact C-N 3.27Å; N448-L450 PolarHBondContact O-N 3.48Å
451	S	31.8	Very low	32	Very low	70 Å²	70	122.5 Å²	122.5	49%	0.49	62%	0.621	S	S	.	*	T	Hydrogen-bonded Turn	trans	-71.5	-48.6	175.9	173.6	0	0	0	0	110.5	N448	N448-S451 VanDerWaalsContact O-CB 3.27Å; N448-S451 WeakPolarHBondContact O-CB 3.35Å; N448-S451 PolarHBondContact O-N 2.96Å; N448-S451 VanDerWaalsContact O-N 3.12Å
452	D	31.8	Very low	32.1	Very low	138 Å²	138	121.9 Å²	121.9	74%	0.738	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.7	6.4	-158	-54.8	-14.2	0	0	0	113.3
453	S	30.7	Very low	32.3	Very low	77 Å²	77	122 Å²	122	54%	0.538	63%	0.626	S	S	.	*	T	Hydrogen-bonded Turn	trans	-116.5	3.4	-175.7	92.4	0	0	0	0	115.5
454	M	30.9	Very low	32.4	Very low	116 Å²	116	124.7 Å²	124.7	57%	0.571	64%	0.635	S	S	*	*	S	Bend	trans	-108	-14.3	-177.4	-85.4	-174.5	60.1	0	0	115.2	Y456	M454-Y456 VanDerWaalsContact C-N 3.33Å; M454-Y456 PolarHBondContact O-N 3.42Å
455	D	31.5	Very low	32.5	Very low	128 Å²	128	120.9 Å²	120.9	68%	0.684	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.4	-9.3	-178	-79	-19.5	0	0	0	114.3	N459	D455-N459 PolarHBondContact O-ND2 2.89Å
456	Y	32.5	Very low	32.8	Very low	202 Å²	202	120.8 Å²	120.8	79%	0.792	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.7	-35.6	-176.9	-102.7	-87.8	0	0	0	114.9	M454	M454-Y456 VanDerWaalsContact C-N 3.33Å; M454-Y456 PolarHBondContact O-N 3.42Å
457	D	34.6	Very low	33	Very low	116 Å²	116	123.5 Å²	123.5	62%	0.62	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.7	-27.5	-172.1	-72.2	-35.6	0	0	0	114.3	N459 S460	D457-N459 VanDerWaalsContact C-N 3.26Å; D457-N459 PolarHBondContact O-N 2.91Å; D457-S460 PolarHBondContact O-N 2.76Å
458	I	33.8	Very low	33.2	Very low	103 Å²	103	125.4 Å²	125.4	53%	0.528	66%	0.659	S	S	.	*	T	Hydrogen-bonded Turn	trans	-67.2	-29.2	-176.9	-64.4	178.7	0	0	0	111.8	S460	I458-S460 VanDerWaalsContact C-N 3.33Å
459	N	32	Very low	33.5	Very low	119 Å²	119	125.5 Å²	125.5	64%	0.636	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.6	-12.4	179.7	-67.3	-62.4	0	0	0	113.8	D455 D457	D455-N459 PolarHBondContact O-ND2 2.89Å; D457-N459 VanDerWaalsContact C-N 3.26Å; D457-N459 PolarHBondContact O-N 2.91Å
460	S	35.9	Very low	33.9	Very low	82 Å²	82	126.7 Å²	126.7	57%	0.573	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.3	-20.1	179.6	141.7	0	0	0	0	113.1	D457 I458	D457-S460 PolarHBondContact O-N 2.76Å; I458-S460 VanDerWaalsContact C-N 3.33Å
461	L	32.8	Very low	34.8	Very low	146 Å²	146	127.9 Å²	127.9	76%	0.764	68%	0.683	S	S	*	*	S	Bend	trans	-95.3	3.3	-179.2	-81.6	159.9	0	0	0	114.8
462	L	32.5	Very low	35.9	Very low	140 Å²	140	129 Å²	129	73%	0.733	69%	0.691	S	S	*	*	S	Bend	trans	-102.5	17.8	-176.6	-73.8	169.3	0	0	0	114
463	S	34.6	Very low	37.2	Very low	91 Å²	91	125.9 Å²	125.9	64%	0.636	68%	0.68	S	S	*	*	S	Bend	trans	-128.1	10.8	-173.4	58.6	0	0	0	0	114.9
464	Q	32.5	Very low	38.6	Very low	175 Å²	175	128.4 Å²	128.4	82%	0.818	68%	0.681	S	S	*	*	S	Bend	trans	-142.9	82.8	-178.4	-66.9	-172.5	-9.4	0	0	113.1
465	D	35.4	Very low	40.6	Very low	109 Å²	109	128.3 Å²	128.3	58%	0.583	68%	0.679	S	S	*	*			trans	-168.8	36.6	143.5	-129.8	12.9	0	0	0	115.4	N467 K468	D465-N467 PolarHBondContact O-N 3.26Å; D465-K468 IonicContact OD1-NZ 3.96Å; D465-K468 IonicContact OD2-NZ 3.57Å; D465-K468 PolarHBondContact OD2-NZ 3.47Å
466	D	34.7	Very low	42.6	Very low	168 Å²	168	126.9 Å²	126.9	90%	0.898	67%	0.671	S	S	*	*			trans	-71.3	52.5	176.5	-83.1	-42.2	0	0	0	113.3
467	N	37.7	Very low	44.8	Very low	152 Å²	152	121.8 Å²	121.8	81%	0.813	65%	0.653	S	S	*	*			trans	-161.3	78.4	175.3	-95.8	-56	0	0	0	113	D465	D465-N467 PolarHBondContact O-N 3.26Å
468	K	38.6	Very low	46.8	Very low	164 Å²	164	122 Å²	122	71%	0.713	65%	0.651	S	S	*	*			trans	-143.6	128.2	167.3	-103.2	146.6	-168.9	160.9	0	112.9	D465	D465-K468 IonicContact OD1-NZ 3.96Å; D465-K468 IonicContact OD2-NZ 3.57Å; D465-K468 PolarHBondContact OD2-NZ 3.47Å
469	P	37.2	Very low	49	Very low	115 Å²	115	122.6 Å²	122.6	75%	0.747	65%	0.651	S	S	*	*			trans	-87.8	144.4	-169.7	33.3	-35.8	0	0	0	114.9
470	N	38	Very low	51.3	Low	142 Å²	142	123 Å²	123	76%	0.759	65%	0.647	S	S	*	*			trans	46.7	69.7	158.6	-68.9	-14.6	0	0	0	117.6	S472	N470-S472 PolarHBondContact O-N 2.79Å
471	N	51.1	Low	53.5	Low	133 Å²	133	120.9 Å²	120.9	71%	0.711	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.3	7.8	-175	-125.1	-6.8	0	0	0	117.1
472	S	56.1	Low	55.9	Low	92 Å²	92	116.4 Å²	116.4	64%	0.643	61%	0.612	S	S	*	*	H	α-helix	trans	-76.4	-28.1	-173.6	56.1	0	0	0	0	114.2	N470	N470-S472 PolarHBondContact O-N 2.79Å
473	S	58.3	Low	58.4	Low	74 Å²	74	113.3 Å²	113.3	52%	0.517	59%	0.593	S	S	.	*	H	α-helix	trans	-71.9	-40.3	179.5	53.4	0	0	0	0	112.6	L476 K477	S473-L476 PolarHBondContact O-N 3.13Å; S473-K477 PolarHBondContact O-N 3.44Å
474	F	60.6	Low	61	Low	129 Å²	129	109.8 Å²	109.8	57%	0.566	57%	0.566	S	S	*	*	H	α-helix	trans	-61	-47.4	176.8	-93.7	-93.6	0	0	0	112	L476 K477 E478	F474-L476 PolarHBondContact O-N 2.9Å; F474-K477 WeakPolarHBondContact O-CA 3.23Å; F474-K477 WeakPolarHBondContact O-CB 3.13Å; F474-K477 PolarHBondContact O-N 3.03Å; F474-E478 PolarHBondContact O-N 2.84Å
475	H	71.3	Confident	63.5	Low	114 Å²	114	103.1 Å²	103.1	53%	0.528	54%	0.535	S	S	.	.	H	α-helix	trans	-64.3	-28	-178.4	-158.7	-25.1	0	0	0	112.7	Q479	H475-Q479 PolarHBondContact CE1-NE2 3.14Å; H475-Q479 PolarHBondContact ND1-NE2 3.41Å; H475-Q479 WeakPolarHBondContact O-CG 3.32Å; H475-Q479 PolarHBondContact O-N 3.4Å
476	L	75.3	Confident	65.8	Low	98 Å²	98	97.9 Å²	97.9	51%	0.513	51%	0.507	S	S	.	.	H	α-helix	trans	-74.5	-42.8	169.4	-71.3	173.6	0	0	0	112	S473 F474 E478 Q479 F480	S473-L476 PolarHBondContact O-N 3.13Å; F474-L476 PolarHBondContact O-N 2.9Å; L476-E478 VanDerWaalsContact C-N 3.32Å; L476-E478 PolarHBondContact O-N 3.23Å; L476-Q479 PolarHBondContact O-N 3.34Å; L476-F480 VanDerWaalsContact O-CD2 3.29Å; L476-F480 WeakPolarHBondContact O-CD2 3.29Å; L476-F480 PolarHBondContact O-N 3.12Å
477	K	77.9	Confident	67.9	Low	96 Å²	96	91.1 Å²	91.1	42%	0.417	47%	0.472	S	S	.	.	H	α-helix	trans	-51.7	-52.2	176.1	-169.7	-169.5	175	-167.4	0	110.3	S473 F474 Q479 F480 F481 D514	S473-K477 PolarHBondContact O-N 3.44Å; F474-K477 WeakPolarHBondContact O-CA 3.23Å; F474-K477 WeakPolarHBondContact O-CB 3.13Å; F474-K477 PolarHBondContact O-N 3.03Å; K477-Q479 PolarHBondContact O-N 2.82Å; K477-F480 PolarHBondContact O-N 3.02Å; K477-F481 HydrophobicContact CD-CE2 4.1Å; K477-F481 HydrophobicContact CG-CD2 3.82Å; K477-F481 HydrophobicContact CG-CE2 3.56Å; K477-F481 WeakPolarHBondContact O-CD2 3.41Å; K477-F481 PolarHBondContact O-N 2.67Å; K477-F481 VanDerWaalsContact O-N 3.1Å; K477-D514 WeakPolarHBondContact CE-OD2 3.38Å; K477-D514 IonicContact NZ-OD2 3.9Å; K477-D514 PolarHBondContact NZ-OD2 2.92Å
478	E	77.3	Confident	69.6	Low	121 Å²	121	86.5 Å²	86.5	57%	0.565	46%	0.46	S	S	*	.	H	α-helix	trans	-60.7	-42.5	-180	-69.1	175.3	179.1	0	0	113.1	F474 L476 F480 F481 A482	F474-E478 PolarHBondContact O-N 2.84Å; L476-E478 VanDerWaalsContact C-N 3.32Å; L476-E478 PolarHBondContact O-N 3.23Å; E478-F480 VanDerWaalsContact C-N 3.3Å; E478-F480 PolarHBondContact O-N 3.17Å; E478-F481 PolarHBondContact O-N 2.93Å; E478-A482 WeakPolarHBondContact O-CB 3.39Å; E478-A482 PolarHBondContact O-N 2.89Å
479	Q	80.1	Confident	71.2	Confident	114 Å²	114	81.6 Å²	81.6	53%	0.533	44%	0.441	S	S	.	.	H	α-helix	trans	-63.6	-34.2	177.1	-74.8	178.4	12.8	0	0	112.7	H475 L476 K477 F483	H475-Q479 PolarHBondContact CE1-NE2 3.14Å; H475-Q479 PolarHBondContact ND1-NE2 3.41Å; H475-Q479 WeakPolarHBondContact O-CG 3.32Å; H475-Q479 PolarHBondContact O-N 3.4Å; L476-Q479 PolarHBondContact O-N 3.34Å; K477-Q479 PolarHBondContact O-N 2.82Å; Q479-F483 PolarHBondContact O-N 3.21Å
480	F	80.1	Confident	72.8	Confident	127 Å²	127	85.1 Å²	85.1	56%	0.557	45%	0.445	S	S	*	.	H	α-helix	trans	-69.9	-43	173.7	-83.4	-70.7	0	0	0	112.3	L476 K477 E478 F483 F484	L476-F480 VanDerWaalsContact O-CD2 3.29Å; L476-F480 WeakPolarHBondContact O-CD2 3.29Å; L476-F480 PolarHBondContact O-N 3.12Å; K477-F480 PolarHBondContact O-N 3.02Å; E478-F480 VanDerWaalsContact C-N 3.3Å; E478-F480 PolarHBondContact O-N 3.17Å; F480-F483 WeakPolarHBondContact O-CB 3.4Å; F480-F483 PolarHBondContact O-N 2.65Å; F480-F483 VanDerWaalsContact O-N 3.12Å; F480-F484 PolarHBondContact O-N 2.92Å
481	F	82	Confident	74.2	Confident	39 Å²	39	80.9 Å²	80.9	17%	0.171	42%	0.422	C	S	.	.	H	α-helix	trans	-67.3	-38.1	176.6	-74.3	-69.4	0	0	0	112.8	K477 E478 F483 F484 Q485 D514 W515	K477-F481 HydrophobicContact CD-CE2 4.1Å; K477-F481 HydrophobicContact CG-CD2 3.82Å; K477-F481 HydrophobicContact CG-CE2 3.56Å; K477-F481 WeakPolarHBondContact O-CD2 3.41Å; K477-F481 PolarHBondContact O-N 2.67Å; K477-F481 VanDerWaalsContact O-N 3.1Å; E478-F481 PolarHBondContact O-N 2.93Å; F481-F483 PolarHBondContact O-N 3Å; F481-F483 VanDerWaalsContact O-N 3.16Å; F481-F484 AromaticContact CD1-CD2 3.84Å; F481-F484 HydrophobicContact CD1-CD2 3.84Å; F481-F484 HydrophobicContact CD1-CE2 4.3Å; F481-F484 HydrophobicContact CE1-CD2 4.11Å; F481-F484 HydrophobicContact CE1-CE2 4.18Å; F481-F484 PolarHBondContact O-N 2.89Å; F481-Q485 PolarHBondContact O-N 2.78Å; F481-D514 HydrophobicContact CE1-CB 4.18Å; F481-D514 HydrophobicContact CZ-CB 4.17Å; F481-W515 HydrophobicContact CE1-CD2 4.04Å; F481-W515 HydrophobicContact CE1-CE3 4.36Å; F481-W515 HydrophobicContact CE1-CG 4.21Å; F481-W515 AromaticContact CZ-CD2 3.89Å; F481-W515 HydrophobicContact CZ-CD2 3.89Å; F481-W515 AromaticContact CZ-CE2 3.67Å; F481-W515 HydrophobicContact CZ-CE3 4.33Å; F481-W515 HydrophobicContact CZ-CG 4.31Å; F481-W515 HydrophobicContact CZ-CH2 4.38Å; F481-W515 AromaticContact CZ-CZ2 3.94Å; F481-W515 HydrophobicContact CZ-CZ2 3.94Å; F481-W515 AromaticContact CZ-NE1 3.92Å
482	A	82.2	Confident	75.3	Confident	52 Å²	52	74.6 Å²	74.6	43%	0.43	39%	0.388	S	S	.	.	H	α-helix	trans	-61	-21.6	171.9	0	0	0	0	0	113.5	E478	E478-A482 WeakPolarHBondContact O-CB 3.39Å; E478-A482 PolarHBondContact O-N 2.89Å
483	F	86.4	Confident	76.1	Confident	75 Å²	75	72.9 Å²	72.9	33%	0.329	37%	0.371	S	S	.	.	H	α-helix	trans	-80	-27.3	175.1	-166	-132.9	0	0	0	112.7	Q479 F480 F481 Q485 N522 F523 Y526	Q479-F483 PolarHBondContact O-N 3.21Å; F480-F483 WeakPolarHBondContact O-CB 3.4Å; F480-F483 PolarHBondContact O-N 2.65Å; F480-F483 VanDerWaalsContact O-N 3.12Å; F481-F483 PolarHBondContact O-N 3Å; F481-F483 VanDerWaalsContact O-N 3.16Å; F483-Q485 VanDerWaalsContact C-N 3.34Å; F483-N522 HydrophobicContact CD2-CB 3.77Å; F483-N522 HydrophobicContact CE2-CB 3.65Å; F483-F523 HydrophobicContact CD1-CB 3.64Å; F483-F523 AromaticContact CD1-CD2 3.76Å; F483-F523 HydrophobicContact CD1-CD2 3.76Å; F483-F523 HydrophobicContact CD1-CG 4.2Å; F483-F523 HydrophobicContact CE1-CB 3.85Å; F483-F523 AromaticContact CE1-CD2 3.7Å; F483-F523 HydrophobicContact CE1-CD2 3.7Å; F483-F523 HydrophobicContact CE1-CG 4.25Å; F483-F523 HydrophobicContact CG-CB 4.08Å; F483-F523 HydrophobicContact CZ-CB 4.46Å; F483-F523 VanDerWaalsContact O-CB 3.3Å; F483-F523 WeakPolarHBondContact O-CB 3.37Å; F483-F523 PolarHBondContact O-N 2.58Å; F483-Y526 AromaticContact CE2-CD2 3.97Å; F483-Y526 HydrophobicContact CE2-CD2 3.97Å; F483-Y526 HydrophobicContact CE2-CE2 4.39Å; F483-Y526 AromaticContact CZ-CD2 3.82Å; F483-Y526 HydrophobicContact CZ-CD2 3.82Å
484	F	87.6	Confident	76.9	Confident	17 Å²	17	76 Å²	76	8%	0.075	38%	0.375	C	S	.	.	H	α-helix	trans	-79.9	-11.3	171.4	-60	-41.2	0	0	0	113.8	F480 F481 Q509 W515 I517 H518 S521 F523	F480-F484 PolarHBondContact O-N 2.92Å; F481-F484 AromaticContact CD1-CD2 3.84Å; F481-F484 HydrophobicContact CD1-CD2 3.84Å; F481-F484 HydrophobicContact CD1-CE2 4.3Å; F481-F484 HydrophobicContact CE1-CD2 4.11Å; F481-F484 HydrophobicContact CE1-CE2 4.18Å; F481-F484 PolarHBondContact O-N 2.89Å; F484-Q509 PolarHBondContact O-NE2 2.69Å; F484-W515 AromaticContact CE2-CE3 3.82Å; F484-W515 HydrophobicContact CE2-CE3 3.82Å; F484-W515 HydrophobicContact CE2-CZ3 4.03Å; F484-W515 HydrophobicContact CZ-CE3 4.21Å; F484-W515 HydrophobicContact CZ-CZ3 4.24Å; F484-I517 HydrophobicContact CD1-CD1 4.4Å; F484-I517 HydrophobicContact CD1-CG1 3.8Å; F484-I517 HydrophobicContact CE1-CD1 4.27Å; F484-I517 HydrophobicContact CE1-CG1 4.11Å; F484-I517 HydrophobicContact CG-CG1 4.21Å; F484-H518 PolarHBondContact O-N 3.09Å; F484-S521 VanDerWaalsContact C-CB 3.46Å; F484-S521 WeakPolarHBondContact O-CB 3.27Å; F484-F523 HydrophobicContact CD1-CB 3.69Å; F484-F523 AromaticContact CD1-CD1 3.86Å; F484-F523 HydrophobicContact CD1-CD1 3.86Å; F484-F523 HydrophobicContact CD1-CD2 4.05Å; F484-F523 AromaticContact CD1-CG 3.57Å; F484-F523 HydrophobicContact CD1-CG 3.57Å; F484-F523 HydrophobicContact CE1-CB 4.17Å; F484-F523 AromaticContact CE1-CD1 3.84Å; F484-F523 HydrophobicContact CE1-CD1 3.84Å; F484-F523 AromaticContact CE1-CD2 3.61Å; F484-F523 HydrophobicContact CE1-CD2 3.61Å; F484-F523 HydrophobicContact CE1-CE1 4.17Å; F484-F523 AromaticContact CE1-CE2 3.95Å; F484-F523 HydrophobicContact CE1-CE2 3.95Å; F484-F523 AromaticContact CE1-CG 3.57Å; F484-F523 HydrophobicContact CE1-CG 3.57Å; F484-F523 HydrophobicContact CE1-CZ 4.22Å
485	Q	85.3	Confident	77.5	Confident	34 Å²	34	71.7 Å²	71.7	16%	0.159	36%	0.358	C	S	.	.	S	Bend	trans	-82.1	154.1	179.5	-75.9	-176.7	-9	0	0	113.3	F481 F483 T487 R506 E510 S521	F481-Q485 PolarHBondContact O-N 2.78Å; F483-Q485 VanDerWaalsContact C-N 3.34Å; Q485-T487 PolarHBondContact O-N 3.37Å; Q485-R506 HydrophobicContact CB-CG 4.31Å; Q485-R506 HydrophobicContact CG-CG 4.45Å; Q485-E510 PolarHBondContact NE2-OE1 3.34Å; Q485-S521 WeakPolarHBondContact O-CA 3.38Å; Q485-S521 WeakPolarHBondContact O-CB 3.07Å
486	P	84.5	Confident	78	Confident	0 Å²	0	67.3 Å²	67.3	0%	0	34%	0.337	C	S	.	.	B	Isolated β-bridge	trans	-67.5	124.7	173.3	28.8	-35.5	0	0	0	111.1	L502 E505 R506	P486-L502 HydrophobicContact CB-CD1 3.62Å; P486-L502 HydrophobicContact CG-CD1 3.81Å; P486-E505 HydrophobicContact CG-CG 4.1Å; P486-R506 HydrophobicContact CG-CG 3.95Å; P486-R506 PolarHBondContact O-NE 3.31Å; P486-R506 PolarHBondContact O-NH2 3.03Å
487	T	78.4	Confident	78.2	Confident	26 Å²	26	65.3 Å²	65.3	16%	0.16	34%	0.34	C	S	.	.	P	Polyproline II helix	trans	-92.9	161.9	-178.2	55.2	0	0	0	0	111.2	Q485 N489 A492 N522	Q485-T487 PolarHBondContact O-N 3.37Å; T487-N489 PolarHBondContact O-N 2.94Å; T487-N489 VanDerWaalsContact OG1-CG 3.23Å; T487-N489 PolarHBondContact OG1-ND2 3.32Å; T487-N489 PolarHBondContact OG1-OD1 3.38Å; T487-A492 WeakPolarHBondContact O-CB 3.27Å; T487-N522 HydrophobicContact CG2-CB 4.07Å; T487-N522 VanDerWaalsContact CG2-CG 3.47Å; T487-N522 WeakPolarHBondContact CG2-OD1 3.45Å; T487-N522 PolarHBondContact OG1-OD1 2.99Å
488	G	72.8	Confident	78.5	Confident	55 Å²	55	64.5 Å²	64.5	57%	0.567	34%	0.344	S	S	*	.	S	Bend	trans	-70.5	33.1	179	0	0	0	0	0	115.3
489	N	72.2	Confident	78.9	Confident	60 Å²	60	64.3 Å²	64.3	32%	0.321	34%	0.341	S	S	.	.			trans	-71.8	159.5	178.8	-68.7	-11	0	0	0	110.9	T487 L491 A492 M493 N522	T487-N489 PolarHBondContact O-N 2.94Å; T487-N489 VanDerWaalsContact OG1-CG 3.23Å; T487-N489 PolarHBondContact OG1-ND2 3.32Å; T487-N489 PolarHBondContact OG1-OD1 3.38Å; N489-L491 VanDerWaalsContact C-N 3.25Å; N489-L491 PolarHBondContact O-N 3.28Å; N489-L491 VanDerWaalsContact O-N 3.17Å; N489-A492 PolarHBondContact O-N 3.24Å; N489-A492 VanDerWaalsContact O-N 3.09Å; N489-M493 PolarHBondContact O-N 3.04Å; N489-N522 PolarHBondContact ND2-OD1 3.44Å
490	K	71	Confident	79.2	Confident	190 Å²	190	64 Å²	64	83%	0.826	34%	0.342	S	S	*	.	H	α-helix	trans	-54.1	-37.8	-179.1	-72.9	-167	175.4	-169.9	0	113.6	M493 K494	K490-M493 PolarHBondContact O-N 3.18Å; K490-K494 WeakPolarHBondContact O-CB 3.44Å; K490-K494 PolarHBondContact O-N 3.15Å
491	L	66.9	Low	79.5	Confident	52 Å²	52	59.1 Å²	59.1	27%	0.272	33%	0.325	S	S	.	.	H	α-helix	trans	-61.3	-50.3	176.1	-175.1	76.4	0	0	0	111.9	N489 M493 K494 L495 C520 F668	N489-L491 VanDerWaalsContact C-N 3.25Å; N489-L491 PolarHBondContact O-N 3.28Å; N489-L491 VanDerWaalsContact O-N 3.17Å; L491-M493 VanDerWaalsContact C-N 3.26Å; L491-M493 PolarHBondContact O-N 3.2Å; L491-K494 WeakPolarHBondContact O-CB 3.46Å; L491-K494 PolarHBondContact O-N 2.96Å; L491-K494 VanDerWaalsContact O-N 3.08Å; L491-L495 WeakPolarHBondContact O-CB 3.31Å; L491-L495 PolarHBondContact O-N 2.91Å; L491-C520 HydrophobicContact CD2-CB 4.39Å; L491-F668 HydrophobicContact CB-CD2 3.8Å; L491-F668 HydrophobicContact CB-CE2 3.85Å; L491-F668 HydrophobicContact CD1-CD2 4.41Å; L491-F668 HydrophobicContact CD2-CD2 4.1Å; L491-F668 HydrophobicContact CG-CD2 4.32Å
492	A	75	Confident	79.7	Confident	1 Å²	1	57.4 Å²	57.4	1%	0.008	32%	0.318	C	S	.	.	H	α-helix	trans	-63.3	-33.6	178.8	0	0	0	0	0	111.9	T487 N489 L495 F496 L502	T487-A492 WeakPolarHBondContact O-CB 3.27Å; N489-A492 PolarHBondContact O-N 3.24Å; N489-A492 VanDerWaalsContact O-N 3.09Å; A492-L495 PolarHBondContact O-N 3.05Å; A492-F496 HydrophobicContact CB-CD2 4.2Å; A492-F496 HydrophobicContact CB-CE2 4.44Å; A492-F496 WeakPolarHBondContact O-CB 3.37Å; A492-F496 WeakPolarHBondContact O-CD2 3.32Å; A492-F496 PolarHBondContact O-N 2.76Å; A492-L502 HydrophobicContact CB-CD1 4.18Å
493	M	73.1	Confident	79.8	Confident	56 Å²	56	58.2 Å²	58.2	28%	0.276	32%	0.315	S	S	.	.	H	α-helix	trans	-76	-26.4	173.9	-58.2	-79.2	68.5	0	0	113.3	N489 K490 L491 G497 T498 L502	N489-M493 PolarHBondContact O-N 3.04Å; K490-M493 PolarHBondContact O-N 3.18Å; L491-M493 VanDerWaalsContact C-N 3.26Å; L491-M493 PolarHBondContact O-N 3.2Å; M493-G497 WeakPolarHBondContact O-CA 3.45Å; M493-G497 PolarHBondContact O-N 3.2Å; M493-T498 WeakPolarHBondContact CE-O 3.47Å; M493-L502 HydrophobicContact CE-CB 3.83Å; M493-L502 HydrophobicContact CE-CD2 3.68Å; M493-L502 HydrophobicContact CE-CG 4.38Å
494	K	74	Confident	79.8	Confident	139 Å²	139	62.4 Å²	62.4	60%	0.604	33%	0.329	S	S	*	.	H	α-helix	trans	-69.7	-36.5	169.1	-174	-179	178.6	-176.5	0	111.6	K490 L491 N670	K490-K494 WeakPolarHBondContact O-CB 3.44Å; K490-K494 PolarHBondContact O-N 3.15Å; L491-K494 WeakPolarHBondContact O-CB 3.46Å; L491-K494 PolarHBondContact O-N 2.96Å; L491-K494 VanDerWaalsContact O-N 3.08Å; K494-N670 PolarHBondContact NZ-OD1 3.41Å
495	L	75	Confident	79.8	Confident	39 Å²	39	62.2 Å²	62.2	20%	0.204	33%	0.328	C	S	.	.	H	α-helix	trans	-81.7	-50.9	-178.1	-173.2	59.3	0	0	0	113	L491 A492 I581 N584 A586 I589	L491-L495 WeakPolarHBondContact O-CB 3.31Å; L491-L495 PolarHBondContact O-N 2.91Å; A492-L495 PolarHBondContact O-N 3.05Å; L495-I581 HydrophobicContact CD2-CD1 4.35Å; L495-N584 VanDerWaalsContact CD1-O 3.26Å; L495-N584 WeakPolarHBondContact CD1-O 3.35Å; L495-A586 HydrophobicContact CD1-CB 4.23Å; L495-A586 HydrophobicContact CG-CB 4.12Å; L495-I589 HydrophobicContact CD2-CD1 3.9Å
496	F	81.2	Confident	79.9	Confident	22 Å²	22	63.4 Å²	63.4	10%	0.096	33%	0.331	C	S	.	.	H	α-helix	trans	-92.6	-10.2	-176.4	-58.6	-68.2	0	0	0	114	A492 T498 A501 L502 E505 H518 A586 I589	A492-F496 HydrophobicContact CB-CD2 4.2Å; A492-F496 HydrophobicContact CB-CE2 4.44Å; A492-F496 WeakPolarHBondContact O-CB 3.37Å; A492-F496 WeakPolarHBondContact O-CD2 3.32Å; A492-F496 PolarHBondContact O-N 2.76Å; F496-T498 PolarHBondContact O-N 3.46Å; F496-A501 HydrophobicContact CB-CB 3.99Å; F496-A501 VanDerWaalsContact O-CB 3.23Å; F496-A501 WeakPolarHBondContact O-CB 3.4Å; F496-L502 HydrophobicContact CB-CB 4.39Å; F496-L502 HydrophobicContact CD2-CB 4.42Å; F496-L502 HydrophobicContact CD2-CD1 3.9Å; F496-L502 HydrophobicContact CE2-CD1 4.16Å; F496-E505 HydrophobicContact CD1-CB 4.49Å; F496-E505 HydrophobicContact CE1-CB 4Å; F496-E505 HydrophobicContact CE1-CG 3.85Å; F496-E505 HydrophobicContact CE2-CG 4.35Å; F496-E505 HydrophobicContact CZ-CB 4.11Å; F496-E505 HydrophobicContact CZ-CG 3.61Å; F496-H518 AromaticContact CZ-CE1 3.93Å; F496-H518 AromaticContact CZ-NE2 3.64Å; F496-A586 HydrophobicContact CD1-CB 3.7Å; F496-A586 HydrophobicContact CE1-CB 3.85Å; F496-I589 HydrophobicContact CE1-CD1 3.69Å; F496-I589 HydrophobicContact CZ-CD1 3.46Å; F496-I589 VanDerWaalsContact CZ-CD1 3.46Å
497	G	80.1	Confident	80	Confident	56 Å²	56	67.9 Å²	67.9	58%	0.577	36%	0.355	S	S	*	.			trans	70.2	-47.6	179.8	0	0	0	0	0	115.5	M493	M493-G497 WeakPolarHBondContact O-CA 3.45Å; M493-G497 PolarHBondContact O-N 3.2Å
498	T	83.8	Confident	80.4	Confident	79 Å²	79	70.3 Å²	70.3	49%	0.485	36%	0.361	S	S	.	.	S	Bend	trans	-126.1	153.6	-172.4	69	0	0	0	0	112.7	M493 F496 L500 A501 L502	M493-T498 WeakPolarHBondContact CE-O 3.47Å; F496-T498 PolarHBondContact O-N 3.46Å; T498-L500 PolarHBondContact O-N 3.43Å; T498-A501 PolarHBondContact O-N 2.98Å; T498-A501 WeakPolarHBondContact OG1-CB 3.31Å; T498-A501 PolarHBondContact OG1-N 2.82Å; T498-A501 VanDerWaalsContact OG1-N 3.13Å; T498-L502 PolarHBondContact O-N 3.18Å; T498-L502 VanDerWaalsContact O-N 3.14Å
499	K	85.5	Confident	81	Confident	118 Å²	118	68.1 Å²	68.1	51%	0.513	34%	0.336	S	S	.	.	H	α-helix	trans	-54.3	-42	170	-63.8	179.4	-174.1	164.8	0	111.4	A501 L502 D503 D1134	K499-A501 PolarHBondContact O-N 3.5Å; K499-L502 WeakPolarHBondContact O-CB 3.48Å; K499-L502 PolarHBondContact O-N 2.95Å; K499-D503 WeakPolarHBondContact O-CB 3.22Å; K499-D503 PolarHBondContact O-N 3.02Å; K499-D1134 IonicContact NZ-OD1 2.74Å; K499-D1134 IonicContact NZ-OD2 3.54Å; K499-D1134 PolarHBondContact NZ-OD2 3.06Å
500	L	86.2	Confident	81.6	Confident	107 Å²	107	70.3 Å²	70.3	56%	0.56	34%	0.344	S	S	*	.	H	α-helix	trans	-64.5	-37.8	-177.6	-177.3	62.5	0	0	0	112.9	T498 R504	T498-L500 PolarHBondContact O-N 3.43Å; L500-R504 VanDerWaalsContact O-CG 3.3Å; L500-R504 WeakPolarHBondContact O-CG 3.18Å; L500-R504 PolarHBondContact O-N 2.9Å
501	A	85.5	Confident	82.2	Confident	24 Å²	24	69 Å²	69	20%	0.198	34%	0.341	C	S	.	.	H	α-helix	trans	-68.6	-42.3	173.7	0	0	0	0	0	111.7	F496 T498 K499 D503 R504 E505	F496-A501 HydrophobicContact CB-CB 3.99Å; F496-A501 VanDerWaalsContact O-CB 3.23Å; F496-A501 WeakPolarHBondContact O-CB 3.4Å; T498-A501 PolarHBondContact O-N 2.98Å; T498-A501 WeakPolarHBondContact OG1-CB 3.31Å; T498-A501 PolarHBondContact OG1-N 2.82Å; T498-A501 VanDerWaalsContact OG1-N 3.13Å; K499-A501 PolarHBondContact O-N 3.5Å; A501-D503 VanDerWaalsContact C-N 3.32Å; A501-D503 PolarHBondContact O-N 2.83Å; A501-R504 WeakPolarHBondContact O-CB 3.27Å; A501-R504 PolarHBondContact O-N 3.34Å; A501-E505 PolarHBondContact O-N 3.47Å
502	L	86.1	Confident	82.8	Confident	3 Å²	3	69.8 Å²	69.8	2%	0.016	34%	0.343	C	S	.	.	H	α-helix	trans	-60.7	-38.6	173.5	174.3	62.6	0	0	0	112.8	P486 A492 M493 F496 T498 K499 E505 R506	P486-L502 HydrophobicContact CB-CD1 3.62Å; P486-L502 HydrophobicContact CG-CD1 3.81Å; A492-L502 HydrophobicContact CB-CD1 4.18Å; M493-L502 HydrophobicContact CE-CB 3.83Å; M493-L502 HydrophobicContact CE-CD2 3.68Å; M493-L502 HydrophobicContact CE-CG 4.38Å; F496-L502 HydrophobicContact CB-CB 4.39Å; F496-L502 HydrophobicContact CD2-CB 4.42Å; F496-L502 HydrophobicContact CD2-CD1 3.9Å; F496-L502 HydrophobicContact CE2-CD1 4.16Å; T498-L502 PolarHBondContact O-N 3.18Å; T498-L502 VanDerWaalsContact O-N 3.14Å; K499-L502 WeakPolarHBondContact O-CB 3.48Å; K499-L502 PolarHBondContact O-N 2.95Å; L502-E505 PolarHBondContact O-N 2.95Å; L502-R506 PolarHBondContact O-N 3.28Å; L502-R506 VanDerWaalsContact O-N 3.17Å
503	D	85.4	Confident	82.8	Confident	69 Å²	69	71.3 Å²	71.3	37%	0.369	36%	0.359	S	S	.	.	H	α-helix	trans	-73.2	-33.7	178.2	-62.4	-26.4	0	0	0	111.4	K499 A501 E505 R506 L507	K499-D503 WeakPolarHBondContact O-CB 3.22Å; K499-D503 PolarHBondContact O-N 3.02Å; A501-D503 VanDerWaalsContact C-N 3.32Å; A501-D503 PolarHBondContact O-N 2.83Å; D503-E505 VanDerWaalsContact C-N 3.33Å; D503-R506 PolarHBondContact O-N 2.97Å; D503-R506 IonicContact OD1-CZ 3.83Å; D503-R506 IonicContact OD1-NH1 3.59Å; D503-R506 PolarHBondContact OD1-NH1 3.2Å; D503-R506 IonicContact OD1-NH2 2.89Å; D503-L507 WeakPolarHBondContact O-CG 3.44Å; D503-L507 PolarHBondContact O-N 3.04Å
504	R	86.9	Confident	82.5	Confident	164 Å²	164	73 Å²	73	62%	0.619	37%	0.37	S	S	*	.	H	α-helix	trans	-62.5	-38.8	167.5	-72.5	170.1	-173.3	167.8	1.3	112	L500 A501 L507 R508	L500-R504 VanDerWaalsContact O-CG 3.3Å; L500-R504 WeakPolarHBondContact O-CG 3.18Å; L500-R504 PolarHBondContact O-N 2.9Å; A501-R504 WeakPolarHBondContact O-CB 3.27Å; A501-R504 PolarHBondContact O-N 3.34Å; R504-L507 WeakPolarHBondContact O-CB 3.31Å; R504-L507 PolarHBondContact O-N 3.45Å; R504-R508 PolarHBondContact O-N 2.8Å
505	E	87	Confident	82.9	Confident	12 Å²	12	73.8 Å²	73.8	6%	0.056	37%	0.369	C	S	.	.	H	α-helix	trans	-66.1	-38.1	179	-179.8	62.6	-172.7	0	0	112.2	P486 F496 A501 L502 D503 L507 R508 Q509 H518	P486-E505 HydrophobicContact CG-CG 4.1Å; F496-E505 HydrophobicContact CD1-CB 4.49Å; F496-E505 HydrophobicContact CE1-CB 4Å; F496-E505 HydrophobicContact CE1-CG 3.85Å; F496-E505 HydrophobicContact CE2-CG 4.35Å; F496-E505 HydrophobicContact CZ-CB 4.11Å; F496-E505 HydrophobicContact CZ-CG 3.61Å; A501-E505 PolarHBondContact O-N 3.47Å; L502-E505 PolarHBondContact O-N 2.95Å; D503-E505 VanDerWaalsContact C-N 3.33Å; E505-L507 VanDerWaalsContact C-N 3.35Å; E505-L507 PolarHBondContact O-N 3.15Å; E505-R508 VanDerWaalsContact CD-NH2 3.32Å; E505-R508 WeakPolarHBondContact O-CB 3.33Å; E505-R508 PolarHBondContact O-N 2.86Å; E505-R508 IonicContact OE1-CZ 2.69Å; E505-R508 IonicContact OE1-NE 3.58Å; E505-R508 IonicContact OE1-NH2 3.86Å; E505-R508 PolarHBondContact OE1-NH2 2.74Å; E505-R508 IonicContact OE2-CZ 2.81Å; E505-R508 IonicContact OE2-NE 2.77Å; E505-R508 PolarHBondContact OE2-NE 3.3Å; E505-R508 IonicContact OE2-NH2 2.85Å; E505-R508 PolarHBondContact OE2-NH2 2.81Å; E505-R508 VanDerWaalsContact OE2-NH2 3.14Å; E505-Q509 PolarHBondContact O-N 2.98Å; E505-H518 IonicContact OE1-CD2 2.67Å; E505-H518 PolarHBondContact OE1-CD2 3.04Å; E505-H518 VanDerWaalsContact OE1-CD2 3.29Å; E505-H518 IonicContact OE1-NE2 3.03Å; E505-H518 PolarHBondContact OE1-NE2 2.82Å
506	R	87.2	Confident	83.6	Confident	60 Å²	60	72.2 Å²	72.2	23%	0.226	36%	0.361	C	S	.	.	H	α-helix	trans	-58.9	-46.2	171.6	-67.7	-174.3	-167.2	117.1	21.2	111.7	Q485 P486 L502 D503 R508 Q509 E510	Q485-R506 HydrophobicContact CB-CG 4.31Å; Q485-R506 HydrophobicContact CG-CG 4.45Å; P486-R506 HydrophobicContact CG-CG 3.95Å; P486-R506 PolarHBondContact O-NE 3.31Å; P486-R506 PolarHBondContact O-NH2 3.03Å; L502-R506 PolarHBondContact O-N 3.28Å; L502-R506 VanDerWaalsContact O-N 3.17Å; D503-R506 PolarHBondContact O-N 2.97Å; D503-R506 IonicContact OD1-CZ 3.83Å; D503-R506 IonicContact OD1-NH1 3.59Å; D503-R506 PolarHBondContact OD1-NH1 3.2Å; D503-R506 IonicContact OD1-NH2 2.89Å; R506-R508 VanDerWaalsContact C-N 3.3Å; R506-R508 PolarHBondContact O-N 2.83Å; R506-Q509 WeakPolarHBondContact O-CB 3.29Å; R506-Q509 PolarHBondContact O-N 3.03Å; R506-E510 WeakPolarHBondContact O-CG 3.26Å; R506-E510 PolarHBondContact O-N 3.25Å
507	L	86.5	Confident	84.1	Confident	94 Å²	94	71.7 Å²	71.7	49%	0.492	36%	0.358	S	S	.	.	H	α-helix	trans	-61.6	-37.7	175.9	-66.1	167.8	0	0	0	111.8	D503 R504 E505 E510 Q511	D503-L507 WeakPolarHBondContact O-CG 3.44Å; D503-L507 PolarHBondContact O-N 3.04Å; R504-L507 WeakPolarHBondContact O-CB 3.31Å; R504-L507 PolarHBondContact O-N 3.45Å; E505-L507 VanDerWaalsContact C-N 3.35Å; E505-L507 PolarHBondContact O-N 3.15Å; L507-E510 PolarHBondContact O-N 3.25Å; L507-Q511 WeakPolarHBondContact O-CB 3.11Å; L507-Q511 WeakPolarHBondContact O-CG 3.25Å; L507-Q511 PolarHBondContact O-N 2.85Å
508	R	87.4	Confident	84.5	Confident	77 Å²	77	69 Å²	69	29%	0.291	33%	0.331	S	S	.	.	H	α-helix	trans	-66.4	-36.1	175.5	-164.6	179.9	70.3	111.1	5.2	112.3	R504 E505 R506 Q512 I589 L591	R504-R508 PolarHBondContact O-N 2.8Å; E505-R508 VanDerWaalsContact CD-NH2 3.32Å; E505-R508 WeakPolarHBondContact O-CB 3.33Å; E505-R508 PolarHBondContact O-N 2.86Å; E505-R508 IonicContact OE1-CZ 2.69Å; E505-R508 IonicContact OE1-NE 3.58Å; E505-R508 IonicContact OE1-NH2 3.86Å; E505-R508 PolarHBondContact OE1-NH2 2.74Å; E505-R508 IonicContact OE2-CZ 2.81Å; E505-R508 IonicContact OE2-NE 2.77Å; E505-R508 PolarHBondContact OE2-NE 3.3Å; E505-R508 IonicContact OE2-NH2 2.85Å; E505-R508 PolarHBondContact OE2-NH2 2.81Å; E505-R508 VanDerWaalsContact OE2-NH2 3.14Å; R506-R508 VanDerWaalsContact C-N 3.3Å; R506-R508 PolarHBondContact O-N 2.83Å; R508-Q512 WeakPolarHBondContact O-CG 3.19Å; R508-Q512 PolarHBondContact O-N 2.97Å; R508-I589 PolarHBondContact NH1-O 2.95Å; R508-I589 PolarHBondContact NH2-O 3.17Å; R508-L591 HydrophobicContact CG-CD1 4.47Å
509	Q	85.6	Confident	84.6	Confident	9 Å²	9	66.5 Å²	66.5	4%	0.042	32%	0.316	C	S	.	.	H	α-helix	trans	-69.1	-45.5	173.2	-176.9	-176.1	0.6	0	0	112.1	F484 E505 R506 Q511 Q512 I516 L591	F484-Q509 PolarHBondContact O-NE2 2.69Å; E505-Q509 PolarHBondContact O-N 2.98Å; R506-Q509 WeakPolarHBondContact O-CB 3.29Å; R506-Q509 PolarHBondContact O-N 3.03Å; Q509-Q511 VanDerWaalsContact C-N 3.29Å; Q509-Q511 PolarHBondContact O-N 3.49Å; Q509-Q512 PolarHBondContact O-N 2.86Å; Q509-Q512 VanDerWaalsContact O-N 3.11Å; Q509-I516 PolarHBondContact NE2-O 3.31Å; Q509-L591 HydrophobicContact CB-CD1 4.04Å
510	E	83.6	Confident	84.4	Confident	106 Å²	106	61.6 Å²	61.6	50%	0.495	30%	0.296	S	S	.	.	H	α-helix	trans	-58.5	-40.8	176.5	-72.3	166.9	-175.6	0	0	111.6	Q485 R506 L507 Q512 G513	Q485-E510 PolarHBondContact NE2-OE1 3.34Å; R506-E510 WeakPolarHBondContact O-CG 3.26Å; R506-E510 PolarHBondContact O-N 3.25Å; L507-E510 PolarHBondContact O-N 3.25Å; E510-Q512 VanDerWaalsContact C-N 3.26Å; E510-Q512 PolarHBondContact O-N 3.33Å; E510-G513 PolarHBondContact O-N 3.49Å
511	Q	83.6	Confident	84.4	Confident	162 Å²	162	56.6 Å²	56.6	76%	0.757	27%	0.27	S	S	*	.	H	α-helix	trans	-65	-22.7	176.6	-74.9	170.1	13.2	0	0	114.6	L507 Q509 G513	L507-Q511 WeakPolarHBondContact O-CB 3.11Å; L507-Q511 WeakPolarHBondContact O-CG 3.25Å; L507-Q511 PolarHBondContact O-N 2.85Å; Q509-Q511 VanDerWaalsContact C-N 3.29Å; Q509-Q511 PolarHBondContact O-N 3.49Å; Q511-G513 VanDerWaalsContact C-N 3.35Å
512	Q	80.8	Confident	84.4	Confident	68 Å²	68	57.3 Å²	57.3	32%	0.318	27%	0.271	S	S	.	.	H	α-helix	trans	-86	-9.7	-179.6	-72	-79.8	-14.4	0	0	113	R508 Q509 E510 I516 L591 N592	R508-Q512 WeakPolarHBondContact O-CG 3.19Å; R508-Q512 PolarHBondContact O-N 2.97Å; Q509-Q512 PolarHBondContact O-N 2.86Å; Q509-Q512 VanDerWaalsContact O-N 3.11Å; E510-Q512 VanDerWaalsContact C-N 3.26Å; E510-Q512 PolarHBondContact O-N 3.33Å; Q512-I516 HydrophobicContact CB-CD1 3.43Å; Q512-I516 VanDerWaalsContact CB-CD1 3.43Å; Q512-I516 VanDerWaalsContact O-CD1 3.29Å; Q512-I516 WeakPolarHBondContact O-CD1 3.16Å; Q512-L591 HydrophobicContact CB-CB 4.48Å; Q512-L591 HydrophobicContact CG-CB 4.04Å; Q512-N592 PolarHBondContact NE2-OD1 2.95Å; Q512-N592 PolarHBondContact OE1-OD1 3.2Å; Q512-N592 VanDerWaalsContact OE1-OD1 3.08Å
513	G	74.3	Confident	84.6	Confident	34 Å²	34	59 Å²	59	35%	0.351	28%	0.278	S	S	.	.			trans	107.2	158.2	168.8	0	0	0	0	0	115.3	E510 Q511 W515	E510-G513 PolarHBondContact O-N 3.49Å; Q511-G513 VanDerWaalsContact C-N 3.35Å; G513-W515 PolarHBondContact O-N 2.62Å
514	D	67.2	Low	84.7	Confident	92 Å²	92	56.6 Å²	56.6	49%	0.492	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48.1	137.5	176.5	-69.9	29.8	0	0	0	111.5	K477 F481	K477-D514 WeakPolarHBondContact CE-OD2 3.38Å; K477-D514 IonicContact NZ-OD2 3.9Å; K477-D514 PolarHBondContact NZ-OD2 2.92Å; F481-D514 HydrophobicContact CE1-CB 4.18Å; F481-D514 HydrophobicContact CZ-CB 4.17Å
515	W	82.7	Confident	84.6	Confident	155 Å²	155	51.2 Å²	51.2	59%	0.587	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	77	28.9	174.8	-47	93.3	0	0	0	116.9	F481 F484 G513 R577	F481-W515 HydrophobicContact CE1-CD2 4.04Å; F481-W515 HydrophobicContact CE1-CE3 4.36Å; F481-W515 HydrophobicContact CE1-CG 4.21Å; F481-W515 AromaticContact CZ-CD2 3.89Å; F481-W515 HydrophobicContact CZ-CD2 3.89Å; F481-W515 AromaticContact CZ-CE2 3.67Å; F481-W515 HydrophobicContact CZ-CE3 4.33Å; F481-W515 HydrophobicContact CZ-CG 4.31Å; F481-W515 HydrophobicContact CZ-CH2 4.38Å; F481-W515 AromaticContact CZ-CZ2 3.94Å; F481-W515 HydrophobicContact CZ-CZ2 3.94Å; F481-W515 AromaticContact CZ-NE1 3.92Å; F484-W515 AromaticContact CE2-CE3 3.82Å; F484-W515 HydrophobicContact CE2-CE3 3.82Å; F484-W515 HydrophobicContact CE2-CZ3 4.03Å; F484-W515 HydrophobicContact CZ-CE3 4.21Å; F484-W515 HydrophobicContact CZ-CZ3 4.24Å; G513-W515 PolarHBondContact O-N 2.62Å; W515-R577 WeakPolarHBondContact O-CD 3.4Å
516	I	89.8	Confident	84.6	Confident	6 Å²	6	56.5 Å²	56.5	3%	0.031	27%	0.266	C	S	.	.			trans	-95.1	133.7	161.5	-66.8	164.8	0	0	0	109.7	Q509 Q512 L591 P593	Q509-I516 PolarHBondContact NE2-O 3.31Å; Q512-I516 HydrophobicContact CB-CD1 3.43Å; Q512-I516 VanDerWaalsContact CB-CD1 3.43Å; Q512-I516 VanDerWaalsContact O-CD1 3.29Å; Q512-I516 WeakPolarHBondContact O-CD1 3.16Å; I516-L591 HydrophobicContact CG2-CB 4.48Å; I516-L591 HydrophobicContact CG2-CD2 4.12Å; I516-P593 HydrophobicContact CD1-CG 4.34Å
517	I	91	Very high	84.8	Confident	10 Å²	10	55.9 Å²	55.9	5%	0.051	26%	0.263	C	S	.	.	B	Isolated β-bridge	trans	-104.5	117.9	-177.6	-59.8	168.4	0	0	0	108.1	F484 F523 R524 V574 R577 T578 G579	F484-I517 HydrophobicContact CD1-CD1 4.4Å; F484-I517 HydrophobicContact CD1-CG1 3.8Å; F484-I517 HydrophobicContact CE1-CD1 4.27Å; F484-I517 HydrophobicContact CE1-CG1 4.11Å; F484-I517 HydrophobicContact CG-CG1 4.21Å; I517-F523 HydrophobicContact CD1-CD1 4.08Å; I517-F523 HydrophobicContact CD1-CE1 3.8Å; I517-F523 HydrophobicContact CG2-CD1 3.92Å; I517-R524 HydrophobicContact CG2-CB 4.15Å; I517-V574 HydrophobicContact CD1-CG1 3.97Å; I517-R577 HydrophobicContact CD1-CB 4.33Å; I517-R577 PolarHBondContact N-O 3.08Å; I517-T578 WeakPolarHBondContact O-CA 3.28Å; I517-G579 PolarHBondContact O-N 3.22Å
518	H	88.8	Confident	84.8	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	24%	0.242	C	C	.	.			trans	-73.4	138.8	175.1	-173.9	-75.1	0	0	0	110	F484 F496 E505 C520 S521	F484-H518 PolarHBondContact O-N 3.09Å; F496-H518 AromaticContact CZ-CE1 3.93Å; F496-H518 AromaticContact CZ-NE2 3.64Å; E505-H518 IonicContact OE1-CD2 2.67Å; E505-H518 PolarHBondContact OE1-CD2 3.04Å; E505-H518 VanDerWaalsContact OE1-CD2 3.29Å; E505-H518 IonicContact OE1-NE2 3.03Å; E505-H518 PolarHBondContact OE1-NE2 2.82Å; H518-C520 PolarHBondContact ND1-N 3.03Å; H518-C520 PolarHBondContact O-N 3.33Å; H518-S521 WeakPolarHBondContact O-CB 3.35Å; H518-S521 PolarHBondContact O-N 3.01Å; H518-S521 PolarHBondContact O-OG 3.09Å
519	P	84.8	Confident	84.7	Confident	27 Å²	27	50.9 Å²	50.9	18%	0.175	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58	-48.4	-178.9	19.7	-31.5	0	0	0	112.3	S521 R524 G579 I581 I589	P519-S521 PolarHBondContact O-N 2.73Å; P519-R524 WeakPolarHBondContact O-CB 3.42Å; P519-R524 WeakPolarHBondContact O-CG 3.23Å; P519-G579 WeakPolarHBondContact CG-O 3.25Å; P519-I581 HydrophobicContact CB-CD1 4.39Å; P519-I581 HydrophobicContact CB-CG1 4.37Å; P519-I581 HydrophobicContact CG-CD1 4.2Å; P519-I581 HydrophobicContact CG-CG1 3.91Å; P519-I589 HydrophobicContact CG-CG2 4.29Å
520	C	81.5	Confident	84.9	Confident	14 Å²	14	54.3 Å²	54.3	10%	0.095	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.4	25.6	174.8	-44.2	0	0	0	0	115.1	L491 H518	L491-C520 HydrophobicContact CD2-CB 4.39Å; H518-C520 PolarHBondContact ND1-N 3.03Å; H518-C520 PolarHBondContact O-N 3.33Å
521	S	86.9	Confident	85.2	Confident	2 Å²	2	49.3 Å²	49.3	1%	0.014	24%	0.24	C	C	.	.	B	Isolated β-bridge	trans	-84.1	155.8	177.4	66.3	0	0	0	0	112.6	F484 Q485 H518 P519 F523 R524 F525	F484-S521 VanDerWaalsContact C-CB 3.46Å; F484-S521 WeakPolarHBondContact O-CB 3.27Å; Q485-S521 WeakPolarHBondContact O-CA 3.38Å; Q485-S521 WeakPolarHBondContact O-CB 3.07Å; H518-S521 WeakPolarHBondContact O-CB 3.35Å; H518-S521 PolarHBondContact O-N 3.01Å; H518-S521 PolarHBondContact O-OG 3.09Å; P519-S521 PolarHBondContact O-N 2.73Å; S521-F523 VanDerWaalsContact C-N 3.32Å; S521-R524 PolarHBondContact O-N 3.02Å; S521-R524 VanDerWaalsContact OG-CB 3.29Å; S521-R524 WeakPolarHBondContact OG-CB 3.45Å; S521-R524 PolarHBondContact OG-N 3.07Å; S521-R524 VanDerWaalsContact OG-N 3.15Å; S521-F525 PolarHBondContact O-N 3.39Å
522	N	85.6	Confident	85.3	Confident	40 Å²	40	43 Å²	43	21%	0.214	21%	0.212	C	C	.	.	H	α-helix	trans	-65.7	-36.1	173.5	-85	9.9	0	0	0	111.6	F483 T487 N489 Y526	F483-N522 HydrophobicContact CD2-CB 3.77Å; F483-N522 HydrophobicContact CE2-CB 3.65Å; T487-N522 HydrophobicContact CG2-CB 4.07Å; T487-N522 VanDerWaalsContact CG2-CG 3.47Å; T487-N522 WeakPolarHBondContact CG2-OD1 3.45Å; T487-N522 PolarHBondContact OG1-OD1 2.99Å; N489-N522 PolarHBondContact ND2-OD1 3.44Å; N522-Y526 WeakPolarHBondContact O-CD2 3.44Å; N522-Y526 PolarHBondContact O-N 3.17Å; N522-Y526 VanDerWaalsContact O-N 3.11Å
523	F	90.3	Very high	85.7	Confident	39 Å²	39	44.4 Å²	44.4	17%	0.171	22%	0.221	C	C	.	.	H	α-helix	trans	-55.8	-53	173.7	174.7	-91.4	0	0	0	111	F483 F484 I517 S521 F525 Y526 W527 V574	F483-F523 HydrophobicContact CD1-CB 3.64Å; F483-F523 AromaticContact CD1-CD2 3.76Å; F483-F523 HydrophobicContact CD1-CD2 3.76Å; F483-F523 HydrophobicContact CD1-CG 4.2Å; F483-F523 HydrophobicContact CE1-CB 3.85Å; F483-F523 AromaticContact CE1-CD2 3.7Å; F483-F523 HydrophobicContact CE1-CD2 3.7Å; F483-F523 HydrophobicContact CE1-CG 4.25Å; F483-F523 HydrophobicContact CG-CB 4.08Å; F483-F523 HydrophobicContact CZ-CB 4.46Å; F483-F523 VanDerWaalsContact O-CB 3.3Å; F483-F523 WeakPolarHBondContact O-CB 3.37Å; F483-F523 PolarHBondContact O-N 2.58Å; F484-F523 HydrophobicContact CD1-CB 3.69Å; F484-F523 AromaticContact CD1-CD1 3.86Å; F484-F523 HydrophobicContact CD1-CD1 3.86Å; F484-F523 HydrophobicContact CD1-CD2 4.05Å; F484-F523 AromaticContact CD1-CG 3.57Å; F484-F523 HydrophobicContact CD1-CG 3.57Å; F484-F523 HydrophobicContact CE1-CB 4.17Å; F484-F523 AromaticContact CE1-CD1 3.84Å; F484-F523 HydrophobicContact CE1-CD1 3.84Å; F484-F523 AromaticContact CE1-CD2 3.61Å; F484-F523 HydrophobicContact CE1-CD2 3.61Å; F484-F523 HydrophobicContact CE1-CE1 4.17Å; F484-F523 AromaticContact CE1-CE2 3.95Å; F484-F523 HydrophobicContact CE1-CE2 3.95Å; F484-F523 AromaticContact CE1-CG 3.57Å; F484-F523 HydrophobicContact CE1-CG 3.57Å; F484-F523 HydrophobicContact CE1-CZ 4.22Å; I517-F523 HydrophobicContact CD1-CD1 4.08Å; I517-F523 HydrophobicContact CD1-CE1 3.8Å; I517-F523 HydrophobicContact CG2-CD1 3.92Å; S521-F523 VanDerWaalsContact C-N 3.32Å; F523-F525 PolarHBondContact O-N 3.1Å; F523-Y526 PolarHBondContact O-N 2.98Å; F523-W527 HydrophobicContact CD1-CB 4.44Å; F523-W527 HydrophobicContact CE1-CB 4.04Å; F523-W527 HydrophobicContact CE1-CD2 4.42Å; F523-W527 HydrophobicContact CE1-CG 4.2Å; F523-W527 HydrophobicContact CE2-CE3 4.41Å; F523-W527 HydrophobicContact CZ-CB 4.29Å; F523-W527 HydrophobicContact CZ-CD2 4.13Å; F523-W527 AromaticContact CZ-CE3 3.82Å; F523-W527 HydrophobicContact CZ-CE3 3.82Å; F523-W527 HydrophobicContact CZ-CG 4.33Å; F523-W527 VanDerWaalsContact O-CB 3.32Å; F523-W527 WeakPolarHBondContact O-CB 3.34Å; F523-W527 PolarHBondContact O-N 3.32Å; F523-V574 HydrophobicContact CE1-CG1 4.13Å
524	R	87.6	Confident	86.5	Confident	18 Å²	18	44.5 Å²	44.5	7%	0.068	21%	0.213	C	C	.	.	H	α-helix	trans	-60.5	-46.9	-176	-176.5	65.5	-163.2	-162.7	11.6	111.3	I517 P519 S521 Y526 W527 D528 N575 T578	I517-R524 HydrophobicContact CG2-CB 4.15Å; P519-R524 WeakPolarHBondContact O-CB 3.42Å; P519-R524 WeakPolarHBondContact O-CG 3.23Å; S521-R524 PolarHBondContact O-N 3.02Å; S521-R524 VanDerWaalsContact OG-CB 3.29Å; S521-R524 WeakPolarHBondContact OG-CB 3.45Å; S521-R524 PolarHBondContact OG-N 3.07Å; S521-R524 VanDerWaalsContact OG-N 3.15Å; R524-Y526 PolarHBondContact O-N 2.91Å; R524-W527 WeakPolarHBondContact O-CB 3.3Å; R524-W527 PolarHBondContact O-N 3.33Å; R524-D528 WeakPolarHBondContact CD-OD2 3.33Å; R524-D528 WeakPolarHBondContact CG-OD2 3.17Å; R524-D528 IonicContact CZ-OD1 2.67Å; R524-D528 IonicContact CZ-OD2 3.78Å; R524-D528 VanDerWaalsContact NE-CG 3.28Å; R524-D528 IonicContact NE-OD1 3.4Å; R524-D528 PolarHBondContact NE-OD1 3.25Å; R524-D528 IonicContact NE-OD2 2.96Å; R524-D528 PolarHBondContact NE-OD2 2.82Å; R524-D528 IonicContact NH2-OD1 2.73Å; R524-D528 PolarHBondContact NH2-OD1 3.02Å; R524-D528 IonicContact NH2-OD2 3.02Å; R524-D528 VanDerWaalsContact O-CG 3.3Å; R524-D528 PolarHBondContact O-N 3.43Å; R524-N575 PolarHBondContact NH1-OD1 2.95Å; R524-N575 PolarHBondContact NH2-OD1 3.41Å; R524-T578 HydrophobicContact CG-CG2 4.33Å; R524-T578 PolarHBondContact NH1-OG1 3.44Å
525	F	84	Confident	87.5	Confident	51 Å²	51	40.1 Å²	40.1	22%	0.224	19%	0.19	C	C	.	.	H	α-helix	trans	-55.6	-45.9	175.7	178.2	-93.7	0	0	0	113.6	S521 F523 L529 W665 F668	S521-F525 PolarHBondContact O-N 3.39Å; F523-F525 PolarHBondContact O-N 3.1Å; F525-L529 PolarHBondContact O-N 3.5Å; F525-W665 HydrophobicContact CD2-CH2 4.01Å; F525-W665 AromaticContact CD2-CZ2 3.87Å; F525-W665 HydrophobicContact CD2-CZ2 3.87Å; F525-W665 AromaticContact CE1-CH2 3.93Å; F525-W665 HydrophobicContact CE1-CH2 3.93Å; F525-W665 HydrophobicContact CE2-CE3 4.29Å; F525-W665 AromaticContact CE2-CH2 3.33Å; F525-W665 HydrophobicContact CE2-CH2 3.33Å; F525-W665 AromaticContact CE2-CZ2 3.65Å; F525-W665 HydrophobicContact CE2-CZ2 3.65Å; F525-W665 AromaticContact CE2-CZ3 3.68Å; F525-W665 HydrophobicContact CE2-CZ3 3.68Å; F525-W665 HydrophobicContact CG-CZ2 4.41Å; F525-W665 AromaticContact CZ-CH2 3.29Å; F525-W665 HydrophobicContact CZ-CH2 3.29Å; F525-W665 HydrophobicContact CZ-CZ2 4.01Å; F525-W665 AromaticContact CZ-CZ3 3.7Å; F525-W665 HydrophobicContact CZ-CZ3 3.7Å; F525-F668 HydrophobicContact CD2-CZ 4.47Å; F525-F668 HydrophobicContact CE2-CD1 4.24Å; F525-F668 AromaticContact CE2-CE1 3.86Å; F525-F668 HydrophobicContact CE2-CE1 3.86Å; F525-F668 HydrophobicContact CE2-CE2 4.36Å; F525-F668 AromaticContact CE2-CZ 3.93Å; F525-F668 HydrophobicContact CE2-CZ 3.93Å; F525-F668 HydrophobicContact CZ-CE1 4.32Å; F525-F668 HydrophobicContact CZ-CZ 4.49Å
526	Y	88.3	Confident	87.8	Confident	123 Å²	123	36.2 Å²	36.2	48%	0.482	18%	0.18	S	C	.	.	H	α-helix	trans	-75	-31.2	178	-73.8	-62.5	0	0	0	113	F483 N522 F523 R524 V530	F483-Y526 AromaticContact CE2-CD2 3.97Å; F483-Y526 HydrophobicContact CE2-CD2 3.97Å; F483-Y526 HydrophobicContact CE2-CE2 4.39Å; F483-Y526 AromaticContact CZ-CD2 3.82Å; F483-Y526 HydrophobicContact CZ-CD2 3.82Å; N522-Y526 WeakPolarHBondContact O-CD2 3.44Å; N522-Y526 PolarHBondContact O-N 3.17Å; N522-Y526 VanDerWaalsContact O-N 3.11Å; F523-Y526 PolarHBondContact O-N 2.98Å; R524-Y526 PolarHBondContact O-N 2.91Å; Y526-V530 WeakPolarHBondContact O-CG2 3.41Å; Y526-V530 PolarHBondContact O-N 2.85Å; Y526-V530 VanDerWaalsContact O-N 3.14Å
527	W	90.5	Very high	87.8	Confident	46 Å²	46	37.6 Å²	37.6	17%	0.174	19%	0.192	C	C	.	.	H	α-helix	trans	-62.9	-52.6	173	-177.1	-95.4	0	0	0	110.6	F523 R524 L529 V530 M531 I570 D571 V574	F523-W527 HydrophobicContact CD1-CB 4.44Å; F523-W527 HydrophobicContact CE1-CB 4.04Å; F523-W527 HydrophobicContact CE1-CD2 4.42Å; F523-W527 HydrophobicContact CE1-CG 4.2Å; F523-W527 HydrophobicContact CE2-CE3 4.41Å; F523-W527 HydrophobicContact CZ-CB 4.29Å; F523-W527 HydrophobicContact CZ-CD2 4.13Å; F523-W527 AromaticContact CZ-CE3 3.82Å; F523-W527 HydrophobicContact CZ-CE3 3.82Å; F523-W527 HydrophobicContact CZ-CG 4.33Å; F523-W527 VanDerWaalsContact O-CB 3.32Å; F523-W527 WeakPolarHBondContact O-CB 3.34Å; F523-W527 PolarHBondContact O-N 3.32Å; R524-W527 WeakPolarHBondContact O-CB 3.3Å; R524-W527 PolarHBondContact O-N 3.33Å; W527-L529 VanDerWaalsContact C-N 3.26Å; W527-L529 PolarHBondContact O-N 3.45Å; W527-V530 WeakPolarHBondContact O-CA 3.25Å; W527-V530 WeakPolarHBondContact O-CB 3.4Å; W527-V530 PolarHBondContact O-N 3.49Å; W527-M531 HydrophobicContact CG-CG 4.43Å; W527-M531 HydrophobicContact CZ2-SD 3.83Å; W527-M531 WeakPolarHBondContact O-CG 3.37Å; W527-M531 PolarHBondContact O-N 2.93Å; W527-I570 HydrophobicContact CH2-CB 4.3Å; W527-I570 HydrophobicContact CH2-CG2 3.59Å; W527-I570 HydrophobicContact CZ2-CG2 3.97Å; W527-D571 HydrophobicContact CZ2-CB 4.15Å; W527-D571 PolarHBondContact NE1-OD1 3.37Å; W527-V574 HydrophobicContact CD2-CG2 4.5Å; W527-V574 HydrophobicContact CG-CG1 4.5Å; W527-V574 HydrophobicContact CZ2-CG2 4.08Å
528	D	86.1	Confident	87.7	Confident	9 Å²	9	37.1 Å²	37.1	5%	0.048	19%	0.19	C	C	.	.	H	α-helix	trans	-62.2	-33	179.7	-64.7	-30.5	0	0	0	112.1	R524 M531 L532 Y661	R524-D528 WeakPolarHBondContact CD-OD2 3.33Å; R524-D528 WeakPolarHBondContact CG-OD2 3.17Å; R524-D528 IonicContact CZ-OD1 2.67Å; R524-D528 IonicContact CZ-OD2 3.78Å; R524-D528 VanDerWaalsContact NE-CG 3.28Å; R524-D528 IonicContact NE-OD1 3.4Å; R524-D528 PolarHBondContact NE-OD1 3.25Å; R524-D528 IonicContact NE-OD2 2.96Å; R524-D528 PolarHBondContact NE-OD2 2.82Å; R524-D528 IonicContact NH2-OD1 2.73Å; R524-D528 PolarHBondContact NH2-OD1 3.02Å; R524-D528 IonicContact NH2-OD2 3.02Å; R524-D528 VanDerWaalsContact O-CG 3.3Å; R524-D528 PolarHBondContact O-N 3.43Å; D528-M531 PolarHBondContact O-N 3.49Å; D528-L532 WeakPolarHBondContact O-CB 3.27Å; D528-L532 PolarHBondContact O-N 2.83Å; D528-Y661 HydrophobicContact CB-CD1 4.06Å; D528-Y661 HydrophobicContact CB-CE1 4.15Å; D528-Y661 WeakPolarHBondContact OD1-CE1 3.49Å
529	L	86.3	Confident	87.7	Confident	57 Å²	57	37.2 Å²	37.2	30%	0.298	19%	0.19	S	C	.	.	H	α-helix	trans	-64.1	-40.9	171.1	-178.9	60.6	0	0	0	112.7	F525 W527 L533 W665	F525-L529 PolarHBondContact O-N 3.5Å; W527-L529 VanDerWaalsContact C-N 3.26Å; W527-L529 PolarHBondContact O-N 3.45Å; L529-L533 HydrophobicContact CD1-CD1 4.44Å; L529-L533 HydrophobicContact CG-CD1 4.41Å; L529-L533 WeakPolarHBondContact O-CG 3.24Å; L529-L533 PolarHBondContact O-N 2.9Å; L529-L533 VanDerWaalsContact O-N 3.11Å; L529-W665 HydrophobicContact CB-CH2 4.01Å; L529-W665 HydrophobicContact CB-CZ2 3.86Å; L529-W665 HydrophobicContact CD1-CH2 3.94Å; L529-W665 HydrophobicContact CD1-CZ2 4.37Å; L529-W665 HydrophobicContact CD2-CH2 4.42Å; L529-W665 HydrophobicContact CG-CH2 4.34Å
530	V	90.4	Very high	88	Confident	82 Å²	82	39.8 Å²	39.8	50%	0.497	20%	0.201	S	C	.	.	H	α-helix	trans	-68.5	-42.7	175.4	170.1	0	0	0	0	110.7	Y526 W527 L533 L534	Y526-V530 WeakPolarHBondContact O-CG2 3.41Å; Y526-V530 PolarHBondContact O-N 2.85Å; Y526-V530 VanDerWaalsContact O-N 3.14Å; W527-V530 WeakPolarHBondContact O-CA 3.25Å; W527-V530 WeakPolarHBondContact O-CB 3.4Å; W527-V530 PolarHBondContact O-N 3.49Å; V530-L533 PolarHBondContact O-N 3.46Å; V530-L534 WeakPolarHBondContact O-CB 3.36Å; V530-L534 PolarHBondContact O-N 2.86Å
531	M	89.2	Confident	88.4	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-60.9	-44.5	175.2	-64.5	-49.5	-59.7	0	0	111.3	W527 D528 L534 L535 V567 F568 D571 Y661	W527-M531 HydrophobicContact CG-CG 4.43Å; W527-M531 HydrophobicContact CZ2-SD 3.83Å; W527-M531 WeakPolarHBondContact O-CG 3.37Å; W527-M531 PolarHBondContact O-N 2.93Å; D528-M531 PolarHBondContact O-N 3.49Å; M531-L534 PolarHBondContact O-N 3.1Å; M531-L535 WeakPolarHBondContact O-CB 3.43Å; M531-L535 PolarHBondContact O-N 2.86Å; M531-V567 HydrophobicContact CE-CG1 4.19Å; M531-V567 HydrophobicContact SD-CG1 3.63Å; M531-F568 HydrophobicContact CE-CD1 3.31Å; M531-F568 HydrophobicContact CE-CE1 3.42Å; M531-F568 VanDerWaalsContact CE-CE1 3.42Å; M531-F568 HydrophobicContact CE-CG 4.1Å; M531-F568 HydrophobicContact CE-CZ 4.27Å; M531-D571 HydrophobicContact CE-CB 3.65Å; M531-D571 HydrophobicContact SD-CB 4.08Å; M531-Y661 HydrophobicContact CB-CE2 3.97Å
532	L	86.2	Confident	88.4	Confident	29 Å²	29	42.3 Å²	42.3	15%	0.152	21%	0.213	C	C	.	.	H	α-helix	trans	-58.2	-48.9	176.3	177.4	62.1	0	0	0	112.1	D528 L535 I536 L658	D528-L532 WeakPolarHBondContact O-CB 3.27Å; D528-L532 PolarHBondContact O-N 2.83Å; L532-L535 PolarHBondContact O-N 2.94Å; L532-I536 HydrophobicContact CD1-CD1 3.81Å; L532-I536 HydrophobicContact CD1-CG1 4.32Å; L532-I536 HydrophobicContact CG-CD1 4Å; L532-I536 VanDerWaalsContact O-CG1 3.29Å; L532-I536 WeakPolarHBondContact O-CG1 3.5Å; L532-I536 PolarHBondContact O-N 3.48Å; L532-L658 HydrophobicContact CD1-CD1 3.29Å
533	L	89.3	Confident	88.6	Confident	99 Å²	99	40.7 Å²	40.7	52%	0.518	21%	0.205	S	C	.	.	H	α-helix	trans	-64.8	-44.6	179	-71.6	170	0	0	0	112.2	L529 V530 L535 A537	L529-L533 HydrophobicContact CD1-CD1 4.44Å; L529-L533 HydrophobicContact CG-CD1 4.41Å; L529-L533 WeakPolarHBondContact O-CG 3.24Å; L529-L533 PolarHBondContact O-N 2.9Å; L529-L533 VanDerWaalsContact O-N 3.11Å; V530-L533 PolarHBondContact O-N 3.46Å; L533-L535 VanDerWaalsContact C-N 3.33Å; L533-L535 PolarHBondContact O-N 2.9Å; L533-A537 WeakPolarHBondContact O-CB 3.28Å; L533-A537 PolarHBondContact O-N 2.88Å; L533-A537 VanDerWaalsContact O-N 3.08Å
534	L	90.1	Very high	88.6	Confident	36 Å²	36	39.8 Å²	39.8	19%	0.188	20%	0.202	C	C	.	.	H	α-helix	trans	-63.5	-40.6	176.6	179	63.1	0	0	0	111.5	V530 M531 A537 N538 V567 F568	V530-L534 WeakPolarHBondContact O-CB 3.36Å; V530-L534 PolarHBondContact O-N 2.86Å; M531-L534 PolarHBondContact O-N 3.1Å; L534-A537 PolarHBondContact O-N 2.84Å; L534-N538 PolarHBondContact O-N 3.3Å; L534-N538 PolarHBondContact O-ND2 3.08Å; L534-V567 HydrophobicContact CD2-CB 3.78Å; L534-V567 HydrophobicContact CD2-CG1 3.57Å; L534-F568 HydrophobicContact CD2-CD2 4.23Å; L534-F568 HydrophobicContact CD2-CE2 3.75Å; L534-F568 HydrophobicContact CD2-CZ 4.08Å; L534-F568 HydrophobicContact CG-CE2 3.81Å; L534-F568 HydrophobicContact CG-CZ 4Å
535	L	88.7	Confident	88.6	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-66	-48.5	179.2	-170.6	165	0	0	0	111	M531 L532 L533 A537 N538 L539 F568 R654 R657 L658 Y661	M531-L535 WeakPolarHBondContact O-CB 3.43Å; M531-L535 PolarHBondContact O-N 2.86Å; L532-L535 PolarHBondContact O-N 2.94Å; L533-L535 VanDerWaalsContact C-N 3.33Å; L533-L535 PolarHBondContact O-N 2.9Å; L535-A537 VanDerWaalsContact C-N 3.28Å; L535-A537 PolarHBondContact O-N 2.85Å; L535-N538 WeakPolarHBondContact O-CB 3.5Å; L535-N538 PolarHBondContact O-N 2.93Å; L535-N538 VanDerWaalsContact O-N 3.1Å; L535-L539 HydrophobicContact CD2-CD1 3.47Å; L535-L539 VanDerWaalsContact CD2-CD1 3.47Å; L535-L539 HydrophobicContact CD2-CG 3.77Å; L535-L539 WeakPolarHBondContact O-CG 3.4Å; L535-L539 PolarHBondContact O-N 3Å; L535-F568 HydrophobicContact CB-CE1 4.29Å; L535-F568 HydrophobicContact CB-CZ 3.98Å; L535-F568 HydrophobicContact CD1-CE1 4.49Å; L535-F568 HydrophobicContact CG-CZ 4.44Å; L535-R654 HydrophobicContact CD1-CB 4.42Å; L535-R654 WeakPolarHBondContact CD1-O 3.38Å; L535-R654 HydrophobicContact CG-CB 4.33Å; L535-R657 HydrophobicContact CD1-CB 3.95Å; L535-L658 HydrophobicContact CD1-CB 4.19Å; L535-L658 HydrophobicContact CD2-CB 3.7Å; L535-L658 HydrophobicContact CD2-CD1 4.21Å; L535-L658 HydrophobicContact CD2-CD2 4.21Å; L535-L658 HydrophobicContact CD2-CG 4.25Å; L535-Y661 HydrophobicContact CD1-CE2 4.39Å
536	I	87.8	Confident	88.7	Confident	73 Å²	73	37 Å²	37	37%	0.374	19%	0.192	S	C	.	.	H	α-helix	trans	-57.1	-43.9	175.3	-70	165.7	0	0	0	110.6	L532 N538 L539 I540 L658	L532-I536 HydrophobicContact CD1-CD1 3.81Å; L532-I536 HydrophobicContact CD1-CG1 4.32Å; L532-I536 HydrophobicContact CG-CD1 4Å; L532-I536 VanDerWaalsContact O-CG1 3.29Å; L532-I536 WeakPolarHBondContact O-CG1 3.5Å; L532-I536 PolarHBondContact O-N 3.48Å; I536-N538 PolarHBondContact O-N 2.85Å; I536-L539 PolarHBondContact O-N 2.83Å; I536-I540 HydrophobicContact CG2-CD1 3.96Å; I536-I540 WeakPolarHBondContact O-CG1 3.48Å; I536-I540 PolarHBondContact O-N 3.23Å; I536-L658 HydrophobicContact CG1-CD1 4.46Å
537	A	90	Very high	88.7	Confident	34 Å²	34	31.1 Å²	31.1	28%	0.281	17%	0.169	S	C	.	.	H	α-helix	trans	-60.4	-44.9	175.2	0	0	0	0	0	112.1	L533 L534 L535 I540 I541	L533-A537 WeakPolarHBondContact O-CB 3.28Å; L533-A537 PolarHBondContact O-N 2.88Å; L533-A537 VanDerWaalsContact O-N 3.08Å; L534-A537 PolarHBondContact O-N 2.84Å; L535-A537 VanDerWaalsContact C-N 3.28Å; L535-A537 PolarHBondContact O-N 2.85Å; A537-I540 PolarHBondContact O-N 2.76Å; A537-I541 HydrophobicContact CB-CD1 4.26Å; A537-I541 VanDerWaalsContact O-CB 3.25Å; A537-I541 WeakPolarHBondContact O-CB 3.47Å; A537-I541 WeakPolarHBondContact O-CG1 3.44Å; A537-I541 PolarHBondContact O-N 3.22Å
538	N	88.9	Confident	88.6	Confident	1 Å²	1	29.5 Å²	29.5	1%	0.005	16%	0.163	C	C	.	.	H	α-helix	trans	-61.5	-46.1	177	-87.8	-109.5	0	0	0	112.5	L534 L535 I536 I540 I541 L542 S564 R654	L534-N538 PolarHBondContact O-N 3.3Å; L534-N538 PolarHBondContact O-ND2 3.08Å; L535-N538 WeakPolarHBondContact O-CB 3.5Å; L535-N538 PolarHBondContact O-N 2.93Å; L535-N538 VanDerWaalsContact O-N 3.1Å; I536-N538 PolarHBondContact O-N 2.85Å; N538-I540 PolarHBondContact O-N 2.75Å; N538-I541 PolarHBondContact O-N 3.49Å; N538-L542 HydrophobicContact CB-CD1 3.98Å; N538-L542 VanDerWaalsContact O-CB 3.28Å; N538-L542 WeakPolarHBondContact O-CB 3.37Å; N538-L542 VanDerWaalsContact O-CG 3.3Å; N538-L542 WeakPolarHBondContact O-CG 3.4Å; N538-L542 PolarHBondContact O-N 3.21Å; N538-S564 VanDerWaalsContact CG-OG 3.32Å; N538-S564 PolarHBondContact ND2-OG 3.48Å; N538-S564 PolarHBondContact OD1-OG 2.87Å; N538-R654 PolarHBondContact OD1-NH1 3.38Å
539	L	88.7	Confident	88.6	Confident	2 Å²	2	33.1 Å²	33.1	1%	0.01	18%	0.179	C	C	.	.	H	α-helix	trans	-68.6	-16.8	-177.1	-64.2	-169.5	0	0	0	113.7	L535 I536 P543 L652 L655 L658 L687 W691	L535-L539 HydrophobicContact CD2-CD1 3.47Å; L535-L539 VanDerWaalsContact CD2-CD1 3.47Å; L535-L539 HydrophobicContact CD2-CG 3.77Å; L535-L539 WeakPolarHBondContact O-CG 3.4Å; L535-L539 PolarHBondContact O-N 3Å; I536-L539 PolarHBondContact O-N 2.83Å; L539-P543 WeakPolarHBondContact O-CD 3.47Å; L539-P543 WeakPolarHBondContact O-CG 3.35Å; L539-L652 HydrophobicContact CD2-CD2 3.82Å; L539-L655 HydrophobicContact CD1-CB 4.39Å; L539-L655 HydrophobicContact CD1-CD1 3.74Å; L539-L658 HydrophobicContact CD1-CD2 4.19Å; L539-L687 HydrophobicContact CB-CD1 4.2Å; L539-L687 HydrophobicContact CD1-CD2 4.11Å; L539-W691 HydrophobicContact CB-CZ2 4.07Å; L539-W691 HydrophobicContact CD1-CZ2 4.06Å; L539-W691 HydrophobicContact CD2-CZ2 3.95Å; L539-W691 HydrophobicContact CG-CZ2 4.22Å; L539-W691 PolarHBondContact O-NE1 3.35Å
540	I	91	Very high	87.9	Confident	81 Å²	81	34.6 Å²	34.6	42%	0.415	19%	0.187	S	C	.	.	H	α-helix	trans	-96.2	-41.2	173.7	-63	168.5	0	0	0	111.3	I536 A537 N538 V544 L687 H690	I536-I540 HydrophobicContact CG2-CD1 3.96Å; I536-I540 WeakPolarHBondContact O-CG1 3.48Å; I536-I540 PolarHBondContact O-N 3.23Å; A537-I540 PolarHBondContact O-N 2.76Å; N538-I540 PolarHBondContact O-N 2.75Å; I540-V544 WeakPolarHBondContact O-CG2 3.5Å; I540-L687 HydrophobicContact CG1-CD1 4.38Å; I540-H690 PolarHBondContact O-CE1 3.41Å; I540-H690 PolarHBondContact O-NE2 3.42Å; I540-H690 VanDerWaalsContact O-NE2 3.1Å
541	I	90.2	Very high	86.7	Confident	67 Å²	67	37.9 Å²	37.9	34%	0.344	20%	0.202	S	C	.	.	H	α-helix	trans	-80.6	-41.4	-172.3	-65.4	169.4	0	0	0	111.8	A537 N538 V544 A545 W557 F560	A537-I541 HydrophobicContact CB-CD1 4.26Å; A537-I541 VanDerWaalsContact O-CB 3.25Å; A537-I541 WeakPolarHBondContact O-CB 3.47Å; A537-I541 WeakPolarHBondContact O-CG1 3.44Å; A537-I541 PolarHBondContact O-N 3.22Å; N538-I541 PolarHBondContact O-N 3.49Å; I541-V544 PolarHBondContact O-N 2.82Å; I541-A545 PolarHBondContact O-N 3.35Å; I541-A545 VanDerWaalsContact O-N 3.07Å; I541-W557 HydrophobicContact CG2-CH2 3.91Å; I541-W557 HydrophobicContact CG2-CZ3 3.56Å; I541-F560 HydrophobicContact CD1-CZ 4.08Å; I541-F560 HydrophobicContact CG2-CE1 4.23Å
542	L	87.2	Confident	85.4	Confident	1 Å²	1	39 Å²	39	1%	0.005	21%	0.208	C	C	.	.	H	α-helix	trans	-60.8	-48.4	-176.4	-67.9	168.3	0	0	0	112.8	N538 V544 A545 I546 W557 R651	N538-L542 HydrophobicContact CB-CD1 3.98Å; N538-L542 VanDerWaalsContact O-CB 3.28Å; N538-L542 WeakPolarHBondContact O-CB 3.37Å; N538-L542 VanDerWaalsContact O-CG 3.3Å; N538-L542 WeakPolarHBondContact O-CG 3.4Å; N538-L542 PolarHBondContact O-N 3.21Å; L542-V544 VanDerWaalsContact C-N 3.28Å; L542-V544 PolarHBondContact O-N 2.99Å; L542-A545 PolarHBondContact O-N 3.34Å; L542-I546 HydrophobicContact CB-CD1 4.35Å; L542-I546 WeakPolarHBondContact O-CB 3.4Å; L542-I546 VanDerWaalsContact O-CD1 3.25Å; L542-I546 WeakPolarHBondContact O-CD1 3.37Å; L542-I546 WeakPolarHBondContact O-CG1 3.05Å; L542-I546 PolarHBondContact O-N 2.99Å; L542-W557 HydrophobicContact CD2-CH2 3.92Å; L542-W557 HydrophobicContact CD2-CZ2 3.99Å; L542-R651 HydrophobicContact CD1-CB 3.75Å; L542-R651 HydrophobicContact CD1-CG 4.43Å
543	P	89.6	Confident	84.4	Confident	7 Å²	7	43.9 Å²	43.9	5%	0.045	23%	0.233	C	C	.	.	H	α-helix	trans	-60.7	-36.4	179.5	-23.5	35.3	0	0	0	113.2	L539 S547 L652 C694	L539-P543 WeakPolarHBondContact O-CD 3.47Å; L539-P543 WeakPolarHBondContact O-CG 3.35Å; P543-S547 WeakPolarHBondContact O-CB 3.44Å; P543-S547 PolarHBondContact O-N 2.95Å; P543-S547 PolarHBondContact O-OG 2.84Å; P543-L652 HydrophobicContact CG-CD2 4.2Å; P543-C694 HydrophobicContact CB-CB 3.81Å
544	V	91	Very high	84	Confident	20 Å²	20	42 Å²	42	12%	0.121	23%	0.228	C	C	.	.	H	α-helix	trans	-68.4	-46.2	179.1	178.7	0	0	0	0	111.1	I540 I541 L542 S547 F548 F549 H690 W721 Y725	I540-V544 WeakPolarHBondContact O-CG2 3.5Å; I541-V544 PolarHBondContact O-N 2.82Å; L542-V544 VanDerWaalsContact C-N 3.28Å; L542-V544 PolarHBondContact O-N 2.99Å; V544-S547 PolarHBondContact O-N 3.27Å; V544-F548 HydrophobicContact CG1-CD2 4.01Å; V544-F548 WeakPolarHBondContact O-CD2 3.37Å; V544-F548 PolarHBondContact O-N 3.23Å; V544-F549 HydrophobicContact CG1-CE2 4.09Å; V544-H690 VanDerWaalsContact CG2-CE1 3.44Å; V544-H690 WeakPolarHBondContact CG2-CE1 3.45Å; V544-W721 HydrophobicContact CG1-CE3 4.16Å; V544-W721 HydrophobicContact CG1-CZ3 3.95Å; V544-Y725 HydrophobicContact CG2-CE2 4.46Å
545	A	87.7	Confident	83.6	Confident	7 Å²	7	46.3 Å²	46.3	6%	0.058	25%	0.25	C	S	.	.	H	α-helix	trans	-58.1	-52.8	175.8	0	0	0	0	0	111.3	I541 L542 S547 F549 W557	I541-A545 PolarHBondContact O-N 3.35Å; I541-A545 VanDerWaalsContact O-N 3.07Å; L542-A545 PolarHBondContact O-N 3.34Å; A545-S547 PolarHBondContact O-N 3.44Å; A545-S547 VanDerWaalsContact O-N 3.13Å; A545-F549 PolarHBondContact O-N 3.33Å; A545-F549 VanDerWaalsContact O-N 3.14Å; A545-W557 HydrophobicContact CB-CH2 3.25Å; A545-W557 HydrophobicContact CB-CZ2 3.29Å; A545-W557 HydrophobicContact CB-CZ3 3.92Å
546	I	85.2	Confident	83.5	Confident	3 Å²	3	53.9 Å²	53.9	2%	0.015	29%	0.285	C	S	.	.	H	α-helix	trans	-58.8	-29.9	-177.5	-65.2	161.5	0	0	0	113	L542 K645 S648 L649 L698	L542-I546 HydrophobicContact CB-CD1 4.35Å; L542-I546 WeakPolarHBondContact O-CB 3.4Å; L542-I546 VanDerWaalsContact O-CD1 3.25Å; L542-I546 WeakPolarHBondContact O-CD1 3.37Å; L542-I546 WeakPolarHBondContact O-CG1 3.05Å; L542-I546 PolarHBondContact O-N 2.99Å; I546-K645 HydrophobicContact CG2-CB 4.41Å; I546-S648 WeakPolarHBondContact CD1-OG 3.26Å; I546-S648 WeakPolarHBondContact CG1-OG 3.3Å; I546-L649 HydrophobicContact CD1-CD2 3.59Å; I546-L649 HydrophobicContact CD1-CG 4.09Å; I546-L649 HydrophobicContact CG2-CD2 4.32Å; I546-L698 HydrophobicContact CG2-CD1 4.29Å; I546-L698 HydrophobicContact CG2-CD2 4.4Å
547	S	88.6	Confident	83.3	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-103.5	-31.6	-173.2	56.2	0	0	0	0	115.6	P543 V544 A545 C694 F697 M701	P543-S547 WeakPolarHBondContact O-CB 3.44Å; P543-S547 PolarHBondContact O-N 2.95Å; P543-S547 PolarHBondContact O-OG 2.84Å; V544-S547 PolarHBondContact O-N 3.27Å; A545-S547 PolarHBondContact O-N 3.44Å; A545-S547 VanDerWaalsContact O-N 3.13Å; S547-C694 WeakPolarHBondContact CB-O 3.46Å; S547-C694 WeakPolarHBondContact OG-CB 3.27Å; S547-F697 WeakPolarHBondContact O-CD1 3.27Å; S547-F697 VanDerWaalsContact O-CE1 3.29Å; S547-F697 WeakPolarHBondContact O-CE1 3.31Å; S547-M701 VanDerWaalsContact O-SD 3.36Å
548	F	89.6	Confident	83.1	Confident	12 Å²	12	53.8 Å²	53.8	5%	0.053	28%	0.277	C	S	.	.	H	α-helix	trans	-113.8	-17.2	-174.9	-59.1	-79.7	0	0	0	114.6	V544 F697 W721 Q724 Y725 A728	V544-F548 HydrophobicContact CG1-CD2 4.01Å; V544-F548 WeakPolarHBondContact O-CD2 3.37Å; V544-F548 PolarHBondContact O-N 3.23Å; F548-F697 AromaticContact CD1-CD1 3.51Å; F548-F697 HydrophobicContact CD1-CD1 3.51Å; F548-F697 HydrophobicContact CD1-CD2 4.38Å; F548-F697 AromaticContact CD1-CE1 3.61Å; F548-F697 HydrophobicContact CD1-CE1 3.61Å; F548-F697 HydrophobicContact CD1-CE2 4.46Å; F548-F697 AromaticContact CD1-CG 3.93Å; F548-F697 HydrophobicContact CD1-CG 3.93Å; F548-F697 HydrophobicContact CD1-CZ 4.1Å; F548-F697 HydrophobicContact CE1-CB 3.69Å; F548-F697 AromaticContact CE1-CD1 3.39Å; F548-F697 HydrophobicContact CE1-CD1 3.39Å; F548-F697 AromaticContact CE1-CD2 3.76Å; F548-F697 HydrophobicContact CE1-CD2 3.76Å; F548-F697 AromaticContact CE1-CE1 3.9Å; F548-F697 HydrophobicContact CE1-CE1 3.9Å; F548-F697 HydrophobicContact CE1-CE2 4.22Å; F548-F697 AromaticContact CE1-CG 3.31Å; F548-F697 HydrophobicContact CE1-CG 3.31Å; F548-F697 HydrophobicContact CE1-CZ 4.29Å; F548-F697 HydrophobicContact CG-CD1 4.34Å; F548-F697 HydrophobicContact CG-CE1 4.49Å; F548-F697 HydrophobicContact CZ-CB 3.78Å; F548-F697 HydrophobicContact CZ-CD1 4.13Å; F548-F697 AromaticContact CZ-CG 3.95Å; F548-F697 HydrophobicContact CZ-CG 3.95Å; F548-W721 HydrophobicContact CB-CB 4.11Å; F548-Q724 HydrophobicContact CD1-CB 3.64Å; F548-Q724 HydrophobicContact CE1-CB 3.71Å; F548-Y725 HydrophobicContact CD2-CD2 4.48Å; F548-Y725 AromaticContact CE2-CD2 3.66Å; F548-Y725 HydrophobicContact CE2-CD2 3.66Å; F548-Y725 HydrophobicContact CE2-CG 4.3Å; F548-Y725 AromaticContact CZ-CD2 3.94Å; F548-Y725 HydrophobicContact CZ-CD2 3.94Å; F548-Y725 HydrophobicContact CZ-CG 4.42Å; F548-A728 HydrophobicContact CE1-CB 4.48Å; F548-A728 HydrophobicContact CZ-CB 4.07Å
549	F	85.5	Confident	83.1	Confident	84 Å²	84	57.7 Å²	57.7	37%	0.368	30%	0.301	S	S	.	.			trans	-103.1	133	178.5	-67.1	-99.3	0	0	0	109.4	V544 A545 D552 K645 W721	V544-F549 HydrophobicContact CG1-CE2 4.09Å; A545-F549 PolarHBondContact O-N 3.33Å; A545-F549 VanDerWaalsContact O-N 3.14Å; F549-D552 VanDerWaalsContact CB-OD1 3.22Å; F549-D552 WeakPolarHBondContact CB-OD1 3.43Å; F549-K645 PolarHBondContact O-NZ 3.32Å; F549-W721 HydrophobicContact CE1-CG 4.5Å; F549-W721 AromaticContact CE2-CD2 3.93Å; F549-W721 HydrophobicContact CE2-CD2 3.93Å; F549-W721 HydrophobicContact CE2-CE3 4.11Å; F549-W721 HydrophobicContact CE2-CG 4.12Å; F549-W721 AromaticContact CZ-CD1 3.84Å; F549-W721 AromaticContact CZ-CD2 3.76Å; F549-W721 HydrophobicContact CZ-CD2 3.76Å; F549-W721 AromaticContact CZ-CE2 3.87Å; F549-W721 HydrophobicContact CZ-CE3 4.36Å; F549-W721 AromaticContact CZ-CG 3.79Å; F549-W721 HydrophobicContact CZ-CG 3.79Å; F549-W721 AromaticContact CZ-NE1 3.88Å
550	N	70.6	Confident	83	Confident	88 Å²	88	60.5 Å²	60.5	47%	0.471	31%	0.313	S	S	.	.	S	Bend	trans	-96.5	-45.9	176.4	-78.2	-60.2	0	0	0	111	D552 K645	N550-D552 VanDerWaalsContact C-N 3.31Å; N550-D552 PolarHBondContact O-N 3.49Å; N550-K645 PolarHBondContact O-NZ 3.04Å
551	D	66.3	Low	82.9	Confident	151 Å²	151	56.7 Å²	56.7	81%	0.807	29%	0.293	S	S	*	.			trans	-89	52.7	-168.8	-50.1	-49	0	0	0	113.4	L553	D551-L553 PolarHBondContact O-N 2.81Å
552	D	62	Low	82.8	Confident	24 Å²	24	57 Å²	57	13%	0.128	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68	-1.5	-168.9	-65.3	-6.2	0	0	0	115.1	F549 N550 S554 K645	F549-D552 VanDerWaalsContact CB-OD1 3.22Å; F549-D552 WeakPolarHBondContact CB-OD1 3.43Å; N550-D552 VanDerWaalsContact C-N 3.31Å; N550-D552 PolarHBondContact O-N 3.49Å; D552-S554 PolarHBondContact O-N 3.4Å; D552-S554 VanDerWaalsContact O-N 3.11Å; D552-K645 IonicContact OD1-NZ 2.71Å; D552-K645 PolarHBondContact OD1-NZ 3.44Å; D552-K645 WeakPolarHBondContact OD2-CE 3.19Å; D552-K645 IonicContact OD2-NZ 3.59Å; D552-K645 PolarHBondContact OD2-NZ 3.12Å
553	L	64.8	Low	83	Confident	131 Å²	131	61.2 Å²	61.2	69%	0.686	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.3	14.1	178.4	-80.2	77.5	0	0	0	113.5	D551 I555	D551-L553 PolarHBondContact O-N 2.81Å; L553-I555 PolarHBondContact O-N 3.09Å
554	S	79.8	Confident	83	Confident	59 Å²	59	61 Å²	61	41%	0.413	33%	0.325	S	S	.	.			trans	-55.8	128.6	168.4	179.4	0	0	0	0	111.2	D552 H556 W557 I558	D552-S554 PolarHBondContact O-N 3.4Å; D552-S554 VanDerWaalsContact O-N 3.11Å; S554-H556 PolarHBondContact O-N 3.16Å; S554-H556 VanDerWaalsContact O-N 3.09Å; S554-W557 WeakPolarHBondContact O-CB 3.25Å; S554-W557 PolarHBondContact O-N 3.01Å; S554-I558 PolarHBondContact O-N 2.83Å
555	I	83.6	Confident	83	Confident	127 Å²	127	60.3 Å²	60.3	65%	0.651	32%	0.32	S	S	*	.	H	α-helix	trans	-52.9	-37.4	-178.6	-61.5	169.5	0	0	0	111.2	L553 W557 I558 V559	L553-I555 PolarHBondContact O-N 3.09Å; I555-W557 VanDerWaalsContact C-N 3.35Å; I555-W557 PolarHBondContact O-N 2.88Å; I555-I558 PolarHBondContact O-N 3.21Å; I555-V559 HydrophobicContact CG2-CG2 4.25Å; I555-V559 WeakPolarHBondContact O-CB 3.33Å; I555-V559 VanDerWaalsContact O-CG2 3.26Å; I555-V559 WeakPolarHBondContact O-CG2 3.34Å; I555-V559 PolarHBondContact O-N 3.23Å
556	H	85.9	Confident	83.2	Confident	159 Å²	159	63.3 Å²	63.3	74%	0.736	34%	0.338	S	S	*	.	H	α-helix	trans	-65.4	-34.4	178.5	-58.4	-59.5	0	0	0	113.3	S554 F560	S554-H556 PolarHBondContact O-N 3.16Å; S554-H556 VanDerWaalsContact O-N 3.09Å; H556-F560 WeakPolarHBondContact O-CB 3.44Å; H556-F560 PolarHBondContact O-N 2.79Å
557	W	84.2	Confident	83.5	Confident	43 Å²	43	64.8 Å²	64.8	16%	0.163	35%	0.347	C	S	.	.	H	α-helix	trans	-70.8	-46.4	176	-177.7	-115.1	0	0	0	111.4	I541 L542 A545 S554 I555 V559 F560 N561	I541-W557 HydrophobicContact CG2-CH2 3.91Å; I541-W557 HydrophobicContact CG2-CZ3 3.56Å; L542-W557 HydrophobicContact CD2-CH2 3.92Å; L542-W557 HydrophobicContact CD2-CZ2 3.99Å; A545-W557 HydrophobicContact CB-CH2 3.25Å; A545-W557 HydrophobicContact CB-CZ2 3.29Å; A545-W557 HydrophobicContact CB-CZ3 3.92Å; S554-W557 WeakPolarHBondContact O-CB 3.25Å; S554-W557 PolarHBondContact O-N 3.01Å; I555-W557 VanDerWaalsContact C-N 3.35Å; I555-W557 PolarHBondContact O-N 2.88Å; W557-V559 VanDerWaalsContact C-N 3.34Å; W557-V559 PolarHBondContact O-N 2.69Å; W557-F560 HydrophobicContact CE3-CD1 4.27Å; W557-F560 AromaticContact CZ3-CD1 3.97Å; W557-F560 HydrophobicContact CZ3-CD1 3.97Å; W557-F560 HydrophobicContact CZ3-CE1 4.31Å; W557-F560 PolarHBondContact O-N 2.67Å; W557-N561 WeakPolarHBondContact CZ2-ND2 3.23Å; W557-N561 PolarHBondContact NE1-ND2 3.29Å; W557-N561 VanDerWaalsContact NE1-ND2 3.11Å; W557-N561 PolarHBondContact O-N 2.94Å
558	I	84.6	Confident	83.6	Confident	63 Å²	63	64.8 Å²	64.8	32%	0.323	35%	0.347	S	S	.	.	H	α-helix	trans	-61.2	-44	177.8	-58.2	173.9	0	0	0	110.4	S554 I555 C562 Y617	S554-I558 PolarHBondContact O-N 2.83Å; I555-I558 PolarHBondContact O-N 3.21Å; I558-C562 WeakPolarHBondContact O-CB 3.44Å; I558-C562 PolarHBondContact O-N 3.12Å; I558-Y617 HydrophobicContact CG1-CE1 4.11Å; I558-Y617 HydrophobicContact CG2-CE1 4.21Å
559	V	88.7	Confident	83.7	Confident	82 Å²	82	68.6 Å²	68.6	50%	0.497	37%	0.367	S	S	.	.	H	α-helix	trans	-63.4	-43.3	175.2	169.5	0	0	0	0	111.6	I555 W557 C562 V563	I555-V559 HydrophobicContact CG2-CG2 4.25Å; I555-V559 WeakPolarHBondContact O-CB 3.33Å; I555-V559 VanDerWaalsContact O-CG2 3.26Å; I555-V559 WeakPolarHBondContact O-CG2 3.34Å; I555-V559 PolarHBondContact O-N 3.23Å; W557-V559 VanDerWaalsContact C-N 3.34Å; W557-V559 PolarHBondContact O-N 2.69Å; V559-C562 PolarHBondContact O-N 3.45Å; V559-V563 HydrophobicContact CG1-CG2 4.35Å; V559-V563 WeakPolarHBondContact O-CB 3.37Å; V559-V563 VanDerWaalsContact O-CG2 3.29Å; V559-V563 WeakPolarHBondContact O-CG2 3.45Å; V559-V563 PolarHBondContact O-N 3.22Å
560	F	88.2	Confident	84.1	Confident	62 Å²	62	68.8 Å²	68.8	27%	0.272	37%	0.371	S	S	.	.	H	α-helix	trans	-60.1	-50.3	177.2	174.4	-100.1	0	0	0	112.1	I541 H556 W557 S564	I541-F560 HydrophobicContact CD1-CZ 4.08Å; I541-F560 HydrophobicContact CG2-CE1 4.23Å; H556-F560 WeakPolarHBondContact O-CB 3.44Å; H556-F560 PolarHBondContact O-N 2.79Å; W557-F560 HydrophobicContact CE3-CD1 4.27Å; W557-F560 AromaticContact CZ3-CD1 3.97Å; W557-F560 HydrophobicContact CZ3-CD1 3.97Å; W557-F560 HydrophobicContact CZ3-CE1 4.31Å; W557-F560 PolarHBondContact O-N 2.67Å; F560-S564 WeakPolarHBondContact O-CB 3.36Å; F560-S564 PolarHBondContact O-N 3.17Å
561	N	87.3	Confident	85.2	Confident	1 Å²	1	64.6 Å²	64.6	1%	0.005	35%	0.349	C	S	.	.	H	α-helix	trans	-65.2	-42.5	178.9	-72.2	-23.9	0	0	0	112	W557 S564 D565 Y617	W557-N561 WeakPolarHBondContact CZ2-ND2 3.23Å; W557-N561 PolarHBondContact NE1-ND2 3.29Å; W557-N561 VanDerWaalsContact NE1-ND2 3.11Å; W557-N561 PolarHBondContact O-N 2.94Å; N561-S564 PolarHBondContact O-N 3.47Å; N561-D565 WeakPolarHBondContact O-CB 3.48Å; N561-D565 PolarHBondContact O-N 3.22Å; N561-Y617 HydrophobicContact CB-CE2 3.87Å; N561-Y617 PolarHBondContact ND2-OH 3.14Å
562	C	88.3	Confident	86.4	Confident	73 Å²	73	57.8 Å²	57.8	49%	0.493	31%	0.313	S	S	.	.	H	α-helix	trans	-61.5	-46.2	178.4	-177.6	0	0	0	0	112	I558 V559 T566	I558-C562 WeakPolarHBondContact O-CB 3.44Å; I558-C562 PolarHBondContact O-N 3.12Å; V559-C562 PolarHBondContact O-N 3.45Å; C562-T566 VanDerWaalsContact O-CB 3.24Å; C562-T566 WeakPolarHBondContact O-CB 3.41Å; C562-T566 PolarHBondContact O-N 3.42Å; C562-T566 PolarHBondContact O-OG1 3.32Å
563	V	91	Very high	87.9	Confident	89 Å²	89	58.6 Å²	58.6	54%	0.539	33%	0.327	S	S	.	.	H	α-helix	trans	-63.3	-45.3	175.1	169.9	0	0	0	0	110.9	V559 T566 V567	V559-V563 HydrophobicContact CG1-CG2 4.35Å; V559-V563 WeakPolarHBondContact O-CB 3.37Å; V559-V563 VanDerWaalsContact O-CG2 3.29Å; V559-V563 WeakPolarHBondContact O-CG2 3.45Å; V559-V563 PolarHBondContact O-N 3.22Å; V563-T566 PolarHBondContact O-N 2.62Å; V563-V567 WeakPolarHBondContact O-CG2 3.44Å; V563-V567 PolarHBondContact O-N 2.92Å
564	S	90.4	Very high	89.2	Confident	2 Å²	2	53.1 Å²	53.1	1%	0.014	30%	0.298	C	S	.	.	H	α-helix	trans	-60	-54.4	179.5	-179.8	0	0	0	0	111.9	N538 F560 N561 T566 V567 F568	N538-S564 VanDerWaalsContact CG-OG 3.32Å; N538-S564 PolarHBondContact ND2-OG 3.48Å; N538-S564 PolarHBondContact OD1-OG 2.87Å; F560-S564 WeakPolarHBondContact O-CB 3.36Å; F560-S564 PolarHBondContact O-N 3.17Å; N561-S564 PolarHBondContact O-N 3.47Å; S564-T566 VanDerWaalsContact C-N 3.31Å; S564-T566 PolarHBondContact O-N 3.19Å; S564-V567 PolarHBondContact O-N 3.33Å; S564-V567 VanDerWaalsContact O-N 3.11Å; S564-F568 WeakPolarHBondContact O-CD2 3.5Å; S564-F568 PolarHBondContact O-N 3.39Å; S564-F568 WeakPolarHBondContact OG-CE2 3.35Å
565	D	90.1	Very high	89.7	Confident	6 Å²	6	51 Å²	51	3%	0.032	28%	0.283	C	S	.	.	H	α-helix	trans	-63.1	-37.9	-179.2	-70.7	-1.4	0	0	0	111.3	N561 V567 F568 L569 R651 R654	N561-D565 WeakPolarHBondContact O-CB 3.48Å; N561-D565 PolarHBondContact O-N 3.22Å; D565-V567 PolarHBondContact O-N 2.99Å; D565-F568 CarbonylContact O-C 3.38Å; D565-F568 PolarHBondContact O-N 3.18Å; D565-L569 WeakPolarHBondContact O-CB 3.46Å; D565-L569 PolarHBondContact O-N 2.97Å; D565-R651 IonicContact OD1-NE 2.8Å; D565-R651 PolarHBondContact OD1-NE 2.98Å; D565-R651 VanDerWaalsContact OD1-NE 3.08Å; D565-R651 IonicContact OD2-CZ 3.27Å; D565-R651 IonicContact OD2-NE 3.59Å; D565-R651 PolarHBondContact OD2-NE 3.16Å; D565-R651 IonicContact OD2-NH2 2.7Å; D565-R651 PolarHBondContact OD2-NH2 3.28Å; D565-R654 IonicContact OD1-CZ 2.79Å; D565-R654 VanDerWaalsContact OD1-CZ 3.3Å; D565-R654 IonicContact OD1-NH1 3.6Å; D565-R654 PolarHBondContact OD1-NH1 3.23Å; D565-R654 IonicContact OD1-NH2 2.62Å; D565-R654 PolarHBondContact OD1-NH2 2.91Å
566	T	91.9	Very high	90.1	Very high	71 Å²	71	47.4 Å²	47.4	44%	0.436	26%	0.263	S	S	.	.	H	α-helix	trans	-58.3	-44.4	172.6	-61.2	0	0	0	0	111.8	C562 V563 S564 L569 I570	C562-T566 VanDerWaalsContact O-CB 3.24Å; C562-T566 WeakPolarHBondContact O-CB 3.41Å; C562-T566 PolarHBondContact O-N 3.42Å; C562-T566 PolarHBondContact O-OG1 3.32Å; V563-T566 PolarHBondContact O-N 2.62Å; S564-T566 VanDerWaalsContact C-N 3.31Å; S564-T566 PolarHBondContact O-N 3.19Å; T566-L569 WeakPolarHBondContact O-CB 3.36Å; T566-L569 PolarHBondContact O-N 3.4Å; T566-I570 HydrophobicContact CG2-CD1 4.09Å; T566-I570 WeakPolarHBondContact O-CG1 3.23Å; T566-I570 PolarHBondContact O-N 2.71Å
567	V	92.6	Very high	90.4	Very high	33 Å²	33	45.1 Å²	45.1	20%	0.2	25%	0.247	C	C	.	.	H	α-helix	trans	-66.2	-41.1	177	172.5	0	0	0	0	111.4	M531 L534 V563 S564 D565 L569 I570 D571	M531-V567 HydrophobicContact CE-CG1 4.19Å; M531-V567 HydrophobicContact SD-CG1 3.63Å; L534-V567 HydrophobicContact CD2-CB 3.78Å; L534-V567 HydrophobicContact CD2-CG1 3.57Å; V563-V567 WeakPolarHBondContact O-CG2 3.44Å; V563-V567 PolarHBondContact O-N 2.92Å; S564-V567 PolarHBondContact O-N 3.33Å; S564-V567 VanDerWaalsContact O-N 3.11Å; D565-V567 PolarHBondContact O-N 2.99Å; V567-L569 PolarHBondContact O-N 3.46Å; V567-I570 PolarHBondContact O-N 3.1Å; V567-D571 PolarHBondContact O-N 3.36Å
568	F	91.1	Very high	90.7	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-67.2	-19.4	173.6	-74.1	-69.5	0	0	0	114	M531 L534 L535 S564 D565 S612 R654 R657	M531-F568 HydrophobicContact CE-CD1 3.31Å; M531-F568 HydrophobicContact CE-CE1 3.42Å; M531-F568 VanDerWaalsContact CE-CE1 3.42Å; M531-F568 HydrophobicContact CE-CG 4.1Å; M531-F568 HydrophobicContact CE-CZ 4.27Å; L534-F568 HydrophobicContact CD2-CD2 4.23Å; L534-F568 HydrophobicContact CD2-CE2 3.75Å; L534-F568 HydrophobicContact CD2-CZ 4.08Å; L534-F568 HydrophobicContact CG-CE2 3.81Å; L534-F568 HydrophobicContact CG-CZ 4Å; L535-F568 HydrophobicContact CB-CE1 4.29Å; L535-F568 HydrophobicContact CB-CZ 3.98Å; L535-F568 HydrophobicContact CD1-CE1 4.49Å; L535-F568 HydrophobicContact CG-CZ 4.44Å; S564-F568 WeakPolarHBondContact O-CD2 3.5Å; S564-F568 PolarHBondContact O-N 3.39Å; S564-F568 WeakPolarHBondContact OG-CE2 3.35Å; D565-F568 CarbonylContact O-C 3.38Å; D565-F568 PolarHBondContact O-N 3.18Å; F568-S612 VanDerWaalsContact C-OG 3.31Å; F568-S612 WeakPolarHBondContact CB-OG 3.37Å; F568-S612 PolarHBondContact O-OG 2.74Å; F568-R654 VanDerWaalsContact CD2-NH1 3.31Å; F568-R654 HydrophobicContact CE1-CG 4.49Å; F568-R657 PolarHBondContact O-NH1 3.18Å
569	L	91.9	Very high	90.8	Very high	92 Å²	92	40.8 Å²	40.8	48%	0.482	23%	0.229	S	C	.	.	H	α-helix	trans	-81.5	-41.3	171.7	-130.8	169	0	0	0	111.4	D565 T566 V567 D571 I572 G573	D565-L569 WeakPolarHBondContact O-CB 3.46Å; D565-L569 PolarHBondContact O-N 2.97Å; T566-L569 WeakPolarHBondContact O-CB 3.36Å; T566-L569 PolarHBondContact O-N 3.4Å; V567-L569 PolarHBondContact O-N 3.46Å; L569-D571 VanDerWaalsContact C-N 3.29Å; L569-D571 PolarHBondContact O-N 2.96Å; L569-I572 WeakPolarHBondContact O-CB 3.27Å; L569-I572 PolarHBondContact O-N 2.94Å; L569-G573 PolarHBondContact O-N 2.89Å
570	I	93.7	Very high	90.7	Very high	88 Å²	88	39.1 Å²	39.1	45%	0.451	22%	0.217	S	C	.	.	H	α-helix	trans	-60.8	-39.8	172.3	-66.4	164.1	0	0	0	110.6	W527 T566 V567 I572 G573 V574	W527-I570 HydrophobicContact CH2-CB 4.3Å; W527-I570 HydrophobicContact CH2-CG2 3.59Å; W527-I570 HydrophobicContact CZ2-CG2 3.97Å; T566-I570 HydrophobicContact CG2-CD1 4.09Å; T566-I570 WeakPolarHBondContact O-CG1 3.23Å; T566-I570 PolarHBondContact O-N 2.71Å; V567-I570 PolarHBondContact O-N 3.1Å; I570-I572 VanDerWaalsContact C-N 3.28Å; I570-I572 PolarHBondContact O-N 3Å; I570-G573 CarbonylContact O-C 3.58Å; I570-G573 WeakPolarHBondContact O-CA 3.4Å; I570-G573 PolarHBondContact O-N 3.4Å; I570-V574 HydrophobicContact CG2-CG2 4.37Å; I570-V574 PolarHBondContact O-N 2.9Å
571	D	92.5	Very high	90.3	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-57.5	-37.4	176.1	-177.8	67.5	0	0	0	113	W527 M531 V567 L569 G573 V574 N575 R657 Y661	W527-D571 HydrophobicContact CZ2-CB 4.15Å; W527-D571 PolarHBondContact NE1-OD1 3.37Å; M531-D571 HydrophobicContact CE-CB 3.65Å; M531-D571 HydrophobicContact SD-CB 4.08Å; V567-D571 PolarHBondContact O-N 3.36Å; L569-D571 VanDerWaalsContact C-N 3.29Å; L569-D571 PolarHBondContact O-N 2.96Å; D571-G573 VanDerWaalsContact C-N 3.3Å; D571-G573 PolarHBondContact O-N 3.24Å; D571-V574 PolarHBondContact O-N 2.95Å; D571-N575 WeakPolarHBondContact O-CB 3.29Å; D571-N575 PolarHBondContact O-N 3Å; D571-N575 PolarHBondContact O-ND2 3.13Å; D571-N575 PolarHBondContact OD2-ND2 2.87Å; D571-R657 IonicContact OD2-CZ 2.69Å; D571-R657 IonicContact OD2-NH1 3.03Å; D571-R657 PolarHBondContact OD2-NH1 2.94Å; D571-Y661 PolarHBondContact OD1-OH 3.32Å; D571-Y661 PolarHBondContact OD2-OH 3.13Å
572	I	92.2	Very high	89.5	Confident	9 Å²	9	44 Å²	44	5%	0.046	24%	0.24	C	C	.	.	H	α-helix	trans	-61.5	-42.1	174	-65.2	166.2	0	0	0	110.2	L569 I570 N575 F576 Y600 F605 D608 S612	L569-I572 WeakPolarHBondContact O-CB 3.27Å; L569-I572 PolarHBondContact O-N 2.94Å; I570-I572 VanDerWaalsContact C-N 3.28Å; I570-I572 PolarHBondContact O-N 3Å; I572-N575 PolarHBondContact O-N 3.3Å; I572-F576 HydrophobicContact CG2-CD2 4.02Å; I572-F576 HydrophobicContact CG2-CE2 3.76Å; I572-F576 WeakPolarHBondContact O-CD2 3.42Å; I572-F576 PolarHBondContact O-N 3.45Å; I572-F576 VanDerWaalsContact O-N 3.08Å; I572-Y600 HydrophobicContact CG2-CE1 4.19Å; I572-F605 HydrophobicContact CG2-CD2 4.08Å; I572-F605 HydrophobicContact CG2-CE2 3.93Å; I572-D608 HydrophobicContact CG1-CB 4.34Å; I572-S612 WeakPolarHBondContact CD1-OG 3.3Å
573	G	92.8	Very high	88.3	Confident	41 Å²	41	44.9 Å²	44.9	42%	0.423	24%	0.24	S	C	.	.	H	α-helix	trans	-63.3	-38.1	173.6	0	0	0	0	0	113.8	L569 I570 D571	L569-G573 PolarHBondContact O-N 2.89Å; I570-G573 CarbonylContact O-C 3.58Å; I570-G573 WeakPolarHBondContact O-CA 3.4Å; I570-G573 PolarHBondContact O-N 3.4Å; D571-G573 VanDerWaalsContact C-N 3.3Å; D571-G573 PolarHBondContact O-N 3.24Å
574	V	92.2	Very high	86.8	Confident	15 Å²	15	46.2 Å²	46.2	9%	0.091	24%	0.244	C	C	.	.	H	α-helix	trans	-66.6	-41.4	173.9	170.7	0	0	0	0	111.2	I517 F523 W527 I570 D571 F576 R577 T578	I517-V574 HydrophobicContact CD1-CG1 3.97Å; F523-V574 HydrophobicContact CE1-CG1 4.13Å; W527-V574 HydrophobicContact CD2-CG2 4.5Å; W527-V574 HydrophobicContact CG-CG1 4.5Å; W527-V574 HydrophobicContact CZ2-CG2 4.08Å; I570-V574 HydrophobicContact CG2-CG2 4.37Å; I570-V574 PolarHBondContact O-N 2.9Å; D571-V574 PolarHBondContact O-N 2.95Å; V574-F576 VanDerWaalsContact C-N 3.34Å; V574-F576 PolarHBondContact O-N 2.88Å; V574-R577 CarbonylContact O-C 3.56Å; V574-R577 WeakPolarHBondContact O-CA 3.39Å; V574-R577 PolarHBondContact O-N 3.01Å; V574-T578 PolarHBondContact O-N 3.18Å; V574-T578 PolarHBondContact O-OG1 3.05Å
575	N	90.5	Very high	85.4	Confident	16 Å²	16	53 Å²	53	9%	0.086	27%	0.274	C	S	.	.	H	α-helix	trans	-64.8	-36.1	177.9	-67.6	-34.2	0	0	0	111.9	R524 D571 I572 R577 T578 Y600	R524-N575 PolarHBondContact NH1-OD1 2.95Å; R524-N575 PolarHBondContact NH2-OD1 3.41Å; D571-N575 WeakPolarHBondContact O-CB 3.29Å; D571-N575 PolarHBondContact O-N 3Å; D571-N575 PolarHBondContact O-ND2 3.13Å; D571-N575 PolarHBondContact OD2-ND2 2.87Å; I572-N575 PolarHBondContact O-N 3.3Å; N575-R577 PolarHBondContact O-N 3.4Å; N575-R577 VanDerWaalsContact O-N 3.13Å; N575-T578 PolarHBondContact O-N 2.99Å; N575-Y600 HydrophobicContact CB-CD1 4.42Å; N575-Y600 HydrophobicContact CB-CE1 3.83Å; N575-Y600 HydrophobicContact CB-CE2 4.09Å; N575-Y600 PolarHBondContact ND2-OH 2.94Å
576	F	92.2	Very high	83.9	Confident	51 Å²	51	53.6 Å²	53.6	22%	0.224	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-13.6	170.3	-84.4	-66.1	0	0	0	114.8	I572 V574 A597 Y600 L601 F605	I572-F576 HydrophobicContact CG2-CD2 4.02Å; I572-F576 HydrophobicContact CG2-CE2 3.76Å; I572-F576 WeakPolarHBondContact O-CD2 3.42Å; I572-F576 PolarHBondContact O-N 3.45Å; I572-F576 VanDerWaalsContact O-N 3.08Å; V574-F576 VanDerWaalsContact C-N 3.34Å; V574-F576 PolarHBondContact O-N 2.88Å; F576-A597 HydrophobicContact CD1-CB 3.83Å; F576-A597 HydrophobicContact CE1-CB 4.05Å; F576-Y600 HydrophobicContact CD1-CD1 4.02Å; F576-Y600 HydrophobicContact CD2-CD1 4.25Å; F576-Y600 HydrophobicContact CD2-CE1 4.19Å; F576-Y600 AromaticContact CE1-CD1 3.89Å; F576-Y600 HydrophobicContact CE1-CD1 3.89Å; F576-Y600 HydrophobicContact CE2-CD1 4.11Å; F576-Y600 HydrophobicContact CE2-CE1 4.05Å; F576-Y600 HydrophobicContact CG-CD1 4.19Å; F576-Y600 AromaticContact CZ-CD1 3.92Å; F576-Y600 HydrophobicContact CZ-CD1 3.92Å; F576-Y600 HydrophobicContact CZ-CE1 4.27Å; F576-L601 HydrophobicContact CE1-CD1 4.48Å; F576-L601 HydrophobicContact CE1-CD2 4.2Å; F576-L601 HydrophobicContact CE1-CG 4Å; F576-L601 HydrophobicContact CZ-CD2 3.92Å; F576-L601 HydrophobicContact CZ-CG 4.24Å; F576-F605 AromaticContact CE2-CD2 3.75Å; F576-F605 HydrophobicContact CE2-CD2 3.75Å; F576-F605 AromaticContact CE2-CE2 3.68Å; F576-F605 HydrophobicContact CE2-CE2 3.68Å; F576-F605 AromaticContact CZ-CD2 3.63Å; F576-F605 HydrophobicContact CZ-CD2 3.63Å; F576-F605 AromaticContact CZ-CE2 3.76Å; F576-F605 HydrophobicContact CZ-CE2 3.76Å; F576-F605 HydrophobicContact CZ-CG 4.38Å
577	R	91.7	Very high	82.5	Confident	110 Å²	110	57.7 Å²	57.7	42%	0.415	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.6	-1	179.2	-65.1	-60.8	-176.5	152.5	-1.7	114.2	W515 I517 V574 N575	W515-R577 WeakPolarHBondContact O-CD 3.4Å; I517-R577 HydrophobicContact CD1-CB 4.33Å; I517-R577 PolarHBondContact N-O 3.08Å; V574-R577 CarbonylContact O-C 3.56Å; V574-R577 WeakPolarHBondContact O-CA 3.39Å; V574-R577 PolarHBondContact O-N 3.01Å; N575-R577 PolarHBondContact O-N 3.4Å; N575-R577 VanDerWaalsContact O-N 3.13Å
578	T	90.4	Very high	81.2	Confident	11 Å²	11	60.2 Å²	60.2	7%	0.067	31%	0.309	C	S	.	.	B	Isolated β-bridge	trans	-90.3	127.6	179.4	-57.9	0	0	0	0	110.1	I517 R524 V574 N575 I596	I517-T578 WeakPolarHBondContact O-CA 3.28Å; R524-T578 HydrophobicContact CG-CG2 4.33Å; R524-T578 PolarHBondContact NH1-OG1 3.44Å; V574-T578 PolarHBondContact O-N 3.18Å; V574-T578 PolarHBondContact O-OG1 3.05Å; N575-T578 PolarHBondContact O-N 2.99Å; T578-I596 VanDerWaalsContact O-CG2 3.29Å; T578-I596 WeakPolarHBondContact O-CG2 3.48Å
579	G	87.9	Confident	80.7	Confident	4 Å²	4	60.3 Å²	60.3	4%	0.041	31%	0.309	C	S	.	.			trans	-65	144.1	176.9	0	0	0	0	0	112.9	I517 P519 M590	I517-G579 PolarHBondContact O-N 3.22Å; P519-G579 WeakPolarHBondContact CG-O 3.25Å; G579-M590 WeakPolarHBondContact CA-O 3.4Å
580	I	85.5	Confident	80.3	Confident	47 Å²	47	57.4 Å²	57.4	24%	0.241	29%	0.294	C	S	.	.	B	Isolated β-bridge	trans	-106.1	128.4	-174.9	-58.7	174.8	0	0	0	110	M590 I596 Q599	I580-M590 HydrophobicContact CB-CB 4.48Å; I580-M590 PolarHBondContact N-O 3Å; I580-M590 VanDerWaalsContact N-O 3.17Å; I580-M590 PolarHBondContact O-N 3.33Å; I580-I596 HydrophobicContact CD1-CG2 4.27Å; I580-I596 HydrophobicContact CG1-CG2 4.46Å; I580-Q599 HydrophobicContact CD1-CB 3.95Å; I580-Q599 HydrophobicContact CD1-CG 3.89Å
581	I	80.7	Confident	79.9	Confident	65 Å²	65	53.3 Å²	53.3	33%	0.333	27%	0.272	S	S	.	.			trans	-86.4	131.6	169.3	-47.7	-179.6	0	0	0	107.7	L495 P519 I589	L495-I581 HydrophobicContact CD2-CD1 4.35Å; P519-I581 HydrophobicContact CB-CD1 4.39Å; P519-I581 HydrophobicContact CB-CG1 4.37Å; P519-I581 HydrophobicContact CG-CD1 4.2Å; P519-I581 HydrophobicContact CG-CG1 3.91Å; I581-I589 HydrophobicContact CG1-CG1 4.33Å
582	K	70	Confident	79.6	Confident	100 Å²	100	56.2 Å²	56.2	44%	0.435	29%	0.288	S	S	.	.	S	Bend	trans	-101	-48.8	-175.3	-94.6	-178.1	166.8	172.3	0	115.7	E588 M590	K582-E588 HydrophobicContact CB-CB 4.37Å; K582-M590 HydrophobicContact CD-CG 4.25Å; K582-M590 HydrophobicContact CD-SD 3.71Å; K582-M590 WeakPolarHBondContact CE-SD 3.36Å; K582-M590 HydrophobicContact CG-SD 4.39Å; K582-M590 PolarHBondContact NZ-SD 2.81Å
583	N	63.5	Low	79.5	Confident	92 Å²	92	57.7 Å²	57.7	49%	0.492	30%	0.298	S	S	.	.	S	Bend	trans	-136	35.5	-171.3	-70.5	-56.1	0	0	0	112.8	F585 E588	N583-F585 HydrophobicContact CB-CD2 4.17Å; N583-F585 WeakPolarHBondContact O-CD2 3.29Å; N583-F585 PolarHBondContact O-N 2.9Å; N583-E588 WeakPolarHBondContact CB-OE2 3.25Å; N583-E588 PolarHBondContact ND2-OE2 3.15Å
584	N	60.2	Low	79.3	Confident	117 Å²	117	64.5 Å²	64.5	63%	0.626	32%	0.316	S	S	*	.	S	Bend	trans	60	-11.6	-178.1	-63.6	-1.3	0	0	0	117.2	L495	L495-N584 VanDerWaalsContact CD1-O 3.26Å; L495-N584 WeakPolarHBondContact CD1-O 3.35Å
585	F	60.7	Low	79.1	Confident	146 Å²	146	67.4 Å²	67.4	64%	0.64	33%	0.329	S	S	*	.			trans	-77.9	142.3	171	-58.6	-69.6	0	0	0	112	N583 D587	N583-F585 HydrophobicContact CB-CD2 4.17Å; N583-F585 WeakPolarHBondContact O-CD2 3.29Å; N583-F585 PolarHBondContact O-N 2.9Å; F585-D587 VanDerWaalsContact C-N 3.31Å; F585-D587 PolarHBondContact O-N 3.28Å
586	A	58.9	Low	79.1	Confident	18 Å²	18	66.7 Å²	66.7	15%	0.149	33%	0.325	C	S	.	.	G	3₁₀ helix	trans	-64.1	-32.2	-179	0	0	0	0	0	113.9	L495 F496 E588 I589	L495-A586 HydrophobicContact CD1-CB 4.23Å; L495-A586 HydrophobicContact CG-CB 4.12Å; F496-A586 HydrophobicContact CD1-CB 3.7Å; F496-A586 HydrophobicContact CE1-CB 3.85Å; A586-E588 PolarHBondContact O-N 2.86Å; A586-I589 WeakPolarHBondContact O-CD1 3.24Å; A586-I589 VanDerWaalsContact O-CG1 3.32Å; A586-I589 WeakPolarHBondContact O-CG1 3.48Å; A586-I589 PolarHBondContact O-N 3.49Å
587	D	60.9	Low	79.1	Confident	157 Å²	157	65.3 Å²	65.3	84%	0.84	32%	0.323	S	S	*	.	G	3₁₀ helix	trans	-73.3	-14.9	-172.9	-60.9	-38.5	0	0	0	113.3	F585	F585-D587 VanDerWaalsContact C-N 3.31Å; F585-D587 PolarHBondContact O-N 3.28Å
588	E	66.8	Low	79.1	Confident	86 Å²	86	69 Å²	69	40%	0.402	34%	0.337	S	S	.	.	G	3₁₀ helix	trans	-99.6	13.6	-179.8	-63.4	-159.4	157.4	0	0	114.8	K582 N583 A586 M590	K582-E588 HydrophobicContact CB-CB 4.37Å; N583-E588 WeakPolarHBondContact CB-OE2 3.25Å; N583-E588 PolarHBondContact ND2-OE2 3.15Å; A586-E588 PolarHBondContact O-N 2.86Å; E588-M590 PolarHBondContact O-N 2.89Å
589	I	80.8	Confident	79.1	Confident	2 Å²	2	71.6 Å²	71.6	1%	0.01	35%	0.348	C	S	.	.			trans	-67	110.3	175.4	-61.6	170.5	0	0	0	109.2	L495 F496 R508 P519 I581 A586 L591	L495-I589 HydrophobicContact CD2-CD1 3.9Å; F496-I589 HydrophobicContact CE1-CD1 3.69Å; F496-I589 HydrophobicContact CZ-CD1 3.46Å; F496-I589 VanDerWaalsContact CZ-CD1 3.46Å; R508-I589 PolarHBondContact NH1-O 2.95Å; R508-I589 PolarHBondContact NH2-O 3.17Å; P519-I589 HydrophobicContact CG-CG2 4.29Å; I581-I589 HydrophobicContact CG1-CG1 4.33Å; A586-I589 WeakPolarHBondContact O-CD1 3.24Å; A586-I589 VanDerWaalsContact O-CG1 3.32Å; A586-I589 WeakPolarHBondContact O-CG1 3.48Å; A586-I589 PolarHBondContact O-N 3.49Å; I589-L591 HydrophobicContact CG2-CD2 4.04Å; I589-L591 HydrophobicContact CG2-CG 4.35Å; I589-L591 PolarHBondContact O-N 3.05Å
590	M	82.5	Confident	79.3	Confident	31 Å²	31	72 Å²	72	15%	0.153	35%	0.349	C	S	.	.	B	Isolated β-bridge	trans	-79.2	108.1	-179	-58.9	-162.2	78.7	0	0	110.7	G579 I580 K582 E588 E595 I596	G579-M590 WeakPolarHBondContact CA-O 3.4Å; I580-M590 HydrophobicContact CB-CB 4.48Å; I580-M590 PolarHBondContact N-O 3Å; I580-M590 VanDerWaalsContact N-O 3.17Å; I580-M590 PolarHBondContact O-N 3.33Å; K582-M590 HydrophobicContact CD-CG 4.25Å; K582-M590 HydrophobicContact CD-SD 3.71Å; K582-M590 WeakPolarHBondContact CE-SD 3.36Å; K582-M590 HydrophobicContact CG-SD 4.39Å; K582-M590 PolarHBondContact NZ-SD 2.81Å; E588-M590 PolarHBondContact O-N 2.89Å; M590-E595 HydrophobicContact CE-CB 3.57Å; M590-E595 HydrophobicContact CE-CG 4.29Å; M590-E595 WeakPolarHBondContact CE-OE2 3.26Å; M590-I596 WeakPolarHBondContact O-CD1 3.47Å; M590-I596 WeakPolarHBondContact O-CG1 3.27Å
591	L	85.3	Confident	79.6	Confident	1 Å²	1	74.3 Å²	74.3	1%	0.005	36%	0.361	C	S	.	.			trans	-100.4	-18.7	174.3	-62	-178.6	0	0	0	113.6	R508 Q509 Q512 I516 I589 P593 I596	R508-L591 HydrophobicContact CG-CD1 4.47Å; Q509-L591 HydrophobicContact CB-CD1 4.04Å; Q512-L591 HydrophobicContact CB-CB 4.48Å; Q512-L591 HydrophobicContact CG-CB 4.04Å; I516-L591 HydrophobicContact CG2-CB 4.48Å; I516-L591 HydrophobicContact CG2-CD2 4.12Å; I589-L591 HydrophobicContact CG2-CD2 4.04Å; I589-L591 HydrophobicContact CG2-CG 4.35Å; I589-L591 PolarHBondContact O-N 3.05Å; L591-P593 VanDerWaalsContact O-CD 3.29Å; L591-P593 WeakPolarHBondContact O-CD 3.29Å; L591-P593 VanDerWaalsContact O-N 3.12Å; L591-I596 WeakPolarHBondContact O-CD1 3.36Å
592	N	86.8	Confident	80.1	Confident	61 Å²	61	79.4 Å²	79.4	33%	0.326	38%	0.38	S	S	.	.			trans	-58.9	112.9	-179.4	-68.4	-41.8	0	0	0	110.6	Q512 K594 E595 I596	Q512-N592 PolarHBondContact NE2-OD1 2.95Å; Q512-N592 PolarHBondContact OE1-OD1 3.2Å; Q512-N592 VanDerWaalsContact OE1-OD1 3.08Å; N592-K594 VanDerWaalsContact C-N 3.28Å; N592-K594 PolarHBondContact O-N 3.29Å; N592-E595 HydrophobicContact CB-CB 4.07Å; N592-E595 HydrophobicContact CB-CG 3.79Å; N592-E595 WeakPolarHBondContact CB-OE2 3.18Å; N592-E595 PolarHBondContact ND2-OE2 3.17Å; N592-E595 PolarHBondContact O-N 2.94Å; N592-I596 PolarHBondContact O-N 3.23Å
593	P	88.6	Confident	80.9	Confident	40 Å²	40	77.9 Å²	77.9	26%	0.26	38%	0.38	S	S	.	.	H	α-helix	trans	-65.4	-29.2	-169.7	22.7	-32.9	0	0	0	113.6	I516 L591 E595 A597	I516-P593 HydrophobicContact CD1-CG 4.34Å; L591-P593 VanDerWaalsContact O-CD 3.29Å; L591-P593 WeakPolarHBondContact O-CD 3.29Å; L591-P593 VanDerWaalsContact O-N 3.12Å; P593-E595 VanDerWaalsContact C-N 3.28Å; P593-E595 PolarHBondContact O-N 3.47Å; P593-A597 VanDerWaalsContact O-CB 3.32Å; P593-A597 WeakPolarHBondContact O-CB 3.45Å; P593-A597 PolarHBondContact O-N 3.27Å
594	K	89.2	Confident	81.9	Confident	185 Å²	185	78.9 Å²	78.9	80%	0.804	38%	0.377	S	S	*	.	H	α-helix	trans	-66.1	-30.3	174.1	-66.4	179.9	-179.7	175.3	0	112.8	N592 R598	N592-K594 VanDerWaalsContact C-N 3.28Å; N592-K594 PolarHBondContact O-N 3.29Å; K594-R598 WeakPolarHBondContact O-CB 3.38Å; K594-R598 PolarHBondContact O-N 3.37Å
595	E	89.2	Confident	83.4	Confident	76 Å²	76	75.6 Å²	75.6	36%	0.355	36%	0.357	S	S	.	.	H	α-helix	trans	-88.2	-40.1	-176.8	-55.9	-172.6	141.3	0	0	111.4	M590 N592 P593 A597 R598 Q599	M590-E595 HydrophobicContact CE-CB 3.57Å; M590-E595 HydrophobicContact CE-CG 4.29Å; M590-E595 WeakPolarHBondContact CE-OE2 3.26Å; N592-E595 HydrophobicContact CB-CB 4.07Å; N592-E595 HydrophobicContact CB-CG 3.79Å; N592-E595 WeakPolarHBondContact CB-OE2 3.18Å; N592-E595 PolarHBondContact ND2-OE2 3.17Å; N592-E595 PolarHBondContact O-N 2.94Å; P593-E595 VanDerWaalsContact C-N 3.28Å; P593-E595 PolarHBondContact O-N 3.47Å; E595-A597 VanDerWaalsContact C-N 3.31Å; E595-A597 PolarHBondContact O-N 3.25Å; E595-R598 PolarHBondContact O-N 2.95Å; E595-Q599 WeakPolarHBondContact O-CB 3.22Å; E595-Q599 PolarHBondContact O-N 3.04Å
596	I	90	Very high	84.7	Confident	0 Å²	0	75 Å²	75	0%	0	36%	0.36	C	S	.	.	H	α-helix	trans	-51	-53.8	166.6	-65.2	167.1	0	0	0	109.4	T578 I580 M590 L591 N592 R598 Q599 Y600	T578-I596 VanDerWaalsContact O-CG2 3.29Å; T578-I596 WeakPolarHBondContact O-CG2 3.48Å; I580-I596 HydrophobicContact CD1-CG2 4.27Å; I580-I596 HydrophobicContact CG1-CG2 4.46Å; M590-I596 WeakPolarHBondContact O-CD1 3.47Å; M590-I596 WeakPolarHBondContact O-CG1 3.27Å; L591-I596 WeakPolarHBondContact O-CD1 3.36Å; N592-I596 PolarHBondContact O-N 3.23Å; I596-R598 PolarHBondContact O-N 3.25Å; I596-Q599 PolarHBondContact O-N 3.24Å; I596-Y600 WeakPolarHBondContact O-CB 3.31Å; I596-Y600 PolarHBondContact O-N 2.76Å
597	A	91.6	Very high	86	Confident	23 Å²	23	76.8 Å²	76.8	19%	0.19	37%	0.366	C	S	.	.	H	α-helix	trans	-58.8	-46.7	179.1	0	0	0	0	0	112.5	F576 P593 E595 Q599 Y600 L601	F576-A597 HydrophobicContact CD1-CB 3.83Å; F576-A597 HydrophobicContact CE1-CB 4.05Å; P593-A597 VanDerWaalsContact O-CB 3.32Å; P593-A597 WeakPolarHBondContact O-CB 3.45Å; P593-A597 PolarHBondContact O-N 3.27Å; E595-A597 VanDerWaalsContact C-N 3.31Å; E595-A597 PolarHBondContact O-N 3.25Å; A597-Q599 VanDerWaalsContact C-N 3.35Å; A597-Q599 PolarHBondContact O-N 2.8Å; A597-Y600 PolarHBondContact O-N 3.09Å; A597-L601 VanDerWaalsContact O-CB 3.26Å; A597-L601 WeakPolarHBondContact O-CB 3.45Å; A597-L601 WeakPolarHBondContact O-CD1 3.34Å; A597-L601 WeakPolarHBondContact O-CG 3.46Å; A597-L601 PolarHBondContact O-N 2.99Å
598	R	92.5	Very high	87.4	Confident	188 Å²	188	69.3 Å²	69.3	71%	0.709	33%	0.326	S	S	*	.	H	α-helix	trans	-61.3	-41.1	177.9	-177.2	-177.4	-73.3	162.9	-5.3	112.3	K594 E595 I596 K602	K594-R598 WeakPolarHBondContact O-CB 3.38Å; K594-R598 PolarHBondContact O-N 3.37Å; E595-R598 PolarHBondContact O-N 2.95Å; I596-R598 PolarHBondContact O-N 3.25Å; R598-K602 WeakPolarHBondContact O-CB 3.4Å; R598-K602 PolarHBondContact O-N 3.14Å
599	Q	90.4	Very high	88.5	Confident	64 Å²	64	67.8 Å²	67.8	30%	0.299	32%	0.321	S	S	.	.	H	α-helix	trans	-71	-42	180	-174.7	65.6	13.1	0	0	111.7	I580 E595 I596 A597 K602 T603	I580-Q599 HydrophobicContact CD1-CB 3.95Å; I580-Q599 HydrophobicContact CD1-CG 3.89Å; E595-Q599 WeakPolarHBondContact O-CB 3.22Å; E595-Q599 PolarHBondContact O-N 3.04Å; I596-Q599 PolarHBondContact O-N 3.24Å; A597-Q599 VanDerWaalsContact C-N 3.35Å; A597-Q599 PolarHBondContact O-N 2.8Å; Q599-K602 PolarHBondContact O-N 3.35Å; Q599-T603 WeakPolarHBondContact O-CG2 3.43Å; Q599-T603 PolarHBondContact O-N 3.24Å; Q599-T603 PolarHBondContact O-OG1 3.46Å
600	Y	90.9	Very high	88.8	Confident	14 Å²	14	71.2 Å²	71.2	6%	0.055	34%	0.339	C	S	.	.	H	α-helix	trans	-67	-43.8	177.7	-175.9	-129.6	0	0	0	112.1	I572 N575 F576 I596 A597 K602 T603 W604 F605 D608	I572-Y600 HydrophobicContact CG2-CE1 4.19Å; N575-Y600 HydrophobicContact CB-CD1 4.42Å; N575-Y600 HydrophobicContact CB-CE1 3.83Å; N575-Y600 HydrophobicContact CB-CE2 4.09Å; N575-Y600 PolarHBondContact ND2-OH 2.94Å; F576-Y600 HydrophobicContact CD1-CD1 4.02Å; F576-Y600 HydrophobicContact CD2-CD1 4.25Å; F576-Y600 HydrophobicContact CD2-CE1 4.19Å; F576-Y600 AromaticContact CE1-CD1 3.89Å; F576-Y600 HydrophobicContact CE1-CD1 3.89Å; F576-Y600 HydrophobicContact CE2-CD1 4.11Å; F576-Y600 HydrophobicContact CE2-CE1 4.05Å; F576-Y600 HydrophobicContact CG-CD1 4.19Å; F576-Y600 AromaticContact CZ-CD1 3.92Å; F576-Y600 HydrophobicContact CZ-CD1 3.92Å; F576-Y600 HydrophobicContact CZ-CE1 4.27Å; I596-Y600 WeakPolarHBondContact O-CB 3.31Å; I596-Y600 PolarHBondContact O-N 2.76Å; A597-Y600 PolarHBondContact O-N 3.09Å; Y600-K602 VanDerWaalsContact C-N 3.27Å; Y600-K602 PolarHBondContact O-N 3.26Å; Y600-T603 PolarHBondContact O-N 2.79Å; Y600-T603 VanDerWaalsContact O-N 3.15Å; Y600-T603 PolarHBondContact O-OG1 2.85Å; Y600-W604 HydrophobicContact CD2-CB 4.23Å; Y600-W604 HydrophobicContact CE2-CB 3.94Å; Y600-W604 PolarHBondContact O-N 3.17Å; Y600-F605 HydrophobicContact CD1-CB 4.18Å; Y600-F605 HydrophobicContact CD1-CD2 4.37Å; Y600-F605 HydrophobicContact CE1-CB 4.19Å; Y600-F605 AromaticContact CE1-CD2 3.97Å; Y600-F605 HydrophobicContact CE1-CD2 3.97Å; Y600-F605 HydrophobicContact CG-CB 4.44Å; Y600-F605 WeakPolarHBondContact O-CB 3.39Å; Y600-F605 PolarHBondContact O-N 3.08Å; Y600-F605 VanDerWaalsContact O-N 3.11Å; Y600-D608 WeakPolarHBondContact CE2-OD2 3.48Å; Y600-D608 WeakPolarHBondContact OH-CB 3.44Å; Y600-D608 PolarHBondContact OH-OD2 3.45Å
601	L	92.6	Very high	89	Confident	94 Å²	94	69.8 Å²	69.8	49%	0.492	33%	0.332	S	S	.	.	H	α-helix	trans	-57.8	-36.9	173.5	-74.5	169.2	0	0	0	112.8	F576 A597 F605	F576-L601 HydrophobicContact CE1-CD1 4.48Å; F576-L601 HydrophobicContact CE1-CD2 4.2Å; F576-L601 HydrophobicContact CE1-CG 4Å; F576-L601 HydrophobicContact CZ-CD2 3.92Å; F576-L601 HydrophobicContact CZ-CG 4.24Å; A597-L601 VanDerWaalsContact O-CB 3.26Å; A597-L601 WeakPolarHBondContact O-CB 3.45Å; A597-L601 WeakPolarHBondContact O-CD1 3.34Å; A597-L601 WeakPolarHBondContact O-CG 3.46Å; A597-L601 PolarHBondContact O-N 2.99Å; L601-F605 HydrophobicContact CD2-CB 4.31Å; L601-F605 HydrophobicContact CD2-CD1 3.55Å; L601-F605 HydrophobicContact CD2-CD2 4.31Å; L601-F605 HydrophobicContact CD2-CE1 3.87Å; L601-F605 HydrophobicContact CD2-CG 3.78Å; L601-F605 HydrophobicContact CD2-CZ 4.37Å
602	K	91.2	Very high	89.1	Confident	172 Å²	172	69.8 Å²	69.8	75%	0.748	33%	0.332	S	S	*	.	H	α-helix	trans	-75.2	-20.5	179	-176.2	177	176.2	-173.3	0	113.6	R598 Q599 Y600	R598-K602 WeakPolarHBondContact O-CB 3.4Å; R598-K602 PolarHBondContact O-N 3.14Å; Q599-K602 PolarHBondContact O-N 3.35Å; Y600-K602 VanDerWaalsContact C-N 3.27Å; Y600-K602 PolarHBondContact O-N 3.26Å
603	T	85.7	Confident	89	Confident	69 Å²	69	69.7 Å²	69.7	42%	0.423	33%	0.331	S	S	.	.	H	α-helix	trans	-114.9	-80.6	-167.7	51.2	0	0	0	0	112.7	Q599 Y600	Q599-T603 WeakPolarHBondContact O-CG2 3.43Å; Q599-T603 PolarHBondContact O-N 3.24Å; Q599-T603 PolarHBondContact O-OG1 3.46Å; Y600-T603 PolarHBondContact O-N 2.79Å; Y600-T603 VanDerWaalsContact O-N 3.15Å; Y600-T603 PolarHBondContact O-OG1 2.85Å
604	W	85.8	Confident	88.9	Confident	113 Å²	113	69.5 Å²	69.5	43%	0.428	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.8	-19.4	-166.4	-64.8	105.4	0	0	0	114.4	Y600 L606 L607 D608	Y600-W604 HydrophobicContact CD2-CB 4.23Å; Y600-W604 HydrophobicContact CE2-CB 3.94Å; Y600-W604 PolarHBondContact O-N 3.17Å; W604-L606 VanDerWaalsContact C-N 3.33Å; W604-L606 PolarHBondContact O-N 3.4Å; W604-L607 PolarHBondContact O-N 3.4Å; W604-L607 VanDerWaalsContact O-N 3.14Å; W604-D608 WeakPolarHBondContact O-CB 3.49Å; W604-D608 PolarHBondContact O-N 3.17Å
605	F	90.5	Very high	88.5	Confident	47 Å²	47	62.9 Å²	62.9	21%	0.206	30%	0.303	C	S	.	.	H	α-helix	trans	-52.6	-43.5	-172.5	171.4	-102.1	0	0	0	114.3	I572 F576 Y600 L601 L607 D608 L609	I572-F605 HydrophobicContact CG2-CD2 4.08Å; I572-F605 HydrophobicContact CG2-CE2 3.93Å; F576-F605 AromaticContact CE2-CD2 3.75Å; F576-F605 HydrophobicContact CE2-CD2 3.75Å; F576-F605 AromaticContact CE2-CE2 3.68Å; F576-F605 HydrophobicContact CE2-CE2 3.68Å; F576-F605 AromaticContact CZ-CD2 3.63Å; F576-F605 HydrophobicContact CZ-CD2 3.63Å; F576-F605 AromaticContact CZ-CE2 3.76Å; F576-F605 HydrophobicContact CZ-CE2 3.76Å; F576-F605 HydrophobicContact CZ-CG 4.38Å; Y600-F605 HydrophobicContact CD1-CB 4.18Å; Y600-F605 HydrophobicContact CD1-CD2 4.37Å; Y600-F605 HydrophobicContact CE1-CB 4.19Å; Y600-F605 AromaticContact CE1-CD2 3.97Å; Y600-F605 HydrophobicContact CE1-CD2 3.97Å; Y600-F605 HydrophobicContact CG-CB 4.44Å; Y600-F605 WeakPolarHBondContact O-CB 3.39Å; Y600-F605 PolarHBondContact O-N 3.08Å; Y600-F605 VanDerWaalsContact O-N 3.11Å; L601-F605 HydrophobicContact CD2-CB 4.31Å; L601-F605 HydrophobicContact CD2-CD1 3.55Å; L601-F605 HydrophobicContact CD2-CD2 4.31Å; L601-F605 HydrophobicContact CD2-CE1 3.87Å; L601-F605 HydrophobicContact CD2-CG 3.78Å; L601-F605 HydrophobicContact CD2-CZ 4.37Å; F605-L607 VanDerWaalsContact C-N 3.35Å; F605-L607 PolarHBondContact O-N 2.72Å; F605-D608 PolarHBondContact O-N 3.14Å; F605-L609 HydrophobicContact CE1-CD2 4.03Å; F605-L609 HydrophobicContact CE2-CB 4.44Å; F605-L609 HydrophobicContact CZ-CB 4.37Å; F605-L609 HydrophobicContact CZ-CD2 3.89Å; F605-L609 WeakPolarHBondContact O-CB 3.47Å; F605-L609 PolarHBondContact O-N 3.29Å
606	L	88.6	Confident	88	Confident	133 Å²	133	60 Å²	60	70%	0.696	29%	0.29	S	S	*	.	H	α-helix	trans	-61.6	-43.9	-177.9	-176	73.1	0	0	0	111.9	W604 L610	W604-L606 VanDerWaalsContact C-N 3.33Å; W604-L606 PolarHBondContact O-N 3.4Å; L606-L610 VanDerWaalsContact O-CB 3.31Å; L606-L610 WeakPolarHBondContact O-CB 3.47Å; L606-L610 PolarHBondContact O-N 3.49Å
607	L	86.7	Confident	87.6	Confident	56 Å²	56	62.4 Å²	62.4	29%	0.293	30%	0.3	S	S	.	.	H	α-helix	trans	-73.7	-44.3	-179.3	-167.3	164.5	0	0	0	110.1	W604 F605 L609 L610 S611 L653 S656	W604-L607 PolarHBondContact O-N 3.4Å; W604-L607 VanDerWaalsContact O-N 3.14Å; F605-L607 VanDerWaalsContact C-N 3.35Å; F605-L607 PolarHBondContact O-N 2.72Å; L607-L609 PolarHBondContact O-N 2.92Å; L607-L610 PolarHBondContact O-N 3.46Å; L607-S611 VanDerWaalsContact O-CB 3.25Å; L607-S611 WeakPolarHBondContact O-CB 3.44Å; L607-S611 PolarHBondContact O-N 3.3Å; L607-S611 PolarHBondContact O-OG 3.15Å; L607-L653 HydrophobicContact CD2-CB 3.99Å; L607-L653 WeakPolarHBondContact CD2-O 3.22Å; L607-S656 WeakPolarHBondContact CD2-OG 3.16Å
608	D	89.1	Confident	87.2	Confident	0 Å²	0	64.6 Å²	64.6	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-58.6	-47.7	175.3	-77.4	-13.2	0	0	0	110.6	I572 Y600 W604 F605 S611 S612 R657 R660	I572-D608 HydrophobicContact CG1-CB 4.34Å; Y600-D608 WeakPolarHBondContact CE2-OD2 3.48Å; Y600-D608 WeakPolarHBondContact OH-CB 3.44Å; Y600-D608 PolarHBondContact OH-OD2 3.45Å; W604-D608 WeakPolarHBondContact O-CB 3.49Å; W604-D608 PolarHBondContact O-N 3.17Å; F605-D608 PolarHBondContact O-N 3.14Å; D608-S611 PolarHBondContact O-N 3.03Å; D608-S611 PolarHBondContact O-OG 2.92Å; D608-S612 PolarHBondContact O-N 3.39Å; D608-S612 VanDerWaalsContact O-N 3.09Å; D608-S612 PolarHBondContact O-OG 3.27Å; D608-R657 VanDerWaalsContact CG-NE 3.27Å; D608-R657 PolarHBondContact O-NH2 3.39Å; D608-R657 WeakPolarHBondContact OD1-CG 3.4Å; D608-R657 IonicContact OD1-CZ 3.74Å; D608-R657 IonicContact OD1-NE 2.73Å; D608-R657 PolarHBondContact OD1-NE 3.33Å; D608-R657 IonicContact OD1-NH2 3.35Å; D608-R657 IonicContact OD2-NE 2.77Å; D608-R660 IonicContact OD1-CZ 3.15Å; D608-R660 IonicContact OD1-NH1 2.68Å; D608-R660 PolarHBondContact OD1-NH1 3.03Å; D608-R660 VanDerWaalsContact OD1-NH1 3.13Å; D608-R660 IonicContact OD1-NH2 3.3Å; D608-R660 IonicContact OD2-CZ 3.31Å; D608-R660 IonicContact OD2-NH1 3.06Å; D608-R660 PolarHBondContact OD2-NH1 2.93Å; D608-R660 IonicContact OD2-NH2 2.68Å; D608-R660 PolarHBondContact OD2-NH2 3.41Å
609	L	90.3	Very high	86.4	Confident	55 Å²	55	59.4 Å²	59.4	29%	0.288	29%	0.289	S	S	.	.	H	α-helix	trans	-57.8	-54.4	174.8	177.4	66.3	0	0	0	112.2	F605 L607 S611 S612 L613	F605-L609 HydrophobicContact CE1-CD2 4.03Å; F605-L609 HydrophobicContact CE2-CB 4.44Å; F605-L609 HydrophobicContact CZ-CB 4.37Å; F605-L609 HydrophobicContact CZ-CD2 3.89Å; F605-L609 WeakPolarHBondContact O-CB 3.47Å; F605-L609 PolarHBondContact O-N 3.29Å; L607-L609 PolarHBondContact O-N 2.92Å; L609-S611 PolarHBondContact O-N 3.05Å; L609-S612 PolarHBondContact O-N 2.9Å; L609-L613 HydrophobicContact CD1-CD1 4.4Å; L609-L613 HydrophobicContact CD1-CD2 4.49Å; L609-L613 HydrophobicContact CD1-CG 4.32Å; L609-L613 HydrophobicContact CG-CD1 4.25Å; L609-L613 WeakPolarHBondContact O-CG 3.45Å; L609-L613 PolarHBondContact O-N 2.93Å
610	L	86.9	Confident	85.8	Confident	73 Å²	73	58.8 Å²	58.8	38%	0.382	29%	0.287	S	S	.	.	H	α-helix	trans	-58.7	-36	-179	-178	61.1	0	0	0	111.6	L606 L607 S612 L615 I650 L653	L606-L610 VanDerWaalsContact O-CB 3.31Å; L606-L610 WeakPolarHBondContact O-CB 3.47Å; L606-L610 PolarHBondContact O-N 3.49Å; L607-L610 PolarHBondContact O-N 3.46Å; L610-S612 VanDerWaalsContact C-N 3.34Å; L610-L615 HydrophobicContact CD1-CD1 4.04Å; L610-I650 HydrophobicContact CD1-CG2 4.04Å; L610-I650 HydrophobicContact CD2-CG2 4.41Å; L610-I650 HydrophobicContact CG-CG2 3.74Å; L610-L653 HydrophobicContact CD2-CD1 3.97Å; L610-L653 HydrophobicContact CG-CD1 4.28Å
611	S	86.9	Confident	85.3	Confident	1 Å²	1	63.6 Å²	63.6	1%	0.007	31%	0.312	C	S	.	.	H	α-helix	trans	-73.7	-19.3	176.3	78.9	0	0	0	0	114.4	L607 D608 L609 R654 R657	L607-S611 VanDerWaalsContact O-CB 3.25Å; L607-S611 WeakPolarHBondContact O-CB 3.44Å; L607-S611 PolarHBondContact O-N 3.3Å; L607-S611 PolarHBondContact O-OG 3.15Å; D608-S611 PolarHBondContact O-N 3.03Å; D608-S611 PolarHBondContact O-OG 2.92Å; L609-S611 PolarHBondContact O-N 3.05Å; S611-R654 VanDerWaalsContact O-CZ 3.23Å; S611-R654 PolarHBondContact O-NE 3.22Å; S611-R654 PolarHBondContact O-NH2 2.58Å; S611-R657 PolarHBondContact OG-NH2 2.91Å
612	S	87.6	Confident	84.7	Confident	1 Å²	1	65.4 Å²	65.4	1%	0.007	32%	0.322	C	S	.	.	H	α-helix	trans	-95.1	-13.9	-179.7	-69.5	0	0	0	0	113.9	F568 I572 D608 L609 L610 R657	F568-S612 VanDerWaalsContact C-OG 3.31Å; F568-S612 WeakPolarHBondContact CB-OG 3.37Å; F568-S612 PolarHBondContact O-OG 2.74Å; I572-S612 WeakPolarHBondContact CD1-OG 3.3Å; D608-S612 PolarHBondContact O-N 3.39Å; D608-S612 VanDerWaalsContact O-N 3.09Å; D608-S612 PolarHBondContact O-OG 3.27Å; L609-S612 PolarHBondContact O-N 2.9Å; L610-S612 VanDerWaalsContact C-N 3.34Å; S612-R657 PolarHBondContact OG-NH2 3.24Å
613	L	85.7	Confident	83.8	Confident	59 Å²	59	60.1 Å²	60.1	31%	0.309	30%	0.3	S	S	.	.			trans	-79.3	131.4	-174.6	-74.9	170.2	0	0	0	112.8	L609 L615	L609-L613 HydrophobicContact CD1-CD1 4.4Å; L609-L613 HydrophobicContact CD1-CD2 4.49Å; L609-L613 HydrophobicContact CD1-CG 4.32Å; L609-L613 HydrophobicContact CG-CD1 4.25Å; L609-L613 WeakPolarHBondContact O-CG 3.45Å; L609-L613 PolarHBondContact O-N 2.93Å; L613-L615 HydrophobicContact CB-CD2 3.96Å; L613-L615 HydrophobicContact CB-CG 3.96Å; L613-L615 HydrophobicContact CD1-CD2 4.34Å; L613-L615 PolarHBondContact O-N 2.99Å
614	P	85.3	Confident	82.8	Confident	36 Å²	36	60.8 Å²	60.8	23%	0.234	30%	0.301	C	S	.	.			trans	-78.2	62.5	174.6	32.4	-35	0	0	0	111.6	D616 Y617 I618	P614-D616 PolarHBondContact O-N 2.82Å; P614-Y617 HydrophobicContact CB-CD2 3.97Å; P614-Y617 PolarHBondContact O-N 3.35Å; P614-I618 HydrophobicContact CG-CD1 4.01Å; P614-I618 HydrophobicContact CG-CG1 4.29Å; P614-I618 VanDerWaalsContact O-CG1 3.28Å; P614-I618 WeakPolarHBondContact O-CG1 3.3Å; P614-I618 PolarHBondContact O-N 3.13Å
615	L	80.5	Confident	81.5	Confident	46 Å²	46	62.3 Å²	62.3	24%	0.241	32%	0.317	C	S	.	.	H	α-helix	trans	-61.5	-28.6	-174	-64.7	176.6	0	0	0	113.4	L610 L613 Y619 I650	L610-L615 HydrophobicContact CD1-CD1 4.04Å; L613-L615 HydrophobicContact CB-CD2 3.96Å; L613-L615 HydrophobicContact CB-CG 3.96Å; L613-L615 HydrophobicContact CD1-CD2 4.34Å; L613-L615 PolarHBondContact O-N 2.99Å; L615-Y619 WeakPolarHBondContact O-CB 3.26Å; L615-Y619 PolarHBondContact O-N 3.13Å; L615-I650 HydrophobicContact CD1-CD1 3.74Å; L615-I650 HydrophobicContact CD1-CG2 4.41Å
616	D	78.8	Confident	79.9	Confident	17 Å²	17	68.6 Å²	68.6	9%	0.091	35%	0.347	C	S	.	.	H	α-helix	trans	-63.5	-51.8	172.7	50.8	-9.2	0	0	0	112.1	P614 L620 V644 R651	P614-D616 PolarHBondContact O-N 2.82Å; D616-L620 PolarHBondContact O-N 3.38Å; D616-L620 VanDerWaalsContact O-N 3.1Å; D616-V644 HydrophobicContact CB-CG1 3.9Å; D616-V644 WeakPolarHBondContact O-CG1 3.29Å; D616-R651 IonicContact OD1-CZ 3.88Å; D616-R651 IonicContact OD1-NH1 3.99Å; D616-R651 IonicContact OD1-NH2 2.89Å; D616-R651 PolarHBondContact OD1-NH2 2.87Å; D616-R651 IonicContact OD2-CZ 2.8Å; D616-R651 IonicContact OD2-NH1 3.08Å; D616-R651 PolarHBondContact OD2-NH1 2.98Å; D616-R651 IonicContact OD2-NH2 3.59Å; D616-R651 PolarHBondContact OD2-NH2 3.04Å
617	Y	81.9	Confident	78.2	Confident	49 Å²	49	65.6 Å²	65.6	19%	0.192	33%	0.332	C	S	.	.	H	α-helix	trans	-71	-38.2	178.8	-61	-68.9	0	0	0	112.6	I558 N561 P614 Y619 L620 I621	I558-Y617 HydrophobicContact CG1-CE1 4.11Å; I558-Y617 HydrophobicContact CG2-CE1 4.21Å; N561-Y617 HydrophobicContact CB-CE2 3.87Å; N561-Y617 PolarHBondContact ND2-OH 3.14Å; P614-Y617 HydrophobicContact CB-CD2 3.97Å; P614-Y617 PolarHBondContact O-N 3.35Å; Y617-Y619 VanDerWaalsContact C-N 3.35Å; Y617-Y619 PolarHBondContact O-N 2.9Å; Y617-L620 PolarHBondContact O-N 3.06Å; Y617-I621 WeakPolarHBondContact O-CD1 3.28Å; Y617-I621 VanDerWaalsContact O-CG1 3.27Å; Y617-I621 WeakPolarHBondContact O-CG1 3.23Å; Y617-I621 PolarHBondContact O-N 3.12Å
618	I	83	Confident	76.5	Confident	70 Å²	70	67.6 Å²	67.6	36%	0.359	34%	0.339	S	S	.	.	H	α-helix	trans	-60.3	-45.7	175.6	-68.8	163.5	0	0	0	110.4	P614 I621 L622	P614-I618 HydrophobicContact CG-CD1 4.01Å; P614-I618 HydrophobicContact CG-CG1 4.29Å; P614-I618 VanDerWaalsContact O-CG1 3.28Å; P614-I618 WeakPolarHBondContact O-CG1 3.3Å; P614-I618 PolarHBondContact O-N 3.13Å; I618-I621 PolarHBondContact O-N 3.41Å; I618-L622 HydrophobicContact CG2-CD1 3.84Å; I618-L622 HydrophobicContact CG2-CG 4.49Å; I618-L622 WeakPolarHBondContact O-CB 3.43Å; I618-L622 VanDerWaalsContact O-CG 3.29Å; I618-L622 WeakPolarHBondContact O-CG 3.47Å; I618-L622 PolarHBondContact O-N 3.06Å
619	Y	76.3	Confident	74.8	Confident	79 Å²	79	73.1 Å²	73.1	31%	0.31	37%	0.372	S	S	.	.	H	α-helix	trans	-67.6	-37.5	179.9	-174.7	-104.6	0	0	0	112.7	L615 Y617 L622 H623 F640 V644 L647	L615-Y619 WeakPolarHBondContact O-CB 3.26Å; L615-Y619 PolarHBondContact O-N 3.13Å; Y617-Y619 VanDerWaalsContact C-N 3.35Å; Y617-Y619 PolarHBondContact O-N 2.9Å; Y619-L622 PolarHBondContact O-N 3.29Å; Y619-H623 PolarHBondContact O-N 2.94Å; Y619-F640 HydrophobicContact CD1-CZ 4.17Å; Y619-F640 AromaticContact CE1-CE1 3.88Å; Y619-F640 HydrophobicContact CE1-CE1 3.88Å; Y619-F640 AromaticContact CE1-CE2 3.66Å; Y619-F640 HydrophobicContact CE1-CE2 3.66Å; Y619-F640 AromaticContact CE1-CZ 3.28Å; Y619-F640 HydrophobicContact CE1-CZ 3.28Å; Y619-F640 AromaticContact CZ-CE2 3.79Å; Y619-F640 AromaticContact CZ-CZ 3.78Å; Y619-F640 WeakPolarHBondContact OH-CE2 3.32Å; Y619-V644 HydrophobicContact CD1-CG1 4.47Å; Y619-V644 HydrophobicContact CD1-CG2 3.62Å; Y619-V644 HydrophobicContact CE1-CG2 3.84Å; Y619-L647 HydrophobicContact CD1-CD1 4.48Å; Y619-L647 HydrophobicContact CG-CD1 4.36Å
620	L	76.8	Confident	72.9	Confident	50 Å²	50	77.8 Å²	77.8	26%	0.262	39%	0.393	S	S	.	.	H	α-helix	trans	-59	-52.7	173.4	-171.7	70.3	0	0	0	111	D616 Y617 L622 H623 D624	D616-L620 PolarHBondContact O-N 3.38Å; D616-L620 VanDerWaalsContact O-N 3.1Å; Y617-L620 PolarHBondContact O-N 3.06Å; L620-L622 VanDerWaalsContact C-N 3.3Å; L620-L622 PolarHBondContact O-N 2.91Å; L620-H623 PolarHBondContact O-N 2.89Å; L620-H623 VanDerWaalsContact O-N 3.14Å; L620-D624 PolarHBondContact O-N 2.92Å; L620-D624 VanDerWaalsContact O-N 3.13Å
621	I	80.4	Confident	71.3	Confident	115 Å²	115	78.4 Å²	78.4	59%	0.59	39%	0.393	S	S	*	.	H	α-helix	trans	-60.2	-38.5	-179.7	-67.3	163.5	0	0	0	111.8	Y617 I618 H623	Y617-I621 WeakPolarHBondContact O-CD1 3.28Å; Y617-I621 VanDerWaalsContact O-CG1 3.27Å; Y617-I621 WeakPolarHBondContact O-CG1 3.23Å; Y617-I621 PolarHBondContact O-N 3.12Å; I618-I621 PolarHBondContact O-N 3.41Å; I621-H623 VanDerWaalsContact C-N 3.3Å; I621-H623 PolarHBondContact O-N 3.47Å
622	L	81	Confident	69.6	Low	133 Å²	133	81.8 Å²	81.8	70%	0.696	41%	0.413	S	S	*	.	H	α-helix	trans	-71.6	-19.7	179.6	-73.3	171.8	0	0	0	114.1	I618 Y619 L620	I618-L622 HydrophobicContact CG2-CD1 3.84Å; I618-L622 HydrophobicContact CG2-CG 4.49Å; I618-L622 WeakPolarHBondContact O-CB 3.43Å; I618-L622 VanDerWaalsContact O-CG 3.29Å; I618-L622 WeakPolarHBondContact O-CG 3.47Å; I618-L622 PolarHBondContact O-N 3.06Å; Y619-L622 PolarHBondContact O-N 3.29Å; L620-L622 VanDerWaalsContact C-N 3.3Å; L620-L622 PolarHBondContact O-N 2.91Å
623	H	72.2	Confident	67.8	Low	60 Å²	60	90 Å²	90	28%	0.278	45%	0.451	S	S	.	.	H	α-helix	trans	-107.8	-14.2	-176.3	-148.9	72.2	0	0	0	114.5	Y619 L620 I621 N625 F640	Y619-H623 PolarHBondContact O-N 2.94Å; L620-H623 PolarHBondContact O-N 2.89Å; L620-H623 VanDerWaalsContact O-N 3.14Å; I621-H623 VanDerWaalsContact C-N 3.3Å; I621-H623 PolarHBondContact O-N 3.47Å; H623-N625 PolarHBondContact O-N 3.19Å; H623-F640 HydrophobicContact CB-CZ 4.02Å; H623-F640 AromaticContact CD2-CE2 3.86Å; H623-F640 AromaticContact CD2-CZ 3.44Å; H623-F640 VanDerWaalsContact CD2-CZ 3.44Å; H623-F640 WeakPolarHBondContact CD2-CZ 3.39Å; H623-F640 AromaticContact CG-CZ 3.7Å
624	D	65.6	Low	66.2	Low	83 Å²	83	89.5 Å²	89.5	44%	0.444	46%	0.455	S	S	.	.	H	α-helix	trans	-64.7	-37.7	-178.3	-134.1	10.2	0	0	0	112.6	L620 E626	L620-D624 PolarHBondContact O-N 2.92Å; L620-D624 VanDerWaalsContact O-N 3.13Å; D624-E626 PolarHBondContact O-N 3.17Å
625	N	58.1	Low	64.8	Low	146 Å²	146	90.1 Å²	90.1	78%	0.781	47%	0.468	S	S	*	.	H	α-helix	trans	-73.2	-26.7	-160.9	-83.1	-18.3	0	0	0	117.4	H623	H623-N625 PolarHBondContact O-N 3.19Å
626	E	56.7	Low	63.7	Low	178 Å²	178	95.9 Å²	95.9	83%	0.832	49%	0.487	S	S	*	.	H	α-helix	trans	-133	-11.2	-170.4	-68.8	-164	167.9	0	0	117.1	D624	D624-E626 PolarHBondContact O-N 3.17Å
627	N	52.2	Low	62.8	Low	71 Å²	71	96 Å²	96	38%	0.38	49%	0.49	S	S	.	.	H	α-helix	trans	-131.9	-5.4	-175.8	-77.9	-83.7	0	0	0	115.8	T629 Q630 F631	N627-T629 VanDerWaalsContact C-N 3.35Å; N627-T629 PolarHBondContact O-N 3.06Å; N627-Q630 PolarHBondContact O-N 3.42Å; N627-F631 HydrophobicContact CB-CD2 4.1Å; N627-F631 HydrophobicContact CB-CE2 4.22Å; N627-F631 PolarHBondContact O-N 3.17Å
628	F	51.6	Low	61.9	Low	98 Å²	98	98.6 Å²	98.6	43%	0.43	51%	0.507	S	S	.	.	H	α-helix	trans	-57.7	-42.1	-167.7	-165.3	-112	0	0	0	113.7	Q630 F631 V632	F628-Q630 VanDerWaalsContact C-N 3.28Å; F628-Q630 PolarHBondContact O-N 3.02Å; F628-F631 PolarHBondContact O-N 3.41Å; F628-V632 HydrophobicContact CD1-CG2 3.68Å; F628-V632 HydrophobicContact CD2-CG2 4.18Å; F628-V632 HydrophobicContact CE1-CG2 3.44Å; F628-V632 VanDerWaalsContact CE1-CG2 3.44Å; F628-V632 HydrophobicContact CE2-CG2 3.97Å; F628-V632 HydrophobicContact CG-CG2 4.04Å; F628-V632 HydrophobicContact CZ-CG2 3.6Å; F628-V632 WeakPolarHBondContact O-CB 3.37Å; F628-V632 VanDerWaalsContact O-CG2 3.24Å; F628-V632 WeakPolarHBondContact O-CG2 3.32Å; F628-V632 PolarHBondContact O-N 3.38Å
629	T	52.6	Low	60.9	Low	115 Å²	115	102.4 Å²	102.4	71%	0.706	52%	0.516	S	S	*	.	H	α-helix	trans	-62.5	-27	-178.2	52.2	0	0	0	0	114.6	N627	N627-T629 VanDerWaalsContact C-N 3.35Å; N627-T629 PolarHBondContact O-N 3.06Å
630	Q	52	Low	60.6	Low	154 Å²	154	101 Å²	101	72%	0.72	51%	0.512	S	S	*	.	H	α-helix	trans	-86.3	-33.5	175.1	-70	-166.7	-1.6	0	0	112.9	N627 F628	N627-Q630 PolarHBondContact O-N 3.42Å; F628-Q630 VanDerWaalsContact C-N 3.28Å; F628-Q630 PolarHBondContact O-N 3.02Å
631	F	51.6	Low	60.1	Low	86 Å²	86	102.1 Å²	102.1	38%	0.377	52%	0.518	S	S	.	.	H	α-helix	trans	-76.8	-31.7	-179.9	-83.4	-90.6	0	0	0	113.5	N627 F628 H633 A634 R636 A637	N627-F631 HydrophobicContact CB-CD2 4.1Å; N627-F631 HydrophobicContact CB-CE2 4.22Å; N627-F631 PolarHBondContact O-N 3.17Å; F628-F631 PolarHBondContact O-N 3.41Å; F631-H633 VanDerWaalsContact C-N 3.26Å; F631-H633 PolarHBondContact O-N 2.67Å; F631-A634 PolarHBondContact O-N 3.49Å; F631-R636 HydrophobicContact CD1-CB 4.5Å; F631-A637 WeakPolarHBondContact O-CB 3.48Å
632	V	51.5	Low	59.5	Low	71 Å²	71	98.3 Å²	98.3	43%	0.43	50%	0.496	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-32.4	-178.7	161.8	0	0	0	0	113.5	F628 A634	F628-V632 HydrophobicContact CD1-CG2 3.68Å; F628-V632 HydrophobicContact CD2-CG2 4.18Å; F628-V632 HydrophobicContact CE1-CG2 3.44Å; F628-V632 VanDerWaalsContact CE1-CG2 3.44Å; F628-V632 HydrophobicContact CE2-CG2 3.97Å; F628-V632 HydrophobicContact CG-CG2 4.04Å; F628-V632 HydrophobicContact CZ-CG2 3.6Å; F628-V632 WeakPolarHBondContact O-CB 3.37Å; F628-V632 VanDerWaalsContact O-CG2 3.24Å; F628-V632 WeakPolarHBondContact O-CG2 3.32Å; F628-V632 PolarHBondContact O-N 3.38Å; V632-A634 VanDerWaalsContact C-N 3.27Å; V632-A634 PolarHBondContact O-N 3.03Å
633	H	51	Low	59.1	Low	174 Å²	174	97.3 Å²	97.3	81%	0.806	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.8	8.4	-176.1	-78	-67.4	0	0	0	115.5	F631	F631-H633 VanDerWaalsContact C-N 3.26Å; F631-H633 PolarHBondContact O-N 2.67Å
634	A	51	Low	59.1	Low	49 Å²	49	95 Å²	95	41%	0.405	48%	0.477	S	S	.	.	S	Bend	trans	-136.4	153.6	176.8	0	0	0	0	0	112.9	F631 V632 R636 A637	F631-A634 PolarHBondContact O-N 3.49Å; V632-A634 VanDerWaalsContact C-N 3.27Å; V632-A634 PolarHBondContact O-N 3.03Å; A634-R636 PolarHBondContact O-N 3.23Å; A634-A637 PolarHBondContact O-N 3.48Å
635	G	56.6	Low	59.3	Low	49 Å²	49	92.7 Å²	92.7	51%	0.505	46%	0.462	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64	24.5	172	0	0	0	0	0	115.6	R639	G635-R639 PolarHBondContact O-NE 2.86Å; G635-R639 PolarHBondContact O-NH2 3.47Å
636	R	57.8	Low	60.2	Low	167 Å²	167	88.3 Å²	88.3	63%	0.63	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.4	-38	160.2	-74.9	-178.4	161.9	97.7	-2.4	110.8	F631 A634 L638 R639 F640	F631-R636 HydrophobicContact CD1-CB 4.5Å; A634-R636 PolarHBondContact O-N 3.23Å; R636-L638 PolarHBondContact O-N 3.34Å; R636-R639 PolarHBondContact O-N 3.04Å; R636-F640 WeakPolarHBondContact O-CB 3.49Å; R636-F640 PolarHBondContact O-N 3.24Å
637	A	58.8	Low	61.3	Low	19 Å²	19	81.6 Å²	81.6	16%	0.157	41%	0.408	C	S	.	.	H	α-helix	trans	-59.3	-43.8	-178.6	0	0	0	0	0	113.5	F631 A634 R639 F640 L641	F631-A637 WeakPolarHBondContact O-CB 3.48Å; A634-A637 PolarHBondContact O-N 3.48Å; A637-R639 VanDerWaalsContact C-N 3.35Å; A637-R639 PolarHBondContact O-N 2.69Å; A637-F640 WeakPolarHBondContact O-CB 3.19Å; A637-F640 PolarHBondContact O-N 3.47Å; A637-L641 WeakPolarHBondContact O-CG 3.48Å; A637-L641 PolarHBondContact O-N 3.23Å
638	L	62.3	Low	62.5	Low	104 Å²	104	78.6 Å²	78.6	55%	0.545	39%	0.393	S	S	.	.	H	α-helix	trans	-63.3	-38.6	177.4	-65.7	175.8	0	0	0	112.7	R636 R642	R636-L638 PolarHBondContact O-N 3.34Å; L638-R642 VanDerWaalsContact O-CG 3.3Å; L638-R642 WeakPolarHBondContact O-CG 3.41Å; L638-R642 PolarHBondContact O-N 3.42Å; L638-R642 VanDerWaalsContact O-N 3.1Å
639	R	63.7	Low	63.9	Low	149 Å²	149	76.6 Å²	76.6	56%	0.562	39%	0.387	S	S	*	.	H	α-helix	trans	-71.5	-34.4	175.1	-75.3	-179	-72.8	167.8	-7.3	112.4	G635 R636 A637 F643	G635-R639 PolarHBondContact O-NE 2.86Å; G635-R639 PolarHBondContact O-NH2 3.47Å; R636-R639 PolarHBondContact O-N 3.04Å; A637-R639 VanDerWaalsContact C-N 3.35Å; A637-R639 PolarHBondContact O-N 2.69Å; R639-F643 PolarHBondContact O-N 3.39Å
640	F	68.2	Low	65.4	Low	51 Å²	51	73.5 Å²	73.5	22%	0.224	37%	0.365	C	S	.	.	H	α-helix	trans	-62.1	-52.8	172.4	-179.7	-85.6	0	0	0	110.8	Y619 H623 R636 A637 R642 F643 V644	Y619-F640 HydrophobicContact CD1-CZ 4.17Å; Y619-F640 AromaticContact CE1-CE1 3.88Å; Y619-F640 HydrophobicContact CE1-CE1 3.88Å; Y619-F640 AromaticContact CE1-CE2 3.66Å; Y619-F640 HydrophobicContact CE1-CE2 3.66Å; Y619-F640 AromaticContact CE1-CZ 3.28Å; Y619-F640 HydrophobicContact CE1-CZ 3.28Å; Y619-F640 AromaticContact CZ-CE2 3.79Å; Y619-F640 AromaticContact CZ-CZ 3.78Å; Y619-F640 WeakPolarHBondContact OH-CE2 3.32Å; H623-F640 HydrophobicContact CB-CZ 4.02Å; H623-F640 AromaticContact CD2-CE2 3.86Å; H623-F640 AromaticContact CD2-CZ 3.44Å; H623-F640 VanDerWaalsContact CD2-CZ 3.44Å; H623-F640 WeakPolarHBondContact CD2-CZ 3.39Å; H623-F640 AromaticContact CG-CZ 3.7Å; R636-F640 WeakPolarHBondContact O-CB 3.49Å; R636-F640 PolarHBondContact O-N 3.24Å; A637-F640 WeakPolarHBondContact O-CB 3.19Å; A637-F640 PolarHBondContact O-N 3.47Å; F640-R642 VanDerWaalsContact C-N 3.3Å; F640-R642 PolarHBondContact O-N 3.42Å; F640-F643 WeakPolarHBondContact O-CA 3.45Å; F640-F643 WeakPolarHBondContact O-CB 3.48Å; F640-F643 PolarHBondContact O-N 3.05Å; F640-V644 HydrophobicContact CD1-CG2 4.16Å; F640-V644 HydrophobicContact CE1-CG2 4.08Å; F640-V644 WeakPolarHBondContact O-CG2 3.47Å; F640-V644 PolarHBondContact O-N 2.84Å
641	L	66.4	Low	66.9	Low	73 Å²	73	66.4 Å²	66.4	38%	0.382	33%	0.332	S	S	.	.	H	α-helix	trans	-57	-41.2	176.9	-70.9	169.6	0	0	0	112.3	A637 F643 V644 K645	A637-L641 WeakPolarHBondContact O-CG 3.48Å; A637-L641 PolarHBondContact O-N 3.23Å; L641-F643 PolarHBondContact O-N 3.1Å; L641-V644 WeakPolarHBondContact O-CB 3.46Å; L641-V644 PolarHBondContact O-N 3.33Å; L641-K645 PolarHBondContact O-N 2.93Å
642	R	68.6	Low	68.3	Low	35 Å²	35	63.8 Å²	63.8	13%	0.132	32%	0.322	C	S	.	.	H	α-helix	trans	-60.3	-40.4	172	-74.4	171.8	-173.4	156.7	15.8	112.9	L638 F640 K645 L646 L702 D704	L638-R642 VanDerWaalsContact O-CG 3.3Å; L638-R642 WeakPolarHBondContact O-CG 3.41Å; L638-R642 PolarHBondContact O-N 3.42Å; L638-R642 VanDerWaalsContact O-N 3.1Å; F640-R642 VanDerWaalsContact C-N 3.3Å; F640-R642 PolarHBondContact O-N 3.42Å; R642-K645 WeakPolarHBondContact O-CB 3.49Å; R642-K645 PolarHBondContact O-N 3.4Å; R642-L646 WeakPolarHBondContact O-CG 3.45Å; R642-L646 PolarHBondContact O-N 3.41Å; R642-L646 VanDerWaalsContact O-N 3.07Å; R642-L702 HydrophobicContact CB-CD2 3.81Å; R642-L702 HydrophobicContact CG-CD2 4.2Å; R642-L702 PolarHBondContact NH1-O 3.27Å; R642-D704 IonicContact CZ-OD1 2.7Å; R642-D704 VanDerWaalsContact CZ-OD1 3.31Å; R642-D704 IonicContact CZ-OD2 2.67Å; R642-D704 IonicContact NH1-OD1 3.43Å; R642-D704 PolarHBondContact NH1-OD1 2.9Å; R642-D704 IonicContact NH1-OD2 3.21Å; R642-D704 PolarHBondContact NH1-OD2 2.72Å; R642-D704 IonicContact NH2-OD1 2.91Å; R642-D704 PolarHBondContact NH2-OD1 3.44Å; R642-D704 IonicContact NH2-OD2 3.35Å
643	F	72.1	Confident	69.8	Low	111 Å²	111	63.9 Å²	63.9	49%	0.487	32%	0.319	S	S	.	.	H	α-helix	trans	-64.7	-38.7	174.6	-175.7	-96.8	0	0	0	112	R639 F640 L641 K645 L646 L647	R639-F643 PolarHBondContact O-N 3.39Å; F640-F643 WeakPolarHBondContact O-CA 3.45Å; F640-F643 WeakPolarHBondContact O-CB 3.48Å; F640-F643 PolarHBondContact O-N 3.05Å; L641-F643 PolarHBondContact O-N 3.1Å; F643-K645 VanDerWaalsContact C-N 3.32Å; F643-K645 PolarHBondContact O-N 3.45Å; F643-L646 WeakPolarHBondContact O-CB 3.24Å; F643-L646 PolarHBondContact O-N 3.22Å; F643-L647 HydrophobicContact CE1-CD1 4.36Å; F643-L647 HydrophobicContact CE1-CD2 4.08Å; F643-L647 HydrophobicContact CE1-CG 4.25Å; F643-L647 HydrophobicContact CZ-CD2 4.25Å; F643-L647 PolarHBondContact O-N 3.29Å; F643-L647 VanDerWaalsContact O-N 3.13Å
644	V	73.2	Confident	71.3	Confident	13 Å²	13	55.6 Å²	55.6	8%	0.079	28%	0.281	C	S	.	.	H	α-helix	trans	-59.9	-42.2	172.5	-170.3	0	0	0	0	111.2	D616 Y619 F640 L641 L646 L647	D616-V644 HydrophobicContact CB-CG1 3.9Å; D616-V644 WeakPolarHBondContact O-CG1 3.29Å; Y619-V644 HydrophobicContact CD1-CG1 4.47Å; Y619-V644 HydrophobicContact CD1-CG2 3.62Å; Y619-V644 HydrophobicContact CE1-CG2 3.84Å; F640-V644 HydrophobicContact CD1-CG2 4.16Å; F640-V644 HydrophobicContact CE1-CG2 4.08Å; F640-V644 WeakPolarHBondContact O-CG2 3.47Å; F640-V644 PolarHBondContact O-N 2.84Å; L641-V644 WeakPolarHBondContact O-CB 3.46Å; L641-V644 PolarHBondContact O-N 3.33Å; V644-L646 VanDerWaalsContact C-N 3.3Å; V644-L646 PolarHBondContact O-N 3Å; V644-L647 WeakPolarHBondContact O-CB 3.41Å; V644-L647 PolarHBondContact O-N 2.99Å
645	K	70.2	Confident	72.6	Confident	33 Å²	33	55.6 Å²	55.6	14%	0.143	27%	0.274	C	S	.	.	H	α-helix	trans	-60	-38.1	172.8	-62.4	-161.9	-173.6	-156	0	112.4	I546 F549 N550 D552 L641 R642 F643 L647 S648	I546-K645 HydrophobicContact CG2-CB 4.41Å; F549-K645 PolarHBondContact O-NZ 3.32Å; N550-K645 PolarHBondContact O-NZ 3.04Å; D552-K645 IonicContact OD1-NZ 2.71Å; D552-K645 PolarHBondContact OD1-NZ 3.44Å; D552-K645 WeakPolarHBondContact OD2-CE 3.19Å; D552-K645 IonicContact OD2-NZ 3.59Å; D552-K645 PolarHBondContact OD2-NZ 3.12Å; L641-K645 PolarHBondContact O-N 2.93Å; R642-K645 WeakPolarHBondContact O-CB 3.49Å; R642-K645 PolarHBondContact O-N 3.4Å; F643-K645 VanDerWaalsContact C-N 3.32Å; F643-K645 PolarHBondContact O-N 3.45Å; K645-L647 VanDerWaalsContact C-N 3.32Å; K645-L647 PolarHBondContact O-N 2.88Å; K645-S648 WeakPolarHBondContact O-CB 3.24Å; K645-S648 PolarHBondContact O-N 3.18Å; K645-S648 VanDerWaalsContact O-N 3.14Å; K645-S648 PolarHBondContact O-OG 3.05Å
646	L	76.7	Confident	73.8	Confident	54 Å²	54	54.3 Å²	54.3	28%	0.283	26%	0.257	S	S	.	.	H	α-helix	trans	-66	-30.7	176.7	-66.6	175.7	0	0	0	113.2	R642 F643 V644 S648 L649 L698 L702	R642-L646 WeakPolarHBondContact O-CG 3.45Å; R642-L646 PolarHBondContact O-N 3.41Å; R642-L646 VanDerWaalsContact O-N 3.07Å; F643-L646 WeakPolarHBondContact O-CB 3.24Å; F643-L646 PolarHBondContact O-N 3.22Å; V644-L646 VanDerWaalsContact C-N 3.3Å; V644-L646 PolarHBondContact O-N 3Å; L646-S648 PolarHBondContact O-N 2.64Å; L646-L649 HydrophobicContact CD2-CD1 3.65Å; L646-L649 VanDerWaalsContact O-CB 3.32Å; L646-L649 WeakPolarHBondContact O-CB 3.35Å; L646-L649 PolarHBondContact O-N 3.4Å; L646-L649 VanDerWaalsContact O-N 3.12Å; L646-L698 HydrophobicContact CD2-CD2 4.06Å; L646-L702 HydrophobicContact CD1-CD1 4.13Å; L646-L702 HydrophobicContact CD1-CD2 4.16Å; L646-L702 HydrophobicContact CD2-CD1 4.26Å; L646-L702 HydrophobicContact CG-CD2 4.44Å
647	L	78.5	Confident	74.9	Confident	37 Å²	37	46.4 Å²	46.4	19%	0.194	23%	0.227	C	C	.	.	H	α-helix	trans	-61.2	-31.5	172.6	-62.9	177.9	0	0	0	112	Y619 F643 V644 K645 L649 I650	Y619-L647 HydrophobicContact CD1-CD1 4.48Å; Y619-L647 HydrophobicContact CG-CD1 4.36Å; F643-L647 HydrophobicContact CE1-CD1 4.36Å; F643-L647 HydrophobicContact CE1-CD2 4.08Å; F643-L647 HydrophobicContact CE1-CG 4.25Å; F643-L647 HydrophobicContact CZ-CD2 4.25Å; F643-L647 PolarHBondContact O-N 3.29Å; F643-L647 VanDerWaalsContact O-N 3.13Å; V644-L647 WeakPolarHBondContact O-CB 3.41Å; V644-L647 PolarHBondContact O-N 2.99Å; K645-L647 VanDerWaalsContact C-N 3.32Å; K645-L647 PolarHBondContact O-N 2.88Å; L647-L649 PolarHBondContact O-N 2.85Å; L647-I650 HydrophobicContact CD2-CD1 4.41Å; L647-I650 VanDerWaalsContact O-CB 3.25Å; L647-I650 WeakPolarHBondContact O-CB 3.37Å; L647-I650 WeakPolarHBondContact O-CD1 3.24Å; L647-I650 VanDerWaalsContact O-CG1 3.25Å; L647-I650 WeakPolarHBondContact O-CG1 3.3Å; L647-I650 PolarHBondContact O-N 2.97Å; L647-I650 VanDerWaalsContact O-N 3.09Å
648	S	78.4	Confident	75.9	Confident	9 Å²	9	46.9 Å²	46.9	6%	0.063	23%	0.227	C	C	.	.	G	3₁₀ helix	trans	-66.5	-18.4	177.2	77.8	0	0	0	0	114	I546 K645 L646 I650 R651	I546-S648 WeakPolarHBondContact CD1-OG 3.26Å; I546-S648 WeakPolarHBondContact CG1-OG 3.3Å; K645-S648 WeakPolarHBondContact O-CB 3.24Å; K645-S648 PolarHBondContact O-N 3.18Å; K645-S648 VanDerWaalsContact O-N 3.14Å; K645-S648 PolarHBondContact O-OG 3.05Å; L646-S648 PolarHBondContact O-N 2.64Å; S648-I650 PolarHBondContact O-N 3.42Å; S648-R651 VanDerWaalsContact O-CB 3.27Å; S648-R651 WeakPolarHBondContact O-CB 3.35Å; S648-R651 WeakPolarHBondContact O-CG 3.43Å; S648-R651 PolarHBondContact O-N 3.46Å
649	L	80.8	Confident	76.6	Confident	56 Å²	56	46.5 Å²	46.5	29%	0.293	23%	0.229	S	C	.	.	G	3₁₀ helix	trans	-64.9	-17.4	172.1	-64.8	170.2	0	0	0	112.7	I546 L646 L647 R651 L652 L698	I546-L649 HydrophobicContact CD1-CD2 3.59Å; I546-L649 HydrophobicContact CD1-CG 4.09Å; I546-L649 HydrophobicContact CG2-CD2 4.32Å; L646-L649 HydrophobicContact CD2-CD1 3.65Å; L646-L649 VanDerWaalsContact O-CB 3.32Å; L646-L649 WeakPolarHBondContact O-CB 3.35Å; L646-L649 PolarHBondContact O-N 3.4Å; L646-L649 VanDerWaalsContact O-N 3.12Å; L647-L649 PolarHBondContact O-N 2.85Å; L649-R651 PolarHBondContact O-N 3.27Å; L649-L652 HydrophobicContact CD2-CD1 3.83Å; L649-L652 VanDerWaalsContact O-CB 3.26Å; L649-L652 WeakPolarHBondContact O-CB 3.39Å; L649-L652 WeakPolarHBondContact O-CG 3.49Å; L649-L652 PolarHBondContact O-N 2.88Å; L649-L698 HydrophobicContact CD1-CD2 4.49Å
650	I	83.9	Confident	77.3	Confident	49 Å²	49	41 Å²	41	25%	0.251	21%	0.208	S	C	.	.	G	3₁₀ helix	trans	-60.5	-26.6	171.6	-62.6	170.7	0	0	0	110.8	L610 L615 L647 S648 L652 L653	L610-I650 HydrophobicContact CD1-CG2 4.04Å; L610-I650 HydrophobicContact CD2-CG2 4.41Å; L610-I650 HydrophobicContact CG-CG2 3.74Å; L615-I650 HydrophobicContact CD1-CD1 3.74Å; L615-I650 HydrophobicContact CD1-CG2 4.41Å; L647-I650 HydrophobicContact CD2-CD1 4.41Å; L647-I650 VanDerWaalsContact O-CB 3.25Å; L647-I650 WeakPolarHBondContact O-CB 3.37Å; L647-I650 WeakPolarHBondContact O-CD1 3.24Å; L647-I650 VanDerWaalsContact O-CG1 3.25Å; L647-I650 WeakPolarHBondContact O-CG1 3.3Å; L647-I650 PolarHBondContact O-N 2.97Å; L647-I650 VanDerWaalsContact O-N 3.09Å; S648-I650 PolarHBondContact O-N 3.42Å; I650-L652 PolarHBondContact O-N 2.86Å; I650-L652 VanDerWaalsContact O-N 3.17Å; I650-L653 HydrophobicContact CG2-CD1 4Å; I650-L653 WeakPolarHBondContact O-CB 3.46Å; I650-L653 WeakPolarHBondContact O-CG 3.43Å; I650-L653 PolarHBondContact O-N 2.71Å; I650-L653 VanDerWaalsContact O-N 3.09Å
651	R	83.7	Confident	77.7	Confident	5 Å²	5	38.6 Å²	38.6	2%	0.019	20%	0.198	C	C	.	.	G	3₁₀ helix	trans	-60.5	-21	170.9	-63.1	-172.3	176	96.7	8.7	112.9	L542 D565 D616 S648 L649 L653 R654	L542-R651 HydrophobicContact CD1-CB 3.75Å; L542-R651 HydrophobicContact CD1-CG 4.43Å; D565-R651 IonicContact OD1-NE 2.8Å; D565-R651 PolarHBondContact OD1-NE 2.98Å; D565-R651 VanDerWaalsContact OD1-NE 3.08Å; D565-R651 IonicContact OD2-CZ 3.27Å; D565-R651 IonicContact OD2-NE 3.59Å; D565-R651 PolarHBondContact OD2-NE 3.16Å; D565-R651 IonicContact OD2-NH2 2.7Å; D565-R651 PolarHBondContact OD2-NH2 3.28Å; D616-R651 IonicContact OD1-CZ 3.88Å; D616-R651 IonicContact OD1-NH1 3.99Å; D616-R651 IonicContact OD1-NH2 2.89Å; D616-R651 PolarHBondContact OD1-NH2 2.87Å; D616-R651 IonicContact OD2-CZ 2.8Å; D616-R651 IonicContact OD2-NH1 3.08Å; D616-R651 PolarHBondContact OD2-NH1 2.98Å; D616-R651 IonicContact OD2-NH2 3.59Å; D616-R651 PolarHBondContact OD2-NH2 3.04Å; S648-R651 VanDerWaalsContact O-CB 3.27Å; S648-R651 WeakPolarHBondContact O-CB 3.35Å; S648-R651 WeakPolarHBondContact O-CG 3.43Å; S648-R651 PolarHBondContact O-N 3.46Å; L649-R651 PolarHBondContact O-N 3.27Å; R651-L653 PolarHBondContact O-N 3.24Å; R651-R654 VanDerWaalsContact O-CB 3.25Å; R651-R654 WeakPolarHBondContact O-CB 3.3Å; R651-R654 VanDerWaalsContact O-CD 3.26Å; R651-R654 WeakPolarHBondContact O-CD 3.44Å; R651-R654 WeakPolarHBondContact O-CG 3.32Å; R651-R654 PolarHBondContact O-N 3.03Å
652	L	81	Confident	78.1	Confident	32 Å²	32	37.2 Å²	37.2	17%	0.168	19%	0.192	C	C	.	.	G	3₁₀ helix	trans	-69.3	-16.2	175.7	-59.1	-179.6	0	0	0	113.2	L539 P543 L649 I650 R654 L655 W691	L539-L652 HydrophobicContact CD2-CD2 3.82Å; P543-L652 HydrophobicContact CG-CD2 4.2Å; L649-L652 HydrophobicContact CD2-CD1 3.83Å; L649-L652 VanDerWaalsContact O-CB 3.26Å; L649-L652 WeakPolarHBondContact O-CB 3.39Å; L649-L652 WeakPolarHBondContact O-CG 3.49Å; L649-L652 PolarHBondContact O-N 2.88Å; I650-L652 PolarHBondContact O-N 2.86Å; I650-L652 VanDerWaalsContact O-N 3.17Å; L652-R654 PolarHBondContact O-N 3.38Å; L652-R654 VanDerWaalsContact O-N 3.07Å; L652-L655 WeakPolarHBondContact O-CB 3.25Å; L652-L655 PolarHBondContact O-N 3.01Å; L652-W691 HydrophobicContact CB-CH2 4.39Å; L652-W691 HydrophobicContact CD2-CH2 4.49Å; L652-W691 HydrophobicContact CD2-CZ2 3.96Å
653	L	83	Confident	78.3	Confident	72 Å²	72	38.6 Å²	38.6	38%	0.377	21%	0.207	S	C	.	.	G	3₁₀ helix	trans	-59.8	-17.1	170.2	-63.9	178.6	0	0	0	112.7	L607 L610 I650 R651 L655 S656	L607-L653 HydrophobicContact CD2-CB 3.99Å; L607-L653 WeakPolarHBondContact CD2-O 3.22Å; L610-L653 HydrophobicContact CD2-CD1 3.97Å; L610-L653 HydrophobicContact CG-CD1 4.28Å; I650-L653 HydrophobicContact CG2-CD1 4Å; I650-L653 WeakPolarHBondContact O-CB 3.46Å; I650-L653 WeakPolarHBondContact O-CG 3.43Å; I650-L653 PolarHBondContact O-N 2.71Å; I650-L653 VanDerWaalsContact O-N 3.09Å; R651-L653 PolarHBondContact O-N 3.24Å; L653-L655 PolarHBondContact O-N 2.97Å; L653-L655 VanDerWaalsContact O-N 3.11Å; L653-S656 WeakPolarHBondContact O-CB 3.19Å; L653-S656 PolarHBondContact O-N 3.45Å; L653-S656 VanDerWaalsContact O-N 3.11Å; L653-S656 PolarHBondContact O-OG 2.96Å
654	R	82.5	Confident	78.3	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	20%	0.204	C	C	.	.	G	3₁₀ helix	trans	-54.7	-22.5	168.8	-67.4	169.3	-166.3	-179	-1.4	112.8	L535 N538 D565 F568 S611 R651 L652 S656 R657 L658	L535-R654 HydrophobicContact CD1-CB 4.42Å; L535-R654 WeakPolarHBondContact CD1-O 3.38Å; L535-R654 HydrophobicContact CG-CB 4.33Å; N538-R654 PolarHBondContact OD1-NH1 3.38Å; D565-R654 IonicContact OD1-CZ 2.79Å; D565-R654 VanDerWaalsContact OD1-CZ 3.3Å; D565-R654 IonicContact OD1-NH1 3.6Å; D565-R654 PolarHBondContact OD1-NH1 3.23Å; D565-R654 IonicContact OD1-NH2 2.62Å; D565-R654 PolarHBondContact OD1-NH2 2.91Å; F568-R654 VanDerWaalsContact CD2-NH1 3.31Å; F568-R654 HydrophobicContact CE1-CG 4.49Å; S611-R654 VanDerWaalsContact O-CZ 3.23Å; S611-R654 PolarHBondContact O-NE 3.22Å; S611-R654 PolarHBondContact O-NH2 2.58Å; R651-R654 VanDerWaalsContact O-CB 3.25Å; R651-R654 WeakPolarHBondContact O-CB 3.3Å; R651-R654 VanDerWaalsContact O-CD 3.26Å; R651-R654 WeakPolarHBondContact O-CD 3.44Å; R651-R654 WeakPolarHBondContact O-CG 3.32Å; R651-R654 PolarHBondContact O-N 3.03Å; L652-R654 PolarHBondContact O-N 3.38Å; L652-R654 VanDerWaalsContact O-N 3.07Å; R654-S656 PolarHBondContact O-N 3.32Å; R654-S656 VanDerWaalsContact O-N 3.1Å; R654-R657 PolarHBondContact O-N 3.49Å; R654-L658 PolarHBondContact O-N 2.95Å
655	L	79	Confident	78.2	Confident	49 Å²	49	39.2 Å²	39.2	26%	0.257	21%	0.209	S	C	.	.	H	α-helix	trans	-51.8	-32.2	173.3	-174.4	72.1	0	0	0	112.7	L539 L652 L653 R657 L658 V659 L687 W691	L539-L655 HydrophobicContact CD1-CB 4.39Å; L539-L655 HydrophobicContact CD1-CD1 3.74Å; L652-L655 WeakPolarHBondContact O-CB 3.25Å; L652-L655 PolarHBondContact O-N 3.01Å; L653-L655 PolarHBondContact O-N 2.97Å; L653-L655 VanDerWaalsContact O-N 3.11Å; L655-R657 VanDerWaalsContact C-N 3.32Å; L655-R657 PolarHBondContact O-N 3.36Å; L655-L658 HydrophobicContact CD1-CB 4.46Å; L655-L658 HydrophobicContact CD1-CD2 3.9Å; L655-L658 WeakPolarHBondContact O-CB 3.48Å; L655-L658 PolarHBondContact O-N 3.41Å; L655-L658 VanDerWaalsContact O-N 3.13Å; L655-V659 PolarHBondContact O-N 3.41Å; L655-V659 VanDerWaalsContact O-N 3.16Å; L655-L687 HydrophobicContact CD1-CD2 4.23Å; L655-W691 HydrophobicContact CB-CH2 4.29Å; L655-W691 HydrophobicContact CD1-CH2 4.21Å; L655-W691 HydrophobicContact CD2-CH2 3.92Å; L655-W691 HydrophobicContact CD2-CZ3 4.13Å; L655-W691 HydrophobicContact CG-CH2 4.37Å
656	S	80.2	Confident	78.2	Confident	23 Å²	23	40.7 Å²	40.7	16%	0.161	22%	0.216	C	C	.	.	H	α-helix	trans	-55	-43.9	172.5	60	0	0	0	0	113	L607 L653 R654 V659 R660	L607-S656 WeakPolarHBondContact CD2-OG 3.16Å; L653-S656 WeakPolarHBondContact O-CB 3.19Å; L653-S656 PolarHBondContact O-N 3.45Å; L653-S656 VanDerWaalsContact O-N 3.11Å; L653-S656 PolarHBondContact O-OG 2.96Å; R654-S656 PolarHBondContact O-N 3.32Å; R654-S656 VanDerWaalsContact O-N 3.1Å; S656-V659 PolarHBondContact O-N 2.88Å; S656-R660 WeakPolarHBondContact O-CG 3.38Å; S656-R660 PolarHBondContact O-N 3.37Å
657	R	81.5	Confident	77.7	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-67.2	-36.8	176.7	-50.7	-162.5	-165.2	165.1	23.9	111.4	L535 F568 D571 D608 S611 S612 R654 L655 V659 R660 Y661	L535-R657 HydrophobicContact CD1-CB 3.95Å; F568-R657 PolarHBondContact O-NH1 3.18Å; D571-R657 IonicContact OD2-CZ 2.69Å; D571-R657 IonicContact OD2-NH1 3.03Å; D571-R657 PolarHBondContact OD2-NH1 2.94Å; D608-R657 VanDerWaalsContact CG-NE 3.27Å; D608-R657 PolarHBondContact O-NH2 3.39Å; D608-R657 WeakPolarHBondContact OD1-CG 3.4Å; D608-R657 IonicContact OD1-CZ 3.74Å; D608-R657 IonicContact OD1-NE 2.73Å; D608-R657 PolarHBondContact OD1-NE 3.33Å; D608-R657 IonicContact OD1-NH2 3.35Å; D608-R657 IonicContact OD2-NE 2.77Å; S611-R657 PolarHBondContact OG-NH2 2.91Å; S612-R657 PolarHBondContact OG-NH2 3.24Å; R654-R657 PolarHBondContact O-N 3.49Å; L655-R657 VanDerWaalsContact C-N 3.32Å; L655-R657 PolarHBondContact O-N 3.36Å; R657-V659 VanDerWaalsContact C-N 3.31Å; R657-V659 PolarHBondContact O-N 3.22Å; R657-R660 PolarHBondContact O-N 3.29Å; R657-Y661 HydrophobicContact CB-CD2 4.16Å; R657-Y661 HydrophobicContact CB-CE2 3.67Å; R657-Y661 WeakPolarHBondContact O-CD2 3.42Å; R657-Y661 PolarHBondContact O-N 2.96Å
658	L	79.5	Confident	77	Confident	29 Å²	29	45.1 Å²	45.1	15%	0.152	23%	0.233	C	C	.	.	H	α-helix	trans	-56.7	-46.2	175.5	-177.7	60.3	0	0	0	111.3	L532 L535 I536 L539 R654 L655 R660 Y661 V662	L532-L658 HydrophobicContact CD1-CD1 3.29Å; L535-L658 HydrophobicContact CD1-CB 4.19Å; L535-L658 HydrophobicContact CD2-CB 3.7Å; L535-L658 HydrophobicContact CD2-CD1 4.21Å; L535-L658 HydrophobicContact CD2-CD2 4.21Å; L535-L658 HydrophobicContact CD2-CG 4.25Å; I536-L658 HydrophobicContact CG1-CD1 4.46Å; L539-L658 HydrophobicContact CD1-CD2 4.19Å; R654-L658 PolarHBondContact O-N 2.95Å; L655-L658 HydrophobicContact CD1-CB 4.46Å; L655-L658 HydrophobicContact CD1-CD2 3.9Å; L655-L658 WeakPolarHBondContact O-CB 3.48Å; L655-L658 PolarHBondContact O-N 3.41Å; L655-L658 VanDerWaalsContact O-N 3.13Å; L658-R660 PolarHBondContact O-N 3.35Å; L658-Y661 PolarHBondContact O-N 3.44Å; L658-V662 HydrophobicContact CD1-CG2 3.82Å; L658-V662 HydrophobicContact CG-CG2 4.19Å; L658-V662 WeakPolarHBondContact O-CB 3.37Å; L658-V662 VanDerWaalsContact O-CG2 3.24Å; L658-V662 WeakPolarHBondContact O-CG2 3.16Å; L658-V662 PolarHBondContact O-N 3.35Å
659	V	77.2	Confident	76.4	Confident	96 Å²	96	48.2 Å²	48.2	58%	0.582	25%	0.249	S	C	*	.	H	α-helix	trans	-61.2	-45.5	178.7	178.6	0	0	0	0	110.7	L655 S656 R657 V662 S663	L655-V659 PolarHBondContact O-N 3.41Å; L655-V659 VanDerWaalsContact O-N 3.16Å; S656-V659 PolarHBondContact O-N 2.88Å; R657-V659 VanDerWaalsContact C-N 3.31Å; R657-V659 PolarHBondContact O-N 3.22Å; V659-V662 PolarHBondContact O-N 2.95Å; V659-S663 PolarHBondContact O-N 3.23Å; V659-S663 PolarHBondContact O-OG 3.11Å; V659-S663 VanDerWaalsContact O-OG 3.06Å
660	R	79	Confident	75.4	Confident	33 Å²	33	50.6 Å²	50.6	13%	0.125	26%	0.262	C	S	.	.	H	α-helix	trans	-56.8	-56.3	175.9	-57.5	-168.2	-51.3	-121.9	17.2	111.4	D608 S656 R657 L658 V662 S663 E664	D608-R660 IonicContact OD1-CZ 3.15Å; D608-R660 IonicContact OD1-NH1 2.68Å; D608-R660 PolarHBondContact OD1-NH1 3.03Å; D608-R660 VanDerWaalsContact OD1-NH1 3.13Å; D608-R660 IonicContact OD1-NH2 3.3Å; D608-R660 IonicContact OD2-CZ 3.31Å; D608-R660 IonicContact OD2-NH1 3.06Å; D608-R660 PolarHBondContact OD2-NH1 2.93Å; D608-R660 IonicContact OD2-NH2 2.68Å; D608-R660 PolarHBondContact OD2-NH2 3.41Å; S656-R660 WeakPolarHBondContact O-CG 3.38Å; S656-R660 PolarHBondContact O-N 3.37Å; R657-R660 PolarHBondContact O-N 3.29Å; L658-R660 PolarHBondContact O-N 3.35Å; R660-V662 VanDerWaalsContact C-N 3.34Å; R660-V662 PolarHBondContact O-N 3.18Å; R660-S663 PolarHBondContact O-N 3.18Å; R660-S663 PolarHBondContact O-OG 3.48Å; R660-E664 VanDerWaalsContact O-CG 3.32Å; R660-E664 WeakPolarHBondContact O-CG 3.32Å; R660-E664 PolarHBondContact O-N 2.94Å
661	Y	77.1	Confident	73.8	Confident	1 Å²	1	55 Å²	55	0%	0.004	29%	0.285	C	S	.	.	H	α-helix	trans	-60.7	-40.7	-178.9	-59.9	-47.9	0	0	0	112.1	D528 M531 L535 D571 R657 L658 S663 E664 W665	D528-Y661 HydrophobicContact CB-CD1 4.06Å; D528-Y661 HydrophobicContact CB-CE1 4.15Å; D528-Y661 WeakPolarHBondContact OD1-CE1 3.49Å; M531-Y661 HydrophobicContact CB-CE2 3.97Å; L535-Y661 HydrophobicContact CD1-CE2 4.39Å; D571-Y661 PolarHBondContact OD1-OH 3.32Å; D571-Y661 PolarHBondContact OD2-OH 3.13Å; R657-Y661 HydrophobicContact CB-CD2 4.16Å; R657-Y661 HydrophobicContact CB-CE2 3.67Å; R657-Y661 WeakPolarHBondContact O-CD2 3.42Å; R657-Y661 PolarHBondContact O-N 2.96Å; L658-Y661 PolarHBondContact O-N 3.44Å; Y661-S663 PolarHBondContact O-N 3.4Å; Y661-E664 PolarHBondContact O-N 2.72Å; Y661-W665 WeakPolarHBondContact O-CB 3.42Å; Y661-W665 PolarHBondContact O-N 2.97Å
662	V	75.1	Confident	72.7	Confident	45 Å²	45	57.6 Å²	57.6	27%	0.273	31%	0.307	S	S	.	.	H	α-helix	trans	-64	-41.9	177.7	169.7	0	0	0	0	111.1	L658 V659 R660 W665 E666 N680	L658-V662 HydrophobicContact CD1-CG2 3.82Å; L658-V662 HydrophobicContact CG-CG2 4.19Å; L658-V662 WeakPolarHBondContact O-CB 3.37Å; L658-V662 VanDerWaalsContact O-CG2 3.24Å; L658-V662 WeakPolarHBondContact O-CG2 3.16Å; L658-V662 PolarHBondContact O-N 3.35Å; V659-V662 PolarHBondContact O-N 2.95Å; R660-V662 VanDerWaalsContact C-N 3.34Å; R660-V662 PolarHBondContact O-N 3.18Å; V662-W665 PolarHBondContact O-N 3.38Å; V662-E666 WeakPolarHBondContact O-CB 3.18Å; V662-E666 PolarHBondContact O-N 3.45Å; V662-N680 WeakPolarHBondContact CG1-ND2 3.42Å
663	S	72.9	Confident	72	Confident	63 Å²	63	59.4 Å²	59.4	44%	0.441	32%	0.323	S	S	.	.	H	α-helix	trans	-64.6	-44.1	174.5	50.5	0	0	0	0	113.1	V659 R660 Y661 W665 E666 E667	V659-S663 PolarHBondContact O-N 3.23Å; V659-S663 PolarHBondContact O-OG 3.11Å; V659-S663 VanDerWaalsContact O-OG 3.06Å; R660-S663 PolarHBondContact O-N 3.18Å; R660-S663 PolarHBondContact O-OG 3.48Å; Y661-S663 PolarHBondContact O-N 3.4Å; S663-W665 VanDerWaalsContact C-N 3.25Å; S663-W665 PolarHBondContact O-N 3.34Å; S663-E666 PolarHBondContact O-N 3.41Å; S663-E667 PolarHBondContact O-N 2.87Å
664	E	70.7	Confident	71.3	Confident	89 Å²	89	61.7 Å²	61.7	42%	0.416	33%	0.33	S	S	.	.	H	α-helix	trans	-61.6	-33.8	177	-69.4	162.5	-174.1	0	0	112	R660 Y661	R660-E664 VanDerWaalsContact O-CG 3.32Å; R660-E664 WeakPolarHBondContact O-CG 3.32Å; R660-E664 PolarHBondContact O-N 2.94Å; Y661-E664 PolarHBondContact O-N 2.72Å
665	W	71.2	Confident	71	Confident	48 Å²	48	66.6 Å²	66.6	18%	0.182	35%	0.351	C	S	.	.	H	α-helix	trans	-82.7	-27.5	176.5	-80	65	0	0	0	113.7	F525 L529 Y661 V662 S663 F668 I669	F525-W665 HydrophobicContact CD2-CH2 4.01Å; F525-W665 AromaticContact CD2-CZ2 3.87Å; F525-W665 HydrophobicContact CD2-CZ2 3.87Å; F525-W665 AromaticContact CE1-CH2 3.93Å; F525-W665 HydrophobicContact CE1-CH2 3.93Å; F525-W665 HydrophobicContact CE2-CE3 4.29Å; F525-W665 AromaticContact CE2-CH2 3.33Å; F525-W665 HydrophobicContact CE2-CH2 3.33Å; F525-W665 AromaticContact CE2-CZ2 3.65Å; F525-W665 HydrophobicContact CE2-CZ2 3.65Å; F525-W665 AromaticContact CE2-CZ3 3.68Å; F525-W665 HydrophobicContact CE2-CZ3 3.68Å; F525-W665 HydrophobicContact CG-CZ2 4.41Å; F525-W665 AromaticContact CZ-CH2 3.29Å; F525-W665 HydrophobicContact CZ-CH2 3.29Å; F525-W665 HydrophobicContact CZ-CZ2 4.01Å; F525-W665 AromaticContact CZ-CZ3 3.7Å; F525-W665 HydrophobicContact CZ-CZ3 3.7Å; L529-W665 HydrophobicContact CB-CH2 4.01Å; L529-W665 HydrophobicContact CB-CZ2 3.86Å; L529-W665 HydrophobicContact CD1-CH2 3.94Å; L529-W665 HydrophobicContact CD1-CZ2 4.37Å; L529-W665 HydrophobicContact CD2-CH2 4.42Å; L529-W665 HydrophobicContact CG-CH2 4.34Å; Y661-W665 WeakPolarHBondContact O-CB 3.42Å; Y661-W665 PolarHBondContact O-N 2.97Å; V662-W665 PolarHBondContact O-N 3.38Å; S663-W665 VanDerWaalsContact C-N 3.25Å; S663-W665 PolarHBondContact O-N 3.34Å; W665-F668 WeakPolarHBondContact O-CB 3.15Å; W665-F668 PolarHBondContact O-N 2.96Å; W665-I669 WeakPolarHBondContact O-CG1 3.34Å; W665-I669 PolarHBondContact O-N 3.38Å
666	E	70.5	Confident	71	Confident	65 Å²	65	66 Å²	66	30%	0.304	35%	0.348	S	S	.	.	H	α-helix	trans	-65.4	-40.7	174.3	-171.7	164.6	164.5	0	0	111.1	V662 S663 F668 I669 I676	V662-E666 WeakPolarHBondContact O-CB 3.18Å; V662-E666 PolarHBondContact O-N 3.45Å; S663-E666 PolarHBondContact O-N 3.41Å; E666-F668 VanDerWaalsContact C-N 3.25Å; E666-F668 PolarHBondContact O-N 3.24Å; E666-I669 CarbonylContact O-C 3.57Å; E666-I669 PolarHBondContact O-N 3.44Å; E666-I676 HydrophobicContact CG-CG2 3.96Å
667	E	66.7	Low	71.1	Confident	110 Å²	110	65.9 Å²	65.9	51%	0.514	35%	0.35	S	S	.	.	H	α-helix	trans	-62.4	-30.7	172.7	-66.7	-169.1	172.2	0	0	113.6	S663 N670	S663-E667 PolarHBondContact O-N 2.87Å; E667-N670 PolarHBondContact O-ND2 3.42Å
668	F	63.9	Low	71.3	Confident	73 Å²	73	67.4 Å²	67.4	32%	0.32	36%	0.358	S	S	.	.	H	α-helix	trans	-73	-41.9	175.9	-167.4	-94.2	0	0	0	111.4	L491 F525 W665 E666 N670	L491-F668 HydrophobicContact CB-CD2 3.8Å; L491-F668 HydrophobicContact CB-CE2 3.85Å; L491-F668 HydrophobicContact CD1-CD2 4.41Å; L491-F668 HydrophobicContact CD2-CD2 4.1Å; L491-F668 HydrophobicContact CG-CD2 4.32Å; F525-F668 HydrophobicContact CD2-CZ 4.47Å; F525-F668 HydrophobicContact CE2-CD1 4.24Å; F525-F668 AromaticContact CE2-CE1 3.86Å; F525-F668 HydrophobicContact CE2-CE1 3.86Å; F525-F668 HydrophobicContact CE2-CE2 4.36Å; F525-F668 AromaticContact CE2-CZ 3.93Å; F525-F668 HydrophobicContact CE2-CZ 3.93Å; F525-F668 HydrophobicContact CZ-CE1 4.32Å; F525-F668 HydrophobicContact CZ-CZ 4.49Å; W665-F668 WeakPolarHBondContact O-CB 3.15Å; W665-F668 PolarHBondContact O-N 2.96Å; E666-F668 VanDerWaalsContact C-N 3.25Å; E666-F668 PolarHBondContact O-N 3.24Å; F668-N670 PolarHBondContact O-N 3.42Å; F668-N670 VanDerWaalsContact O-N 3.09Å; F668-N670 PolarHBondContact O-ND2 3.06Å
669	I	65.4	Low	71.6	Confident	75 Å²	75	71.7 Å²	71.7	39%	0.385	38%	0.375	S	S	.	.			trans	-87.3	79.3	-178.1	-57.1	172.1	0	0	0	109.4	W665 E666 L671	W665-I669 WeakPolarHBondContact O-CG1 3.34Å; W665-I669 PolarHBondContact O-N 3.38Å; E666-I669 CarbonylContact O-C 3.57Å; E666-I669 PolarHBondContact O-N 3.44Å; I669-L671 HydrophobicContact CG2-CB 4.17Å; I669-L671 PolarHBondContact O-N 3.45Å
670	N	59.8	Low	71.9	Confident	106 Å²	106	69 Å²	69	57%	0.567	36%	0.358	S	S	*	.			trans	-68.7	23.6	178.5	-65.4	-110.6	0	0	0	113.2	K494 E667 F668	K494-N670 PolarHBondContact NZ-OD1 3.41Å; E667-N670 PolarHBondContact O-ND2 3.42Å; F668-N670 PolarHBondContact O-N 3.42Å; F668-N670 VanDerWaalsContact O-N 3.09Å; F668-N670 PolarHBondContact O-ND2 3.06Å
671	L	51	Low	72.3	Confident	141 Å²	141	68.3 Å²	68.3	74%	0.738	36%	0.356	S	S	*	.	S	Bend	trans	-96.7	91.9	174.8	-106.1	70.7	0	0	0	109.7	I669	I669-L671 HydrophobicContact CG2-CB 4.17Å; I669-L671 PolarHBondContact O-N 3.45Å
672	A	59.1	Low	73	Confident	59 Å²	59	70.9 Å²	70.9	49%	0.488	37%	0.372	S	S	.	.			trans	47	74.1	166.2	0	0	0	0	0	114.9	K674 F675	A672-K674 PolarHBondContact O-N 3.28Å; A672-F675 HydrophobicContact CB-CD2 3.7Å; A672-F675 HydrophobicContact CB-CE2 4.28Å; A672-F675 WeakPolarHBondContact O-CB 3.37Å; A672-F675 PolarHBondContact O-N 3.29Å
673	S	66.2	Low	73.6	Confident	71 Å²	71	72.9 Å²	72.9	50%	0.497	38%	0.381	S	S	.	.	H	α-helix	trans	-36.2	-45.2	180	50.6	0	0	0	0	115.2	F675 I676 G677	S673-F675 VanDerWaalsContact C-N 3.25Å; S673-F675 PolarHBondContact O-N 2.82Å; S673-F675 VanDerWaalsContact O-N 3.16Å; S673-I676 WeakPolarHBondContact O-CG2 3.2Å; S673-I676 PolarHBondContact O-N 2.99Å; S673-G677 PolarHBondContact O-N 2.85Å
674	K	69.3	Low	74.4	Confident	120 Å²	120	73.5 Å²	73.5	52%	0.522	38%	0.379	S	S	.	.	H	α-helix	trans	-57.9	-30.5	179.3	-61.7	-170.7	175	-170.4	0	114.5	A672 I678 L776	A672-K674 PolarHBondContact O-N 3.28Å; K674-I678 PolarHBondContact O-N 2.99Å; K674-L776 HydrophobicContact CB-CD1 3.87Å
675	F	76.9	Confident	75.4	Confident	103 Å²	103	70.2 Å²	70.2	45%	0.452	36%	0.364	S	S	.	.	H	α-helix	trans	-78.2	-41.2	176.1	-75.1	-96.9	0	0	0	112.9	A672 S673 G677 I678 F679 L776 F780	A672-F675 HydrophobicContact CB-CD2 3.7Å; A672-F675 HydrophobicContact CB-CE2 4.28Å; A672-F675 WeakPolarHBondContact O-CB 3.37Å; A672-F675 PolarHBondContact O-N 3.29Å; S673-F675 VanDerWaalsContact C-N 3.25Å; S673-F675 PolarHBondContact O-N 2.82Å; S673-F675 VanDerWaalsContact O-N 3.16Å; F675-G677 VanDerWaalsContact C-N 3.34Å; F675-I678 VanDerWaalsContact O-CG2 3.26Å; F675-I678 WeakPolarHBondContact O-CG2 3.23Å; F675-F679 WeakPolarHBondContact O-CB 3.32Å; F675-F679 PolarHBondContact O-N 3.06Å; F675-F679 VanDerWaalsContact O-N 3.17Å; F675-L776 HydrophobicContact CD1-CD1 4.49Å; F675-L776 HydrophobicContact CD2-CD1 4.12Å; F675-L776 HydrophobicContact CE2-CD1 4.19Å; F675-L776 HydrophobicContact CG-CD1 4.3Å; F675-L776 HydrophobicContact CZ-CD1 4.42Å; F675-F780 HydrophobicContact CE1-CE1 4.37Å; F675-F780 AromaticContact CE1-CZ 3.78Å; F675-F780 HydrophobicContact CE1-CZ 3.78Å; F675-F780 HydrophobicContact CE2-CZ 4.43Å; F675-F780 AromaticContact CZ-CE1 3.64Å; F675-F780 HydrophobicContact CZ-CE1 3.64Å; F675-F780 HydrophobicContact CZ-CE2 4.32Å; F675-F780 AromaticContact CZ-CZ 3.4Å; F675-F780 HydrophobicContact CZ-CZ 3.4Å
676	I	78.9	Confident	76.4	Confident	37 Å²	37	72.4 Å²	72.4	19%	0.19	38%	0.379	C	S	.	.	H	α-helix	trans	-69.7	-35.6	176.3	-179	61.6	0	0	0	110.3	E666 S673 F679 N680	E666-I676 HydrophobicContact CG-CG2 3.96Å; S673-I676 WeakPolarHBondContact O-CG2 3.2Å; S673-I676 PolarHBondContact O-N 2.99Å; I676-F679 HydrophobicContact CD1-CD1 4.08Å; I676-F679 PolarHBondContact O-N 2.95Å; I676-N680 WeakPolarHBondContact CD1-OD1 3.31Å; I676-N680 WeakPolarHBondContact O-CB 3.37Å; I676-N680 PolarHBondContact O-N 3.44Å; I676-N680 PolarHBondContact O-ND2 2.93Å; I676-N680 PolarHBondContact O-OD1 3.48Å
677	G	80.9	Confident	77.4	Confident	20 Å²	20	70.6 Å²	70.6	21%	0.206	37%	0.371	C	S	.	.	H	α-helix	trans	-57	-50.7	171.4	0	0	0	0	0	114.2	S673 F675 F679 N680 L681	S673-G677 PolarHBondContact O-N 2.85Å; F675-G677 VanDerWaalsContact C-N 3.34Å; G677-F679 VanDerWaalsContact C-N 3.32Å; G677-F679 PolarHBondContact O-N 3.28Å; G677-N680 PolarHBondContact O-N 3.28Å; G677-L681 WeakPolarHBondContact O-CB 3.39Å; G677-L681 PolarHBondContact O-N 3.22Å
678	I	85.7	Confident	78.6	Confident	31 Å²	31	69 Å²	69	16%	0.159	37%	0.365	C	S	.	.	H	α-helix	trans	-66.4	-33.8	177.3	-165.8	168.8	0	0	0	112.2	K674 F675 L681 V682 F769 A773 L776	K674-I678 PolarHBondContact O-N 2.99Å; F675-I678 VanDerWaalsContact O-CG2 3.26Å; F675-I678 WeakPolarHBondContact O-CG2 3.23Å; I678-L681 PolarHBondContact O-N 3.45Å; I678-V682 WeakPolarHBondContact O-CG2 3.43Å; I678-V682 PolarHBondContact O-N 3.32Å; I678-F769 HydrophobicContact CD1-CE2 4.43Å; I678-F769 HydrophobicContact CG1-CE2 4.49Å; I678-A773 HydrophobicContact CD1-CB 4.19Å; I678-L776 HydrophobicContact CD1-CD2 4.02Å; I678-L776 HydrophobicContact CG2-CD2 3.98Å
679	F	85.3	Confident	80	Confident	119 Å²	119	65.5 Å²	65.5	52%	0.522	35%	0.35	S	S	.	.	H	α-helix	trans	-67.4	-44.7	176.2	179.7	-104.2	0	0	0	111.7	F675 I676 G677 L681 V682 L683	F675-F679 WeakPolarHBondContact O-CB 3.32Å; F675-F679 PolarHBondContact O-N 3.06Å; F675-F679 VanDerWaalsContact O-N 3.17Å; I676-F679 HydrophobicContact CD1-CD1 4.08Å; I676-F679 PolarHBondContact O-N 2.95Å; G677-F679 VanDerWaalsContact C-N 3.32Å; G677-F679 PolarHBondContact O-N 3.28Å; F679-L681 VanDerWaalsContact C-N 3.3Å; F679-L681 PolarHBondContact O-N 3.02Å; F679-V682 PolarHBondContact O-N 2.97Å; F679-L683 HydrophobicContact CD1-CD1 3.93Å; F679-L683 HydrophobicContact CE1-CD1 3.46Å; F679-L683 VanDerWaalsContact CE1-CD1 3.46Å; F679-L683 HydrophobicContact CE1-CG 4.23Å; F679-L683 HydrophobicContact CZ-CD1 3.88Å; F679-L683 HydrophobicContact CZ-CG 4.28Å; F679-L683 WeakPolarHBondContact O-CG 3.43Å; F679-L683 PolarHBondContact O-N 3.31Å
680	N	84.3	Confident	81.4	Confident	40 Å²	40	62.5 Å²	62.5	21%	0.214	34%	0.335	C	S	.	.	H	α-helix	trans	-59.4	-40.9	173.7	-71	-13.9	0	0	0	111.2	V662 I676 G677 L683 L684	V662-N680 WeakPolarHBondContact CG1-ND2 3.42Å; I676-N680 WeakPolarHBondContact CD1-OD1 3.31Å; I676-N680 WeakPolarHBondContact O-CB 3.37Å; I676-N680 PolarHBondContact O-N 3.44Å; I676-N680 PolarHBondContact O-ND2 2.93Å; I676-N680 PolarHBondContact O-OD1 3.48Å; G677-N680 PolarHBondContact O-N 3.28Å; N680-L683 PolarHBondContact O-N 2.69Å; N680-L684 WeakPolarHBondContact O-CB 3.43Å; N680-L684 PolarHBondContact O-N 3.45Å
681	L	88.3	Confident	83.1	Confident	18 Å²	18	59.9 Å²	59.9	9%	0.094	32%	0.317	C	S	.	.	H	α-helix	trans	-64.2	-43.6	175.1	-179.4	61.2	0	0	0	112.5	G677 I678 F679 L683 L684 L685 H772	G677-L681 WeakPolarHBondContact O-CB 3.39Å; G677-L681 PolarHBondContact O-N 3.22Å; I678-L681 PolarHBondContact O-N 3.45Å; F679-L681 VanDerWaalsContact C-N 3.3Å; F679-L681 PolarHBondContact O-N 3.02Å; L681-L683 VanDerWaalsContact C-N 3.35Å; L681-L683 PolarHBondContact O-N 3.42Å; L681-L684 PolarHBondContact O-N 2.91Å; L681-L685 HydrophobicContact CD1-CD1 4.24Å; L681-L685 HydrophobicContact CD1-CG 4.28Å; L681-L685 HydrophobicContact CG-CD1 4.08Å; L681-L685 VanDerWaalsContact O-CG 3.29Å; L681-L685 WeakPolarHBondContact O-CG 3.35Å; L681-L685 PolarHBondContact O-N 2.8Å; L681-H772 HydrophobicContact CD2-CB 3.75Å; L681-H772 VanDerWaalsContact CD2-CD2 3.47Å; L681-H772 WeakPolarHBondContact CD2-CD2 3.43Å
682	V	90.7	Very high	85.1	Confident	55 Å²	55	54 Å²	54	33%	0.333	29%	0.286	S	S	.	.	H	α-helix	trans	-62.6	-41.7	175.8	169.6	0	0	0	0	111.3	I678 F679 L685 L686 F769	I678-V682 WeakPolarHBondContact O-CG2 3.43Å; I678-V682 PolarHBondContact O-N 3.32Å; F679-V682 PolarHBondContact O-N 2.97Å; V682-L685 PolarHBondContact O-N 3.43Å; V682-L686 HydrophobicContact CG1-CD1 4.19Å; V682-L686 WeakPolarHBondContact O-CG 3.33Å; V682-L686 PolarHBondContact O-N 3.4Å; V682-F769 HydrophobicContact CG2-CD2 4.07Å; V682-F769 HydrophobicContact CG2-CE2 3.72Å
683	L	88.9	Confident	86.8	Confident	88 Å²	88	51.2 Å²	51.2	46%	0.461	26%	0.263	S	S	.	.	H	α-helix	trans	-62.5	-42.4	173.8	-71.9	176.9	0	0	0	112.3	F679 N680 L681 L686 L687	F679-L683 HydrophobicContact CD1-CD1 3.93Å; F679-L683 HydrophobicContact CE1-CD1 3.46Å; F679-L683 VanDerWaalsContact CE1-CD1 3.46Å; F679-L683 HydrophobicContact CE1-CG 4.23Å; F679-L683 HydrophobicContact CZ-CD1 3.88Å; F679-L683 HydrophobicContact CZ-CG 4.28Å; F679-L683 WeakPolarHBondContact O-CG 3.43Å; F679-L683 PolarHBondContact O-N 3.31Å; N680-L683 PolarHBondContact O-N 2.69Å; L681-L683 VanDerWaalsContact C-N 3.35Å; L681-L683 PolarHBondContact O-N 3.42Å; L683-L686 PolarHBondContact O-N 3.47Å; L683-L687 WeakPolarHBondContact O-CB 3.4Å; L683-L687 PolarHBondContact O-N 3.16Å
684	L	87.9	Confident	88.2	Confident	76 Å²	76	48 Å²	48	40%	0.398	24%	0.241	S	C	.	.	H	α-helix	trans	-62.6	-42.6	176.5	179.1	61.7	0	0	0	111.7	N680 L681 L687 L688	N680-L684 WeakPolarHBondContact O-CB 3.43Å; N680-L684 PolarHBondContact O-N 3.45Å; L681-L684 PolarHBondContact O-N 2.91Å; L684-L687 PolarHBondContact O-N 3.21Å; L684-L688 HydrophobicContact CD1-CD1 4.28Å; L684-L688 HydrophobicContact CD1-CG 4.28Å; L684-L688 HydrophobicContact CG-CD1 4.07Å; L684-L688 HydrophobicContact CG-CG 4.48Å; L684-L688 WeakPolarHBondContact O-CB 3.33Å; L684-L688 VanDerWaalsContact O-CG 3.31Å; L684-L688 WeakPolarHBondContact O-CG 3.44Å; L684-L688 PolarHBondContact O-N 3.25Å
685	L	92	Very high	89.3	Confident	19 Å²	19	45.7 Å²	45.7	10%	0.099	23%	0.234	C	C	.	.	H	α-helix	trans	-66.5	-38.6	177.5	-69	169.4	0	0	0	112.1	L681 V682 L688 G689 M736 G765 F769	L681-L685 HydrophobicContact CD1-CD1 4.24Å; L681-L685 HydrophobicContact CD1-CG 4.28Å; L681-L685 HydrophobicContact CG-CD1 4.08Å; L681-L685 VanDerWaalsContact O-CG 3.29Å; L681-L685 WeakPolarHBondContact O-CG 3.35Å; L681-L685 PolarHBondContact O-N 2.8Å; V682-L685 PolarHBondContact O-N 3.43Å; L685-L688 PolarHBondContact O-N 3.45Å; L685-G689 PolarHBondContact O-N 3.49Å; L685-M736 HydrophobicContact CB-CE 4.33Å; L685-M736 HydrophobicContact CB-SD 4.36Å; L685-M736 VanDerWaalsContact O-SD 3.33Å; L685-G765 VanDerWaalsContact CD2-CA 3.45Å; L685-F769 HydrophobicContact CD1-CB 3.85Å; L685-F769 HydrophobicContact CD1-CD2 4.42Å; L685-F769 HydrophobicContact CD1-CG 4.45Å
686	L	92.7	Very high	90.1	Very high	95 Å²	95	41 Å²	41	50%	0.497	21%	0.213	S	C	.	.	H	α-helix	trans	-63.5	-40.1	172.4	-70.5	169.9	0	0	0	111.9	V682 L683 H690	V682-L686 HydrophobicContact CG1-CD1 4.19Å; V682-L686 WeakPolarHBondContact O-CG 3.33Å; V682-L686 PolarHBondContact O-N 3.4Å; L683-L686 PolarHBondContact O-N 3.47Å; L686-H690 VanDerWaalsContact O-CB 3.25Å; L686-H690 WeakPolarHBondContact O-CB 3.45Å; L686-H690 PolarHBondContact O-N 2.99Å
687	L	91.3	Very high	90.7	Very high	26 Å²	26	39.2 Å²	39.2	14%	0.136	20%	0.204	C	C	.	.	H	α-helix	trans	-66.6	-42.5	175.9	-175.5	65.2	0	0	0	112.2	L539 I540 L655 L683 L684 H690 W691	L539-L687 HydrophobicContact CB-CD1 4.2Å; L539-L687 HydrophobicContact CD1-CD2 4.11Å; I540-L687 HydrophobicContact CG1-CD1 4.38Å; L655-L687 HydrophobicContact CD1-CD2 4.23Å; L683-L687 WeakPolarHBondContact O-CB 3.4Å; L683-L687 PolarHBondContact O-N 3.16Å; L684-L687 PolarHBondContact O-N 3.21Å; L687-H690 WeakPolarHBondContact O-CB 3.28Å; L687-H690 PolarHBondContact O-N 2.97Å; L687-W691 HydrophobicContact CD1-CZ2 4.34Å; L687-W691 HydrophobicContact CD2-CZ2 4.07Å; L687-W691 HydrophobicContact CG-CZ2 4.19Å; L687-W691 PolarHBondContact O-N 3.21Å
688	L	91.8	Very high	91.2	Very high	76 Å²	76	38.9 Å²	38.9	40%	0.398	20%	0.197	S	C	.	.	H	α-helix	trans	-65.6	-43.7	176	-71.8	172.1	0	0	0	111.6	L684 L685 H690 W691 N692	L684-L688 HydrophobicContact CD1-CD1 4.28Å; L684-L688 HydrophobicContact CD1-CG 4.28Å; L684-L688 HydrophobicContact CG-CD1 4.07Å; L684-L688 HydrophobicContact CG-CG 4.48Å; L684-L688 WeakPolarHBondContact O-CB 3.33Å; L684-L688 VanDerWaalsContact O-CG 3.31Å; L684-L688 WeakPolarHBondContact O-CG 3.44Å; L684-L688 PolarHBondContact O-N 3.25Å; L685-L688 PolarHBondContact O-N 3.45Å; L688-H690 VanDerWaalsContact C-N 3.27Å; L688-H690 PolarHBondContact O-N 3.4Å; L688-W691 PolarHBondContact O-N 3.17Å; L688-N692 WeakPolarHBondContact O-CB 3.41Å; L688-N692 PolarHBondContact O-N 3.35Å
689	G	94.2	Very high	91.4	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-59.2	-38.6	173.1	0	0	0	0	0	112.5	L685 A693	L685-G689 PolarHBondContact O-N 3.49Å; G689-A693 WeakPolarHBondContact O-CB 3.46Å; G689-A693 PolarHBondContact O-N 3.36Å
690	H	95.2	Very high	91.6	Very high	12 Å²	12	33.6 Å²	33.6	6%	0.056	18%	0.175	C	C	.	.	H	α-helix	trans	-66.9	-46.6	174.6	168.1	76.4	0	0	0	113.2	I540 V544 L686 L687 L688 N692 A693 C694 Y725	I540-H690 PolarHBondContact O-CE1 3.41Å; I540-H690 PolarHBondContact O-NE2 3.42Å; I540-H690 VanDerWaalsContact O-NE2 3.1Å; V544-H690 VanDerWaalsContact CG2-CE1 3.44Å; V544-H690 WeakPolarHBondContact CG2-CE1 3.45Å; L686-H690 VanDerWaalsContact O-CB 3.25Å; L686-H690 WeakPolarHBondContact O-CB 3.45Å; L686-H690 PolarHBondContact O-N 2.99Å; L687-H690 WeakPolarHBondContact O-CB 3.28Å; L687-H690 PolarHBondContact O-N 2.97Å; L688-H690 VanDerWaalsContact C-N 3.27Å; L688-H690 PolarHBondContact O-N 3.4Å; H690-N692 VanDerWaalsContact C-N 3.34Å; H690-N692 PolarHBondContact O-N 3Å; H690-A693 VanDerWaalsContact O-CB 3.31Å; H690-A693 WeakPolarHBondContact O-CB 3.31Å; H690-A693 PolarHBondContact O-N 2.85Å; H690-C694 PolarHBondContact O-N 3.16Å; H690-C694 PolarHBondContact O-SG 2.91Å; H690-Y725 AromaticContact CE1-CE2 4Å; H690-Y725 AromaticContact ND1-CE2 3.57Å; H690-Y725 AromaticContact ND1-CZ 3.63Å; H690-Y725 PolarHBondContact ND1-OH 3.03Å
691	W	93.8	Very high	91.8	Very high	51 Å²	51	31.9 Å²	31.9	19%	0.193	17%	0.165	C	C	.	.	H	α-helix	trans	-64.2	-39.8	175.1	-70	-1.5	0	0	0	112.5	L539 L652 L655 L687 L688 A693 C694 L695	L539-W691 HydrophobicContact CB-CZ2 4.07Å; L539-W691 HydrophobicContact CD1-CZ2 4.06Å; L539-W691 HydrophobicContact CD2-CZ2 3.95Å; L539-W691 HydrophobicContact CG-CZ2 4.22Å; L539-W691 PolarHBondContact O-NE1 3.35Å; L652-W691 HydrophobicContact CB-CH2 4.39Å; L652-W691 HydrophobicContact CD2-CH2 4.49Å; L652-W691 HydrophobicContact CD2-CZ2 3.96Å; L655-W691 HydrophobicContact CB-CH2 4.29Å; L655-W691 HydrophobicContact CD1-CH2 4.21Å; L655-W691 HydrophobicContact CD2-CH2 3.92Å; L655-W691 HydrophobicContact CD2-CZ3 4.13Å; L655-W691 HydrophobicContact CG-CH2 4.37Å; L687-W691 HydrophobicContact CD1-CZ2 4.34Å; L687-W691 HydrophobicContact CD2-CZ2 4.07Å; L687-W691 HydrophobicContact CG-CZ2 4.19Å; L687-W691 PolarHBondContact O-N 3.21Å; L688-W691 PolarHBondContact O-N 3.17Å; W691-A693 VanDerWaalsContact C-N 3.31Å; W691-A693 PolarHBondContact O-N 3.18Å; W691-C694 PolarHBondContact O-N 2.97Å; W691-L695 WeakPolarHBondContact O-CB 3.24Å; W691-L695 PolarHBondContact O-N 2.86Å
692	N	94.2	Very high	91.6	Very high	18 Å²	18	32.9 Å²	32.9	10%	0.096	17%	0.171	C	C	.	.	H	α-helix	trans	-61.7	-39.3	175	-172.3	-7.1	0	0	0	110.8	L688 H690 L695 Q696 A732 S758	L688-N692 WeakPolarHBondContact O-CB 3.41Å; L688-N692 PolarHBondContact O-N 3.35Å; H690-N692 VanDerWaalsContact C-N 3.34Å; H690-N692 PolarHBondContact O-N 3Å; N692-L695 PolarHBondContact O-N 3.16Å; N692-Q696 WeakPolarHBondContact O-CB 3.45Å; N692-Q696 WeakPolarHBondContact O-CG 3.44Å; N692-Q696 PolarHBondContact O-N 2.92Å; N692-A732 HydrophobicContact CB-CB 3.98Å; N692-S758 PolarHBondContact ND2-OG 3.47Å; N692-S758 VanDerWaalsContact OD1-CB 3.27Å; N692-S758 WeakPolarHBondContact OD1-CB 3.5Å; N692-S758 PolarHBondContact OD1-OG 3.4Å
693	A	95.2	Very high	91.4	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-60.3	-52.5	171.6	0	0	0	0	0	112.5	G689 H690 W691 L695 Q696 F697 Y725 A728 L729 A732	G689-A693 WeakPolarHBondContact O-CB 3.46Å; G689-A693 PolarHBondContact O-N 3.36Å; H690-A693 VanDerWaalsContact O-CB 3.31Å; H690-A693 WeakPolarHBondContact O-CB 3.31Å; H690-A693 PolarHBondContact O-N 2.85Å; W691-A693 VanDerWaalsContact C-N 3.31Å; W691-A693 PolarHBondContact O-N 3.18Å; A693-L695 VanDerWaalsContact C-N 3.29Å; A693-L695 PolarHBondContact O-N 3.39Å; A693-Q696 PolarHBondContact O-N 3.05Å; A693-F697 PolarHBondContact O-N 2.99Å; A693-Y725 HydrophobicContact CB-CE2 4.48Å; A693-A728 HydrophobicContact CB-CB 4.34Å; A693-A728 WeakPolarHBondContact O-CB 3.32Å; A693-L729 HydrophobicContact CB-CB 4.02Å; A693-L729 HydrophobicContact CB-CD1 3.94Å; A693-A732 HydrophobicContact CB-CB 3.99Å
694	C	94.1	Very high	91.2	Very high	4 Å²	4	35.6 Å²	35.6	3%	0.027	18%	0.18	C	C	.	.	H	α-helix	trans	-57.8	-42.2	177.3	-67.7	0	0	0	0	111.6	P543 S547 H690 W691 F697 L698	P543-C694 HydrophobicContact CB-CB 3.81Å; S547-C694 WeakPolarHBondContact CB-O 3.46Å; S547-C694 WeakPolarHBondContact OG-CB 3.27Å; H690-C694 PolarHBondContact O-N 3.16Å; H690-C694 PolarHBondContact O-SG 2.91Å; W691-C694 PolarHBondContact O-N 2.97Å; C694-F697 PolarHBondContact O-N 3.41Å; C694-L698 WeakPolarHBondContact O-CB 3.49Å; C694-L698 PolarHBondContact O-N 2.85Å
695	L	92.4	Very high	91.2	Very high	72 Å²	72	34.2 Å²	34.2	38%	0.377	17%	0.17	S	C	.	.	H	α-helix	trans	-64.6	-41.7	177.2	-176.4	63.3	0	0	0	113	W691 N692 A693 F697 L698 I699 V754	W691-L695 WeakPolarHBondContact O-CB 3.24Å; W691-L695 PolarHBondContact O-N 2.86Å; N692-L695 PolarHBondContact O-N 3.16Å; A693-L695 VanDerWaalsContact C-N 3.29Å; A693-L695 PolarHBondContact O-N 3.39Å; L695-F697 PolarHBondContact O-N 3.32Å; L695-L698 PolarHBondContact O-N 3.34Å; L695-I699 HydrophobicContact CD1-CD1 4.29Å; L695-I699 HydrophobicContact CD1-CG1 3.99Å; L695-I699 HydrophobicContact CG-CG1 4.49Å; L695-I699 WeakPolarHBondContact O-CG1 3.49Å; L695-I699 PolarHBondContact O-N 3.27Å; L695-V754 HydrophobicContact CG-CG1 4.31Å
696	Q	93.3	Very high	91.1	Very high	4 Å²	4	35.6 Å²	35.6	2%	0.019	18%	0.18	C	C	.	.	H	α-helix	trans	-62.5	-26.3	178.6	-71.4	-86.3	-19.5	0	0	112.9	N692 A693 P700 W710 H735 V754 S758	N692-Q696 WeakPolarHBondContact O-CB 3.45Å; N692-Q696 WeakPolarHBondContact O-CG 3.44Å; N692-Q696 PolarHBondContact O-N 2.92Å; A693-Q696 PolarHBondContact O-N 3.05Å; Q696-P700 VanDerWaalsContact O-CD 3.23Å; Q696-P700 WeakPolarHBondContact O-CD 3.23Å; Q696-W710 PolarHBondContact O-NE1 3.07Å; Q696-H735 PolarHBondContact NE2-CE1 3.34Å; Q696-V754 HydrophobicContact CG-CG1 4.38Å; Q696-V754 PolarHBondContact NE2-O 3.38Å; Q696-S758 VanDerWaalsContact NE2-CB 3.26Å; Q696-S758 PolarHBondContact NE2-OG 3.43Å
697	F	93.1	Very high	91	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-93.9	-37.9	174.9	-171	-90.8	0	0	0	113.1	S547 F548 A693 C694 L695 I699 P700 M701 Y705 W710 V711 Q724 A728	S547-F697 WeakPolarHBondContact O-CD1 3.27Å; S547-F697 VanDerWaalsContact O-CE1 3.29Å; S547-F697 WeakPolarHBondContact O-CE1 3.31Å; F548-F697 AromaticContact CD1-CD1 3.51Å; F548-F697 HydrophobicContact CD1-CD1 3.51Å; F548-F697 HydrophobicContact CD1-CD2 4.38Å; F548-F697 AromaticContact CD1-CE1 3.61Å; F548-F697 HydrophobicContact CD1-CE1 3.61Å; F548-F697 HydrophobicContact CD1-CE2 4.46Å; F548-F697 AromaticContact CD1-CG 3.93Å; F548-F697 HydrophobicContact CD1-CG 3.93Å; F548-F697 HydrophobicContact CD1-CZ 4.1Å; F548-F697 HydrophobicContact CE1-CB 3.69Å; F548-F697 AromaticContact CE1-CD1 3.39Å; F548-F697 HydrophobicContact CE1-CD1 3.39Å; F548-F697 AromaticContact CE1-CD2 3.76Å; F548-F697 HydrophobicContact CE1-CD2 3.76Å; F548-F697 AromaticContact CE1-CE1 3.9Å; F548-F697 HydrophobicContact CE1-CE1 3.9Å; F548-F697 HydrophobicContact CE1-CE2 4.22Å; F548-F697 AromaticContact CE1-CG 3.31Å; F548-F697 HydrophobicContact CE1-CG 3.31Å; F548-F697 HydrophobicContact CE1-CZ 4.29Å; F548-F697 HydrophobicContact CG-CD1 4.34Å; F548-F697 HydrophobicContact CG-CE1 4.49Å; F548-F697 HydrophobicContact CZ-CB 3.78Å; F548-F697 HydrophobicContact CZ-CD1 4.13Å; F548-F697 AromaticContact CZ-CG 3.95Å; F548-F697 HydrophobicContact CZ-CG 3.95Å; A693-F697 PolarHBondContact O-N 2.99Å; C694-F697 PolarHBondContact O-N 3.41Å; L695-F697 PolarHBondContact O-N 3.32Å; F697-I699 VanDerWaalsContact C-N 3.31Å; F697-I699 PolarHBondContact O-N 3.17Å; F697-P700 VanDerWaalsContact O-CD 3.32Å; F697-P700 WeakPolarHBondContact O-CD 3.48Å; F697-M701 PolarHBondContact O-N 3.17Å; F697-Y705 HydrophobicContact CE1-CE1 4.31Å; F697-Y705 WeakPolarHBondContact CE1-OH 3.36Å; F697-Y705 HydrophobicContact CE2-CE1 4.45Å; F697-Y705 AromaticContact CZ-CE1 3.95Å; F697-Y705 HydrophobicContact CZ-CE1 3.95Å; F697-Y705 WeakPolarHBondContact CZ-OH 3.47Å; F697-W710 HydrophobicContact CB-CZ2 4.19Å; F697-W710 AromaticContact CD2-CH2 3.99Å; F697-W710 HydrophobicContact CD2-CH2 3.99Å; F697-W710 AromaticContact CD2-CZ2 4Å; F697-W710 HydrophobicContact CD2-CZ2 4Å; F697-V711 HydrophobicContact CD2-CB 4.48Å; F697-V711 HydrophobicContact CE2-CB 4.21Å; F697-V711 HydrophobicContact CE2-CG1 3.85Å; F697-Q724 HydrophobicContact CD2-CB 4.31Å; F697-Q724 HydrophobicContact CE2-CB 3.75Å; F697-Q724 HydrophobicContact CE2-CG 3.93Å; F697-Q724 HydrophobicContact CZ-CB 4.01Å; F697-Q724 VanDerWaalsContact CZ-CD 3.48Å; F697-Q724 HydrophobicContact CZ-CG 3.99Å; F697-A728 HydrophobicContact CB-CB 4.13Å
698	L	90.6	Very high	90.9	Very high	12 Å²	12	40.6 Å²	40.6	6%	0.063	21%	0.208	C	C	.	.	H	α-helix	trans	-55.3	-42.5	176.8	177	59.6	0	0	0	112.4	I546 L646 L649 C694 L695 M701 L702	I546-L698 HydrophobicContact CG2-CD1 4.29Å; I546-L698 HydrophobicContact CG2-CD2 4.4Å; L646-L698 HydrophobicContact CD2-CD2 4.06Å; L649-L698 HydrophobicContact CD1-CD2 4.49Å; C694-L698 WeakPolarHBondContact O-CB 3.49Å; C694-L698 PolarHBondContact O-N 2.85Å; L695-L698 PolarHBondContact O-N 3.34Å; L698-M701 HydrophobicContact CD1-CE 3.74Å; L698-M701 WeakPolarHBondContact O-CB 3.18Å; L698-M701 PolarHBondContact O-N 2.91Å; L698-L702 HydrophobicContact CD1-CD1 4.27Å; L698-L702 HydrophobicContact CD1-CD2 4.32Å; L698-L702 HydrophobicContact CD1-CG 4.02Å; L698-L702 HydrophobicContact CG-CD1 4.1Å; L698-L702 HydrophobicContact CG-CG 4.3Å; L698-L702 VanDerWaalsContact O-CG 3.31Å; L698-L702 WeakPolarHBondContact O-CG 3.49Å; L698-L702 PolarHBondContact O-N 2.93Å
699	I	90.2	Very high	90.8	Very high	35 Å²	35	37 Å²	37	18%	0.179	19%	0.19	C	C	.	.	H	α-helix	trans	-64.8	-49.7	-176.3	-65.1	-75.6	0	0	0	112.1	L695 F697 M701 L702 H703 V754	L695-I699 HydrophobicContact CD1-CD1 4.29Å; L695-I699 HydrophobicContact CD1-CG1 3.99Å; L695-I699 HydrophobicContact CG-CG1 4.49Å; L695-I699 WeakPolarHBondContact O-CG1 3.49Å; L695-I699 PolarHBondContact O-N 3.27Å; F697-I699 VanDerWaalsContact C-N 3.31Å; F697-I699 PolarHBondContact O-N 3.17Å; I699-M701 VanDerWaalsContact C-N 3.33Å; I699-M701 PolarHBondContact O-N 3.27Å; I699-L702 HydrophobicContact CD1-CD1 4.36Å; I699-L702 PolarHBondContact O-N 3.1Å; I699-H703 PolarHBondContact O-CD2 3.27Å; I699-H703 VanDerWaalsContact O-CD2 3.23Å; I699-H703 PolarHBondContact O-N 3.47Å; I699-V754 HydrophobicContact CB-CG2 4.35Å; I699-V754 HydrophobicContact CD1-CG2 4.45Å; I699-V754 HydrophobicContact CG1-CG2 3.89Å; I699-V754 HydrophobicContact CG2-CG2 4.17Å
700	P	90.1	Very high	90.8	Very high	5 Å²	5	37.8 Å²	37.8	3%	0.032	19%	0.193	C	C	.	.	H	α-helix	trans	-54.8	-40.9	168	-29.6	34.9	0	0	0	114.7	Q696 F697 H703 D704 Y705 V711	Q696-P700 VanDerWaalsContact O-CD 3.23Å; Q696-P700 WeakPolarHBondContact O-CD 3.23Å; F697-P700 VanDerWaalsContact O-CD 3.32Å; F697-P700 WeakPolarHBondContact O-CD 3.48Å; P700-H703 CarbonylContact O-C 3.58Å; P700-H703 PolarHBondContact O-N 3.11Å; P700-D704 PolarHBondContact O-N 3.43Å; P700-Y705 HydrophobicContact CB-CD1 4.18Å; P700-Y705 WeakPolarHBondContact O-CA 3.5Å; P700-Y705 PolarHBondContact O-N 3.44Å; P700-V711 HydrophobicContact CB-CG2 3.35Å; P700-V711 HydrophobicContact CG-CG2 3.69Å
701	M	87.5	Confident	90.7	Very high	3 Å²	3	37.2 Å²	37.2	2%	0.015	19%	0.19	C	C	.	.	H	α-helix	trans	-63.4	-41.7	177.9	-174.8	-166.3	82.2	0	0	112.2	S547 F697 L698 I699 H703 D704 Y705	S547-M701 VanDerWaalsContact O-SD 3.36Å; F697-M701 PolarHBondContact O-N 3.17Å; L698-M701 HydrophobicContact CD1-CE 3.74Å; L698-M701 WeakPolarHBondContact O-CB 3.18Å; L698-M701 PolarHBondContact O-N 2.91Å; I699-M701 VanDerWaalsContact C-N 3.33Å; I699-M701 PolarHBondContact O-N 3.27Å; M701-H703 PolarHBondContact O-N 3.47Å; M701-D704 PolarHBondContact O-N 3.03Å; M701-Y705 HydrophobicContact CB-CE1 3.96Å; M701-Y705 HydrophobicContact CG-CE1 4.49Å; M701-Y705 HydrophobicContact CG-CE2 4.32Å; M701-Y705 WeakPolarHBondContact CG-OH 3.36Å
702	L	84.9	Confident	90.5	Very high	39 Å²	39	35.6 Å²	35.6	20%	0.204	19%	0.188	C	C	.	.	H	α-helix	trans	-60.8	-34.5	176.5	-71.3	174.1	0	0	0	112.1	R642 L646 L698 I699 D704	R642-L702 HydrophobicContact CB-CD2 3.81Å; R642-L702 HydrophobicContact CG-CD2 4.2Å; R642-L702 PolarHBondContact NH1-O 3.27Å; L646-L702 HydrophobicContact CD1-CD1 4.13Å; L646-L702 HydrophobicContact CD1-CD2 4.16Å; L646-L702 HydrophobicContact CD2-CD1 4.26Å; L646-L702 HydrophobicContact CG-CD2 4.44Å; L698-L702 HydrophobicContact CD1-CD1 4.27Å; L698-L702 HydrophobicContact CD1-CD2 4.32Å; L698-L702 HydrophobicContact CD1-CG 4.02Å; L698-L702 HydrophobicContact CG-CD1 4.1Å; L698-L702 HydrophobicContact CG-CG 4.3Å; L698-L702 VanDerWaalsContact O-CG 3.31Å; L698-L702 WeakPolarHBondContact O-CG 3.49Å; L698-L702 PolarHBondContact O-N 2.93Å; I699-L702 HydrophobicContact CD1-CD1 4.36Å; I699-L702 PolarHBondContact O-N 3.1Å; L702-D704 VanDerWaalsContact C-N 3.34Å; L702-D704 PolarHBondContact O-N 3.47Å
703	H	86.1	Confident	90.4	Very high	106 Å²	106	37.9 Å²	37.9	49%	0.491	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.1	14.3	-179.5	-78.5	-114.1	0	0	0	114.6	I699 P700 M701 Y705 P706	I699-H703 PolarHBondContact O-CD2 3.27Å; I699-H703 VanDerWaalsContact O-CD2 3.23Å; I699-H703 PolarHBondContact O-N 3.47Å; P700-H703 CarbonylContact O-C 3.58Å; P700-H703 PolarHBondContact O-N 3.11Å; M701-H703 PolarHBondContact O-N 3.47Å; H703-Y705 VanDerWaalsContact C-N 3.32Å; H703-Y705 PolarHBondContact O-N 2.66Å; H703-P706 HydrophobicContact CB-CG 4.28Å
704	D	85.2	Confident	90.1	Very high	94 Å²	94	39.1 Å²	39.1	50%	0.503	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.8	34.4	-178.4	-68.2	-76	0	0	0	114.2	R642 P700 M701 L702	R642-D704 IonicContact CZ-OD1 2.7Å; R642-D704 VanDerWaalsContact CZ-OD1 3.31Å; R642-D704 IonicContact CZ-OD2 2.67Å; R642-D704 IonicContact NH1-OD1 3.43Å; R642-D704 PolarHBondContact NH1-OD1 2.9Å; R642-D704 IonicContact NH1-OD2 3.21Å; R642-D704 PolarHBondContact NH1-OD2 2.72Å; R642-D704 IonicContact NH2-OD1 2.91Å; R642-D704 PolarHBondContact NH2-OD1 3.44Å; R642-D704 IonicContact NH2-OD2 3.35Å; P700-D704 PolarHBondContact O-N 3.43Å; M701-D704 PolarHBondContact O-N 3.03Å; L702-D704 VanDerWaalsContact C-N 3.34Å; L702-D704 PolarHBondContact O-N 3.47Å
705	Y	88.4	Confident	90	Very high	48 Å²	48	47.5 Å²	47.5	19%	0.188	25%	0.245	C	C	.	.			trans	50	66	178.3	-58.3	-68.9	0	0	0	113.5	F697 P700 M701 H703 V711 Q717	F697-Y705 HydrophobicContact CE1-CE1 4.31Å; F697-Y705 WeakPolarHBondContact CE1-OH 3.36Å; F697-Y705 HydrophobicContact CE2-CE1 4.45Å; F697-Y705 AromaticContact CZ-CE1 3.95Å; F697-Y705 HydrophobicContact CZ-CE1 3.95Å; F697-Y705 WeakPolarHBondContact CZ-OH 3.47Å; P700-Y705 HydrophobicContact CB-CD1 4.18Å; P700-Y705 WeakPolarHBondContact O-CA 3.5Å; P700-Y705 PolarHBondContact O-N 3.44Å; M701-Y705 HydrophobicContact CB-CE1 3.96Å; M701-Y705 HydrophobicContact CG-CE1 4.49Å; M701-Y705 HydrophobicContact CG-CE2 4.32Å; M701-Y705 WeakPolarHBondContact CG-OH 3.36Å; H703-Y705 VanDerWaalsContact C-N 3.32Å; H703-Y705 PolarHBondContact O-N 2.66Å; Y705-V711 HydrophobicContact CD1-CG1 3.79Å; Y705-V711 HydrophobicContact CD1-CG2 4.14Å; Y705-V711 HydrophobicContact CE1-CG1 3.9Å; Y705-V711 HydrophobicContact CE1-CG2 4.45Å; Y705-Q717 HydrophobicContact CG-CB 4.46Å
706	P	89.5	Confident	89.9	Confident	47 Å²	47	45 Å²	45	31%	0.305	23%	0.232	S	C	.	.			trans	-59.5	145.5	-178.4	25.9	-32.7	0	0	0	110.6	H703 E708 S709 A712	H703-P706 HydrophobicContact CB-CG 4.28Å; P706-E708 PolarHBondContact O-N 2.78Å; P706-S709 WeakPolarHBondContact O-CB 3.46Å; P706-S709 PolarHBondContact O-N 3.09Å; P706-S709 PolarHBondContact O-OG 2.96Å; P706-A712 WeakPolarHBondContact O-CB 3.25Å
707	V	89.9	Confident	89.7	Confident	122 Å²	122	48.9 Å²	48.9	74%	0.739	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.1	-32.5	-173.6	-177	0	0	0	0	112.4	S709	V707-S709 PolarHBondContact O-N 3.4Å
708	E	88.3	Confident	89.4	Confident	105 Å²	105	55.8 Å²	55.8	49%	0.491	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-8.8	177.2	-67.4	-51.8	125.2	0	0	115	P706 K713 T747	P706-E708 PolarHBondContact O-N 2.78Å; E708-K713 WeakPolarHBondContact O-CE 3.39Å; E708-K713 PolarHBondContact O-NZ 2.86Å; E708-K713 WeakPolarHBondContact OE2-CE 3.47Å; E708-K713 IonicContact OE2-NZ 3.04Å; E708-K713 PolarHBondContact OE2-NZ 2.97Å; E708-T747 PolarHBondContact O-OG1 3.47Å
709	S	91.3	Very high	89.4	Confident	1 Å²	1	56.7 Å²	56.7	1%	0.007	30%	0.296	C	S	.	.	S	Bend	trans	-73.3	153.4	-174	65.4	0	0	0	0	114.3	P706 V707 V711 A712 K713 E751	P706-S709 WeakPolarHBondContact O-CB 3.46Å; P706-S709 PolarHBondContact O-N 3.09Å; P706-S709 PolarHBondContact O-OG 2.96Å; V707-S709 PolarHBondContact O-N 3.4Å; S709-V711 PolarHBondContact O-N 2.9Å; S709-A712 PolarHBondContact O-N 3.49Å; S709-A712 VanDerWaalsContact OG-CB 3.28Å; S709-A712 WeakPolarHBondContact OG-CB 3.46Å; S709-A712 PolarHBondContact OG-N 3.44Å; S709-K713 WeakPolarHBondContact O-CB 3.4Å; S709-K713 WeakPolarHBondContact O-CG 3.49Å; S709-K713 PolarHBondContact O-N 3.16Å; S709-E751 WeakPolarHBondContact CA-OE1 3.27Å; S709-E751 VanDerWaalsContact CB-OE1 3.28Å; S709-E751 WeakPolarHBondContact CB-OE1 3.4Å
710	W	92.7	Very high	89.5	Confident	16 Å²	16	62 Å²	62	6%	0.061	32%	0.315	C	S	.	.	H	α-helix	trans	-60.6	-31.1	178.6	74.9	-96.7	0	0	0	112.9	Q696 F697 G714 L716 W727 A728 K731 E751	Q696-W710 PolarHBondContact O-NE1 3.07Å; F697-W710 HydrophobicContact CB-CZ2 4.19Å; F697-W710 AromaticContact CD2-CH2 3.99Å; F697-W710 HydrophobicContact CD2-CH2 3.99Å; F697-W710 AromaticContact CD2-CZ2 4Å; F697-W710 HydrophobicContact CD2-CZ2 4Å; W710-G714 PolarHBondContact O-N 3.48Å; W710-L716 HydrophobicContact CE3-CD1 4.3Å; W710-L716 HydrophobicContact CZ3-CD1 3.64Å; W710-W727 HydrophobicContact CZ3-CB 4.19Å; W710-A728 HydrophobicContact CH2-CB 3.84Å; W710-A728 HydrophobicContact CZ2-CB 4.17Å; W710-K731 HydrophobicContact CD2-CD 4.12Å; W710-K731 HydrophobicContact CG-CD 4.28Å; W710-E751 PolarHBondContact N-OE1 3.32Å
711	V	93	Very high	89.5	Confident	0 Å²	0	65.4 Å²	65.4	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-78.9	-39.2	177.5	148.6	0	0	0	0	112	F697 P700 Y705 S709 G714 K715 L716 Q717	F697-V711 HydrophobicContact CD2-CB 4.48Å; F697-V711 HydrophobicContact CE2-CB 4.21Å; F697-V711 HydrophobicContact CE2-CG1 3.85Å; P700-V711 HydrophobicContact CB-CG2 3.35Å; P700-V711 HydrophobicContact CG-CG2 3.69Å; Y705-V711 HydrophobicContact CD1-CG1 3.79Å; Y705-V711 HydrophobicContact CD1-CG2 4.14Å; Y705-V711 HydrophobicContact CE1-CG1 3.9Å; Y705-V711 HydrophobicContact CE1-CG2 4.45Å; S709-V711 PolarHBondContact O-N 2.9Å; V711-G714 PolarHBondContact O-N 2.7Å; V711-K715 PolarHBondContact O-N 3.26Å; V711-K715 VanDerWaalsContact O-N 3.13Å; V711-L716 HydrophobicContact CB-CB 4.38Å; V711-L716 HydrophobicContact CG1-CB 4.06Å; V711-L716 PolarHBondContact O-N 2.83Å; V711-Q717 HydrophobicContact CG1-CB 4.32Å
712	A	91.5	Very high	89.8	Confident	17 Å²	17	70.2 Å²	70.2	14%	0.14	35%	0.348	C	S	.	.	H	α-helix	trans	-64.3	-47.6	171.9	0	0	0	0	0	111.1	P706 S709 G714 K715	P706-A712 WeakPolarHBondContact O-CB 3.25Å; S709-A712 PolarHBondContact O-N 3.49Å; S709-A712 VanDerWaalsContact OG-CB 3.28Å; S709-A712 WeakPolarHBondContact OG-CB 3.46Å; S709-A712 PolarHBondContact OG-N 3.44Å; A712-G714 VanDerWaalsContact C-N 3.26Å; A712-G714 PolarHBondContact O-N 3.18Å; A712-K715 WeakPolarHBondContact O-CA 3.4Å; A712-K715 PolarHBondContact O-N 3.39Å
713	K	90.7	Very high	90.3	Very high	66 Å²	66	72 Å²	72	29%	0.287	36%	0.358	S	S	.	.	H	α-helix	trans	-63.1	-30	174.7	-72	170.7	175.8	164.5	0	113.2	E708 S709 K715 Y744 T747	E708-K713 WeakPolarHBondContact O-CE 3.39Å; E708-K713 PolarHBondContact O-NZ 2.86Å; E708-K713 WeakPolarHBondContact OE2-CE 3.47Å; E708-K713 IonicContact OE2-NZ 3.04Å; E708-K713 PolarHBondContact OE2-NZ 2.97Å; S709-K713 WeakPolarHBondContact O-CB 3.4Å; S709-K713 WeakPolarHBondContact O-CG 3.49Å; S709-K713 PolarHBondContact O-N 3.16Å; K713-K715 VanDerWaalsContact C-N 3.29Å; K713-Y744 HydrophobicContact CB-CD2 4.02Å; K713-Y744 HydrophobicContact CB-CE2 3.93Å; K713-Y744 PolarHBondContact O-OH 3.17Å; K713-T747 PolarHBondContact NZ-OG1 2.91Å
714	G	89.5	Confident	90.7	Very high	25 Å²	25	67.5 Å²	67.5	26%	0.258	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-9.2	170.4	0	0	0	0	0	115	W710 V711 A712 L716	W710-G714 PolarHBondContact O-N 3.48Å; V711-G714 PolarHBondContact O-N 2.7Å; A712-G714 VanDerWaalsContact C-N 3.26Å; A712-G714 PolarHBondContact O-N 3.18Å; G714-L716 PolarHBondContact O-N 2.85Å
715	K	91	Very high	91.1	Very high	181 Å²	181	64.9 Å²	64.9	79%	0.787	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.3	25	-167.2	-57.3	-175.3	178	-176.7	0	113.5	V711 A712 K713	V711-K715 PolarHBondContact O-N 3.26Å; V711-K715 VanDerWaalsContact O-N 3.13Å; A712-K715 WeakPolarHBondContact O-CA 3.4Å; A712-K715 PolarHBondContact O-N 3.39Å; K713-K715 VanDerWaalsContact C-N 3.29Å
716	L	91.1	Very high	91.5	Very high	19 Å²	19	65.1 Å²	65.1	10%	0.099	33%	0.327	C	S	.	.	G	3₁₀ helix	trans	-81.8	-14.6	-173.2	-69.1	172	0	0	0	113.6	W710 V711 G714 N718 A719 Q724 W727	W710-L716 HydrophobicContact CE3-CD1 4.3Å; W710-L716 HydrophobicContact CZ3-CD1 3.64Å; V711-L716 HydrophobicContact CB-CB 4.38Å; V711-L716 HydrophobicContact CG1-CB 4.06Å; V711-L716 PolarHBondContact O-N 2.83Å; G714-L716 PolarHBondContact O-N 2.85Å; L716-N718 PolarHBondContact O-N 3.32Å; L716-N718 VanDerWaalsContact O-N 3.07Å; L716-A719 HydrophobicContact CD2-CB 4.08Å; L716-A719 WeakPolarHBondContact O-CB 3.13Å; L716-A719 PolarHBondContact O-N 3.36Å; L716-Q724 WeakPolarHBondContact O-CG 3.41Å; L716-Q724 PolarHBondContact O-NE2 3.28Å; L716-W727 HydrophobicContact CD1-CB 3.73Å; L716-W727 HydrophobicContact CD1-CG 3.96Å; L716-W727 HydrophobicContact CD2-CG 4.42Å
717	Q	89.1	Confident	91.7	Very high	85 Å²	85	67.4 Å²	67.4	40%	0.397	33%	0.329	S	S	.	.	G	3₁₀ helix	trans	-51.3	-34.6	-177.3	63.9	-174.8	54.2	0	0	114.4	Y705 V711 Q724	Y705-Q717 HydrophobicContact CG-CB 4.46Å; V711-Q717 HydrophobicContact CG1-CB 4.32Å; Q717-Q724 PolarHBondContact O-NE2 3.48Å
718	N	87.4	Confident	92	Very high	146 Å²	146	61.6 Å²	61.6	78%	0.781	29%	0.294	S	S	*	.	G	3₁₀ helix	trans	-112.8	10.9	179.8	-63.5	-0.6	0	0	0	112.4	L716	L716-N718 PolarHBondContact O-N 3.32Å; L716-N718 VanDerWaalsContact O-N 3.07Å
719	A	90.3	Very high	92.3	Very high	30 Å²	30	58.9 Å²	58.9	25%	0.248	28%	0.283	C	S	.	.	S	Bend	trans	-74.5	165.4	174.2	0	0	0	0	0	110.8	L716 D723 Q724	L716-A719 HydrophobicContact CD2-CB 4.08Å; L716-A719 WeakPolarHBondContact O-CB 3.13Å; L716-A719 PolarHBondContact O-N 3.36Å; A719-D723 HydrophobicContact CB-CB 4.33Å; A719-Q724 HydrophobicContact CB-CG 4.26Å; A719-Q724 PolarHBondContact O-NE2 3.24Å
720	Y	92.3	Very high	92.5	Very high	147 Å²	147	63.8 Å²	63.8	58%	0.576	30%	0.304	S	S	*	.			trans	-64.2	143.2	175.1	-177.3	-121.2	0	0	0	110.4	F722 D723 Q724	Y720-F722 HydrophobicContact CD1-CB 3.62Å; Y720-F722 HydrophobicContact CE1-CB 3.56Å; Y720-F722 PolarHBondContact O-N 3.02Å; Y720-D723 WeakPolarHBondContact O-CB 3.28Å; Y720-D723 PolarHBondContact O-N 3.33Å; Y720-Q724 PolarHBondContact O-N 3.39Å; Y720-Q724 VanDerWaalsContact O-N 3.14Å
721	W	90.8	Very high	92.6	Very high	76 Å²	76	63.2 Å²	63.2	29%	0.288	30%	0.302	S	S	.	.	H	α-helix	trans	-55.1	-32	-172.9	73.6	-94.2	0	0	0	113	V544 F548 F549 Q724 Y725	V544-W721 HydrophobicContact CG1-CE3 4.16Å; V544-W721 HydrophobicContact CG1-CZ3 3.95Å; F548-W721 HydrophobicContact CB-CB 4.11Å; F549-W721 HydrophobicContact CE1-CG 4.5Å; F549-W721 AromaticContact CE2-CD2 3.93Å; F549-W721 HydrophobicContact CE2-CD2 3.93Å; F549-W721 HydrophobicContact CE2-CE3 4.11Å; F549-W721 HydrophobicContact CE2-CG 4.12Å; F549-W721 AromaticContact CZ-CD1 3.84Å; F549-W721 AromaticContact CZ-CD2 3.76Å; F549-W721 HydrophobicContact CZ-CD2 3.76Å; F549-W721 AromaticContact CZ-CE2 3.87Å; F549-W721 HydrophobicContact CZ-CE3 4.36Å; F549-W721 AromaticContact CZ-CG 3.79Å; F549-W721 HydrophobicContact CZ-CG 3.79Å; F549-W721 AromaticContact CZ-NE1 3.88Å; W721-Q724 WeakPolarHBondContact O-CB 3.5Å; W721-Q724 PolarHBondContact O-N 3.26Å; W721-Y725 WeakPolarHBondContact O-CB 3.39Å; W721-Y725 PolarHBondContact O-N 3.43Å
722	F	93.8	Very high	92.7	Very high	105 Å²	105	63.2 Å²	63.2	46%	0.461	30%	0.302	S	S	.	.	H	α-helix	trans	-69.5	-37	177.5	-173.8	-96.1	0	0	0	112.2	Y720 Y725 T726	Y720-F722 HydrophobicContact CD1-CB 3.62Å; Y720-F722 HydrophobicContact CE1-CB 3.56Å; Y720-F722 PolarHBondContact O-N 3.02Å; F722-Y725 PolarHBondContact O-N 2.96Å; F722-T726 WeakPolarHBondContact O-CB 3.26Å; F722-T726 PolarHBondContact O-N 2.9Å; F722-T726 PolarHBondContact O-OG1 3.4Å
723	D	93.7	Very high	92.8	Very high	77 Å²	77	64.6 Å²	64.6	41%	0.412	31%	0.306	S	S	.	.	H	α-helix	trans	-67.6	-42.7	174.9	-61.1	-42.5	0	0	0	110.6	A719 Y720 Y725 T726 W727	A719-D723 HydrophobicContact CB-CB 4.33Å; Y720-D723 WeakPolarHBondContact O-CB 3.28Å; Y720-D723 PolarHBondContact O-N 3.33Å; D723-Y725 VanDerWaalsContact C-N 3.35Å; D723-Y725 PolarHBondContact O-N 2.86Å; D723-T726 PolarHBondContact O-N 2.9Å; D723-W727 PolarHBondContact O-N 2.83Å
724	Q	94.2	Very high	93	Very high	11 Å²	11	61.8 Å²	61.8	5%	0.051	30%	0.295	C	S	.	.	H	α-helix	trans	-56.3	-49.5	173.6	-63.9	175.5	-21.6	0	0	110.7	F548 F697 L716 Q717 A719 Y720 W721 W727 A728	F548-Q724 HydrophobicContact CD1-CB 3.64Å; F548-Q724 HydrophobicContact CE1-CB 3.71Å; F697-Q724 HydrophobicContact CD2-CB 4.31Å; F697-Q724 HydrophobicContact CE2-CB 3.75Å; F697-Q724 HydrophobicContact CE2-CG 3.93Å; F697-Q724 HydrophobicContact CZ-CB 4.01Å; F697-Q724 VanDerWaalsContact CZ-CD 3.48Å; F697-Q724 HydrophobicContact CZ-CG 3.99Å; L716-Q724 WeakPolarHBondContact O-CG 3.41Å; L716-Q724 PolarHBondContact O-NE2 3.28Å; Q717-Q724 PolarHBondContact O-NE2 3.48Å; A719-Q724 HydrophobicContact CB-CG 4.26Å; A719-Q724 PolarHBondContact O-NE2 3.24Å; Y720-Q724 PolarHBondContact O-N 3.39Å; Y720-Q724 VanDerWaalsContact O-N 3.14Å; W721-Q724 WeakPolarHBondContact O-CB 3.5Å; W721-Q724 PolarHBondContact O-N 3.26Å; Q724-W727 PolarHBondContact O-N 2.97Å; Q724-A728 VanDerWaalsContact O-CB 3.32Å; Q724-A728 WeakPolarHBondContact O-CB 3.46Å; Q724-A728 PolarHBondContact O-N 3.43Å
725	Y	95.5	Very high	93.3	Very high	39 Å²	39	60.9 Å²	60.9	15%	0.153	28%	0.284	C	S	.	.	H	α-helix	trans	-63	-43.9	176.5	173.6	-106.5	0	0	0	112.6	V544 F548 H690 A693 W721 F722 D723 W727 A728 L729	V544-Y725 HydrophobicContact CG2-CE2 4.46Å; F548-Y725 HydrophobicContact CD2-CD2 4.48Å; F548-Y725 AromaticContact CE2-CD2 3.66Å; F548-Y725 HydrophobicContact CE2-CD2 3.66Å; F548-Y725 HydrophobicContact CE2-CG 4.3Å; F548-Y725 AromaticContact CZ-CD2 3.94Å; F548-Y725 HydrophobicContact CZ-CD2 3.94Å; F548-Y725 HydrophobicContact CZ-CG 4.42Å; H690-Y725 AromaticContact CE1-CE2 4Å; H690-Y725 AromaticContact ND1-CE2 3.57Å; H690-Y725 AromaticContact ND1-CZ 3.63Å; H690-Y725 PolarHBondContact ND1-OH 3.03Å; A693-Y725 HydrophobicContact CB-CE2 4.48Å; W721-Y725 WeakPolarHBondContact O-CB 3.39Å; W721-Y725 PolarHBondContact O-N 3.43Å; F722-Y725 PolarHBondContact O-N 2.96Å; D723-Y725 VanDerWaalsContact C-N 3.35Å; D723-Y725 PolarHBondContact O-N 2.86Å; Y725-W727 PolarHBondContact O-N 3.4Å; Y725-A728 PolarHBondContact O-N 3.27Å; Y725-L729 HydrophobicContact CE1-CD2 4.07Å; Y725-L729 VanDerWaalsContact O-CB 3.24Å; Y725-L729 WeakPolarHBondContact O-CB 3.49Å; Y725-L729 PolarHBondContact O-N 3.49Å
726	T	95.3	Very high	93.4	Very high	52 Å²	52	53 Å²	53	32%	0.319	25%	0.25	S	C	.	.	H	α-helix	trans	-61.2	-43.2	178.4	-67	0	0	0	0	111.8	F722 D723 F730	F722-T726 WeakPolarHBondContact O-CB 3.26Å; F722-T726 PolarHBondContact O-N 2.9Å; F722-T726 PolarHBondContact O-OG1 3.4Å; D723-T726 PolarHBondContact O-N 2.9Å; T726-F730 WeakPolarHBondContact O-CB 3.47Å; T726-F730 PolarHBondContact O-N 3.37Å
727	W	94.9	Very high	93.5	Very high	96 Å²	96	55.5 Å²	55.5	36%	0.364	26%	0.263	S	S	.	.	H	α-helix	trans	-71.4	-36.2	176.3	-74.7	110.5	0	0	0	113	W710 L716 D723 Q724 Y725 F730 K731	W710-W727 HydrophobicContact CZ3-CB 4.19Å; L716-W727 HydrophobicContact CD1-CB 3.73Å; L716-W727 HydrophobicContact CD1-CG 3.96Å; L716-W727 HydrophobicContact CD2-CG 4.42Å; D723-W727 PolarHBondContact O-N 2.83Å; Q724-W727 PolarHBondContact O-N 2.97Å; Y725-W727 PolarHBondContact O-N 3.4Å; W727-F730 AromaticContact CE3-CD1 4Å; W727-F730 HydrophobicContact CE3-CD1 4Å; W727-F730 HydrophobicContact CZ3-CD1 4Å; W727-F730 HydrophobicContact CZ3-CE1 4.31Å; W727-F730 PolarHBondContact O-N 3.41Å; W727-K731 PolarHBondContact O-N 3.14Å
728	A	95.3	Very high	93.7	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-63.8	-42.4	173.3	0	0	0	0	0	111.9	F548 A693 F697 W710 Q724 Y725 K731 A732	F548-A728 HydrophobicContact CE1-CB 4.48Å; F548-A728 HydrophobicContact CZ-CB 4.07Å; A693-A728 HydrophobicContact CB-CB 4.34Å; A693-A728 WeakPolarHBondContact O-CB 3.32Å; F697-A728 HydrophobicContact CB-CB 4.13Å; W710-A728 HydrophobicContact CH2-CB 3.84Å; W710-A728 HydrophobicContact CZ2-CB 4.17Å; Q724-A728 VanDerWaalsContact O-CB 3.32Å; Q724-A728 WeakPolarHBondContact O-CB 3.46Å; Q724-A728 PolarHBondContact O-N 3.43Å; Y725-A728 PolarHBondContact O-N 3.27Å; A728-K731 PolarHBondContact O-N 3.29Å; A728-A732 PolarHBondContact O-N 3.47Å
729	L	95.3	Very high	94	Very high	47 Å²	47	54.8 Å²	54.8	25%	0.246	26%	0.264	C	S	.	.	H	α-helix	trans	-66.8	-42.7	176.3	-174.9	67.4	0	0	0	111.2	A693 Y725 K731 A732 M733	A693-L729 HydrophobicContact CB-CB 4.02Å; A693-L729 HydrophobicContact CB-CD1 3.94Å; Y725-L729 HydrophobicContact CE1-CD2 4.07Å; Y725-L729 VanDerWaalsContact O-CB 3.24Å; Y725-L729 WeakPolarHBondContact O-CB 3.49Å; Y725-L729 PolarHBondContact O-N 3.49Å; L729-K731 VanDerWaalsContact C-N 3.3Å; L729-K731 PolarHBondContact O-N 2.78Å; L729-A732 PolarHBondContact O-N 3.44Å; L729-M733 HydrophobicContact CD1-CG 3.96Å; L729-M733 HydrophobicContact CD1-SD 4.48Å; L729-M733 HydrophobicContact CG-CG 4.06Å; L729-M733 VanDerWaalsContact O-CB 3.25Å; L729-M733 WeakPolarHBondContact O-CB 3.05Å; L729-M733 WeakPolarHBondContact O-CG 3.25Å; L729-M733 PolarHBondContact O-N 3.01Å
730	F	94.9	Very high	94	Very high	104 Å²	104	54.7 Å²	54.7	46%	0.456	27%	0.266	S	S	.	.	H	α-helix	trans	-57.3	-43.2	172.7	177.6	-106.7	0	0	0	111.7	T726 W727 S734	T726-F730 WeakPolarHBondContact O-CB 3.47Å; T726-F730 PolarHBondContact O-N 3.37Å; W727-F730 AromaticContact CE3-CD1 4Å; W727-F730 HydrophobicContact CE3-CD1 4Å; W727-F730 HydrophobicContact CZ3-CD1 4Å; W727-F730 HydrophobicContact CZ3-CE1 4.31Å; W727-F730 PolarHBondContact O-N 3.41Å; F730-S734 VanDerWaalsContact O-CB 3.25Å; F730-S734 WeakPolarHBondContact O-CB 3.35Å; F730-S734 PolarHBondContact O-N 3.38Å; F730-S734 PolarHBondContact O-OG 2.76Å
731	K	94.6	Very high	93.9	Very high	5 Å²	5	51.3 Å²	51.3	2%	0.022	25%	0.252	C	S	.	.	H	α-helix	trans	-62.7	-50.5	176.1	-169.9	173.3	-166.9	-60.8	0	112.1	W710 W727 A728 L729 S734 H735 Y741 T755	W710-K731 HydrophobicContact CD2-CD 4.12Å; W710-K731 HydrophobicContact CG-CD 4.28Å; W727-K731 PolarHBondContact O-N 3.14Å; A728-K731 PolarHBondContact O-N 3.29Å; L729-K731 VanDerWaalsContact C-N 3.3Å; L729-K731 PolarHBondContact O-N 2.78Å; K731-S734 PolarHBondContact O-N 3.31Å; K731-H735 PolarHBondContact NZ-CE1 2.58Å; K731-H735 VanDerWaalsContact NZ-CE1 3.29Å; K731-H735 PolarHBondContact O-N 2.67Å; K731-H735 VanDerWaalsContact O-N 3.17Å; K731-Y741 WeakPolarHBondContact CE-O 3.12Å; K731-T755 PolarHBondContact NZ-OG1 2.99Å; K731-T755 VanDerWaalsContact NZ-OG1 3.14Å
732	A	95.5	Very high	93.7	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-64.4	-43.9	179.8	0	0	0	0	0	113	N692 A693 A728 L729 S734 H735 M736	N692-A732 HydrophobicContact CB-CB 3.98Å; A693-A732 HydrophobicContact CB-CB 3.99Å; A728-A732 PolarHBondContact O-N 3.47Å; L729-A732 PolarHBondContact O-N 3.44Å; A732-S734 VanDerWaalsContact C-N 3.3Å; A732-S734 PolarHBondContact O-N 2.86Å; A732-H735 PolarHBondContact O-N 2.91Å; A732-M736 WeakPolarHBondContact O-CB 3.42Å; A732-M736 PolarHBondContact O-N 3.29Å
733	M	94	Very high	93.3	Very high	46 Å²	46	52.1 Å²	52.1	23%	0.227	26%	0.262	C	S	.	.	H	α-helix	trans	-64.4	-34.2	175.4	-68.2	-64.9	-62.8	0	0	112.1	L729 M736 L737	L729-M733 HydrophobicContact CD1-CG 3.96Å; L729-M733 HydrophobicContact CD1-SD 4.48Å; L729-M733 HydrophobicContact CG-CG 4.06Å; L729-M733 VanDerWaalsContact O-CB 3.25Å; L729-M733 WeakPolarHBondContact O-CB 3.05Å; L729-M733 WeakPolarHBondContact O-CG 3.25Å; L729-M733 PolarHBondContact O-N 3.01Å; M733-M736 HydrophobicContact CE-CE 3.62Å; M733-M736 PolarHBondContact O-N 3.31Å; M733-M736 HydrophobicContact SD-CE 3.55Å; M733-M736 VanDerWaalsContact SD-CE 3.55Å; M733-L737 HydrophobicContact CE-CD1 4.18Å; M733-L737 WeakPolarHBondContact O-CB 3.44Å; M733-L737 PolarHBondContact O-N 3.01Å
734	S	95	Very high	93.1	Very high	6 Å²	6	51.9 Å²	51.9	4%	0.042	26%	0.256	C	S	.	.	H	α-helix	trans	-68.8	-32.3	176.4	-60.1	0	0	0	0	112.6	F730 K731 A732 T738 I739 G740	F730-S734 VanDerWaalsContact O-CB 3.25Å; F730-S734 WeakPolarHBondContact O-CB 3.35Å; F730-S734 PolarHBondContact O-N 3.38Å; F730-S734 PolarHBondContact O-OG 2.76Å; K731-S734 PolarHBondContact O-N 3.31Å; A732-S734 VanDerWaalsContact C-N 3.3Å; A732-S734 PolarHBondContact O-N 2.86Å; S734-T738 PolarHBondContact O-N 2.96Å; S734-I739 PolarHBondContact O-N 2.9Å; S734-G740 CarbonylContact C-O 3.59Å; S734-G740 VanDerWaalsContact C-O 3.28Å; S734-G740 WeakPolarHBondContact CB-O 3.48Å; S734-G740 PolarHBondContact O-N 2.8Å; S734-G740 VanDerWaalsContact O-N 3.11Å
735	H	94.7	Very high	92.9	Very high	6 Å²	6	55.1 Å²	55.1	3%	0.028	28%	0.278	C	S	.	.	H	α-helix	trans	-71.9	-43.4	168	-53.6	156.9	0	0	0	111.5	Q696 K731 A732 L737 T738 G740 S758 M759	Q696-H735 PolarHBondContact NE2-CE1 3.34Å; K731-H735 PolarHBondContact NZ-CE1 2.58Å; K731-H735 VanDerWaalsContact NZ-CE1 3.29Å; K731-H735 PolarHBondContact O-N 2.67Å; K731-H735 VanDerWaalsContact O-N 3.17Å; A732-H735 PolarHBondContact O-N 2.91Å; H735-L737 PolarHBondContact O-N 3.39Å; H735-T738 PolarHBondContact O-N 2.83Å; H735-T738 VanDerWaalsContact O-N 3.1Å; H735-G740 PolarHBondContact CD2-O 2.95Å; H735-G740 VanDerWaalsContact CD2-O 3.27Å; H735-S758 WeakPolarHBondContact ND1-CB 3.49Å; H735-S758 PolarHBondContact ND1-OG 2.85Å; H735-M759 HydrophobicContact CB-CG 4.08Å
736	M	93.8	Very high	92.7	Very high	15 Å²	15	54.9 Å²	54.9	7%	0.074	28%	0.281	C	S	.	.	H	α-helix	trans	-64	-38.3	-176.5	-170.1	173.9	81.4	0	0	113.6	L685 A732 M733 T738	L685-M736 HydrophobicContact CB-CE 4.33Å; L685-M736 HydrophobicContact CB-SD 4.36Å; L685-M736 VanDerWaalsContact O-SD 3.33Å; A732-M736 WeakPolarHBondContact O-CB 3.42Å; A732-M736 PolarHBondContact O-N 3.29Å; M733-M736 HydrophobicContact CE-CE 3.62Å; M733-M736 PolarHBondContact O-N 3.31Å; M733-M736 HydrophobicContact SD-CE 3.55Å; M733-M736 VanDerWaalsContact SD-CE 3.55Å; M736-T738 VanDerWaalsContact C-N 3.3Å
737	L	93.2	Very high	92.4	Very high	73 Å²	73	56 Å²	56	38%	0.382	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.1	12.4	176.4	-59.7	176.8	0	0	0	112.6	M733 H735 I739 Y766	M733-L737 HydrophobicContact CE-CD1 4.18Å; M733-L737 WeakPolarHBondContact O-CB 3.44Å; M733-L737 PolarHBondContact O-N 3.01Å; H735-L737 PolarHBondContact O-N 3.39Å; L737-I739 HydrophobicContact CB-CD1 3.85Å; L737-I739 HydrophobicContact CB-CG1 3.9Å; L737-I739 HydrophobicContact CD1-CD1 4.35Å; L737-I739 WeakPolarHBondContact O-CG1 3.42Å; L737-I739 PolarHBondContact O-N 3.46Å; L737-Y766 HydrophobicContact CD2-CD2 4.44Å
738	T	93.6	Very high	92.1	Very high	90 Å²	90	52.9 Å²	52.9	55%	0.552	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.8	29.4	178.4	61.3	0	0	0	0	115.3	S734 H735 M736 A763	S734-T738 PolarHBondContact O-N 2.96Å; H735-T738 PolarHBondContact O-N 2.83Å; H735-T738 VanDerWaalsContact O-N 3.1Å; M736-T738 VanDerWaalsContact C-N 3.3Å; T738-A763 HydrophobicContact CG2-CB 4.44Å
739	I	94.1	Very high	91.9	Very high	126 Å²	126	59.1 Å²	59.1	65%	0.646	31%	0.313	S	S	*	.			trans	-85.6	-42.5	-176.2	-55.5	176.2	0	0	0	112.1	S734 L737	S734-I739 PolarHBondContact O-N 2.9Å; L737-I739 HydrophobicContact CB-CD1 3.85Å; L737-I739 HydrophobicContact CB-CG1 3.9Å; L737-I739 HydrophobicContact CD1-CD1 4.35Å; L737-I739 WeakPolarHBondContact O-CG1 3.42Å; L737-I739 PolarHBondContact O-N 3.46Å
740	G	90.1	Very high	91.7	Very high	27 Å²	27	58.2 Å²	58.2	28%	0.278	31%	0.311	S	S	.	.			trans	155.2	-169.8	-177.6	0	0	0	0	0	115.3	S734 H735 G742	S734-G740 CarbonylContact C-O 3.59Å; S734-G740 VanDerWaalsContact C-O 3.28Å; S734-G740 WeakPolarHBondContact CB-O 3.48Å; S734-G740 PolarHBondContact O-N 2.8Å; S734-G740 VanDerWaalsContact O-N 3.11Å; H735-G740 PolarHBondContact CD2-O 2.95Å; H735-G740 VanDerWaalsContact CD2-O 3.27Å; G740-G742 PolarHBondContact O-N 3.44Å
741	Y	89.5	Confident	91.5	Very high	77 Å²	77	53.6 Å²	53.6	30%	0.302	29%	0.29	S	S	.	.			trans	-87.2	2.6	-166.7	-56.4	-69.5	0	0	0	116.4	K731 T755 M759	K731-Y741 WeakPolarHBondContact CE-O 3.12Å; Y741-T755 HydrophobicContact CD1-CG2 3.8Å; Y741-T755 HydrophobicContact CE1-CG2 3.99Å; Y741-M759 HydrophobicContact CD1-SD 4.46Å; Y741-M759 HydrophobicContact CE1-CE 4.32Å; Y741-M759 HydrophobicContact CE1-SD 3.67Å
742	G	86.6	Confident	91.4	Very high	30 Å²	30	55 Å²	55	31%	0.309	30%	0.303	S	S	.	.	S	Bend	trans	81.9	-148.7	-167.9	0	0	0	0	0	112.5	G740	G740-G742 PolarHBondContact O-N 3.44Å
743	R	86.4	Confident	91.4	Very high	167 Å²	167	62.7 Å²	62.7	63%	0.63	33%	0.332	S	S	*	.	S	Bend	trans	-71.1	-29.9	-173.9	-173.1	178	175.9	91.2	4.3	114.2
744	Y	88.2	Confident	91.4	Very high	73 Å²	73	61.4 Å²	61.4	29%	0.286	33%	0.327	S	S	.	.	S	Bend	trans	-138.8	140	-178.3	-55.2	-68.1	0	0	0	109.5	K713	K713-Y744 HydrophobicContact CB-CD2 4.02Å; K713-Y744 HydrophobicContact CB-CE2 3.93Å; K713-Y744 PolarHBondContact O-OH 3.17Å
745	P	89.9	Confident	91.3	Very high	79 Å²	79	61.2 Å²	61.2	51%	0.513	33%	0.325	S	S	.	.			trans	-65.7	156.4	169.2	30.7	-35.1	0	0	0	110.5	T747	P745-T747 PolarHBondContact O-N 2.71Å
746	P	91.1	Very high	91.3	Very high	34 Å²	34	64.4 Å²	64.4	22%	0.221	35%	0.345	C	S	.	.			trans	-63.5	130.7	175.2	28	-34.8	0	0	0	110.7	E751 A752 T755	P746-E751 HydrophobicContact CB-CB 3.8Å; P746-A752 HydrophobicContact CB-CB 4.41Å; P746-T755 HydrophobicContact CG-CG2 4.08Å
747	T	90.3	Very high	91.4	Very high	76 Å²	76	68.4 Å²	68.4	47%	0.466	37%	0.366	S	S	.	.			trans	-117.7	-21.5	179.6	36	0	0	0	0	113.5	E708 K713 P745 E751	E708-T747 PolarHBondContact O-OG1 3.47Å; K713-T747 PolarHBondContact NZ-OG1 2.91Å; P745-T747 PolarHBondContact O-N 2.71Å; T747-E751 PolarHBondContact N-OE2 2.81Å
748	S	89	Confident	91.5	Very high	30 Å²	30	65 Å²	65	21%	0.21	35%	0.348	C	S	.	.	S	Bend	trans	-84.9	146.1	165.6	176.8	0	0	0	0	111.4	S750 E751 A752	S748-S750 PolarHBondContact O-N 2.74Å; S748-S750 PolarHBondContact OG-N 3.06Å; S748-S750 PolarHBondContact OG-OG 3.5Å; S748-E751 PolarHBondContact N-OE2 3.07Å; S748-E751 VanDerWaalsContact N-OE2 3.16Å; S748-E751 PolarHBondContact O-N 3.01Å; S748-E751 VanDerWaalsContact O-N 3.1Å; S748-A752 PolarHBondContact O-N 3.21Å
749	L	90.7	Very high	91.6	Very high	130 Å²	130	64.3 Å²	64.3	68%	0.681	34%	0.339	S	S	*	.	H	α-helix	trans	-56.6	-35.3	171.1	-178.4	62	0	0	0	112.3	A752 W753	L749-A752 PolarHBondContact O-N 2.92Å; L749-W753 VanDerWaalsContact O-CD1 3.28Å; L749-W753 PolarHBondContact O-N 3.08Å; L749-W753 VanDerWaalsContact O-N 3.16Å
750	S	90.1	Very high	91.6	Very high	29 Å²	29	62.5 Å²	62.5	20%	0.203	33%	0.334	C	S	.	.	H	α-helix	trans	-66.3	-42.6	175.4	55.3	0	0	0	0	112	S748 A752 V754	S748-S750 PolarHBondContact O-N 2.74Å; S748-S750 PolarHBondContact OG-N 3.06Å; S748-S750 PolarHBondContact OG-OG 3.5Å; S750-A752 VanDerWaalsContact C-N 3.33Å; S750-V754 WeakPolarHBondContact O-CG2 3.41Å; S750-V754 PolarHBondContact O-N 3.18Å; S750-V754 VanDerWaalsContact O-N 3.12Å
751	E	91.9	Very high	91.7	Very high	6 Å²	6	65 Å²	65	3%	0.028	34%	0.344	C	S	.	.	H	α-helix	trans	-68.4	-33.2	176.5	-64.5	176.9	140	0	0	112.3	S709 W710 P746 T747 S748 T755	S709-E751 WeakPolarHBondContact CA-OE1 3.27Å; S709-E751 VanDerWaalsContact CB-OE1 3.28Å; S709-E751 WeakPolarHBondContact CB-OE1 3.4Å; W710-E751 PolarHBondContact N-OE1 3.32Å; P746-E751 HydrophobicContact CB-CB 3.8Å; T747-E751 PolarHBondContact N-OE2 2.81Å; S748-E751 PolarHBondContact N-OE2 3.07Å; S748-E751 VanDerWaalsContact N-OE2 3.16Å; S748-E751 PolarHBondContact O-N 3.01Å; S748-E751 VanDerWaalsContact O-N 3.1Å; E751-T755 WeakPolarHBondContact O-CB 3.06Å; E751-T755 PolarHBondContact O-N 2.88Å; E751-T755 PolarHBondContact O-OG1 3.27Å
752	A	92.7	Very high	92	Very high	34 Å²	34	61.4 Å²	61.4	28%	0.281	33%	0.33	S	S	.	.	H	α-helix	trans	-63.2	-51.4	176	0	0	0	0	0	110.8	P746 S748 L749 S750 V754 T755 V756	P746-A752 HydrophobicContact CB-CB 4.41Å; S748-A752 PolarHBondContact O-N 3.21Å; L749-A752 PolarHBondContact O-N 2.92Å; S750-A752 VanDerWaalsContact C-N 3.33Å; A752-V754 PolarHBondContact O-N 2.86Å; A752-T755 CarbonylContact O-C 3.45Å; A752-T755 WeakPolarHBondContact O-CB 3.29Å; A752-T755 PolarHBondContact O-N 3.23Å; A752-V756 WeakPolarHBondContact O-CG2 3.39Å; A752-V756 PolarHBondContact O-N 3.24Å
753	W	94.8	Very high	92.3	Very high	163 Å²	163	62.1 Å²	62.1	62%	0.617	33%	0.333	S	S	*	.	H	α-helix	trans	-61.6	-44.1	177	-79.4	113.5	0	0	0	113.1	L749 T755 V756 I757	L749-W753 VanDerWaalsContact O-CD1 3.28Å; L749-W753 PolarHBondContact O-N 3.08Å; L749-W753 VanDerWaalsContact O-N 3.16Å; W753-T755 VanDerWaalsContact C-N 3.27Å; W753-T755 PolarHBondContact O-N 3.31Å; W753-V756 PolarHBondContact O-N 2.9Å; W753-I757 WeakPolarHBondContact O-CG1 3.48Å; W753-I757 PolarHBondContact O-N 3.36Å
754	V	92.9	Very high	92.7	Very high	18 Å²	18	58 Å²	58	11%	0.109	33%	0.327	C	S	.	.	H	α-helix	trans	-64.4	-34.6	176.4	179.2	0	0	0	0	110.9	L695 Q696 I699 S750 A752 S758	L695-V754 HydrophobicContact CG-CG1 4.31Å; Q696-V754 HydrophobicContact CG-CG1 4.38Å; Q696-V754 PolarHBondContact NE2-O 3.38Å; I699-V754 HydrophobicContact CB-CG2 4.35Å; I699-V754 HydrophobicContact CD1-CG2 4.45Å; I699-V754 HydrophobicContact CG1-CG2 3.89Å; I699-V754 HydrophobicContact CG2-CG2 4.17Å; S750-V754 WeakPolarHBondContact O-CG2 3.41Å; S750-V754 PolarHBondContact O-N 3.18Å; S750-V754 VanDerWaalsContact O-N 3.12Å; A752-V754 PolarHBondContact O-N 2.86Å; V754-S758 WeakPolarHBondContact O-CB 3.33Å; V754-S758 PolarHBondContact O-N 3.27Å
755	T	94.4	Very high	92.9	Very high	3 Å²	3	54.8 Å²	54.8	2%	0.018	32%	0.317	C	S	.	.	H	α-helix	trans	-68.9	-42.6	173.5	-63.9	0	0	0	0	112.2	K731 Y741 P746 E751 A752 W753 S758 M759	K731-T755 PolarHBondContact NZ-OG1 2.99Å; K731-T755 VanDerWaalsContact NZ-OG1 3.14Å; Y741-T755 HydrophobicContact CD1-CG2 3.8Å; Y741-T755 HydrophobicContact CE1-CG2 3.99Å; P746-T755 HydrophobicContact CG-CG2 4.08Å; E751-T755 WeakPolarHBondContact O-CB 3.06Å; E751-T755 PolarHBondContact O-N 2.88Å; E751-T755 PolarHBondContact O-OG1 3.27Å; A752-T755 CarbonylContact O-C 3.45Å; A752-T755 WeakPolarHBondContact O-CB 3.29Å; A752-T755 PolarHBondContact O-N 3.23Å; W753-T755 VanDerWaalsContact C-N 3.27Å; W753-T755 PolarHBondContact O-N 3.31Å; T755-S758 WeakPolarHBondContact O-CB 3.5Å; T755-S758 PolarHBondContact O-N 3.27Å; T755-M759 HydrophobicContact CG2-CG 4.42Å; T755-M759 HydrophobicContact CG2-SD 3.9Å; T755-M759 WeakPolarHBondContact O-CB 3.17Å; T755-M759 VanDerWaalsContact O-CG 3.28Å; T755-M759 WeakPolarHBondContact O-CG 3.25Å; T755-M759 PolarHBondContact O-N 3.31Å
756	V	95	Very high	93	Very high	73 Å²	73	56.1 Å²	56.1	44%	0.442	31%	0.312	S	S	.	.	H	α-helix	trans	-61	-48.7	175.2	169	0	0	0	0	111.1	A752 W753 S758 M759 V760	A752-V756 WeakPolarHBondContact O-CG2 3.39Å; A752-V756 PolarHBondContact O-N 3.24Å; W753-V756 PolarHBondContact O-N 2.9Å; V756-S758 VanDerWaalsContact C-N 3.28Å; V756-S758 PolarHBondContact O-N 2.9Å; V756-M759 PolarHBondContact O-N 2.91Å; V756-V760 HydrophobicContact CG1-CG2 4.48Å; V756-V760 WeakPolarHBondContact O-CG2 3.37Å; V756-V760 PolarHBondContact O-N 2.79Å
757	I	94.5	Very high	93.2	Very high	98 Å²	98	57.1 Å²	57.1	50%	0.503	32%	0.324	S	S	.	.	H	α-helix	trans	-59.6	-42	176.8	-66.7	164.6	0	0	0	110.8	W753 V760 T761	W753-I757 WeakPolarHBondContact O-CG1 3.48Å; W753-I757 PolarHBondContact O-N 3.36Å; I757-V760 PolarHBondContact O-N 3.1Å; I757-T761 HydrophobicContact CG2-CG2 4.49Å; I757-T761 WeakPolarHBondContact O-CB 3.49Å; I757-T761 WeakPolarHBondContact O-CG2 3.32Å; I757-T761 PolarHBondContact O-N 2.84Å; I757-T761 PolarHBondContact O-OG1 3.12Å
758	S	95.3	Very high	93.3	Very high	2 Å²	2	57.1 Å²	57.1	1%	0.014	32%	0.32	C	S	.	.	H	α-helix	trans	-65.3	-34.6	177.5	-174.5	0	0	0	0	113.4	N692 Q696 H735 V754 T755 V756 T761 G762	N692-S758 PolarHBondContact ND2-OG 3.47Å; N692-S758 VanDerWaalsContact OD1-CB 3.27Å; N692-S758 WeakPolarHBondContact OD1-CB 3.5Å; N692-S758 PolarHBondContact OD1-OG 3.4Å; Q696-S758 VanDerWaalsContact NE2-CB 3.26Å; Q696-S758 PolarHBondContact NE2-OG 3.43Å; H735-S758 WeakPolarHBondContact ND1-CB 3.49Å; H735-S758 PolarHBondContact ND1-OG 2.85Å; V754-S758 WeakPolarHBondContact O-CB 3.33Å; V754-S758 PolarHBondContact O-N 3.27Å; T755-S758 WeakPolarHBondContact O-CB 3.5Å; T755-S758 PolarHBondContact O-N 3.27Å; V756-S758 VanDerWaalsContact C-N 3.28Å; V756-S758 PolarHBondContact O-N 2.9Å; S758-T761 PolarHBondContact O-OG1 3.34Å; S758-G762 PolarHBondContact O-N 3.23Å
759	M	95.3	Very high	93.4	Very high	75 Å²	75	58.2 Å²	58.2	37%	0.369	32%	0.321	S	S	.	.	H	α-helix	trans	-74.3	-42.1	173.9	-71.8	169.5	67.1	0	0	112.3	H735 Y741 T755 V756 G762 A763	H735-M759 HydrophobicContact CB-CG 4.08Å; Y741-M759 HydrophobicContact CD1-SD 4.46Å; Y741-M759 HydrophobicContact CE1-CE 4.32Å; Y741-M759 HydrophobicContact CE1-SD 3.67Å; T755-M759 HydrophobicContact CG2-CG 4.42Å; T755-M759 HydrophobicContact CG2-SD 3.9Å; T755-M759 WeakPolarHBondContact O-CB 3.17Å; T755-M759 VanDerWaalsContact O-CG 3.28Å; T755-M759 WeakPolarHBondContact O-CG 3.25Å; T755-M759 PolarHBondContact O-N 3.31Å; V756-M759 PolarHBondContact O-N 2.91Å; M759-G762 PolarHBondContact O-N 3.26Å; M759-A763 WeakPolarHBondContact O-CB 3.39Å; M759-A763 PolarHBondContact O-N 3.16Å
760	V	95.3	Very high	93.5	Very high	89 Å²	89	55.4 Å²	55.4	54%	0.539	31%	0.309	S	S	.	.	H	α-helix	trans	-64.5	-52.3	178.2	171.3	0	0	0	0	110.6	V756 I757 G762 A763 T764	V756-V760 HydrophobicContact CG1-CG2 4.48Å; V756-V760 WeakPolarHBondContact O-CG2 3.37Å; V756-V760 PolarHBondContact O-N 2.79Å; I757-V760 PolarHBondContact O-N 3.1Å; V760-G762 VanDerWaalsContact C-N 3.26Å; V760-G762 PolarHBondContact O-N 2.89Å; V760-A763 PolarHBondContact O-N 2.94Å; V760-T764 PolarHBondContact O-N 3.24Å; V760-T764 PolarHBondContact O-OG1 3.06Å
761	T	92.9	Very high	93.6	Very high	78 Å²	78	55.6 Å²	55.6	48%	0.479	32%	0.316	S	S	.	.	H	α-helix	trans	-60.2	-37.9	175.3	50.7	0	0	0	0	112	I757 S758 G765	I757-T761 HydrophobicContact CG2-CG2 4.49Å; I757-T761 WeakPolarHBondContact O-CB 3.49Å; I757-T761 WeakPolarHBondContact O-CG2 3.32Å; I757-T761 PolarHBondContact O-N 2.84Å; I757-T761 PolarHBondContact O-OG1 3.12Å; S758-T761 PolarHBondContact O-OG1 3.34Å; T761-G765 PolarHBondContact O-N 3.31Å
762	G	94.1	Very high	93.4	Very high	2 Å²	2	59.4 Å²	59.4	2%	0.021	33%	0.334	C	S	.	.	H	α-helix	trans	-59.8	-56.9	175.1	0	0	0	0	0	113.8	S758 M759 V760 T764 G765 Y766	S758-G762 PolarHBondContact O-N 3.23Å; M759-G762 PolarHBondContact O-N 3.26Å; V760-G762 VanDerWaalsContact C-N 3.26Å; V760-G762 PolarHBondContact O-N 2.89Å; G762-T764 VanDerWaalsContact C-N 3.33Å; G762-T764 PolarHBondContact O-N 3.48Å; G762-G765 PolarHBondContact O-N 3.25Å; G762-G765 VanDerWaalsContact O-N 3.16Å; G762-Y766 PolarHBondContact O-N 3.42Å
763	A	94	Very high	93.2	Very high	45 Å²	45	58.9 Å²	58.9	37%	0.372	33%	0.329	S	S	.	.	H	α-helix	trans	-61.6	-38.9	179.8	0	0	0	0	0	112.4	T738 M759 V760 Y766 A767	T738-A763 HydrophobicContact CG2-CB 4.44Å; M759-A763 WeakPolarHBondContact O-CB 3.39Å; M759-A763 PolarHBondContact O-N 3.16Å; V760-A763 PolarHBondContact O-N 2.94Å; A763-Y766 PolarHBondContact O-N 2.94Å; A763-A767 WeakPolarHBondContact O-CB 3.41Å; A763-A767 PolarHBondContact O-N 3.48Å
764	T	94.3	Very high	92.9	Very high	80 Å²	80	53.2 Å²	53.2	49%	0.491	32%	0.317	S	S	.	.	H	α-helix	trans	-61.5	-46.7	172.9	-56.6	0	0	0	0	111.5	V760 G762 Y766 A767 L768	V760-T764 PolarHBondContact O-N 3.24Å; V760-T764 PolarHBondContact O-OG1 3.06Å; G762-T764 VanDerWaalsContact C-N 3.33Å; G762-T764 PolarHBondContact O-N 3.48Å; T764-Y766 PolarHBondContact O-N 2.98Å; T764-A767 PolarHBondContact O-N 2.97Å; T764-L768 HydrophobicContact CG2-CD1 4.36Å; T764-L768 WeakPolarHBondContact O-CG 3.07Å; T764-L768 PolarHBondContact O-N 3.3Å
765	G	91.8	Very high	92.6	Very high	7 Å²	7	54.5 Å²	54.5	7%	0.072	33%	0.329	C	S	.	.	H	α-helix	trans	-62.3	-40.4	177.7	0	0	0	0	0	113.4	L685 T761 G762 F769	L685-G765 VanDerWaalsContact CD2-CA 3.45Å; T761-G765 PolarHBondContact O-N 3.31Å; G762-G765 PolarHBondContact O-N 3.25Å; G762-G765 VanDerWaalsContact O-N 3.16Å; G765-F769 PolarHBondContact O-N 3.25Å; G765-F769 VanDerWaalsContact O-N 3.07Å
766	Y	92.3	Very high	92.1	Very high	106 Å²	106	55.3 Å²	55.3	42%	0.416	33%	0.334	S	S	.	.	H	α-helix	trans	-68.2	-40.4	176.2	-175.3	-110.9	0	0	0	112.6	L737 G762 A763 T764 L768 F769 V770	L737-Y766 HydrophobicContact CD2-CD2 4.44Å; G762-Y766 PolarHBondContact O-N 3.42Å; A763-Y766 PolarHBondContact O-N 2.94Å; T764-Y766 PolarHBondContact O-N 2.98Å; Y766-L768 PolarHBondContact O-N 2.8Å; Y766-F769 WeakPolarHBondContact O-CB 3.26Å; Y766-F769 PolarHBondContact O-N 2.9Å; Y766-V770 HydrophobicContact CD1-CG2 4.47Å; Y766-V770 HydrophobicContact CE1-CG2 4.07Å; Y766-V770 HydrophobicContact CE2-CG2 4.36Å; Y766-V770 WeakPolarHBondContact O-CG2 3.18Å; Y766-V770 PolarHBondContact O-N 2.83Å
767	A	94.6	Very high	91.6	Very high	56 Å²	56	57.7 Å²	57.7	46%	0.463	34%	0.343	S	S	.	.	H	α-helix	trans	-61.1	-43.3	175.2	0	0	0	0	0	112.1	A763 T764 V770 G771	A763-A767 WeakPolarHBondContact O-CB 3.41Å; A763-A767 PolarHBondContact O-N 3.48Å; T764-A767 PolarHBondContact O-N 2.97Å; A767-V770 PolarHBondContact O-N 2.96Å; A767-G771 PolarHBondContact O-N 3.48Å
768	L	92.5	Very high	91.1	Very high	76 Å²	76	57.2 Å²	57.2	40%	0.398	34%	0.338	S	S	.	.	H	α-helix	trans	-61	-43.1	173.8	-70.4	169.9	0	0	0	111.7	T764 Y766 V770 G771 H772	T764-L768 HydrophobicContact CG2-CD1 4.36Å; T764-L768 WeakPolarHBondContact O-CG 3.07Å; T764-L768 PolarHBondContact O-N 3.3Å; Y766-L768 PolarHBondContact O-N 2.8Å; L768-V770 PolarHBondContact O-N 3.46Å; L768-G771 PolarHBondContact O-N 2.99Å; L768-H772 PolarHBondContact O-CD2 3.36Å; L768-H772 VanDerWaalsContact O-CD2 3.32Å; L768-H772 PolarHBondContact O-N 3.34Å
769	F	92.7	Very high	90.3	Very high	52 Å²	52	59 Å²	59	23%	0.228	35%	0.351	C	S	.	.	H	α-helix	trans	-58.5	-45.3	175.5	176.1	-101.3	0	0	0	112.5	I678 V682 L685 G765 Y766 A773	I678-F769 HydrophobicContact CD1-CE2 4.43Å; I678-F769 HydrophobicContact CG1-CE2 4.49Å; V682-F769 HydrophobicContact CG2-CD2 4.07Å; V682-F769 HydrophobicContact CG2-CE2 3.72Å; L685-F769 HydrophobicContact CD1-CB 3.85Å; L685-F769 HydrophobicContact CD1-CD2 4.42Å; L685-F769 HydrophobicContact CD1-CG 4.45Å; G765-F769 PolarHBondContact O-N 3.25Å; G765-F769 VanDerWaalsContact O-N 3.07Å; Y766-F769 WeakPolarHBondContact O-CB 3.26Å; Y766-F769 PolarHBondContact O-N 2.9Å; F769-A773 VanDerWaalsContact O-CB 3.25Å; F769-A773 WeakPolarHBondContact O-CB 3.42Å; F769-A773 PolarHBondContact O-N 2.94Å
770	V	92.4	Very high	89.6	Confident	71 Å²	71	60.7 Å²	60.7	43%	0.43	36%	0.356	S	S	.	.	H	α-helix	trans	-63.5	-42.2	177.4	174	0	0	0	0	111.3	Y766 A767 L768 A773 A774	Y766-V770 HydrophobicContact CD1-CG2 4.47Å; Y766-V770 HydrophobicContact CE1-CG2 4.07Å; Y766-V770 HydrophobicContact CE2-CG2 4.36Å; Y766-V770 WeakPolarHBondContact O-CG2 3.18Å; Y766-V770 PolarHBondContact O-N 2.83Å; A767-V770 PolarHBondContact O-N 2.96Å; L768-V770 PolarHBondContact O-N 3.46Å; V770-A773 PolarHBondContact O-N 3.22Å; V770-A774 WeakPolarHBondContact O-CB 3.39Å; V770-A774 PolarHBondContact O-N 2.87Å
771	G	91.1	Very high	88.8	Confident	33 Å²	33	60.5 Å²	60.5	34%	0.34	35%	0.352	S	S	.	.	H	α-helix	trans	-60.7	-50.9	175.9	0	0	0	0	0	113.1	A767 L768 A773 A774 A775	A767-G771 PolarHBondContact O-N 3.48Å; L768-G771 PolarHBondContact O-N 2.99Å; G771-A773 VanDerWaalsContact C-N 3.35Å; G771-A773 PolarHBondContact O-N 2.99Å; G771-A774 PolarHBondContact O-N 3.28Å; G771-A775 WeakPolarHBondContact O-CB 3.41Å; G771-A775 PolarHBondContact O-N 3.11Å
772	H	87.7	Confident	88.4	Confident	87 Å²	87	60.1 Å²	60.1	40%	0.403	35%	0.352	S	S	.	.	H	α-helix	trans	-64.3	-36.7	177.1	-82.4	-88.9	0	0	0	112.8	L681 L768 A775 L776	L681-H772 HydrophobicContact CD2-CB 3.75Å; L681-H772 VanDerWaalsContact CD2-CD2 3.47Å; L681-H772 WeakPolarHBondContact CD2-CD2 3.43Å; L768-H772 PolarHBondContact O-CD2 3.36Å; L768-H772 VanDerWaalsContact O-CD2 3.32Å; L768-H772 PolarHBondContact O-N 3.34Å; H772-A775 PolarHBondContact O-N 3.1Å; H772-L776 WeakPolarHBondContact O-CB 3.24Å; H772-L776 PolarHBondContact O-N 3.38Å
773	A	89.1	Confident	88.1	Confident	22 Å²	22	61.7 Å²	61.7	18%	0.182	36%	0.363	C	S	.	.	H	α-helix	trans	-64.2	-43.7	174.5	0	0	0	0	0	111.8	I678 F769 V770 G771 L776 I777	I678-A773 HydrophobicContact CD1-CB 4.19Å; F769-A773 VanDerWaalsContact O-CB 3.25Å; F769-A773 WeakPolarHBondContact O-CB 3.42Å; F769-A773 PolarHBondContact O-N 2.94Å; V770-A773 PolarHBondContact O-N 3.22Å; G771-A773 VanDerWaalsContact C-N 3.35Å; G771-A773 PolarHBondContact O-N 2.99Å; A773-L776 PolarHBondContact O-N 3.34Å; A773-I777 VanDerWaalsContact O-CG1 3.27Å; A773-I777 WeakPolarHBondContact O-CG1 3.34Å; A773-I777 PolarHBondContact O-N 3.47Å
774	A	89.2	Confident	87.8	Confident	44 Å²	44	63.4 Å²	63.4	36%	0.364	36%	0.362	S	S	.	.	H	α-helix	trans	-63	-45	175.5	0	0	0	0	0	112.1	V770 G771 L776 I777 Q778	V770-A774 WeakPolarHBondContact O-CB 3.39Å; V770-A774 PolarHBondContact O-N 2.87Å; G771-A774 PolarHBondContact O-N 3.28Å; A774-L776 VanDerWaalsContact C-N 3.3Å; A774-L776 PolarHBondContact O-N 2.77Å; A774-I777 PolarHBondContact O-N 3.34Å; A774-Q778 WeakPolarHBondContact O-CG 3.07Å; A774-Q778 PolarHBondContact O-N 3.14Å
775	A	85.4	Confident	87.5	Confident	45 Å²	45	63.4 Å²	63.4	37%	0.372	35%	0.353	S	S	.	.	H	α-helix	trans	-64.7	-31.4	177.4	0	0	0	0	0	113.1	G771 H772 S779	G771-A775 WeakPolarHBondContact O-CB 3.41Å; G771-A775 PolarHBondContact O-N 3.11Å; H772-A775 PolarHBondContact O-N 3.1Å; A775-S779 PolarHBondContact O-N 3.41Å
776	L	85.1	Confident	87.4	Confident	21 Å²	21	66.6 Å²	66.6	11%	0.11	37%	0.368	C	S	.	.	H	α-helix	trans	-69.8	-48.5	171.4	-176.4	69.7	0	0	0	111	K674 F675 I678 H772 A773 A774 Q778 S779 F780	K674-L776 HydrophobicContact CB-CD1 3.87Å; F675-L776 HydrophobicContact CD1-CD1 4.49Å; F675-L776 HydrophobicContact CD2-CD1 4.12Å; F675-L776 HydrophobicContact CE2-CD1 4.19Å; F675-L776 HydrophobicContact CG-CD1 4.3Å; F675-L776 HydrophobicContact CZ-CD1 4.42Å; I678-L776 HydrophobicContact CD1-CD2 4.02Å; I678-L776 HydrophobicContact CG2-CD2 3.98Å; H772-L776 WeakPolarHBondContact O-CB 3.24Å; H772-L776 PolarHBondContact O-N 3.38Å; A773-L776 PolarHBondContact O-N 3.34Å; A774-L776 VanDerWaalsContact C-N 3.3Å; A774-L776 PolarHBondContact O-N 2.77Å; L776-Q778 VanDerWaalsContact C-N 3.31Å; L776-Q778 PolarHBondContact O-N 3.49Å; L776-S779 WeakPolarHBondContact O-CA 3.31Å; L776-S779 WeakPolarHBondContact O-CB 3.46Å; L776-S779 PolarHBondContact O-N 3.4Å; L776-S779 PolarHBondContact O-OG 3.39Å; L776-F780 HydrophobicContact CD1-CE2 4.42Å; L776-F780 HydrophobicContact CD2-CE2 4.36Å; L776-F780 HydrophobicContact CG-CE2 3.91Å; L776-F780 VanDerWaalsContact O-CD2 3.31Å; L776-F780 WeakPolarHBondContact O-CD2 3.21Å; L776-F780 PolarHBondContact O-N 3.21Å
777	I	84.8	Confident	87.4	Confident	123 Å²	123	63.2 Å²	63.2	63%	0.631	36%	0.355	S	S	*	.	H	α-helix	trans	-55.3	-46	176.7	-70.5	164.5	0	0	0	110.9	A773 A774 S779 F780	A773-I777 VanDerWaalsContact O-CG1 3.27Å; A773-I777 WeakPolarHBondContact O-CG1 3.34Å; A773-I777 PolarHBondContact O-N 3.47Å; A774-I777 PolarHBondContact O-N 3.34Å; I777-S779 PolarHBondContact O-N 2.93Å; I777-F780 PolarHBondContact O-N 3.3Å
778	Q	82.4	Confident	87.3	Confident	87 Å²	87	66.8 Å²	66.8	41%	0.407	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-17.3	176.5	-72.6	177	-8.6	0	0	114.6	A774 L776 R785	A774-Q778 WeakPolarHBondContact O-CG 3.07Å; A774-Q778 PolarHBondContact O-N 3.14Å; L776-Q778 VanDerWaalsContact C-N 3.31Å; L776-Q778 PolarHBondContact O-N 3.49Å; Q778-R785 PolarHBondContact O-NH1 3.16Å; Q778-R785 VanDerWaalsContact O-NH1 3.14Å
779	S	80.1	Confident	87.3	Confident	41 Å²	41	66.8 Å²	66.8	29%	0.287	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.6	-16.2	178.7	75.8	0	0	0	0	114.3	A775 L776 I777	A775-S779 PolarHBondContact O-N 3.41Å; L776-S779 WeakPolarHBondContact O-CA 3.31Å; L776-S779 WeakPolarHBondContact O-CB 3.46Å; L776-S779 PolarHBondContact O-N 3.4Å; L776-S779 PolarHBondContact O-OG 3.39Å; I777-S779 PolarHBondContact O-N 2.93Å
780	F	80.1	Confident	87.4	Confident	109 Å²	109	68.2 Å²	68.2	48%	0.478	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.3	148.4	168.9	-74.9	-81	0	0	0	111.1	F675 L776 I777 C782	F675-F780 HydrophobicContact CE1-CE1 4.37Å; F675-F780 AromaticContact CE1-CZ 3.78Å; F675-F780 HydrophobicContact CE1-CZ 3.78Å; F675-F780 HydrophobicContact CE2-CZ 4.43Å; F675-F780 AromaticContact CZ-CE1 3.64Å; F675-F780 HydrophobicContact CZ-CE1 3.64Å; F675-F780 HydrophobicContact CZ-CE2 4.32Å; F675-F780 AromaticContact CZ-CZ 3.4Å; F675-F780 HydrophobicContact CZ-CZ 3.4Å; L776-F780 HydrophobicContact CD1-CE2 4.42Å; L776-F780 HydrophobicContact CD2-CE2 4.36Å; L776-F780 HydrophobicContact CG-CE2 3.91Å; L776-F780 VanDerWaalsContact O-CD2 3.31Å; L776-F780 WeakPolarHBondContact O-CD2 3.21Å; L776-F780 PolarHBondContact O-N 3.21Å; I777-F780 PolarHBondContact O-N 3.3Å; F780-C782 PolarHBondContact O-N 2.96Å
781	D	79	Confident	87.5	Confident	86 Å²	86	67.5 Å²	67.5	46%	0.46	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.5	33	169.8	-84.7	-7.4	0	0	0	116.2	S783 K784 R785	D781-S783 VanDerWaalsContact C-N 3.26Å; D781-S783 PolarHBondContact O-N 3.44Å; D781-S783 VanDerWaalsContact O-N 3.13Å; D781-K784 HydrophobicContact CB-CB 4.28Å; D781-K784 HydrophobicContact CB-CD 4.11Å; D781-K784 HydrophobicContact CB-CG 4.27Å; D781-K784 WeakPolarHBondContact O-CA 3.43Å; D781-K784 WeakPolarHBondContact O-CB 3.5Å; D781-K784 PolarHBondContact O-N 3.09Å; D781-K784 IonicContact OD1-NZ 3.81Å; D781-K784 WeakPolarHBondContact OD2-CD 3.28Å; D781-K784 WeakPolarHBondContact OD2-CE 3.09Å; D781-K784 IonicContact OD2-NZ 3.54Å; D781-K784 PolarHBondContact OD2-NZ 3.33Å; D781-R785 PolarHBondContact O-N 3.17Å
782	C	84.2	Confident	87.7	Confident	70 Å²	70	71.3 Å²	71.3	47%	0.473	36%	0.359	S	S	.	.	H	α-helix	trans	-47.6	-43.4	178.1	-172.9	0	0	0	0	113.5	F780 K784 R785 L786	F780-C782 PolarHBondContact O-N 2.96Å; C782-K784 VanDerWaalsContact C-N 3.35Å; C782-K784 PolarHBondContact O-N 3.39Å; C782-R785 WeakPolarHBondContact O-CB 3.23Å; C782-R785 PolarHBondContact O-N 3.05Å; C782-R785 VanDerWaalsContact O-N 3.13Å; C782-L786 WeakPolarHBondContact O-CB 3.1Å; C782-L786 PolarHBondContact O-N 3.13Å
783	S	86.5	Confident	88.1	Confident	35 Å²	35	72 Å²	72	25%	0.245	36%	0.362	C	S	.	.	H	α-helix	trans	-70.4	-23.7	179.1	55.2	0	0	0	0	114.7	D781 Y787 M823	D781-S783 VanDerWaalsContact C-N 3.26Å; D781-S783 PolarHBondContact O-N 3.44Å; D781-S783 VanDerWaalsContact O-N 3.13Å; S783-Y787 PolarHBondContact O-N 2.86Å; S783-M823 PolarHBondContact O-N 3.36Å
784	K	88.6	Confident	88.4	Confident	81 Å²	81	71.8 Å²	71.8	35%	0.352	36%	0.358	S	S	.	.	H	α-helix	trans	-78.8	-37.4	167.1	-59.9	-173.4	-169	163.2	0	111.2	D781 C782 Y787 R788	D781-K784 HydrophobicContact CB-CB 4.28Å; D781-K784 HydrophobicContact CB-CD 4.11Å; D781-K784 HydrophobicContact CB-CG 4.27Å; D781-K784 WeakPolarHBondContact O-CA 3.43Å; D781-K784 WeakPolarHBondContact O-CB 3.5Å; D781-K784 PolarHBondContact O-N 3.09Å; D781-K784 IonicContact OD1-NZ 3.81Å; D781-K784 WeakPolarHBondContact OD2-CD 3.28Å; D781-K784 WeakPolarHBondContact OD2-CE 3.09Å; D781-K784 IonicContact OD2-NZ 3.54Å; D781-K784 PolarHBondContact OD2-NZ 3.33Å; C782-K784 VanDerWaalsContact C-N 3.35Å; C782-K784 PolarHBondContact O-N 3.39Å; K784-Y787 PolarHBondContact O-N 3.39Å; K784-R788 WeakPolarHBondContact O-CG 3.45Å; K784-R788 PolarHBondContact O-N 2.94Å
785	R	87.9	Confident	88.6	Confident	80 Å²	80	73 Å²	73	30%	0.302	36%	0.359	S	S	.	.	H	α-helix	trans	-61.3	-50.3	177.7	-152	-170.2	74.8	-145	-0.5	110.2	Q778 D781 C782 Y787 R788 E789	Q778-R785 PolarHBondContact O-NH1 3.16Å; Q778-R785 VanDerWaalsContact O-NH1 3.14Å; D781-R785 PolarHBondContact O-N 3.17Å; C782-R785 WeakPolarHBondContact O-CB 3.23Å; C782-R785 PolarHBondContact O-N 3.05Å; C782-R785 VanDerWaalsContact O-N 3.13Å; R785-Y787 VanDerWaalsContact C-N 3.32Å; R785-Y787 PolarHBondContact O-N 2.67Å; R785-R788 PolarHBondContact O-N 2.94Å; R785-R788 VanDerWaalsContact O-N 3.1Å; R785-E789 WeakPolarHBondContact CD-OE1 3.43Å; R785-E789 WeakPolarHBondContact CG-OE1 3.25Å; R785-E789 IonicContact CZ-OE1 3.97Å; R785-E789 IonicContact NE-OE1 3.71Å; R785-E789 PolarHBondContact NE-OE1 3.4Å; R785-E789 IonicContact NH2-OE1 3.76Å; R785-E789 WeakPolarHBondContact O-CB 3.43Å; R785-E789 VanDerWaalsContact O-CG 3.3Å; R785-E789 WeakPolarHBondContact O-CG 3.31Å; R785-E789 PolarHBondContact O-N 2.86Å
786	L	89.8	Confident	89.1	Confident	73 Å²	73	75.6 Å²	75.6	38%	0.382	36%	0.363	S	S	.	.	H	α-helix	trans	-58.1	-40.1	174.5	-175	65.1	0	0	0	112.5	C782 E789 K790 M823	C782-L786 WeakPolarHBondContact O-CB 3.1Å; C782-L786 PolarHBondContact O-N 3.13Å; L786-E789 WeakPolarHBondContact CA-OE2 3.34Å; L786-K790 WeakPolarHBondContact O-CB 3.38Å; L786-K790 PolarHBondContact O-N 3.26Å; L786-M823 HydrophobicContact CB-CB 4.38Å; L786-M823 HydrophobicContact CD2-CB 4.11Å; L786-M823 HydrophobicContact CD2-CG 4.04Å; L786-M823 HydrophobicContact CG-CB 4.02Å; L786-M823 HydrophobicContact CG-CG 4.1Å; L786-M823 HydrophobicContact CG-SD 4.09Å
787	Y	92.9	Very high	89.7	Confident	36 Å²	36	80.9 Å²	80.9	14%	0.141	38%	0.382	C	S	.	.	H	α-helix	trans	-61.5	-47.4	173.3	175.7	-96.4	0	0	0	112	S783 K784 R785 K790 F791	S783-Y787 PolarHBondContact O-N 2.86Å; K784-Y787 PolarHBondContact O-N 3.39Å; R785-Y787 VanDerWaalsContact C-N 3.32Å; R785-Y787 PolarHBondContact O-N 2.67Å; Y787-K790 PolarHBondContact O-N 3.33Å; Y787-F791 VanDerWaalsContact O-CB 3.29Å; Y787-F791 WeakPolarHBondContact O-CB 3.32Å; Y787-F791 PolarHBondContact O-N 3.39Å
788	R	92	Very high	90.2	Very high	130 Å²	130	75.2 Å²	75.2	49%	0.491	35%	0.354	S	S	.	.	H	α-helix	trans	-65.2	-43.4	177.7	-69.9	-172.3	-59.1	-111.1	-0.6	112.4	K784 R785 K790 F791 K792	K784-R788 WeakPolarHBondContact O-CG 3.45Å; K784-R788 PolarHBondContact O-N 2.94Å; R785-R788 PolarHBondContact O-N 2.94Å; R785-R788 VanDerWaalsContact O-N 3.1Å; R788-K790 PolarHBondContact O-N 3.18Å; R788-F791 PolarHBondContact O-N 3.23Å; R788-K792 WeakPolarHBondContact O-CB 3.24Å; R788-K792 PolarHBondContact O-N 2.85Å
789	E	93	Very high	90.8	Very high	76 Å²	76	73.3 Å²	73.3	36%	0.355	35%	0.353	S	S	.	.	H	α-helix	trans	-57.8	-47	175.2	-72.7	160.6	-177.3	0	0	110.8	R785 L786 K792 Q793	R785-E789 WeakPolarHBondContact CD-OE1 3.43Å; R785-E789 WeakPolarHBondContact CG-OE1 3.25Å; R785-E789 IonicContact CZ-OE1 3.97Å; R785-E789 IonicContact NE-OE1 3.71Å; R785-E789 PolarHBondContact NE-OE1 3.4Å; R785-E789 IonicContact NH2-OE1 3.76Å; R785-E789 WeakPolarHBondContact O-CB 3.43Å; R785-E789 VanDerWaalsContact O-CG 3.3Å; R785-E789 WeakPolarHBondContact O-CG 3.31Å; R785-E789 PolarHBondContact O-N 2.86Å; L786-E789 WeakPolarHBondContact CA-OE2 3.34Å; E789-K792 PolarHBondContact O-N 3.31Å; E789-Q793 WeakPolarHBondContact O-CG 3.47Å; E789-Q793 PolarHBondContact O-N 3.31Å
790	K	93.3	Very high	91.6	Very high	82 Å²	82	77 Å²	77	36%	0.357	36%	0.361	S	S	.	.	H	α-helix	trans	-68.2	-39.7	177	-160.9	75.1	-164.2	163.7	0	112.7	L786 Y787 R788 K792 Q793 V794 M823	L786-K790 WeakPolarHBondContact O-CB 3.38Å; L786-K790 PolarHBondContact O-N 3.26Å; Y787-K790 PolarHBondContact O-N 3.33Å; R788-K790 PolarHBondContact O-N 3.18Å; K790-K792 VanDerWaalsContact C-N 3.33Å; K790-K792 PolarHBondContact O-N 3.18Å; K790-Q793 WeakPolarHBondContact O-CB 3.37Å; K790-Q793 PolarHBondContact O-N 3.36Å; K790-V794 WeakPolarHBondContact O-CG2 3.44Å; K790-V794 PolarHBondContact O-N 2.89Å; K790-M823 HydrophobicContact CB-CE 4.4Å; K790-M823 HydrophobicContact CB-SD 3.46Å; K790-M823 WeakPolarHBondContact CB-SD 3.42Å; K790-M823 HydrophobicContact CD-CE 4.02Å; K790-M823 HydrophobicContact CD-SD 4.18Å; K790-M823 HydrophobicContact CG-CE 3.92Å; K790-M823 HydrophobicContact CG-SD 3.61Å
791	F	94.8	Very high	92.4	Very high	56 Å²	56	77.1 Å²	77.1	25%	0.246	36%	0.358	C	S	.	.	H	α-helix	trans	-67.2	-34.4	178.1	-165.4	-99.9	0	0	0	112.2	Y787 R788 V794 D795 A812 Y815	Y787-F791 VanDerWaalsContact O-CB 3.29Å; Y787-F791 WeakPolarHBondContact O-CB 3.32Å; Y787-F791 PolarHBondContact O-N 3.39Å; R788-F791 PolarHBondContact O-N 3.23Å; F791-V794 WeakPolarHBondContact O-CB 3.32Å; F791-V794 PolarHBondContact O-N 3.48Å; F791-V794 VanDerWaalsContact O-N 3.15Å; F791-D795 PolarHBondContact O-N 3.31Å; F791-A812 HydrophobicContact CE2-CB 4.41Å; F791-A812 HydrophobicContact CZ-CB 3.87Å; F791-Y815 HydrophobicContact CD2-CD1 4.46Å; F791-Y815 HydrophobicContact CD2-CG 4.19Å; F791-Y815 HydrophobicContact CE2-CG 4.31Å
792	K	95.3	Very high	93.2	Very high	114 Å²	114	81.4 Å²	81.4	50%	0.496	37%	0.373	S	S	.	.	H	α-helix	trans	-59.3	-49.1	170.2	-169.4	-161.9	-179.9	-149.5	0	111.1	R788 E789 K790 V794 D795 E796	R788-K792 WeakPolarHBondContact O-CB 3.24Å; R788-K792 PolarHBondContact O-N 2.85Å; E789-K792 PolarHBondContact O-N 3.31Å; K790-K792 VanDerWaalsContact C-N 3.33Å; K790-K792 PolarHBondContact O-N 3.18Å; K792-V794 PolarHBondContact O-N 3.28Å; K792-D795 PolarHBondContact O-N 3.36Å; K792-E796 WeakPolarHBondContact CE-OE1 3.37Å; K792-E796 IonicContact NZ-OE1 2.67Å; K792-E796 PolarHBondContact NZ-OE1 3.1Å; K792-E796 WeakPolarHBondContact O-CB 3.5Å; K792-E796 WeakPolarHBondContact O-CG 3.41Å; K792-E796 PolarHBondContact O-N 3.06Å
793	Q	96	Very high	93.8	Very high	101 Å²	101	79.9 Å²	79.9	47%	0.472	36%	0.36	S	S	.	.	H	α-helix	trans	-57.4	-34.8	173.9	-66.8	174.5	5.2	0	0	112.4	E789 K790 Y797	E789-Q793 WeakPolarHBondContact O-CG 3.47Å; E789-Q793 PolarHBondContact O-N 3.31Å; K790-Q793 WeakPolarHBondContact O-CB 3.37Å; K790-Q793 PolarHBondContact O-N 3.36Å; Q793-Y797 WeakPolarHBondContact O-CB 3.43Å; Q793-Y797 PolarHBondContact O-N 3.49Å
794	V	95.7	Very high	94.3	Very high	17 Å²	17	82.4 Å²	82.4	10%	0.103	38%	0.375	C	S	.	.	H	α-helix	trans	-69.6	-46.3	176.6	173.5	0	0	0	0	111.4	K790 F791 K792 Y797 M798 I811 Y815	K790-V794 WeakPolarHBondContact O-CG2 3.44Å; K790-V794 PolarHBondContact O-N 2.89Å; F791-V794 WeakPolarHBondContact O-CB 3.32Å; F791-V794 PolarHBondContact O-N 3.48Å; F791-V794 VanDerWaalsContact O-N 3.15Å; K792-V794 PolarHBondContact O-N 3.28Å; V794-Y797 WeakPolarHBondContact O-CB 3.48Å; V794-Y797 PolarHBondContact O-N 2.9Å; V794-M798 HydrophobicContact CG1-CE 4.29Å; V794-M798 HydrophobicContact CG1-CG 4.47Å; V794-M798 VanDerWaalsContact O-CG 3.27Å; V794-M798 WeakPolarHBondContact O-CG 3.23Å; V794-M798 PolarHBondContact O-N 3.24Å; V794-I811 HydrophobicContact CG1-CG2 3.81Å; V794-Y815 HydrophobicContact CG1-CD2 4.48Å; V794-Y815 HydrophobicContact CG1-CE2 4.02Å; V794-Y815 HydrophobicContact CG2-CE1 4.12Å; V794-Y815 HydrophobicContact CG2-CE2 4.11Å
795	D	94.7	Very high	94.6	Very high	70 Å²	70	89.6 Å²	89.6	37%	0.374	40%	0.4	S	S	.	.	H	α-helix	trans	-70.4	-33.9	176.2	-171.6	50.5	0	0	0	113	F791 K792 Y797 M798 A799 R808	F791-D795 PolarHBondContact O-N 3.31Å; K792-D795 PolarHBondContact O-N 3.36Å; D795-Y797 VanDerWaalsContact C-N 3.28Å; D795-Y797 PolarHBondContact O-N 2.72Å; D795-M798 HydrophobicContact CB-CE 3.92Å; D795-M798 CarbonylContact O-C 3.49Å; D795-M798 PolarHBondContact O-N 2.92Å; D795-M798 VanDerWaalsContact O-N 3.11Å; D795-M798 WeakPolarHBondContact OD1-CE 3.2Å; D795-A799 VanDerWaalsContact O-CB 3.29Å; D795-A799 WeakPolarHBondContact O-CB 3.06Å; D795-A799 PolarHBondContact O-N 2.89Å; D795-R808 IonicContact OD1-NH1 2.67Å; D795-R808 PolarHBondContact OD1-NH1 3.39Å
796	E	95.7	Very high	94.9	Very high	99 Å²	99	88.3 Å²	88.3	46%	0.463	41%	0.412	S	S	.	.	H	α-helix	trans	-56.6	-43.1	168.8	-74.4	171.7	-172.7	0	0	111	K792 A799 Y800	K792-E796 WeakPolarHBondContact CE-OE1 3.37Å; K792-E796 IonicContact NZ-OE1 2.67Å; K792-E796 PolarHBondContact NZ-OE1 3.1Å; K792-E796 WeakPolarHBondContact O-CB 3.5Å; K792-E796 WeakPolarHBondContact O-CG 3.41Å; K792-E796 PolarHBondContact O-N 3.06Å; E796-A799 PolarHBondContact O-N 2.83Å; E796-Y800 WeakPolarHBondContact O-CB 3.32Å; E796-Y800 PolarHBondContact O-N 2.96Å
797	Y	96.6	Very high	95.2	Very high	132 Å²	132	88.5 Å²	88.5	52%	0.518	41%	0.413	S	S	.	.	H	α-helix	trans	-64.8	-43.2	172.1	175.3	-96	0	0	0	112.8	Q793 V794 D795 A799 Y800 R801	Q793-Y797 WeakPolarHBondContact O-CB 3.43Å; Q793-Y797 PolarHBondContact O-N 3.49Å; V794-Y797 WeakPolarHBondContact O-CB 3.48Å; V794-Y797 PolarHBondContact O-N 2.9Å; D795-Y797 VanDerWaalsContact C-N 3.28Å; D795-Y797 PolarHBondContact O-N 2.72Å; Y797-A799 VanDerWaalsContact C-N 3.29Å; Y797-A799 PolarHBondContact O-N 3.07Å; Y797-Y800 PolarHBondContact O-N 3.26Å; Y797-R801 HydrophobicContact CD2-CG 4.17Å; Y797-R801 HydrophobicContact CE1-CG 4.14Å; Y797-R801 HydrophobicContact CE2-CG 3.72Å; Y797-R801 WeakPolarHBondContact O-CB 3.13Å; Y797-R801 WeakPolarHBondContact O-CG 3.34Å; Y797-R801 PolarHBondContact O-N 3.47Å
798	M	96.6	Very high	95.3	Very high	5 Å²	5	90 Å²	90	3%	0.025	42%	0.418	C	S	.	.	H	α-helix	trans	-64	-33.5	176.3	-65.5	-165.5	-71.6	0	0	112.4	V794 D795 K802 L803 R808 I811	V794-M798 HydrophobicContact CG1-CE 4.29Å; V794-M798 HydrophobicContact CG1-CG 4.47Å; V794-M798 VanDerWaalsContact O-CG 3.27Å; V794-M798 WeakPolarHBondContact O-CG 3.23Å; V794-M798 PolarHBondContact O-N 3.24Å; D795-M798 HydrophobicContact CB-CE 3.92Å; D795-M798 CarbonylContact O-C 3.49Å; D795-M798 PolarHBondContact O-N 2.92Å; D795-M798 VanDerWaalsContact O-N 3.11Å; D795-M798 WeakPolarHBondContact OD1-CE 3.2Å; M798-K802 PolarHBondContact O-N 3.49Å; M798-K802 VanDerWaalsContact O-N 3.14Å; M798-L803 HydrophobicContact CB-CB 4.47Å; M798-L803 HydrophobicContact CB-CD1 4.26Å; M798-L803 HydrophobicContact CB-CG 4.44Å; M798-L803 HydrophobicContact CG-CD1 3.93Å; M798-L803 PolarHBondContact O-N 3.42Å; M798-R808 HydrophobicContact CB-CG 4.13Å; M798-R808 HydrophobicContact CE-CB 4.2Å; M798-R808 HydrophobicContact CE-CG 4.39Å; M798-R808 HydrophobicContact CG-CG 4.47Å; M798-R808 PolarHBondContact O-NH2 3.13Å; M798-R808 HydrophobicContact SD-CB 3.79Å; M798-R808 HydrophobicContact SD-CG 3.71Å; M798-I811 HydrophobicContact CE-CG2 4.37Å; M798-I811 HydrophobicContact CG-CD1 4.22Å; M798-I811 HydrophobicContact SD-CB 3.8Å; M798-I811 HydrophobicContact SD-CD1 3.63Å; M798-I811 HydrophobicContact SD-CG1 4.31Å; M798-I811 HydrophobicContact SD-CG2 3.75Å
799	A	95	Very high	95.5	Very high	47 Å²	47	91.4 Å²	91.4	39%	0.388	43%	0.428	S	S	.	.	H	α-helix	trans	-71.8	-49.5	174.7	0	0	0	0	0	111.6	D795 E796 Y797 R801 K802	D795-A799 VanDerWaalsContact O-CB 3.29Å; D795-A799 WeakPolarHBondContact O-CB 3.06Å; D795-A799 PolarHBondContact O-N 2.89Å; E796-A799 PolarHBondContact O-N 2.83Å; Y797-A799 VanDerWaalsContact C-N 3.29Å; Y797-A799 PolarHBondContact O-N 3.07Å; A799-R801 PolarHBondContact O-N 3.32Å; A799-K802 WeakPolarHBondContact O-CA 3.33Å; A799-K802 PolarHBondContact O-N 2.81Å
800	Y	96.3	Very high	95.7	Very high	118 Å²	118	93 Å²	93	46%	0.463	43%	0.431	S	S	.	.	H	α-helix	trans	-58	-45.7	176.7	175.9	-104.2	0	0	0	112.3	E796 Y797 K802	E796-Y800 WeakPolarHBondContact O-CB 3.32Å; E796-Y800 PolarHBondContact O-N 2.96Å; Y797-Y800 PolarHBondContact O-N 3.26Å; Y800-K802 PolarHBondContact O-N 3.14Å
801	R	97	Very high	95.8	Very high	111 Å²	111	91 Å²	91	42%	0.419	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.9	0.5	174.9	-63.5	-58	-166.8	-176.8	2	114.1	Y797 A799 L803	Y797-R801 HydrophobicContact CD2-CG 4.17Å; Y797-R801 HydrophobicContact CE1-CG 4.14Å; Y797-R801 HydrophobicContact CE2-CG 3.72Å; Y797-R801 WeakPolarHBondContact O-CB 3.13Å; Y797-R801 WeakPolarHBondContact O-CG 3.34Å; Y797-R801 PolarHBondContact O-N 3.47Å; A799-R801 PolarHBondContact O-N 3.32Å; R801-L803 VanDerWaalsContact C-N 3.27Å; R801-L803 HydrophobicContact CB-CD2 3.82Å; R801-L803 HydrophobicContact CB-CG 4.09Å; R801-L803 PolarHBondContact O-N 2.91Å
802	K	95.7	Very high	95.8	Very high	177 Å²	177	89.8 Å²	89.8	77%	0.77	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.6	39.3	179.6	-58.3	-175.2	178.3	-175.9	0	114.1	M798 A799 Y800	M798-K802 PolarHBondContact O-N 3.49Å; M798-K802 VanDerWaalsContact O-N 3.14Å; A799-K802 WeakPolarHBondContact O-CA 3.33Å; A799-K802 PolarHBondContact O-N 2.81Å; Y800-K802 PolarHBondContact O-N 3.14Å
803	L	96.5	Very high	95.8	Very high	37 Å²	37	85.8 Å²	85.8	19%	0.194	41%	0.41	C	S	.	.			trans	-63	141.2	-174.2	-59.5	-169.5	0	0	0	112.1	M798 R801 L807 R808 I811	M798-L803 HydrophobicContact CB-CB 4.47Å; M798-L803 HydrophobicContact CB-CD1 4.26Å; M798-L803 HydrophobicContact CB-CG 4.44Å; M798-L803 HydrophobicContact CG-CD1 3.93Å; M798-L803 PolarHBondContact O-N 3.42Å; R801-L803 VanDerWaalsContact C-N 3.27Å; R801-L803 HydrophobicContact CB-CD2 3.82Å; R801-L803 HydrophobicContact CB-CG 4.09Å; R801-L803 PolarHBondContact O-N 2.91Å; L803-L807 HydrophobicContact CB-CD2 4.34Å; L803-L807 HydrophobicContact CD1-CD2 4.06Å; L803-L807 HydrophobicContact CD1-CG 4.46Å; L803-L807 HydrophobicContact CD2-CD2 4.33Å; L803-L807 HydrophobicContact CG-CD2 4.48Å; L803-R808 HydrophobicContact CB-CG 4.19Å; L803-R808 PolarHBondContact O-NE 2.72Å; L803-I811 HydrophobicContact CD1-CD1 3.85Å
804	P	97.1	Very high	95.8	Very high	88 Å²	88	84.8 Å²	84.8	57%	0.571	40%	0.402	S	S	*	.			trans	-58.3	146.2	178.9	-25.3	34.3	0	0	0	113.2	G806 L807 R808	P804-G806 VanDerWaalsContact C-N 3.27Å; P804-G806 PolarHBondContact O-N 2.9Å; P804-G806 VanDerWaalsContact O-N 3.16Å; P804-L807 PolarHBondContact O-N 3.26Å; P804-R808 PolarHBondContact O-N 2.68Å
805	R	94.6	Very high	95.7	Very high	233 Å²	233	86.7 Å²	86.7	88%	0.879	41%	0.408	S	S	*	.	H	α-helix	trans	-52.2	-40.7	-177.6	-71.7	-176.5	175.2	177.8	-2.2	113.6	R808 K809	R805-R808 PolarHBondContact O-N 3.2Å; R805-K809 PolarHBondContact O-N 3.27Å
806	G	95.2	Very high	95.6	Very high	53 Å²	53	89 Å²	89	55%	0.546	42%	0.417	S	S	.	.	H	α-helix	trans	-62.4	-41.8	176.6	0	0	0	0	0	113.3	P804 K809 R810	P804-G806 VanDerWaalsContact C-N 3.27Å; P804-G806 PolarHBondContact O-N 2.9Å; P804-G806 VanDerWaalsContact O-N 3.16Å; G806-K809 PolarHBondContact O-N 3.15Å; G806-R810 PolarHBondContact O-N 3.22Å
807	L	95.6	Very high	95.5	Very high	77 Å²	77	86.4 Å²	86.4	40%	0.403	41%	0.405	S	S	.	.	H	α-helix	trans	-68.1	-37.8	175.5	-178.1	57.9	0	0	0	111.4	L803 P804 R810 I811	L803-L807 HydrophobicContact CB-CD2 4.34Å; L803-L807 HydrophobicContact CD1-CD2 4.06Å; L803-L807 HydrophobicContact CD1-CG 4.46Å; L803-L807 HydrophobicContact CD2-CD2 4.33Å; L803-L807 HydrophobicContact CG-CD2 4.48Å; P804-L807 PolarHBondContact O-N 3.26Å; L807-R810 WeakPolarHBondContact O-CB 3.36Å; L807-R810 PolarHBondContact O-N 3.06Å; L807-I811 HydrophobicContact CD1-CD1 4.23Å; L807-I811 HydrophobicContact CD1-CG1 4.39Å; L807-I811 HydrophobicContact CG-CD1 3.99Å; L807-I811 WeakPolarHBondContact O-CG1 3.4Å; L807-I811 PolarHBondContact O-N 2.89Å
808	R	95.6	Very high	95.3	Very high	68 Å²	68	82.4 Å²	82.4	26%	0.257	39%	0.389	S	S	.	.	H	α-helix	trans	-62.7	-45	174.1	-58.6	-157.8	-163.9	-166.5	10.2	112.6	D795 M798 L803 P804 R805 R810 I811 A812	D795-R808 IonicContact OD1-NH1 2.67Å; D795-R808 PolarHBondContact OD1-NH1 3.39Å; M798-R808 HydrophobicContact CB-CG 4.13Å; M798-R808 HydrophobicContact CE-CB 4.2Å; M798-R808 HydrophobicContact CE-CG 4.39Å; M798-R808 HydrophobicContact CG-CG 4.47Å; M798-R808 PolarHBondContact O-NH2 3.13Å; M798-R808 HydrophobicContact SD-CB 3.79Å; M798-R808 HydrophobicContact SD-CG 3.71Å; L803-R808 HydrophobicContact CB-CG 4.19Å; L803-R808 PolarHBondContact O-NE 2.72Å; P804-R808 PolarHBondContact O-N 2.68Å; R805-R808 PolarHBondContact O-N 3.2Å; R808-R810 VanDerWaalsContact C-N 3.3Å; R808-R810 PolarHBondContact O-N 3.3Å; R808-I811 PolarHBondContact O-N 2.73Å; R808-A812 WeakPolarHBondContact O-CB 3.29Å; R808-A812 PolarHBondContact O-N 2.96Å
809	K	95.4	Very high	95.1	Very high	158 Å²	158	85.4 Å²	85.4	69%	0.687	40%	0.4	S	S	*	.	H	α-helix	trans	-59.9	-42.4	175.7	-172.3	176.2	-179.2	179.9	0	111.1	R805 G806 A812 S813	R805-K809 PolarHBondContact O-N 3.27Å; G806-K809 PolarHBondContact O-N 3.15Å; K809-A812 PolarHBondContact O-N 3.31Å; K809-S813 PolarHBondContact O-N 2.85Å; K809-S813 PolarHBondContact O-OG 3.17Å
810	R	96.1	Very high	94.9	Very high	110 Å²	110	87.7 Å²	87.7	42%	0.415	40%	0.403	S	S	.	.	H	α-helix	trans	-58.9	-48.3	173.9	-79.9	-163.7	58.8	-179.7	-9.4	112.6	G806 L807 R808 A812 S813 Y814 Q877 D880	G806-R810 PolarHBondContact O-N 3.22Å; L807-R810 WeakPolarHBondContact O-CB 3.36Å; L807-R810 PolarHBondContact O-N 3.06Å; R808-R810 VanDerWaalsContact C-N 3.3Å; R808-R810 PolarHBondContact O-N 3.3Å; R810-A812 VanDerWaalsContact C-N 3.35Å; R810-A812 PolarHBondContact O-N 3.27Å; R810-S813 PolarHBondContact O-N 2.85Å; R810-Y814 WeakPolarHBondContact O-CB 3.32Å; R810-Y814 PolarHBondContact O-N 3.14Å; R810-Q877 PolarHBondContact O-NE2 3.27Å; R810-Q877 PolarHBondContact O-OE1 3.2Å; R810-D880 IonicContact CZ-OD1 2.98Å; R810-D880 IonicContact NH1-OD1 2.69Å; R810-D880 PolarHBondContact NH1-OD1 2.94Å; R810-D880 IonicContact NH2-OD1 3.04Å; R810-D880 PolarHBondContact NH2-OD1 3.44Å; R810-D880 IonicContact NH2-OD2 3.35Å; R810-D880 PolarHBondContact NH2-OD2 2.71Å
811	I	96.2	Very high	94.4	Very high	40 Å²	40	83.4 Å²	83.4	21%	0.205	40%	0.395	C	S	.	.	H	α-helix	trans	-61.2	-43.2	177.4	-68.7	164.5	0	0	0	110.8	V794 M798 L803 L807 R808 Y814 Y815	V794-I811 HydrophobicContact CG1-CG2 3.81Å; M798-I811 HydrophobicContact CE-CG2 4.37Å; M798-I811 HydrophobicContact CG-CD1 4.22Å; M798-I811 HydrophobicContact SD-CB 3.8Å; M798-I811 HydrophobicContact SD-CD1 3.63Å; M798-I811 HydrophobicContact SD-CG1 4.31Å; M798-I811 HydrophobicContact SD-CG2 3.75Å; L803-I811 HydrophobicContact CD1-CD1 3.85Å; L807-I811 HydrophobicContact CD1-CD1 4.23Å; L807-I811 HydrophobicContact CD1-CG1 4.39Å; L807-I811 HydrophobicContact CG-CD1 3.99Å; L807-I811 WeakPolarHBondContact O-CG1 3.4Å; L807-I811 PolarHBondContact O-N 2.89Å; R808-I811 PolarHBondContact O-N 2.73Å; I811-Y814 WeakPolarHBondContact O-CB 3.39Å; I811-Y814 PolarHBondContact O-N 3.27Å; I811-Y815 HydrophobicContact CG2-CD2 3.93Å; I811-Y815 HydrophobicContact CG2-CE2 4.05Å; I811-Y815 WeakPolarHBondContact O-CD2 3.49Å; I811-Y815 PolarHBondContact O-N 3.29Å
812	A	94.5	Very high	94	Very high	30 Å²	30	83 Å²	83	25%	0.248	40%	0.396	C	S	.	.	H	α-helix	trans	-57.5	-54.8	177.1	0	0	0	0	0	112.1	F791 R808 K809 R810 Y814 Y815 E816	F791-A812 HydrophobicContact CE2-CB 4.41Å; F791-A812 HydrophobicContact CZ-CB 3.87Å; R808-A812 WeakPolarHBondContact O-CB 3.29Å; R808-A812 PolarHBondContact O-N 2.96Å; K809-A812 PolarHBondContact O-N 3.31Å; R810-A812 VanDerWaalsContact C-N 3.35Å; R810-A812 PolarHBondContact O-N 3.27Å; A812-Y814 VanDerWaalsContact C-N 3.27Å; A812-Y814 PolarHBondContact O-N 3.03Å; A812-Y815 PolarHBondContact O-N 2.8Å; A812-E816 WeakPolarHBondContact O-CB 3.45Å; A812-E816 PolarHBondContact O-N 2.82Å
813	S	95.1	Very high	93.6	Very high	30 Å²	30	76.7 Å²	76.7	21%	0.21	37%	0.37	C	S	.	.	H	α-helix	trans	-66	-26	178.9	-58.2	0	0	0	0	113.5	K809 R810 H817	K809-S813 PolarHBondContact O-N 2.85Å; K809-S813 PolarHBondContact O-OG 3.17Å; R810-S813 PolarHBondContact O-N 2.85Å; S813-H817 WeakPolarHBondContact O-CB 3.45Å; S813-H817 PolarHBondContact O-N 3.42Å
814	Y	95.9	Very high	93.2	Very high	80 Å²	80	80.6 Å²	80.6	31%	0.314	39%	0.385	S	S	.	.	H	α-helix	trans	-66.6	-49.4	171	171.6	-92.1	0	0	0	111.6	R810 I811 A812 E816 H817 R818 V875 Q877	R810-Y814 WeakPolarHBondContact O-CB 3.32Å; R810-Y814 PolarHBondContact O-N 3.14Å; I811-Y814 WeakPolarHBondContact O-CB 3.39Å; I811-Y814 PolarHBondContact O-N 3.27Å; A812-Y814 VanDerWaalsContact C-N 3.27Å; A812-Y814 PolarHBondContact O-N 3.03Å; Y814-E816 VanDerWaalsContact C-N 3.33Å; Y814-E816 PolarHBondContact O-N 3.42Å; Y814-H817 PolarHBondContact O-N 3.13Å; Y814-R818 HydrophobicContact CE1-CB 4.41Å; Y814-R818 VanDerWaalsContact O-CB 3.28Å; Y814-R818 WeakPolarHBondContact O-CB 3.15Å; Y814-R818 PolarHBondContact O-N 3.31Å; Y814-V875 HydrophobicContact CE2-CB 4.37Å; Y814-V875 WeakPolarHBondContact CE2-O 3.45Å; Y814-Q877 HydrophobicContact CD2-CG 4.43Å
815	Y	94.1	Very high	92.8	Very high	57 Å²	57	80.1 Å²	80.1	22%	0.224	38%	0.378	C	S	.	.	H	α-helix	trans	-62.5	-41.5	177.9	-92.5	-93.3	0	0	0	111.7	F791 V794 I811 A812 Y819	F791-Y815 HydrophobicContact CD2-CD1 4.46Å; F791-Y815 HydrophobicContact CD2-CG 4.19Å; F791-Y815 HydrophobicContact CE2-CG 4.31Å; V794-Y815 HydrophobicContact CG1-CD2 4.48Å; V794-Y815 HydrophobicContact CG1-CE2 4.02Å; V794-Y815 HydrophobicContact CG2-CE1 4.12Å; V794-Y815 HydrophobicContact CG2-CE2 4.11Å; I811-Y815 HydrophobicContact CG2-CD2 3.93Å; I811-Y815 HydrophobicContact CG2-CE2 4.05Å; I811-Y815 WeakPolarHBondContact O-CD2 3.49Å; I811-Y815 PolarHBondContact O-N 3.29Å; A812-Y815 PolarHBondContact O-N 2.8Å; Y815-Y819 AromaticContact CD1-CD2 3.72Å; Y815-Y819 HydrophobicContact CD1-CD2 3.72Å; Y815-Y819 AromaticContact CD1-CE2 3.77Å; Y815-Y819 HydrophobicContact CD1-CE2 3.77Å; Y815-Y819 HydrophobicContact CE1-CD2 4.27Å; Y815-Y819 AromaticContact CE1-CE2 3.86Å; Y815-Y819 HydrophobicContact CE1-CE2 3.86Å; Y815-Y819 HydrophobicContact CG-CD2 4.45Å; Y815-Y819 WeakPolarHBondContact O-CB 3.41Å; Y815-Y819 PolarHBondContact O-N 2.99Å
816	E	93.3	Very high	92.4	Very high	120 Å²	120	73.1 Å²	73.1	56%	0.561	36%	0.355	S	S	*	.	H	α-helix	trans	-59.2	-48.4	175.1	-175.5	176.7	-159.1	0	0	111.9	A812 Y814 Q820	A812-E816 WeakPolarHBondContact O-CB 3.45Å; A812-E816 PolarHBondContact O-N 2.82Å; Y814-E816 VanDerWaalsContact C-N 3.33Å; Y814-E816 PolarHBondContact O-N 3.42Å; E816-Q820 VanDerWaalsContact O-CA 3.24Å; E816-Q820 WeakPolarHBondContact O-CA 3.44Å; E816-Q820 PolarHBondContact O-N 3.17Å
817	H	92.6	Very high	92	Very high	44 Å²	44	75.8 Å²	75.8	20%	0.204	36%	0.357	C	S	.	.	H	α-helix	trans	-68.8	-43.4	179.3	-157	108.2	0	0	0	112.5	S813 Y814 Y939	S813-H817 WeakPolarHBondContact O-CB 3.45Å; S813-H817 PolarHBondContact O-N 3.42Å; Y814-H817 PolarHBondContact O-N 3.13Å; H817-Y939 HydrophobicContact CB-CD1 4.18Å; H817-Y939 HydrophobicContact CB-CE1 4.06Å; H817-Y939 AromaticContact CE1-CD1 3.96Å; H817-Y939 AromaticContact CE1-CG 3.66Å; H817-Y939 AromaticContact CG-CD1 3.72Å; H817-Y939 AromaticContact ND1-CD1 3.5Å; H817-Y939 WeakPolarHBondContact ND1-CD1 3.49Å; H817-Y939 AromaticContact ND1-CE1 3.9Å; H817-Y939 AromaticContact ND1-CG 3.55Å
818	R	93.1	Very high	91.8	Very high	47 Å²	47	77.1 Å²	77.1	18%	0.177	36%	0.361	C	S	.	.	H	α-helix	trans	-71.3	-30.2	-176.2	177.2	59.1	-172.3	88.8	-9.4	113.9	Y814 E826	Y814-R818 HydrophobicContact CE1-CB 4.41Å; Y814-R818 VanDerWaalsContact O-CB 3.28Å; Y814-R818 WeakPolarHBondContact O-CB 3.15Å; Y814-R818 PolarHBondContact O-N 3.31Å; R818-E826 IonicContact NH2-OE2 3.96Å
819	Y	91.5	Very high	91.6	Very high	68 Å²	68	77.7 Å²	77.7	27%	0.267	37%	0.368	S	S	.	.	H	α-helix	trans	-122.5	-14.1	-172.9	-63.9	-74.2	0	0	0	114.7	Y815 G821 K822	Y815-Y819 AromaticContact CD1-CD2 3.72Å; Y815-Y819 HydrophobicContact CD1-CD2 3.72Å; Y815-Y819 AromaticContact CD1-CE2 3.77Å; Y815-Y819 HydrophobicContact CD1-CE2 3.77Å; Y815-Y819 HydrophobicContact CE1-CD2 4.27Å; Y815-Y819 AromaticContact CE1-CE2 3.86Å; Y815-Y819 HydrophobicContact CE1-CE2 3.86Å; Y815-Y819 HydrophobicContact CG-CD2 4.45Å; Y815-Y819 WeakPolarHBondContact O-CB 3.41Å; Y815-Y819 PolarHBondContact O-N 2.99Å; Y819-G821 PolarHBondContact O-N 3.21Å; Y819-G821 VanDerWaalsContact O-N 3.13Å; Y819-K822 PolarHBondContact O-N 2.67Å
820	Q	90.8	Very high	91.3	Very high	96 Å²	96	71.5 Å²	71.5	45%	0.449	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.2	37.1	170.4	-49.9	175.3	29.3	0	0	113.4	E816 K822	E816-Q820 VanDerWaalsContact O-CA 3.24Å; E816-Q820 WeakPolarHBondContact O-CA 3.44Å; E816-Q820 PolarHBondContact O-N 3.17Å; Q820-K822 VanDerWaalsContact C-N 3.31Å; Q820-K822 PolarHBondContact O-N 2.73Å
821	G	86.3	Confident	91	Very high	28 Å²	28	71.8 Å²	71.8	29%	0.289	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.3	9.7	-179.2	0	0	0	0	0	115.9	Y819	Y819-G821 PolarHBondContact O-N 3.21Å; Y819-G821 VanDerWaalsContact O-N 3.13Å
822	K	88.9	Confident	90.8	Very high	102 Å²	102	77.4 Å²	77.4	44%	0.443	38%	0.378	S	S	.	.			trans	-133.7	130.6	179.9	-64	173.3	-175.5	170.9	0	110.9	Y819 Q820 F824	Y819-K822 PolarHBondContact O-N 2.67Å; Q820-K822 VanDerWaalsContact C-N 3.31Å; Q820-K822 PolarHBondContact O-N 2.73Å; K822-F824 HydrophobicContact CB-CD2 4.43Å; K822-F824 HydrophobicContact CB-CE2 3.61Å; K822-F824 HydrophobicContact CB-CZ 3.96Å; K822-F824 HydrophobicContact CD-CE2 4.28Å; K822-F824 HydrophobicContact CD-CZ 4.21Å
823	M	87.1	Confident	90.6	Very high	45 Å²	45	78.8 Å²	78.8	22%	0.222	38%	0.381	C	S	.	.			trans	-106.8	137	176.6	-172.4	166.1	178.2	0	0	111.5	S783 L786 K790	S783-M823 PolarHBondContact O-N 3.36Å; L786-M823 HydrophobicContact CB-CB 4.38Å; L786-M823 HydrophobicContact CD2-CB 4.11Å; L786-M823 HydrophobicContact CD2-CG 4.04Å; L786-M823 HydrophobicContact CG-CB 4.02Å; L786-M823 HydrophobicContact CG-CG 4.1Å; L786-M823 HydrophobicContact CG-SD 4.09Å; K790-M823 HydrophobicContact CB-CE 4.4Å; K790-M823 HydrophobicContact CB-SD 3.46Å; K790-M823 WeakPolarHBondContact CB-SD 3.42Å; K790-M823 HydrophobicContact CD-CE 4.02Å; K790-M823 HydrophobicContact CD-SD 4.18Å; K790-M823 HydrophobicContact CG-CE 3.92Å; K790-M823 HydrophobicContact CG-SD 3.61Å
824	F	88.3	Confident	90.4	Very high	118 Å²	118	80.7 Å²	80.7	52%	0.518	39%	0.394	S	S	.	.			trans	-144	148.1	177.1	-54.1	-74.7	0	0	0	109	K822 E826 I829	K822-F824 HydrophobicContact CB-CD2 4.43Å; K822-F824 HydrophobicContact CB-CE2 3.61Å; K822-F824 HydrophobicContact CB-CZ 3.96Å; K822-F824 HydrophobicContact CD-CE2 4.28Å; K822-F824 HydrophobicContact CD-CZ 4.21Å; F824-E826 PolarHBondContact O-N 3.11Å; F824-I829 HydrophobicContact CB-CD1 4.09Å
825	N	88.1	Confident	90	Very high	79 Å²	79	82.5 Å²	82.5	42%	0.422	41%	0.405	S	S	.	.			trans	-94.3	88.3	168.5	-170.4	3.1	0	0	0	109.7	N827 E828 I829	N825-N827 VanDerWaalsContact C-N 3.28Å; N825-N827 PolarHBondContact O-N 2.85Å; N825-E828 HydrophobicContact CB-CB 3.94Å; N825-E828 VanDerWaalsContact CB-OE2 3.26Å; N825-E828 WeakPolarHBondContact CB-OE2 3.28Å; N825-E828 WeakPolarHBondContact ND2-CB 3.46Å; N825-E828 PolarHBondContact ND2-OE2 3.44Å; N825-E828 PolarHBondContact O-N 2.91Å; N825-E828 VanDerWaalsContact O-N 3.17Å; N825-I829 WeakPolarHBondContact O-CG1 3.42Å; N825-I829 PolarHBondContact O-N 2.88Å; N825-I829 VanDerWaalsContact O-N 3.12Å
826	E	86.9	Confident	89.7	Confident	85 Å²	85	83.1 Å²	83.1	40%	0.397	42%	0.417	S	S	.	.	H	α-helix	trans	-57.4	-37.8	-172.7	-171.5	167.8	-165.7	0	0	113	R818 F824 L830	R818-E826 IonicContact NH2-OE2 3.96Å; F824-E826 PolarHBondContact O-N 3.11Å; E826-L830 HydrophobicContact CG-CD1 4.09Å; E826-L830 WeakPolarHBondContact O-CB 3.48Å; E826-L830 VanDerWaalsContact O-CG 3.22Å; E826-L830 WeakPolarHBondContact O-CG 3.21Å; E826-L830 PolarHBondContact O-N 3.03Å
827	N	86.7	Confident	89.5	Confident	110 Å²	110	81.3 Å²	81.3	59%	0.588	41%	0.411	S	S	*	.	H	α-helix	trans	-69.6	-36.4	179.1	-57.7	-66.7	0	0	0	112.9	N825 N831	N825-N827 VanDerWaalsContact C-N 3.28Å; N825-N827 PolarHBondContact O-N 2.85Å; N827-N831 WeakPolarHBondContact O-CB 3.36Å; N827-N831 PolarHBondContact O-N 3.13Å; N827-N831 VanDerWaalsContact O-N 3.14Å; N827-N831 PolarHBondContact O-ND2 3.07Å; N827-N831 VanDerWaalsContact O-ND2 3.08Å
828	E	90.3	Very high	89.3	Confident	105 Å²	105	80.8 Å²	80.8	49%	0.491	41%	0.408	S	S	.	.	H	α-helix	trans	-69.8	-50.5	179.8	179.2	170.4	-139.2	0	0	110	N825 L830 N831 E832	N825-E828 HydrophobicContact CB-CB 3.94Å; N825-E828 VanDerWaalsContact CB-OE2 3.26Å; N825-E828 WeakPolarHBondContact CB-OE2 3.28Å; N825-E828 WeakPolarHBondContact ND2-CB 3.46Å; N825-E828 PolarHBondContact ND2-OE2 3.44Å; N825-E828 PolarHBondContact O-N 2.91Å; N825-E828 VanDerWaalsContact O-N 3.17Å; E828-L830 VanDerWaalsContact C-N 3.31Å; E828-L830 PolarHBondContact O-N 2.98Å; E828-N831 PolarHBondContact O-N 3.38Å; E828-E832 PolarHBondContact O-N 3.43Å
829	I	91.5	Very high	88.9	Confident	79 Å²	79	82.3 Å²	82.3	41%	0.405	42%	0.417	S	S	.	.	H	α-helix	trans	-57.8	-42.1	175.8	-62.8	165.8	0	0	0	111.4	F824 N825 N831 L833	F824-I829 HydrophobicContact CB-CD1 4.09Å; N825-I829 WeakPolarHBondContact O-CG1 3.42Å; N825-I829 PolarHBondContact O-N 2.88Å; N825-I829 VanDerWaalsContact O-N 3.12Å; I829-N831 VanDerWaalsContact C-N 3.3Å; I829-N831 PolarHBondContact O-N 2.77Å; I829-L833 WeakPolarHBondContact O-CG 3.18Å
830	L	89.3	Confident	88.7	Confident	29 Å²	29	85 Å²	85	15%	0.152	43%	0.433	C	S	.	.	H	α-helix	trans	-70.1	-24.4	177.7	-72.3	172.6	0	0	0	113.2	E826 E828 K838 I841	E826-L830 HydrophobicContact CG-CD1 4.09Å; E826-L830 WeakPolarHBondContact O-CB 3.48Å; E826-L830 VanDerWaalsContact O-CG 3.22Å; E826-L830 WeakPolarHBondContact O-CG 3.21Å; E826-L830 PolarHBondContact O-N 3.03Å; E828-L830 VanDerWaalsContact C-N 3.31Å; E828-L830 PolarHBondContact O-N 2.98Å; L830-K838 HydrophobicContact CD2-CG 4.43Å; L830-K838 WeakPolarHBondContact O-CD 3.36Å; L830-I841 HydrophobicContact CD2-CG2 4.14Å
831	N	89.9	Confident	88.6	Confident	115 Å²	115	83.6 Å²	83.6	62%	0.615	43%	0.427	S	S	*	.	H	α-helix	trans	-87.2	-19.8	178	-72.6	-22.3	0	0	0	113.7	N827 E828 I829 L833	N827-N831 WeakPolarHBondContact O-CB 3.36Å; N827-N831 PolarHBondContact O-N 3.13Å; N827-N831 VanDerWaalsContact O-N 3.14Å; N827-N831 PolarHBondContact O-ND2 3.07Å; N827-N831 VanDerWaalsContact O-ND2 3.08Å; E828-N831 PolarHBondContact O-N 3.38Å; I829-N831 VanDerWaalsContact C-N 3.3Å; I829-N831 PolarHBondContact O-N 2.77Å; N831-L833 VanDerWaalsContact C-N 3.29Å
832	E	91.5	Very high	88.7	Confident	159 Å²	159	83.6 Å²	83.6	74%	0.743	42%	0.42	S	S	*	.	H	α-helix	trans	-73.7	-21.9	168.3	-69.2	-175.8	160.4	0	0	112.7	E828	E828-E832 PolarHBondContact O-N 3.43Å
833	L	91.5	Very high	88.5	Confident	58 Å²	58	80.6 Å²	80.6	30%	0.304	41%	0.409	S	S	.	.	S	Bend	trans	-84.5	150	-179.9	-67.5	173	0	0	0	111.9	I829 N831 L837 I841	I829-L833 WeakPolarHBondContact O-CG 3.18Å; N831-L833 VanDerWaalsContact C-N 3.29Å; L833-L837 HydrophobicContact CB-CB 4.42Å; L833-L837 HydrophobicContact CD2-CD1 4.27Å; L833-I841 HydrophobicContact CD1-CD1 3.49Å; L833-I841 VanDerWaalsContact CD1-CD1 3.49Å
834	S	91.5	Very high	88.5	Confident	70 Å²	70	84.4 Å²	84.4	49%	0.49	42%	0.422	S	S	.	.			trans	-65.3	145.8	170.8	61.4	0	0	0	0	111.1	C836 L837 K838	S834-C836 PolarHBondContact O-N 2.92Å; S834-L837 WeakPolarHBondContact O-CA 3.49Å; S834-L837 PolarHBondContact O-N 3.37Å; S834-K838 PolarHBondContact O-N 2.93Å
835	E	87.1	Confident	88.5	Confident	118 Å²	118	82 Å²	82	55%	0.551	41%	0.414	S	S	*	.	H	α-helix	trans	-52.6	-35.2	-176.8	-67.7	-63.3	148.7	0	0	112.9	L837 K838 E839	E835-L837 PolarHBondContact O-N 2.81Å; E835-K838 VanDerWaalsContact CD-NZ 3.26Å; E835-K838 PolarHBondContact O-N 3.22Å; E835-K838 IonicContact OE1-NZ 3.99Å; E835-K838 PolarHBondContact OE1-NZ 3.09Å; E835-K838 VanDerWaalsContact OE2-CD 3.31Å; E835-K838 WeakPolarHBondContact OE2-CD 3.35Å; E835-K838 VanDerWaalsContact OE2-CE 3.32Å; E835-K838 WeakPolarHBondContact OE2-CE 3.44Å; E835-K838 IonicContact OE2-NZ 3.83Å; E835-K838 PolarHBondContact OE2-NZ 2.99Å; E835-E839 WeakPolarHBondContact O-CB 3.38Å; E835-E839 PolarHBondContact O-N 3.23Å
836	C	87.4	Confident	88.4	Confident	71 Å²	71	78.2 Å²	78.2	48%	0.48	39%	0.394	S	S	.	.	H	α-helix	trans	-65.5	-34.1	175.7	-55	0	0	0	0	113.8	S834 Q840	S834-C836 PolarHBondContact O-N 2.92Å; C836-Q840 WeakPolarHBondContact O-CB 3.3Å; C836-Q840 WeakPolarHBondContact O-CG 3.39Å; C836-Q840 PolarHBondContact O-N 3.17Å
837	L	90.1	Very high	88.3	Confident	81 Å²	81	81 Å²	81	42%	0.424	40%	0.401	S	S	.	.	H	α-helix	trans	-78	-39.9	175.6	-70.4	174.6	0	0	0	111	L833 S834 E835 Q840 I841	L833-L837 HydrophobicContact CB-CB 4.42Å; L833-L837 HydrophobicContact CD2-CD1 4.27Å; S834-L837 WeakPolarHBondContact O-CA 3.49Å; S834-L837 PolarHBondContact O-N 3.37Å; E835-L837 PolarHBondContact O-N 2.81Å; L837-Q840 PolarHBondContact O-N 3.17Å; L837-I841 VanDerWaalsContact O-CG1 3.31Å; L837-I841 WeakPolarHBondContact O-CG1 3.43Å; L837-I841 PolarHBondContact O-N 2.81Å
838	K	88.1	Confident	88.2	Confident	33 Å²	33	78.6 Å²	78.6	14%	0.143	40%	0.396	C	S	.	.	H	α-helix	trans	-58.7	-50.5	173.7	173.2	179.9	167.3	-173.2	0	111.4	L830 S834 E835 Q840 I841 I842	L830-K838 HydrophobicContact CD2-CG 4.43Å; L830-K838 WeakPolarHBondContact O-CD 3.36Å; S834-K838 PolarHBondContact O-N 2.93Å; E835-K838 VanDerWaalsContact CD-NZ 3.26Å; E835-K838 PolarHBondContact O-N 3.22Å; E835-K838 IonicContact OE1-NZ 3.99Å; E835-K838 PolarHBondContact OE1-NZ 3.09Å; E835-K838 VanDerWaalsContact OE2-CD 3.31Å; E835-K838 WeakPolarHBondContact OE2-CD 3.35Å; E835-K838 VanDerWaalsContact OE2-CE 3.32Å; E835-K838 WeakPolarHBondContact OE2-CE 3.44Å; E835-K838 IonicContact OE2-NZ 3.83Å; E835-K838 PolarHBondContact OE2-NZ 2.99Å; K838-Q840 VanDerWaalsContact C-N 3.34Å; K838-Q840 PolarHBondContact O-N 3.3Å; K838-I841 PolarHBondContact O-N 3.17Å; K838-I842 HydrophobicContact CG-CD1 3.9Å; K838-I842 VanDerWaalsContact O-CG1 3.25Å; K838-I842 WeakPolarHBondContact O-CG1 3.45Å; K838-I842 PolarHBondContact O-N 3.4Å
839	E	83.9	Confident	87.9	Confident	79 Å²	79	73.6 Å²	73.6	37%	0.369	37%	0.373	S	S	.	.	H	α-helix	trans	-57.5	-45.4	173.4	-179.1	178.9	-166.6	0	0	111.4	E835 I841 I842 N843 S865	E835-E839 WeakPolarHBondContact O-CB 3.38Å; E835-E839 PolarHBondContact O-N 3.23Å; E839-I841 VanDerWaalsContact C-N 3.34Å; E839-I841 PolarHBondContact O-N 3.17Å; E839-I842 PolarHBondContact O-N 2.99Å; E839-N843 VanDerWaalsContact CG-ND2 3.32Å; E839-N843 WeakPolarHBondContact CG-ND2 3.46Å; E839-N843 VanDerWaalsContact O-CB 3.27Å; E839-N843 WeakPolarHBondContact O-CB 3.42Å; E839-N843 PolarHBondContact O-N 3.49Å; E839-N843 PolarHBondContact O-ND2 3.04Å; E839-S865 WeakPolarHBondContact OE1-CB 3.14Å; E839-S865 PolarHBondContact OE1-OG 3.07Å
840	Q	86.8	Confident	87.5	Confident	126 Å²	126	71.2 Å²	71.2	59%	0.589	36%	0.362	S	S	*	.	H	α-helix	trans	-61.5	-38.9	178.3	-76.6	171.7	23.2	0	0	112.9	C836 L837 K838 Y844	C836-Q840 WeakPolarHBondContact O-CB 3.3Å; C836-Q840 WeakPolarHBondContact O-CG 3.39Å; C836-Q840 PolarHBondContact O-N 3.17Å; L837-Q840 PolarHBondContact O-N 3.17Å; K838-Q840 VanDerWaalsContact C-N 3.34Å; K838-Q840 PolarHBondContact O-N 3.3Å; Q840-Y844 VanDerWaalsContact O-CB 3.24Å; Q840-Y844 WeakPolarHBondContact O-CB 3.36Å; Q840-Y844 PolarHBondContact O-N 3.44Å
841	I	89.7	Confident	87.1	Confident	66 Å²	66	73.3 Å²	73.3	34%	0.338	38%	0.383	S	S	.	.	H	α-helix	trans	-68.6	-47.5	176.8	-70.5	164	0	0	0	110.9	L830 L833 L837 K838 E839 Y844 N845	L830-I841 HydrophobicContact CD2-CG2 4.14Å; L833-I841 HydrophobicContact CD1-CD1 3.49Å; L833-I841 VanDerWaalsContact CD1-CD1 3.49Å; L837-I841 VanDerWaalsContact O-CG1 3.31Å; L837-I841 WeakPolarHBondContact O-CG1 3.43Å; L837-I841 PolarHBondContact O-N 2.81Å; K838-I841 PolarHBondContact O-N 3.17Å; E839-I841 VanDerWaalsContact C-N 3.34Å; E839-I841 PolarHBondContact O-N 3.17Å; I841-Y844 PolarHBondContact O-N 3.44Å; I841-N845 VanDerWaalsContact O-CG 3.32Å; I841-N845 PolarHBondContact O-N 3.24Å
842	I	87.2	Confident	86.7	Confident	27 Å²	27	70.1 Å²	70.1	14%	0.138	37%	0.373	C	S	.	.	H	α-helix	trans	-66.9	-41.7	-177.9	-55.1	163.3	0	0	0	110.1	K838 E839 Y844 N845 C846 V868	K838-I842 HydrophobicContact CG-CD1 3.9Å; K838-I842 VanDerWaalsContact O-CG1 3.25Å; K838-I842 WeakPolarHBondContact O-CG1 3.45Å; K838-I842 PolarHBondContact O-N 3.4Å; E839-I842 PolarHBondContact O-N 2.99Å; I842-Y844 PolarHBondContact O-N 2.75Å; I842-N845 PolarHBondContact O-N 2.9Å; I842-C846 WeakPolarHBondContact O-CB 3.1Å; I842-C846 PolarHBondContact O-N 3.41Å; I842-C846 PolarHBondContact O-SG 2.93Å; I842-C846 VanDerWaalsContact O-SG 3.38Å; I842-V868 HydrophobicContact CB-CG1 4.38Å; I842-V868 HydrophobicContact CG2-CG1 3.59Å; I842-V868 WeakPolarHBondContact CG2-O 3.3Å
843	N	85.5	Confident	86.3	Confident	39 Å²	39	62.6 Å²	62.6	21%	0.209	34%	0.338	C	S	.	.	H	α-helix	trans	-62.6	-37.7	171.9	-84.5	-40.4	0	0	0	112.4	E839 R847 S865 V868	E839-N843 VanDerWaalsContact CG-ND2 3.32Å; E839-N843 WeakPolarHBondContact CG-ND2 3.46Å; E839-N843 VanDerWaalsContact O-CB 3.27Å; E839-N843 WeakPolarHBondContact O-CB 3.42Å; E839-N843 PolarHBondContact O-N 3.49Å; E839-N843 PolarHBondContact O-ND2 3.04Å; N843-R847 WeakPolarHBondContact O-CB 3.43Å; N843-R847 PolarHBondContact O-N 3.4Å; N843-S865 PolarHBondContact ND2-OG 2.96Å; N843-V868 WeakPolarHBondContact OD1-CG1 3.32Å
844	Y	88.2	Confident	85.5	Confident	126 Å²	126	62.7 Å²	62.7	49%	0.494	34%	0.342	S	S	.	.	H	α-helix	trans	-66	-40	174.7	-176.5	-86.9	0	0	0	112.7	Q840 I841 I842 R847	Q840-Y844 VanDerWaalsContact O-CB 3.24Å; Q840-Y844 WeakPolarHBondContact O-CB 3.36Å; Q840-Y844 PolarHBondContact O-N 3.44Å; I841-Y844 PolarHBondContact O-N 3.44Å; I842-Y844 PolarHBondContact O-N 2.75Å; Y844-R847 WeakPolarHBondContact O-CD 3.33Å; Y844-R847 WeakPolarHBondContact O-CG 3.35Å; Y844-R847 PolarHBondContact O-NE 3.39Å; Y844-R847 VanDerWaalsContact O-NE 3.17Å; Y844-R847 PolarHBondContact OH-NH2 2.84Å
845	N	87.2	Confident	84.5	Confident	67 Å²	67	60.3 Å²	60.3	36%	0.358	32%	0.323	S	S	.	.	H	α-helix	trans	-68.1	-41.7	177.1	-70.6	-8.9	0	0	0	111.2	I841 I842	I841-N845 VanDerWaalsContact O-CG 3.32Å; I841-N845 PolarHBondContact O-N 3.24Å; I842-N845 PolarHBondContact O-N 2.9Å
846	C	86	Confident	84.1	Confident	0 Å²	0	55 Å²	55	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-84.7	-8.2	-177.7	-63.3	0	0	0	0	114.4	I842 A848 L849 V850 V868	I842-C846 WeakPolarHBondContact O-CB 3.1Å; I842-C846 PolarHBondContact O-N 3.41Å; I842-C846 PolarHBondContact O-SG 2.93Å; I842-C846 VanDerWaalsContact O-SG 3.38Å; C846-A848 PolarHBondContact O-N 3.1Å; C846-L849 WeakPolarHBondContact O-CA 3.19Å; C846-L849 VanDerWaalsContact O-CB 3.29Å; C846-L849 WeakPolarHBondContact O-CB 3.4Å; C846-L849 PolarHBondContact O-N 3.36Å; C846-V850 HydrophobicContact CB-CG2 4.42Å; C846-V850 WeakPolarHBondContact O-CG2 3.46Å; C846-V850 PolarHBondContact O-N 3.41Å; C846-V868 HydrophobicContact CB-CG1 3.79Å; C846-V868 HydrophobicContact CB-CG2 4.06Å
847	R	85	Confident	83.4	Confident	144 Å²	144	55.1 Å²	55.1	54%	0.543	30%	0.296	S	S	.	.	H	α-helix	trans	-51.9	-35.5	-176.2	72.8	-166.1	165.5	127.9	5.4	114.7	N843 Y844 A851	N843-R847 WeakPolarHBondContact O-CB 3.43Å; N843-R847 PolarHBondContact O-N 3.4Å; Y844-R847 WeakPolarHBondContact O-CD 3.33Å; Y844-R847 WeakPolarHBondContact O-CG 3.35Å; Y844-R847 PolarHBondContact O-NE 3.39Å; Y844-R847 VanDerWaalsContact O-NE 3.17Å; Y844-R847 PolarHBondContact OH-NH2 2.84Å; R847-A851 WeakPolarHBondContact O-CB 3.42Å; R847-A851 PolarHBondContact O-N 3.49Å
848	A	83.5	Confident	82.6	Confident	58 Å²	58	59.8 Å²	59.8	48%	0.479	31%	0.314	S	S	.	.	H	α-helix	trans	-70.1	-41.6	177.5	0	0	0	0	0	111.4	C846 A851 A852	C846-A848 PolarHBondContact O-N 3.1Å; A848-A851 PolarHBondContact O-N 3.5Å; A848-A852 WeakPolarHBondContact O-CB 3.41Å; A848-A852 PolarHBondContact O-N 3.27Å
849	L	84.4	Confident	82.2	Confident	1 Å²	1	59.3 Å²	59.3	1%	0.005	32%	0.316	C	S	.	.	H	α-helix	trans	-64	-46.6	174.9	-167.6	80.2	0	0	0	111.3	C846 A851 A852 V853 L871 F894 I895 Q896 Y943	C846-L849 WeakPolarHBondContact O-CA 3.19Å; C846-L849 VanDerWaalsContact O-CB 3.29Å; C846-L849 WeakPolarHBondContact O-CB 3.4Å; C846-L849 PolarHBondContact O-N 3.36Å; L849-A851 VanDerWaalsContact C-N 3.3Å; L849-A851 PolarHBondContact O-N 3.43Å; L849-A852 PolarHBondContact O-N 3.11Å; L849-V853 HydrophobicContact CD1-CG2 4.22Å; L849-V853 HydrophobicContact CG-CG2 4.08Å; L849-V853 VanDerWaalsContact O-CB 3.3Å; L849-V853 WeakPolarHBondContact O-CB 3.26Å; L849-V853 VanDerWaalsContact O-CG2 3.23Å; L849-V853 WeakPolarHBondContact O-CG2 3.32Å; L849-V853 PolarHBondContact O-N 3.39Å; L849-L871 HydrophobicContact CD2-CD1 3.84Å; L849-F894 HydrophobicContact CD1-CB 3.93Å; L849-F894 HydrophobicContact CD2-CB 3.88Å; L849-F894 HydrophobicContact CD2-CG 4.44Å; L849-F894 HydrophobicContact CG-CB 4.29Å; L849-I895 VanDerWaalsContact CD1-O 3.26Å; L849-I895 WeakPolarHBondContact CD1-O 3.47Å; L849-Q896 HydrophobicContact CD1-CB 4.15Å; L849-Y943 HydrophobicContact CD1-CD2 4.44Å; L849-Y943 HydrophobicContact CD2-CD2 3.74Å; L849-Y943 HydrophobicContact CD2-CE2 4.43Å; L849-Y943 HydrophobicContact CD2-CG 4.27Å
850	V	84.1	Confident	82.1	Confident	29 Å²	29	58.9 Å²	58.9	18%	0.176	32%	0.316	C	S	.	.	H	α-helix	trans	-61.2	-37.6	178.4	171.7	0	0	0	0	111.9	C846 F856 V864 V868	C846-V850 HydrophobicContact CB-CG2 4.42Å; C846-V850 WeakPolarHBondContact O-CG2 3.46Å; C846-V850 PolarHBondContact O-N 3.41Å; V850-F856 HydrophobicContact CG1-CB 4.21Å; V850-F856 HydrophobicContact CG2-CD2 4.48Å; V850-V864 HydrophobicContact CB-CG1 4.45Å; V850-V864 HydrophobicContact CG1-CG1 3.77Å; V850-V864 HydrophobicContact CG2-CG1 3.72Å; V850-V868 HydrophobicContact CG2-CG2 3.86Å
851	A	81.3	Confident	81.9	Confident	73 Å²	73	58.5 Å²	58.5	60%	0.603	31%	0.314	S	S	*	.	H	α-helix	trans	-78.3	-29.4	176.6	0	0	0	0	0	113.8	R847 A848 L849	R847-A851 WeakPolarHBondContact O-CB 3.42Å; R847-A851 PolarHBondContact O-N 3.49Å; A848-A851 PolarHBondContact O-N 3.5Å; L849-A851 VanDerWaalsContact C-N 3.3Å; L849-A851 PolarHBondContact O-N 3.43Å
852	A	81.5	Confident	81.7	Confident	48 Å²	48	59.9 Å²	59.9	40%	0.397	32%	0.322	S	S	.	.	H	α-helix	trans	-87	-30.3	-177.5	0	0	0	0	0	113.6	A848 L849 P854	A848-A852 WeakPolarHBondContact O-CB 3.41Å; A848-A852 PolarHBondContact O-N 3.27Å; L849-A852 PolarHBondContact O-N 3.11Å; A852-P854 VanDerWaalsContact O-CD 3.26Å; A852-P854 WeakPolarHBondContact O-CD 3.25Å
853	V	82.2	Confident	81.6	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	32%	0.317	C	S	.	.			trans	-82.4	109.4	179.1	171.9	0	0	0	0	109.7	L849 F855 F856 F894 G916 Y918	L849-V853 HydrophobicContact CD1-CG2 4.22Å; L849-V853 HydrophobicContact CG-CG2 4.08Å; L849-V853 VanDerWaalsContact O-CB 3.3Å; L849-V853 WeakPolarHBondContact O-CB 3.26Å; L849-V853 VanDerWaalsContact O-CG2 3.23Å; L849-V853 WeakPolarHBondContact O-CG2 3.32Å; L849-V853 PolarHBondContact O-N 3.39Å; V853-F855 HydrophobicContact CG1-CB 3.83Å; V853-F855 HydrophobicContact CG1-CD1 4.45Å; V853-F855 PolarHBondContact O-N 3.33Å; V853-F856 HydrophobicContact CB-CD2 3.67Å; V853-F856 HydrophobicContact CB-CE2 4.22Å; V853-F856 HydrophobicContact CB-CG 4.48Å; V853-F856 HydrophobicContact CG1-CD2 3.6Å; V853-F856 HydrophobicContact CG1-CE2 3.95Å; V853-F856 HydrophobicContact CG1-CG 4.19Å; V853-F856 HydrophobicContact CG2-CD2 4.25Å; V853-F856 HydrophobicContact CG2-CE2 4.39Å; V853-F856 PolarHBondContact O-N 3.24Å; V853-F894 HydrophobicContact CG1-CD1 4.43Å; V853-F894 HydrophobicContact CG2-CD1 4.3Å; V853-G916 WeakPolarHBondContact CA-O 3.42Å; V853-G916 VanDerWaalsContact CG2-O 3.28Å; V853-G916 WeakPolarHBondContact CG2-O 3.26Å; V853-Y918 HydrophobicContact CG1-CD1 4.08Å; V853-Y918 HydrophobicContact CG1-CE1 4.47Å
854	P	74.1	Confident	81.7	Confident	61 Å²	61	57 Å²	57	40%	0.396	31%	0.307	S	S	.	.	H	α-helix	trans	-65.3	-16.4	-174.9	-21.2	34.6	0	0	0	113.8	A852 T857 F858 V1066	A852-P854 VanDerWaalsContact O-CD 3.26Å; A852-P854 WeakPolarHBondContact O-CD 3.25Å; P854-T857 WeakPolarHBondContact CA-OG1 3.09Å; P854-T857 PolarHBondContact O-OG1 3.45Å; P854-F858 WeakPolarHBondContact O-CD2 3.17Å; P854-V1066 HydrophobicContact CG-CG1 4.3Å
855	F	71.1	Confident	81.4	Confident	20 Å²	20	51.9 Å²	51.9	9%	0.088	29%	0.29	C	S	.	.	H	α-helix	trans	-70.2	-28.3	173.8	167.9	-98.3	0	0	0	112.9	V853 F863 Y918 M960 M964	V853-F855 HydrophobicContact CG1-CB 3.83Å; V853-F855 HydrophobicContact CG1-CD1 4.45Å; V853-F855 PolarHBondContact O-N 3.33Å; F855-F863 AromaticContact CE1-CE1 3.75Å; F855-F863 HydrophobicContact CE1-CE1 3.75Å; F855-F863 AromaticContact CE1-CZ 3.71Å; F855-F863 HydrophobicContact CE1-CZ 3.71Å; F855-F863 AromaticContact CZ-CE1 3.97Å; F855-F863 HydrophobicContact CZ-CE1 3.97Å; F855-F863 AromaticContact CZ-CZ 3.65Å; F855-F863 HydrophobicContact CZ-CZ 3.65Å; F855-Y918 HydrophobicContact CB-CE1 3.91Å; F855-Y918 HydrophobicContact CG-CE1 4.47Å; F855-M960 HydrophobicContact CD2-SD 3.87Å; F855-M960 HydrophobicContact CE1-CG 4.49Å; F855-M960 HydrophobicContact CE2-CG 3.54Å; F855-M960 HydrophobicContact CE2-SD 3.23Å; F855-M960 WeakPolarHBondContact CE2-SD 3.46Å; F855-M960 HydrophobicContact CZ-CG 3.43Å; F855-M960 VanDerWaalsContact CZ-CG 3.43Å; F855-M960 HydrophobicContact CZ-SD 3.67Å; F855-M964 HydrophobicContact CD1-CE 4.48Å; F855-M964 HydrophobicContact CD2-CG 4.24Å; F855-M964 HydrophobicContact CE1-CE 3.88Å; F855-M964 HydrophobicContact CE1-SD 4.18Å; F855-M964 HydrophobicContact CE2-CE 3.91Å; F855-M964 HydrophobicContact CE2-CG 3.27Å; F855-M964 HydrophobicContact CE2-SD 3.76Å; F855-M964 HydrophobicContact CZ-CE 3.56Å; F855-M964 HydrophobicContact CZ-CG 3.58Å; F855-M964 HydrophobicContact CZ-SD 3.36Å; F855-M964 WeakPolarHBondContact CZ-SD 3.47Å
856	F	78.2	Confident	81.4	Confident	6 Å²	6	50.7 Å²	50.7	3%	0.026	28%	0.282	C	S	.	.	H	α-helix	trans	-89.3	-26.3	175.8	-65.1	-47.7	0	0	0	113	V850 V853 F858 A859 F863 V864 V867 F894	V850-F856 HydrophobicContact CG1-CB 4.21Å; V850-F856 HydrophobicContact CG2-CD2 4.48Å; V853-F856 HydrophobicContact CB-CD2 3.67Å; V853-F856 HydrophobicContact CB-CE2 4.22Å; V853-F856 HydrophobicContact CB-CG 4.48Å; V853-F856 HydrophobicContact CG1-CD2 3.6Å; V853-F856 HydrophobicContact CG1-CE2 3.95Å; V853-F856 HydrophobicContact CG1-CG 4.19Å; V853-F856 HydrophobicContact CG2-CD2 4.25Å; V853-F856 HydrophobicContact CG2-CE2 4.39Å; V853-F856 PolarHBondContact O-N 3.24Å; F856-F858 PolarHBondContact O-N 3.04Å; F856-A859 WeakPolarHBondContact O-CB 3.47Å; F856-A859 PolarHBondContact O-N 2.93Å; F856-A859 VanDerWaalsContact O-N 3.12Å; F856-F863 AromaticContact CD1-CE1 3.92Å; F856-F863 HydrophobicContact CD1-CE1 3.92Å; F856-F863 AromaticContact CE1-CE1 3.82Å; F856-F863 HydrophobicContact CE1-CE1 3.82Å; F856-F863 HydrophobicContact CE1-CZ 4.48Å; F856-V864 HydrophobicContact CB-CG2 4.26Å; F856-V864 HydrophobicContact CD1-CG2 4.23Å; F856-V867 HydrophobicContact CE1-CB 4.29Å; F856-V867 HydrophobicContact CE1-CG1 4Å; F856-V867 HydrophobicContact CE1-CG2 4.37Å; F856-V867 HydrophobicContact CZ-CG1 3.81Å; F856-F894 AromaticContact CE2-CD1 3.91Å; F856-F894 HydrophobicContact CE2-CD1 3.91Å; F856-F894 AromaticContact CE2-CE1 3.73Å; F856-F894 HydrophobicContact CE2-CE1 3.73Å; F856-F894 HydrophobicContact CE2-CZ 4.34Å; F856-F894 HydrophobicContact CZ-CD1 4.13Å; F856-F894 AromaticContact CZ-CE1 3.5Å; F856-F894 HydrophobicContact CZ-CE1 3.5Å; F856-F894 VanDerWaalsContact CZ-CE1 3.5Å; F856-F894 AromaticContact CZ-CZ 3.74Å; F856-F894 HydrophobicContact CZ-CZ 3.74Å
857	T	74	Confident	81.4	Confident	73 Å²	73	50.9 Å²	50.9	45%	0.448	28%	0.283	S	S	.	.	H	α-helix	trans	-66.7	-19	-176.9	56.7	0	0	0	0	114.6	P854	P854-T857 WeakPolarHBondContact CA-OG1 3.09Å; P854-T857 PolarHBondContact O-OG1 3.45Å
858	F	73.2	Confident	81.5	Confident	180 Å²	180	44 Å²	44	79%	0.789	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.1	12.1	175.6	-55.6	-73.9	0	0	0	113.1	P854 F856	P854-F858 WeakPolarHBondContact O-CD2 3.17Å; F856-F858 PolarHBondContact O-N 3.04Å
859	A	79.2	Confident	81.6	Confident	22 Å²	22	44.5 Å²	44.5	18%	0.182	25%	0.254	C	S	.	.	S	Bend	trans	-88.3	161.2	-177.9	0	0	0	0	0	113	F856 F863 V864 M960	F856-A859 WeakPolarHBondContact O-CB 3.47Å; F856-A859 PolarHBondContact O-N 2.93Å; F856-A859 VanDerWaalsContact O-N 3.12Å; A859-F863 HydrophobicContact CB-CD1 3.75Å; A859-F863 HydrophobicContact CB-CE1 4.25Å; A859-V864 HydrophobicContact CB-CG2 3.86Å; A859-M960 HydrophobicContact CB-CE 3.45Å; A859-M960 VanDerWaalsContact CB-CE 3.45Å
860	D	82.1	Confident	81.8	Confident	71 Å²	71	46.5 Å²	46.5	38%	0.38	26%	0.263	S	S	.	.			trans	-63.8	134.4	165.4	175.4	30.8	0	0	0	109.9	N862 F863 V864 Y957	D860-N862 VanDerWaalsContact CG-ND2 3.32Å; D860-N862 PolarHBondContact O-N 2.87Å; D860-N862 PolarHBondContact OD1-N 3.21Å; D860-N862 PolarHBondContact OD1-ND2 3.38Å; D860-N862 WeakPolarHBondContact OD2-CB 3.31Å; D860-N862 PolarHBondContact OD2-ND2 3.19Å; D860-F863 HydrophobicContact CB-CB 4.33Å; D860-F863 WeakPolarHBondContact O-CB 3.3Å; D860-F863 PolarHBondContact O-N 2.61Å; D860-V864 PolarHBondContact O-N 3.33Å; D860-Y957 HydrophobicContact CB-CE1 4.2Å; D860-Y957 VanDerWaalsContact OD2-CE1 3.3Å; D860-Y957 WeakPolarHBondContact OD2-CE1 3.22Å; D860-Y957 PolarHBondContact OD2-OH 3.49Å
861	Q	83.2	Confident	82.1	Confident	117 Å²	117	46.1 Å²	46.1	55%	0.547	26%	0.26	S	S	.	.	H	α-helix	trans	-60.1	-30.7	-178.6	-176.1	58.9	61	0	0	112.1	V864 S865	Q861-V864 PolarHBondContact O-N 3.07Å; Q861-S865 PolarHBondContact O-N 3.3Å
862	N	84.3	Confident	82.6	Confident	96 Å²	96	50.3 Å²	50.3	51%	0.513	26%	0.26	S	S	.	.	H	α-helix	trans	-70	-38.9	176.2	-48	-82.9	0	0	0	111.6	D860 V864 S865 E866 Y957	D860-N862 VanDerWaalsContact CG-ND2 3.32Å; D860-N862 PolarHBondContact O-N 2.87Å; D860-N862 PolarHBondContact OD1-N 3.21Å; D860-N862 PolarHBondContact OD1-ND2 3.38Å; D860-N862 WeakPolarHBondContact OD2-CB 3.31Å; D860-N862 PolarHBondContact OD2-ND2 3.19Å; N862-V864 VanDerWaalsContact C-N 3.32Å; N862-S865 PolarHBondContact O-N 3.13Å; N862-E866 WeakPolarHBondContact O-CB 3.28Å; N862-E866 PolarHBondContact O-N 3.04Å; N862-Y957 VanDerWaalsContact CB-OH 3.28Å; N862-Y957 WeakPolarHBondContact CB-OH 3.32Å
863	F	86.3	Confident	83	Confident	3 Å²	3	50.8 Å²	50.8	1%	0.013	25%	0.252	C	S	.	.	H	α-helix	trans	-60.9	-42.6	170.7	166.8	-91.2	0	0	0	110.9	F855 F856 A859 D860 E866 V867 V953 L954 Y957 M960	F855-F863 AromaticContact CE1-CE1 3.75Å; F855-F863 HydrophobicContact CE1-CE1 3.75Å; F855-F863 AromaticContact CE1-CZ 3.71Å; F855-F863 HydrophobicContact CE1-CZ 3.71Å; F855-F863 AromaticContact CZ-CE1 3.97Å; F855-F863 HydrophobicContact CZ-CE1 3.97Å; F855-F863 AromaticContact CZ-CZ 3.65Å; F855-F863 HydrophobicContact CZ-CZ 3.65Å; F856-F863 AromaticContact CD1-CE1 3.92Å; F856-F863 HydrophobicContact CD1-CE1 3.92Å; F856-F863 AromaticContact CE1-CE1 3.82Å; F856-F863 HydrophobicContact CE1-CE1 3.82Å; F856-F863 HydrophobicContact CE1-CZ 4.48Å; A859-F863 HydrophobicContact CB-CD1 3.75Å; A859-F863 HydrophobicContact CB-CE1 4.25Å; D860-F863 HydrophobicContact CB-CB 4.33Å; D860-F863 WeakPolarHBondContact O-CB 3.3Å; D860-F863 PolarHBondContact O-N 2.61Å; F863-E866 PolarHBondContact O-N 2.9Å; F863-V867 HydrophobicContact CD1-CG2 4.34Å; F863-V867 HydrophobicContact CD2-CG2 4.24Å; F863-V867 HydrophobicContact CE1-CG2 3.92Å; F863-V867 HydrophobicContact CE2-CG2 3.78Å; F863-V867 HydrophobicContact CG-CG2 4.5Å; F863-V867 HydrophobicContact CZ-CG2 3.6Å; F863-V867 WeakPolarHBondContact O-CG2 3.46Å; F863-V867 PolarHBondContact O-N 3.08Å; F863-V953 HydrophobicContact CD2-CG1 3.5Å; F863-V953 VanDerWaalsContact CD2-CG1 3.5Å; F863-V953 HydrophobicContact CE2-CG1 3.54Å; F863-L954 HydrophobicContact CE2-CD2 4.28Å; F863-Y957 HydrophobicContact CB-CD1 3.91Å; F863-Y957 HydrophobicContact CB-CD2 3.96Å; F863-Y957 HydrophobicContact CB-CE1 3.89Å; F863-Y957 HydrophobicContact CB-CE2 3.97Å; F863-Y957 HydrophobicContact CB-CG 3.95Å; F863-Y957 HydrophobicContact CD2-CD1 4.43Å; F863-Y957 AromaticContact CD2-CD2 3.71Å; F863-Y957 HydrophobicContact CD2-CD2 3.71Å; F863-Y957 HydrophobicContact CD2-CE2 4.45Å; F863-Y957 AromaticContact CD2-CG 3.71Å; F863-Y957 HydrophobicContact CD2-CG 3.71Å; F863-Y957 HydrophobicContact CG-CD2 4.33Å; F863-Y957 HydrophobicContact CG-CG 4.25Å; F863-M960 HydrophobicContact CD1-CE 4.42Å; F863-M960 HydrophobicContact CD1-CG 4.49Å; F863-M960 HydrophobicContact CD2-CG 4.39Å; F863-M960 HydrophobicContact CE1-CE 4.42Å; F863-M960 HydrophobicContact CE1-CG 3.91Å; F863-M960 HydrophobicContact CE2-CB 4.22Å; F863-M960 HydrophobicContact CE2-CG 3.82Å; F863-M960 HydrophobicContact CZ-CB 4.44Å; F863-M960 HydrophobicContact CZ-CG 3.56Å
864	V	85.8	Confident	83.6	Confident	3 Å²	3	52.9 Å²	52.9	2%	0.018	26%	0.262	C	S	.	.	H	α-helix	trans	-60.2	-49.3	176.8	177.5	0	0	0	0	110.7	V850 F856 A859 D860 Q861 N862 E866 V867 V868	V850-V864 HydrophobicContact CB-CG1 4.45Å; V850-V864 HydrophobicContact CG1-CG1 3.77Å; V850-V864 HydrophobicContact CG2-CG1 3.72Å; F856-V864 HydrophobicContact CB-CG2 4.26Å; F856-V864 HydrophobicContact CD1-CG2 4.23Å; A859-V864 HydrophobicContact CB-CG2 3.86Å; D860-V864 PolarHBondContact O-N 3.33Å; Q861-V864 PolarHBondContact O-N 3.07Å; N862-V864 VanDerWaalsContact C-N 3.32Å; V864-E866 PolarHBondContact O-N 3.39Å; V864-V867 PolarHBondContact O-N 2.93Å; V864-V868 HydrophobicContact CG1-CG2 4.05Å; V864-V868 WeakPolarHBondContact O-CB 3.05Å; V864-V868 WeakPolarHBondContact O-CG2 3.48Å; V864-V868 PolarHBondContact O-N 2.88Å
865	S	83.1	Confident	84.6	Confident	18 Å²	18	50.3 Å²	50.3	13%	0.126	25%	0.245	C	C	.	.	H	α-helix	trans	-59.3	-44.1	174.6	-82.8	0	0	0	0	112.5	E839 N843 Q861 N862 V867 V868 V869	E839-S865 WeakPolarHBondContact OE1-CB 3.14Å; E839-S865 PolarHBondContact OE1-OG 3.07Å; N843-S865 PolarHBondContact ND2-OG 2.96Å; Q861-S865 PolarHBondContact O-N 3.3Å; N862-S865 PolarHBondContact O-N 3.13Å; S865-V867 PolarHBondContact O-N 3.26Å; S865-V868 PolarHBondContact O-N 3.33Å; S865-V869 WeakPolarHBondContact O-CG2 3.49Å; S865-V869 PolarHBondContact O-N 2.67Å
866	E	85.9	Confident	85.8	Confident	42 Å²	42	51.1 Å²	51.1	20%	0.196	25%	0.248	C	C	.	.	H	α-helix	trans	-65.3	-37	-178.7	-154.2	-164.4	141.1	0	0	112.5	N862 F863 V864 K870 V953 N956	N862-E866 WeakPolarHBondContact O-CB 3.28Å; N862-E866 PolarHBondContact O-N 3.04Å; F863-E866 PolarHBondContact O-N 2.9Å; V864-E866 PolarHBondContact O-N 3.39Å; E866-K870 WeakPolarHBondContact O-CD 3.48Å; E866-K870 WeakPolarHBondContact O-CG 3.4Å; E866-K870 IonicContact OE1-NZ 2.76Å; E866-K870 PolarHBondContact OE1-NZ 2.76Å; E866-V953 HydrophobicContact CB-CG1 4.37Å; E866-V953 HydrophobicContact CB-CG2 4.43Å; E866-V953 HydrophobicContact CG-CG2 4.02Å; E866-V953 VanDerWaalsContact OE1-CG2 3.31Å; E866-V953 WeakPolarHBondContact OE1-CG2 3.45Å; E866-N956 PolarHBondContact OE1-ND2 3.28Å; E866-N956 VanDerWaalsContact OE1-ND2 3.14Å; E866-N956 PolarHBondContact OE2-ND2 3.48Å
867	V	87.9	Confident	86.7	Confident	4 Å²	4	51.4 Å²	51.4	2%	0.024	25%	0.25	C	C	.	.	H	α-helix	trans	-68.5	-50.7	171.1	174.5	0	0	0	0	110.9	F856 F863 V864 S865 V869 K870 L871 L945 V953	F856-V867 HydrophobicContact CE1-CB 4.29Å; F856-V867 HydrophobicContact CE1-CG1 4Å; F856-V867 HydrophobicContact CE1-CG2 4.37Å; F856-V867 HydrophobicContact CZ-CG1 3.81Å; F863-V867 HydrophobicContact CD1-CG2 4.34Å; F863-V867 HydrophobicContact CD2-CG2 4.24Å; F863-V867 HydrophobicContact CE1-CG2 3.92Å; F863-V867 HydrophobicContact CE2-CG2 3.78Å; F863-V867 HydrophobicContact CG-CG2 4.5Å; F863-V867 HydrophobicContact CZ-CG2 3.6Å; F863-V867 WeakPolarHBondContact O-CG2 3.46Å; F863-V867 PolarHBondContact O-N 3.08Å; V864-V867 PolarHBondContact O-N 2.93Å; S865-V867 PolarHBondContact O-N 3.26Å; V867-V869 VanDerWaalsContact C-N 3.33Å; V867-V869 PolarHBondContact O-N 3.35Å; V867-K870 CarbonylContact O-C 3.49Å; V867-K870 WeakPolarHBondContact O-CA 3.47Å; V867-K870 PolarHBondContact O-N 3.04Å; V867-L871 HydrophobicContact CG1-CD2 4.03Å; V867-L871 HydrophobicContact CG1-CG 4.29Å; V867-L871 WeakPolarHBondContact O-CG 3.42Å; V867-L871 PolarHBondContact O-N 3.2Å; V867-L945 HydrophobicContact CG1-CD2 4.06Å; V867-V953 HydrophobicContact CG2-CG1 3.83Å
868	V	87	Confident	87.8	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-60.2	-39.5	-171.8	162.8	0	0	0	0	112.1	I842 N843 C846 V850 V864 S865 K870 L871	I842-V868 HydrophobicContact CB-CG1 4.38Å; I842-V868 HydrophobicContact CG2-CG1 3.59Å; I842-V868 WeakPolarHBondContact CG2-O 3.3Å; N843-V868 WeakPolarHBondContact OD1-CG1 3.32Å; C846-V868 HydrophobicContact CB-CG1 3.79Å; C846-V868 HydrophobicContact CB-CG2 4.06Å; V850-V868 HydrophobicContact CG2-CG2 3.86Å; V864-V868 HydrophobicContact CG1-CG2 4.05Å; V864-V868 WeakPolarHBondContact O-CB 3.05Å; V864-V868 WeakPolarHBondContact O-CG2 3.48Å; V864-V868 PolarHBondContact O-N 2.88Å; S865-V868 PolarHBondContact O-N 3.33Å; V868-K870 PolarHBondContact O-N 3.05Å; V868-L871 HydrophobicContact CG2-CD1 4.38Å; V868-L871 PolarHBondContact O-N 3.34Å
869	V	85.3	Confident	88.7	Confident	68 Å²	68	44.8 Å²	44.8	41%	0.412	24%	0.235	S	C	.	.	H	α-helix	trans	-66.9	-22.5	175.1	173	0	0	0	0	113	S865 V867	S865-V869 WeakPolarHBondContact O-CG2 3.49Å; S865-V869 PolarHBondContact O-N 2.67Å; V867-V869 VanDerWaalsContact C-N 3.33Å; V867-V869 PolarHBondContact O-N 3.35Å
870	K	88.1	Confident	89.5	Confident	43 Å²	43	45.5 Å²	45.5	19%	0.187	24%	0.236	C	C	.	.	H	α-helix	trans	-96.1	-3.1	179.4	-62.8	176.4	-175.1	-179.6	0	113.5	E866 V867 V868 L945 E952 V953	E866-K870 WeakPolarHBondContact O-CD 3.48Å; E866-K870 WeakPolarHBondContact O-CG 3.4Å; E866-K870 IonicContact OE1-NZ 2.76Å; E866-K870 PolarHBondContact OE1-NZ 2.76Å; V867-K870 CarbonylContact O-C 3.49Å; V867-K870 WeakPolarHBondContact O-CA 3.47Å; V867-K870 PolarHBondContact O-N 3.04Å; V868-K870 PolarHBondContact O-N 3.05Å; K870-L945 HydrophobicContact CB-CD1 3.84Å; K870-E952 IonicContact NZ-OE1 2.85Å; K870-E952 PolarHBondContact NZ-OE1 3.42Å; K870-E952 IonicContact NZ-OE2 2.67Å; K870-E952 PolarHBondContact NZ-OE2 2.93Å; K870-V953 HydrophobicContact CD-CG2 3.86Å
871	L	90.2	Very high	90.1	Very high	20 Å²	20	46.6 Å²	46.6	11%	0.105	24%	0.242	C	C	.	.			trans	-73.2	145.8	176.3	-67.1	-176.5	0	0	0	112.6	L849 V867 V868 F894 Y943 L945	L849-L871 HydrophobicContact CD2-CD1 3.84Å; V867-L871 HydrophobicContact CG1-CD2 4.03Å; V867-L871 HydrophobicContact CG1-CG 4.29Å; V867-L871 WeakPolarHBondContact O-CG 3.42Å; V867-L871 PolarHBondContact O-N 3.2Å; V868-L871 HydrophobicContact CG2-CD1 4.38Å; V868-L871 PolarHBondContact O-N 3.34Å; L871-F894 HydrophobicContact CD2-CD2 3.9Å; L871-F894 HydrophobicContact CD2-CE2 3.87Å; L871-Y943 HydrophobicContact CB-CD1 3.8Å; L871-Y943 HydrophobicContact CB-CG 4.25Å; L871-Y943 HydrophobicContact CD1-CD1 4.32Å; L871-Y943 HydrophobicContact CD1-CG 4.12Å; L871-L945 HydrophobicContact CD2-CB 3.97Å; L871-L945 HydrophobicContact CD2-CD1 4.35Å
872	R	90.8	Very high	90.7	Very high	162 Å²	162	41.6 Å²	41.6	61%	0.611	22%	0.219	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-125.4	125.3	176.3	-64.4	178.5	-178.8	-103.3	-1.6	111.4	Y943 S944	R872-Y943 CarbonylContact O-C 3.48Å; R872-Y943 WeakPolarHBondContact O-CA 3.25Å; R872-S944 PolarHBondContact N-O 2.95Å; R872-S944 PolarHBondContact O-N 3.37Å
873	Y	91.5	Very high	91.2	Very high	58 Å²	58	37.4 Å²	37.4	23%	0.227	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	123.1	-178.1	179.6	-99.8	0	0	0	112.6	V875 N941 Y943	Y873-V875 HydrophobicContact CD1-CG2 4.49Å; Y873-V875 HydrophobicContact CE1-CG2 3.64Å; Y873-N941 HydrophobicContact CE2-CB 4.02Å; Y873-N941 PolarHBondContact OH-OD1 2.83Å; Y873-Y943 HydrophobicContact CD2-CE1 4.14Å; Y873-Y943 HydrophobicContact CD2-CE2 4.3Å; Y873-Y943 AromaticContact CD2-CZ 3.95Å; Y873-Y943 HydrophobicContact CG-CE1 4.47Å
874	E	94.2	Very high	91.5	Very high	44 Å²	44	43.4 Å²	43.4	21%	0.206	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	155.6	-179.7	-72.3	177.6	-141.7	0	0	111.2	F876 K891 V942 S944	E874-F876 HydrophobicContact CB-CE2 4.08Å; E874-K891 IonicContact OE1-NZ 3.67Å; E874-K891 PolarHBondContact OE1-NZ 3.18Å; E874-K891 IonicContact OE2-NZ 3.67Å; E874-K891 PolarHBondContact OE2-NZ 3.47Å; E874-V942 HydrophobicContact CB-CG2 4.11Å; E874-V942 PolarHBondContact N-O 2.89Å; E874-V942 PolarHBondContact O-N 3.37Å; E874-V942 VanDerWaalsContact O-O 3.05Å; E874-S944 VanDerWaalsContact OE1-CB 3.23Å; E874-S944 WeakPolarHBondContact OE1-CB 3.39Å; E874-S944 PolarHBondContact OE1-OG 2.97Å
875	V	95.7	Very high	91.8	Very high	7 Å²	7	44.8 Å²	44.8	4%	0.042	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	135.4	-178.2	180	0	0	0	0	109.1	Y814 Y873 C940 N941	Y814-V875 HydrophobicContact CE2-CB 4.37Å; Y814-V875 WeakPolarHBondContact CE2-O 3.45Å; Y873-V875 HydrophobicContact CD1-CG2 4.49Å; Y873-V875 HydrophobicContact CE1-CG2 3.64Å; V875-C940 WeakPolarHBondContact CA-O 3.2Å; V875-N941 WeakPolarHBondContact CG2-OD1 3.49Å
876	F	96.8	Very high	92	Very high	36 Å²	36	45.3 Å²	45.3	16%	0.158	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	146.9	176.4	-65.9	-86.5	0	0	0	110.9	E874 D880 I882 Y893 A936 Y939 C940 V942	E874-F876 HydrophobicContact CB-CE2 4.08Å; F876-D880 HydrophobicContact CB-CB 4.43Å; F876-D880 HydrophobicContact CD1-CB 4.43Å; F876-I882 HydrophobicContact CB-CD1 4.19Å; F876-I882 HydrophobicContact CB-CG1 4.17Å; F876-I882 HydrophobicContact CD1-CG1 3.91Å; F876-I882 HydrophobicContact CD1-CG2 4.48Å; F876-I882 HydrophobicContact CD2-CD1 4.03Å; F876-I882 HydrophobicContact CD2-CG1 4.15Å; F876-I882 HydrophobicContact CD2-CG2 4.28Å; F876-I882 HydrophobicContact CE1-CG1 4.37Å; F876-I882 HydrophobicContact CE1-CG2 4.13Å; F876-I882 HydrophobicContact CE2-CG2 3.93Å; F876-I882 HydrophobicContact CG-CD1 4.02Å; F876-I882 HydrophobicContact CG-CG1 3.79Å; F876-I882 HydrophobicContact CZ-CG2 3.85Å; F876-Y893 HydrophobicContact CE2-CD1 4.47Å; F876-Y893 AromaticContact CE2-CE1 3.99Å; F876-Y893 HydrophobicContact CE2-CE1 3.99Å; F876-Y893 AromaticContact CZ-CE1 3.99Å; F876-Y893 HydrophobicContact CZ-CE1 3.99Å; F876-A936 HydrophobicContact CB-CB 4.36Å; F876-Y939 WeakPolarHBondContact O-CA 3.46Å; F876-C940 HydrophobicContact CB-CB 4.41Å; F876-C940 PolarHBondContact N-O 3.25Å; F876-C940 PolarHBondContact O-N 3.43Å; F876-V942 HydrophobicContact CD2-CG2 3.8Å; F876-V942 HydrophobicContact CE2-CG2 3.6Å
877	Q	96.5	Very high	92.3	Very high	12 Å²	12	45.9 Å²	45.9	6%	0.056	24%	0.243	C	C	.	.			trans	-88.4	154.1	178.5	-51.6	-167.4	-75	0	0	110.9	R810 Y814 G879 D880 A936 Y939	R810-Q877 PolarHBondContact O-NE2 3.27Å; R810-Q877 PolarHBondContact O-OE1 3.2Å; Y814-Q877 HydrophobicContact CD2-CG 4.43Å; Q877-G879 PolarHBondContact O-N 3.43Å; Q877-D880 VanDerWaalsContact CB-OD2 3.31Å; Q877-D880 WeakPolarHBondContact CB-OD2 3.35Å; Q877-D880 PolarHBondContact N-OD2 3.18Å; Q877-D880 VanDerWaalsContact N-OD2 3.08Å; Q877-D880 WeakPolarHBondContact O-CB 3.45Å; Q877-D880 PolarHBondContact O-N 3.46Å; Q877-A936 VanDerWaalsContact O-CB 3.31Å; Q877-A936 WeakPolarHBondContact O-CB 3.44Å; Q877-Y939 HydrophobicContact CB-CE1 4.23Å; Q877-Y939 HydrophobicContact CG-CE1 4.06Å
878	P	96.2	Very high	92.5	Very high	62 Å²	62	51.5 Å²	51.5	40%	0.403	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.6	129.7	171	22.6	-35.5	0	0	0	111.2	E937 T938 Y939	P878-E937 WeakPolarHBondContact CB-O 3.47Å; P878-T938 WeakPolarHBondContact CA-O 3.29Å; P878-Y939 HydrophobicContact CG-CD2 4.2Å; P878-Y939 HydrophobicContact CG-CE2 4.03Å
879	G	93.4	Very high	92.5	Very high	52 Å²	52	51.6 Å²	51.6	54%	0.536	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	89.7	-7.3	-174.6	0	0	0	0	0	116	Q877 A936	Q877-G879 PolarHBondContact O-N 3.43Å; G879-A936 WeakPolarHBondContact CA-O 3.3Å; G879-A936 PolarHBondContact N-O 3.14Å
880	D	95.7	Very high	92.7	Very high	37 Å²	37	52.9 Å²	52.9	20%	0.198	28%	0.281	C	S	.	.			trans	-73.8	137.5	179.9	-81	-32.4	0	0	0	113.5	R810 F876 Q877 I882 R935 A936	R810-D880 IonicContact CZ-OD1 2.98Å; R810-D880 IonicContact NH1-OD1 2.69Å; R810-D880 PolarHBondContact NH1-OD1 2.94Å; R810-D880 IonicContact NH2-OD1 3.04Å; R810-D880 PolarHBondContact NH2-OD1 3.44Å; R810-D880 IonicContact NH2-OD2 3.35Å; R810-D880 PolarHBondContact NH2-OD2 2.71Å; F876-D880 HydrophobicContact CB-CB 4.43Å; F876-D880 HydrophobicContact CD1-CB 4.43Å; Q877-D880 VanDerWaalsContact CB-OD2 3.31Å; Q877-D880 WeakPolarHBondContact CB-OD2 3.35Å; Q877-D880 PolarHBondContact N-OD2 3.18Å; Q877-D880 VanDerWaalsContact N-OD2 3.08Å; Q877-D880 WeakPolarHBondContact O-CB 3.45Å; Q877-D880 PolarHBondContact O-N 3.46Å; D880-I882 PolarHBondContact O-N 3.06Å; D880-R935 CarbonylContact O-C 3.51Å; D880-R935 WeakPolarHBondContact O-CA 3.34Å; D880-A936 PolarHBondContact O-N 2.75Å
881	L	94.8	Very high	93	Very high	95 Å²	95	53.1 Å²	53.1	50%	0.497	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	84.6	179.8	-169.6	69	0	0	0	110.8	I883 K884 V934 R935	L881-I883 VanDerWaalsContact C-N 3.25Å; L881-I883 WeakPolarHBondContact CD1-O 3.39Å; L881-I883 WeakPolarHBondContact CG-O 3.26Å; L881-I883 PolarHBondContact O-N 3.08Å; L881-K884 HydrophobicContact CD2-CB 3.75Å; L881-K884 HydrophobicContact CD2-CD 4.2Å; L881-K884 HydrophobicContact CD2-CG 3.99Å; L881-K884 HydrophobicContact CG-CB 4.36Å; L881-V934 CarbonylContact C-O 3.56Å; L881-R935 HydrophobicContact CD1-CB 4.46Å
882	I	95.5	Very high	93.1	Very high	12 Å²	12	52.1 Å²	52.1	6%	0.062	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.2	-35.7	-178.8	-47.4	-179.7	0	0	0	112	F876 D880 Y893 V900 F919 V934 A936	F876-I882 HydrophobicContact CB-CD1 4.19Å; F876-I882 HydrophobicContact CB-CG1 4.17Å; F876-I882 HydrophobicContact CD1-CG1 3.91Å; F876-I882 HydrophobicContact CD1-CG2 4.48Å; F876-I882 HydrophobicContact CD2-CD1 4.03Å; F876-I882 HydrophobicContact CD2-CG1 4.15Å; F876-I882 HydrophobicContact CD2-CG2 4.28Å; F876-I882 HydrophobicContact CE1-CG1 4.37Å; F876-I882 HydrophobicContact CE1-CG2 4.13Å; F876-I882 HydrophobicContact CE2-CG2 3.93Å; F876-I882 HydrophobicContact CG-CD1 4.02Å; F876-I882 HydrophobicContact CG-CG1 3.79Å; F876-I882 HydrophobicContact CZ-CG2 3.85Å; D880-I882 PolarHBondContact O-N 3.06Å; I882-Y893 HydrophobicContact CG2-CD1 4.41Å; I882-Y893 HydrophobicContact CG2-CD2 4.04Å; I882-Y893 HydrophobicContact CG2-CE1 4.01Å; I882-Y893 HydrophobicContact CG2-CE2 3.57Å; I882-Y893 HydrophobicContact CG2-CG 4.4Å; I882-Y893 PolarHBondContact O-OH 3.29Å; I882-V900 HydrophobicContact CD1-CG1 3.68Å; I882-F919 HydrophobicContact CB-CE2 4.42Å; I882-F919 HydrophobicContact CB-CZ 4.5Å; I882-F919 HydrophobicContact CD1-CZ 4.01Å; I882-F919 HydrophobicContact CG2-CE2 3.9Å; I882-F919 HydrophobicContact CG2-CZ 3.97Å; I882-V934 PolarHBondContact N-O 3.07Å; I882-A936 HydrophobicContact CD1-CB 4.23Å; I882-A936 HydrophobicContact CG1-CB 4.47Å
883	I	95.1	Very high	93.3	Very high	7 Å²	7	45.1 Å²	45.1	4%	0.036	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	135.2	173.7	-64.4	-177.5	0	0	0	109.4	L881 Y893 F919 R930 S933 V934	L881-I883 VanDerWaalsContact C-N 3.25Å; L881-I883 WeakPolarHBondContact CD1-O 3.39Å; L881-I883 WeakPolarHBondContact CG-O 3.26Å; L881-I883 PolarHBondContact O-N 3.08Å; I883-Y893 HydrophobicContact CD1-CD2 4.25Å; I883-Y893 HydrophobicContact CD1-CE2 4.12Å; I883-Y893 HydrophobicContact CG1-CD2 4.47Å; I883-Y893 HydrophobicContact CG1-CE2 3.93Å; I883-F919 HydrophobicContact CD1-CD2 3.62Å; I883-F919 HydrophobicContact CD1-CE2 3.87Å; I883-F919 HydrophobicContact CG1-CD2 4.44Å; I883-F919 HydrophobicContact CG1-CE2 4.23Å; I883-R930 HydrophobicContact CG2-CB 3.8Å; I883-R930 HydrophobicContact CG2-CG 3.63Å; I883-S933 CarbonylContact O-C 3.54Å; I883-S933 VanDerWaalsContact O-CA 3.31Å; I883-S933 WeakPolarHBondContact O-CA 3.16Å; I883-V934 HydrophobicContact CB-CB 3.95Å; I883-V934 HydrophobicContact CB-CG2 4.05Å; I883-V934 HydrophobicContact CD1-CG2 4.19Å; I883-V934 HydrophobicContact CG1-CB 4.4Å; I883-V934 HydrophobicContact CG1-CG2 4.44Å; I883-V934 PolarHBondContact N-O 2.84Å; I883-V934 VanDerWaalsContact N-O 3.1Å; I883-V934 PolarHBondContact O-N 2.92Å
884	K	92.7	Very high	93.4	Very high	129 Å²	129	42.5 Å²	42.5	56%	0.561	24%	0.24	S	C	*	.			trans	-108.3	132.7	169.5	-176.7	173.7	179.8	175.1	0	110.4	L881 T887	L881-K884 HydrophobicContact CD2-CB 3.75Å; L881-K884 HydrophobicContact CD2-CD 4.2Å; L881-K884 HydrophobicContact CD2-CG 3.99Å; L881-K884 HydrophobicContact CG-CB 4.36Å; K884-T887 HydrophobicContact CB-CG2 3.86Å; K884-T887 HydrophobicContact CD-CG2 4.41Å; K884-T887 HydrophobicContact CG-CG2 4.2Å; K884-T887 PolarHBondContact O-N 3.07Å; K884-T887 PolarHBondContact O-OG1 2.91Å
885	E	90.7	Very high	93.3	Very high	32 Å²	32	40.4 Å²	40.4	15%	0.15	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.9	149.1	174.6	-156.2	-159.1	148.4	0	0	111.4	T887 R905 R930 S933 R977	E885-T887 PolarHBondContact O-N 3.11Å; E885-T887 VanDerWaalsContact O-N 3.09Å; E885-R905 IonicContact OE1-CZ 3.32Å; E885-R905 VanDerWaalsContact OE1-CZ 3.32Å; E885-R905 IonicContact OE1-NE 3.07Å; E885-R905 PolarHBondContact OE1-NE 3.46Å; E885-R905 IonicContact OE1-NH2 2.72Å; E885-R905 PolarHBondContact OE1-NH2 3.31Å; E885-R905 WeakPolarHBondContact OE2-CG 3.34Å; E885-R905 IonicContact OE2-CZ 3.88Å; E885-R905 IonicContact OE2-NE 2.93Å; E885-R905 PolarHBondContact OE2-NE 3.13Å; E885-R905 IonicContact OE2-NH2 3.95Å; E885-R930 WeakPolarHBondContact CG-O 3.16Å; E885-S933 PolarHBondContact N-OG 3.43Å; E885-R977 IonicContact OE1-CZ 3.93Å; E885-R977 IonicContact OE1-NH2 2.67Å; E885-R977 PolarHBondContact OE1-NH2 3.44Å
886	G	88.7	Confident	93.1	Very high	29 Å²	29	42.7 Å²	42.7	30%	0.299	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	77.7	-11.2	175.4	0	0	0	0	0	114.4	R929 R930	G886-R929 VanDerWaalsContact O-CD 3.25Å; G886-R929 WeakPolarHBondContact O-CD 3.47Å; G886-R929 WeakPolarHBondContact O-CG 3.29Å; G886-R929 PolarHBondContact O-NH1 2.71Å; G886-R930 PolarHBondContact N-O 2.89Å
887	T	91.9	Very high	92.9	Very high	54 Å²	54	45.3 Å²	45.3	33%	0.331	25%	0.253	S	S	.	.	S	Bend	trans	-73.8	162.4	171.5	64.3	0	0	0	0	111.8	K884 E885 R929 R930	K884-T887 HydrophobicContact CB-CG2 3.86Å; K884-T887 HydrophobicContact CD-CG2 4.41Å; K884-T887 HydrophobicContact CG-CG2 4.2Å; K884-T887 PolarHBondContact O-N 3.07Å; K884-T887 PolarHBondContact O-OG1 2.91Å; E885-T887 PolarHBondContact O-N 3.11Å; E885-T887 VanDerWaalsContact O-N 3.09Å; T887-R929 CarbonylContact O-C 3.42Å; T887-R929 VanDerWaalsContact O-CA 3.3Å; T887-R929 WeakPolarHBondContact O-CA 3.41Å; T887-R929 WeakPolarHBondContact O-CB 3.27Å; T887-R930 WeakPolarHBondContact O-CG 3.38Å; T887-R930 PolarHBondContact O-N 3.15Å; T887-R930 WeakPolarHBondContact OG1-CG 3.48Å
888	I	91	Very high	92.8	Very high	122 Å²	122	45.1 Å²	45.1	63%	0.626	26%	0.255	S	S	*	.	B	Isolated β-bridge	trans	-84	129.4	172.7	-60.5	174.3	0	0	0	108.1
889	G	87.6	Confident	92.8	Very high	3 Å²	3	45 Å²	45	3%	0.031	25%	0.25	C	C	.	.	P	Polyproline II helix	trans	-91.8	120.7	179.6	0	0	0	0	0	113
890	T	90.7	Very high	92.9	Very high	95 Å²	95	42.5 Å²	42.5	58%	0.583	22%	0.224	S	C	*	.			trans	-103	-13	-179.6	52.2	0	0	0	0	114.2	R947	T890-R947 VanDerWaalsContact O-CB 3.31Å; T890-R947 WeakPolarHBondContact O-CB 3.48Å; T890-R947 PolarHBondContact O-N 3.18Å
891	K	93.6	Very high	92.9	Very high	47 Å²	47	41.3 Å²	41.3	20%	0.204	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	154.8	-178.7	65.9	-168.7	-165.3	176	0	112	E874 Y893 R930 L945	E874-K891 IonicContact OE1-NZ 3.67Å; E874-K891 PolarHBondContact OE1-NZ 3.18Å; E874-K891 IonicContact OE2-NZ 3.67Å; E874-K891 PolarHBondContact OE2-NZ 3.47Å; K891-Y893 HydrophobicContact CD-CE1 4.39Å; K891-Y893 VanDerWaalsContact CE-CE1 3.45Å; K891-Y893 VanDerWaalsContact CE-CZ 3.44Å; K891-Y893 WeakPolarHBondContact CE-OH 3.49Å; K891-Y893 HydrophobicContact CG-CE1 4.47Å; K891-Y893 HydrophobicContact CG-CE2 4.5Å; K891-R930 VanDerWaalsContact O-CZ 3.3Å; K891-R930 PolarHBondContact O-NH1 3.29Å; K891-R930 PolarHBondContact O-NH2 3.17Å; K891-L945 CarbonylContact C-O 3.57Å; K891-L945 WeakPolarHBondContact CA-O 3.17Å; K891-L945 VanDerWaalsContact CB-O 3.25Å; K891-L945 WeakPolarHBondContact CB-O 3.5Å
892	M	92.6	Very high	92.8	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	170.9	166.9	65	176.1	-67.6	0	0	110.4	F894 Y918 E921 L924 S944 L945 F950 M964	M892-F894 HydrophobicContact CE-CD1 4.43Å; M892-F894 HydrophobicContact CE-CD2 4.39Å; M892-F894 HydrophobicContact CE-CE1 3.77Å; M892-F894 HydrophobicContact CE-CE2 3.73Å; M892-F894 HydrophobicContact CE-CZ 3.38Å; M892-F894 HydrophobicContact CG-CE2 4.26Å; M892-F894 HydrophobicContact SD-CE2 4.1Å; M892-F894 HydrophobicContact SD-CZ 3.97Å; M892-Y918 HydrophobicContact CE-CD2 3.78Å; M892-Y918 HydrophobicContact CE-CG 4.28Å; M892-E921 HydrophobicContact CE-CB 4.22Å; M892-E921 HydrophobicContact SD-CB 4.38Å; M892-L924 HydrophobicContact CB-CD1 3.71Å; M892-L924 HydrophobicContact CG-CD1 3.79Å; M892-L924 HydrophobicContact SD-CD1 4.2Å; M892-S944 VanDerWaalsContact O-CA 3.3Å; M892-S944 WeakPolarHBondContact O-CA 3.48Å; M892-L945 HydrophobicContact CG-CB 4.03Å; M892-L945 PolarHBondContact N-O 2.92Å; M892-L945 PolarHBondContact O-N 2.93Å; M892-L945 HydrophobicContact SD-CD2 4.45Å; M892-F950 HydrophobicContact SD-CD2 3.74Å; M892-F950 HydrophobicContact SD-CE2 3.44Å; M892-F950 WeakPolarHBondContact SD-CE2 3.31Å; M892-F950 HydrophobicContact SD-CZ 4.07Å; M892-M964 HydrophobicContact CE-CE 4.16Å; M892-M964 HydrophobicContact SD-CE 4.36Å
893	Y	94.7	Very high	92.5	Very high	15 Å²	15	38.3 Å²	38.3	6%	0.059	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	142.4	180	-54.1	-91.2	0	0	0	111.7	F876 I882 I883 K891 Y918 F919 V942 Y943	F876-Y893 HydrophobicContact CE2-CD1 4.47Å; F876-Y893 AromaticContact CE2-CE1 3.99Å; F876-Y893 HydrophobicContact CE2-CE1 3.99Å; F876-Y893 AromaticContact CZ-CE1 3.99Å; F876-Y893 HydrophobicContact CZ-CE1 3.99Å; I882-Y893 HydrophobicContact CG2-CD1 4.41Å; I882-Y893 HydrophobicContact CG2-CD2 4.04Å; I882-Y893 HydrophobicContact CG2-CE1 4.01Å; I882-Y893 HydrophobicContact CG2-CE2 3.57Å; I882-Y893 HydrophobicContact CG2-CG 4.4Å; I882-Y893 PolarHBondContact O-OH 3.29Å; I883-Y893 HydrophobicContact CD1-CD2 4.25Å; I883-Y893 HydrophobicContact CD1-CE2 4.12Å; I883-Y893 HydrophobicContact CG1-CD2 4.47Å; I883-Y893 HydrophobicContact CG1-CE2 3.93Å; K891-Y893 HydrophobicContact CD-CE1 4.39Å; K891-Y893 VanDerWaalsContact CE-CE1 3.45Å; K891-Y893 VanDerWaalsContact CE-CZ 3.44Å; K891-Y893 WeakPolarHBondContact CE-OH 3.49Å; K891-Y893 HydrophobicContact CG-CE1 4.47Å; K891-Y893 HydrophobicContact CG-CE2 4.5Å; Y893-Y918 CarbonylContact O-C 3.41Å; Y893-Y918 VanDerWaalsContact O-CA 3.27Å; Y893-Y918 WeakPolarHBondContact O-CA 3.4Å; Y893-Y918 WeakPolarHBondContact O-CB 3.17Å; Y893-F919 AromaticContact CD2-CD2 3.95Å; Y893-F919 HydrophobicContact CD2-CD2 3.95Å; Y893-F919 AromaticContact CD2-CE2 3.34Å; Y893-F919 HydrophobicContact CD2-CE2 3.34Å; Y893-F919 AromaticContact CD2-CZ 3.93Å; Y893-F919 HydrophobicContact CD2-CZ 3.93Å; Y893-F919 HydrophobicContact CE2-CE2 4.07Å; Y893-F919 AromaticContact CG-CE2 3.87Å; Y893-F919 HydrophobicContact CG-CE2 3.87Å; Y893-F919 AromaticContact CG-CZ 3.98Å; Y893-F919 HydrophobicContact CG-CZ 3.98Å; Y893-F919 PolarHBondContact N-O 3.4Å; Y893-F919 PolarHBondContact O-N 3.27Å; Y893-V942 HydrophobicContact CD1-CG2 3.9Å; Y893-Y943 CarbonylContact C-O 3.2Å; Y893-Y943 WeakPolarHBondContact CA-O 3.5Å
894	F	92.7	Very high	91.9	Very high	2 Å²	2	40.2 Å²	40.2	1%	0.009	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	132.7	170.5	-57.5	-97.1	0	0	0	109	L849 V853 F856 L871 M892 Y918 V942 Y943 L945	L849-F894 HydrophobicContact CD1-CB 3.93Å; L849-F894 HydrophobicContact CD2-CB 3.88Å; L849-F894 HydrophobicContact CD2-CG 4.44Å; L849-F894 HydrophobicContact CG-CB 4.29Å; V853-F894 HydrophobicContact CG1-CD1 4.43Å; V853-F894 HydrophobicContact CG2-CD1 4.3Å; F856-F894 AromaticContact CE2-CD1 3.91Å; F856-F894 HydrophobicContact CE2-CD1 3.91Å; F856-F894 AromaticContact CE2-CE1 3.73Å; F856-F894 HydrophobicContact CE2-CE1 3.73Å; F856-F894 HydrophobicContact CE2-CZ 4.34Å; F856-F894 HydrophobicContact CZ-CD1 4.13Å; F856-F894 AromaticContact CZ-CE1 3.5Å; F856-F894 HydrophobicContact CZ-CE1 3.5Å; F856-F894 VanDerWaalsContact CZ-CE1 3.5Å; F856-F894 AromaticContact CZ-CZ 3.74Å; F856-F894 HydrophobicContact CZ-CZ 3.74Å; L871-F894 HydrophobicContact CD2-CD2 3.9Å; L871-F894 HydrophobicContact CD2-CE2 3.87Å; M892-F894 HydrophobicContact CE-CD1 4.43Å; M892-F894 HydrophobicContact CE-CD2 4.39Å; M892-F894 HydrophobicContact CE-CE1 3.77Å; M892-F894 HydrophobicContact CE-CE2 3.73Å; M892-F894 HydrophobicContact CE-CZ 3.38Å; M892-F894 HydrophobicContact CG-CE2 4.26Å; M892-F894 HydrophobicContact SD-CE2 4.1Å; M892-F894 HydrophobicContact SD-CZ 3.97Å; F894-Y918 HydrophobicContact CD1-CG 4.23Å; F894-Y918 HydrophobicContact CE1-CG 4.3Å; F894-V942 CarbonylContact O-C 3.56Å; F894-V942 VanDerWaalsContact O-CA 3.28Å; F894-V942 WeakPolarHBondContact O-CA 3.07Å; F894-V942 WeakPolarHBondContact O-CB 3.33Å; F894-Y943 PolarHBondContact N-O 3.11Å; F894-Y943 PolarHBondContact O-N 3.24Å; F894-L945 HydrophobicContact CE2-CB 4.09Å; F894-L945 HydrophobicContact CE2-CD2 4.11Å
895	I	93.5	Very high	91.3	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	117.3	-176.4	-52.6	-179	0	0	0	109.9	L849 G898 V900 L913 G916 S917 F919 V942	L849-I895 VanDerWaalsContact CD1-O 3.26Å; L849-I895 WeakPolarHBondContact CD1-O 3.47Å; I895-G898 WeakPolarHBondContact CG2-O 3.44Å; I895-V900 HydrophobicContact CD1-CG1 4.33Å; I895-V900 HydrophobicContact CD1-CG2 3.65Å; I895-L913 HydrophobicContact CD1-CB 3.96Å; I895-G916 PolarHBondContact O-N 2.8Å; I895-S917 PolarHBondContact N-O 3.02Å; I895-F919 HydrophobicContact CD1-CD1 4.06Å; I895-F919 HydrophobicContact CD1-CE1 3.88Å; I895-F919 HydrophobicContact CG1-CD1 4.09Å; I895-F919 HydrophobicContact CG1-CE1 3.74Å; I895-V942 HydrophobicContact CG1-CG1 4.47Å
896	Q	91.1	Very high	90.6	Very high	55 Å²	55	48 Å²	48	26%	0.257	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	-44.5	172.4	-175.2	-177.6	6.2	0	0	111.3	L849 N941 Y943	L849-Q896 HydrophobicContact CD1-CB 4.15Å; Q896-N941 WeakPolarHBondContact CB-O 3.4Å; Q896-N941 PolarHBondContact N-O 3.28Å; Q896-Y943 HydrophobicContact CB-CD2 4.31Å; Q896-Y943 HydrophobicContact CB-CE2 4.17Å; Q896-Y943 HydrophobicContact CG-CE2 4.33Å
897	E	92.5	Very high	90	Very high	91 Å²	91	48.9 Å²	48.9	43%	0.425	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.7	125.8	-176.5	173.3	-173.9	-156.7	0	0	108.3	D915 C940 N941	E897-D915 WeakPolarHBondContact CA-OD1 3.4Å; E897-C940 WeakPolarHBondContact O-CA 3.49Å; E897-N941 HydrophobicContact CB-CB 4.2Å; E897-N941 PolarHBondContact N-O 2.86Å; E897-N941 PolarHBondContact O-N 2.98Å; E897-N941 PolarHBondContact OE2-ND2 3.18Å
898	G	93.5	Very high	89.6	Confident	8 Å²	8	53.1 Å²	53.1	8%	0.082	28%	0.275	C	S	.	.			trans	124.9	173.7	175.3	0	0	0	0	0	114.6	I895 D915 T938	I895-G898 WeakPolarHBondContact CG2-O 3.44Å; G898-D915 PolarHBondContact N-OD1 3.47Å; G898-D915 PolarHBondContact O-N 3.46Å; G898-T938 WeakPolarHBondContact CA-OG1 3.43Å
899	I	96.4	Very high	89.4	Confident	59 Å²	59	50.3 Å²	50.3	30%	0.303	26%	0.264	S	S	.	.			trans	-122.7	135.1	-175.5	-52.3	175.2	0	0	0	110.2	L913 E937 T938 C940	I899-L913 WeakPolarHBondContact CA-O 3.25Å; I899-E937 HydrophobicContact CB-CB 4.35Å; I899-E937 HydrophobicContact CG2-CB 4.41Å; I899-E937 VanDerWaalsContact CG2-OE2 3.26Å; I899-E937 WeakPolarHBondContact CG2-OE2 3.15Å; I899-E937 PolarHBondContact O-N 2.75Å; I899-T938 HydrophobicContact CB-CG2 4.5Å; I899-T938 PolarHBondContact N-OG1 2.85Å; I899-T938 PolarHBondContact O-N 2.9Å; I899-C940 PolarHBondContact O-SG 3.44Å
900	V	96.8	Very high	89.2	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	134.8	176.8	-53.6	0	0	0	0	111.8	I882 I895 S912 L913 F919 V934 R935 C940	I882-V900 HydrophobicContact CD1-CG1 3.68Å; I895-V900 HydrophobicContact CD1-CG1 4.33Å; I895-V900 HydrophobicContact CD1-CG2 3.65Å; V900-S912 CarbonylContact O-C 3.57Å; V900-S912 VanDerWaalsContact O-CA 3.27Å; V900-S912 WeakPolarHBondContact O-CA 3.49Å; V900-L913 HydrophobicContact CG2-CB 3.88Å; V900-L913 PolarHBondContact N-O 3.14Å; V900-L913 PolarHBondContact O-N 3.47Å; V900-F919 HydrophobicContact CG1-CE1 4.35Å; V900-F919 HydrophobicContact CG2-CD1 4.08Å; V900-F919 HydrophobicContact CG2-CE1 3.82Å; V900-F919 HydrophobicContact CG2-CZ 4.43Å; V900-V934 HydrophobicContact CB-CG1 3.76Å; V900-V934 HydrophobicContact CG2-CG1 3.67Å; V900-R935 CarbonylContact C-O 3.47Å; V900-R935 WeakPolarHBondContact CA-O 3.48Å; V900-R935 WeakPolarHBondContact CB-O 3.32Å; V900-C940 HydrophobicContact CG1-CB 4.34Å; V900-C940 VanDerWaalsContact CG1-SG 3.56Å
901	D	95.1	Very high	89.1	Confident	13 Å²	13	52.3 Å²	52.3	7%	0.07	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	134.5	172.3	-66.8	-38.1	0	0	0	111.3	V903 V909 S912 V934 R935	D901-V903 HydrophobicContact CB-CG2 3.89Å; D901-V909 HydrophobicContact CB-CG1 3.94Å; D901-V909 HydrophobicContact CB-CG2 4.1Å; D901-S912 PolarHBondContact OD1-OG 3.19Å; D901-V934 CarbonylContact O-C 3.58Å; D901-V934 VanDerWaalsContact O-CA 3.27Å; D901-V934 WeakPolarHBondContact O-CA 3.48Å; D901-R935 HydrophobicContact CB-CB 4.48Å; D901-R935 PolarHBondContact N-O 3.09Å; D901-R935 PolarHBondContact O-N 3.21Å; D901-R935 IonicContact OD2-CZ 2.82Å; D901-R935 IonicContact OD2-NE 2.68Å; D901-R935 PolarHBondContact OD2-NE 3.23Å; D901-R935 IonicContact OD2-NH2 3.37Å; D901-R935 PolarHBondContact OD2-NH2 3.04Å
902	I	92.4	Very high	89.1	Confident	29 Å²	29	52.8 Å²	52.8	15%	0.149	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	115.2	161	-55.6	-169.7	0	0	0	108.1	A910 T911 L913 A932 S933 V934	I902-A910 PolarHBondContact O-N 2.77Å; I902-T911 HydrophobicContact CB-CG2 4.06Å; I902-T911 WeakPolarHBondContact CB-O 3.37Å; I902-T911 HydrophobicContact CD1-CG2 3.79Å; I902-T911 HydrophobicContact CG1-CG2 4.04Å; I902-T911 PolarHBondContact N-O 3.19Å; I902-L913 HydrophobicContact CD1-CD1 3.96Å; I902-L913 HydrophobicContact CD1-CG 4.23Å; I902-L913 HydrophobicContact CG1-CD1 4.44Å; I902-L913 HydrophobicContact CG1-CG 4.48Å; I902-A932 HydrophobicContact CG2-CB 3.65Å; I902-S933 WeakPolarHBondContact CA-O 3.48Å; I902-V934 HydrophobicContact CG1-CG2 4.48Å
903	V	90	Very high	89.1	Confident	14 Å²	14	54 Å²	54	9%	0.085	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	132.8	-173.3	-170.9	0	0	0	0	110.4	D901 E908 V909 S933 R935	D901-V903 HydrophobicContact CB-CG2 3.89Å; V903-E908 WeakPolarHBondContact CA-O 3.47Å; V903-V909 HydrophobicContact CG2-CG2 4.5Å; V903-S933 PolarHBondContact N-O 3.31Å; V903-S933 PolarHBondContact O-N 3.12Å; V903-S933 VanDerWaalsContact O-N 3.08Å; V903-R935 HydrophobicContact CG2-CB 4.25Å
904	T	81.3	Confident	89	Confident	48 Å²	48	56.3 Å²	56.3	29%	0.294	32%	0.316	S	S	.	.			trans	-78.6	-177.7	176.9	69.8	0	0	0	0	112	D906 G907 E908 A910	T904-D906 PolarHBondContact O-N 3.33Å; T904-D906 PolarHBondContact OG1-N 2.82Å; T904-D906 PolarHBondContact OG1-OD2 2.91Å; T904-G907 PolarHBondContact O-N 2.78Å; T904-E908 PolarHBondContact N-O 2.89Å; T904-E908 PolarHBondContact OG1-O 3.35Å; T904-A910 HydrophobicContact CG2-CB 3.94Å
905	R	79.6	Confident	88.9	Confident	185 Å²	185	60.2 Å²	60.2	70%	0.698	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-33.2	173.7	-69.2	-173.8	175.8	-167.2	-2	112.7	E885 G907	E885-R905 IonicContact OE1-CZ 3.32Å; E885-R905 VanDerWaalsContact OE1-CZ 3.32Å; E885-R905 IonicContact OE1-NE 3.07Å; E885-R905 PolarHBondContact OE1-NE 3.46Å; E885-R905 IonicContact OE1-NH2 2.72Å; E885-R905 PolarHBondContact OE1-NH2 3.31Å; E885-R905 WeakPolarHBondContact OE2-CG 3.34Å; E885-R905 IonicContact OE2-CZ 3.88Å; E885-R905 IonicContact OE2-NE 2.93Å; E885-R905 PolarHBondContact OE2-NE 3.13Å; E885-R905 IonicContact OE2-NH2 3.95Å; R905-G907 PolarHBondContact O-N 2.93Å
906	D	76.5	Confident	88.6	Confident	138 Å²	138	60.5 Å²	60.5	74%	0.738	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.5	-2.3	-172.9	-41.9	-77.4	0	0	0	111.7	T904 E908	T904-D906 PolarHBondContact O-N 3.33Å; T904-D906 PolarHBondContact OG1-N 2.82Å; T904-D906 PolarHBondContact OG1-OD2 2.91Å; D906-E908 VanDerWaalsContact C-N 3.29Å
907	G	77	Confident	88.6	Confident	48 Å²	48	59.2 Å²	59.2	50%	0.495	34%	0.337	S	S	.	.	S	Bend	trans	85.5	-3.6	-179.4	0	0	0	0	0	114.2	T904 R905	T904-G907 PolarHBondContact O-N 2.78Å; R905-G907 PolarHBondContact O-N 2.93Å
908	E	83.3	Confident	88.5	Confident	143 Å²	143	55.7 Å²	55.7	67%	0.668	32%	0.32	S	S	*	.			trans	-72.7	143.5	177	-60.2	-163.4	148	0	0	111.6	V903 T904 D906 A910	V903-E908 WeakPolarHBondContact CA-O 3.47Å; T904-E908 PolarHBondContact N-O 2.89Å; T904-E908 PolarHBondContact OG1-O 3.35Å; D906-E908 VanDerWaalsContact C-N 3.29Å; E908-A910 PolarHBondContact O-N 2.97Å
909	V	86.8	Confident	88.5	Confident	64 Å²	64	55.5 Å²	55.5	39%	0.388	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	110.9	172.8	179.2	0	0	0	0	108	D901 V903	D901-V909 HydrophobicContact CB-CG1 3.94Å; D901-V909 HydrophobicContact CB-CG2 4.1Å; V903-V909 HydrophobicContact CG2-CG2 4.5Å
910	A	83.7	Confident	88.2	Confident	68 Å²	68	53.4 Å²	53.4	56%	0.562	31%	0.31	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.7	-35.9	179.2	0	0	0	0	0	112.1	I902 T904 E908	I902-A910 PolarHBondContact O-N 2.77Å; T904-A910 HydrophobicContact CG2-CB 3.94Å; E908-A910 PolarHBondContact O-N 2.97Å
911	T	89.2	Confident	87.8	Confident	72 Å²	72	53.6 Å²	53.6	44%	0.442	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-168.6	158.5	175.5	-172.7	0	0	0	0	109.3	I902	I902-T911 HydrophobicContact CB-CG2 4.06Å; I902-T911 WeakPolarHBondContact CB-O 3.37Å; I902-T911 HydrophobicContact CD1-CG2 3.79Å; I902-T911 HydrophobicContact CG1-CG2 4.04Å; I902-T911 PolarHBondContact N-O 3.19Å
912	S	92.7	Very high	87.5	Confident	57 Å²	57	53.6 Å²	53.6	40%	0.399	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	141.2	173.5	-47	0	0	0	0	109.6	V900 D901	V900-S912 CarbonylContact O-C 3.57Å; V900-S912 VanDerWaalsContact O-CA 3.27Å; V900-S912 WeakPolarHBondContact O-CA 3.49Å; D901-S912 PolarHBondContact OD1-OG 3.19Å
913	L	92.7	Very high	87.2	Confident	26 Å²	26	52.5 Å²	52.5	14%	0.136	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	135.2	-177.4	-63.7	-178.2	0	0	0	110.5	I895 I899 V900 I902 F919	I895-L913 HydrophobicContact CD1-CB 3.96Å; I899-L913 WeakPolarHBondContact CA-O 3.25Å; V900-L913 HydrophobicContact CG2-CB 3.88Å; V900-L913 PolarHBondContact N-O 3.14Å; V900-L913 PolarHBondContact O-N 3.47Å; I902-L913 HydrophobicContact CD1-CD1 3.96Å; I902-L913 HydrophobicContact CD1-CG 4.23Å; I902-L913 HydrophobicContact CG1-CD1 4.44Å; I902-L913 HydrophobicContact CG1-CG 4.48Å; L913-F919 HydrophobicContact CD1-CB 4Å; L913-F919 HydrophobicContact CD1-CD1 4.33Å
914	S	92.7	Very high	87.1	Confident	62 Å²	62	51.9 Å²	51.9	43%	0.434	30%	0.301	S	S	.	.			trans	-109	178.4	178.1	61.9	0	0	0	0	112.7	S917	S914-S917 WeakPolarHBondContact O-CB 3.25Å; S914-S917 PolarHBondContact O-N 3.24Å; S914-S917 PolarHBondContact O-OG 2.91Å
915	D	90.9	Very high	87.3	Confident	85 Å²	85	50.5 Å²	50.5	46%	0.455	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-25.6	130.8	163	-56.9	20.3	0	0	0	113.6	E897 G898 S917	E897-D915 WeakPolarHBondContact CA-OD1 3.4Å; G898-D915 PolarHBondContact N-OD1 3.47Å; G898-D915 PolarHBondContact O-N 3.46Å; D915-S917 PolarHBondContact O-N 3.33Å
916	G	87	Confident	87.4	Confident	6 Å²	6	42.8 Å²	42.8	6%	0.062	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	81.2	-10.8	-176.4	0	0	0	0	0	114.9	V853 I895	V853-G916 WeakPolarHBondContact CA-O 3.42Å; V853-G916 VanDerWaalsContact CG2-O 3.28Å; V853-G916 WeakPolarHBondContact CG2-O 3.26Å; I895-G916 PolarHBondContact O-N 2.8Å
917	S	90.7	Very high	87.4	Confident	27 Å²	27	41.1 Å²	41.1	19%	0.189	26%	0.257	C	S	.	.			trans	-79.5	160.7	170.8	-54.6	0	0	0	0	112.1	I895 S914 D915	I895-S917 PolarHBondContact N-O 3.02Å; S914-S917 WeakPolarHBondContact O-CB 3.25Å; S914-S917 PolarHBondContact O-N 3.24Å; S914-S917 PolarHBondContact O-OG 2.91Å; D915-S917 PolarHBondContact O-N 3.33Å
918	Y	91.4	Very high	87.7	Confident	17 Å²	17	40.6 Å²	40.6	7%	0.067	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	152	171.4	65.6	-93.8	0	0	0	111	V853 F855 M892 Y893 F894 E921 M964 R971	V853-Y918 HydrophobicContact CG1-CD1 4.08Å; V853-Y918 HydrophobicContact CG1-CE1 4.47Å; F855-Y918 HydrophobicContact CB-CE1 3.91Å; F855-Y918 HydrophobicContact CG-CE1 4.47Å; M892-Y918 HydrophobicContact CE-CD2 3.78Å; M892-Y918 HydrophobicContact CE-CG 4.28Å; Y893-Y918 CarbonylContact O-C 3.41Å; Y893-Y918 VanDerWaalsContact O-CA 3.27Å; Y893-Y918 WeakPolarHBondContact O-CA 3.4Å; Y893-Y918 WeakPolarHBondContact O-CB 3.17Å; F894-Y918 HydrophobicContact CD1-CG 4.23Å; F894-Y918 HydrophobicContact CE1-CG 4.3Å; Y918-E921 HydrophobicContact CE2-CG 4.1Å; Y918-M964 HydrophobicContact CE2-CE 4.33Å; Y918-R971 PolarHBondContact O-NH1 3.38Å; Y918-R971 PolarHBondContact O-NH2 3.05Å; Y918-R971 VanDerWaalsContact O-NH2 3.15Å
919	F	92.2	Very high	88	Confident	4 Å²	4	41.1 Å²	41.1	2%	0.018	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	156.6	-175	62.8	-93.9	0	0	0	113.6	I882 I883 Y893 I895 V900 L913 E921 V934	I882-F919 HydrophobicContact CB-CE2 4.42Å; I882-F919 HydrophobicContact CB-CZ 4.5Å; I882-F919 HydrophobicContact CD1-CZ 4.01Å; I882-F919 HydrophobicContact CG2-CE2 3.9Å; I882-F919 HydrophobicContact CG2-CZ 3.97Å; I883-F919 HydrophobicContact CD1-CD2 3.62Å; I883-F919 HydrophobicContact CD1-CE2 3.87Å; I883-F919 HydrophobicContact CG1-CD2 4.44Å; I883-F919 HydrophobicContact CG1-CE2 4.23Å; Y893-F919 AromaticContact CD2-CD2 3.95Å; Y893-F919 HydrophobicContact CD2-CD2 3.95Å; Y893-F919 AromaticContact CD2-CE2 3.34Å; Y893-F919 HydrophobicContact CD2-CE2 3.34Å; Y893-F919 AromaticContact CD2-CZ 3.93Å; Y893-F919 HydrophobicContact CD2-CZ 3.93Å; Y893-F919 HydrophobicContact CE2-CE2 4.07Å; Y893-F919 AromaticContact CG-CE2 3.87Å; Y893-F919 HydrophobicContact CG-CE2 3.87Å; Y893-F919 AromaticContact CG-CZ 3.98Å; Y893-F919 HydrophobicContact CG-CZ 3.98Å; Y893-F919 PolarHBondContact N-O 3.4Å; Y893-F919 PolarHBondContact O-N 3.27Å; I895-F919 HydrophobicContact CD1-CD1 4.06Å; I895-F919 HydrophobicContact CD1-CE1 3.88Å; I895-F919 HydrophobicContact CG1-CD1 4.09Å; I895-F919 HydrophobicContact CG1-CE1 3.74Å; V900-F919 HydrophobicContact CG1-CE1 4.35Å; V900-F919 HydrophobicContact CG2-CD1 4.08Å; V900-F919 HydrophobicContact CG2-CE1 3.82Å; V900-F919 HydrophobicContact CG2-CZ 4.43Å; L913-F919 HydrophobicContact CD1-CB 4Å; L913-F919 HydrophobicContact CD1-CD1 4.33Å; F919-E921 VanDerWaalsContact CA-OE2 3.25Å; F919-E921 WeakPolarHBondContact CA-OE2 3.29Å; F919-V934 HydrophobicContact CD2-CB 4.29Å; F919-V934 HydrophobicContact CD2-CG1 4.01Å; F919-V934 HydrophobicContact CD2-CG2 3.97Å; F919-V934 HydrophobicContact CE1-CG1 4.43Å; F919-V934 HydrophobicContact CE2-CB 4.17Å; F919-V934 HydrophobicContact CE2-CG1 3.76Å; F919-V934 HydrophobicContact CE2-CG2 4.36Å; F919-V934 HydrophobicContact CG-CG1 4.44Å; F919-V934 HydrophobicContact CZ-CG1 3.99Å
920	G	90.4	Very high	88.1	Confident	15 Å²	15	39 Å²	39	16%	0.155	23%	0.228	C	C	.	.			trans	91.4	6.7	176.2	0	0	0	0	0	115	C923 R930	G920-C923 PolarHBondContact O-SG 2.68Å; G920-R930 PolarHBondContact O-NH1 2.96Å
921	E	88.3	Confident	88.3	Confident	4 Å²	4	36.9 Å²	36.9	2%	0.019	21%	0.208	C	C	.	.			trans	-64.8	-37.3	177.7	68.9	-65.4	156.4	0	0	113.7	M892 Y918 F919 C923 L924 L925 R971	M892-E921 HydrophobicContact CE-CB 4.22Å; M892-E921 HydrophobicContact SD-CB 4.38Å; Y918-E921 HydrophobicContact CE2-CG 4.1Å; F919-E921 VanDerWaalsContact CA-OE2 3.25Å; F919-E921 WeakPolarHBondContact CA-OE2 3.29Å; E921-C923 VanDerWaalsContact C-N 3.31Å; E921-C923 PolarHBondContact O-N 3.09Å; E921-C923 VanDerWaalsContact O-N 3.17Å; E921-L924 WeakPolarHBondContact O-CB 3.35Å; E921-L924 PolarHBondContact O-N 3.25Å; E921-L925 PolarHBondContact O-N 2.73Å; E921-R971 WeakPolarHBondContact OE1-CD 3.12Å; E921-R971 IonicContact OE1-CZ 3.8Å; E921-R971 IonicContact OE1-NE 3.33Å; E921-R971 IonicContact OE1-NH1 2.68Å; E921-R971 PolarHBondContact OE1-NH1 2.9Å; E921-R971 IonicContact OE2-NH1 2.67Å; E921-R971 PolarHBondContact OE2-NH1 2.92Å
922	I	88.4	Confident	88.2	Confident	14 Å²	14	34.2 Å²	34.2	7%	0.072	19%	0.194	C	C	.	.	H	α-helix	trans	-53	-45.2	-171.7	-64.7	164.5	0	0	0	112.2	L924 L925 T926 V931 A968 R971 L972	I922-L924 VanDerWaalsContact C-N 3.32Å; I922-L924 PolarHBondContact O-N 3.2Å; I922-L925 PolarHBondContact O-N 3.3Å; I922-T926 HydrophobicContact CG2-CG2 4.01Å; I922-T926 WeakPolarHBondContact O-CB 3.4Å; I922-T926 VanDerWaalsContact O-CG2 3.23Å; I922-T926 WeakPolarHBondContact O-CG2 3.36Å; I922-T926 PolarHBondContact O-N 3.45Å; I922-T926 PolarHBondContact O-OG1 2.92Å; I922-V931 HydrophobicContact CD1-CG2 3.87Å; I922-V931 HydrophobicContact CG2-CG1 4.29Å; I922-V931 HydrophobicContact CG2-CG2 4.43Å; I922-A968 HydrophobicContact CG1-CB 3.96Å; I922-R971 HydrophobicContact CD1-CB 4.09Å; I922-L972 HydrophobicContact CD1-CG 4.28Å; I922-L972 HydrophobicContact CG2-CD1 3.99Å; I922-L972 HydrophobicContact CG2-CD2 4.04Å; I922-L972 HydrophobicContact CG2-CG 4.06Å
923	C	87.6	Confident	88.2	Confident	5 Å²	5	32.4 Å²	32.4	3%	0.034	18%	0.181	C	C	.	.	H	α-helix	trans	-73.1	-20.6	-179.2	60.4	0	0	0	0	114.1	G920 E921 T926 N927 A928 R930	G920-C923 PolarHBondContact O-SG 2.68Å; E921-C923 VanDerWaalsContact C-N 3.31Å; E921-C923 PolarHBondContact O-N 3.09Å; E921-C923 VanDerWaalsContact O-N 3.17Å; C923-T926 WeakPolarHBondContact CA-OG1 3.44Å; C923-N927 WeakPolarHBondContact O-CA 3.17Å; C923-N927 PolarHBondContact O-N 2.97Å; C923-A928 WeakPolarHBondContact CB-O 3.25Å; C923-R930 PolarHBondContact SG-NH1 3.13Å
924	L	87.4	Confident	88.3	Confident	1 Å²	1	31.5 Å²	31.5	1%	0.005	18%	0.177	C	C	.	.	H	α-helix	trans	-74.1	-36.5	176.3	-55.6	-172.4	0	0	0	110.8	M892 E921 I922 R947 F950	M892-L924 HydrophobicContact CB-CD1 3.71Å; M892-L924 HydrophobicContact CG-CD1 3.79Å; M892-L924 HydrophobicContact SD-CD1 4.2Å; E921-L924 WeakPolarHBondContact O-CB 3.35Å; E921-L924 PolarHBondContact O-N 3.25Å; I922-L924 VanDerWaalsContact C-N 3.32Å; I922-L924 PolarHBondContact O-N 3.2Å; L924-R947 HydrophobicContact CD2-CB 3.89Å; L924-R947 HydrophobicContact CD2-CG 4.07Å; L924-F950 HydrophobicContact CB-CD1 3.66Å; L924-F950 HydrophobicContact CB-CE1 3.58Å; L924-F950 HydrophobicContact CD1-CB 4.25Å; L924-F950 HydrophobicContact CD1-CD1 3.55Å; L924-F950 HydrophobicContact CD1-CD2 4.42Å; L924-F950 HydrophobicContact CD1-CE1 3.86Å; L924-F950 HydrophobicContact CD1-CG 3.83Å; L924-F950 HydrophobicContact CD1-CZ 4.41Å; L924-F950 HydrophobicContact CG-CD1 4.26Å; L924-F950 HydrophobicContact CG-CE1 4.38Å
925	L	84.4	Confident	88.5	Confident	19 Å²	19	32.6 Å²	32.6	10%	0.099	17%	0.171	C	C	.	.	H	α-helix	trans	-79.9	-51.3	177.6	-59.6	172.5	0	0	0	111.9	E921 I922 N927 F950 L954 M964 E965 A968 V982	E921-L925 PolarHBondContact O-N 2.73Å; I922-L925 PolarHBondContact O-N 3.3Å; L925-N927 PolarHBondContact O-N 2.8Å; L925-F950 HydrophobicContact CD2-CE1 3.86Å; L925-F950 HydrophobicContact CD2-CZ 4.23Å; L925-F950 HydrophobicContact CG-CE1 4.28Å; L925-L954 HydrophobicContact CD2-CD1 3.89Å; L925-M964 HydrophobicContact CD1-CB 4.04Å; L925-E965 HydrophobicContact CD1-CG 4.21Å; L925-E965 HydrophobicContact CD2-CG 4.4Å; L925-A968 HydrophobicContact CD1-CB 3.89Å; L925-V982 HydrophobicContact CB-CG1 4.41Å; L925-V982 HydrophobicContact CD1-CG1 4.47Å
926	T	81.5	Confident	88.8	Confident	23 Å²	23	28.6 Å²	28.6	14%	0.141	15%	0.15	C	C	.	.	H	α-helix	trans	-75.5	-17.2	-174	56.5	0	0	0	0	114.7	I922 C923 A928 V981 V982	I922-T926 HydrophobicContact CG2-CG2 4.01Å; I922-T926 WeakPolarHBondContact O-CB 3.4Å; I922-T926 VanDerWaalsContact O-CG2 3.23Å; I922-T926 WeakPolarHBondContact O-CG2 3.36Å; I922-T926 PolarHBondContact O-N 3.45Å; I922-T926 PolarHBondContact O-OG1 2.92Å; C923-T926 WeakPolarHBondContact CA-OG1 3.44Å; T926-A928 PolarHBondContact O-N 2.84Å; T926-A928 VanDerWaalsContact O-N 3.14Å; T926-A928 VanDerWaalsContact OG1-CB 3.27Å; T926-A928 WeakPolarHBondContact OG1-CB 3.45Å; T926-A928 PolarHBondContact OG1-N 3.4Å; T926-V981 HydrophobicContact CG2-CG1 4.03Å; T926-V982 HydrophobicContact CG2-CB 4.36Å; T926-V982 HydrophobicContact CG2-CG2 3.95Å
927	N	78.3	Confident	89.2	Confident	104 Å²	104	33.2 Å²	33.2	56%	0.556	17%	0.17	S	C	*	.			trans	58.5	6.2	-160.2	-59	-72.5	0	0	0	115.5	C923 L925 R947	C923-N927 WeakPolarHBondContact O-CA 3.17Å; C923-N927 PolarHBondContact O-N 2.97Å; L925-N927 PolarHBondContact O-N 2.8Å; N927-R947 PolarHBondContact OD1-NH1 3.26Å; N927-R947 PolarHBondContact OD1-NH2 3.07Å
928	A	81.4	Confident	89.4	Confident	36 Å²	36	34.5 Å²	34.5	30%	0.298	18%	0.177	S	C	.	.	P	Polyproline II helix	trans	-77.3	170.2	-177.8	0	0	0	0	0	112.6	C923 T926	C923-A928 WeakPolarHBondContact CB-O 3.25Å; T926-A928 PolarHBondContact O-N 2.84Å; T926-A928 VanDerWaalsContact O-N 3.14Å; T926-A928 VanDerWaalsContact OG1-CB 3.27Å; T926-A928 WeakPolarHBondContact OG1-CB 3.45Å; T926-A928 PolarHBondContact OG1-N 3.4Å
929	R	89.4	Confident	89.7	Confident	155 Å²	155	37.2 Å²	37.2	59%	0.585	19%	0.187	S	C	*	.	B	Isolated β-bridge	trans	-68	154.9	168.8	-69.7	168.2	179.5	-86.4	0.5	110.5	G886 T887 V931	G886-R929 VanDerWaalsContact O-CD 3.25Å; G886-R929 WeakPolarHBondContact O-CD 3.47Å; G886-R929 WeakPolarHBondContact O-CG 3.29Å; G886-R929 PolarHBondContact O-NH1 2.71Å; T887-R929 CarbonylContact O-C 3.42Å; T887-R929 VanDerWaalsContact O-CA 3.3Å; T887-R929 WeakPolarHBondContact O-CA 3.41Å; T887-R929 WeakPolarHBondContact O-CB 3.27Å; R929-V931 PolarHBondContact O-N 3.43Å
930	R	90.6	Very high	89.8	Confident	18 Å²	18	37 Å²	37	7%	0.068	19%	0.187	C	C	.	.	P	Polyproline II helix	trans	-53.6	129.7	175.9	-62.5	-72.8	-156.7	-171.4	7.3	110	I883 E885 G886 T887 K891 G920 C923	I883-R930 HydrophobicContact CG2-CB 3.8Å; I883-R930 HydrophobicContact CG2-CG 3.63Å; E885-R930 WeakPolarHBondContact CG-O 3.16Å; G886-R930 PolarHBondContact N-O 2.89Å; T887-R930 WeakPolarHBondContact O-CG 3.38Å; T887-R930 PolarHBondContact O-N 3.15Å; T887-R930 WeakPolarHBondContact OG1-CG 3.48Å; K891-R930 VanDerWaalsContact O-CZ 3.3Å; K891-R930 PolarHBondContact O-NH1 3.29Å; K891-R930 PolarHBondContact O-NH2 3.17Å; G920-R930 PolarHBondContact O-NH1 2.96Å; C923-R930 PolarHBondContact SG-NH1 3.13Å
931	V	86.8	Confident	90	Very high	24 Å²	24	36.4 Å²	36.4	15%	0.145	18%	0.18	C	C	.	.	S	Bend	trans	-92	-17.1	-169	-61	0	0	0	0	115.2	I922 R929 L972 I975 R977	I922-V931 HydrophobicContact CD1-CG2 3.87Å; I922-V931 HydrophobicContact CG2-CG1 4.29Å; I922-V931 HydrophobicContact CG2-CG2 4.43Å; R929-V931 PolarHBondContact O-N 3.43Å; V931-L972 HydrophobicContact CB-CD2 4.44Å; V931-L972 HydrophobicContact CG1-CD2 4Å; V931-L972 HydrophobicContact CG2-CD2 4.33Å; V931-I975 HydrophobicContact CG2-CD1 4.39Å; V931-R977 PolarHBondContact O-NH2 3.19Å
932	A	87.9	Confident	90.3	Very high	16 Å²	16	36.2 Å²	36.2	13%	0.132	18%	0.179	C	C	.	.	S	Bend	trans	-141.7	170.6	170.4	0	0	0	0	0	109.6	I902	I902-A932 HydrophobicContact CG2-CB 3.65Å
933	S	92.8	Very high	90.6	Very high	20 Å²	20	36.6 Å²	36.6	14%	0.14	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	152	168.5	-63.9	0	0	0	0	110.6	I883 E885 I902 V903	I883-S933 CarbonylContact O-C 3.54Å; I883-S933 VanDerWaalsContact O-CA 3.31Å; I883-S933 WeakPolarHBondContact O-CA 3.16Å; E885-S933 PolarHBondContact N-OG 3.43Å; I902-S933 WeakPolarHBondContact CA-O 3.48Å; V903-S933 PolarHBondContact N-O 3.31Å; V903-S933 PolarHBondContact O-N 3.12Å; V903-S933 VanDerWaalsContact O-N 3.08Å
934	V	95.3	Very high	90.9	Very high	7 Å²	7	36.5 Å²	36.5	4%	0.042	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	124.3	174.9	-174.6	0	0	0	0	109.6	L881 I882 I883 V900 D901 I902 F919	L881-V934 CarbonylContact C-O 3.56Å; I882-V934 PolarHBondContact N-O 3.07Å; I883-V934 HydrophobicContact CB-CB 3.95Å; I883-V934 HydrophobicContact CB-CG2 4.05Å; I883-V934 HydrophobicContact CD1-CG2 4.19Å; I883-V934 HydrophobicContact CG1-CB 4.4Å; I883-V934 HydrophobicContact CG1-CG2 4.44Å; I883-V934 PolarHBondContact N-O 2.84Å; I883-V934 VanDerWaalsContact N-O 3.1Å; I883-V934 PolarHBondContact O-N 2.92Å; V900-V934 HydrophobicContact CB-CG1 3.76Å; V900-V934 HydrophobicContact CG2-CG1 3.67Å; D901-V934 CarbonylContact O-C 3.58Å; D901-V934 VanDerWaalsContact O-CA 3.27Å; D901-V934 WeakPolarHBondContact O-CA 3.48Å; I902-V934 HydrophobicContact CG1-CG2 4.48Å; F919-V934 HydrophobicContact CD2-CB 4.29Å; F919-V934 HydrophobicContact CD2-CG1 4.01Å; F919-V934 HydrophobicContact CD2-CG2 3.97Å; F919-V934 HydrophobicContact CE1-CG1 4.43Å; F919-V934 HydrophobicContact CE2-CB 4.17Å; F919-V934 HydrophobicContact CE2-CG1 3.76Å; F919-V934 HydrophobicContact CE2-CG2 4.36Å; F919-V934 HydrophobicContact CG-CG1 4.44Å; F919-V934 HydrophobicContact CZ-CG1 3.99Å
935	R	95.8	Very high	91.2	Very high	85 Å²	85	36.6 Å²	36.6	32%	0.321	18%	0.179	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	134.5	-175.8	174.4	-176.9	68.4	-156.4	2.1	110	D880 L881 V900 D901 V903	D880-R935 CarbonylContact O-C 3.51Å; D880-R935 WeakPolarHBondContact O-CA 3.34Å; L881-R935 HydrophobicContact CD1-CB 4.46Å; V900-R935 CarbonylContact C-O 3.47Å; V900-R935 WeakPolarHBondContact CA-O 3.48Å; V900-R935 WeakPolarHBondContact CB-O 3.32Å; D901-R935 HydrophobicContact CB-CB 4.48Å; D901-R935 PolarHBondContact N-O 3.09Å; D901-R935 PolarHBondContact O-N 3.21Å; D901-R935 IonicContact OD2-CZ 2.82Å; D901-R935 IonicContact OD2-NE 2.68Å; D901-R935 PolarHBondContact OD2-NE 3.23Å; D901-R935 IonicContact OD2-NH2 3.37Å; D901-R935 PolarHBondContact OD2-NH2 3.04Å; V903-R935 HydrophobicContact CG2-CB 4.25Å
936	A	97.2	Very high	91.6	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	127.6	169.9	0	0	0	0	0	110.9	F876 Q877 G879 D880 I882	F876-A936 HydrophobicContact CB-CB 4.36Å; Q877-A936 VanDerWaalsContact O-CB 3.31Å; Q877-A936 WeakPolarHBondContact O-CB 3.44Å; G879-A936 WeakPolarHBondContact CA-O 3.3Å; G879-A936 PolarHBondContact N-O 3.14Å; D880-A936 PolarHBondContact O-N 2.75Å; I882-A936 HydrophobicContact CD1-CB 4.23Å; I882-A936 HydrophobicContact CG1-CB 4.47Å
937	E	95.4	Very high	92.1	Very high	104 Å²	104	41.1 Å²	41.1	49%	0.486	20%	0.196	S	C	.	.	S	Bend	trans	-85.4	-47	169.1	-174.7	-173	-162.4	0	0	110	P878 I899	P878-E937 WeakPolarHBondContact CB-O 3.47Å; I899-E937 HydrophobicContact CB-CB 4.35Å; I899-E937 HydrophobicContact CG2-CB 4.41Å; I899-E937 VanDerWaalsContact CG2-OE2 3.26Å; I899-E937 WeakPolarHBondContact CG2-OE2 3.15Å; I899-E937 PolarHBondContact O-N 2.75Å
938	T	95.9	Very high	92.7	Very high	54 Å²	54	39.5 Å²	39.5	33%	0.331	20%	0.197	S	C	.	.	S	Bend	trans	-108	-170.4	179.3	62.4	0	0	0	0	111.4	P878 G898 I899 C940	P878-T938 WeakPolarHBondContact CA-O 3.29Å; G898-T938 WeakPolarHBondContact CA-OG1 3.43Å; I899-T938 HydrophobicContact CB-CG2 4.5Å; I899-T938 PolarHBondContact N-OG1 2.85Å; I899-T938 PolarHBondContact O-N 2.9Å; T938-C940 PolarHBondContact O-N 2.84Å; T938-C940 PolarHBondContact O-SG 2.68Å
939	Y	96	Very high	93.2	Very high	74 Å²	74	38.7 Å²	38.7	29%	0.29	19%	0.189	S	C	.	.			trans	-70.6	121.6	162.5	-82.5	-86.8	0	0	0	108.5	H817 F876 Q877 P878	H817-Y939 HydrophobicContact CB-CD1 4.18Å; H817-Y939 HydrophobicContact CB-CE1 4.06Å; H817-Y939 AromaticContact CE1-CD1 3.96Å; H817-Y939 AromaticContact CE1-CG 3.66Å; H817-Y939 AromaticContact CG-CD1 3.72Å; H817-Y939 AromaticContact ND1-CD1 3.5Å; H817-Y939 WeakPolarHBondContact ND1-CD1 3.49Å; H817-Y939 AromaticContact ND1-CE1 3.9Å; H817-Y939 AromaticContact ND1-CG 3.55Å; F876-Y939 WeakPolarHBondContact O-CA 3.46Å; Q877-Y939 HydrophobicContact CB-CE1 4.23Å; Q877-Y939 HydrophobicContact CG-CE1 4.06Å; P878-Y939 HydrophobicContact CG-CD2 4.2Å; P878-Y939 HydrophobicContact CG-CE2 4.03Å
940	C	96	Very high	93.2	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	114.9	-176.2	-54.7	0	0	0	0	110.7	V875 F876 E897 I899 V900 T938 V942	V875-C940 WeakPolarHBondContact CA-O 3.2Å; F876-C940 HydrophobicContact CB-CB 4.41Å; F876-C940 PolarHBondContact N-O 3.25Å; F876-C940 PolarHBondContact O-N 3.43Å; E897-C940 WeakPolarHBondContact O-CA 3.49Å; I899-C940 PolarHBondContact O-SG 3.44Å; V900-C940 HydrophobicContact CG1-CB 4.34Å; V900-C940 VanDerWaalsContact CG1-SG 3.56Å; T938-C940 PolarHBondContact O-N 2.84Å; T938-C940 PolarHBondContact O-SG 2.68Å; C940-V942 HydrophobicContact CB-CG1 4.08Å
941	N	94.4	Very high	93.2	Very high	2 Å²	2	32.8 Å²	32.8	1%	0.011	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	114.5	170.3	-63.8	-35.9	0	0	0	107.8	Y873 V875 Q896 E897	Y873-N941 HydrophobicContact CE2-CB 4.02Å; Y873-N941 PolarHBondContact OH-OD1 2.83Å; V875-N941 WeakPolarHBondContact CG2-OD1 3.49Å; Q896-N941 WeakPolarHBondContact CB-O 3.4Å; Q896-N941 PolarHBondContact N-O 3.28Å; E897-N941 HydrophobicContact CB-CB 4.2Å; E897-N941 PolarHBondContact N-O 2.86Å; E897-N941 PolarHBondContact O-N 2.98Å; E897-N941 PolarHBondContact OE2-ND2 3.18Å
942	V	94.4	Very high	93.4	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	151	-171	-54.5	0	0	0	0	111.4	E874 F876 Y893 F894 I895 C940	E874-V942 HydrophobicContact CB-CG2 4.11Å; E874-V942 PolarHBondContact N-O 2.89Å; E874-V942 PolarHBondContact O-N 3.37Å; E874-V942 VanDerWaalsContact O-O 3.05Å; F876-V942 HydrophobicContact CD2-CG2 3.8Å; F876-V942 HydrophobicContact CE2-CG2 3.6Å; Y893-V942 HydrophobicContact CD1-CG2 3.9Å; F894-V942 CarbonylContact O-C 3.56Å; F894-V942 VanDerWaalsContact O-CA 3.28Å; F894-V942 WeakPolarHBondContact O-CA 3.07Å; F894-V942 WeakPolarHBondContact O-CB 3.33Å; I895-V942 HydrophobicContact CG1-CG1 4.47Å; C940-V942 HydrophobicContact CB-CG1 4.08Å
943	Y	93.8	Very high	93.5	Very high	21 Å²	21	35.9 Å²	35.9	8%	0.082	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	124.1	167.1	-72.5	-86.5	0	0	0	109.6	L849 L871 R872 Y873 Y893 F894 Q896	L849-Y943 HydrophobicContact CD1-CD2 4.44Å; L849-Y943 HydrophobicContact CD2-CD2 3.74Å; L849-Y943 HydrophobicContact CD2-CE2 4.43Å; L849-Y943 HydrophobicContact CD2-CG 4.27Å; L871-Y943 HydrophobicContact CB-CD1 3.8Å; L871-Y943 HydrophobicContact CB-CG 4.25Å; L871-Y943 HydrophobicContact CD1-CD1 4.32Å; L871-Y943 HydrophobicContact CD1-CG 4.12Å; R872-Y943 CarbonylContact O-C 3.48Å; R872-Y943 WeakPolarHBondContact O-CA 3.25Å; Y873-Y943 HydrophobicContact CD2-CE1 4.14Å; Y873-Y943 HydrophobicContact CD2-CE2 4.3Å; Y873-Y943 AromaticContact CD2-CZ 3.95Å; Y873-Y943 HydrophobicContact CG-CE1 4.47Å; Y893-Y943 CarbonylContact C-O 3.2Å; Y893-Y943 WeakPolarHBondContact CA-O 3.5Å; F894-Y943 PolarHBondContact N-O 3.11Å; F894-Y943 PolarHBondContact O-N 3.24Å; Q896-Y943 HydrophobicContact CB-CD2 4.31Å; Q896-Y943 HydrophobicContact CB-CE2 4.17Å; Q896-Y943 HydrophobicContact CG-CE2 4.33Å
944	S	94.6	Very high	93.3	Very high	4 Å²	4	35 Å²	35	3%	0.028	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	147.7	170.3	82.8	0	0	0	0	111.4	R872 E874 M892	R872-S944 PolarHBondContact N-O 2.95Å; R872-S944 PolarHBondContact O-N 3.37Å; E874-S944 VanDerWaalsContact OE1-CB 3.23Å; E874-S944 WeakPolarHBondContact OE1-CB 3.39Å; E874-S944 PolarHBondContact OE1-OG 2.97Å; M892-S944 VanDerWaalsContact O-CA 3.3Å; M892-S944 WeakPolarHBondContact O-CA 3.48Å
945	L	93.3	Very high	93	Very high	2 Å²	2	39.6 Å²	39.6	1%	0.01	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	120.1	173.6	-178.5	63.2	0	0	0	108.3	V867 K870 L871 K891 M892 F894 F950	V867-L945 HydrophobicContact CG1-CD2 4.06Å; K870-L945 HydrophobicContact CB-CD1 3.84Å; L871-L945 HydrophobicContact CD2-CB 3.97Å; L871-L945 HydrophobicContact CD2-CD1 4.35Å; K891-L945 CarbonylContact C-O 3.57Å; K891-L945 WeakPolarHBondContact CA-O 3.17Å; K891-L945 VanDerWaalsContact CB-O 3.25Å; K891-L945 WeakPolarHBondContact CB-O 3.5Å; M892-L945 HydrophobicContact CG-CB 4.03Å; M892-L945 PolarHBondContact N-O 2.92Å; M892-L945 PolarHBondContact O-N 2.93Å; M892-L945 HydrophobicContact SD-CD2 4.45Å; F894-L945 HydrophobicContact CE2-CB 4.09Å; F894-L945 HydrophobicContact CE2-CD2 4.11Å; L945-F950 HydrophobicContact CD2-CB 4.19Å; L945-F950 HydrophobicContact CD2-CD2 3.79Å; L945-F950 HydrophobicContact CD2-CG 4.49Å; L945-F950 HydrophobicContact CG-CB 4.24Å
946	D	93.2	Very high	92.6	Very high	47 Å²	47	38 Å²	38	25%	0.251	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	157.9	-178.1	76.7	-91.9	0	0	0	112.4	A948 S949 F950	D946-A948 VanDerWaalsContact C-N 3.32Å; D946-A948 PolarHBondContact O-N 3.07Å; D946-A948 WeakPolarHBondContact OD2-CA 3.48Å; D946-A948 WeakPolarHBondContact OD2-CB 3.38Å; D946-A948 PolarHBondContact OD2-N 3.38Å; D946-S949 VanDerWaalsContact OD1-CB 3.25Å; D946-S949 WeakPolarHBondContact OD1-CB 3.16Å; D946-S949 PolarHBondContact OD1-OG 3.47Å; D946-S949 PolarHBondContact OD2-N 3.05Å; D946-S949 PolarHBondContact OD2-OG 2.95Å; D946-F950 VanDerWaalsContact O-CB 3.23Å; D946-F950 WeakPolarHBondContact O-CB 3.25Å; D946-F950 PolarHBondContact O-N 3.04Å
947	R	91.3	Very high	92.2	Very high	91 Å²	91	40.1 Å²	40.1	34%	0.343	21%	0.205	S	C	.	.	H	α-helix	trans	-61.1	-34.3	-176.4	-177.4	179.7	150.5	144.7	7.1	114.1	T890 L924 N927 L951	T890-R947 VanDerWaalsContact O-CB 3.31Å; T890-R947 WeakPolarHBondContact O-CB 3.48Å; T890-R947 PolarHBondContact O-N 3.18Å; L924-R947 HydrophobicContact CD2-CB 3.89Å; L924-R947 HydrophobicContact CD2-CG 4.07Å; N927-R947 PolarHBondContact OD1-NH1 3.26Å; N927-R947 PolarHBondContact OD1-NH2 3.07Å; R947-L951 HydrophobicContact CG-CD1 3.93Å; R947-L951 HydrophobicContact CG-CG 4.41Å; R947-L951 WeakPolarHBondContact O-CG 3.49Å; R947-L951 PolarHBondContact O-N 2.88Å; R947-L951 VanDerWaalsContact O-N 3.09Å
948	A	91.8	Very high	91.7	Very high	70 Å²	70	39.1 Å²	39.1	58%	0.579	21%	0.207	S	C	*	.	H	α-helix	trans	-72.5	-51.6	-177.2	0	0	0	0	0	109.7	D946 F950 L951 E952	D946-A948 VanDerWaalsContact C-N 3.32Å; D946-A948 PolarHBondContact O-N 3.07Å; D946-A948 WeakPolarHBondContact OD2-CA 3.48Å; D946-A948 WeakPolarHBondContact OD2-CB 3.38Å; D946-A948 PolarHBondContact OD2-N 3.38Å; A948-F950 VanDerWaalsContact C-N 3.28Å; A948-F950 PolarHBondContact O-N 2.96Å; A948-L951 PolarHBondContact O-N 2.82Å; A948-E952 WeakPolarHBondContact O-CB 3.22Å; A948-E952 PolarHBondContact O-N 2.61Å
949	S	91.7	Very high	91.2	Very high	18 Å²	18	43 Å²	43	13%	0.126	23%	0.225	C	C	.	.	H	α-helix	trans	-52.1	-46.1	171.4	-64.7	0	0	0	0	112.1	D946 V953	D946-S949 VanDerWaalsContact OD1-CB 3.25Å; D946-S949 WeakPolarHBondContact OD1-CB 3.16Å; D946-S949 PolarHBondContact OD1-OG 3.47Å; D946-S949 PolarHBondContact OD2-N 3.05Å; D946-S949 PolarHBondContact OD2-OG 2.95Å; S949-V953 WeakPolarHBondContact O-CG2 3.29Å; S949-V953 PolarHBondContact O-N 2.96Å; S949-V953 VanDerWaalsContact O-N 3.12Å
950	F	90.1	Very high	90.6	Very high	8 Å²	8	40.6 Å²	40.6	4%	0.035	22%	0.217	C	C	.	.	H	α-helix	trans	-61.6	-48	-179.2	-179.5	-112.1	0	0	0	113.2	M892 L924 L925 L945 D946 A948 L954 M964	M892-F950 HydrophobicContact SD-CD2 3.74Å; M892-F950 HydrophobicContact SD-CE2 3.44Å; M892-F950 WeakPolarHBondContact SD-CE2 3.31Å; M892-F950 HydrophobicContact SD-CZ 4.07Å; L924-F950 HydrophobicContact CB-CD1 3.66Å; L924-F950 HydrophobicContact CB-CE1 3.58Å; L924-F950 HydrophobicContact CD1-CB 4.25Å; L924-F950 HydrophobicContact CD1-CD1 3.55Å; L924-F950 HydrophobicContact CD1-CD2 4.42Å; L924-F950 HydrophobicContact CD1-CE1 3.86Å; L924-F950 HydrophobicContact CD1-CG 3.83Å; L924-F950 HydrophobicContact CD1-CZ 4.41Å; L924-F950 HydrophobicContact CG-CD1 4.26Å; L924-F950 HydrophobicContact CG-CE1 4.38Å; L925-F950 HydrophobicContact CD2-CE1 3.86Å; L925-F950 HydrophobicContact CD2-CZ 4.23Å; L925-F950 HydrophobicContact CG-CE1 4.28Å; L945-F950 HydrophobicContact CD2-CB 4.19Å; L945-F950 HydrophobicContact CD2-CD2 3.79Å; L945-F950 HydrophobicContact CD2-CG 4.49Å; L945-F950 HydrophobicContact CG-CB 4.24Å; D946-F950 VanDerWaalsContact O-CB 3.23Å; D946-F950 WeakPolarHBondContact O-CB 3.25Å; D946-F950 PolarHBondContact O-N 3.04Å; A948-F950 VanDerWaalsContact C-N 3.28Å; A948-F950 PolarHBondContact O-N 2.96Å; F950-L954 HydrophobicContact CD1-CD1 4.12Å; F950-L954 HydrophobicContact CD2-CD1 4.41Å; F950-L954 HydrophobicContact CE1-CD1 3.55Å; F950-L954 HydrophobicContact CE2-CD1 3.88Å; F950-L954 HydrophobicContact CE2-CG 4.29Å; F950-L954 HydrophobicContact CZ-CD1 3.44Å; F950-L954 VanDerWaalsContact CZ-CD1 3.44Å; F950-L954 HydrophobicContact CZ-CG 4.32Å; F950-L954 WeakPolarHBondContact O-CB 3.43Å; F950-L954 WeakPolarHBondContact O-CG 3.3Å; F950-L954 PolarHBondContact O-N 2.94Å; F950-M964 HydrophobicContact CE2-CE 3.82Å; F950-M964 HydrophobicContact CE2-SD 3.44Å; F950-M964 WeakPolarHBondContact CE2-SD 3.45Å; F950-M964 HydrophobicContact CZ-CE 4.07Å; F950-M964 HydrophobicContact CZ-SD 3.55Å; F950-M964 VanDerWaalsContact CZ-SD 3.55Å
951	L	90	Very high	90.2	Very high	41 Å²	41	44.4 Å²	44.4	22%	0.215	23%	0.231	C	C	.	.	H	α-helix	trans	-69.3	-39.7	-179.4	-69.6	173.1	0	0	0	111.8	R947 A948 V953 L954 D955	R947-L951 HydrophobicContact CG-CD1 3.93Å; R947-L951 HydrophobicContact CG-CG 4.41Å; R947-L951 WeakPolarHBondContact O-CG 3.49Å; R947-L951 PolarHBondContact O-N 2.88Å; R947-L951 VanDerWaalsContact O-N 3.09Å; A948-L951 PolarHBondContact O-N 2.82Å; L951-V953 PolarHBondContact O-N 3.14Å; L951-L954 PolarHBondContact O-N 2.68Å; L951-D955 WeakPolarHBondContact O-CB 3.32Å; L951-D955 PolarHBondContact O-N 3.06Å
952	E	90.8	Very high	89.6	Confident	103 Å²	103	50.4 Å²	50.4	48%	0.481	25%	0.253	S	S	.	.	H	α-helix	trans	-57	-47.2	175.8	-170.8	-157	152.9	0	0	111.9	K870 A948 D955 N956	K870-E952 IonicContact NZ-OE1 2.85Å; K870-E952 PolarHBondContact NZ-OE1 3.42Å; K870-E952 IonicContact NZ-OE2 2.67Å; K870-E952 PolarHBondContact NZ-OE2 2.93Å; A948-E952 WeakPolarHBondContact O-CB 3.22Å; A948-E952 PolarHBondContact O-N 2.61Å; E952-D955 PolarHBondContact O-N 2.86Å; E952-N956 PolarHBondContact O-N 3.35Å
953	V	89.8	Confident	89.1	Confident	2 Å²	2	53.3 Å²	53.3	1%	0.012	27%	0.271	C	S	.	.	H	α-helix	trans	-68.3	-39.2	177	-176	0	0	0	0	111.1	F863 E866 V867 K870 S949 L951 D955 N956 Y957	F863-V953 HydrophobicContact CD2-CG1 3.5Å; F863-V953 VanDerWaalsContact CD2-CG1 3.5Å; F863-V953 HydrophobicContact CE2-CG1 3.54Å; E866-V953 HydrophobicContact CB-CG1 4.37Å; E866-V953 HydrophobicContact CB-CG2 4.43Å; E866-V953 HydrophobicContact CG-CG2 4.02Å; E866-V953 VanDerWaalsContact OE1-CG2 3.31Å; E866-V953 WeakPolarHBondContact OE1-CG2 3.45Å; V867-V953 HydrophobicContact CG2-CG1 3.83Å; K870-V953 HydrophobicContact CD-CG2 3.86Å; S949-V953 WeakPolarHBondContact O-CG2 3.29Å; S949-V953 PolarHBondContact O-N 2.96Å; S949-V953 VanDerWaalsContact O-N 3.12Å; L951-V953 PolarHBondContact O-N 3.14Å; V953-D955 VanDerWaalsContact C-N 3.34Å; V953-D955 PolarHBondContact O-N 2.7Å; V953-N956 WeakPolarHBondContact O-CB 3.5Å; V953-N956 PolarHBondContact O-N 3.14Å; V953-Y957 HydrophobicContact CG1-CD2 4.19Å; V953-Y957 WeakPolarHBondContact O-CD2 3.32Å; V953-Y957 PolarHBondContact O-N 2.77Å
954	L	88.4	Confident	88.6	Confident	2 Å²	2	52.4 Å²	52.4	1%	0.01	27%	0.268	C	S	.	.	H	α-helix	trans	-69.7	-28.5	178.5	-75.3	-169	0	0	0	113.8	F863 L925 F950 L951 Y957 M960 R961 M964	F863-L954 HydrophobicContact CE2-CD2 4.28Å; L925-L954 HydrophobicContact CD2-CD1 3.89Å; F950-L954 HydrophobicContact CD1-CD1 4.12Å; F950-L954 HydrophobicContact CD2-CD1 4.41Å; F950-L954 HydrophobicContact CE1-CD1 3.55Å; F950-L954 HydrophobicContact CE2-CD1 3.88Å; F950-L954 HydrophobicContact CE2-CG 4.29Å; F950-L954 HydrophobicContact CZ-CD1 3.44Å; F950-L954 VanDerWaalsContact CZ-CD1 3.44Å; F950-L954 HydrophobicContact CZ-CG 4.32Å; F950-L954 WeakPolarHBondContact O-CB 3.43Å; F950-L954 WeakPolarHBondContact O-CG 3.3Å; F950-L954 PolarHBondContact O-N 2.94Å; L951-L954 PolarHBondContact O-N 2.68Å; L954-Y957 CarbonylContact O-C 3.28Å; L954-Y957 PolarHBondContact O-N 3.16Å; L954-M960 HydrophobicContact CD2-CB 4.46Å; L954-R961 HydrophobicContact CB-CB 4.17Å; L954-R961 HydrophobicContact CB-CG 4.44Å; L954-R961 HydrophobicContact CD1-CB 4.32Å; L954-R961 HydrophobicContact CD1-CG 4.25Å; L954-R961 HydrophobicContact CD2-CB 4.13Å; L954-R961 HydrophobicContact CG-CB 4.45Å; L954-M964 HydrophobicContact CD1-SD 4.17Å; L954-M964 HydrophobicContact CD2-SD 4.05Å
955	D	88.8	Confident	88.2	Confident	103 Å²	103	52.9 Å²	52.9	55%	0.551	27%	0.27	S	S	*	.	H	α-helix	trans	-75.5	-27.2	172.7	-70.4	-17.9	0	0	0	111.5	L951 E952 V953 R961	L951-D955 WeakPolarHBondContact O-CB 3.32Å; L951-D955 PolarHBondContact O-N 3.06Å; E952-D955 PolarHBondContact O-N 2.86Å; V953-D955 VanDerWaalsContact C-N 3.34Å; V953-D955 PolarHBondContact O-N 2.7Å; D955-R961 IonicContact OD1-NH1 3.27Å; D955-R961 PolarHBondContact OD1-NH1 2.67Å
956	N	88.7	Confident	87.7	Confident	51 Å²	51	53.2 Å²	53.2	27%	0.273	27%	0.272	S	S	.	.	H	α-helix	trans	-68.1	-33.5	164.5	-85	-35.1	0	0	0	112.8	R408 E866 E952 V953 P958	R408-N956 PolarHBondContact NH1-OD1 3.48Å; R408-N956 VanDerWaalsContact NH1-OD1 3.09Å; R408-N956 PolarHBondContact NH2-OD1 3.16Å; E866-N956 PolarHBondContact OE1-ND2 3.28Å; E866-N956 VanDerWaalsContact OE1-ND2 3.14Å; E866-N956 PolarHBondContact OE2-ND2 3.48Å; E952-N956 PolarHBondContact O-N 3.35Å; V953-N956 WeakPolarHBondContact O-CB 3.5Å; V953-N956 PolarHBondContact O-N 3.14Å; N956-P958 WeakPolarHBondContact O-CD 3.29Å
957	Y	88.2	Confident	87.2	Confident	46 Å²	46	52.4 Å²	52.4	18%	0.18	27%	0.269	C	S	.	.			trans	-125.8	68.3	-171.1	-70.4	-84.5	0	0	0	113.4	D860 N862 F863 V953 L954 L959 M960 R961	D860-Y957 HydrophobicContact CB-CE1 4.2Å; D860-Y957 VanDerWaalsContact OD2-CE1 3.3Å; D860-Y957 WeakPolarHBondContact OD2-CE1 3.22Å; D860-Y957 PolarHBondContact OD2-OH 3.49Å; N862-Y957 VanDerWaalsContact CB-OH 3.28Å; N862-Y957 WeakPolarHBondContact CB-OH 3.32Å; F863-Y957 HydrophobicContact CB-CD1 3.91Å; F863-Y957 HydrophobicContact CB-CD2 3.96Å; F863-Y957 HydrophobicContact CB-CE1 3.89Å; F863-Y957 HydrophobicContact CB-CE2 3.97Å; F863-Y957 HydrophobicContact CB-CG 3.95Å; F863-Y957 HydrophobicContact CD2-CD1 4.43Å; F863-Y957 AromaticContact CD2-CD2 3.71Å; F863-Y957 HydrophobicContact CD2-CD2 3.71Å; F863-Y957 HydrophobicContact CD2-CE2 4.45Å; F863-Y957 AromaticContact CD2-CG 3.71Å; F863-Y957 HydrophobicContact CD2-CG 3.71Å; F863-Y957 HydrophobicContact CG-CD2 4.33Å; F863-Y957 HydrophobicContact CG-CG 4.25Å; V953-Y957 HydrophobicContact CG1-CD2 4.19Å; V953-Y957 WeakPolarHBondContact O-CD2 3.32Å; V953-Y957 PolarHBondContact O-N 2.77Å; L954-Y957 CarbonylContact O-C 3.28Å; L954-Y957 PolarHBondContact O-N 3.16Å; Y957-L959 VanDerWaalsContact C-N 3.27Å; Y957-L959 PolarHBondContact O-N 3.05Å; Y957-L959 VanDerWaalsContact O-N 3.16Å; Y957-M960 WeakPolarHBondContact O-CB 3.47Å; Y957-M960 PolarHBondContact O-N 3.05Å; Y957-R961 PolarHBondContact O-N 3.11Å
958	P	85.7	Confident	86.8	Confident	83 Å²	83	48.1 Å²	48.1	54%	0.539	25%	0.253	S	S	.	.	H	α-helix	trans	-66.7	-20.1	-171.5	26.1	-36.3	0	0	0	114.9	N956 R962	N956-P958 WeakPolarHBondContact O-CD 3.29Å; P958-R962 PolarHBondContact O-N 3.3Å
959	L	84.6	Confident	86.4	Confident	134 Å²	134	44.8 Å²	44.8	70%	0.702	23%	0.225	S	C	*	.	H	α-helix	trans	-66	-46.6	169.5	177.1	61.4	0	0	0	110.6	Y957 R961 R962 T963	Y957-L959 VanDerWaalsContact C-N 3.27Å; Y957-L959 PolarHBondContact O-N 3.05Å; Y957-L959 VanDerWaalsContact O-N 3.16Å; L959-R961 VanDerWaalsContact C-N 3.28Å; L959-R961 PolarHBondContact O-N 2.89Å; L959-R962 WeakPolarHBondContact O-CB 3.49Å; L959-R962 PolarHBondContact O-N 3.45Å; L959-R962 VanDerWaalsContact O-N 3.1Å; L959-T963 PolarHBondContact O-N 2.85Å; L959-T963 PolarHBondContact O-OG1 3.38Å
960	M	83.8	Confident	86	Confident	24 Å²	24	46 Å²	46	12%	0.118	23%	0.229	C	C	.	.	H	α-helix	trans	-66.1	-34.9	-178.7	-163.3	58.2	71	0	0	111.7	F855 A859 F863 L954 Y957 R962 T963 M964	F855-M960 HydrophobicContact CD2-SD 3.87Å; F855-M960 HydrophobicContact CE1-CG 4.49Å; F855-M960 HydrophobicContact CE2-CG 3.54Å; F855-M960 HydrophobicContact CE2-SD 3.23Å; F855-M960 WeakPolarHBondContact CE2-SD 3.46Å; F855-M960 HydrophobicContact CZ-CG 3.43Å; F855-M960 VanDerWaalsContact CZ-CG 3.43Å; F855-M960 HydrophobicContact CZ-SD 3.67Å; A859-M960 HydrophobicContact CB-CE 3.45Å; A859-M960 VanDerWaalsContact CB-CE 3.45Å; F863-M960 HydrophobicContact CD1-CE 4.42Å; F863-M960 HydrophobicContact CD1-CG 4.49Å; F863-M960 HydrophobicContact CD2-CG 4.39Å; F863-M960 HydrophobicContact CE1-CE 4.42Å; F863-M960 HydrophobicContact CE1-CG 3.91Å; F863-M960 HydrophobicContact CE2-CB 4.22Å; F863-M960 HydrophobicContact CE2-CG 3.82Å; F863-M960 HydrophobicContact CZ-CB 4.44Å; F863-M960 HydrophobicContact CZ-CG 3.56Å; L954-M960 HydrophobicContact CD2-CB 4.46Å; Y957-M960 WeakPolarHBondContact O-CB 3.47Å; Y957-M960 PolarHBondContact O-N 3.05Å; M960-R962 VanDerWaalsContact C-N 3.31Å; M960-R962 PolarHBondContact O-N 3.08Å; M960-T963 WeakPolarHBondContact O-CB 3.2Å; M960-T963 PolarHBondContact O-N 3.03Å; M960-T963 VanDerWaalsContact O-N 3.17Å; M960-M964 WeakPolarHBondContact O-CG 3.49Å; M960-M964 PolarHBondContact O-N 2.87Å
961	R	86.2	Confident	85.6	Confident	81 Å²	81	48.3 Å²	48.3	31%	0.306	24%	0.238	S	C	.	.	H	α-helix	trans	-55.2	-43.3	170.7	-179.6	173.1	174.4	152.8	2.4	112.5	L954 D955 Y957 L959 T963 M964 E965	L954-R961 HydrophobicContact CB-CB 4.17Å; L954-R961 HydrophobicContact CB-CG 4.44Å; L954-R961 HydrophobicContact CD1-CB 4.32Å; L954-R961 HydrophobicContact CD1-CG 4.25Å; L954-R961 HydrophobicContact CD2-CB 4.13Å; L954-R961 HydrophobicContact CG-CB 4.45Å; D955-R961 IonicContact OD1-NH1 3.27Å; D955-R961 PolarHBondContact OD1-NH1 2.67Å; Y957-R961 PolarHBondContact O-N 3.11Å; L959-R961 VanDerWaalsContact C-N 3.28Å; L959-R961 PolarHBondContact O-N 2.89Å; R961-T963 PolarHBondContact O-N 3.45Å; R961-M964 PolarHBondContact O-N 2.72Å; R961-E965 WeakPolarHBondContact CG-OE1 3.49Å; R961-E965 IonicContact CZ-OE1 2.94Å; R961-E965 IonicContact NE-OE1 2.72Å; R961-E965 PolarHBondContact NE-OE1 3.23Å; R961-E965 IonicContact NH2-OE1 3.87Å; R961-E965 WeakPolarHBondContact O-CG 3.47Å; R961-E965 PolarHBondContact O-N 3.47Å
962	R	83.4	Confident	85.2	Confident	127 Å²	127	46.6 Å²	46.6	48%	0.479	23%	0.229	S	C	.	.	H	α-helix	trans	-63.2	-41.5	176.3	-64.5	179.8	-172.9	-164.6	-0.5	112	P958 L959 M960 M964 E965 S966	P958-R962 PolarHBondContact O-N 3.3Å; L959-R962 WeakPolarHBondContact O-CB 3.49Å; L959-R962 PolarHBondContact O-N 3.45Å; L959-R962 VanDerWaalsContact O-N 3.1Å; M960-R962 VanDerWaalsContact C-N 3.31Å; M960-R962 PolarHBondContact O-N 3.08Å; R962-M964 VanDerWaalsContact C-N 3.29Å; R962-M964 PolarHBondContact O-N 3.24Å; R962-E965 PolarHBondContact O-N 3.42Å; R962-S966 PolarHBondContact O-N 3.31Å; R962-S966 PolarHBondContact O-OG 2.99Å
963	T	83.5	Confident	84.7	Confident	61 Å²	61	46.5 Å²	46.5	37%	0.374	23%	0.231	S	C	.	.	H	α-helix	trans	-61	-37.4	175.6	-47.3	0	0	0	0	112	L959 M960 R961 S966 V967	L959-T963 PolarHBondContact O-N 2.85Å; L959-T963 PolarHBondContact O-OG1 3.38Å; M960-T963 WeakPolarHBondContact O-CB 3.2Å; M960-T963 PolarHBondContact O-N 3.03Å; M960-T963 VanDerWaalsContact O-N 3.17Å; R961-T963 PolarHBondContact O-N 3.45Å; T963-S966 PolarHBondContact O-OG 2.83Å; T963-S966 VanDerWaalsContact O-OG 3.1Å; T963-V967 WeakPolarHBondContact O-CG2 3.35Å; T963-V967 PolarHBondContact O-N 3.44Å
964	M	83.3	Confident	84.1	Confident	2 Å²	2	51.9 Å²	51.9	1%	0.01	25%	0.254	C	S	.	.	H	α-helix	trans	-74.2	-36.6	174.2	-59	-163.5	99.4	0	0	112.6	F855 M892 Y918 L925 F950 L954 M960 R961 R962 A968	F855-M964 HydrophobicContact CD1-CE 4.48Å; F855-M964 HydrophobicContact CD2-CG 4.24Å; F855-M964 HydrophobicContact CE1-CE 3.88Å; F855-M964 HydrophobicContact CE1-SD 4.18Å; F855-M964 HydrophobicContact CE2-CE 3.91Å; F855-M964 HydrophobicContact CE2-CG 3.27Å; F855-M964 HydrophobicContact CE2-SD 3.76Å; F855-M964 HydrophobicContact CZ-CE 3.56Å; F855-M964 HydrophobicContact CZ-CG 3.58Å; F855-M964 HydrophobicContact CZ-SD 3.36Å; F855-M964 WeakPolarHBondContact CZ-SD 3.47Å; M892-M964 HydrophobicContact CE-CE 4.16Å; M892-M964 HydrophobicContact SD-CE 4.36Å; Y918-M964 HydrophobicContact CE2-CE 4.33Å; L925-M964 HydrophobicContact CD1-CB 4.04Å; F950-M964 HydrophobicContact CE2-CE 3.82Å; F950-M964 HydrophobicContact CE2-SD 3.44Å; F950-M964 WeakPolarHBondContact CE2-SD 3.45Å; F950-M964 HydrophobicContact CZ-CE 4.07Å; F950-M964 HydrophobicContact CZ-SD 3.55Å; F950-M964 VanDerWaalsContact CZ-SD 3.55Å; L954-M964 HydrophobicContact CD1-SD 4.17Å; L954-M964 HydrophobicContact CD2-SD 4.05Å; M960-M964 WeakPolarHBondContact O-CG 3.49Å; M960-M964 PolarHBondContact O-N 2.87Å; R961-M964 PolarHBondContact O-N 2.72Å; R962-M964 VanDerWaalsContact C-N 3.29Å; R962-M964 PolarHBondContact O-N 3.24Å; M964-A968 WeakPolarHBondContact O-CB 3.38Å; M964-A968 PolarHBondContact O-N 2.8Å
965	E	84.8	Confident	83.5	Confident	15 Å²	15	55.1 Å²	55.1	7%	0.07	27%	0.271	C	S	.	.	H	α-helix	trans	-63.9	-40.4	174.6	-73.8	179	-156.6	0	0	111.9	L925 R961 R962 A969 V982 S983 R985	L925-E965 HydrophobicContact CD1-CG 4.21Å; L925-E965 HydrophobicContact CD2-CG 4.4Å; R961-E965 WeakPolarHBondContact CG-OE1 3.49Å; R961-E965 IonicContact CZ-OE1 2.94Å; R961-E965 IonicContact NE-OE1 2.72Å; R961-E965 PolarHBondContact NE-OE1 3.23Å; R961-E965 IonicContact NH2-OE1 3.87Å; R961-E965 WeakPolarHBondContact O-CG 3.47Å; R961-E965 PolarHBondContact O-N 3.47Å; R962-E965 PolarHBondContact O-N 3.42Å; E965-A969 WeakPolarHBondContact O-CB 3.17Å; E965-A969 PolarHBondContact O-N 2.98Å; E965-V982 HydrophobicContact CB-CG1 3.89Å; E965-V982 HydrophobicContact CG-CG1 3.94Å; E965-S983 PolarHBondContact OE2-OG 3.41Å; E965-R985 IonicContact OE2-CZ 2.99Å; E965-R985 IonicContact OE2-NE 3.92Å; E965-R985 IonicContact OE2-NH2 3.14Å; E965-R985 PolarHBondContact OE2-NH2 3.3Å
966	S	83	Confident	82.6	Confident	8 Å²	8	53.6 Å²	53.6	6%	0.056	28%	0.28	C	S	.	.	H	α-helix	trans	-69.9	-44.1	177.5	62.8	0	0	0	0	112.7	R962 T963 A968 A969 E970	R962-S966 PolarHBondContact O-N 3.31Å; R962-S966 PolarHBondContact O-OG 2.99Å; T963-S966 PolarHBondContact O-OG 2.83Å; T963-S966 VanDerWaalsContact O-OG 3.1Å; S966-A968 VanDerWaalsContact C-N 3.34Å; S966-A968 PolarHBondContact O-N 2.95Å; S966-A969 PolarHBondContact O-N 3.18Å; S966-E970 WeakPolarHBondContact O-CB 3.32Å; S966-E970 PolarHBondContact O-N 2.93Å
967	V	83	Confident	81.8	Confident	31 Å²	31	55.7 Å²	55.7	19%	0.188	28%	0.284	C	S	.	.	H	α-helix	trans	-64.8	-37	174.9	174.1	0	0	0	0	111.6	T963 E970 R971	T963-V967 WeakPolarHBondContact O-CG2 3.35Å; T963-V967 PolarHBondContact O-N 3.44Å; V967-E970 PolarHBondContact O-N 3.04Å; V967-R971 HydrophobicContact CG1-CG 4.38Å; V967-R971 WeakPolarHBondContact O-CB 3.4Å; V967-R971 VanDerWaalsContact O-CG 3.24Å; V967-R971 WeakPolarHBondContact O-CG 3.38Å; V967-R971 PolarHBondContact O-N 2.92Å
968	A	84.1	Confident	80.7	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-65.2	-39.9	174.1	0	0	0	0	0	112.4	I922 L925 M964 S966 R971 L972 V982	I922-A968 HydrophobicContact CG1-CB 3.96Å; L925-A968 HydrophobicContact CD1-CB 3.89Å; M964-A968 WeakPolarHBondContact O-CB 3.38Å; M964-A968 PolarHBondContact O-N 2.8Å; S966-A968 VanDerWaalsContact C-N 3.34Å; S966-A968 PolarHBondContact O-N 2.95Å; A968-R971 PolarHBondContact O-N 3.16Å; A968-L972 WeakPolarHBondContact O-CG 3.4Å; A968-L972 PolarHBondContact O-N 3.18Å; A968-V982 HydrophobicContact CB-CG1 4.14Å; A968-V982 HydrophobicContact CB-CG2 4.15Å
969	A	82.7	Confident	79.8	Confident	1 Å²	1	57.1 Å²	57.1	1%	0.008	29%	0.292	C	S	.	.	H	α-helix	trans	-66.7	-42.2	175.9	0	0	0	0	0	112	E965 S966 L972 N973 P979 V982 L988 L992	E965-A969 WeakPolarHBondContact O-CB 3.17Å; E965-A969 PolarHBondContact O-N 2.98Å; S966-A969 PolarHBondContact O-N 3.18Å; A969-L972 PolarHBondContact O-N 3.24Å; A969-N973 PolarHBondContact O-N 2.7Å; A969-P979 HydrophobicContact CB-CB 4.01Å; A969-V982 HydrophobicContact CB-CB 4.49Å; A969-V982 HydrophobicContact CB-CG2 4.19Å; A969-L988 HydrophobicContact CB-CD2 4.19Å; A969-L992 HydrophobicContact CB-CD1 4.4Å
970	E	82.7	Confident	78.8	Confident	43 Å²	43	55.6 Å²	55.6	20%	0.201	28%	0.284	C	S	.	.	H	α-helix	trans	-60	-45.5	173.6	-173.5	-148.6	100.5	0	0	111.9	S966 V967 N973 K974 H1064	S966-E970 WeakPolarHBondContact O-CB 3.32Å; S966-E970 PolarHBondContact O-N 2.93Å; V967-E970 PolarHBondContact O-N 3.04Å; E970-N973 PolarHBondContact O-N 2.91Å; E970-K974 WeakPolarHBondContact O-CG 3.22Å; E970-K974 PolarHBondContact O-N 2.99Å; E970-K974 VanDerWaalsContact O-N 3.1Å; E970-K974 IonicContact OE1-NZ 3.2Å; E970-K974 PolarHBondContact OE1-NZ 3.39Å; E970-H1064 IonicContact OE1-CE1 3.57Å; E970-H1064 IonicContact OE1-ND1 3.14Å; E970-H1064 IonicContact OE1-NE2 2.71Å; E970-H1064 IonicContact OE2-CE1 2.73Å; E970-H1064 PolarHBondContact OE2-CE1 3.41Å; E970-H1064 IonicContact OE2-ND1 3.6Å
971	R	83.2	Confident	78	Confident	57 Å²	57	58.3 Å²	58.3	22%	0.215	30%	0.302	C	S	.	.	H	α-helix	trans	-65	-37.5	176.8	-74.1	172.2	173.1	-152.8	-4.6	112.7	Y918 E921 I922 V967 A968 I975	Y918-R971 PolarHBondContact O-NH1 3.38Å; Y918-R971 PolarHBondContact O-NH2 3.05Å; Y918-R971 VanDerWaalsContact O-NH2 3.15Å; E921-R971 WeakPolarHBondContact OE1-CD 3.12Å; E921-R971 IonicContact OE1-CZ 3.8Å; E921-R971 IonicContact OE1-NE 3.33Å; E921-R971 IonicContact OE1-NH1 2.68Å; E921-R971 PolarHBondContact OE1-NH1 2.9Å; E921-R971 IonicContact OE2-NH1 2.67Å; E921-R971 PolarHBondContact OE2-NH1 2.92Å; I922-R971 HydrophobicContact CD1-CB 4.09Å; V967-R971 HydrophobicContact CG1-CG 4.38Å; V967-R971 WeakPolarHBondContact O-CB 3.4Å; V967-R971 VanDerWaalsContact O-CG 3.24Å; V967-R971 WeakPolarHBondContact O-CG 3.38Å; V967-R971 PolarHBondContact O-N 2.92Å; A968-R971 PolarHBondContact O-N 3.16Å; R971-I975 WeakPolarHBondContact O-CD1 3.4Å; R971-I975 VanDerWaalsContact O-CG1 3.3Å; R971-I975 WeakPolarHBondContact O-CG1 3.43Å; R971-I975 PolarHBondContact O-N 3.12Å
972	L	80.6	Confident	76.9	Confident	5 Å²	5	55.1 Å²	55.1	3%	0.026	29%	0.292	C	S	.	.	H	α-helix	trans	-64.4	-44.6	173.5	-80.7	164.5	0	0	0	112.3	I922 V931 A968 A969 K974 I975 G976 R977 V982	I922-L972 HydrophobicContact CD1-CG 4.28Å; I922-L972 HydrophobicContact CG2-CD1 3.99Å; I922-L972 HydrophobicContact CG2-CD2 4.04Å; I922-L972 HydrophobicContact CG2-CG 4.06Å; V931-L972 HydrophobicContact CB-CD2 4.44Å; V931-L972 HydrophobicContact CG1-CD2 4Å; V931-L972 HydrophobicContact CG2-CD2 4.33Å; A968-L972 WeakPolarHBondContact O-CG 3.4Å; A968-L972 PolarHBondContact O-N 3.18Å; A969-L972 PolarHBondContact O-N 3.24Å; L972-K974 VanDerWaalsContact C-N 3.31Å; L972-K974 PolarHBondContact O-N 3.05Å; L972-I975 CarbonylContact O-C 3.55Å; L972-I975 WeakPolarHBondContact O-CA 3.49Å; L972-I975 PolarHBondContact O-N 2.89Å; L972-G976 PolarHBondContact O-N 3.27Å; L972-R977 CarbonylContact C-O 3.53Å; L972-R977 HydrophobicContact CB-CB 4.27Å; L972-R977 HydrophobicContact CD2-CB 3.65Å; L972-R977 HydrophobicContact CD2-CG 4.19Å; L972-R977 PolarHBondContact O-N 3.31Å; L972-V982 HydrophobicContact CD1-CG2 3.29Å
973	N	80.5	Confident	75.8	Confident	101 Å²	101	49.8 Å²	49.8	54%	0.54	27%	0.274	S	S	.	.	H	α-helix	trans	-58.5	-44.2	177.5	-168	5.3	0	0	0	111	A969 E970 I975 G976	A969-N973 PolarHBondContact O-N 2.7Å; E970-N973 PolarHBondContact O-N 2.91Å; N973-I975 PolarHBondContact O-N 3.44Å; N973-G976 PolarHBondContact O-N 2.93Å
974	K	77.6	Confident	74.3	Confident	114 Å²	114	54.4 Å²	54.4	50%	0.496	30%	0.296	S	S	.	.	H	α-helix	trans	-62.1	-20.8	173.6	-72.1	170.3	179.3	170.8	0	114.7	E970 L972 H1064	E970-K974 WeakPolarHBondContact O-CG 3.22Å; E970-K974 PolarHBondContact O-N 2.99Å; E970-K974 VanDerWaalsContact O-N 3.1Å; E970-K974 IonicContact OE1-NZ 3.2Å; E970-K974 PolarHBondContact OE1-NZ 3.39Å; L972-K974 VanDerWaalsContact C-N 3.31Å; L972-K974 PolarHBondContact O-N 3.05Å; K974-H1064 PolarHBondContact NZ-CD2 3.45Å; K974-H1064 PolarHBondContact NZ-CE1 2.9Å; K974-H1064 PolarHBondContact NZ-NE2 3.25Å
975	I	74.3	Confident	73	Confident	70 Å²	70	57 Å²	57	36%	0.359	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.7	3.7	177.1	-62.5	166.3	0	0	0	111	V931 R971 L972 N973 R977	V931-I975 HydrophobicContact CG2-CD1 4.39Å; R971-I975 WeakPolarHBondContact O-CD1 3.4Å; R971-I975 VanDerWaalsContact O-CG1 3.3Å; R971-I975 WeakPolarHBondContact O-CG1 3.43Å; R971-I975 PolarHBondContact O-N 3.12Å; L972-I975 CarbonylContact O-C 3.55Å; L972-I975 WeakPolarHBondContact O-CA 3.49Å; L972-I975 PolarHBondContact O-N 2.89Å; N973-I975 PolarHBondContact O-N 3.44Å; I975-R977 HydrophobicContact CG2-CG 4.11Å
976	G	70.8	Confident	71.4	Confident	72 Å²	72	65.3 Å²	65.3	74%	0.742	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	69	31.8	-178.5	0	0	0	0	0	113.5	L972 N973	L972-G976 PolarHBondContact O-N 3.27Å; N973-G976 PolarHBondContact O-N 2.93Å
977	R	71.1	Confident	70.2	Confident	95 Å²	95	68.1 Å²	68.1	36%	0.358	36%	0.356	S	S	.	.	S	Bend	trans	-114.4	146.6	176.4	-61.1	-74.6	-175.4	113.9	10.4	109.8	E885 V931 L972 I975 P979	E885-R977 IonicContact OE1-CZ 3.93Å; E885-R977 IonicContact OE1-NH2 2.67Å; E885-R977 PolarHBondContact OE1-NH2 3.44Å; V931-R977 PolarHBondContact O-NH2 3.19Å; L972-R977 CarbonylContact C-O 3.53Å; L972-R977 HydrophobicContact CB-CB 4.27Å; L972-R977 HydrophobicContact CD2-CB 3.65Å; L972-R977 HydrophobicContact CD2-CG 4.19Å; L972-R977 PolarHBondContact O-N 3.31Å; I975-R977 HydrophobicContact CG2-CG 4.11Å; R977-P979 WeakPolarHBondContact O-CD 3.4Å
978	D	66.4	Low	69	Low	119 Å²	119	67.1 Å²	67.1	64%	0.636	35%	0.35	S	S	*	.			trans	-57.8	118.7	-178.5	-63.5	-53.9	0	0	0	112.3	L980 V981	D978-L980 PolarHBondContact O-N 3Å; D978-V981 HydrophobicContact CB-CG2 4.13Å; D978-V981 WeakPolarHBondContact O-CG2 3.18Å; D978-V981 PolarHBondContact O-N 3.06Å
979	P	66.7	Low	67.7	Low	39 Å²	39	76.3 Å²	76.3	25%	0.253	39%	0.386	S	S	.	.	G	3₁₀ helix	trans	-68.2	-23.2	-178.5	26.5	-34.2	0	0	0	112.8	A969 R977 V981 V982	A969-P979 HydrophobicContact CB-CB 4.01Å; R977-P979 WeakPolarHBondContact O-CD 3.4Å; P979-V981 PolarHBondContact O-N 3.11Å; P979-V981 VanDerWaalsContact O-N 3.12Å; P979-V982 PolarHBondContact O-N 3.32Å
980	L	62.7	Low	66.6	Low	102 Å²	102	81.4 Å²	81.4	53%	0.534	41%	0.413	S	S	.	.	G	3₁₀ helix	trans	-59.3	-21.2	178	-66.2	171.1	0	0	0	113.3	D978 V982 S983	D978-L980 PolarHBondContact O-N 3Å; L980-V982 PolarHBondContact O-N 2.72Å; L980-S983 CarbonylContact O-C 3.55Å; L980-S983 PolarHBondContact O-N 3.23Å
981	V	66.5	Low	65.7	Low	81 Å²	81	81 Å²	81	49%	0.491	41%	0.413	S	S	.	.	G	3₁₀ helix	trans	-61.9	-22.2	177.9	178.9	0	0	0	0	112.6	T926 D978 P979	T926-V981 HydrophobicContact CG2-CG1 4.03Å; D978-V981 HydrophobicContact CB-CG2 4.13Å; D978-V981 WeakPolarHBondContact O-CG2 3.18Å; D978-V981 PolarHBondContact O-N 3.06Å; P979-V981 PolarHBondContact O-N 3.11Å; P979-V981 VanDerWaalsContact O-N 3.12Å
982	V	63.1	Low	64.5	Low	14 Å²	14	80.3 Å²	80.3	9%	0.085	41%	0.413	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-38.3	176.9	-167.8	0	0	0	0	112.6	L925 T926 E965 A968 A969 L972 P979 L980	L925-V982 HydrophobicContact CB-CG1 4.41Å; L925-V982 HydrophobicContact CD1-CG1 4.47Å; T926-V982 HydrophobicContact CG2-CB 4.36Å; T926-V982 HydrophobicContact CG2-CG2 3.95Å; E965-V982 HydrophobicContact CB-CG1 3.89Å; E965-V982 HydrophobicContact CG-CG1 3.94Å; A968-V982 HydrophobicContact CB-CG1 4.14Å; A968-V982 HydrophobicContact CB-CG2 4.15Å; A969-V982 HydrophobicContact CB-CB 4.49Å; A969-V982 HydrophobicContact CB-CG2 4.19Å; L972-V982 HydrophobicContact CD1-CG2 3.29Å; P979-V982 PolarHBondContact O-N 3.32Å; L980-V982 PolarHBondContact O-N 2.72Å
983	S	60.2	Low	63.6	Low	16 Å²	16	87 Å²	87	11%	0.112	44%	0.441	C	S	.	.			trans	-158	117.3	-174.8	-128.6	0	0	0	0	109.4	E965 L980 R985	E965-S983 PolarHBondContact OE2-OG 3.41Å; L980-S983 CarbonylContact O-C 3.55Å; L980-S983 PolarHBondContact O-N 3.23Å; S983-R985 PolarHBondContact O-N 2.87Å; S983-R985 PolarHBondContact OG-NE 3.03Å
984	N	53.3	Low	63	Low	158 Å²	158	86.6 Å²	86.6	85%	0.845	44%	0.439	S	S	*	.			trans	-70.8	24.1	169.8	-78.2	-21.8	0	0	0	112.6
985	R	56.4	Low	62.2	Low	56 Å²	56	84 Å²	84	21%	0.211	43%	0.432	C	S	.	.			trans	-87.2	123	-174.1	-79.7	-162.2	-64.1	119.5	-4.6	109.5	E965 S983 D987 L988 D991	E965-R985 IonicContact OE2-CZ 2.99Å; E965-R985 IonicContact OE2-NE 3.92Å; E965-R985 IonicContact OE2-NH2 3.14Å; E965-R985 PolarHBondContact OE2-NH2 3.3Å; S983-R985 PolarHBondContact O-N 2.87Å; S983-R985 PolarHBondContact OG-NE 3.03Å; R985-D987 VanDerWaalsContact CB-OD1 3.29Å; R985-D987 WeakPolarHBondContact CB-OD1 3.42Å; R985-D987 WeakPolarHBondContact CD-OD2 3.37Å; R985-D987 IonicContact CZ-OD2 3.25Å; R985-D987 IonicContact NE-OD2 3.03Å; R985-D987 IonicContact NH1-OD2 3.29Å; R985-D987 PolarHBondContact NH1-OD2 2.98Å; R985-D987 PolarHBondContact O-N 3.19Å; R985-L988 HydrophobicContact CB-CB 4.28Å; R985-L988 WeakPolarHBondContact O-CB 3.37Å; R985-L988 PolarHBondContact O-N 2.89Å; R985-D991 IonicContact CZ-OD2 2.64Å; R985-D991 IonicContact NH1-OD2 2.65Å; R985-D991 PolarHBondContact NH1-OD2 3.4Å
986	K	50.5	Low	61.4	Low	190 Å²	190	83.9 Å²	83.9	83%	0.826	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-37.1	175.3	-69.8	-175.5	176.5	-177.6	0	110.8	L988 Y989	K986-L988 PolarHBondContact O-N 3.1Å; K986-Y989 PolarHBondContact O-N 3.03Å
987	D	57.9	Low	61	Low	67 Å²	67	85.9 Å²	85.9	36%	0.358	42%	0.422	S	S	.	.	H	α-helix	trans	-60.2	-13	170.5	48.8	-60.2	0	0	0	114.1	R985 Y989 D990 D991	R985-D987 VanDerWaalsContact CB-OD1 3.29Å; R985-D987 WeakPolarHBondContact CB-OD1 3.42Å; R985-D987 WeakPolarHBondContact CD-OD2 3.37Å; R985-D987 IonicContact CZ-OD2 3.25Å; R985-D987 IonicContact NE-OD2 3.03Å; R985-D987 IonicContact NH1-OD2 3.29Å; R985-D987 PolarHBondContact NH1-OD2 2.98Å; R985-D987 PolarHBondContact O-N 3.19Å; D987-Y989 VanDerWaalsContact C-N 3.25Å; D987-Y989 PolarHBondContact O-N 2.7Å; D987-D990 PolarHBondContact O-N 3.21Å; D987-D991 VanDerWaalsContact O-CB 3.27Å; D987-D991 WeakPolarHBondContact O-CB 3.27Å; D987-D991 PolarHBondContact O-N 3.08Å
988	L	58.6	Low	60.7	Low	9 Å²	9	86 Å²	86	5%	0.047	43%	0.429	C	S	.	.	H	α-helix	trans	-63.7	-31.9	172.4	-173	68.7	0	0	0	112	A969 R985 K986 L992	A969-L988 HydrophobicContact CB-CD2 4.19Å; R985-L988 HydrophobicContact CB-CB 4.28Å; R985-L988 WeakPolarHBondContact O-CB 3.37Å; R985-L988 PolarHBondContact O-N 2.89Å; K986-L988 PolarHBondContact O-N 3.1Å; L988-L992 HydrophobicContact CD1-CD1 4.19Å; L988-L992 HydrophobicContact CG-CD1 4.28Å; L988-L992 WeakPolarHBondContact O-CB 3.45Å; L988-L992 PolarHBondContact O-N 3.27Å
989	Y	55.9	Low	60.4	Low	193 Å²	193	83.1 Å²	83.1	76%	0.757	42%	0.416	S	S	*	.	H	α-helix	trans	-73.1	-37.3	178	-126.2	-85.8	0	0	0	111.7	K986 D987 K993	K986-Y989 PolarHBondContact O-N 3.03Å; D987-Y989 VanDerWaalsContact C-N 3.25Å; D987-Y989 PolarHBondContact O-N 2.7Å; Y989-K993 WeakPolarHBondContact O-CB 3.21Å; Y989-K993 PolarHBondContact O-N 3.11Å
990	D	60.1	Low	59.8	Low	109 Å²	109	84.9 Å²	84.9	58%	0.583	42%	0.423	S	S	*	.	H	α-helix	trans	-74.4	-41.2	175.7	-62.2	-45.4	0	0	0	111.3	D987 L992 K993 L994	D987-D990 PolarHBondContact O-N 3.21Å; D990-L992 PolarHBondContact O-N 3.31Å; D990-K993 PolarHBondContact O-N 3.01Å; D990-L994 WeakPolarHBondContact O-CB 3.18Å; D990-L994 PolarHBondContact O-N 2.8Å
991	D	62.8	Low	59.8	Low	35 Å²	35	84.9 Å²	84.9	19%	0.187	42%	0.42	C	S	.	.	H	α-helix	trans	-57.5	-46.3	170.7	-82.1	-17.8	0	0	0	110.2	R985 D987 K993 L994 V995	R985-D991 IonicContact CZ-OD2 2.64Å; R985-D991 IonicContact NH1-OD2 2.65Å; R985-D991 PolarHBondContact NH1-OD2 3.4Å; D987-D991 VanDerWaalsContact O-CB 3.27Å; D987-D991 WeakPolarHBondContact O-CB 3.27Å; D987-D991 PolarHBondContact O-N 3.08Å; D991-K993 VanDerWaalsContact C-N 3.32Å; D991-K993 PolarHBondContact O-N 3.45Å; D991-L994 PolarHBondContact O-N 2.82Å; D991-V995 WeakPolarHBondContact O-CB 3.43Å; D991-V995 VanDerWaalsContact O-CG2 3.27Å; D991-V995 WeakPolarHBondContact O-CG2 3.24Å; D991-V995 PolarHBondContact O-N 3.06Å
992	L	59.1	Low	59.3	Low	42 Å²	42	83.1 Å²	83.1	22%	0.22	42%	0.415	C	S	.	.	H	α-helix	trans	-63	-37.9	175.9	-113.3	80.4	0	0	0	112.2	A969 L988 D990 N996	A969-L992 HydrophobicContact CB-CD1 4.4Å; L988-L992 HydrophobicContact CD1-CD1 4.19Å; L988-L992 HydrophobicContact CG-CD1 4.28Å; L988-L992 WeakPolarHBondContact O-CB 3.45Å; L988-L992 PolarHBondContact O-N 3.27Å; D990-L992 PolarHBondContact O-N 3.31Å; L992-N996 WeakPolarHBondContact O-CB 3.44Å; L992-N996 PolarHBondContact O-N 2.93Å; L992-N996 PolarHBondContact O-ND2 3.11Å
993	K	61.6	Low	59	Low	144 Å²	144	84.1 Å²	84.1	63%	0.626	42%	0.419	S	S	*	.	H	α-helix	trans	-69.1	-45.3	179.6	-165.9	179.5	-179.2	-170.9	0	110.8	Y989 D990 D991 N996 E997	Y989-K993 WeakPolarHBondContact O-CB 3.21Å; Y989-K993 PolarHBondContact O-N 3.11Å; D990-K993 PolarHBondContact O-N 3.01Å; D991-K993 VanDerWaalsContact C-N 3.32Å; D991-K993 PolarHBondContact O-N 3.45Å; K993-N996 PolarHBondContact O-N 2.95Å; K993-E997 WeakPolarHBondContact O-CB 3.28Å; K993-E997 PolarHBondContact O-N 3.21Å
994	L	66.4	Low	58.6	Low	93 Å²	93	90.2 Å²	90.2	49%	0.487	44%	0.44	S	S	.	.	H	α-helix	trans	-62.4	-43.2	175.4	-175.5	69.9	0	0	0	111.9	D990 D991 E997 I998	D990-L994 WeakPolarHBondContact O-CB 3.18Å; D990-L994 PolarHBondContact O-N 2.8Å; D991-L994 PolarHBondContact O-N 2.82Å; L994-E997 PolarHBondContact O-N 3.03Å; L994-I998 HydrophobicContact CD1-CD1 4.36Å; L994-I998 HydrophobicContact CG-CD1 3.97Å; L994-I998 WeakPolarHBondContact O-CB 3.43Å; L994-I998 VanDerWaalsContact O-CG1 3.29Å; L994-I998 WeakPolarHBondContact O-CG1 3.27Å; L994-I998 PolarHBondContact O-N 3.04Å
995	V	61	Low	58.6	Low	59 Å²	59	88.2 Å²	88.2	36%	0.358	43%	0.425	S	S	.	.	H	α-helix	trans	-64.2	-42.4	175.6	169.1	0	0	0	0	111	D991 E997 V999	D991-V995 WeakPolarHBondContact O-CB 3.43Å; D991-V995 VanDerWaalsContact O-CG2 3.27Å; D991-V995 WeakPolarHBondContact O-CG2 3.24Å; D991-V995 PolarHBondContact O-N 3.06Å; V995-E997 VanDerWaalsContact C-N 3.33Å; V995-E997 PolarHBondContact O-N 2.97Å; V995-V999 HydrophobicContact CG1-CG2 4.47Å; V995-V999 WeakPolarHBondContact O-CB 3.35Å; V995-V999 VanDerWaalsContact O-CG2 3.25Å; V995-V999 WeakPolarHBondContact O-CG2 3.26Å; V995-V999 PolarHBondContact O-N 2.9Å
996	N	57.6	Low	58.3	Low	68 Å²	68	86.8 Å²	86.8	36%	0.364	43%	0.426	S	S	.	.	H	α-helix	trans	-64.2	-37.3	172.8	-85.6	-81.5	0	0	0	112	L992 K993 N1000	L992-N996 WeakPolarHBondContact O-CB 3.44Å; L992-N996 PolarHBondContact O-N 2.93Å; L992-N996 PolarHBondContact O-ND2 3.11Å; K993-N996 PolarHBondContact O-N 2.95Å; N996-N1000 VanDerWaalsContact O-CB 3.25Å; N996-N1000 WeakPolarHBondContact O-CB 3.29Å; N996-N1000 VanDerWaalsContact O-CG 3.3Å; N996-N1000 PolarHBondContact O-N 3.45Å; N996-N1000 PolarHBondContact O-ND2 2.9Å
997	E	63.5	Low	58.1	Low	114 Å²	114	81.7 Å²	81.7	53%	0.533	41%	0.407	S	S	.	.	H	α-helix	trans	-66.8	-47.2	178.9	-167.4	153.3	-138.8	0	0	111.1	K993 L994 V995 V999 N1000 Q1001	K993-E997 WeakPolarHBondContact O-CB 3.28Å; K993-E997 PolarHBondContact O-N 3.21Å; L994-E997 PolarHBondContact O-N 3.03Å; V995-E997 VanDerWaalsContact C-N 3.33Å; V995-E997 PolarHBondContact O-N 2.97Å; E997-V999 PolarHBondContact O-N 2.89Å; E997-N1000 CarbonylContact O-C 3.52Å; E997-N1000 PolarHBondContact O-N 3.27Å; E997-Q1001 VanDerWaalsContact O-CB 3.27Å; E997-Q1001 WeakPolarHBondContact O-CB 3.33Å; E997-Q1001 PolarHBondContact O-N 3.2Å
998	I	65.4	Low	57.5	Low	98 Å²	98	83.2 Å²	83.2	50%	0.503	42%	0.415	S	S	.	.	H	α-helix	trans	-59.9	-44.8	173.6	-68	165.6	0	0	0	111.4	L994 Q1001 A1002	L994-I998 HydrophobicContact CD1-CD1 4.36Å; L994-I998 HydrophobicContact CG-CD1 3.97Å; L994-I998 WeakPolarHBondContact O-CB 3.43Å; L994-I998 VanDerWaalsContact O-CG1 3.29Å; L994-I998 WeakPolarHBondContact O-CG1 3.27Å; L994-I998 PolarHBondContact O-N 3.04Å; I998-Q1001 PolarHBondContact O-N 3.45Å; I998-A1002 WeakPolarHBondContact O-CB 3.4Å; I998-A1002 PolarHBondContact O-N 3.01Å
999	V	59.6	Low	57.1	Low	58 Å²	58	88.4 Å²	88.4	35%	0.352	45%	0.447	S	S	.	.	H	α-helix	trans	-64.9	-46.3	177.6	167.4	0	0	0	0	111	V995 E997 Q1001 A1002 I1003	V995-V999 HydrophobicContact CG1-CG2 4.47Å; V995-V999 WeakPolarHBondContact O-CB 3.35Å; V995-V999 VanDerWaalsContact O-CG2 3.25Å; V995-V999 WeakPolarHBondContact O-CG2 3.26Å; V995-V999 PolarHBondContact O-N 2.9Å; E997-V999 PolarHBondContact O-N 2.89Å; V999-Q1001 PolarHBondContact O-N 3.33Å; V999-A1002 PolarHBondContact O-N 3.12Å; V999-I1003 HydrophobicContact CG1-CD1 3.75Å; V999-I1003 VanDerWaalsContact O-CD1 3.29Å; V999-I1003 WeakPolarHBondContact O-CD1 3.12Å; V999-I1003 WeakPolarHBondContact O-CG1 3.48Å; V999-I1003 PolarHBondContact O-N 3.47Å
1000	N	54.6	Low	56.4	Low	76 Å²	76	85.4 Å²	85.4	41%	0.406	44%	0.44	S	S	.	.	H	α-helix	trans	-68.1	-16.8	175.5	-73.3	-60.2	0	0	0	113.4	N996 E997 R1004	N996-N1000 VanDerWaalsContact O-CB 3.25Å; N996-N1000 WeakPolarHBondContact O-CB 3.29Å; N996-N1000 VanDerWaalsContact O-CG 3.3Å; N996-N1000 PolarHBondContact O-N 3.45Å; N996-N1000 PolarHBondContact O-ND2 2.9Å; E997-N1000 CarbonylContact O-C 3.52Å; E997-N1000 PolarHBondContact O-N 3.27Å; N1000-R1004 PolarHBondContact O-N 3.1Å; N1000-R1004 PolarHBondContact O-NE 3.29Å; N1000-R1004 PolarHBondContact O-NH2 3.49Å
1001	Q	60.8	Low	55.4	Low	102 Å²	102	85.8 Å²	85.8	48%	0.477	44%	0.441	S	S	.	.	H	α-helix	trans	-83.4	-46.7	172	-174.7	168	-13.4	0	0	110.8	E997 I998 V999 I1003 R1004 E1005	E997-Q1001 VanDerWaalsContact O-CB 3.27Å; E997-Q1001 WeakPolarHBondContact O-CB 3.33Å; E997-Q1001 PolarHBondContact O-N 3.2Å; I998-Q1001 PolarHBondContact O-N 3.45Å; V999-Q1001 PolarHBondContact O-N 3.33Å; Q1001-I1003 PolarHBondContact O-N 3.37Å; Q1001-R1004 PolarHBondContact O-N 3.1Å; Q1001-R1004 VanDerWaalsContact O-N 3.09Å; Q1001-E1005 HydrophobicContact CG-CG 4.5Å; Q1001-E1005 WeakPolarHBondContact CG-OE1 3.29Å; Q1001-E1005 PolarHBondContact NE2-OE1 3.39Å; Q1001-E1005 VanDerWaalsContact NE2-OE1 3.08Å; Q1001-E1005 WeakPolarHBondContact O-CB 3.29Å; Q1001-E1005 WeakPolarHBondContact O-CG 3.36Å; Q1001-E1005 PolarHBondContact O-N 3.05Å
1002	A	56.3	Low	54.1	Low	45 Å²	45	92.8 Å²	92.8	37%	0.372	47%	0.472	S	S	.	.	H	α-helix	trans	-63.3	-26.4	174.3	0	0	0	0	0	113.9	I998 V999 A1006	I998-A1002 WeakPolarHBondContact O-CB 3.4Å; I998-A1002 PolarHBondContact O-N 3.01Å; V999-A1002 PolarHBondContact O-N 3.12Å; A1002-A1006 WeakPolarHBondContact O-CB 3.48Å; A1002-A1006 PolarHBondContact O-N 3.45Å
1003	I	58.4	Low	52.9	Low	34 Å²	34	93.8 Å²	93.8	17%	0.174	49%	0.493	C	S	.	.	H	α-helix	trans	-70.2	-48.5	169.7	-66.6	157	0	0	0	110.5	V999 Q1001 E1005 A1006 D1007 P1065	V999-I1003 HydrophobicContact CG1-CD1 3.75Å; V999-I1003 VanDerWaalsContact O-CD1 3.29Å; V999-I1003 WeakPolarHBondContact O-CD1 3.12Å; V999-I1003 WeakPolarHBondContact O-CG1 3.48Å; V999-I1003 PolarHBondContact O-N 3.47Å; Q1001-I1003 PolarHBondContact O-N 3.37Å; I1003-E1005 PolarHBondContact O-N 3.44Å; I1003-A1006 WeakPolarHBondContact O-CA 3.4Å; I1003-A1006 WeakPolarHBondContact O-CB 3.24Å; I1003-A1006 PolarHBondContact O-N 2.92Å; I1003-D1007 PolarHBondContact O-N 3.38Å; I1003-P1065 HydrophobicContact CD1-CG 3.37Å; I1003-P1065 HydrophobicContact CG1-CG 3.97Å
1004	R	51.2	Low	51.5	Low	145 Å²	145	94.9 Å²	94.9	55%	0.547	50%	0.5	S	S	.	.	H	α-helix	trans	-63.4	-42.8	178.9	-80.5	177.1	-79.3	-175.5	0.4	112.3	N1000 Q1001 A1006 D1007 D1008	N1000-R1004 PolarHBondContact O-N 3.1Å; N1000-R1004 PolarHBondContact O-NE 3.29Å; N1000-R1004 PolarHBondContact O-NH2 3.49Å; Q1001-R1004 PolarHBondContact O-N 3.1Å; Q1001-R1004 VanDerWaalsContact O-N 3.09Å; R1004-A1006 PolarHBondContact O-N 3.04Å; R1004-A1006 VanDerWaalsContact O-N 3.15Å; R1004-D1007 PolarHBondContact O-N 3.27Å; R1004-D1007 VanDerWaalsContact O-N 3.17Å; R1004-D1008 WeakPolarHBondContact O-CB 3.44Å; R1004-D1008 PolarHBondContact O-N 3.45Å
1005	E	53.7	Low	49.9	Very low	115 Å²	115	96.2 Å²	96.2	54%	0.537	51%	0.512	S	S	.	.	H	α-helix	trans	-62.7	-16.9	172.3	-69.7	172.7	-167.3	0	0	113.4	Q1001 I1003 V1009	Q1001-E1005 HydrophobicContact CG-CG 4.5Å; Q1001-E1005 WeakPolarHBondContact CG-OE1 3.29Å; Q1001-E1005 PolarHBondContact NE2-OE1 3.39Å; Q1001-E1005 VanDerWaalsContact NE2-OE1 3.08Å; Q1001-E1005 WeakPolarHBondContact O-CB 3.29Å; Q1001-E1005 WeakPolarHBondContact O-CG 3.36Å; Q1001-E1005 PolarHBondContact O-N 3.05Å; I1003-E1005 PolarHBondContact O-N 3.44Å; E1005-V1009 WeakPolarHBondContact O-CG2 3.48Å
1006	A	48.8	Very low	48.4	Very low	27 Å²	27	101.8 Å²	101.8	22%	0.223	53%	0.534	C	S	.	.	H	α-helix	trans	-91	-38.9	171.5	0	0	0	0	0	112.7	A1002 I1003 R1004 Y1068	A1002-A1006 WeakPolarHBondContact O-CB 3.48Å; A1002-A1006 PolarHBondContact O-N 3.45Å; I1003-A1006 WeakPolarHBondContact O-CA 3.4Å; I1003-A1006 WeakPolarHBondContact O-CB 3.24Å; I1003-A1006 PolarHBondContact O-N 2.92Å; R1004-A1006 PolarHBondContact O-N 3.04Å; R1004-A1006 VanDerWaalsContact O-N 3.15Å; A1006-Y1068 HydrophobicContact CB-CE1 4.19Å
1007	D	46.7	Very low	47.2	Very low	82 Å²	82	106.8 Å²	106.8	44%	0.439	56%	0.561	S	S	.	*	H	α-helix	trans	-70.4	-45.7	179	-70	-26.4	0	0	0	111.8	I1003 R1004 V1009 Q1010 I1011	I1003-D1007 PolarHBondContact O-N 3.38Å; R1004-D1007 PolarHBondContact O-N 3.27Å; R1004-D1007 VanDerWaalsContact O-N 3.17Å; D1007-V1009 VanDerWaalsContact C-N 3.25Å; D1007-V1009 PolarHBondContact O-N 3.18Å; D1007-Q1010 PolarHBondContact O-N 3.05Å; D1007-I1011 WeakPolarHBondContact O-CG1 3.49Å; D1007-I1011 PolarHBondContact O-N 3.21Å
1008	D	46.2	Very low	45.6	Very low	99 Å²	99	107.1 Å²	107.1	53%	0.529	58%	0.576	S	S	.	*	H	α-helix	trans	-60.2	-36.8	179	-70	-31.7	0	0	0	111.4	R1004 Q1010 I1011 E1012	R1004-D1008 WeakPolarHBondContact O-CB 3.44Å; R1004-D1008 PolarHBondContact O-N 3.45Å; D1008-Q1010 PolarHBondContact O-N 3.42Å; D1008-I1011 PolarHBondContact O-N 3.39Å; D1008-I1011 VanDerWaalsContact O-N 3.17Å; D1008-E1012 PolarHBondContact O-N 3.34Å
1009	V	48.9	Very low	44	Very low	118 Å²	118	106.7 Å²	106.7	72%	0.715	59%	0.587	S	S	*	*	H	α-helix	trans	-70.3	-11	176.3	171.4	0	0	0	0	113.2	E1005 D1007	E1005-V1009 WeakPolarHBondContact O-CG2 3.48Å; D1007-V1009 VanDerWaalsContact C-N 3.25Å; D1007-V1009 PolarHBondContact O-N 3.18Å
1010	Q	41.4	Very low	42.8	Very low	131 Å²	131	111.4 Å²	111.4	61%	0.612	61%	0.61	S	S	*	*	H	α-helix	trans	-96.2	-27.3	169.1	-63.9	-158.1	-119.1	0	0	113.1	D1007 D1008 G1013	D1007-Q1010 PolarHBondContact O-N 3.05Å; D1008-Q1010 PolarHBondContact O-N 3.42Å; Q1010-G1013 PolarHBondContact O-N 3.35Å
1011	I	39.4	Very low	42	Very low	117 Å²	117	117.2 Å²	117.2	60%	0.6	64%	0.635	S	S	*	*	H	α-helix	trans	-77.6	-35.3	-174.6	-67.3	167.4	0	0	0	112.3	D1007 D1008 G1013	D1007-I1011 WeakPolarHBondContact O-CG1 3.49Å; D1007-I1011 PolarHBondContact O-N 3.21Å; D1008-I1011 PolarHBondContact O-N 3.39Å; D1008-I1011 VanDerWaalsContact O-N 3.17Å; I1011-G1013 PolarHBondContact O-N 3.26Å
1012	E	35.1	Very low	40.7	Very low	181 Å²	181	120.8 Å²	120.8	85%	0.846	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.3	0.8	175.3	-62.7	-167.2	144.6	0	0	113.9	D1008	D1008-E1012 PolarHBondContact O-N 3.34Å
1013	G	35.1	Very low	39.7	Very low	63 Å²	63	122.1 Å²	122.1	65%	0.649	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.3	-8.4	-173	0	0	0	0	0	116.8	Q1010 I1011	Q1010-G1013 PolarHBondContact O-N 3.35Å; I1011-G1013 PolarHBondContact O-N 3.26Å
1014	E	32.4	Very low	38.6	Very low	167 Å²	167	126.6 Å²	126.6	78%	0.78	70%	0.704	S	S	*	*	S	Bend	trans	-115.7	7.2	-168.1	-62.2	-165	150.2	0	0	114.8
1015	T	31.2	Very low	37.8	Very low	121 Å²	121	127 Å²	127	74%	0.742	72%	0.717	S	S	*	*	S	Bend	trans	-108.4	24.5	-172.7	52.3	0	0	0	0	115.7
1016	E	31	Very low	36.8	Very low	176 Å²	176	125.1 Å²	125.1	82%	0.822	73%	0.729	S	S	*	*	S	Bend	trans	-133.6	63.6	173.5	-70	-164.1	149.6	0	0	112.4
1017	N	31.7	Very low	36.1	Very low	173 Å²	173	132.7 Å²	132.7	93%	0.925	75%	0.753	S	S	*	*	S	Bend	trans	-164.3	45.4	170.4	-104.3	-58.4	0	0	0	115.4
1018	S	30.3	Very low	35.4	Very low	122 Å²	122	136.7 Å²	136.7	85%	0.853	77%	0.766	S	S	*	*			trans	-159.6	87.2	165.3	63.1	0	0	0	0	113.4
1019	A	31.8	Very low	34.8	Very low	88 Å²	88	138.2 Å²	138.2	73%	0.727	78%	0.779	S	S	*	*			trans	-133.5	167	159.2	0	0	0	0	0	107.9
1020	D	34.7	Very low	34	Very low	157 Å²	157	139.3 Å²	139.3	84%	0.84	78%	0.781	S	S	*	*			trans	69.9	86.6	-178.9	-51.5	-18.1	0	0	0	116
1021	E	36.9	Very low	33.8	Very low	199 Å²	199	140.8 Å²	140.8	93%	0.93	79%	0.793	S	S	*	*				-178.6	122.3	112.6	-96.5	-177.2	-177.7	0	0	111.4
1022	D	34.2	Very low	33.5	Very low	177 Å²	177	142.1 Å²	142.1	95%	0.947	80%	0.802	S	S	*	*			trans	-84	144.5	177.7	-67	-65.8	0	0	0	112.4
1023	G	34.1	Very low	33.5	Very low	72 Å²	72	140.6 Å²	140.6	74%	0.742	81%	0.805	S	S	*	*			trans	-153.7	2.4	-164.9	0	0	0	0	0	122.8
1024	V	36.1	Very low	33.3	Very low	129 Å²	129	144.5 Å²	144.5	78%	0.782	81%	0.811	S	S	*	*			trans	58.7	114.1	161.2	-176.6	0	0	0	0	120.5
1025	D	33.5	Very low	33.3	Very low	154 Å²	154	142.4 Å²	142.4	82%	0.824	81%	0.81	S	S	*	*			trans	44.3	140.9	144.2	-58.9	-25.5	0	0	0	124.6
1026	G	34.4	Very low	33.3	Very low	75 Å²	75	142 Å²	142	77%	0.773	81%	0.807	S	S	*	*			trans	-163.9	-8.6	177.7	0	0	0	0	0	122
1027	Y	32.3	Very low	33.3	Very low	185 Å²	185	141.2 Å²	141.2	73%	0.725	81%	0.808	S	S	*	*			trans	55.5	119.5	167.2	-92.4	-109.4	0	0	0	121.9
1028	K	33.6	Very low	33.4	Very low	167 Å²	167	136.9 Å²	136.9	73%	0.726	80%	0.804	S	S	*	*			trans	47.3	152.1	131	-55.7	-171.5	-173	176.1	0	121
1029	T	33.4	Very low	33.4	Very low	130 Å²	130	143 Å²	143	80%	0.798	81%	0.809	S	S	*	*			cis	-154.8	172.4	12.4	-15.6	0	0	0	0	110.9
1030	N	32.7	Very low	33.4	Very low	142 Å²	142	142.8 Å²	142.8	76%	0.759	81%	0.807	S	S	*	*			trans	-68.1	162.4	170.3	-58.2	-23.8	0	0	0	112.9
1031	D	36.3	Very low	33.3	Very low	162 Å²	162	141.3 Å²	141.3	87%	0.866	81%	0.809	S	S	*	*				-164.7	162.3	111.5	-107.9	-24.9	0	0	0	114.3
1032	N	32.3	Very low	33.1	Very low	145 Å²	145	134.7 Å²	134.7	78%	0.775	79%	0.794	S	S	*	*			trans	-101.5	151.1	179.3	-67.5	-74.3	0	0	0	111.9
1033	T	36	Very low	33.2	Very low	148 Å²	148	133.9 Å²	133.9	91%	0.908	79%	0.79	S	S	*	*			trans	-162.4	151.3	145.9	-0.6	0	0	0	0	113.4
1034	N	30.6	Very low	33.1	Very low	146 Å²	146	136.4 Å²	136.4	78%	0.781	78%	0.782	S	S	*	*			trans	-89.3	156.9	169.7	-62.2	-65.1	0	0	0	110.2
1035	T	32.3	Very low	33	Very low	123 Å²	123	136 Å²	136	76%	0.755	77%	0.77	S	S	*	*				162.9	128.8	109.2	46.1	0	0	0	0	115.5
1036	T	31.7	Very low	32.8	Very low	111 Å²	111	138.1 Å²	138.1	68%	0.681	77%	0.766	S	S	*	*			trans	55.8	129.6	137.1	64.3	0	0	0	0	124.8
1037	N	31.2	Very low	32.8	Very low	161 Å²	161	140.8 Å²	140.8	86%	0.861	76%	0.758	S	S	*	*			trans	76	113.6	134.8	-63.5	-14.3	0	0	0	121.4
1038	G	33.4	Very low	32.8	Very low	81 Å²	81	138.8 Å²	138.8	84%	0.835	76%	0.755	S	S	*	*			trans	-163.9	109.8	166.5	0	0	0	0	0	113.5
1039	R	29.2	Very low	32.6	Very low	251 Å²	251	136 Å²	136	95%	0.947	75%	0.748	S	S	*	*			trans	-60.8	161.8	171.2	-95.2	174.1	165.7	148.1	-7.8	112.5
1040	A	33.4	Very low	32.3	Very low	83 Å²	83	138.6 Å²	138.6	69%	0.686	75%	0.752	S	S	*	*			cis	-164.7	165.2	1.5	0	0	0	0	0	112.9
1041	S	32	Very low	32.2	Very low	126 Å²	126	141.8 Å²	141.8	88%	0.881	75%	0.753	S	S	*	*			trans	49.2	133.4	145.7	-157.3	0	0	0	0	121.5
1042	G	33.5	Very low	31.7	Very low	61 Å²	61	141.3 Å²	141.3	63%	0.629	75%	0.75	S	S	*	*			cis	163	166.5	-5.1	0	0	0	0	0	114.9
1043	N	34.9	Very low	31.6	Very low	160 Å²	160	144.9 Å²	144.9	86%	0.856	76%	0.755	S	S	*	*			trans	65.7	167.6	169.6	-64.9	-16.5	0	0	0	119.9
1044	H	33.4	Very low	31.1	Very low	125 Å²	125	145.7 Å²	145.7	58%	0.579	75%	0.748	S	S	*	*				-161	147.2	-68.6	-138.7	13.1	0	0	0	114.2	Q26	Q26-H1044 PolarHBondContact NE2-O 2.69Å
1045	K	32.5	Very low	31.1	Very low	120 Å²	120	144.3 Å²	144.3	52%	0.522	75%	0.747	S	S	.	*			trans	77.9	113.9	149.1	-74	168.3	177.5	167.2	0	123.4	Q26	Q26-K1045 PolarHBondContact NE2-O 2.96Å
1046	R	29.7	Very low	30.8	Very low	198 Å²	198	144.2 Å²	144.2	75%	0.747	75%	0.75	S	S	*	*				78.2	145.9	121.1	-65.3	178.9	172.6	-172.2	-2.7	118.8
1047	H	33.7	Very low	30.6	Very low	131 Å²	131	148.8 Å²	148.8	61%	0.606	76%	0.761	S	S	*	*			cis	-163	161	-5.5	-133	-64.6	0	0	0	112.3
1048	H	32.6	Very low	30.4	Very low	144 Å²	144	150.4 Å²	150.4	67%	0.667	76%	0.76	S	S	*	*			trans	68.9	145.3	158.1	-63	-59.7	0	0	0	117.9
1049	D	29.1	Very low	30	Very low	108 Å²	108	154.1 Å²	154.1	58%	0.578	76%	0.761	S	S	*	*			cis	-154	115	-12.3	-119.7	1.6	0	0	0	111.5
1050	E	28.6	Very low	29.9	Very low	185 Å²	185	150.2 Å²	150.2	86%	0.864	76%	0.758	S	S	*	*			trans	-137.6	121.6	158.4	-78.5	-161.2	144.9	0	0	109
1051	R	29.8	Very low	29.5	Very low	209 Å²	209	155.3 Å²	155.3	79%	0.789	77%	0.765	S	S	*	*			trans	-105	91.5	-179.3	-98.5	-174.6	-82	171.4	-5.3	111.7	Y1053	R1051-Y1053 PolarHBondContact O-N 3.47Å
1052	N	26.9	Very low	29.2	Very low	152 Å²	152	158.4 Å²	158.4	81%	0.813	76%	0.763	S	S	*	*			trans	-55.6	120.2	161.9	-93.2	-61.5	0	0	0	110.5	Q1054	N1052-Q1054 PolarHBondContact O-N 2.9Å
1053	Y	28.7	Very low	28.9	Very low	220 Å²	220	160.9 Å²	160.9	86%	0.863	77%	0.771	S	S	*	*			trans	-84.2	88.6	174.9	-121.5	-90.9	0	0	0	110.3	R1051	R1051-Y1053 PolarHBondContact O-N 3.47Å
1054	Q	27.3	Very low	28.7	Very low	164 Å²	164	157 Å²	157	77%	0.766	75%	0.748	S	S	*	*			trans	-70.2	128	165.5	-72.7	-178.1	-28	0	0	109.5	N1052 C1056	N1052-Q1054 PolarHBondContact O-N 2.9Å; Q1054-C1056 PolarHBondContact O-N 3.26Å; Q1054-C1056 VanDerWaalsContact O-N 3.11Å
1055	P	30.1	Very low	28.4	Very low	118 Å²	118	154.6 Å²	154.6	77%	0.766	74%	0.743	S	S	*	*			trans	-70.2	109.2	174.1	27.8	-32.8	0	0	0	109.7	K1057	P1055-K1057 PolarHBondContact O-N 3.05Å
1056	C	26.3	Very low	28.3	Very low	121 Å²	121	153.2 Å²	153.2	82%	0.818	74%	0.744	S	S	*	*			trans	-63.5	104.9	177.2	-69.4	0	0	0	0	111	Q1054 K1058	Q1054-C1056 PolarHBondContact O-N 3.26Å; Q1054-C1056 VanDerWaalsContact O-N 3.11Å; C1056-K1058 VanDerWaalsContact C-N 3.29Å; C1056-K1058 PolarHBondContact O-N 2.92Å
1057	K	25.8	Very low	28.1	Very low	207 Å²	207	151.3 Å²	151.3	90%	0.9	75%	0.749	S	S	*	*			trans	-64	87.2	164.5	-72.1	-176	177.3	179.7	0	110.1	P1055	P1055-K1057 PolarHBondContact O-N 3.05Å
1058	K	28.5	Very low	27.8	Very low	194 Å²	194	152 Å²	152	84%	0.843	75%	0.747	S	S	*	*			trans	-109	136.8	158.4	-82.6	-171.5	173.8	-179.1	0	109.1	C1056 N1060	C1056-K1058 VanDerWaalsContact C-N 3.29Å; C1056-K1058 PolarHBondContact O-N 2.92Å; K1058-N1060 PolarHBondContact O-N 3.43Å
1059	N	24.9	Very low	27.5	Very low	160 Å²	160	153.7 Å²	153.7	86%	0.856	75%	0.753	S	S	*	*			trans	-68.2	120.9	-170.8	-63.1	-36.5	0	0	0	111.5
1060	N	27	Very low	27.4	Very low	168 Å²	168	156.8 Å²	156.8	90%	0.898	76%	0.761	S	S	*	*			trans	-144.2	120.7	146.1	-96.6	-24.7	0	0	0	108	K1058	K1058-N1060 PolarHBondContact O-N 3.43Å
1061	K	25.1	Very low	27.2	Very low	190 Å²	190	156.1 Å²	156.1	83%	0.826	76%	0.758	S	S	*	*			trans	-83.9	170.9	173.4	-68.2	-178	175.4	-176.9	0	109.5
1062	F	25.1	Very low	27.1	Very low	191 Å²	191	156.7 Å²	156.7	84%	0.838	76%	0.76	S	S	*	*			trans	79.8	46.9	-179	-57.1	-79.5	0	0	0	117.3
1063	S	27.7	Very low	27	Very low	113 Å²	113	159.2 Å²	159.2	79%	0.79	76%	0.764	S	S	*	*			trans	-70.7	142	141.5	49.8	0	0	0	0	109.7
1064	H	30.9	Very low	26.8	Very low	80 Å²	80	157.2 Å²	157.2	37%	0.37	77%	0.767	S	S	.	*			trans	-76.1	136.9	173.9	-82.2	-144.8	0	0	0	110.3	E970 K974 V1066	E970-H1064 IonicContact OE1-CE1 3.57Å; E970-H1064 IonicContact OE1-ND1 3.14Å; E970-H1064 IonicContact OE1-NE2 2.71Å; E970-H1064 IonicContact OE2-CE1 2.73Å; E970-H1064 PolarHBondContact OE2-CE1 3.41Å; E970-H1064 IonicContact OE2-ND1 3.6Å; K974-H1064 PolarHBondContact NZ-CD2 3.45Å; K974-H1064 PolarHBondContact NZ-CE1 2.9Å; K974-H1064 PolarHBondContact NZ-NE2 3.25Å; H1064-V1066 PolarHBondContact O-N 3.17Å
1065	P	26.2	Very low	26.8	Very low	74 Å²	74	154.9 Å²	154.9	48%	0.481	77%	0.769	S	S	.	*	S	Bend	trans	-81.7	84.1	179.3	33.7	-35.1	0	0	0	111.1	I1003	I1003-P1065 HydrophobicContact CD1-CG 3.37Å; I1003-P1065 HydrophobicContact CG1-CG 3.97Å
1066	V	30.6	Very low	26.7	Very low	91 Å²	91	157.5 Å²	157.5	55%	0.552	77%	0.771	S	S	*	*			trans	-125.2	35.8	161	-158.8	0	0	0	0	110.5	P854 H1064	P854-V1066 HydrophobicContact CG-CG1 4.3Å; H1064-V1066 PolarHBondContact O-N 3.17Å
1067	N	25.6	Very low	26.9	Very low	157 Å²	157	163.7 Å²	163.7	84%	0.84	78%	0.777	S	S	*	*			trans	-98.8	69.4	165.2	-90.9	-18.8	0	0	0	109.1	F1069	N1067-F1069 VanDerWaalsContact C-N 3.32Å; N1067-F1069 PolarHBondContact O-N 3.35Å
1068	Y	27.1	Very low	26.8	Very low	145 Å²	145	160.6 Å²	160.6	57%	0.569	77%	0.77	S	S	*	*			trans	-71.6	86.6	176.5	-88.4	-72.5	0	0	0	111	A1006 K1070	A1006-Y1068 HydrophobicContact CB-CE1 4.19Å; Y1068-K1070 PolarHBondContact O-N 3.09Å
1069	F	25.4	Very low	26.9	Very low	180 Å²	180	156.8 Å²	156.8	79%	0.789	77%	0.765	S	S	*	*			trans	-75.1	57.9	-177.3	-142	-79.1	0	0	0	112.4	N1067 Q1071	N1067-F1069 VanDerWaalsContact C-N 3.32Å; N1067-F1069 PolarHBondContact O-N 3.35Å; F1069-Q1071 HydrophobicContact CD1-CG 4.37Å; F1069-Q1071 PolarHBondContact O-N 2.76Å
1070	K	27.7	Very low	27	Very low	174 Å²	174	156.3 Å²	156.3	76%	0.757	76%	0.762	S	S	*	*			trans	-80.1	83.7	-173.9	-155.8	153.7	-162.1	155.1	0	111.4	Y1068 R1072	Y1068-K1070 PolarHBondContact O-N 3.09Å; K1070-R1072 PolarHBondContact O-N 3.46Å
1071	Q	25	Very low	27.1	Very low	170 Å²	170	156 Å²	156	79%	0.794	76%	0.759	S	S	*	*			trans	-52.3	112.5	170.5	-65.3	-174.6	6.3	0	0	110.5	F1069	F1069-Q1071 HydrophobicContact CD1-CG 4.37Å; F1069-Q1071 PolarHBondContact O-N 2.76Å
1072	R	26.5	Very low	27.2	Very low	222 Å²	222	154.1 Å²	154.1	84%	0.838	76%	0.757	S	S	*	*			trans	-125.3	127.9	160.1	-82.9	-168.5	165.8	-176.8	-3.3	109.9	K1070	K1070-R1072 PolarHBondContact O-N 3.46Å
1073	K	26.3	Very low	27.3	Very low	205 Å²	205	151.7 Å²	151.7	89%	0.891	74%	0.742	S	S	*	*			trans	-62.3	147.4	-173.6	-66.8	170.2	179	170.9	0	110.8	S1075	K1073-S1075 PolarHBondContact O-N 3.13Å
1074	L	24.8	Very low	27.3	Very low	177 Å²	177	155.8 Å²	155.8	93%	0.927	75%	0.746	S	S	*	*			trans	-55.3	133.9	177.7	-75.5	66.5	0	0	0	111.7
1075	S	27	Very low	27.2	Very low	115 Å²	115	156.9 Å²	156.9	80%	0.804	76%	0.762	S	S	*	*			trans	-141.9	135.3	150.2	59	0	0	0	0	109.3	K1073	K1073-S1075 PolarHBondContact O-N 3.13Å
1076	H	27.8	Very low	27.4	Very low	173 Å²	173	157.8 Å²	157.8	80%	0.801	77%	0.77	S	S	*	*			trans	-69.2	136.1	-174.6	-74.4	-45.3	0	0	0	112.5
1077	W	29.3	Very low	27.3	Very low	252 Å²	252	162 Å²	162	96%	0.955	78%	0.784	S	S	*	*			trans	-150.6	110.4	135.3	-84.7	108.4	0	0	0	110.8
1078	N	24.8	Very low	27.8	Very low	141 Å²	141	159.6 Å²	159.6	75%	0.754	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-90.3	136.9	172.7	-94.5	-14.9	0	0	0	111.1
1079	P	31	Very low	27.9	Very low	114 Å²	114	159.9 Å²	159.9	74%	0.74	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-103.5	123.2	145.9	-1.4	21.9	0	0	0	109.5	I1081	P1079-I1081 PolarHBondContact O-N 3.47Å
1080	L	25.8	Very low	28	Very low	150 Å²	150	160.8 Å²	160.8	79%	0.785	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-72.9	124.4	-178.2	-65.1	90.5	0	0	0	112.2
1081	I	29	Very low	28	Very low	162 Å²	162	160.7 Å²	160.7	83%	0.831	79%	0.788	S	S	*	*			trans	-132.9	132.2	142.1	-62.5	-174	0	0	0	107.8	P1079 R1083	P1079-I1081 PolarHBondContact O-N 3.47Å; I1081-R1083 PolarHBondContact O-N 3.43Å
1082	L	27.8	Very low	28.1	Very low	150 Å²	150	159.4 Å²	159.4	79%	0.785	78%	0.782	S	S	*	*			trans	-85.9	110.1	-171	-74.6	151.6	0	0	0	112.4
1083	R	26.4	Very low	28.3	Very low	141 Å²	141	158.1 Å²	158.1	53%	0.532	79%	0.785	S	S	.	*			trans	-112.3	114.5	153.8	-172.3	-178.6	-175	-167.1	2.4	107.1	I1081	I1081-R1083 PolarHBondContact O-N 3.43Å
1084	K	28.2	Very low	28.4	Very low	199 Å²	199	153.6 Å²	153.6	87%	0.865	78%	0.779	S	S	*	*			trans	-144.6	107	173.8	-164.8	-176.6	-174.7	-169.7	0	109.3
1085	S	28.3	Very low	28.8	Very low	102 Å²	102	149.8 Å²	149.8	71%	0.713	77%	0.773	S	S	*	*			trans	-89.2	161.9	166.9	49.8	0	0	0	0	110.7
1086	S	30.7	Very low	29	Very low	93 Å²	93	151.4 Å²	151.4	65%	0.65	77%	0.773	S	S	*	*			trans	-58.1	131.7	165.7	32.7	0	0	0	0	110.7
1087	E	29.6	Very low	29.2	Very low	179 Å²	179	149.1 Å²	149.1	84%	0.836	77%	0.767	S	S	*	*				89.9	160.4	86.7	-75.9	-175.1	160.7	0	0	113.2
1088	P	35.4	Very low	29.2	Very low	107 Å²	107	147.4 Å²	147.4	70%	0.695	76%	0.76	S	S	*	*			cis	-131.2	-150.3	-21.8	26	-1.5	0	0	0	111.8
1089	E	29.1	Very low	29.4	Very low	152 Å²	152	145.2 Å²	145.2	71%	0.71	76%	0.756	S	S	*	*			trans	99	99.7	153.3	-55.3	-106.2	104.2	0	0	118.9
1090	W	27	Very low	29.3	Very low	199 Å²	199	144.9 Å²	144.9	75%	0.754	76%	0.756	S	S	*	*			trans	31.7	129.2	141.6	-41.3	100.8	0	0	0	122.6
1091	L	28.3	Very low	29.6	Very low	171 Å²	171	142.6 Å²	142.6	90%	0.895	76%	0.759	S	S	*	*				-152.1	155.4	104.6	-110.5	169.7	0	0	0	111.4
1092	H	27.8	Very low	29.6	Very low	143 Å²	143	140.9 Å²	140.9	66%	0.662	76%	0.756	S	S	*	*			trans	-77.5	153.5	-175.3	-77.8	-123.4	0	0	0	112.7
1093	H	30.5	Very low	29.6	Very low	196 Å²	196	138.8 Å²	138.8	91%	0.907	75%	0.754	S	S	*	*				-162.5	149.8	111.2	-113.6	-85.4	0	0	0	111.8
1094	S	27.9	Very low	29.8	Very low	109 Å²	109	137.5 Å²	137.5	76%	0.762	76%	0.762	S	S	*	*			trans	-108.7	150.5	-167.5	73.5	0	0	0	0	114.8
1095	A	33.5	Very low	29.7	Very low	97 Å²	97	135.2 Å²	135.2	80%	0.802	76%	0.759	S	S	*	*			trans	-147.9	132.1	148.3	0	0	0	0	0	110.5
1096	N	29.8	Very low	29.6	Very low	150 Å²	150	138.9 Å²	138.9	80%	0.802	76%	0.762	S	S	*	*			trans	-73.9	164.1	165.1	-77.8	-32.8	0	0	0	108.7
1097	D	32	Very low	29.4	Very low	124 Å²	124	140.5 Å²	140.5	66%	0.663	76%	0.763	S	S	*	*				-164	167.4	55.5	-126.6	-30	0	0	0	117.3
1098	R	30	Very low	29.3	Very low	217 Å²	217	138.4 Å²	138.4	82%	0.819	76%	0.763	S	S	*	*			trans	-5.1	155.8	152.3	-69.6	158.2	-159.4	-147.7	-2.2	120.1
1099	S	28.9	Very low	28.9	Very low	94 Å²	94	136.7 Å²	136.7	66%	0.657	77%	0.765	S	S	*	*			cis	-175.7	167.7	-11.8	53.6	0	0	0	0	110
1100	S	28.8	Very low	29	Very low	108 Å²	108	137.7 Å²	137.7	76%	0.755	77%	0.773	S	S	*	*			trans	49.6	129.1	152.2	57.4	0	0	0	0	119.4
1101	A	32.7	Very low	28.9	Very low	101 Å²	101	139 Å²	139	84%	0.835	78%	0.778	S	S	*	*				-163.4	-178.5	58.9	0	0	0	0	0	113.3
1102	T	28.9	Very low	28.9	Very low	126 Å²	126	140.6 Å²	140.6	77%	0.773	78%	0.778	S	S	*	*			trans	-113.3	159.6	-165.9	48.2	0	0	0	0	115
1103	S	28	Very low	28.8	Very low	107 Å²	107	144 Å²	144	75%	0.748	79%	0.785	S	S	*	*			trans	66.2	160.5	162.4	59	0	0	0	0	115.8
1104	T	30.3	Very low	28.7	Very low	114 Å²	114	143.4 Å²	143.4	70%	0.699	78%	0.776	S	S	*	*			cis	-157.9	144.2	27.2	-42.6	0	0	0	0	112.8
1105	L	26.8	Very low	28.7	Very low	151 Å²	151	145 Å²	145	79%	0.791	77%	0.771	S	S	*	*			trans	50.4	157.1	154.7	-75.1	170.5	0	0	0	124.1
1106	F	25.1	Very low	28.6	Very low	179 Å²	179	147.7 Å²	147.7	79%	0.785	77%	0.77	S	S	*	*			trans	-23.4	151	150.1	-76.2	-114.5	0	0	0	114.4
1107	N	26.1	Very low	28.4	Very low	127 Å²	127	148.9 Å²	148.9	68%	0.679	77%	0.768	S	S	*	*				-174.1	166.8	56.1	-144.7	-18	0	0	0	114.4
1108	T	28.9	Very low	28.1	Very low	134 Å²	134	150.8 Å²	150.8	82%	0.822	77%	0.773	S	S	*	*			trans	59.1	163.3	156.2	59.2	0	0	0	0	121.5
1109	G	27.3	Very low	28.1	Very low	72 Å²	72	144.2 Å²	144.2	74%	0.742	77%	0.773	S	S	*	*			trans	128.8	59.5	138.8	0	0	0	0	0	119.8	R1111	G1109-R1111 PolarHBondContact O-N 3.14Å
1110	I	29.6	Very low	28.1	Very low	172 Å²	172	149.2 Å²	149.2	88%	0.882	78%	0.783	S	S	*	*			trans	-66.9	117.5	163.7	-58.1	169.5	0	0	0	109.6
1111	R	26.1	Very low	28.1	Very low	227 Å²	227	149.2 Å²	149.2	86%	0.857	78%	0.782	S	S	*	*			trans	165.9	114.9	142.4	-95.7	161.6	174.7	-173.4	-0.6	113.6	G1109	G1109-R1111 PolarHBondContact O-N 3.14Å
1112	K	28.4	Very low	27.9	Very low	204 Å²	204	151 Å²	151	89%	0.887	78%	0.778	S	S	*	*				179.4	131.4	104	-101.3	175.1	-179.1	176.8	0	113.1
1113	W	26.2	Very low	27.8	Very low	215 Å²	215	151.8 Å²	151.8	81%	0.814	78%	0.776	S	S	*	*			trans	-65.4	151	149.3	-98.5	35.5	0	0	0	109.9
1114	Y	26.8	Very low	27.6	Very low	184 Å²	184	151.1 Å²	151.1	72%	0.722	77%	0.771	S	S	*	*				179.6	148.6	100.6	-109.1	-66.9	0	0	0	116.8
1115	H	28.4	Very low	27.4	Very low	143 Å²	143	155 Å²	155	66%	0.662	78%	0.778	S	S	*	*			trans	84.5	149.8	141.9	-99	-66.8	0	0	0	124.3
1116	I	30.8	Very low	27.4	Very low	152 Å²	152	154.6 Å²	154.6	78%	0.779	78%	0.782	S	S	*	*			trans	73.3	92.7	166.8	-59.6	150.1	0	0	0	113.9
1117	K	26.1	Very low	27.4	Very low	176 Å²	176	153.5 Å²	153.5	77%	0.765	78%	0.783	S	S	*	*			cis	73.8	104.9	48.7	-104.3	-160.7	177.9	-175.5	0	116.3
1118	H	26.9	Very low	27.3	Very low	163 Å²	163	155 Å²	155	76%	0.755	79%	0.791	S	S	*	*			trans	48	114.9	145.4	-62.6	-54.5	0	0	0	122.2
1119	G	29.8	Very low	27.2	Very low	79 Å²	79	158.6 Å²	158.6	81%	0.814	80%	0.795	S	S	*	*			trans	-118.4	145.6	132.3	0	0	0	0	0	109.4
1120	K	27.2	Very low	27.2	Very low	200 Å²	200	162 Å²	162	87%	0.87	80%	0.801	S	S	*	*			trans	-149.3	93.7	-175.8	-137.6	-163.3	-171.2	-168	0	112.9
1121	S	30.4	Very low	26.9	Very low	107 Å²	107	163.6 Å²	163.6	75%	0.748	80%	0.802	S	S	*	*			trans	-172.9	154.2	166.4	50.2	0	0	0	0	107.8
1122	N	28.1	Very low	26.8	Very low	138 Å²	138	157.7 Å²	157.7	74%	0.738	80%	0.796	S	S	*	*			cis	-147.6	154.8	-18	-115.9	-11.3	0	0	0	110.4
1123	I	26	Very low	26.7	Very low	143 Å²	143	154.3 Å²	154.3	73%	0.733	79%	0.792	S	S	*	*			trans	14.3	131.3	133.8	-56.5	167.4	0	0	0	116.5
1124	S	23.9	Very low	26.7	Very low	93 Å²	93	149.6 Å²	149.6	65%	0.65	78%	0.783	S	S	*	*			cis	-174.7	152.9	-11.6	59.9	0	0	0	0	110.6
1125	K	25.8	Very low	26.6	Very low	195 Å²	195	145 Å²	145	85%	0.848	77%	0.771	S	S	*	*			trans	155.3	166.9	144.9	-86.5	163	-176.6	177	0	110.5
1126	V	28.2	Very low	26.4	Very low	144 Å²	144	146 Å²	146	87%	0.873	78%	0.78	S	S	*	*			trans	61.9	54.3	177.3	-155.8	0	0	0	0	115.7
1127	I	25.5	Very low	26.1	Very low	155 Å²	155	142.5 Å²	142.5	80%	0.795	77%	0.766	S	S	*	*			trans	-115.6	98.9	146.8	-62	177.9	0	0	0	106.8
1128	N	24.1	Very low	26	Very low	160 Å²	160	141.8 Å²	141.8	86%	0.856	77%	0.767	S	S	*	*			trans	156.3	84.1	155.3	-84	-30.2	0	0	0	112.6
1129	K	25.6	Very low	25.8	Very low	209 Å²	209	143 Å²	143	91%	0.909	77%	0.77	S	S	*	*			trans	-163.7	123.7	153.4	-96	176.9	-178.7	-177.2	0	103.3
1130	T	27.4	Very low	25.5	Very low	142 Å²	142	148.3 Å²	148.3	87%	0.871	77%	0.771	S	S	*	*			cis	-127.1	131.7	20.6	45.4	0	0	0	0	113.5
1131	K	24	Very low	25.3	Very low	207 Å²	207	145.1 Å²	145.1	90%	0.9	76%	0.763	S	S	*	*	S	Bend	trans	-142.4	132.3	159.5	-128.7	-171	-176.5	-171.7	0	107
1132	S	24.5	Very low	25.1	Very low	103 Å²	103	145.2 Å²	145.2	72%	0.72	76%	0.763	S	S	*	*			trans	56.5	101.7	170.8	174.7	0	0	0	0	118.2
1133	V	26	Very low	25.2	Very low	132 Å²	132	143.5 Å²	143.5	80%	0.8	76%	0.76	S	S	*	*			trans	-130.3	46	137.3	-161.1	0	0	0	0	110.3	N1135	V1133-N1135 PolarHBondContact O-N 3.33Å
1134	D	25.8	Very low	25.2	Very low	117 Å²	117	142.5 Å²	142.5	63%	0.626	76%	0.756	S	S	*	*			trans	-73.4	72.4	159.2	-86.3	-15.6	0	0	0	107.6	K499	K499-D1134 IonicContact NZ-OD1 2.74Å; K499-D1134 IonicContact NZ-OD2 3.54Å; K499-D1134 PolarHBondContact NZ-OD2 3.06Å
1135	N	23.7	Very low	25.3	Very low	88 Å²	88	145.5 Å²	145.5	47%	0.471	76%	0.764	S	S	.	*			trans	178.8	99.3	167.3	-105	-77.2	0	0	0	112.1	K312 V1133	K312-N1135 VanDerWaalsContact NZ-CG 3.26Å; K312-N1135 PolarHBondContact NZ-ND2 3Å; V1133-N1135 PolarHBondContact O-N 3.33Å
1136	L	25.7	Very low	25.3	Very low	163 Å²	163	140.4 Å²	140.4	85%	0.853	75%	0.753	S	S	*	*			trans	-148.4	82.7	145.6	-139.6	168.3	0	0	0	110
1137	T	23.4	Very low	25.2	Very low	79 Å²	79	139.2 Å²	139.2	49%	0.485	74%	0.742	S	S	.	*			trans	-78.8	124.5	175.1	59.5	0	0	0	0	110.3	K309	K309-T1137 PolarHBondContact NZ-OG1 2.88Å
1138	M	23.5	Very low	25.4	Very low	161 Å²	161	138.8 Å²	138.8	79%	0.793	74%	0.741	S	S	*	*			trans	-137	72	149.3	-154.4	-179	-56	0	0	112	K1140	M1138-K1140 PolarHBondContact O-N 3Å
1139	F	22.7	Very low	25.4	Very low	188 Å²	188	140 Å²	140	83%	0.825	73%	0.734	S	S	*	*			trans	-59.1	121.6	143.5	-96.7	-93.5	0	0	0	107.8	L1141	F1139-L1141 HydrophobicContact CD1-CD1 4.17Å
1140	K	24	Very low	25.5	Very low	191 Å²	191	138 Å²	138	83%	0.83	73%	0.727	S	S	*	*			trans	-142.7	117.7	153.1	-145.5	172.6	-173.5	-179.9	0	108.1	M1138	M1138-K1140 PolarHBondContact O-N 3Å
1141	L	22.9	Very low	25.4	Very low	132 Å²	132	137.6 Å²	137.6	69%	0.691	72%	0.718	S	S	*	*			trans	-88	154.1	-173.6	-64.1	89.9	0	0	0	111.2	F1139	F1139-L1141 HydrophobicContact CD1-CD1 4.17Å
1142	S	26.3	Very low	25.6	Very low	109 Å²	109	133.7 Å²	133.7	76%	0.762	71%	0.712	S	S	*	*			trans	68.6	167.2	140.9	-76.9	0	0	0	0	119
1143	P	30.4	Very low	25.7	Very low	102 Å²	102	138 Å²	138	66%	0.662	72%	0.718	S	S	*	*			cis	-131.3	-162.2	-21.1	30.2	-8.5	0	0	0	112.7
1144	N	25.6	Very low	25.8	Very low	122 Å²	122	137 Å²	137	65%	0.652	72%	0.717	S	S	*	*			trans	86.4	114.4	161.8	-58.2	-12.8	0	0	0	115.6
1145	L	26.3	Very low	25.9	Very low	157 Å²	157	137 Å²	137	82%	0.822	72%	0.721	S	S	*	*				73.9	133.4	68.7	-87.1	102.2	0	0	0	111.9
1146	S	26.3	Very low	26.2	Very low	87 Å²	87	138.3 Å²	138.3	61%	0.608	73%	0.734	S	S	*	*			cis	-157	163.3	14.4	67.1	0	0	0	0	114.9
1147	N	25.5	Very low	26.2	Very low	120 Å²	120	135.7 Å²	135.7	64%	0.642	73%	0.725	S	S	*	*			trans	53.3	111.2	143.7	-57.2	-10	0	0	0	120.9
1148	N	28.9	Very low	26.4	Very low	146 Å²	146	138.7 Å²	138.7	78%	0.781	74%	0.738	S	S	*	*				-173.9	113.4	103	-85.4	-20.8	0	0	0	109.3
1149	W	24.6	Very low	26.5	Very low	185 Å²	185	136 Å²	136	70%	0.701	73%	0.73	S	S	*	*				92.3	143.2	72.1	-94.1	97.3	0	0	0	112.5	I1151	W1149-I1151 HydrophobicContact CZ3-CD1 4.36Å
1150	H	28.6	Very low	26.6	Very low	166 Å²	166	133.5 Å²	133.5	77%	0.769	73%	0.731	S	S	*	*			trans	69.5	118.5	-169.2	-48.6	-79.2	0	0	0	113.9
1151	I	24.4	Very low	26.7	Very low	135 Å²	135	129.8 Å²	129.8	69%	0.692	72%	0.723	S	S	*	*			cis	70.8	94.3	28.6	-43.6	172.4	0	0	0	114.1	W1149	W1149-I1151 HydrophobicContact CZ3-CD1 4.36Å
1152	T	27.8	Very low	26.8	Very low	125 Å²	125	128.4 Å²	128.4	77%	0.767	73%	0.725	S	S	*	*				-169.6	144.3	121.7	21	0	0	0	0	113.4
1153	K	26.4	Very low	26.9	Very low	193 Å²	193	129 Å²	129	84%	0.839	72%	0.724	S	S	*	*			trans	18	133.3	141.7	-58	176.2	-178.3	179.4	0	117.4
1154	S	29.7	Very low	26.6	Very low	111 Å²	111	130.5 Å²	130.5	78%	0.776	73%	0.725	S	S	*	*			cis	-172.8	154.5	35.9	39.1	0	0	0	0	112
1155	T	26.8	Very low	26.8	Very low	117 Å²	117	132.1 Å²	132.1	72%	0.718	73%	0.733	S	S	*	*			trans	-83.5	135	154.8	38.1	0	0	0	0	109.4	V1157	T1155-V1157 VanDerWaalsContact C-N 3.33Å; T1155-V1157 PolarHBondContact O-N 3.35Å
1156	P	30.2	Very low	26.8	Very low	116 Å²	116	132.3 Å²	132.3	75%	0.753	73%	0.73	S	S	*	*			trans	-74	89.1	169.6	30	-32.7	0	0	0	109.4	N1158	P1156-N1158 PolarHBondContact O-N 3.23Å
1157	V	27.1	Very low	27.1	Very low	107 Å²	107	136.2 Å²	136.2	65%	0.648	74%	0.739	S	S	*	*			trans	-76.8	106.9	159.8	-174.1	0	0	0	0	106.3	T1155 V1159	T1155-V1157 VanDerWaalsContact C-N 3.33Å; T1155-V1157 PolarHBondContact O-N 3.35Å; V1157-V1159 HydrophobicContact CB-CG2 4.27Å; V1157-V1159 HydrophobicContact CG1-CG2 3.63Å; V1157-V1159 PolarHBondContact O-N 3.2Å
1158	N	26.5	Very low	27.5	Very low	142 Å²	142	136.1 Å²	136.1	76%	0.759	74%	0.738	S	S	*	*			trans	-70.8	82	171.5	-79.4	11.9	0	0	0	109.4	P1156 T1160	P1156-N1158 PolarHBondContact O-N 3.23Å; N1158-T1160 PolarHBondContact O-N 3.4Å
1159	V	26.1	Very low	27.8	Very low	105 Å²	105	135.8 Å²	135.8	64%	0.636	74%	0.736	S	S	*	*			trans	-81.1	95.1	166.6	-170.1	0	0	0	0	107.5	V1157 V1161	V1157-V1159 HydrophobicContact CB-CG2 4.27Å; V1157-V1159 HydrophobicContact CG1-CG2 3.63Å; V1157-V1159 PolarHBondContact O-N 3.2Å; V1159-V1161 VanDerWaalsContact C-N 3.29Å; V1159-V1161 HydrophobicContact CB-CG2 4.49Å; V1159-V1161 HydrophobicContact CG1-CG2 3.66Å; V1159-V1161 PolarHBondContact O-N 3.23Å
1160	T	25	Very low	28.5	Very low	136 Å²	136	133.3 Å²	133.3	83%	0.834	74%	0.737	S	S	*	*			trans	-70	87.9	167	31.1	0	0	0	0	109.6	N1158 S1162	N1158-T1160 PolarHBondContact O-N 3.4Å; T1160-S1162 PolarHBondContact O-N 3.18Å
1161	V	26.4	Very low	29	Very low	112 Å²	112	131.8 Å²	131.8	68%	0.679	73%	0.734	S	S	*	*			trans	-79.6	93.7	166.9	-173.7	0	0	0	0	108.1	V1159 V1163	V1159-V1161 VanDerWaalsContact C-N 3.29Å; V1159-V1161 HydrophobicContact CB-CG2 4.49Å; V1159-V1161 HydrophobicContact CG1-CG2 3.66Å; V1159-V1161 PolarHBondContact O-N 3.23Å; V1161-V1163 HydrophobicContact CG1-CG2 4.11Å; V1161-V1163 PolarHBondContact O-N 3.04Å
1162	S	25.1	Very low	29.7	Very low	103 Å²	103	132 Å²	132	72%	0.72	74%	0.737	S	S	*	*			trans	-78.5	96.6	168.7	53.6	0	0	0	0	109.6	T1160	T1160-S1162 PolarHBondContact O-N 3.18Å
1163	V	28.5	Very low	30.2	Very low	122 Å²	122	133 Å²	133	74%	0.739	74%	0.737	S	S	*	*			trans	-79.3	119.8	161.8	-178.6	0	0	0	0	107.3	V1161	V1161-V1163 HydrophobicContact CG1-CG2 4.11Å; V1161-V1163 PolarHBondContact O-N 3.04Å
1164	I	24	Very low	30.4	Very low	133 Å²	133	130.9 Å²	130.9	68%	0.682	74%	0.735	S	S	*	*			trans	-90	135.1	170.7	-60.5	167.8	0	0	0	107.2	E1166	I1164-E1166 HydrophobicContact CG2-CG 4.45Å
1165	N	29.3	Very low	30.6	Very low	156 Å²	156	132 Å²	132	83%	0.834	74%	0.737	S	S	*	*			trans	-136.7	147	152.6	-100.9	5.9	0	0	0	106.7
1166	E	25.2	Very low	30.9	Very low	162 Å²	162	132 Å²	132	76%	0.757	74%	0.737	S	S	*	*			trans	-95.1	-170.4	-168.1	-63.9	157	134.2	0	0	111.9	I1164	I1164-E1166 HydrophobicContact CG2-CG 4.45Å
1167	H	33	Very low	30.9	Very low	169 Å²	169	132.4 Å²	132.4	78%	0.782	74%	0.74	S	S	*	*			trans	88.9	133.4	179.2	-55.6	16.9	0	0	0	116.9
1168	D	33.9	Very low	31.1	Very low	117 Å²	117	137.2 Å²	137.2	63%	0.626	75%	0.752	S	S	*	*			cis	-174.2	158.2	-37	-96.3	-14	0	0	0	106.5
1169	D	36.3	Very low	31.2	Very low	139 Å²	139	139.8 Å²	139.8	74%	0.743	76%	0.759	S	S	*	*			trans	60.6	150	164.4	-44.5	-20.7	0	0	0	118.6
1170	D	37.5	Very low	31.3	Very low	134 Å²	134	140 Å²	140	72%	0.717	77%	0.766	S	S	*	*			cis	-163.4	172.5	-20.2	-106.3	-19.9	0	0	0	110.9
1171	D	39.8	Very low	31.4	Very low	133 Å²	133	141.1 Å²	141.1	71%	0.711	77%	0.765	S	S	*	*			trans	68	109	157	-59.6	-11.9	0	0	0	124.7
1172	D	38.6	Very low	31.5	Very low	141 Å²	141	141.6 Å²	141.6	75%	0.754	77%	0.768	S	S	*	*				83.3	129.9	121.4	-64.7	-4.2	0	0	0	128.5
1173	D	38.3	Very low	31.5	Very low	145 Å²	145	141 Å²	141	78%	0.775	76%	0.764	S	S	*	*			trans	73.2	79.1	139.6	-72.7	3.4	0	0	0	125.9
1174	D	32.3	Very low	31.5	Very low	149 Å²	149	142.8 Å²	142.8	80%	0.797	77%	0.769	S	S	*	*				42	104.8	115.9	-164.9	26.2	0	0	0	122.4
1175	V	33.3	Very low	31.6	Very low	135 Å²	135	141.7 Å²	141.7	82%	0.818	77%	0.769	S	S	*	*			trans	-142.7	136.6	150.5	-179.2	0	0	0	0	112.5
1176	T	33.2	Very low	31.5	Very low	116 Å²	116	139.9 Å²	139.9	71%	0.712	77%	0.768	S	S	*	*			trans	-44.3	148.8	-177.9	60.1	0	0	0	0	118.7
1177	P	30.3	Very low	31.6	Very low	125 Å²	125	139.3 Å²	139.3	81%	0.812	77%	0.769	S	S	*	*			trans	-81.8	156.7	-175.6	34	-37.6	0	0	0	115.9
1178	K	30.1	Very low	31.3	Very low	208 Å²	208	139.9 Å²	139.9	90%	0.904	77%	0.769	S	S	*	*			trans	-133.6	162.6	166.5	-82.8	-178.9	178.3	169.9	0	111.7	S1180	K1178-S1180 PolarHBondContact O-N 3.23Å
1179	E	28.8	Very low	31.1	Very low	195 Å²	195	141.7 Å²	141.7	91%	0.911	78%	0.777	S	S	*	*			trans	-55.9	125.8	-170	-58.8	171.3	122.7	0	0	114.1
1180	S	28	Very low	30.6	Very low	111 Å²	111	141 Å²	141	78%	0.776	77%	0.773	S	S	*	*			trans	-91.7	112.6	176.3	53.3	0	0	0	0	112.2	K1178 T1182	K1178-S1180 PolarHBondContact O-N 3.23Å; S1180-T1182 PolarHBondContact O-N 3.23Å
1181	I	28.2	Very low	30.2	Very low	159 Å²	159	144.5 Å²	144.5	82%	0.815	78%	0.782	S	S	*	*			trans	-80.5	109.5	172.5	-61.8	171.6	0	0	0	108.8	S1183	I1181-S1183 PolarHBondContact O-N 3.31Å; I1181-S1183 VanDerWaalsContact O-N 3.1Å
1182	T	27.4	Very low	29.6	Very low	122 Å²	122	146.1 Å²	146.1	75%	0.748	79%	0.786	S	S	*	*			trans	-79.5	91.2	177.7	52.4	0	0	0	0	112.1	S1180	S1180-T1182 PolarHBondContact O-N 3.23Å
1183	S	25.9	Very low	29.2	Very low	89 Å²	89	143.8 Å²	143.8	62%	0.622	78%	0.78	S	S	*	*			trans	-86.2	101.1	168.5	57.6	0	0	0	0	111.4	I1181 T1185	I1181-S1183 PolarHBondContact O-N 3.31Å; I1181-S1183 VanDerWaalsContact O-N 3.1Å; S1183-T1185 PolarHBondContact O-N 3.07Å
1184	N	28.6	Very low	28.9	Very low	160 Å²	160	143.3 Å²	143.3	86%	0.856	78%	0.778	S	S	*	*			trans	-74.9	85.9	173	-79.6	-1.4	0	0	0	111.2
1185	T	26	Very low	28.9	Very low	111 Å²	111	143.7 Å²	143.7	68%	0.681	78%	0.775	S	S	*	*			trans	-86.3	117.5	170.6	-52.4	0	0	0	0	110	S1183 I1187	S1183-T1185 PolarHBondContact O-N 3.07Å; T1185-I1187 PolarHBondContact O-N 3.43Å
1186	S	27	Very low	28.9	Very low	117 Å²	117	142.9 Å²	142.9	82%	0.818	77%	0.766	S	S	*	*			trans	-69.2	102	179.2	-49.9	0	0	0	0	111.7	K1188	S1186-K1188 PolarHBondContact O-N 2.98Å; S1186-K1188 VanDerWaalsContact O-N 3.11Å
1187	I	26.9	Very low	28.7	Very low	150 Å²	150	144.2 Å²	144.2	77%	0.769	77%	0.769	S	S	*	*			trans	-69	107.3	173	-63.3	176	0	0	0	109.2	T1185 I1189	T1185-I1187 PolarHBondContact O-N 3.43Å; I1187-I1189 HydrophobicContact CG2-CG1 4.44Å; I1187-I1189 PolarHBondContact O-N 2.59Å
1188	K	27.6	Very low	28.7	Very low	182 Å²	182	145.4 Å²	145.4	79%	0.791	77%	0.767	S	S	*	*			trans	-70.7	119.3	156.6	-82.6	-171.1	172.2	-173.1	0	108.1	S1186 N1190	S1186-K1188 PolarHBondContact O-N 2.98Å; S1186-K1188 VanDerWaalsContact O-N 3.11Å; K1188-N1190 VanDerWaalsContact C-N 3.26Å; K1188-N1190 PolarHBondContact O-N 2.77Å
1189	I	28.8	Very low	28.5	Very low	154 Å²	154	139.9 Å²	139.9	79%	0.79	76%	0.755	S	S	*	*			trans	-75	86.7	162.9	-58.6	177.1	0	0	0	107.5	I1187	I1187-I1189 HydrophobicContact CG2-CG1 4.44Å; I1187-I1189 PolarHBondContact O-N 2.59Å
1190	N	26.9	Very low	28.5	Very low	124 Å²	124	137.9 Å²	137.9	66%	0.663	75%	0.749	S	S	*	*			trans	-72.3	127.9	154.3	-99.6	22.7	0	0	0	107.1	K1188	K1188-N1190 VanDerWaalsContact C-N 3.26Å; K1188-N1190 PolarHBondContact O-N 2.77Å
1191	K	27.4	Very low	28.3	Very low	208 Å²	208	139.2 Å²	139.2	90%	0.904	75%	0.747	S	S	*	*			trans	-95.6	95	170.6	-134.6	-172.3	-175.9	-169.6	0	108.2
1192	Q	28	Very low	28.4	Very low	168 Å²	168	138.8 Å²	138.8	79%	0.785	75%	0.747	S	S	*	*			trans	-157.3	150.9	175.5	-152.5	164.4	4.5	0	0	111.5
1193	S	30.4	Very low	28.4	Very low	91 Å²	91	140.1 Å²	140.1	64%	0.636	75%	0.749	S	S	*	*			trans	69.6	156	177.7	76.7	0	0	0	0	118.8
1194	D	32.5	Very low	28.4	Very low	136 Å²	136	148.8 Å²	148.8	73%	0.727	78%	0.78	S	S	*	*			trans	72.8	126.9	162	-39.4	-37.2	0	0	0	117.8
1195	E	32.6	Very low	28.4	Very low	156 Å²	156	148.3 Å²	148.3	73%	0.729	78%	0.776	S	S	*	*			cis	-158.4	157.9	-10.3	-134	-175.8	-150.1	0	0	112.3
1196	N	31.7	Very low	28.5	Very low	118 Å²	118	150.2 Å²	150.2	63%	0.631	78%	0.781	S	S	*	*			trans	64.2	130.6	154.9	-58.5	-35	0	0	0	124.3
1197	N	30.6	Very low	28.6	Very low	145 Å²	145	152.1 Å²	152.1	78%	0.775	78%	0.779	S	S	*	*			trans	84.8	125.8	142.4	-68.8	-25.7	0	0	0	123.6
1198	L	28.7	Very low	28.7	Very low	149 Å²	149	152.2 Å²	152.2	78%	0.78	78%	0.78	S	S	*	*			trans	56.4	93.9	157	-76.5	84	0	0	0	120.7
1199	S	27.4	Very low	28.8	Very low	92 Å²	92	150.3 Å²	150.3	64%	0.643	78%	0.779	S	S	*	*				34.5	121.2	124.2	62.2	0	0	0	0	121.6
1200	I	28.5	Very low	28.8	Very low	154 Å²	154	150.1 Å²	150.1	79%	0.79	78%	0.779	S	S	*	*			trans	83.5	121.9	153	-56.7	161.9	0	0	0	116.9
1201	N	24.2	Very low	28.9	Very low	138 Å²	138	151.9 Å²	151.9	74%	0.738	79%	0.787	S	S	*	*			trans	1.1	114	161.2	-56.1	-6.8	0	0	0	118.1
1202	N	29.3	Very low	29	Very low	150 Å²	150	147.6 Å²	147.6	80%	0.802	78%	0.778	S	S	*	*				-176.6	165.7	105	-94.8	-35.6	0	0	0	113.8
1203	N	26.9	Very low	29.1	Very low	150 Å²	150	145.9 Å²	145.9	80%	0.802	78%	0.777	S	S	*	*			trans	-39.4	131.2	175.3	-45.6	-38.4	0	0	0	115.8
1204	Q	26.9	Very low	29	Very low	272 Å²	272	150.9 Å²	150.9	100%	1.271	79%	0.79	S	S	*	*				-149.8	0	108.7	-113.9	177.5	-12.6	0	0	111.1

Retrieved 1,204 of 1,204 residues in 226 ms (Link to these results)

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