A0A5K4F0Z4_SCHMA Loading...

Pleckstrin homology domain-containing family G member 7

AlphaFold DB , UniProt , Accession A0A5K4F0Z4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 978 aa.

						>A0A5K4F0Z4_SCHMA|A0A5K4F0Z4
MTMKQGKSVFVRSKFRMLKRTHTMHVGYTGPMDESSNLQRHESWQSLELDTVPSSSGTGDVESLSNKTVITTTPTATTTTTTTATSTMTNENNTEIIISKQDGQDNEQIDLASRRGRRSAIIDKKNLIGETEVENQETTTISQNVNKNLNETGQERPPLTSSVNSFRERQKKILRKQNTIADLSCRNQMANTNQDYELKRRGNVFMKLIERGTRSKDLNEALQSLKSSYFHDQYLESFRDSHWSQLDKSGNSENSMTDREVRRCEAVWELFKSELTFFTDHLMVLKNCFMEPLKKLQVDGYLMFVEPMHLFGNLDDLCYVSHTFCRELISNLSQESVSNEFGSTDVLLRPLKRWSEHSKDGEIYHNYCLNYDSALNYLDSLRKLEHFNEFEKWCEQDTRCRRLQLTDLLVAPMQHYMKIPLLLSSIRRYTACSAEQEMLTACLTKVENSLKSLEDKMRWLKNFERLQEIQSQLIWPSVSELEPRVFIPEFLRQSLIRQPCERLIANPKRQLLHEGFLTLNDGTKTIEIFAFLFDDFLLVTRIKKPPKKKSFSENPLTGRSITEGGVFVVYRQVIALDRFTIHDLGIVEATANGLRNAIVLVLITRFQQITGVYTLQAANELDKQRWIEKLRNSQQAFQEKLKRKLYGIDMDQHTNKHSKLINAKNKLSSQTSIADDYLSTSLSLGIKDSIDELNKSTDLCKGNITDQKNSELSLKKLIKSKTLQTEQQHQQGSGDDNPQEDDNSNELLNTTDSSQVTTVEVNYATVNNTVIVNIPDTNMNTKNLEPDNTLSGNTDYSSDESIPNNNKIRPNDNLSLHNKTPDYIIRNRHSLDPNFATLNISNTKYSDSIGITSTSSVTMNSPNTHIQITPVTEKQIVAPIFSPPSLLLFDRVTQHNEFPFEMTRQVQFSPPLSPILHAPCASLPLDITAQSVYDLPDRMLSQMNISDDSSKLNNLINKRSIKGYSASPPVNRKNDESN
					

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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	31	Very low	29.2	Very low	245 Å²	245	159.8 Å²	159.8	100%	1.207	85%	0.852	S	S	*	*				0	137.2	0	-64.7	156.6	170.9	0	0	107.2
2	T	33.9	Very low	29.1	Very low	142 Å²	142	163.9 Å²	163.9	87%	0.871	85%	0.847	S	S	*	*			cis	-100.7	160	-2.4	45.2	0	0	0	0	112
3	M	26.5	Very low	28.7	Very low	178 Å²	178	158.9 Å²	158.9	88%	0.877	84%	0.835	S	S	*	*			trans	-87	142.2	175.1	-73.3	-179.1	169	0	0	111.2
4	K	32.2	Very low	28.7	Very low	210 Å²	210	160.1 Å²	160.1	91%	0.913	83%	0.83	S	S	*	*			trans	-104.6	119.1	151.6	-84.6	-174	173.7	179.7	0	108.4	G6	K4-G6 PolarHBondContact O-N 3.41Å
5	Q	31.3	Very low	28.4	Very low	177 Å²	177	163.3 Å²	163.3	83%	0.827	84%	0.835	S	S	*	*			trans	-73	113.9	175.9	-69.3	175.5	-18.2	0	0	109.9	K7	Q5-K7 PolarHBondContact O-N 3.02Å
6	G	29.8	Very low	28.3	Very low	79 Å²	79	167.6 Å²	167.6	81%	0.814	84%	0.838	S	S	*	*			trans	-73.3	114.9	166.4	0	0	0	0	0	109.8	K4	K4-G6 PolarHBondContact O-N 3.41Å
7	K	31.6	Very low	28.2	Very low	192 Å²	192	168.2 Å²	168.2	84%	0.835	84%	0.84	S	S	*	*			trans	-72.2	135.2	172.8	-74.7	-176.4	175.1	-179.9	0	109.8	Q5 V9	Q5-K7 PolarHBondContact O-N 3.02Å; K7-V9 PolarHBondContact O-N 2.94Å
8	S	25.2	Very low	28.1	Very low	99 Å²	99	166.9 Å²	166.9	69%	0.692	84%	0.836	S	S	*	*			trans	-60.8	129.2	-179.8	-179.8	0	0	0	0	111.9
9	V	28.4	Very low	28	Very low	123 Å²	123	168 Å²	168	75%	0.745	83%	0.834	S	S	*	*			trans	-100.9	98.6	167.5	179.3	0	0	0	0	107.9	K7 V11	K7-V9 PolarHBondContact O-N 2.94Å; V9-V11 HydrophobicContact CG1-CG2 4.21Å; V9-V11 PolarHBondContact O-N 3.05Å
10	F	26.1	Very low	28	Very low	184 Å²	184	170.7 Å²	170.7	81%	0.807	84%	0.835	S	S	*	*			trans	-69.4	94.8	172.2	-101.6	-92.5	0	0	0	110	R12	F10-R12 PolarHBondContact O-N 3.24Å
11	V	25.8	Very low	28.1	Very low	129 Å²	129	168.2 Å²	168.2	78%	0.782	83%	0.829	S	S	*	*			trans	-72.5	77.8	170.7	-175.3	0	0	0	0	109.2	V9 S13	V9-V11 HydrophobicContact CG1-CG2 4.21Å; V9-V11 PolarHBondContact O-N 3.05Å; V11-S13 VanDerWaalsContact C-N 3.32Å; V11-S13 PolarHBondContact O-N 2.67Å
12	R	27.3	Very low	27.9	Very low	209 Å²	209	164.9 Å²	164.9	79%	0.789	81%	0.81	S	S	*	*			trans	-79.1	79.7	-179.5	-166.9	175.1	-170.2	170.5	4.5	110	F10 K14	F10-R12 PolarHBondContact O-N 3.24Å; R12-K14 PolarHBondContact O-N 3.48Å
13	S	24.2	Very low	27.7	Very low	99 Å²	99	164.5 Å²	164.5	69%	0.692	81%	0.808	S	S	*	*			trans	-52.8	111.8	177.4	-174.5	0	0	0	0	110.9	V11	V11-S13 VanDerWaalsContact C-N 3.32Å; V11-S13 PolarHBondContact O-N 2.67Å
14	K	28.3	Very low	27.8	Very low	176 Å²	176	164 Å²	164	77%	0.765	81%	0.806	S	S	*	*			trans	-105.5	96.5	172.3	-83.6	-171.8	173.3	-177.5	0	108.5	R12 R16	R12-K14 PolarHBondContact O-N 3.48Å; K14-R16 PolarHBondContact O-N 3.45Å; K14-R16 VanDerWaalsContact O-N 3.11Å
15	F	24.5	Very low	27.5	Very low	208 Å²	208	162.4 Å²	162.4	91%	0.912	80%	0.801	S	S	*	*			trans	-57.6	115.5	158.8	-102	-94.2	0	0	0	108.7
16	R	27.5	Very low	27.3	Very low	231 Å²	231	161.1 Å²	161.1	87%	0.872	81%	0.805	S	S	*	*			trans	-102.5	120.4	171.9	-127.5	179.5	-179.6	176.4	-1.4	107.2	K14 L18	K14-R16 PolarHBondContact O-N 3.45Å; K14-R16 VanDerWaalsContact O-N 3.11Å; R16-L18 PolarHBondContact O-N 3.15Å
17	M	25.8	Very low	27.2	Very low	179 Å²	179	160.7 Å²	160.7	88%	0.882	80%	0.801	S	S	*	*			trans	-57.4	125.8	175.1	-69.2	175.9	174.8	0	0	110.1	K19	M17-K19 PolarHBondContact O-N 3.16Å; M17-K19 VanDerWaalsContact O-N 3.16Å
18	L	27.1	Very low	27.2	Very low	145 Å²	145	162.8 Å²	162.8	76%	0.759	81%	0.805	S	S	*	*			trans	-85.9	79.4	171.8	-140.7	79.9	0	0	0	109.7	R16 R20	R16-L18 PolarHBondContact O-N 3.15Å; L18-R20 PolarHBondContact O-N 3.02Å; L18-R20 VanDerWaalsContact O-N 3.11Å
19	K	25.7	Very low	27.5	Very low	187 Å²	187	164.9 Å²	164.9	81%	0.813	81%	0.814	S	S	*	*			trans	-66.8	105.5	160.2	-80.2	-166.8	174.7	-170.3	0	107.9	M17	M17-K19 PolarHBondContact O-N 3.16Å; M17-K19 VanDerWaalsContact O-N 3.16Å
20	R	27.9	Very low	27.6	Very low	222 Å²	222	161.8 Å²	161.8	84%	0.838	81%	0.807	S	S	*	*			trans	-106.1	90.4	162.3	-97.4	-175.7	167.8	163.7	-2.9	108.9	L18	L18-R20 PolarHBondContact O-N 3.02Å; L18-R20 VanDerWaalsContact O-N 3.11Å
21	T	29.4	Very low	28.2	Very low	118 Å²	118	158.9 Å²	158.9	72%	0.724	81%	0.806	S	S	*	*			trans	-63.5	154.8	165.4	43.6	0	0	0	0	110.3
22	H	26.4	Very low	28.4	Very low	175 Å²	175	161.6 Å²	161.6	81%	0.81	81%	0.813	S	S	*	*			trans	-53.8	141.4	169.8	-82	10.5	0	0	0	111.8
23	T	30.1	Very low	28.6	Very low	134 Å²	134	158.4 Å²	158.4	82%	0.822	81%	0.811	S	S	*	*			trans	-122.2	93.8	155.2	34.8	0	0	0	0	107.2	H25	T23-H25 PolarHBondContact O-N 3.14Å
24	M	28.4	Very low	28.8	Very low	168 Å²	168	162 Å²	162	83%	0.828	82%	0.817	S	S	*	*			trans	-59.5	134	163.4	-78.6	-75.4	-71.3	0	0	108.4
25	H	26.1	Very low	28.9	Very low	177 Å²	177	158.1 Å²	158.1	82%	0.819	81%	0.812	S	S	*	*			trans	-100.9	172.9	169.5	-138.6	53.5	0	0	0	109	T23	T23-H25 PolarHBondContact O-N 3.14Å
26	V	28.1	Very low	29.2	Very low	149 Å²	149	152.8 Å²	152.8	90%	0.903	80%	0.8	S	S	*	*			trans	81	116.4	-171.7	-170.2	0	0	0	0	113.5
27	G	27.7	Very low	29.4	Very low	70 Å²	70	148.2 Å²	148.2	72%	0.722	79%	0.793	S	S	*	*			trans	175.9	37.9	-177	0	0	0	0	0	110.7	T29	G27-T29 PolarHBondContact O-N 3.38Å
28	Y	30.7	Very low	29.5	Very low	237 Å²	237	145.8 Å²	145.8	93%	0.929	78%	0.783	S	S	*	*			trans	-90.4	101.4	-176.2	-133.7	-84.2	0	0	0	109	G30	Y28-G30 PolarHBondContact O-N 2.97Å
29	T	32.5	Very low	29.7	Very low	142 Å²	142	146.6 Å²	146.6	87%	0.871	78%	0.783	S	S	*	*			trans	-87.6	102.5	178.5	52.1	0	0	0	0	110.5	G27	G27-T29 PolarHBondContact O-N 3.38Å
30	G	30.2	Very low	29.9	Very low	58 Å²	58	148.2 Å²	148.2	60%	0.598	78%	0.784	S	S	*	*			trans	-121.3	143.7	163.8	0	0	0	0	0	109.5	Y28	Y28-G30 PolarHBondContact O-N 2.97Å
31	P	38.3	Very low	30	Very low	123 Å²	123	144 Å²	144	80%	0.799	77%	0.774	S	S	*	*			trans	-73.5	154.1	-175.7	31.1	-35.2	0	0	0	112.3
32	M	30.1	Very low	30.1	Very low	186 Å²	186	146 Å²	146	92%	0.916	78%	0.775	S	S	*	*			trans	-111.7	113.1	167.7	-87.9	-73.8	-174.4	0	0	108.5
33	D	30.7	Very low	30.3	Very low	142 Å²	142	141.6 Å²	141.6	76%	0.759	76%	0.764	S	S	*	*			trans	-100.6	136.7	166.5	-77.8	-46.3	0	0	0	110.3
34	E	29.5	Very low	30.3	Very low	176 Å²	176	145.5 Å²	145.5	82%	0.822	76%	0.764	S	S	*	*			trans	48.7	113.8	143.9	-61.1	-151	128.9	0	0	122.4
35	S	30	Very low	30.4	Very low	94 Å²	94	144.5 Å²	144.5	66%	0.657	76%	0.757	S	S	*	*				87.1	100.3	115.2	-62.6	0	0	0	0	122.3
36	S	31.5	Very low	30.7	Very low	95 Å²	95	140.7 Å²	140.7	66%	0.664	75%	0.75	S	S	*	*				101.4	145.3	109.2	80.9	0	0	0	0	121.6
37	N	30.6	Very low	30.8	Very low	135 Å²	135	138.7 Å²	138.7	72%	0.722	73%	0.734	S	S	*	*			trans	70.4	145.5	150.5	-64.5	-41.1	0	0	0	120.9
38	L	29.1	Very low	30.9	Very low	128 Å²	128	143.7 Å²	143.7	67%	0.67	74%	0.739	S	S	*	*			cis	-168.5	162.2	-30.6	-150.3	68.5	0	0	0	110.2
39	Q	30.2	Very low	30.9	Very low	162 Å²	162	138.6 Å²	138.6	76%	0.757	73%	0.726	S	S	*	*			trans	65	139.4	161.9	-74.8	160.2	-24.7	0	0	117.4
40	R	29.5	Very low	30.5	Very low	221 Å²	221	138.2 Å²	138.2	83%	0.834	72%	0.719	S	S	*	*			cis	-145.6	148.5	40.7	-75.4	-177.5	176	174.4	-0.9	114.7
41	H	31.4	Very low	30.4	Very low	134 Å²	134	142 Å²	142	62%	0.62	73%	0.731	S	S	*	*			trans	53.3	149.3	135.7	-65.3	-126.6	0	0	0	120.3
42	E	31	Very low	30.2	Very low	159 Å²	159	142.5 Å²	142.5	74%	0.743	73%	0.731	S	S	*	*			cis	-171.8	161.3	-11.8	-101.6	174.6	153.8	0	0	105.9
43	S	30.3	Very low	30.7	Very low	83 Å²	83	138.8 Å²	138.8	58%	0.58	72%	0.721	S	S	*	*			cis	-167	127.8	-15.8	48.5	0	0	0	0	114.7
44	W	30.5	Very low	30.6	Very low	216 Å²	216	136.7 Å²	136.7	82%	0.818	72%	0.718	S	S	*	*			trans	62.8	170	142.9	-58	49.7	0	0	0	115.7
45	Q	31	Very low	30.8	Very low	148 Å²	148	134 Å²	134	69%	0.692	72%	0.718	S	S	*	*			cis	-150	157.3	9.9	-141.6	151.5	15.7	0	0	106.7	L47	Q45-L47 HydrophobicContact CG-CD1 4.24Å
46	S	31	Very low	30.9	Very low	97 Å²	97	135.2 Å²	135.2	68%	0.678	73%	0.727	S	S	*	*			cis	-145.4	142.2	26.6	-70.3	0	0	0	0	109
47	L	30.2	Very low	30.9	Very low	107 Å²	107	134.5 Å²	134.5	56%	0.56	73%	0.734	S	S	*	*				59	137.1	81.5	-65.1	156.8	0	0	0	113.6	Q45 L49	Q45-L47 HydrophobicContact CG-CD1 4.24Å; L47-L49 HydrophobicContact CD2-CD1 4.3Å
48	E	30.1	Very low	31.1	Very low	175 Å²	175	134.7 Å²	134.7	82%	0.818	74%	0.741	S	S	*	*			cis	-144.5	-169.9	24.8	-153.1	144.7	-137.4	0	0	114.8
49	L	30.5	Very low	31.2	Very low	129 Å²	129	132 Å²	132	68%	0.675	74%	0.744	S	S	*	*			trans	-92.5	155	-152.4	-90.1	66	0	0	0	118.5	L47	L47-L49 HydrophobicContact CD2-CD1 4.3Å
50	D	24.1	Very low	31.2	Very low	135 Å²	135	130.9 Å²	130.9	72%	0.722	74%	0.743	S	S	*	*			trans	26.3	134.1	137.1	-50	-32.5	0	0	0	122.4
51	T	29.2	Very low	31.4	Very low	138 Å²	138	125.9 Å²	125.9	85%	0.847	74%	0.737	S	S	*	*				175.5	136.6	109.1	-70.7	0	0	0	0	112.4
52	V	32.7	Very low	31.3	Very low	132 Å²	132	127.5 Å²	127.5	80%	0.8	74%	0.744	S	S	*	*			trans	-153.3	153.9	177.1	171.5	0	0	0	0	107.4
53	P	41.6	Very low	31.2	Very low	108 Å²	108	124.7 Å²	124.7	70%	0.701	74%	0.743	S	S	*	*			cis	-124.3	-175.6	-7.8	35.6	-18.3	0	0	0	114.1
54	S	29.5	Very low	31.3	Very low	99 Å²	99	128.9 Å²	128.9	69%	0.692	76%	0.757	S	S	*	*				164.4	140	115.7	-73.4	0	0	0	0	115.4
55	S	32.3	Very low	31.3	Very low	119 Å²	119	122.7 Å²	122.7	83%	0.832	75%	0.747	S	S	*	*			trans	63.1	148.9	161.2	64.4	0	0	0	0	118.5
56	S	32.9	Very low	31.3	Very low	119 Å²	119	122 Å²	122	83%	0.832	75%	0.748	S	S	*	*			cis	-161.1	148.8	-6.5	44.2	0	0	0	0	110.5
57	G	32	Very low	31.4	Very low	80 Å²	80	126.1 Å²	126.1	83%	0.825	75%	0.754	S	S	*	*			trans	172.1	82.8	171.6	0	0	0	0	0	117
58	T	33.4	Very low	31.5	Very low	140 Å²	140	126.4 Å²	126.4	86%	0.859	76%	0.761	S	S	*	*			trans	-71.4	152.1	158.4	49.9	0	0	0	0	110
59	G	31.3	Very low	31.5	Very low	71 Å²	71	123.7 Å²	123.7	73%	0.732	76%	0.756	S	S	*	*			cis	172.1	-169.1	8.2	0	0	0	0	0	108.5
60	D	30.1	Very low	31.7	Very low	139 Å²	139	125.6 Å²	125.6	74%	0.743	77%	0.765	S	S	*	*			cis	-171.1	165.9	-12.3	-118.1	-57.2	0	0	0	112.4
61	V	34.2	Very low	32	Very low	115 Å²	115	124.3 Å²	124.3	70%	0.697	76%	0.762	S	S	*	*			trans	55.1	116.4	153.4	177.7	0	0	0	0	122.9
62	E	29.1	Very low	32.1	Very low	168 Å²	168	124 Å²	124	79%	0.785	76%	0.76	S	S	*	*			trans	54.3	107	141.3	-65	-174.7	138.4	0	0	126
63	S	29.8	Very low	31.9	Very low	101 Å²	101	124 Å²	124	71%	0.706	76%	0.761	S	S	*	*				92.2	157.3	112.4	84.4	0	0	0	0	124.3
64	L	31.7	Very low	32.1	Very low	170 Å²	170	123.7 Å²	123.7	89%	0.89	76%	0.759	S	S	*	*			trans	79.2	148.2	159.9	-76.1	162.3	0	0	0	121.2
65	S	29.7	Very low	32.1	Very low	87 Å²	87	125.4 Å²	125.4	61%	0.608	77%	0.765	S	S	*	*			trans	-106.6	155.2	-163.5	51.3	0	0	0	0	112.9
66	N	30.8	Very low	32.1	Very low	133 Å²	133	123.4 Å²	123.4	71%	0.711	76%	0.756	S	S	*	*				176.8	156.8	90.2	-96.9	-75.2	0	0	0	113.4
67	K	34.1	Very low	32	Very low	183 Å²	183	123.9 Å²	123.9	80%	0.796	75%	0.754	S	S	*	*			trans	68.1	150.6	154.1	-74.9	177.5	179.8	178.5	0	117.5
68	T	31.9	Very low	32.1	Very low	114 Å²	114	125.7 Å²	125.7	70%	0.699	75%	0.749	S	S	*	*			cis	-155.4	151.6	2.8	0.2	0	0	0	0	112.4
69	V	30.4	Very low	32	Very low	118 Å²	118	124.8 Å²	124.8	72%	0.715	74%	0.743	S	S	*	*			trans	59.2	119.4	143.2	174.9	0	0	0	0	120
70	I	35.4	Very low	32.1	Very low	168 Å²	168	127 Å²	127	86%	0.862	74%	0.743	S	S	*	*				-151.7	155.3	105.1	-93.9	170.5	0	0	0	107.6
71	T	30.5	Very low	32.2	Very low	109 Å²	109	126.2 Å²	126.2	67%	0.669	74%	0.743	S	S	*	*			trans	-130.7	145	-162.7	-45	0	0	0	0	111.9
72	T	31.4	Very low	32.2	Very low	131 Å²	131	126.2 Å²	126.2	80%	0.804	74%	0.743	S	S	*	*			trans	151.6	150.7	130.9	47.1	0	0	0	0	115.1
73	T	28.8	Very low	32.3	Very low	133 Å²	133	124.5 Å²	124.5	82%	0.816	75%	0.745	S	S	*	*			trans	-154.6	-172.6	177	54.6	0	0	0	0	106.5
74	P	44.3	Very low	32.4	Very low	101 Å²	101	123.8 Å²	123.8	66%	0.656	75%	0.745	S	S	*	*				-130.1	-169.7	-51.1	32	-12.4	0	0	0	112.9
75	T	29.1	Very low	32.3	Very low	135 Å²	135	121.9 Å²	121.9	83%	0.828	74%	0.74	S	S	*	*			trans	68.1	152.9	151.5	39.5	0	0	0	0	119.9
76	A	33.2	Very low	32.4	Very low	77 Å²	77	122.7 Å²	122.7	64%	0.636	75%	0.746	S	S	*	*			cis	-164.3	172.1	-7	0	0	0	0	0	114
77	T	31.3	Very low	32.3	Very low	129 Å²	129	122.3 Å²	122.3	79%	0.791	75%	0.749	S	S	*	*			trans	87.9	143.9	144.2	21.1	0	0	0	0	124.8
78	T	33.3	Very low	32.3	Very low	117 Å²	117	121.1 Å²	121.1	72%	0.718	75%	0.748	S	S	*	*			trans	89.9	92	147.9	28.1	0	0	0	0	124.4
79	T	32	Very low	32.2	Very low	121 Å²	121	121.1 Å²	121.1	74%	0.742	75%	0.748	S	S	*	*				83.7	149.8	119.3	44.8	0	0	0	0	126.5
80	T	33.8	Very low	32.3	Very low	119 Å²	119	123.1 Å²	123.1	73%	0.73	76%	0.755	S	S	*	*			trans	84.1	109.4	154.3	37.2	0	0	0	0	123.1
81	T	30.7	Very low	32.1	Very low	122 Å²	122	122.6 Å²	122.6	75%	0.748	75%	0.749	S	S	*	*			trans	46.9	148.2	132.3	56.2	0	0	0	0	121.3
82	T	34.1	Very low	32.3	Very low	114 Å²	114	125.4 Å²	125.4	70%	0.699	76%	0.76	S	S	*	*			cis	-170	148.7	36.8	-24.6	0	0	0	0	113.8
83	T	32.2	Very low	32.2	Very low	132 Å²	132	125.8 Å²	125.8	81%	0.81	76%	0.757	S	S	*	*			trans	59.8	151.1	148.1	38.1	0	0	0	0	125.8
84	A	32.6	Very low	32.5	Very low	87 Å²	87	126.2 Å²	126.2	72%	0.719	76%	0.759	S	S	*	*			trans	73.1	139.7	156.6	0	0	0	0	0	118.9
85	T	29.5	Very low	31.7	Very low	129 Å²	129	129 Å²	129	79%	0.791	76%	0.764	S	S	*	*			cis	137	152.1	-12.3	47.4	0	0	0	0	110.2
86	S	32	Very low	31.9	Very low	105 Å²	105	130.9 Å²	130.9	73%	0.734	77%	0.767	S	S	*	*			trans	88.3	111.7	-177.7	-48.7	0	0	0	0	114.2
87	T	28.5	Very low	31.8	Very low	124 Å²	124	132.5 Å²	132.5	76%	0.761	76%	0.763	S	S	*	*			cis	84.4	130.3	47	66.5	0	0	0	0	115.3
88	M	32.9	Very low	31.7	Very low	158 Å²	158	133.5 Å²	133.5	78%	0.778	76%	0.763	S	S	*	*			trans	140	88.6	163.2	-78.7	-65.8	97.4	0	0	107.9
89	T	30.2	Very low	31.5	Very low	114 Å²	114	133.9 Å²	133.9	70%	0.699	77%	0.77	S	S	*	*				56.3	111.2	87.1	64.8	0	0	0	0	115.3
90	N	33.2	Very low	31.3	Very low	161 Å²	161	136.4 Å²	136.4	86%	0.861	77%	0.77	S	S	*	*				-155.8	154.8	114.2	-137.4	-0.5	0	0	0	112
91	E	31	Very low	31.1	Very low	157 Å²	157	140.1 Å²	140.1	73%	0.734	78%	0.78	S	S	*	*			trans	-99.6	166	-178.4	-57.9	173.7	145.8	0	0	111.4
92	N	33.6	Very low	30.9	Very low	167 Å²	167	140.9 Å²	140.9	89%	0.893	78%	0.779	S	S	*	*			trans	-164.6	131.1	136.6	-103.4	-42.9	0	0	0	111.1
93	N	30.2	Very low	30.8	Very low	140 Å²	140	138.7 Å²	138.7	75%	0.749	78%	0.779	S	S	*	*			trans	-91.1	152.2	179.5	-66.9	-42.2	0	0	0	111.8
94	T	34.9	Very low	30.6	Very low	141 Å²	141	140.1 Å²	140.1	87%	0.865	78%	0.777	S	S	*	*			trans	-142.2	104.5	146.9	47.3	0	0	0	0	109.9
95	E	27.7	Very low	30.5	Very low	161 Å²	161	144 Å²	144	75%	0.752	79%	0.785	S	S	*	*			trans	-76.5	146.4	159.5	-64.1	-178.5	111.9	0	0	109.8	I97	E95-I97 HydrophobicContact CB-CD1 4.48Å; E95-I97 HydrophobicContact CB-CG1 4.43Å
96	I	32.2	Very low	30.5	Very low	173 Å²	173	143.6 Å²	143.6	89%	0.887	78%	0.778	S	S	*	*			trans	-131.5	139.9	154	-64.5	-174.6	0	0	0	107.7
97	I	32.2	Very low	30.5	Very low	111 Å²	111	147.6 Å²	147.6	57%	0.569	79%	0.785	S	S	*	*			trans	-125.6	134.8	-156.1	-80.7	175.7	0	0	0	111.1	E95	E95-I97 HydrophobicContact CB-CD1 4.48Å; E95-I97 HydrophobicContact CB-CG1 4.43Å
98	I	29.1	Very low	30.5	Very low	151 Å²	151	150.2 Å²	150.2	77%	0.774	79%	0.789	S	S	*	*			trans	58.9	124.7	159.6	-66.2	164	0	0	0	118.6
99	S	29.7	Very low	30.2	Very low	124 Å²	124	150.2 Å²	150.2	87%	0.867	79%	0.79	S	S	*	*			trans	-153	134.6	130.1	-68.9	0	0	0	0	110
100	K	27.1	Very low	30.2	Very low	174 Å²	174	151.6 Å²	151.6	76%	0.757	79%	0.794	S	S	*	*			trans	-96.4	158.4	164.1	-73.8	-176.4	169	-164.4	0	109.4
101	Q	30	Very low	29.8	Very low	198 Å²	198	151.8 Å²	151.8	93%	0.925	79%	0.794	S	S	*	*			trans	-149.9	144.1	136.5	-127.1	165.7	-4.8	0	0	112
102	D	26.5	Very low	29.9	Very low	137 Å²	137	147.9 Å²	147.9	73%	0.733	79%	0.789	S	S	*	*			trans	-106.5	162.1	-176	-66.1	-80	0	0	0	111.2
103	G	31.3	Very low	29.8	Very low	68 Å²	68	145.2 Å²	145.2	70%	0.701	78%	0.783	S	S	*	*			trans	177.1	75	173.9	0	0	0	0	0	109.7
104	Q	29.2	Very low	29.7	Very low	162 Å²	162	149.9 Å²	149.9	76%	0.757	79%	0.79	S	S	*	*				56.6	115.2	94.6	-75	-157.9	-67.8	0	0	114.8
105	D	30.2	Very low	29.6	Very low	169 Å²	169	155.6 Å²	155.6	90%	0.904	80%	0.796	S	S	*	*				-142.5	162.6	123.7	-121.6	-32	0	0	0	109.8
106	N	28.1	Very low	29.6	Very low	120 Å²	120	151.5 Å²	151.5	64%	0.642	80%	0.797	S	S	*	*			trans	-118.2	141.1	-166.2	-61.4	-90	0	0	0	113.8
107	E	31.8	Very low	29.7	Very low	189 Å²	189	154.7 Å²	154.7	88%	0.883	80%	0.798	S	S	*	*			trans	-177.4	149.2	140.6	-107.3	-179.1	-162.9	0	0	109.4
108	Q	30.3	Very low	29.8	Very low	180 Å²	180	160.4 Å²	160.4	84%	0.841	81%	0.812	S	S	*	*			cis	-150.1	159.7	-46	-173.4	169.2	23.3	0	0	106.8
109	I	26.4	Very low	29.7	Very low	157 Å²	157	159.2 Å²	159.2	81%	0.805	82%	0.817	S	S	*	*			trans	-79.5	136.4	-175.9	-60.1	157.5	0	0	0	111.7
110	D	28.6	Very low	30	Very low	143 Å²	143	158 Å²	158	77%	0.765	82%	0.815	S	S	*	*			trans	-143.4	142.6	138.5	-158.5	-3.6	0	0	0	111.4
111	L	24.9	Very low	30.4	Very low	165 Å²	165	157.7 Å²	157.7	86%	0.864	82%	0.82	S	S	*	*			trans	-152.6	65.1	-173.6	-134.1	180	0	0	0	111.3
112	A	33.1	Very low	30.7	Very low	76 Å²	76	155 Å²	155	63%	0.628	81%	0.81	S	S	*	*			trans	-114.7	116.9	-169.9	0	0	0	0	0	115.9
113	S	32.9	Very low	30.9	Very low	110 Å²	110	155.3 Å²	155.3	77%	0.769	81%	0.812	S	S	*	*			trans	53.7	99.2	142.4	-67	0	0	0	0	122.2
114	R	28.6	Very low	31	Very low	239 Å²	239	161 Å²	161	90%	0.902	82%	0.817	S	S	*	*				38.8	109.4	120.7	-63.9	179.7	171.8	-157.9	-1.2	119.1
115	R	32.1	Very low	31.3	Very low	260 Å²	260	161.9 Å²	161.9	98%	0.981	82%	0.819	S	S	*	*				-161.5	125.8	129.5	-106.9	163.4	-165.2	-152.8	3.9	109.6
116	G	27.4	Very low	31.3	Very low	76 Å²	76	161.5 Å²	161.5	78%	0.784	82%	0.817	S	S	*	*			trans	-123.2	157	-172.3	0	0	0	0	0	114.3
117	R	34.1	Very low	31.4	Very low	240 Å²	240	164.1 Å²	164.1	91%	0.906	83%	0.83	S	S	*	*			trans	-154.9	116.6	162.8	-105.3	175.1	-177.1	-178.7	0	110.6
118	R	34.8	Very low	31.5	Very low	230 Å²	230	163.4 Å²	163.4	87%	0.868	83%	0.83	S	S	*	*			trans	30.2	103.2	153	-58.7	172.5	-176.6	-98.2	-0.3	116
119	S	27.4	Very low	31.6	Very low	126 Å²	126	158.1 Å²	158.1	88%	0.881	82%	0.824	S	S	*	*				56.8	99.6	65.9	-43.2	0	0	0	0	113.1
120	A	35.9	Very low	31.7	Very low	99 Å²	99	159.5 Å²	159.5	82%	0.818	83%	0.827	S	S	*	*			trans	-114	150.3	160.9	0	0	0	0	0	108.9
121	I	35.8	Very low	31.8	Very low	167 Å²	167	158 Å²	158	86%	0.856	82%	0.824	S	S	*	*			trans	-88.2	132.9	-165.7	-64.4	163.1	0	0	0	110.8
122	I	34.5	Very low	32.1	Very low	142 Å²	142	159.7 Å²	159.7	73%	0.728	83%	0.827	S	S	*	*			trans	-106.9	112.9	168.2	-54.3	176.9	0	0	0	107.8	K124	I122-K124 HydrophobicContact CG2-CG 4.01Å; I122-K124 PolarHBondContact O-N 3.42Å
123	D	32.3	Very low	32	Very low	144 Å²	144	161.9 Å²	161.9	77%	0.77	83%	0.832	S	S	*	*			trans	-87.7	92.5	179	-150.9	-16.4	0	0	0	109.9
124	K	33.5	Very low	31.9	Very low	187 Å²	187	166 Å²	166	81%	0.813	84%	0.84	S	S	*	*			trans	-91.9	97.9	177.4	-77.5	-169.1	177	-176.4	0	110.8	I122	I122-K124 HydrophobicContact CG2-CG 4.01Å; I122-K124 PolarHBondContact O-N 3.42Å
125	K	33.8	Very low	32	Very low	180 Å²	180	162.2 Å²	162.2	78%	0.783	84%	0.837	S	S	*	*			trans	-130.9	132	159.1	-75	-171.9	176.3	-179.7	0	111
126	N	30.4	Very low	31.8	Very low	162 Å²	162	158.6 Å²	158.6	87%	0.866	83%	0.831	S	S	*	*			trans	101.9	66.3	-179.9	-57.1	-3.8	0	0	0	115.5
127	L	32	Very low	31.9	Very low	174 Å²	174	164.3 Å²	164.3	91%	0.911	84%	0.838	S	S	*	*			trans	-147	112.8	145.1	-147.6	72.3	0	0	0	110.1
128	I	33.5	Very low	31.4	Very low	174 Å²	174	158.8 Å²	158.8	89%	0.892	83%	0.831	S	S	*	*			trans	-135.1	137.2	164.4	-59.8	170.1	0	0	0	103.1
129	G	32.4	Very low	31.1	Very low	70 Å²	70	153 Å²	153	72%	0.722	82%	0.821	S	S	*	*			cis	155.5	70.6	1.1	0	0	0	0	0	110.4
130	E	27.9	Very low	31.1	Very low	185 Å²	185	153.1 Å²	153.1	86%	0.864	82%	0.817	S	S	*	*			trans	-94.9	154.6	159.9	-58.7	174.8	-170.9	0	0	106.8
131	T	31.2	Very low	30.8	Very low	113 Å²	113	155.5 Å²	155.5	69%	0.693	81%	0.814	S	S	*	*			cis	-147.2	150.7	15.3	-38.5	0	0	0	0	109.1	V133	T131-V133 HydrophobicContact CG2-CG2 4.05Å
132	E	30.4	Very low	30.5	Very low	200 Å²	200	152.2 Å²	152.2	94%	0.935	81%	0.806	S	S	*	*			trans	-144.3	142.7	155.6	-127.8	159.5	-135.9	0	0	109
133	V	31.7	Very low	30.4	Very low	122 Å²	122	154.1 Å²	154.1	74%	0.739	81%	0.812	S	S	*	*			trans	-131.5	116.2	-171.1	177.8	0	0	0	0	108.7	T131	T131-V133 HydrophobicContact CG2-CG2 4.05Å
134	E	30.1	Very low	30.2	Very low	197 Å²	197	153.8 Å²	153.8	92%	0.921	81%	0.81	S	S	*	*			trans	-146	155	163	-140.8	165.7	-146.6	0	0	110.3
135	N	30.9	Very low	30.3	Very low	158 Å²	158	149.8 Å²	149.8	85%	0.845	80%	0.801	S	S	*	*			trans	-89.6	163.4	-160.3	-78.6	-46.1	0	0	0	114.5
136	Q	28.5	Very low	30.1	Very low	185 Å²	185	147.9 Å²	147.9	86%	0.864	80%	0.799	S	S	*	*			trans	-75.4	144	177.6	-58.6	170.9	-1	0	0	111.9
137	E	28.5	Very low	30.3	Very low	196 Å²	196	148.3 Å²	148.3	92%	0.916	79%	0.794	S	S	*	*			trans	-153.3	167.3	131.6	-121.7	171.7	-152.1	0	0	110.8
138	T	25.2	Very low	30.1	Very low	123 Å²	123	146.4 Å²	146.4	76%	0.755	78%	0.784	S	S	*	*			trans	-122.9	164.5	-162.9	53.1	0	0	0	0	113.1
139	T	27.7	Very low	30	Very low	110 Å²	110	144.8 Å²	144.8	68%	0.675	78%	0.777	S	S	*	*				152	110.1	126.3	-68.2	0	0	0	0	115.4
140	T	26.2	Very low	29.8	Very low	128 Å²	128	146.8 Å²	146.8	79%	0.785	77%	0.771	S	S	*	*			trans	62.5	160	161.2	64.7	0	0	0	0	117.8
141	I	30.8	Very low	29.9	Very low	148 Å²	148	145.3 Å²	145.3	76%	0.759	76%	0.764	S	S	*	*			cis	-143.2	135.5	29.1	-70.6	175.3	0	0	0	112.9
142	S	28.6	Very low	29.6	Very low	99 Å²	99	146.5 Å²	146.5	69%	0.692	77%	0.771	S	S	*	*			trans	23	149.7	146.7	-57.1	0	0	0	0	126.7
143	Q	32.5	Very low	29.7	Very low	181 Å²	181	140.6 Å²	140.6	85%	0.846	76%	0.764	S	S	*	*			trans	81.1	141.2	147	-79	175	31.2	0	0	119.8
144	N	29.5	Very low	29.7	Very low	138 Å²	138	143.9 Å²	143.9	74%	0.738	77%	0.771	S	S	*	*			cis	-167.7	172.6	-15.3	-157.6	-1.6	0	0	0	112.8
145	V	33.9	Very low	29.7	Very low	103 Å²	103	143.3 Å²	143.3	62%	0.624	77%	0.769	S	S	*	*			trans	81.2	99	156.8	-176.1	0	0	0	0	120.1
146	N	29.6	Very low	29.3	Very low	139 Å²	139	147.5 Å²	147.5	74%	0.743	77%	0.772	S	S	*	*			trans	60.3	149.6	134.4	-63.6	-21.1	0	0	0	121.3
147	K	34.6	Very low	29.6	Very low	172 Å²	172	143.8 Å²	143.8	75%	0.748	76%	0.764	S	S	*	*			cis	-159.8	142.5	17.9	-136.6	164.4	-176.2	178.4	0	111.6
148	N	28.7	Very low	29.7	Very low	134 Å²	134	140 Å²	140	72%	0.717	76%	0.757	S	S	*	*			trans	35.2	132.3	137.7	-65.7	30.8	0	0	0	120.1
149	L	31.1	Very low	29.8	Very low	139 Å²	139	142.5 Å²	142.5	73%	0.728	77%	0.765	S	S	*	*			cis	-164.9	153.6	36.2	-99.8	131.1	0	0	0	112.8
150	N	28.6	Very low	29.8	Very low	113 Å²	113	143.4 Å²	143.4	60%	0.604	77%	0.77	S	S	*	*				22.1	150.7	126.1	-63.4	35.5	0	0	0	121.3
151	E	28.8	Very low	29.8	Very low	153 Å²	153	143 Å²	143	72%	0.715	77%	0.773	S	S	*	*			cis	-167.5	165.8	2.3	-118.9	164.3	153.6	0	0	114.2
152	T	26.4	Very low	29.7	Very low	139 Å²	139	140.9 Å²	140.9	85%	0.853	77%	0.771	S	S	*	*			trans	56.1	147.7	154.6	60.4	0	0	0	0	123.7
153	G	31.3	Very low	29.9	Very low	75 Å²	75	141.9 Å²	141.9	77%	0.773	77%	0.773	S	S	*	*			trans	109.5	129.6	172.5	0	0	0	0	0	113.9
154	Q	33.4	Very low	29.9	Very low	192 Å²	192	140 Å²	140	90%	0.897	77%	0.768	S	S	*	*			cis	-158.6	-168.1	-13.7	-146	172.9	-2.1	0	0	108
155	E	28.4	Very low	30	Very low	185 Å²	185	136.8 Å²	136.8	86%	0.864	76%	0.757	S	S	*	*			trans	-64.3	158.6	-167.8	-60.2	-178.4	118	0	0	117	P157	E155-P157 WeakPolarHBondContact O-CD 3.3Å
156	R	24.1	Very low	30	Very low	245 Å²	245	139.5 Å²	139.5	93%	0.925	76%	0.76	S	S	*	*			trans	-106.9	104.9	-179.2	177.3	-159.5	-92	-177.7	-7.4	111.9
157	P	33.4	Very low	30.3	Very low	107 Å²	107	140.6 Å²	140.6	70%	0.695	75%	0.754	S	S	*	*			trans	-84.2	160.3	166	33.6	-33.6	0	0	0	112.6	E155	E155-P157 WeakPolarHBondContact O-CD 3.3Å
158	P	31.7	Very low	30.2	Very low	116 Å²	116	138.8 Å²	138.8	75%	0.753	75%	0.748	S	S	*	*			trans	-81.9	153.8	-172.6	32	-36.1	0	0	0	115.3	T160	P158-T160 PolarHBondContact O-N 3.34Å
159	L	27.1	Very low	30.4	Very low	177 Å²	177	141.8 Å²	141.8	93%	0.927	75%	0.75	S	S	*	*			trans	-84.9	92.7	-177.1	-76.1	162.7	0	0	0	113.3
160	T	28.1	Very low	30.7	Very low	129 Å²	129	141.4 Å²	141.4	79%	0.791	74%	0.744	S	S	*	*			trans	-140.4	47.2	175.7	50.2	0	0	0	0	115.3	P158	P158-T160 PolarHBondContact O-N 3.34Å
161	S	26.1	Very low	31.1	Very low	120 Å²	120	143.9 Å²	143.9	84%	0.839	75%	0.749	S	S	*	*			trans	-149.4	42	179.3	57.8	0	0	0	0	117.6
162	S	27.8	Very low	31.2	Very low	102 Å²	102	144.5 Å²	144.5	71%	0.713	75%	0.75	S	S	*	*			trans	-129.2	57.2	177.8	-170.1	0	0	0	0	115.8
163	V	33.6	Very low	31.6	Very low	121 Å²	121	143.8 Å²	143.8	73%	0.733	74%	0.74	S	S	*	*	S	Bend	trans	-129.8	-37.9	167.7	-177.2	0	0	0	0	112.6	S165	V163-S165 PolarHBondContact O-N 2.97Å
164	N	31.1	Very low	31.7	Very low	140 Å²	140	147.4 Å²	147.4	75%	0.749	74%	0.74	S	S	*	*	H	α-helix	trans	-73.8	-20.7	-174.8	-73	-26.5	0	0	0	114.9	F166	N164-F166 VanDerWaalsContact C-N 3.3Å; N164-F166 PolarHBondContact O-N 3.35Å
165	S	33.1	Very low	31.7	Very low	72 Å²	72	149.1 Å²	149.1	50%	0.503	74%	0.739	S	S	.	*	H	α-helix	trans	-68.3	-23.3	-177.3	52.6	0	0	0	0	114.4	V163	V163-S165 PolarHBondContact O-N 2.97Å
166	F	32.1	Very low	31.7	Very low	159 Å²	159	149.5 Å²	149.5	70%	0.697	74%	0.737	S	S	*	*	H	α-helix	trans	-77.4	-37.9	-179	-129.5	-97.8	0	0	0	112.7	N164 E168 R169 Q170	N164-F166 VanDerWaalsContact C-N 3.3Å; N164-F166 PolarHBondContact O-N 3.35Å; F166-E168 PolarHBondContact O-N 3.2Å; F166-R169 PolarHBondContact O-N 3.08Å; F166-Q170 PolarHBondContact O-N 3.26Å
167	R	35.9	Very low	32.2	Very low	163 Å²	163	145.7 Å²	145.7	62%	0.615	73%	0.73	S	S	*	*	H	α-helix	trans	-70.5	-29	-173.7	-155.9	174.4	-162.6	160.1	10.4	113.2
168	E	33.7	Very low	32.2	Very low	134 Å²	134	148.3 Å²	148.3	63%	0.626	74%	0.738	S	S	*	*	H	α-helix	trans	-80	-28.8	175.8	-65.9	-155.2	119.6	0	0	113.6	F166 K171 K172	F166-E168 PolarHBondContact O-N 3.2Å; E168-K171 PolarHBondContact O-N 3.33Å; E168-K172 PolarHBondContact O-N 3.11Å; E168-K172 VanDerWaalsContact O-N 3.16Å
169	R	33.5	Very low	32.8	Very low	197 Å²	197	147 Å²	147	74%	0.743	73%	0.729	S	S	*	*	H	α-helix	trans	-67.6	-42.7	176.6	-99.8	-174	178.6	-168.3	1.1	112.1	F166 K171 K172 I173	F166-R169 PolarHBondContact O-N 3.08Å; R169-K171 VanDerWaalsContact C-N 3.34Å; R169-K171 PolarHBondContact O-N 3.01Å; R169-K172 PolarHBondContact O-N 3.05Å; R169-K172 VanDerWaalsContact O-N 3.16Å; R169-I173 WeakPolarHBondContact O-CG1 3.43Å; R169-I173 PolarHBondContact O-N 3.06Å
170	Q	37.4	Very low	33.6	Very low	131 Å²	131	144 Å²	144	61%	0.612	71%	0.712	S	S	*	*	H	α-helix	trans	-59.2	-44	173.3	-74.7	-179.3	-32.7	0	0	111.8	F166 K172 I173	F166-Q170 PolarHBondContact O-N 3.26Å; Q170-K172 PolarHBondContact O-N 3.49Å; Q170-I173 PolarHBondContact O-N 3.3Å
171	K	35.2	Very low	34	Very low	164 Å²	164	141 Å²	141	71%	0.713	70%	0.701	S	S	*	*	H	α-helix	trans	-66.1	-16.7	177.2	-74.6	-169.9	171.8	-170.6	0	115	E168 R169	E168-K171 PolarHBondContact O-N 3.33Å; R169-K171 VanDerWaalsContact C-N 3.34Å; R169-K171 PolarHBondContact O-N 3.01Å
172	K	32.8	Very low	34.5	Very low	167 Å²	167	141.2 Å²	141.2	73%	0.726	69%	0.692	S	S	*	*	H	α-helix	trans	-100.4	-4.3	175.1	-81.9	176.4	176	165.9	0	114.6	E168 R169 Q170	E168-K172 PolarHBondContact O-N 3.11Å; E168-K172 VanDerWaalsContact O-N 3.16Å; R169-K172 PolarHBondContact O-N 3.05Å; R169-K172 VanDerWaalsContact O-N 3.16Å; Q170-K172 PolarHBondContact O-N 3.49Å
173	I	33.5	Very low	34.9	Very low	124 Å²	124	142.4 Å²	142.4	64%	0.636	69%	0.69	S	S	*	*	H	α-helix	trans	-98.1	-25.1	-179.2	-74.7	171.1	0	0	0	113.1	R169 Q170 R175	R169-I173 WeakPolarHBondContact O-CG1 3.43Å; R169-I173 PolarHBondContact O-N 3.06Å; Q170-I173 PolarHBondContact O-N 3.3Å; I173-R175 VanDerWaalsContact C-N 3.31Å; I173-R175 PolarHBondContact O-N 3.37Å
174	L	34.5	Very low	35.1	Very low	151 Å²	151	140.3 Å²	140.3	79%	0.791	68%	0.681	S	S	*	*	S	Bend	trans	-79.1	0.1	176.3	-96.1	74.2	0	0	0	115.5	K176	L174-K176 VanDerWaalsContact C-N 3.29Å; L174-K176 PolarHBondContact O-N 3.24Å
175	R	32.1	Very low	35.4	Very low	228 Å²	228	138.7 Å²	138.7	86%	0.86	68%	0.679	S	S	*	*			trans	-90.5	43.6	177.1	-71.3	-168.3	173.4	-167.7	-2.3	113.7	I173	I173-R175 VanDerWaalsContact C-N 3.31Å; I173-R175 PolarHBondContact O-N 3.37Å
176	K	29.5	Very low	35.3	Very low	192 Å²	192	145.5 Å²	145.5	84%	0.835	69%	0.694	S	S	*	*			trans	-143.5	52.1	172.2	-80.4	-163.7	174.9	-177	0	112.7	L174	L174-K176 VanDerWaalsContact C-N 3.29Å; L174-K176 PolarHBondContact O-N 3.24Å
177	Q	35	Very low	35.3	Very low	165 Å²	165	144.4 Å²	144.4	77%	0.771	70%	0.695	S	S	*	*			trans	-124.4	110.4	156.7	-68.5	-169.2	0.3	0	0	108.1	T179	Q177-T179 VanDerWaalsContact C-N 3.33Å; Q177-T179 PolarHBondContact O-N 2.86Å; Q177-T179 VanDerWaalsContact O-N 3.14Å
178	N	31.9	Very low	35.1	Very low	163 Å²	163	145 Å²	145	87%	0.872	71%	0.705	S	S	*	*			trans	-84	80	177.2	-69.6	-9.9	0	0	0	108.5
179	T	45.6	Very low	34.8	Very low	89 Å²	89	147.8 Å²	147.8	55%	0.546	72%	0.72	S	S	.	*			trans	-72	138.8	178.1	-52.2	0	0	0	0	110	Q177 A181 D182	Q177-T179 VanDerWaalsContact C-N 3.33Å; Q177-T179 PolarHBondContact O-N 2.86Å; Q177-T179 VanDerWaalsContact O-N 3.14Å; T179-A181 PolarHBondContact O-N 2.9Å; T179-D182 PolarHBondContact O-N 2.83Å; T179-D182 VanDerWaalsContact O-N 3.14Å
180	I	43.3	Very low	34.7	Very low	112 Å²	112	142.8 Å²	142.8	57%	0.574	72%	0.722	S	S	*	*	G	3₁₀ helix	trans	-60.2	-20.7	-169.2	-67.4	170.7	0	0	0	113.2	D182 L183 F205	I180-D182 VanDerWaalsContact C-N 3.33Å; I180-D182 PolarHBondContact O-N 2.67Å; I180-L183 PolarHBondContact O-N 3.12Å; I180-F205 HydrophobicContact CD1-CE2 4.32Å; I180-F205 HydrophobicContact CG2-CE2 3.99Å; I180-F205 HydrophobicContact CG2-CZ 4.03Å
181	A	36.5	Very low	34.2	Very low	68 Å²	68	144.3 Å²	144.3	56%	0.562	73%	0.734	S	S	*	*	G	3₁₀ helix	trans	-58.3	-36.4	175.4	0	0	0	0	0	114.1	T179 L183 S184	T179-A181 PolarHBondContact O-N 2.9Å; A181-L183 PolarHBondContact O-N 3.09Å; A181-S184 PolarHBondContact O-N 2.92Å; A181-S184 VanDerWaalsContact O-N 3.11Å; A181-S184 PolarHBondContact O-OG 3.31Å
182	D	35.4	Very low	34	Very low	123 Å²	123	142.5 Å²	142.5	66%	0.658	74%	0.737	S	S	*	*	G	3₁₀ helix	trans	-65.1	-13.9	-178.2	-90.9	-26	0	0	0	113.7	T179 I180	T179-D182 PolarHBondContact O-N 2.83Å; T179-D182 VanDerWaalsContact O-N 3.14Å; I180-D182 VanDerWaalsContact C-N 3.33Å; I180-D182 PolarHBondContact O-N 2.67Å
183	L	36.7	Very low	33.8	Very low	127 Å²	127	141.9 Å²	141.9	67%	0.665	74%	0.741	S	S	*	*	G	3₁₀ helix	trans	-84.1	-15.1	177.3	-68.2	169.8	0	0	0	113.7	I180 A181	I180-L183 PolarHBondContact O-N 3.12Å; A181-L183 PolarHBondContact O-N 3.09Å
184	S	39.4	Very low	33.7	Very low	77 Å²	77	144 Å²	144	54%	0.538	75%	0.749	S	S	.	*	T	Hydrogen-bonded Turn	trans	-82.9	-42.1	177.7	70.7	0	0	0	0	112	A181 R186 N187	A181-S184 PolarHBondContact O-N 2.92Å; A181-S184 VanDerWaalsContact O-N 3.11Å; A181-S184 PolarHBondContact O-OG 3.31Å; S184-R186 PolarHBondContact O-N 3.23Å; S184-N187 PolarHBondContact O-N 3.02Å
185	C	36.4	Very low	33.4	Very low	107 Å²	107	144.4 Å²	144.4	72%	0.723	75%	0.751	S	S	*	*	G	3₁₀ helix	trans	-69.1	-16	-178.1	-66.7	0	0	0	0	114.2
186	R	31.4	Very low	33.5	Very low	214 Å²	214	144.5 Å²	144.5	81%	0.808	75%	0.754	S	S	*	*	G	3₁₀ helix	trans	-85.5	-4.5	179.4	-165.6	161	177.3	155.2	-0.4	114.5	S184	S184-R186 PolarHBondContact O-N 3.23Å
187	N	32.5	Very low	33.6	Very low	136 Å²	136	142 Å²	142	73%	0.727	74%	0.744	S	S	*	*	G	3₁₀ helix	trans	-101.5	12.7	-175.8	-79.1	-16.4	0	0	0	115.3	S184	S184-N187 PolarHBondContact O-N 3.02Å
188	Q	30.6	Very low	33.5	Very low	176 Å²	176	141.2 Å²	141.2	82%	0.822	75%	0.745	S	S	*	*	S	Bend	trans	-107.8	27.6	178.5	-63.2	-164.1	20.6	0	0	114.8
189	M	27.9	Very low	33.7	Very low	192 Å²	192	143 Å²	143	95%	0.946	75%	0.745	S	S	*	*	S	Bend	trans	-137	42.3	173.2	-65.2	-161.7	81.7	0	0	114.2
190	A	31.1	Very low	33.3	Very low	93 Å²	93	148.9 Å²	148.9	77%	0.769	76%	0.757	S	S	*	*			trans	-152.3	125.4	162.6	0	0	0	0	0	109.5
191	N	27	Very low	32.8	Very low	163 Å²	163	154.1 Å²	154.1	87%	0.872	77%	0.77	S	S	*	*			trans	-141.6	69	178.6	-164	19	0	0	0	112
192	T	30.9	Very low	32.7	Very low	126 Å²	126	152.9 Å²	152.9	77%	0.773	76%	0.763	S	S	*	*	S	Bend	trans	-147.7	120.3	166.2	32.2	0	0	0	0	110.1
193	N	29.6	Very low	32.9	Very low	154 Å²	154	152.8 Å²	152.8	82%	0.824	76%	0.763	S	S	*	*	S	Bend	trans	47.1	84.9	157.1	-57.3	-9.1	0	0	0	119
194	Q	30.6	Very low	33.1	Very low	169 Å²	169	152.4 Å²	152.4	79%	0.79	77%	0.766	S	S	*	*			trans	-160.8	58.3	142.2	-117.8	171.6	35.1	0	0	115	Y196	Q194-Y196 PolarHBondContact O-N 3.22Å
195	D	28.1	Very low	33.2	Very low	158 Å²	158	154.8 Å²	154.8	85%	0.845	77%	0.766	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.1	99.4	158.8	-79.8	-57.6	0	0	0	109.9
196	Y	33.3	Very low	33.2	Very low	231 Å²	231	154.5 Å²	154.5	91%	0.906	76%	0.756	S	S	*	*	T	Hydrogen-bonded Turn	trans	-175.3	-23.6	145.2	-101.6	-62.3	0	0	0	113.9	Q194	Q194-Y196 PolarHBondContact O-N 3.22Å
197	E	31.8	Very low	33.4	Very low	138 Å²	138	151.7 Å²	151.7	65%	0.645	75%	0.749	S	S	*	*	S	Bend	trans	-85.9	-23.5	-172	-91	-91.1	105.9	0	0	115.8	K199 R200	E197-K199 PolarHBondContact O-N 2.97Å; E197-R200 PolarHBondContact O-N 3.3Å
198	L	34.4	Very low	34	Very low	149 Å²	149	152 Å²	152	78%	0.78	75%	0.75	S	S	*	*	G	3₁₀ helix	trans	-63.1	-20	-170.2	-85.6	77.9	0	0	0	114.6	R200	L198-R200 PolarHBondContact O-N 3.32Å; L198-R200 VanDerWaalsContact O-N 3.15Å
199	K	35.9	Very low	34.7	Very low	202 Å²	202	148.7 Å²	148.7	88%	0.878	74%	0.737	S	S	*	*	G	3₁₀ helix	trans	-70.4	-5.1	-176.2	-103.2	179.9	178.9	175.3	0	115.6	E197	E197-K199 PolarHBondContact O-N 2.97Å
200	R	36.4	Very low	35.1	Very low	212 Å²	212	145.9 Å²	145.9	80%	0.8	72%	0.722	S	S	*	*	G	3₁₀ helix	trans	-107.7	-7.5	-176.2	-146.5	176.7	-67.6	-168.7	2.2	115.9	E197 L198	E197-R200 PolarHBondContact O-N 3.3Å; L198-R200 PolarHBondContact O-N 3.32Å; L198-R200 VanDerWaalsContact O-N 3.15Å
201	R	33.3	Very low	35.5	Very low	222 Å²	222	149.7 Å²	149.7	84%	0.838	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.4	-14.9	179.1	-74.1	-169.2	176.7	-160.1	-0.1	116	N203	R201-N203 VanDerWaalsContact C-N 3.31Å; R201-N203 PolarHBondContact O-N 2.83Å
202	G	33.8	Very low	36	Very low	41 Å²	41	146.3 Å²	146.3	42%	0.423	72%	0.72	S	S	.	*	H	α-helix	trans	-62.8	-31.8	-179.4	0	0	0	0	0	114.9	V204 F205	G202-V204 VanDerWaalsContact C-N 3.28Å; G202-V204 PolarHBondContact O-N 2.97Å; G202-F205 PolarHBondContact O-N 3.16Å
203	N	39.7	Very low	36.6	Very low	122 Å²	122	143.9 Å²	143.9	65%	0.652	71%	0.705	S	S	*	*	H	α-helix	trans	-77.6	-3.4	-168.1	-65.6	32	0	0	0	115.1	R201	R201-N203 VanDerWaalsContact C-N 3.31Å; R201-N203 PolarHBondContact O-N 2.83Å
204	V	41.5	Very low	37.6	Very low	119 Å²	119	140.1 Å²	140.1	72%	0.721	68%	0.679	S	S	*	*	H	α-helix	trans	-93	-35.3	177	-174.1	0	0	0	0	111.4	G202	G202-V204 VanDerWaalsContact C-N 3.28Å; G202-V204 PolarHBondContact O-N 2.97Å
205	F	41.2	Very low	38.6	Very low	126 Å²	126	134.5 Å²	134.5	55%	0.553	66%	0.659	S	S	*	*	H	α-helix	trans	-80.2	-38.4	-178.5	-144	-98.6	0	0	0	112.4	I180 G202 K207 L208 I209	I180-F205 HydrophobicContact CD1-CE2 4.32Å; I180-F205 HydrophobicContact CG2-CE2 3.99Å; I180-F205 HydrophobicContact CG2-CZ 4.03Å; G202-F205 PolarHBondContact O-N 3.16Å; F205-K207 PolarHBondContact O-N 2.78Å; F205-L208 PolarHBondContact O-N 2.85Å; F205-L208 VanDerWaalsContact O-N 3.14Å; F205-I209 HydrophobicContact CD1-CD1 4.27Å
206	M	35.8	Very low	39.8	Very low	102 Å²	102	134.8 Å²	134.8	50%	0.502	65%	0.652	S	S	.	*	G	3₁₀ helix	trans	-60.8	-30.8	176	-71.3	-63.1	-69	0	0	112.9	L208 I209 E210	M206-L208 PolarHBondContact O-N 2.94Å; M206-I209 CarbonylContact O-C 3.51Å; M206-I209 WeakPolarHBondContact O-CA 3.39Å; M206-I209 PolarHBondContact O-N 2.9Å; M206-E210 PolarHBondContact O-N 3.18Å
207	K	37.2	Very low	41.7	Very low	155 Å²	155	125.8 Å²	125.8	67%	0.674	62%	0.62	S	S	*	*	G	3₁₀ helix	trans	-71.5	-4	177.6	-77.4	-166.9	170.2	-167.5	0	115.4	F205	F205-K207 PolarHBondContact O-N 2.78Å
208	L	43.1	Very low	43.8	Very low	141 Å²	141	119.3 Å²	119.3	74%	0.738	59%	0.59	S	S	*	*	G	3₁₀ helix	trans	-96.5	-9	165.1	-116.9	72	0	0	0	113.3	F205 M206	F205-L208 PolarHBondContact O-N 2.85Å; F205-L208 VanDerWaalsContact O-N 3.14Å; M206-L208 PolarHBondContact O-N 2.94Å
209	I	45.7	Very low	45.8	Very low	107 Å²	107	115.7 Å²	115.7	55%	0.549	57%	0.571	S	S	.	*	T	Hydrogen-bonded Turn	trans	-105.2	-26.1	-177.8	-61.1	174.2	0	0	0	110.5	F205 M206 R211	F205-I209 HydrophobicContact CD1-CD1 4.27Å; M206-I209 CarbonylContact O-C 3.51Å; M206-I209 WeakPolarHBondContact O-CA 3.39Å; M206-I209 PolarHBondContact O-N 2.9Å; I209-R211 PolarHBondContact O-N 3.14Å
210	E	36.7	Very low	47.8	Very low	133 Å²	133	112.8 Å²	112.8	62%	0.621	56%	0.561	S	S	*	*			trans	-72.5	63.2	171.4	-69.4	178.9	152.4	0	0	113.4	M206	M206-E210 PolarHBondContact O-N 3.18Å
211	R	38.7	Very low	49.7	Very low	173 Å²	173	103.3 Å²	103.3	65%	0.653	53%	0.528	S	S	*	.			trans	-125.8	92	156.7	-92.1	-173.2	160.1	170	-7.7	109.6	I209 T213 R214	I209-R211 PolarHBondContact O-N 3.14Å; R211-T213 PolarHBondContact O-N 3.14Å; R211-R214 HydrophobicContact CB-CG 3.75Å; R211-R214 PolarHBondContact O-N 3.29Å
212	G	39.3	Very low	51.8	Low	92 Å²	92	92.8 Å²	92.8	95%	0.948	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68	26.9	174.7	0	0	0	0	0	115.4
213	T	42.9	Very low	53.8	Low	75 Å²	75	97.9 Å²	97.9	46%	0.46	50%	0.501	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.6	-18.3	179.3	56.1	0	0	0	0	112.9	R211 S215 K216 D217	R211-T213 PolarHBondContact O-N 3.14Å; T213-S215 VanDerWaalsContact C-N 3.31Å; T213-S215 PolarHBondContact O-N 2.98Å; T213-K216 PolarHBondContact O-N 3.38Å; T213-D217 PolarHBondContact OG1-OD2 3.14Å
214	R	49.5	Very low	55.4	Low	75 Å²	75	95.9 Å²	95.9	28%	0.283	50%	0.497	S	S	.	.	H	α-helix	trans	-64.6	-15.2	-157.3	-69.7	-169.5	77.3	174.4	0.3	117.8	R211 K216 D217 L218 G300 Y301	R211-R214 HydrophobicContact CB-CG 3.75Å; R211-R214 PolarHBondContact O-N 3.29Å; R214-K216 VanDerWaalsContact C-N 3.34Å; R214-D217 WeakPolarHBondContact CA-OD2 3.24Å; R214-D217 WeakPolarHBondContact CG-OD2 3.49Å; R214-D217 PolarHBondContact O-N 3.03Å; R214-L218 WeakPolarHBondContact O-CB 3.39Å; R214-L218 PolarHBondContact O-N 3.01Å; R214-G300 PolarHBondContact NH2-O 3.24Å; R214-Y301 VanDerWaalsContact NH2-CD1 3.28Å
215	S	51.6	Low	56.9	Low	52 Å²	52	90.6 Å²	90.6	36%	0.364	46%	0.464	S	S	.	.	H	α-helix	trans	-64.9	-39.3	169.2	162.5	0	0	0	0	111	T213 N219 E389	T213-S215 VanDerWaalsContact C-N 3.31Å; T213-S215 PolarHBondContact O-N 2.98Å; S215-N219 VanDerWaalsContact O-CB 3.29Å; S215-N219 WeakPolarHBondContact O-CB 3.42Å; S215-N219 PolarHBondContact O-N 3.03Å; S215-E389 WeakPolarHBondContact CB-OE1 3.31Å; S215-E389 PolarHBondContact OG-OE1 3.38Å
216	K	53.9	Low	58	Low	164 Å²	164	93.3 Å²	93.3	71%	0.713	48%	0.476	S	S	*	.	H	α-helix	trans	-66.4	-49.4	172.1	-66.4	-170	177.3	-173.3	0	110.9	T213 R214 L218 N219 E220	T213-K216 PolarHBondContact O-N 3.38Å; R214-K216 VanDerWaalsContact C-N 3.34Å; K216-L218 PolarHBondContact O-N 3.07Å; K216-N219 PolarHBondContact O-N 3.43Å; K216-N219 VanDerWaalsContact O-N 3.13Å; K216-E220 WeakPolarHBondContact O-CB 3.4Å; K216-E220 PolarHBondContact O-N 2.91Å
217	D	72.7	Confident	59.2	Low	41 Å²	41	92.1 Å²	92.1	22%	0.219	48%	0.477	C	S	.	.	H	α-helix	trans	-58.3	-36.5	-179.6	-41.9	-15.7	0	0	0	111.8	T213 R214 A221 Y301	T213-D217 PolarHBondContact OG1-OD2 3.14Å; R214-D217 WeakPolarHBondContact CA-OD2 3.24Å; R214-D217 WeakPolarHBondContact CG-OD2 3.49Å; R214-D217 PolarHBondContact O-N 3.03Å; D217-A221 WeakPolarHBondContact O-CB 3.39Å; D217-A221 PolarHBondContact O-N 2.78Å; D217-A221 VanDerWaalsContact O-N 3.08Å; D217-Y301 HydrophobicContact CB-CE1 4.34Å; D217-Y301 WeakPolarHBondContact CB-OH 3.5Å; D217-Y301 PolarHBondContact O-OH 2.64Å
218	L	76.1	Confident	60.7	Low	3 Å²	3	86.7 Å²	86.7	2%	0.016	46%	0.459	C	S	.	.	H	α-helix	trans	-73.3	-43.3	174.8	176.9	59.4	0	0	0	112.4	R214 K216 E220 A221 L222 L296 Y301 H386 E389	R214-L218 WeakPolarHBondContact O-CB 3.39Å; R214-L218 PolarHBondContact O-N 3.01Å; K216-L218 PolarHBondContact O-N 3.07Å; L218-E220 VanDerWaalsContact C-N 3.33Å; L218-E220 PolarHBondContact O-N 2.84Å; L218-A221 WeakPolarHBondContact O-CB 3.04Å; L218-A221 PolarHBondContact O-N 3.09Å; L218-L222 HydrophobicContact CD1-CD1 4.4Å; L218-L222 HydrophobicContact CD1-CG 4.27Å; L218-L222 HydrophobicContact CG-CD1 4.15Å; L218-L222 HydrophobicContact CG-CG 4.48Å; L218-L222 WeakPolarHBondContact O-CB 3.29Å; L218-L222 VanDerWaalsContact O-CG 3.29Å; L218-L222 WeakPolarHBondContact O-CG 3.26Å; L218-L222 PolarHBondContact O-N 3.42Å; L218-L296 HydrophobicContact CD1-CD2 4.11Å; L218-Y301 HydrophobicContact CB-CD1 4.07Å; L218-Y301 HydrophobicContact CB-CE1 4.13Å; L218-Y301 HydrophobicContact CD1-CD1 3.87Å; L218-Y301 HydrophobicContact CD1-CG 3.97Å; L218-Y301 HydrophobicContact CG-CD1 4.49Å; L218-H386 HydrophobicContact CD2-CB 3.76Å; L218-E389 HydrophobicContact CD2-CB 4.48Å
219	N	76.9	Confident	61.6	Low	73 Å²	73	86.5 Å²	86.5	39%	0.39	45%	0.449	S	S	.	.	H	α-helix	trans	-67.2	-35.8	179.9	-159.7	-25.6	0	0	0	111.5	S215 K216 L222 Q223	S215-N219 VanDerWaalsContact O-CB 3.29Å; S215-N219 WeakPolarHBondContact O-CB 3.42Å; S215-N219 PolarHBondContact O-N 3.03Å; K216-N219 PolarHBondContact O-N 3.43Å; K216-N219 VanDerWaalsContact O-N 3.13Å; N219-L222 PolarHBondContact O-N 2.85Å; N219-Q223 VanDerWaalsContact O-CG 3.28Å; N219-Q223 WeakPolarHBondContact O-CG 3.24Å; N219-Q223 PolarHBondContact O-N 3.25Å; N219-Q223 PolarHBondContact O-NE2 3.21Å; N219-Q223 PolarHBondContact OD1-NE2 3.22Å
220	E	77.2	Confident	62.4	Low	140 Å²	140	85.6 Å²	85.6	65%	0.654	44%	0.442	S	S	*	.	H	α-helix	trans	-66	-42	170	-170.4	171.3	-175	0	0	111.7	K216 L218 L222 Q223 S224	K216-E220 WeakPolarHBondContact O-CB 3.4Å; K216-E220 PolarHBondContact O-N 2.91Å; L218-E220 VanDerWaalsContact C-N 3.33Å; L218-E220 PolarHBondContact O-N 2.84Å; E220-L222 PolarHBondContact O-N 3.4Å; E220-Q223 PolarHBondContact O-N 2.87Å; E220-S224 PolarHBondContact O-N 3.25Å
221	A	76.7	Confident	63.5	Low	13 Å²	13	83.7 Å²	83.7	11%	0.107	43%	0.432	C	S	.	.	H	α-helix	trans	-60.5	-43.6	172.9	0	0	0	0	0	112.3	D217 L218 S224 L225 L296 Y301	D217-A221 WeakPolarHBondContact O-CB 3.39Å; D217-A221 PolarHBondContact O-N 2.78Å; D217-A221 VanDerWaalsContact O-N 3.08Å; L218-A221 WeakPolarHBondContact O-CB 3.04Å; L218-A221 PolarHBondContact O-N 3.09Å; A221-S224 PolarHBondContact O-N 3.07Å; A221-S224 PolarHBondContact O-OG 2.69Å; A221-L225 WeakPolarHBondContact O-CB 3.46Å; A221-L225 PolarHBondContact O-N 3.12Å; A221-L296 HydrophobicContact CB-CD2 4.17Å; A221-Y301 HydrophobicContact CB-CD2 4.44Å; A221-Y301 HydrophobicContact CB-CE2 4.08Å
222	L	78.4	Confident	64.9	Low	2 Å²	2	76.9 Å²	76.9	1%	0.01	41%	0.409	C	S	.	.	H	α-helix	trans	-60.7	-43.2	174.2	-71.6	168.3	0	0	0	111.9	L218 N219 E220 S224 L225 L296 F390 W393	L218-L222 HydrophobicContact CD1-CD1 4.4Å; L218-L222 HydrophobicContact CD1-CG 4.27Å; L218-L222 HydrophobicContact CG-CD1 4.15Å; L218-L222 HydrophobicContact CG-CG 4.48Å; L218-L222 WeakPolarHBondContact O-CB 3.29Å; L218-L222 VanDerWaalsContact O-CG 3.29Å; L218-L222 WeakPolarHBondContact O-CG 3.26Å; L218-L222 PolarHBondContact O-N 3.42Å; N219-L222 PolarHBondContact O-N 2.85Å; E220-L222 PolarHBondContact O-N 3.4Å; L222-S224 VanDerWaalsContact C-N 3.33Å; L222-S224 PolarHBondContact O-N 3.17Å; L222-L225 WeakPolarHBondContact O-CB 3.38Å; L222-L225 PolarHBondContact O-N 3.1Å; L222-L225 VanDerWaalsContact O-N 3.1Å; L222-L296 HydrophobicContact CD2-CD1 3.71Å; L222-L296 HydrophobicContact CD2-CD2 4.29Å; L222-F390 HydrophobicContact CD2-CD2 4.01Å; L222-W393 HydrophobicContact CB-CD2 4.32Å; L222-W393 HydrophobicContact CB-CG 4.16Å; L222-W393 HydrophobicContact CD1-CB 4.21Å; L222-W393 HydrophobicContact CD1-CG 4.32Å; L222-W393 HydrophobicContact CD2-CB 4.36Å; L222-W393 HydrophobicContact CD2-CD2 3.93Å; L222-W393 HydrophobicContact CD2-CE3 4.08Å; L222-W393 HydrophobicContact CD2-CG 4.06Å; L222-W393 HydrophobicContact CG-CG 4.42Å; L222-W393 WeakPolarHBondContact O-CZ2 3.4Å
223	Q	74.9	Confident	66.2	Low	148 Å²	148	79.6 Å²	79.6	69%	0.692	40%	0.397	S	S	*	.	H	α-helix	trans	-67.9	-31.1	176.5	-71.1	170	46.2	0	0	112.9	N219 E220 L225	N219-Q223 VanDerWaalsContact O-CG 3.28Å; N219-Q223 WeakPolarHBondContact O-CG 3.24Å; N219-Q223 PolarHBondContact O-N 3.25Å; N219-Q223 PolarHBondContact O-NE2 3.21Å; N219-Q223 PolarHBondContact OD1-NE2 3.22Å; E220-Q223 PolarHBondContact O-N 2.87Å; Q223-L225 PolarHBondContact O-N 3.36Å
224	S	74.3	Confident	67.4	Low	80 Å²	80	80.5 Å²	80.5	56%	0.559	39%	0.393	S	S	*	.	H	α-helix	trans	-72.6	-12.9	172	84	0	0	0	0	113.7	E220 A221 L222 K226	E220-S224 PolarHBondContact O-N 3.25Å; A221-S224 PolarHBondContact O-N 3.07Å; A221-S224 PolarHBondContact O-OG 2.69Å; L222-S224 VanDerWaalsContact C-N 3.33Å; L222-S224 PolarHBondContact O-N 3.17Å; S224-K226 PolarHBondContact O-N 2.91Å
225	L	72.1	Confident	68.5	Low	7 Å²	7	77 Å²	77	4%	0.037	38%	0.38	C	S	.	.			trans	-80.9	84.9	-166.2	-146.3	79.7	0	0	0	111.5	A221 L222 Q223 S227 P292 K295 L296 W393	A221-L225 WeakPolarHBondContact O-CB 3.46Å; A221-L225 PolarHBondContact O-N 3.12Å; L222-L225 WeakPolarHBondContact O-CB 3.38Å; L222-L225 PolarHBondContact O-N 3.1Å; L222-L225 VanDerWaalsContact O-N 3.1Å; Q223-L225 PolarHBondContact O-N 3.36Å; L225-S227 PolarHBondContact O-N 3.37Å; L225-S227 VanDerWaalsContact O-N 3.12Å; L225-P292 HydrophobicContact CD2-CB 3.71Å; L225-K295 HydrophobicContact CD1-CB 4.38Å; L225-K295 HydrophobicContact CD1-CD 3.62Å; L225-K295 HydrophobicContact CD1-CG 3.9Å; L225-K295 HydrophobicContact CG-CD 4.07Å; L225-L296 HydrophobicContact CD1-CD2 4.17Å; L225-L296 HydrophobicContact CD1-CG 4.21Å; L225-L296 HydrophobicContact CD2-CD1 4.15Å; L225-L296 HydrophobicContact CD2-CD2 4.48Å; L225-L296 HydrophobicContact CD2-CG 4.04Å; L225-W393 HydrophobicContact CB-CH2 4.11Å; L225-W393 HydrophobicContact CB-CZ2 4.22Å; L225-W393 HydrophobicContact CD2-CH2 4.08Å; L225-W393 HydrophobicContact CD2-CZ3 4.22Å
226	K	63.4	Low	69.3	Low	183 Å²	183	77 Å²	77	80%	0.796	37%	0.374	S	S	*	.			trans	-44	122.3	169.2	-69	-168.9	177.7	-172.7	0	111	S224 S228	S224-K226 PolarHBondContact O-N 2.91Å; K226-S228 PolarHBondContact O-N 2.77Å
227	S	62.4	Low	70.1	Confident	77 Å²	77	72.6 Å²	72.6	54%	0.538	36%	0.364	S	S	.	.			trans	-54	126.9	178.3	-46.8	0	0	0	0	110.8	L225	L225-S227 PolarHBondContact O-N 3.37Å; L225-S227 VanDerWaalsContact O-N 3.12Å
228	S	67.6	Low	69.8	Low	41 Å²	41	72.2 Å²	72.2	29%	0.287	36%	0.36	S	S	.	.			trans	-72.6	143.1	168.4	-165.3	0	0	0	0	109.4	K226 E291 R399	K226-S228 PolarHBondContact O-N 2.77Å; S228-E291 VanDerWaalsContact CB-OE2 3.27Å; S228-E291 WeakPolarHBondContact CB-OE2 3.29Å; S228-E291 PolarHBondContact OG-OE2 2.71Å; S228-R399 PolarHBondContact O-NH1 2.88Å
229	Y	61.6	Low	69.2	Low	137 Å²	137	75.6 Å²	75.6	54%	0.537	37%	0.373	S	S	.	.			trans	-145.2	113.9	-176.4	-170.3	-108.6	0	0	0	110.8	H231	Y229-H231 HydrophobicContact CD1-CB 3.95Å; Y229-H231 HydrophobicContact CE1-CB 3.59Å; Y229-H231 AromaticContact CE1-CG 3.79Å; Y229-H231 AromaticContact CE1-ND1 3.56Å; Y229-H231 AromaticContact CZ-ND1 3.91Å; Y229-H231 PolarHBondContact OH-ND1 2.85Å
230	F	62.7	Low	68.9	Low	89 Å²	89	79.1 Å²	79.1	39%	0.39	39%	0.392	S	S	.	.			trans	-83.7	127.9	165.6	-177.4	-93.9	0	0	0	109	D232 F278 M283 N287 H322	F230-D232 HydrophobicContact CE1-CB 3.86Å; F230-D232 HydrophobicContact CZ-CB 4.33Å; F230-F278 HydrophobicContact CD1-CE1 4.28Å; F230-F278 HydrophobicContact CD1-CZ 4.15Å; F230-F278 AromaticContact CE1-CE1 3.83Å; F230-F278 HydrophobicContact CE1-CE1 3.83Å; F230-F278 AromaticContact CE1-CZ 3.64Å; F230-F278 HydrophobicContact CE1-CZ 3.64Å; F230-F278 HydrophobicContact CZ-CZ 4.27Å; F230-M283 HydrophobicContact CB-SD 3.72Å; F230-M283 HydrophobicContact CD1-CG 4.17Å; F230-M283 HydrophobicContact CD1-SD 3.6Å; F230-M283 HydrophobicContact CD2-SD 4.36Å; F230-M283 HydrophobicContact CE1-SD 4.3Å; F230-M283 HydrophobicContact CG-SD 3.63Å; F230-N287 VanDerWaalsContact CB-ND2 3.29Å; F230-N287 WeakPolarHBondContact CB-ND2 3.45Å; F230-N287 PolarHBondContact N-ND2 2.99Å; F230-H322 AromaticContact CZ-NE2 3.88Å
231	H	60.7	Low	68.6	Low	92 Å²	92	73.3 Å²	73.3	43%	0.426	37%	0.367	S	S	.	.			trans	-128.6	112.2	176	-165.2	61.7	0	0	0	109.7	Y229	Y229-H231 HydrophobicContact CD1-CB 3.95Å; Y229-H231 HydrophobicContact CE1-CB 3.59Å; Y229-H231 AromaticContact CE1-CG 3.79Å; Y229-H231 AromaticContact CE1-ND1 3.56Å; Y229-H231 AromaticContact CZ-ND1 3.91Å; Y229-H231 PolarHBondContact OH-ND1 2.85Å
232	D	67.8	Low	68.4	Low	31 Å²	31	76.7 Å²	76.7	17%	0.166	38%	0.38	C	S	.	.			trans	-103.4	93.6	162.7	-170	-28.1	0	0	0	107.5	F230 Y234 L235 E236 H322 R326	F230-D232 HydrophobicContact CE1-CB 3.86Å; F230-D232 HydrophobicContact CZ-CB 4.33Å; D232-Y234 PolarHBondContact O-N 3.16Å; D232-Y234 VanDerWaalsContact O-N 3.08Å; D232-Y234 WeakPolarHBondContact OD1-CB 3.46Å; D232-Y234 PolarHBondContact OD1-N 3.4Å; D232-L235 HydrophobicContact CB-CB 4.2Å; D232-L235 HydrophobicContact CB-CD1 4.21Å; D232-L235 HydrophobicContact CB-CG 4.27Å; D232-L235 PolarHBondContact O-N 2.81Å; D232-L235 PolarHBondContact OD1-N 3.16Å; D232-E236 PolarHBondContact O-N 3.43Å; D232-H322 IonicContact OD2-CD2 3.94Å; D232-H322 IonicContact OD2-CE1 2.57Å; D232-H322 IonicContact OD2-NE2 3.18Å; D232-H322 PolarHBondContact OD2-NE2 3.12Å; D232-R326 WeakPolarHBondContact OD2-CD 3.42Å; D232-R326 IonicContact OD2-NE 3.68Å
233	Q	66.6	Low	68	Low	149 Å²	149	77.7 Å²	77.7	70%	0.696	38%	0.384	S	S	*	.	H	α-helix	trans	-59.1	-22.4	-175.5	-165.2	172.9	12.3	0	0	112.7	S237	Q233-S237 PolarHBondContact O-OG 3.26Å
234	Y	68.8	Low	67.5	Low	93 Å²	93	73.6 Å²	73.6	37%	0.365	37%	0.371	S	S	.	.	H	α-helix	trans	-84.4	-21.8	177.6	178.1	-102.4	0	0	0	113.3	D232 S237 F238 I329	D232-Y234 PolarHBondContact O-N 3.16Å; D232-Y234 VanDerWaalsContact O-N 3.08Å; D232-Y234 WeakPolarHBondContact OD1-CB 3.46Å; D232-Y234 PolarHBondContact OD1-N 3.4Å; Y234-S237 PolarHBondContact O-OG 3.18Å; Y234-F238 HydrophobicContact CD2-CE2 4.42Å; Y234-F238 HydrophobicContact CE2-CE2 4.08Å; Y234-F238 WeakPolarHBondContact O-CD2 3.3Å; Y234-F238 VanDerWaalsContact O-CE2 3.29Å; Y234-F238 WeakPolarHBondContact O-CE2 3.49Å; Y234-I329 HydrophobicContact CD1-CG2 4.5Å; Y234-I329 HydrophobicContact CE1-CG2 3.69Å
235	L	72.7	Confident	67	Low	2 Å²	2	75 Å²	75	1%	0.01	37%	0.369	C	S	.	.	H	α-helix	trans	-88.4	-40	171	-70.2	-179.6	0	0	0	111.9	D232 S237 F238 L275 F278 C325 R326 I329	D232-L235 HydrophobicContact CB-CB 4.2Å; D232-L235 HydrophobicContact CB-CD1 4.21Å; D232-L235 HydrophobicContact CB-CG 4.27Å; D232-L235 PolarHBondContact O-N 2.81Å; D232-L235 PolarHBondContact OD1-N 3.16Å; L235-S237 PolarHBondContact O-N 2.78Å; L235-F238 PolarHBondContact O-N 3.04Å; L235-F238 VanDerWaalsContact O-N 3.11Å; L235-L275 HydrophobicContact CB-CD1 4.06Å; L235-F278 HydrophobicContact CD1-CD1 4.41Å; L235-F278 HydrophobicContact CD1-CE1 4.27Å; L235-C325 HydrophobicContact CD1-CB 4.1Å; L235-C325 HydrophobicContact CD2-CB 4.03Å; L235-R326 HydrophobicContact CD1-CG 3.98Å; L235-R326 HydrophobicContact CD2-CG 3.99Å; L235-R326 HydrophobicContact CG-CG 4.08Å; L235-I329 HydrophobicContact CD2-CG2 4.08Å
236	E	66.8	Low	66.5	Low	52 Å²	52	75.3 Å²	75.3	24%	0.243	37%	0.37	C	S	.	.	H	α-helix	trans	-61.6	-32.9	-178.1	-161.9	67.8	-167.5	0	0	111.7	D232 F238 R239	D232-E236 PolarHBondContact O-N 3.43Å; E236-F238 PolarHBondContact O-N 3.11Å; E236-F238 VanDerWaalsContact O-N 3.16Å; E236-R239 VanDerWaalsContact O-CB 3.27Å; E236-R239 WeakPolarHBondContact O-CB 3.1Å; E236-R239 PolarHBondContact O-N 3.47Å; E236-R239 VanDerWaalsContact O-N 3.15Å; E236-R239 VanDerWaalsContact OE1-CD 3.29Å; E236-R239 WeakPolarHBondContact OE1-CD 3.47Å; E236-R239 IonicContact OE1-CZ 3.02Å; E236-R239 IonicContact OE1-NE 3.11Å; E236-R239 IonicContact OE1-NH1 3.88Å; E236-R239 PolarHBondContact OE1-NH1 3.3Å
237	S	70.7	Confident	66.3	Low	71 Å²	71	69 Å²	69	50%	0.497	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-19.9	176.5	55	0	0	0	0	114.9	Q233 Y234 L235 S241	Q233-S237 PolarHBondContact O-OG 3.26Å; Y234-S237 PolarHBondContact O-OG 3.18Å; L235-S237 PolarHBondContact O-N 2.78Å; S237-S241 PolarHBondContact O-OG 3.42Å
238	F	67.7	Low	65.7	Low	33 Å²	33	73.9 Å²	73.9	15%	0.145	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.5	-0.6	178.3	-62.8	-78.6	0	0	0	113.8	Y234 L235 E236 D240 S241 L246 W268 F271 I329	Y234-F238 HydrophobicContact CD2-CE2 4.42Å; Y234-F238 HydrophobicContact CE2-CE2 4.08Å; Y234-F238 WeakPolarHBondContact O-CD2 3.3Å; Y234-F238 VanDerWaalsContact O-CE2 3.29Å; Y234-F238 WeakPolarHBondContact O-CE2 3.49Å; L235-F238 PolarHBondContact O-N 3.04Å; L235-F238 VanDerWaalsContact O-N 3.11Å; E236-F238 PolarHBondContact O-N 3.11Å; E236-F238 VanDerWaalsContact O-N 3.16Å; F238-D240 VanDerWaalsContact C-N 3.34Å; F238-D240 PolarHBondContact O-N 2.73Å; F238-S241 WeakPolarHBondContact O-CB 3.3Å; F238-S241 PolarHBondContact O-N 3.07Å; F238-S241 VanDerWaalsContact O-N 3.16Å; F238-L246 HydrophobicContact CD1-CD1 4.39Å; F238-L246 HydrophobicContact CE1-CD1 4.34Å; F238-L246 HydrophobicContact CE1-CD2 4.44Å; F238-L246 HydrophobicContact CE1-CG 4.49Å; F238-W268 HydrophobicContact CD1-CH2 4.49Å; F238-F271 HydrophobicContact CB-CE1 4.05Å; F238-F271 HydrophobicContact CB-CZ 4.23Å; F238-I329 HydrophobicContact CD1-CD1 3.95Å; F238-I329 HydrophobicContact CD1-CG1 4.24Å; F238-I329 HydrophobicContact CD2-CD1 4.28Å; F238-I329 HydrophobicContact CD2-CG1 3.69Å; F238-I329 HydrophobicContact CE1-CD1 4.09Å; F238-I329 HydrophobicContact CE1-CG1 4.21Å; F238-I329 HydrophobicContact CE2-CD1 4.41Å; F238-I329 HydrophobicContact CE2-CG1 3.67Å; F238-I329 HydrophobicContact CG-CD1 4.04Å; F238-I329 HydrophobicContact CG-CG1 3.97Å; F238-I329 HydrophobicContact CZ-CD1 4.31Å; F238-I329 HydrophobicContact CZ-CG1 3.94Å
239	R	63.8	Low	64.6	Low	74 Å²	74	74 Å²	74	28%	0.279	36%	0.358	S	S	.	.	S	Bend	trans	-58.5	-43.7	-175.8	-167.2	-177.4	-163.9	-174	5.6	112.4	E236 K272 L275 D280 R401	E236-R239 VanDerWaalsContact O-CB 3.27Å; E236-R239 WeakPolarHBondContact O-CB 3.1Å; E236-R239 PolarHBondContact O-N 3.47Å; E236-R239 VanDerWaalsContact O-N 3.15Å; E236-R239 VanDerWaalsContact OE1-CD 3.29Å; E236-R239 WeakPolarHBondContact OE1-CD 3.47Å; E236-R239 IonicContact OE1-CZ 3.02Å; E236-R239 IonicContact OE1-NE 3.11Å; E236-R239 IonicContact OE1-NH1 3.88Å; E236-R239 PolarHBondContact OE1-NH1 3.3Å; R239-K272 WeakPolarHBondContact O-CE 3.26Å; R239-K272 PolarHBondContact O-NZ 2.87Å; R239-L275 HydrophobicContact CB-CD2 4.44Å; R239-D280 IonicContact CZ-OD1 3.49Å; R239-D280 IonicContact NE-OD1 3Å; R239-D280 IonicContact NH2-OD1 3.96Å; R239-D280 PolarHBondContact NH2-OD1 2.95Å; R239-R401 VanDerWaalsContact NH2-NH2 3.12Å
240	D	70.3	Confident	63.6	Low	148 Å²	148	71 Å²	71	79%	0.791	37%	0.368	S	S	*	.	S	Bend	trans	-96	-3.8	178.1	-64.5	-43.8	0	0	0	113.3	F238	F238-D240 VanDerWaalsContact C-N 3.34Å; F238-D240 PolarHBondContact O-N 2.73Å
241	S	71.5	Confident	62.5	Low	18 Å²	18	72.6 Å²	72.6	13%	0.126	38%	0.381	C	S	.	.			trans	-67.4	157.6	179.3	-68.7	0	0	0	0	114.2	S237 F238 Q245 W268 K272	S237-S241 PolarHBondContact O-OG 3.42Å; F238-S241 WeakPolarHBondContact O-CB 3.3Å; F238-S241 PolarHBondContact O-N 3.07Å; F238-S241 VanDerWaalsContact O-N 3.16Å; S241-Q245 VanDerWaalsContact CB-OE1 3.25Å; S241-Q245 PolarHBondContact OG-OE1 2.83Å; S241-Q245 VanDerWaalsContact OG-OE1 3.14Å; S241-W268 PolarHBondContact O-NE1 3.29Å; S241-W268 VanDerWaalsContact O-NE1 3.1Å; S241-K272 PolarHBondContact O-NZ 2.93Å; S241-K272 VanDerWaalsContact O-NZ 3.16Å
242	H	71.3	Confident	61.5	Low	83 Å²	83	74 Å²	74	38%	0.384	40%	0.401	S	S	.	.			trans	-117.2	150.5	170.8	-166.7	-111.6	0	0	0	109.6	S244 Q245	H242-S244 PolarHBondContact ND1-OG 3.01Å; H242-S244 PolarHBondContact O-N 2.75Å; H242-S244 VanDerWaalsContact O-N 3.16Å; H242-Q245 WeakPolarHBondContact O-CB 3.41Å; H242-Q245 PolarHBondContact O-N 2.68Å
243	W	70.3	Confident	60	Low	24 Å²	24	81.1 Å²	81.1	9%	0.091	43%	0.433	C	S	.	.	G	3₁₀ helix	trans	-57.4	-34.1	-176.9	60.6	-96.2	0	0	0	112.9	Q245 L246 D247 M256 V261 C264 E265 W268 F341	W243-Q245 PolarHBondContact O-N 2.95Å; W243-L246 PolarHBondContact O-N 3.02Å; W243-D247 PolarHBondContact O-N 3.47Å; W243-M256 HydrophobicContact CZ3-CE 4.43Å; W243-V261 HydrophobicContact CH2-CG1 4.26Å; W243-V261 HydrophobicContact CZ2-CG1 3.94Å; W243-C264 HydrophobicContact CD2-CB 4.15Å; W243-C264 HydrophobicContact CE3-CB 4.19Å; W243-E265 HydrophobicContact CZ2-CG 4.5Å; W243-W268 HydrophobicContact CB-CB 4.01Å; W243-W268 HydrophobicContact CB-CD2 3.79Å; W243-W268 HydrophobicContact CB-CE3 3.9Å; W243-W268 HydrophobicContact CB-CG 3.83Å; W243-W268 HydrophobicContact CG-CB 4.33Å; W243-W268 HydrophobicContact CG-CG 4.41Å; W243-F341 HydrophobicContact CB-CE1 3.93Å; W243-F341 HydrophobicContact CB-CZ 4.22Å; W243-F341 HydrophobicContact CE3-CE1 4.47Å
244	S	64	Low	59.1	Low	62 Å²	62	80.8 Å²	80.8	43%	0.434	44%	0.437	S	S	.	.	G	3₁₀ helix	trans	-69	6.7	175.8	70.5	0	0	0	0	114.9	H242	H242-S244 PolarHBondContact ND1-OG 3.01Å; H242-S244 PolarHBondContact O-N 2.75Å; H242-S244 VanDerWaalsContact O-N 3.16Å
245	Q	64.5	Low	58.5	Low	109 Å²	109	81.8 Å²	81.8	51%	0.509	46%	0.457	S	S	.	.	G	3₁₀ helix	trans	-101.6	-17.9	169.2	-62.2	174	-16.5	0	0	112.4	S241 H242 W243	S241-Q245 VanDerWaalsContact CB-OE1 3.25Å; S241-Q245 PolarHBondContact OG-OE1 2.83Å; S241-Q245 VanDerWaalsContact OG-OE1 3.14Å; H242-Q245 WeakPolarHBondContact O-CB 3.41Å; H242-Q245 PolarHBondContact O-N 2.68Å; W243-Q245 PolarHBondContact O-N 2.95Å
246	L	60.4	Low	58.1	Low	13 Å²	13	84.6 Å²	84.6	7%	0.068	47%	0.471	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.3	-33.2	167.6	-73.8	94.9	0	0	0	111	F238 W243 K248 W268 I329 L332 S336 F341	F238-L246 HydrophobicContact CD1-CD1 4.39Å; F238-L246 HydrophobicContact CE1-CD1 4.34Å; F238-L246 HydrophobicContact CE1-CD2 4.44Å; F238-L246 HydrophobicContact CE1-CG 4.49Å; W243-L246 PolarHBondContact O-N 3.02Å; L246-K248 VanDerWaalsContact C-N 3.34Å; L246-K248 PolarHBondContact O-N 3.47Å; L246-W268 HydrophobicContact CD1-CH2 3.54Å; L246-W268 HydrophobicContact CD1-CZ2 4.45Å; L246-W268 HydrophobicContact CD1-CZ3 3.69Å; L246-I329 HydrophobicContact CD2-CD1 4.08Å; L246-L332 HydrophobicContact CD2-CB 4.48Å; L246-S336 WeakPolarHBondContact O-CB 3.49Å; L246-F341 HydrophobicContact CB-CE2 3.73Å; L246-F341 HydrophobicContact CB-CZ 4.18Å; L246-F341 HydrophobicContact CD2-CE2 4.39Å
247	D	59.2	Low	58.6	Low	51 Å²	51	85.5 Å²	85.5	27%	0.273	48%	0.48	S	S	.	.			trans	-67.4	93.3	169.6	-171.2	2.9	0	0	0	110.3	W243 S249	W243-D247 PolarHBondContact O-N 3.47Å; D247-S249 VanDerWaalsContact C-N 3.34Å; D247-S249 WeakPolarHBondContact OD1-CB 3.33Å; D247-S249 PolarHBondContact OD1-N 3.18Å; D247-S249 VanDerWaalsContact OD1-N 3.12Å
248	K	51.8	Low	59.1	Low	180 Å²	180	87.5 Å²	87.5	78%	0.783	49%	0.485	S	S	*	.			trans	-98.5	18.1	176.8	-67.4	-178.7	179.7	177.9	0	111.9	L246 G250	L246-K248 VanDerWaalsContact C-N 3.34Å; L246-K248 PolarHBondContact O-N 3.47Å; K248-G250 PolarHBondContact O-N 2.85Å
249	S	43.6	Very low	59.7	Low	44 Å²	44	90.9 Å²	90.9	31%	0.308	50%	0.497	S	S	.	.			trans	-65	101.2	168.5	-179.3	0	0	0	0	109.5	D247 N251	D247-S249 VanDerWaalsContact C-N 3.34Å; D247-S249 WeakPolarHBondContact OD1-CB 3.33Å; D247-S249 PolarHBondContact OD1-N 3.18Å; D247-S249 VanDerWaalsContact OD1-N 3.12Å; S249-N251 PolarHBondContact O-N 3.29Å; S249-N251 VanDerWaalsContact O-N 3.13Å
250	G	40.3	Very low	60.4	Low	73 Å²	73	90.7 Å²	90.7	75%	0.753	50%	0.499	S	S	*	.			trans	-68.2	-0.2	171.2	0	0	0	0	0	114	K248 S252	K248-G250 PolarHBondContact O-N 2.85Å; G250-S252 PolarHBondContact O-N 3.28Å
251	N	38.9	Very low	61	Low	123 Å²	123	85.6 Å²	85.6	66%	0.658	47%	0.473	S	S	*	.			trans	-89.9	83.2	-175.5	-70.9	1	0	0	0	111	S249 E253	S249-N251 PolarHBondContact O-N 3.29Å; S249-N251 VanDerWaalsContact O-N 3.13Å; N251-E253 PolarHBondContact O-N 2.96Å
252	S	40.4	Very low	61.7	Low	121 Å²	121	89.5 Å²	89.5	85%	0.846	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.6	23	178.1	63.4	0	0	0	0	115.3	G250	G250-S252 PolarHBondContact O-N 3.28Å
253	E	36.3	Very low	62.2	Low	180 Å²	180	86.7 Å²	86.7	84%	0.841	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.2	-20.9	-176.5	-63.6	-165.1	136	0	0	113.7	N251	N251-E253 PolarHBondContact O-N 2.96Å
254	N	48.5	Very low	62.8	Low	143 Å²	143	85.5 Å²	85.5	77%	0.765	47%	0.467	S	S	*	.	S	Bend	trans	-96.3	89.9	166.4	-89.2	5.5	0	0	0	109.7	M256	N254-M256 PolarHBondContact O-N 3.34Å
255	S	55.5	Low	63.9	Low	113 Å²	113	87 Å²	87	79%	0.79	47%	0.467	S	S	*	.			trans	-64.9	105.6	171.4	60	0	0	0	0	110.3	T257	S255-T257 PolarHBondContact O-N 2.9Å
256	M	63.8	Low	65	Low	62 Å²	62	82.1 Å²	82.1	31%	0.305	45%	0.445	S	S	.	.			trans	-47.7	136.1	168	-83	174.7	61.3	0	0	109.9	W243 N254 E260 V261 C264	W243-M256 HydrophobicContact CZ3-CE 4.43Å; N254-M256 PolarHBondContact O-N 3.34Å; M256-E260 HydrophobicContact CB-CB 4.49Å; M256-E260 HydrophobicContact CE-CB 3.94Å; M256-V261 HydrophobicContact CB-CG2 4.01Å; M256-V261 HydrophobicContact CE-CG2 4.36Å; M256-C264 HydrophobicContact CE-CB 4.39Å
257	T	77.4	Confident	66.2	Low	71 Å²	71	81.5 Å²	81.5	44%	0.436	44%	0.442	S	S	.	.			trans	-66.3	153.2	-178	65.6	0	0	0	0	111.1	S255 R259 E260 V261	S255-T257 PolarHBondContact O-N 2.9Å; T257-R259 PolarHBondContact O-N 2.88Å; T257-E260 VanDerWaalsContact CB-OE2 3.24Å; T257-E260 WeakPolarHBondContact CB-OE2 3.26Å; T257-E260 VanDerWaalsContact CG2-OE2 3.31Å; T257-E260 WeakPolarHBondContact CG2-OE2 3.26Å; T257-E260 PolarHBondContact N-OE2 2.73Å; T257-E260 PolarHBondContact O-N 3.31Å; T257-E260 VanDerWaalsContact OG1-CD 3.25Å; T257-E260 WeakPolarHBondContact OG1-CG 3.27Å; T257-E260 PolarHBondContact OG1-N 3.14Å; T257-E260 PolarHBondContact OG1-OE2 2.96Å; T257-V261 PolarHBondContact O-N 3.03Å
258	D	81.2	Confident	67.5	Low	112 Å²	112	79.7 Å²	79.7	60%	0.599	43%	0.431	S	S	*	.	H	α-helix	trans	-47.6	-20	169.5	-134.5	49.2	0	0	0	114	R262	D258-R262 VanDerWaalsContact O-CD 3.24Å; D258-R262 WeakPolarHBondContact O-CD 3.48Å; D258-R262 VanDerWaalsContact O-CG 3.27Å; D258-R262 WeakPolarHBondContact O-CG 3.35Å; D258-R262 PolarHBondContact O-NE 3.17Å; D258-R262 PolarHBondContact O-NH1 3.02Å; D258-R262 IonicContact OD1-NH2 2.78Å; D258-R262 IonicContact OD2-CZ 3.34Å; D258-R262 IonicContact OD2-NH1 3.46Å; D258-R262 PolarHBondContact OD2-NH1 3.08Å; D258-R262 IonicContact OD2-NH2 2.8Å; D258-R262 PolarHBondContact OD2-NH2 3.11Å
259	R	81.5	Confident	69.4	Low	104 Å²	104	76.5 Å²	76.5	39%	0.392	42%	0.419	S	S	.	.	H	α-helix	trans	-87.6	-44.6	175.6	179.8	177.9	-172.8	163.7	5.9	112	T257 R262 R263 Y429 T430	T257-R259 PolarHBondContact O-N 2.88Å; R259-R262 PolarHBondContact O-N 2.94Å; R259-R263 PolarHBondContact O-N 2.87Å; R259-Y429 WeakPolarHBondContact CD-O 3.48Å; R259-Y429 WeakPolarHBondContact CG-O 3.48Å; R259-Y429 PolarHBondContact NE-O 3.28Å; R259-T430 PolarHBondContact NH2-O 3.03Å
260	E	78.1	Confident	71.6	Confident	70 Å²	70	74.4 Å²	74.4	33%	0.327	41%	0.405	S	S	.	.	H	α-helix	trans	-70.1	-38.1	179.3	-70.5	151.6	146.2	0	0	111.9	M256 T257 R262 R263 C264	M256-E260 HydrophobicContact CB-CB 4.49Å; M256-E260 HydrophobicContact CE-CB 3.94Å; T257-E260 VanDerWaalsContact CB-OE2 3.24Å; T257-E260 WeakPolarHBondContact CB-OE2 3.26Å; T257-E260 VanDerWaalsContact CG2-OE2 3.31Å; T257-E260 WeakPolarHBondContact CG2-OE2 3.26Å; T257-E260 PolarHBondContact N-OE2 2.73Å; T257-E260 PolarHBondContact O-N 3.31Å; T257-E260 VanDerWaalsContact OG1-CD 3.25Å; T257-E260 WeakPolarHBondContact OG1-CG 3.27Å; T257-E260 PolarHBondContact OG1-N 3.14Å; T257-E260 PolarHBondContact OG1-OE2 2.96Å; E260-R262 PolarHBondContact O-N 3.27Å; E260-R263 WeakPolarHBondContact O-CB 3.2Å; E260-R263 PolarHBondContact O-N 3.09Å; E260-R263 VanDerWaalsContact O-N 3.14Å; E260-C264 PolarHBondContact O-N 2.8Å; E260-C264 PolarHBondContact O-SG 3.22Å
261	V	83.1	Confident	73.9	Confident	42 Å²	42	71 Å²	71	26%	0.255	37%	0.369	S	S	.	.	H	α-helix	trans	-55.1	-52.1	171.1	175.5	0	0	0	0	110.1	W243 M256 T257 R263 C264 E265	W243-V261 HydrophobicContact CH2-CG1 4.26Å; W243-V261 HydrophobicContact CZ2-CG1 3.94Å; M256-V261 HydrophobicContact CB-CG2 4.01Å; M256-V261 HydrophobicContact CE-CG2 4.36Å; T257-V261 PolarHBondContact O-N 3.03Å; V261-R263 VanDerWaalsContact C-N 3.29Å; V261-R263 PolarHBondContact O-N 3.46Å; V261-C264 PolarHBondContact O-N 2.87Å; V261-C264 VanDerWaalsContact O-N 3.17Å; V261-E265 WeakPolarHBondContact O-CG 3.4Å; V261-E265 PolarHBondContact O-N 2.94Å
262	R	85	Confident	76.3	Confident	99 Å²	99	68.6 Å²	68.6	37%	0.374	35%	0.353	S	S	.	.	H	α-helix	trans	-65.1	-29.1	177.4	-67.3	175.4	-172.2	120.8	5.2	113.6	D258 R259 E260 A266 Y429	D258-R262 VanDerWaalsContact O-CD 3.24Å; D258-R262 WeakPolarHBondContact O-CD 3.48Å; D258-R262 VanDerWaalsContact O-CG 3.27Å; D258-R262 WeakPolarHBondContact O-CG 3.35Å; D258-R262 PolarHBondContact O-NE 3.17Å; D258-R262 PolarHBondContact O-NH1 3.02Å; D258-R262 IonicContact OD1-NH2 2.78Å; D258-R262 IonicContact OD2-CZ 3.34Å; D258-R262 IonicContact OD2-NH1 3.46Å; D258-R262 PolarHBondContact OD2-NH1 3.08Å; D258-R262 IonicContact OD2-NH2 2.8Å; D258-R262 PolarHBondContact OD2-NH2 3.11Å; R259-R262 PolarHBondContact O-N 2.94Å; E260-R262 PolarHBondContact O-N 3.27Å; R262-A266 WeakPolarHBondContact O-CB 3.49Å; R262-A266 PolarHBondContact O-N 3.38Å; R262-A266 VanDerWaalsContact O-N 3.08Å; R262-Y429 HydrophobicContact CB-CD1 3.75Å; R262-Y429 HydrophobicContact CB-CD2 3.93Å; R262-Y429 HydrophobicContact CB-CE1 3.79Å; R262-Y429 HydrophobicContact CB-CE2 3.98Å; R262-Y429 HydrophobicContact CB-CG 3.82Å; R262-Y429 HydrophobicContact CG-CE1 4.36Å; R262-Y429 WeakPolarHBondContact O-CD2 3.3Å
263	R	82.8	Confident	78.8	Confident	24 Å²	24	64.2 Å²	64.2	9%	0.091	32%	0.322	C	S	.	.	H	α-helix	trans	-65.8	-49.5	171.9	-168.2	-173.2	56.1	44.8	1.7	110	R259 E260 V261 A266 V267 F341 G342	R259-R263 PolarHBondContact O-N 2.87Å; E260-R263 WeakPolarHBondContact O-CB 3.2Å; E260-R263 PolarHBondContact O-N 3.09Å; E260-R263 VanDerWaalsContact O-N 3.14Å; V261-R263 VanDerWaalsContact C-N 3.29Å; V261-R263 PolarHBondContact O-N 3.46Å; R263-A266 PolarHBondContact O-N 3.27Å; R263-V267 WeakPolarHBondContact O-CG2 3.35Å; R263-V267 PolarHBondContact O-N 2.95Å; R263-F341 PolarHBondContact NH1-O 2.87Å; R263-F341 PolarHBondContact NH2-O 3.09Å; R263-G342 VanDerWaalsContact CZ-O 3.29Å; R263-G342 VanDerWaalsContact NH1-C 3.34Å; R263-G342 PolarHBondContact NH1-O 2.95Å
264	C	83.2	Confident	81.4	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-65	-38.7	178.6	-65.2	0	0	0	0	112.4	W243 M256 E260 V261 A266 V267 W268 F341	W243-C264 HydrophobicContact CD2-CB 4.15Å; W243-C264 HydrophobicContact CE3-CB 4.19Å; M256-C264 HydrophobicContact CE-CB 4.39Å; E260-C264 PolarHBondContact O-N 2.8Å; E260-C264 PolarHBondContact O-SG 3.22Å; V261-C264 PolarHBondContact O-N 2.87Å; V261-C264 VanDerWaalsContact O-N 3.17Å; C264-A266 PolarHBondContact O-N 3.06Å; C264-V267 PolarHBondContact O-N 2.92Å; C264-W268 WeakPolarHBondContact O-CB 3.42Å; C264-W268 PolarHBondContact O-N 3.39Å; C264-F341 HydrophobicContact CB-CD1 4.28Å; C264-F341 HydrophobicContact CB-CE1 4.41Å; C264-F341 PolarHBondContact SG-O 3.32Å
265	E	86.4	Confident	83.4	Confident	93 Å²	93	49.1 Å²	49.1	44%	0.435	25%	0.247	S	C	.	.	H	α-helix	trans	-56.7	-47.3	169.1	-72.4	176.1	151.3	0	0	111.7	W243 V261 W268 E269	W243-E265 HydrophobicContact CZ2-CG 4.5Å; V261-E265 WeakPolarHBondContact O-CG 3.4Å; V261-E265 PolarHBondContact O-N 2.94Å; E265-W268 CarbonylContact O-C 3.6Å; E265-W268 PolarHBondContact O-N 2.92Å; E265-E269 WeakPolarHBondContact O-CB 3.21Å; E265-E269 PolarHBondContact O-N 3.47Å
266	A	87.3	Confident	85.1	Confident	6 Å²	6	46.2 Å²	46.2	5%	0.05	23%	0.225	C	C	.	.	H	α-helix	trans	-68.7	-33.4	178.7	0	0	0	0	0	113.3	R262 R263 C264 L270 I426 Y429	R262-A266 WeakPolarHBondContact O-CB 3.49Å; R262-A266 PolarHBondContact O-N 3.38Å; R262-A266 VanDerWaalsContact O-N 3.08Å; R263-A266 PolarHBondContact O-N 3.27Å; C264-A266 PolarHBondContact O-N 3.06Å; A266-L270 PolarHBondContact O-N 3.33Å; A266-L270 VanDerWaalsContact O-N 3.11Å; A266-I426 HydrophobicContact CB-CG1 3.71Å; A266-Y429 HydrophobicContact CB-CD2 4.35Å
267	V	86.6	Confident	86.5	Confident	1 Å²	1	43.4 Å²	43.4	1%	0.006	21%	0.211	C	C	.	.	H	α-helix	trans	-64.1	-43.3	170.5	177.8	0	0	0	0	110.6	R263 C264 L270 F271 L332 L347 I426	R263-V267 WeakPolarHBondContact O-CG2 3.35Å; R263-V267 PolarHBondContact O-N 2.95Å; C264-V267 PolarHBondContact O-N 2.92Å; V267-L270 PolarHBondContact O-N 3.41Å; V267-F271 PolarHBondContact O-N 3.02Å; V267-F271 VanDerWaalsContact O-N 3.08Å; V267-L332 HydrophobicContact CG1-CD1 4.37Å; V267-L332 HydrophobicContact CG1-CD2 3.97Å; V267-L347 HydrophobicContact CB-CD1 4.48Å; V267-L347 HydrophobicContact CG1-CD1 4.25Å; V267-L347 HydrophobicContact CG1-CD2 4.18Å; V267-L347 HydrophobicContact CG1-CG 4.24Å; V267-L347 HydrophobicContact CG2-CD1 3.64Å; V267-L347 HydrophobicContact CG2-CG 4.45Å; V267-I426 HydrophobicContact CG2-CG1 4.47Å; V267-I426 HydrophobicContact CG2-CG2 4.38Å
268	W	86.8	Confident	87.2	Confident	12 Å²	12	40.1 Å²	40.1	5%	0.045	19%	0.191	C	C	.	.	H	α-helix	trans	-70.7	-34.6	178.6	-160.5	-109.9	0	0	0	112.4	F238 S241 W243 L246 C264 E265 F271 K272 I329 L332	F238-W268 HydrophobicContact CD1-CH2 4.49Å; S241-W268 PolarHBondContact O-NE1 3.29Å; S241-W268 VanDerWaalsContact O-NE1 3.1Å; W243-W268 HydrophobicContact CB-CB 4.01Å; W243-W268 HydrophobicContact CB-CD2 3.79Å; W243-W268 HydrophobicContact CB-CE3 3.9Å; W243-W268 HydrophobicContact CB-CG 3.83Å; W243-W268 HydrophobicContact CG-CB 4.33Å; W243-W268 HydrophobicContact CG-CG 4.41Å; L246-W268 HydrophobicContact CD1-CH2 3.54Å; L246-W268 HydrophobicContact CD1-CZ2 4.45Å; L246-W268 HydrophobicContact CD1-CZ3 3.69Å; C264-W268 WeakPolarHBondContact O-CB 3.42Å; C264-W268 PolarHBondContact O-N 3.39Å; E265-W268 CarbonylContact O-C 3.6Å; E265-W268 PolarHBondContact O-N 2.92Å; W268-F271 HydrophobicContact CD2-CD1 4.38Å; W268-F271 HydrophobicContact CE3-CD1 4.08Å; W268-F271 AromaticContact CH2-CD1 3.85Å; W268-F271 HydrophobicContact CH2-CD1 3.85Å; W268-F271 AromaticContact CH2-CE1 3.86Å; W268-F271 HydrophobicContact CH2-CE1 3.86Å; W268-F271 HydrophobicContact CZ2-CD1 4.16Å; W268-F271 HydrophobicContact CZ2-CE1 4.24Å; W268-F271 AromaticContact CZ3-CD1 3.82Å; W268-F271 HydrophobicContact CZ3-CD1 3.82Å; W268-F271 HydrophobicContact CZ3-CE1 4.21Å; W268-F271 PolarHBondContact O-N 2.94Å; W268-K272 WeakPolarHBondContact O-CB 3.45Å; W268-K272 PolarHBondContact O-N 2.86Å; W268-I329 HydrophobicContact CH2-CD1 4.04Å; W268-I329 HydrophobicContact CZ3-CD1 3.98Å; W268-L332 HydrophobicContact CZ3-CD1 4.45Å
269	E	90.7	Very high	87.6	Confident	114 Å²	114	36 Å²	36	53%	0.533	17%	0.17	S	C	.	.	H	α-helix	trans	-61.8	-43.7	171.9	-169.3	-177.1	-179.1	0	0	110.8	E265 K272 S273 L422	E265-E269 WeakPolarHBondContact O-CB 3.21Å; E265-E269 PolarHBondContact O-N 3.47Å; E269-K272 PolarHBondContact O-N 2.96Å; E269-S273 WeakPolarHBondContact O-CB 3.39Å; E269-S273 PolarHBondContact O-N 3.34Å; E269-S273 PolarHBondContact O-OG 2.88Å; E269-L422 HydrophobicContact CB-CD2 4.32Å; E269-L422 HydrophobicContact CG-CD2 3.75Å
270	L	90.6	Very high	87.9	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-58.3	-54.4	173.6	176.7	60.5	0	0	0	111.2	A266 V267 K272 S273 E274 F324 L347 I419 L422 L423 I426	A266-L270 PolarHBondContact O-N 3.33Å; A266-L270 VanDerWaalsContact O-N 3.11Å; V267-L270 PolarHBondContact O-N 3.41Å; L270-K272 PolarHBondContact O-N 2.91Å; L270-S273 PolarHBondContact O-N 3Å; L270-S273 PolarHBondContact O-OG 2.97Å; L270-E274 PolarHBondContact O-N 2.86Å; L270-F324 HydrophobicContact CD2-CZ 4.34Å; L270-F324 HydrophobicContact CG-CZ 4.47Å; L270-L347 HydrophobicContact CD2-CD2 4.07Å; L270-I419 HydrophobicContact CD1-CD1 4.12Å; L270-L422 HydrophobicContact CD1-CB 4.11Å; L270-L422 HydrophobicContact CD1-CD1 3.9Å; L270-L423 HydrophobicContact CD2-CD2 4.31Å; L270-I426 HydrophobicContact CB-CD1 4.1Å; L270-I426 HydrophobicContact CD2-CD1 3.69Å
271	F	88.8	Confident	88.6	Confident	1 Å²	1	30.6 Å²	30.6	0%	0.004	15%	0.149	C	C	.	.	H	α-helix	trans	-57.5	-48.3	178	172.5	-111.9	0	0	0	112.6	F238 V267 W268 S273 E274 L275 L328 I329	F238-F271 HydrophobicContact CB-CE1 4.05Å; F238-F271 HydrophobicContact CB-CZ 4.23Å; V267-F271 PolarHBondContact O-N 3.02Å; V267-F271 VanDerWaalsContact O-N 3.08Å; W268-F271 HydrophobicContact CD2-CD1 4.38Å; W268-F271 HydrophobicContact CE3-CD1 4.08Å; W268-F271 AromaticContact CH2-CD1 3.85Å; W268-F271 HydrophobicContact CH2-CD1 3.85Å; W268-F271 AromaticContact CH2-CE1 3.86Å; W268-F271 HydrophobicContact CH2-CE1 3.86Å; W268-F271 HydrophobicContact CZ2-CD1 4.16Å; W268-F271 HydrophobicContact CZ2-CE1 4.24Å; W268-F271 AromaticContact CZ3-CD1 3.82Å; W268-F271 HydrophobicContact CZ3-CD1 3.82Å; W268-F271 HydrophobicContact CZ3-CE1 4.21Å; W268-F271 PolarHBondContact O-N 2.94Å; F271-S273 VanDerWaalsContact C-N 3.34Å; F271-S273 PolarHBondContact O-N 3Å; F271-E274 PolarHBondContact O-N 2.79Å; F271-L275 HydrophobicContact CE1-CD2 4.14Å; F271-L275 HydrophobicContact CZ-CD2 4Å; F271-L275 WeakPolarHBondContact O-CB 3.33Å; F271-L275 PolarHBondContact O-N 3.18Å; F271-L328 HydrophobicContact CB-CD2 3.75Å; F271-L328 HydrophobicContact CB-CG 4.24Å; F271-L328 HydrophobicContact CD2-CB 4.38Å; F271-L328 HydrophobicContact CD2-CD2 4.08Å; F271-L328 HydrophobicContact CD2-CG 4.12Å; F271-L328 HydrophobicContact CG-CD2 4.4Å; F271-I329 HydrophobicContact CD2-CB 4.49Å; F271-I329 HydrophobicContact CE1-CD1 4.02Å; F271-I329 HydrophobicContact CE2-CB 3.76Å; F271-I329 HydrophobicContact CE2-CG1 4.4Å; F271-I329 HydrophobicContact CE2-CG2 4.45Å; F271-I329 HydrophobicContact CZ-CB 3.88Å; F271-I329 HydrophobicContact CZ-CD1 4Å; F271-I329 HydrophobicContact CZ-CG1 4.02Å
272	K	88.7	Confident	89.1	Confident	72 Å²	72	28.6 Å²	28.6	31%	0.313	14%	0.137	S	C	.	.	H	α-helix	trans	-69.9	-31.4	-176.8	-164	155	-167.8	152.1	0	112	R239 S241 W268 E269 L270 T276	R239-K272 WeakPolarHBondContact O-CE 3.26Å; R239-K272 PolarHBondContact O-NZ 2.87Å; S241-K272 PolarHBondContact O-NZ 2.93Å; S241-K272 VanDerWaalsContact O-NZ 3.16Å; W268-K272 WeakPolarHBondContact O-CB 3.45Å; W268-K272 PolarHBondContact O-N 2.86Å; E269-K272 PolarHBondContact O-N 2.96Å; L270-K272 PolarHBondContact O-N 2.91Å; K272-T276 VanDerWaalsContact O-CB 3.29Å; K272-T276 WeakPolarHBondContact O-CB 3.46Å; K272-T276 PolarHBondContact O-N 3.05Å; K272-T276 PolarHBondContact O-OG1 2.69Å
273	S	92.4	Very high	89.3	Confident	30 Å²	30	24.6 Å²	24.6	21%	0.21	12%	0.123	C	C	.	.	H	α-helix	trans	-68.1	-41.7	172.6	75.2	0	0	0	0	112.2	E269 L270 F271 T276 F277 L422	E269-S273 WeakPolarHBondContact O-CB 3.39Å; E269-S273 PolarHBondContact O-N 3.34Å; E269-S273 PolarHBondContact O-OG 2.88Å; L270-S273 PolarHBondContact O-N 3Å; L270-S273 PolarHBondContact O-OG 2.97Å; F271-S273 VanDerWaalsContact C-N 3.34Å; F271-S273 PolarHBondContact O-N 3Å; S273-T276 PolarHBondContact O-N 3.06Å; S273-F277 WeakPolarHBondContact O-CB 3.3Å; S273-F277 PolarHBondContact O-N 2.82Å; S273-L422 WeakPolarHBondContact OG-CD1 3.41Å
274	E	91.3	Very high	89.7	Confident	0 Å²	0	23.7 Å²	23.7	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-66.8	-44.6	175	-168.1	73.1	-144.9	0	0	111	L270 F271 T276 F277 F278 S321 F324 C325 H415	L270-E274 PolarHBondContact O-N 2.86Å; F271-E274 PolarHBondContact O-N 2.79Å; E274-T276 VanDerWaalsContact C-N 3.33Å; E274-T276 PolarHBondContact O-N 3.09Å; E274-F277 CarbonylContact O-C 3.58Å; E274-F277 WeakPolarHBondContact O-CB 3.29Å; E274-F277 PolarHBondContact O-N 2.82Å; E274-F277 VanDerWaalsContact O-N 3.13Å; E274-F278 WeakPolarHBondContact O-CB 3.43Å; E274-F278 PolarHBondContact O-N 2.99Å; E274-S321 WeakPolarHBondContact OE1-CA 3.47Å; E274-S321 VanDerWaalsContact OE1-CB 3.26Å; E274-S321 WeakPolarHBondContact OE1-CB 3.44Å; E274-S321 PolarHBondContact OE1-OG 3.33Å; E274-F324 HydrophobicContact CB-CD1 4.44Å; E274-F324 HydrophobicContact CB-CE1 4.44Å; E274-F324 HydrophobicContact CG-CD1 3.69Å; E274-F324 HydrophobicContact CG-CE1 4.15Å; E274-C325 VanDerWaalsContact CG-SG 3.5Å; E274-H415 IonicContact OE1-NE2 3.87Å; E274-H415 IonicContact OE2-CD2 3.51Å; E274-H415 IonicContact OE2-CE1 3.79Å; E274-H415 IonicContact OE2-NE2 2.69Å; E274-H415 PolarHBondContact OE2-NE2 2.85Å
275	L	90.9	Very high	90.1	Very high	5 Å²	5	23.8 Å²	23.8	3%	0.026	12%	0.12	C	C	.	.	H	α-helix	trans	-62.7	-39.5	177.2	-178.3	60.7	0	0	0	111.9	L235 R239 F271 F278 T279	L235-L275 HydrophobicContact CB-CD1 4.06Å; R239-L275 HydrophobicContact CB-CD2 4.44Å; F271-L275 HydrophobicContact CE1-CD2 4.14Å; F271-L275 HydrophobicContact CZ-CD2 4Å; F271-L275 WeakPolarHBondContact O-CB 3.33Å; F271-L275 PolarHBondContact O-N 3.18Å; L275-F278 PolarHBondContact O-N 2.86Å; L275-T279 WeakPolarHBondContact O-CB 3.09Å; L275-T279 PolarHBondContact O-N 2.94Å; L275-T279 PolarHBondContact O-OG1 3.03Å
276	T	91.3	Very high	90.3	Very high	53 Å²	53	21.3 Å²	21.3	33%	0.325	11%	0.108	S	C	.	.	H	α-helix	trans	-62.6	-45.7	172.1	-57.7	0	0	0	0	110.5	K272 S273 E274 D280	K272-T276 VanDerWaalsContact O-CB 3.29Å; K272-T276 WeakPolarHBondContact O-CB 3.46Å; K272-T276 PolarHBondContact O-N 3.05Å; K272-T276 PolarHBondContact O-OG1 2.69Å; S273-T276 PolarHBondContact O-N 3.06Å; E274-T276 VanDerWaalsContact C-N 3.33Å; E274-T276 PolarHBondContact O-N 3.09Å; T276-D280 HydrophobicContact CG2-CB 4.33Å; T276-D280 WeakPolarHBondContact O-CA 3.47Å; T276-D280 WeakPolarHBondContact O-CB 3.35Å; T276-D280 PolarHBondContact O-N 3.35Å
277	F	92.9	Very high	90.4	Very high	2 Å²	2	21.3 Å²	21.3	1%	0.009	11%	0.107	C	C	.	.	I	π-helix	trans	-62.6	-43.3	177.4	168.7	-116.6	0	0	0	112.7	S273 E274 H281 L282 P412 H415	S273-F277 WeakPolarHBondContact O-CB 3.3Å; S273-F277 PolarHBondContact O-N 2.82Å; E274-F277 CarbonylContact O-C 3.58Å; E274-F277 WeakPolarHBondContact O-CB 3.29Å; E274-F277 PolarHBondContact O-N 2.82Å; E274-F277 VanDerWaalsContact O-N 3.13Å; F277-H281 HydrophobicContact CD2-CB 4.25Å; F277-H281 AromaticContact CD2-ND1 3.99Å; F277-H281 WeakPolarHBondContact O-CB 3.47Å; F277-H281 PolarHBondContact O-N 3.14Å; F277-L282 HydrophobicContact CD1-CD1 4.13Å; F277-L282 HydrophobicContact CD1-CG 4.45Å; F277-L282 HydrophobicContact CD2-CG 4.32Å; F277-L282 HydrophobicContact CE1-CD1 3.55Å; F277-L282 HydrophobicContact CE1-CD2 4.39Å; F277-L282 HydrophobicContact CE1-CG 4.01Å; F277-L282 HydrophobicContact CE2-CD1 4.29Å; F277-L282 HydrophobicContact CE2-CD2 3.76Å; F277-L282 HydrophobicContact CE2-CG 3.83Å; F277-L282 HydrophobicContact CZ-CD1 3.65Å; F277-L282 HydrophobicContact CZ-CD2 3.62Å; F277-L282 HydrophobicContact CZ-CG 3.69Å; F277-L282 PolarHBondContact O-N 3.48Å; F277-P412 HydrophobicContact CE2-CB 4.02Å; F277-P412 HydrophobicContact CE2-CG 3.98Å; F277-P412 HydrophobicContact CZ-CB 3.95Å; F277-P412 HydrophobicContact CZ-CG 4.23Å; F277-H415 HydrophobicContact CD1-CB 4.36Å; F277-H415 AromaticContact CD1-CD2 3.19Å; F277-H415 WeakPolarHBondContact CD1-CD2 3.47Å; F277-H415 AromaticContact CD1-CG 3.69Å; F277-H415 AromaticContact CD1-NE2 3.49Å; F277-H415 WeakPolarHBondContact CD1-NE2 3.34Å; F277-H415 HydrophobicContact CD2-CB 3.78Å; F277-H415 AromaticContact CD2-CG 3.86Å; F277-H415 HydrophobicContact CE1-CB 4.45Å; F277-H415 AromaticContact CE1-CD2 3.46Å; F277-H415 VanDerWaalsContact CE1-CD2 3.46Å; F277-H415 WeakPolarHBondContact CE1-CD2 3.49Å; F277-H415 HydrophobicContact CE2-CB 3.92Å; F277-H415 HydrophobicContact CG-CB 4.01Å; F277-H415 AromaticContact CG-CD2 3.57Å; F277-H415 AromaticContact CG-CG 3.54Å; F277-H415 AromaticContact CG-ND1 3.91Å; F277-H415 AromaticContact CG-NE2 3.9Å; F277-H415 HydrophobicContact CZ-CB 4.23Å
278	F	92.4	Very high	90.5	Very high	3 Å²	3	21.3 Å²	21.3	1%	0.013	11%	0.107	C	C	.	.	I	π-helix	trans	-64.1	-61	176.8	180	-108.8	0	0	0	111.9	F230 L235 E274 L275 L282 M283 H322	F230-F278 HydrophobicContact CD1-CE1 4.28Å; F230-F278 HydrophobicContact CD1-CZ 4.15Å; F230-F278 AromaticContact CE1-CE1 3.83Å; F230-F278 HydrophobicContact CE1-CE1 3.83Å; F230-F278 AromaticContact CE1-CZ 3.64Å; F230-F278 HydrophobicContact CE1-CZ 3.64Å; F230-F278 HydrophobicContact CZ-CZ 4.27Å; L235-F278 HydrophobicContact CD1-CD1 4.41Å; L235-F278 HydrophobicContact CD1-CE1 4.27Å; E274-F278 WeakPolarHBondContact O-CB 3.43Å; E274-F278 PolarHBondContact O-N 2.99Å; L275-F278 PolarHBondContact O-N 2.86Å; F278-L282 HydrophobicContact CD2-CD1 4.5Å; F278-L282 WeakPolarHBondContact O-CB 3.45Å; F278-L282 PolarHBondContact O-N 3.3Å; F278-M283 HydrophobicContact CD1-CG 4.26Å; F278-M283 HydrophobicContact CD2-CE 4.45Å; F278-M283 HydrophobicContact CD2-CG 4.42Å; F278-M283 HydrophobicContact CE1-CG 3.82Å; F278-M283 HydrophobicContact CE1-SD 4.43Å; F278-M283 HydrophobicContact CE2-CE 3.67Å; F278-M283 HydrophobicContact CE2-CG 3.99Å; F278-M283 HydrophobicContact CE2-SD 4.08Å; F278-M283 HydrophobicContact CZ-CE 3.98Å; F278-M283 HydrophobicContact CZ-CG 3.67Å; F278-M283 HydrophobicContact CZ-SD 3.76Å; F278-M283 WeakPolarHBondContact O-CB 3.24Å; F278-M283 WeakPolarHBondContact O-CG 3.48Å; F278-M283 PolarHBondContact O-N 3.27Å; F278-H322 HydrophobicContact CD2-CB 4.21Å; F278-H322 AromaticContact CE1-CD2 3.79Å; F278-H322 HydrophobicContact CE2-CB 3.59Å; F278-H322 HydrophobicContact CZ-CB 3.84Å; F278-H322 AromaticContact CZ-CD2 3.51Å; F278-H322 AromaticContact CZ-CG 3.95Å
279	T	89.2	Confident	90.6	Very high	25 Å²	25	20.8 Å²	20.8	15%	0.153	11%	0.105	C	C	.	.	I	π-helix	trans	-75.5	-42.1	-171.3	-60.5	0	0	0	0	112.3	L275	L275-T279 WeakPolarHBondContact O-CB 3.09Å; L275-T279 PolarHBondContact O-N 2.94Å; L275-T279 PolarHBondContact O-OG1 3.03Å
280	D	88.2	Confident	90.6	Very high	12 Å²	12	15.3 Å²	15.3	6%	0.064	8%	0.08	C	C	.	.	I	π-helix	trans	-96.8	-13	-169.2	-52.7	-32.7	0	0	0	113.7	R239 T276 V284 R401	R239-D280 IonicContact CZ-OD1 3.49Å; R239-D280 IonicContact NE-OD1 3Å; R239-D280 IonicContact NH2-OD1 3.96Å; R239-D280 PolarHBondContact NH2-OD1 2.95Å; T276-D280 HydrophobicContact CG2-CB 4.33Å; T276-D280 WeakPolarHBondContact O-CA 3.47Å; T276-D280 WeakPolarHBondContact O-CB 3.35Å; T276-D280 PolarHBondContact O-N 3.35Å; D280-V284 VanDerWaalsContact O-CG2 3.29Å; D280-V284 WeakPolarHBondContact O-CG2 3.14Å; D280-R401 IonicContact OD1-CZ 3.06Å; D280-R401 IonicContact OD1-NH1 2.87Å; D280-R401 IonicContact OD1-NH2 3Å; D280-R401 PolarHBondContact OD1-NH2 3.36Å; D280-R401 IonicContact OD2-CZ 2.71Å; D280-R401 IonicContact OD2-NH1 3.29Å; D280-R401 PolarHBondContact OD2-NH1 2.87Å; D280-R401 IonicContact OD2-NH2 2.71Å; D280-R401 PolarHBondContact OD2-NH2 3.3Å
281	H	92.1	Very high	90.5	Very high	48 Å²	48	18 Å²	18	22%	0.222	9%	0.093	C	C	.	.	I	π-helix	trans	-117.6	-60.3	172.6	-50	134.5	0	0	0	112.6	F277 V284 L285 L408 A411	F277-H281 HydrophobicContact CD2-CB 4.25Å; F277-H281 AromaticContact CD2-ND1 3.99Å; F277-H281 WeakPolarHBondContact O-CB 3.47Å; F277-H281 PolarHBondContact O-N 3.14Å; H281-V284 PolarHBondContact O-N 3.25Å; H281-L285 VanDerWaalsContact O-CB 3.25Å; H281-L285 WeakPolarHBondContact O-CB 3.39Å; H281-L285 PolarHBondContact O-N 2.93Å; H281-L408 HydrophobicContact CB-CD2 4.41Å; H281-A411 HydrophobicContact CB-CB 3.88Å
282	L	93.1	Very high	90.5	Very high	1 Å²	1	18.3 Å²	18.3	1%	0.005	10%	0.095	C	C	.	.	I	π-helix	trans	-67.2	-48.2	-174	-64	-177.1	0	0	0	112.9	F277 F278 V284 L285 K286 L314 L317 P412	F277-L282 HydrophobicContact CD1-CD1 4.13Å; F277-L282 HydrophobicContact CD1-CG 4.45Å; F277-L282 HydrophobicContact CD2-CG 4.32Å; F277-L282 HydrophobicContact CE1-CD1 3.55Å; F277-L282 HydrophobicContact CE1-CD2 4.39Å; F277-L282 HydrophobicContact CE1-CG 4.01Å; F277-L282 HydrophobicContact CE2-CD1 4.29Å; F277-L282 HydrophobicContact CE2-CD2 3.76Å; F277-L282 HydrophobicContact CE2-CG 3.83Å; F277-L282 HydrophobicContact CZ-CD1 3.65Å; F277-L282 HydrophobicContact CZ-CD2 3.62Å; F277-L282 HydrophobicContact CZ-CG 3.69Å; F277-L282 PolarHBondContact O-N 3.48Å; F278-L282 HydrophobicContact CD2-CD1 4.5Å; F278-L282 WeakPolarHBondContact O-CB 3.45Å; F278-L282 PolarHBondContact O-N 3.3Å; L282-V284 VanDerWaalsContact C-N 3.34Å; L282-L285 PolarHBondContact O-N 3.27Å; L282-K286 WeakPolarHBondContact O-CB 3.36Å; L282-K286 PolarHBondContact O-N 3.48Å; L282-L314 HydrophobicContact CD2-CD1 3.58Å; L282-L317 HydrophobicContact CD1-CB 4.34Å; L282-L317 HydrophobicContact CD2-CB 4.32Å; L282-P412 HydrophobicContact CD2-CG 4.06Å
283	M	90.3	Very high	90.5	Very high	14 Å²	14	14.9 Å²	14.9	7%	0.069	8%	0.08	C	C	.	.	H	α-helix	trans	-70.3	-29.2	178	-70.1	-60.7	97.4	0	0	112.5	F230 F278 K286 N287 C318	F230-M283 HydrophobicContact CB-SD 3.72Å; F230-M283 HydrophobicContact CD1-CG 4.17Å; F230-M283 HydrophobicContact CD1-SD 3.6Å; F230-M283 HydrophobicContact CD2-SD 4.36Å; F230-M283 HydrophobicContact CE1-SD 4.3Å; F230-M283 HydrophobicContact CG-SD 3.63Å; F278-M283 HydrophobicContact CD1-CG 4.26Å; F278-M283 HydrophobicContact CD2-CE 4.45Å; F278-M283 HydrophobicContact CD2-CG 4.42Å; F278-M283 HydrophobicContact CE1-CG 3.82Å; F278-M283 HydrophobicContact CE1-SD 4.43Å; F278-M283 HydrophobicContact CE2-CE 3.67Å; F278-M283 HydrophobicContact CE2-CG 3.99Å; F278-M283 HydrophobicContact CE2-SD 4.08Å; F278-M283 HydrophobicContact CZ-CE 3.98Å; F278-M283 HydrophobicContact CZ-CG 3.67Å; F278-M283 HydrophobicContact CZ-SD 3.76Å; F278-M283 WeakPolarHBondContact O-CB 3.24Å; F278-M283 WeakPolarHBondContact O-CG 3.48Å; F278-M283 PolarHBondContact O-N 3.27Å; M283-K286 HydrophobicContact CE-CB 4.5Å; M283-K286 HydrophobicContact CE-CD 4.15Å; M283-N287 WeakPolarHBondContact O-CB 3.49Å; M283-N287 PolarHBondContact O-N 3.21Å; M283-N287 PolarHBondContact O-ND2 3.49Å; M283-C318 HydrophobicContact CE-CB 3.7Å; M283-C318 WeakPolarHBondContact CE-SG 3.19Å
284	V	90.9	Very high	90.4	Very high	6 Å²	6	17.3 Å²	17.3	4%	0.036	9%	0.086	C	C	.	.	H	α-helix	trans	-66.2	-52.5	169.9	173.9	0	0	0	0	110.3	D280 H281 L282 K286 N287 C288 R399 C400 L408	D280-V284 VanDerWaalsContact O-CG2 3.29Å; D280-V284 WeakPolarHBondContact O-CG2 3.14Å; H281-V284 PolarHBondContact O-N 3.25Å; L282-V284 VanDerWaalsContact C-N 3.34Å; V284-K286 VanDerWaalsContact C-N 3.27Å; V284-K286 PolarHBondContact O-N 3.31Å; V284-N287 PolarHBondContact O-N 3.08Å; V284-C288 HydrophobicContact CG1-CB 4.4Å; V284-C288 WeakPolarHBondContact O-CA 3.33Å; V284-C288 WeakPolarHBondContact O-CB 3.36Å; V284-C288 PolarHBondContact O-N 2.88Å; V284-C288 PolarHBondContact O-SG 2.87Å; V284-C288 VanDerWaalsContact O-SG 3.36Å; V284-R399 HydrophobicContact CG2-CB 4.33Å; V284-R399 WeakPolarHBondContact CG2-O 3.22Å; V284-C400 HydrophobicContact CG1-CB 4.29Å; V284-C400 VanDerWaalsContact CG1-SG 3.59Å; V284-L408 HydrophobicContact CB-CD2 4.48Å; V284-L408 HydrophobicContact CG1-CD1 3.77Å; V284-L408 HydrophobicContact CG1-CD2 4.16Å
285	L	91.8	Very high	90.2	Very high	1 Å²	1	21.3 Å²	21.3	1%	0.005	10%	0.104	C	C	.	.	I	π-helix	trans	-59.8	-37.9	180	-172.6	63.1	0	0	0	111.9	H281 L282 F289 M290 F311 L314 L405 L408 L409	H281-L285 VanDerWaalsContact O-CB 3.25Å; H281-L285 WeakPolarHBondContact O-CB 3.39Å; H281-L285 PolarHBondContact O-N 2.93Å; L282-L285 PolarHBondContact O-N 3.27Å; L285-F289 HydrophobicContact CD1-CD2 4.42Å; L285-F289 WeakPolarHBondContact O-CB 3.34Å; L285-F289 PolarHBondContact O-N 3.13Å; L285-M290 PolarHBondContact O-N 2.98Å; L285-M290 VanDerWaalsContact O-N 3.08Å; L285-F311 HydrophobicContact CD1-CD1 3.87Å; L285-F311 HydrophobicContact CD1-CE1 3.65Å; L285-F311 HydrophobicContact CD2-CD1 4.35Å; L285-F311 HydrophobicContact CG-CD1 3.93Å; L285-F311 HydrophobicContact CG-CE1 4.14Å; L285-L314 HydrophobicContact CB-CD2 4.06Å; L285-L314 HydrophobicContact CD2-CD1 4.02Å; L285-L314 HydrophobicContact CD2-CD2 3.75Å; L285-L314 HydrophobicContact CG-CD2 3.68Å; L285-L405 HydrophobicContact CD1-CD1 3.54Å; L285-L408 HydrophobicContact CD1-CB 4.03Å; L285-L409 HydrophobicContact CD1-CD2 4.27Å; L285-L409 HydrophobicContact CD1-CG 4.48Å; L285-L409 HydrophobicContact CD2-CD2 4.14Å
286	K	90.7	Very high	89.9	Confident	41 Å²	41	21 Å²	21	18%	0.178	10%	0.102	C	C	.	.	I	π-helix	trans	-72	-55.5	175.1	-176.6	170.3	171	159.9	0	112.9	L282 M283 V284 M290 E291 L314 D315	L282-K286 WeakPolarHBondContact O-CB 3.36Å; L282-K286 PolarHBondContact O-N 3.48Å; M283-K286 HydrophobicContact CE-CB 4.5Å; M283-K286 HydrophobicContact CE-CD 4.15Å; V284-K286 VanDerWaalsContact C-N 3.27Å; V284-K286 PolarHBondContact O-N 3.31Å; K286-M290 WeakPolarHBondContact O-CB 3.33Å; K286-M290 PolarHBondContact O-N 2.83Å; K286-M290 VanDerWaalsContact O-N 3.15Å; K286-E291 WeakPolarHBondContact CE-OE1 3.36Å; K286-E291 HydrophobicContact CG-CG 4.17Å; K286-E291 IonicContact NZ-OE1 3.27Å; K286-E291 PolarHBondContact O-N 3.26Å; K286-L314 HydrophobicContact CB-CD2 4.2Å; K286-D315 IonicContact NZ-OD1 3.88Å; K286-D315 PolarHBondContact NZ-OD1 3.41Å
287	N	88.7	Confident	89.8	Confident	6 Å²	6	20.3 Å²	20.3	3%	0.032	10%	0.095	C	C	.	.	I	π-helix	trans	-88.3	-18.6	-165.8	-52.4	-27	0	0	0	113.7	F230 M283 V284 P292	F230-N287 VanDerWaalsContact CB-ND2 3.29Å; F230-N287 WeakPolarHBondContact CB-ND2 3.45Å; F230-N287 PolarHBondContact N-ND2 2.99Å; M283-N287 WeakPolarHBondContact O-CB 3.49Å; M283-N287 PolarHBondContact O-N 3.21Å; M283-N287 PolarHBondContact O-ND2 3.49Å; V284-N287 PolarHBondContact O-N 3.08Å; N287-P292 WeakPolarHBondContact O-CD 3.5Å; N287-P292 WeakPolarHBondContact O-CG 3.41Å
288	C	88.2	Confident	89.5	Confident	1 Å²	1	26.3 Å²	26.3	1%	0.007	13%	0.132	C	C	.	.	I	π-helix	trans	-99.4	-27.8	176.5	-47.5	0	0	0	0	112.4	V284 P292 C394 R399	V284-C288 HydrophobicContact CG1-CB 4.4Å; V284-C288 WeakPolarHBondContact O-CA 3.33Å; V284-C288 WeakPolarHBondContact O-CB 3.36Å; V284-C288 PolarHBondContact O-N 2.88Å; V284-C288 PolarHBondContact O-SG 2.87Å; V284-C288 VanDerWaalsContact O-SG 3.36Å; C288-P292 WeakPolarHBondContact O-CG 3.29Å; C288-C394 PolarHBondContact O-SG 2.8Å; C288-R399 PolarHBondContact SG-NH2 3.1Å; C288-R399 VanDerWaalsContact SG-NH2 3.39Å
289	F	89.7	Confident	89	Confident	1 Å²	1	30.1 Å²	30.1	0%	0.004	15%	0.152	C	C	.	.	I	π-helix	trans	-115.6	-61.6	179.8	-58.5	-101.2	0	0	0	112.7	L285 E291 L293 F311 C394 E395 L405 L408	L285-F289 HydrophobicContact CD1-CD2 4.42Å; L285-F289 WeakPolarHBondContact O-CB 3.34Å; L285-F289 PolarHBondContact O-N 3.13Å; F289-E291 PolarHBondContact O-N 2.79Å; F289-L293 VanDerWaalsContact O-CB 3.23Å; F289-L293 WeakPolarHBondContact O-CB 3.46Å; F289-L293 PolarHBondContact O-N 3.3Å; F289-F311 HydrophobicContact CB-CE1 3.98Å; F289-F311 HydrophobicContact CB-CZ 3.8Å; F289-C394 HydrophobicContact CD1-CB 3.43Å; F289-C394 VanDerWaalsContact CD1-CB 3.43Å; F289-C394 HydrophobicContact CD2-CB 4.44Å; F289-C394 HydrophobicContact CE1-CB 3.28Å; F289-C394 HydrophobicContact CE2-CB 4.31Å; F289-C394 HydrophobicContact CG-CB 4.04Å; F289-C394 HydrophobicContact CZ-CB 3.76Å; F289-E395 HydrophobicContact CZ-CG 4.34Å; F289-L405 HydrophobicContact CD1-CB 4.46Å; F289-L405 HydrophobicContact CD1-CD1 3.8Å; F289-L405 HydrophobicContact CD1-CD2 4.17Å; F289-L405 HydrophobicContact CD1-CG 4.37Å; F289-L405 HydrophobicContact CD2-CD1 4.48Å; F289-L405 HydrophobicContact CE1-CB 3.87Å; F289-L405 HydrophobicContact CE1-CD1 3.99Å; F289-L405 HydrophobicContact CE1-CD2 4.31Å; F289-L405 HydrophobicContact CE1-CG 4.27Å; F289-L405 HydrophobicContact CG-CD1 4.07Å; F289-L405 HydrophobicContact CZ-CB 4.27Å; F289-L405 HydrophobicContact CZ-CD1 4.43Å; F289-L408 HydrophobicContact CD2-CD1 4.29Å; F289-L408 HydrophobicContact CE2-CD1 3.49Å; F289-L408 VanDerWaalsContact CE2-CD1 3.49Å; F289-L408 HydrophobicContact CZ-CD1 4.08Å
290	M	89.6	Confident	88.8	Confident	0 Å²	0	30.2 Å²	30.2	0%	0	16%	0.158	C	C	.	.	I	π-helix	trans	-64	-45.5	-170.5	-167.7	-141.7	-88.2	0	0	113.7	L285 K286 K294 F311 L314	L285-M290 PolarHBondContact O-N 2.98Å; L285-M290 VanDerWaalsContact O-N 3.08Å; K286-M290 WeakPolarHBondContact O-CB 3.33Å; K286-M290 PolarHBondContact O-N 2.83Å; K286-M290 VanDerWaalsContact O-N 3.15Å; M290-K294 HydrophobicContact CG-CD 4.33Å; M290-K294 WeakPolarHBondContact O-CG 3.3Å; M290-K294 PolarHBondContact O-N 3.26Å; M290-K294 HydrophobicContact SD-CD 4.16Å; M290-K294 WeakPolarHBondContact SD-CE 3.36Å; M290-K294 PolarHBondContact SD-NZ 3.01Å; M290-F311 HydrophobicContact CB-CD2 3.91Å; M290-F311 HydrophobicContact CB-CE2 3.86Å; M290-F311 HydrophobicContact CB-CG 4.32Å; M290-F311 HydrophobicContact CB-CZ 4.23Å; M290-F311 HydrophobicContact CE-CB 4.14Å; M290-F311 HydrophobicContact CG-CD2 3.64Å; M290-F311 HydrophobicContact CG-CE2 3.94Å; M290-F311 HydrophobicContact CG-CG 4.26Å; M290-L314 HydrophobicContact CE-CB 3.83Å; M290-L314 HydrophobicContact CE-CD2 3.99Å; M290-L314 HydrophobicContact CE-CG 4.25Å
291	E	89.5	Confident	88.5	Confident	57 Å²	57	31.7 Å²	31.7	27%	0.266	16%	0.163	S	C	.	.	H	α-helix	trans	-74.9	-43	-178	-67.7	-175	169.7	0	0	113.1	S228 K286 F289 L293 K294 K295	S228-E291 VanDerWaalsContact CB-OE2 3.27Å; S228-E291 WeakPolarHBondContact CB-OE2 3.29Å; S228-E291 PolarHBondContact OG-OE2 2.71Å; K286-E291 WeakPolarHBondContact CE-OE1 3.36Å; K286-E291 HydrophobicContact CG-CG 4.17Å; K286-E291 IonicContact NZ-OE1 3.27Å; K286-E291 PolarHBondContact O-N 3.26Å; F289-E291 PolarHBondContact O-N 2.79Å; E291-L293 VanDerWaalsContact C-N 3.32Å; E291-L293 PolarHBondContact O-N 2.62Å; E291-K294 PolarHBondContact O-N 2.87Å; E291-K295 WeakPolarHBondContact O-CB 3.29Å; E291-K295 PolarHBondContact O-N 3.24Å
292	P	88.5	Confident	88.2	Confident	7 Å²	7	29.8 Å²	29.8	5%	0.045	15%	0.154	C	C	.	.	H	α-helix	trans	-52.8	-44.6	166.4	-35.2	43.3	0	0	0	113.8	L225 N287 C288 K295 L296 F390 W393	L225-P292 HydrophobicContact CD2-CB 3.71Å; N287-P292 WeakPolarHBondContact O-CD 3.5Å; N287-P292 WeakPolarHBondContact O-CG 3.41Å; C288-P292 WeakPolarHBondContact O-CG 3.29Å; P292-K295 PolarHBondContact O-N 3.2Å; P292-L296 WeakPolarHBondContact O-CG 3.4Å; P292-L296 PolarHBondContact O-N 3.28Å; P292-F390 HydrophobicContact CB-CE2 4.13Å; P292-W393 HydrophobicContact CB-CZ3 4.26Å
293	L	89.7	Confident	87.8	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-59.9	-51.3	175	178.5	66.4	0	0	0	111.9	F289 E291 K295 L296 Q297 L302 V305 P307 F311 F390	F289-L293 VanDerWaalsContact O-CB 3.23Å; F289-L293 WeakPolarHBondContact O-CB 3.46Å; F289-L293 PolarHBondContact O-N 3.3Å; E291-L293 VanDerWaalsContact C-N 3.32Å; E291-L293 PolarHBondContact O-N 2.62Å; L293-K295 PolarHBondContact O-N 2.98Å; L293-L296 PolarHBondContact O-N 3.3Å; L293-Q297 VanDerWaalsContact O-CG 3.29Å; L293-Q297 WeakPolarHBondContact O-CG 3.4Å; L293-Q297 PolarHBondContact O-N 2.96Å; L293-L302 HydrophobicContact CD1-CB 3.77Å; L293-L302 HydrophobicContact CD1-CD1 3.64Å; L293-L302 HydrophobicContact CD1-CG 4.36Å; L293-V305 HydrophobicContact CD1-CB 4.08Å; L293-V305 HydrophobicContact CD1-CG1 4.22Å; L293-V305 HydrophobicContact CD1-CG2 4.2Å; L293-V305 HydrophobicContact CD2-CB 4.26Å; L293-V305 HydrophobicContact CD2-CG1 3.62Å; L293-P307 HydrophobicContact CD2-CB 4.34Å; L293-P307 HydrophobicContact CD2-CG 3.92Å; L293-F311 HydrophobicContact CD2-CE2 3.98Å; L293-F390 HydrophobicContact CB-CE1 4.33Å; L293-F390 HydrophobicContact CB-CE2 4.37Å; L293-F390 HydrophobicContact CB-CZ 3.74Å; L293-F390 HydrophobicContact CD1-CE1 4.33Å; L293-F390 HydrophobicContact CD1-CZ 4.37Å
294	K	88.8	Confident	87.7	Confident	80 Å²	80	40.1 Å²	40.1	35%	0.348	20%	0.203	S	C	.	.	H	α-helix	trans	-57.5	-36	178.2	-77.4	171.2	173.7	176.6	0	112.1	M290 E291 V298 P307	M290-K294 HydrophobicContact CG-CD 4.33Å; M290-K294 WeakPolarHBondContact O-CG 3.3Å; M290-K294 PolarHBondContact O-N 3.26Å; M290-K294 HydrophobicContact SD-CD 4.16Å; M290-K294 WeakPolarHBondContact SD-CE 3.36Å; M290-K294 PolarHBondContact SD-NZ 3.01Å; E291-K294 PolarHBondContact O-N 2.87Å; K294-V298 PolarHBondContact O-N 3.01Å; K294-P307 HydrophobicContact CG-CG 4.33Å
295	K	86.9	Confident	87.5	Confident	84 Å²	84	40.1 Å²	40.1	37%	0.365	20%	0.203	S	C	.	.	H	α-helix	trans	-70.1	-49.5	177.4	-172.7	176.4	167.3	-168	0	111.9	L225 E291 P292 L293 Q297 V298 D299	L225-K295 HydrophobicContact CD1-CB 4.38Å; L225-K295 HydrophobicContact CD1-CD 3.62Å; L225-K295 HydrophobicContact CD1-CG 3.9Å; L225-K295 HydrophobicContact CG-CD 4.07Å; E291-K295 WeakPolarHBondContact O-CB 3.29Å; E291-K295 PolarHBondContact O-N 3.24Å; P292-K295 PolarHBondContact O-N 3.2Å; L293-K295 PolarHBondContact O-N 2.98Å; K295-Q297 PolarHBondContact O-N 2.85Å; K295-Q297 VanDerWaalsContact O-N 3.14Å; K295-V298 WeakPolarHBondContact O-CB 3.5Å; K295-V298 PolarHBondContact O-N 3.28Å; K295-D299 PolarHBondContact O-N 2.96Å
296	L	86.4	Confident	87.5	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-56.1	-30.6	174.1	-73	161.9	0	0	0	112.7	L218 A221 L222 L225 P292 L293 D299 G300 Y301 L302 F390	L218-L296 HydrophobicContact CD1-CD2 4.11Å; A221-L296 HydrophobicContact CB-CD2 4.17Å; L222-L296 HydrophobicContact CD2-CD1 3.71Å; L222-L296 HydrophobicContact CD2-CD2 4.29Å; L225-L296 HydrophobicContact CD1-CD2 4.17Å; L225-L296 HydrophobicContact CD1-CG 4.21Å; L225-L296 HydrophobicContact CD2-CD1 4.15Å; L225-L296 HydrophobicContact CD2-CD2 4.48Å; L225-L296 HydrophobicContact CD2-CG 4.04Å; P292-L296 WeakPolarHBondContact O-CG 3.4Å; P292-L296 PolarHBondContact O-N 3.28Å; L293-L296 PolarHBondContact O-N 3.3Å; L296-D299 CarbonylContact O-C 3.5Å; L296-D299 PolarHBondContact O-N 3.26Å; L296-G300 PolarHBondContact O-N 3.01Å; L296-Y301 CarbonylContact C-O 3.48Å; L296-Y301 PolarHBondContact O-N 2.93Å; L296-L302 HydrophobicContact CD1-CD1 3.97Å; L296-F390 HydrophobicContact CD1-CD2 3.49Å; L296-F390 VanDerWaalsContact CD1-CD2 3.49Å; L296-F390 HydrophobicContact CD1-CE2 3.65Å
297	Q	88	Confident	87.4	Confident	37 Å²	37	42.5 Å²	42.5	17%	0.173	22%	0.216	C	C	.	.	H	α-helix	trans	-72.2	-31.3	175.3	-72.7	176	-20.2	0	0	114	L293 K295 D299 G300 Y301 L302 V305	L293-Q297 VanDerWaalsContact O-CG 3.29Å; L293-Q297 WeakPolarHBondContact O-CG 3.4Å; L293-Q297 PolarHBondContact O-N 2.96Å; K295-Q297 PolarHBondContact O-N 2.85Å; K295-Q297 VanDerWaalsContact O-N 3.14Å; Q297-D299 VanDerWaalsContact C-N 3.3Å; Q297-G300 PolarHBondContact O-N 3.28Å; Q297-Y301 WeakPolarHBondContact CA-O 3.42Å; Q297-Y301 WeakPolarHBondContact CG-O 3.47Å; Q297-L302 PolarHBondContact NE2-O 2.94Å; Q297-V305 PolarHBondContact NE2-O 2.76Å
298	V	86.4	Confident	87.4	Confident	128 Å²	128	47 Å²	47	78%	0.776	24%	0.237	S	C	*	.	H	α-helix	trans	-66.5	-37.3	168.2	176.5	0	0	0	0	110.3	K294 K295 G300	K294-V298 PolarHBondContact O-N 3.01Å; K295-V298 WeakPolarHBondContact O-CB 3.5Å; K295-V298 PolarHBondContact O-N 3.28Å; V298-G300 PolarHBondContact O-N 2.86Å
299	D	83.2	Confident	87.5	Confident	84 Å²	84	52.7 Å²	52.7	45%	0.449	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	1.9	176.6	-58.4	-39.4	0	0	0	113.6	K295 L296 Q297 Y301	K295-D299 PolarHBondContact O-N 2.96Å; L296-D299 CarbonylContact O-C 3.5Å; L296-D299 PolarHBondContact O-N 3.26Å; Q297-D299 VanDerWaalsContact C-N 3.3Å; D299-Y301 HydrophobicContact CB-CD2 4.03Å; D299-Y301 HydrophobicContact CB-CE2 4.32Å; D299-Y301 WeakPolarHBondContact O-CD2 3.48Å; D299-Y301 WeakPolarHBondContact O-CE2 3.38Å
300	G	83	Confident	87.6	Confident	27 Å²	27	52.7 Å²	52.7	28%	0.278	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.1	19.5	174.5	0	0	0	0	0	115.6	R214 L296 Q297 V298	R214-G300 PolarHBondContact NH2-O 3.24Å; L296-G300 PolarHBondContact O-N 3.01Å; Q297-G300 PolarHBondContact O-N 3.28Å; V298-G300 PolarHBondContact O-N 2.86Å
301	Y	83.3	Confident	87.7	Confident	43 Å²	43	52.8 Å²	52.8	17%	0.169	26%	0.264	C	S	.	.	S	Bend	trans	-106.4	159.8	172.2	-60.2	-87.9	0	0	0	111	R214 D217 L218 A221 L296 Q297 D299 M303	R214-Y301 VanDerWaalsContact NH2-CD1 3.28Å; D217-Y301 HydrophobicContact CB-CE1 4.34Å; D217-Y301 WeakPolarHBondContact CB-OH 3.5Å; D217-Y301 PolarHBondContact O-OH 2.64Å; L218-Y301 HydrophobicContact CB-CD1 4.07Å; L218-Y301 HydrophobicContact CB-CE1 4.13Å; L218-Y301 HydrophobicContact CD1-CD1 3.87Å; L218-Y301 HydrophobicContact CD1-CG 3.97Å; L218-Y301 HydrophobicContact CG-CD1 4.49Å; A221-Y301 HydrophobicContact CB-CD2 4.44Å; A221-Y301 HydrophobicContact CB-CE2 4.08Å; L296-Y301 CarbonylContact C-O 3.48Å; L296-Y301 PolarHBondContact O-N 2.93Å; Q297-Y301 WeakPolarHBondContact CA-O 3.42Å; Q297-Y301 WeakPolarHBondContact CG-O 3.47Å; D299-Y301 HydrophobicContact CB-CD2 4.03Å; D299-Y301 HydrophobicContact CB-CE2 4.32Å; D299-Y301 WeakPolarHBondContact O-CD2 3.48Å; D299-Y301 WeakPolarHBondContact O-CE2 3.38Å; Y301-M303 PolarHBondContact O-N 3.03Å
302	L	85.1	Confident	87.7	Confident	7 Å²	7	51 Å²	51	4%	0.037	26%	0.26	C	S	.	.	S	Bend	trans	51	24.3	175.1	-55.1	177.7	0	0	0	115.6	L293 L296 Q297 F304 V305 H386 F390	L293-L302 HydrophobicContact CD1-CB 3.77Å; L293-L302 HydrophobicContact CD1-CD1 3.64Å; L293-L302 HydrophobicContact CD1-CG 4.36Å; L296-L302 HydrophobicContact CD1-CD1 3.97Å; Q297-L302 PolarHBondContact NE2-O 2.94Å; L302-F304 HydrophobicContact CD2-CE1 4.06Å; L302-F304 HydrophobicContact CD2-CE2 4.41Å; L302-F304 HydrophobicContact CD2-CZ 3.59Å; L302-F304 PolarHBondContact O-N 3.27Å; L302-V305 HydrophobicContact CB-CG2 4.09Å; L302-V305 WeakPolarHBondContact O-CB 3.32Å; L302-V305 WeakPolarHBondContact O-CG2 3.48Å; L302-V305 PolarHBondContact O-N 3.41Å; L302-H386 HydrophobicContact CD2-CB 4.22Å; L302-F390 HydrophobicContact CD1-CB 3.79Å; L302-F390 HydrophobicContact CD1-CD1 4.05Å; L302-F390 HydrophobicContact CD1-CD2 3.82Å; L302-F390 HydrophobicContact CD1-CE2 4.44Å; L302-F390 HydrophobicContact CD1-CG 3.6Å
303	M	86.1	Confident	87.9	Confident	141 Å²	141	51.6 Å²	51.6	70%	0.695	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-5	-178.7	-59	-170.7	79.8	0	0	114.4	Y301	Y301-M303 PolarHBondContact O-N 3.03Å
304	F	86.9	Confident	88.1	Confident	92 Å²	92	51.6 Å²	51.6	40%	0.404	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.4	-12.1	171.6	57.5	-100	0	0	0	113.1	L302 Y377 L381 L384 F387	L302-F304 HydrophobicContact CD2-CE1 4.06Å; L302-F304 HydrophobicContact CD2-CE2 4.41Å; L302-F304 HydrophobicContact CD2-CZ 3.59Å; L302-F304 PolarHBondContact O-N 3.27Å; F304-Y377 PolarHBondContact O-OH 3.2Å; F304-Y377 VanDerWaalsContact O-OH 3.08Å; F304-L381 HydrophobicContact CD2-CD2 3.91Å; F304-L381 HydrophobicContact CE2-CD2 4.03Å; F304-L384 HydrophobicContact CD2-CD1 3.59Å; F304-L384 HydrophobicContact CE2-CB 4.48Å; F304-L384 HydrophobicContact CE2-CD1 3.39Å; F304-L384 HydrophobicContact CG-CD1 4.3Å; F304-L384 HydrophobicContact CZ-CB 4.46Å; F304-L384 HydrophobicContact CZ-CD1 3.94Å; F304-F387 HydrophobicContact CE2-CB 4.42Å
305	V	87.7	Confident	88.2	Confident	5 Å²	5	50.8 Å²	50.8	3%	0.03	26%	0.263	C	S	.	.			trans	-86.7	128.9	175.2	-170.1	0	0	0	0	108.6	L293 Q297 L302 P307 Y377 L381 F387	L293-V305 HydrophobicContact CD1-CB 4.08Å; L293-V305 HydrophobicContact CD1-CG1 4.22Å; L293-V305 HydrophobicContact CD1-CG2 4.2Å; L293-V305 HydrophobicContact CD2-CB 4.26Å; L293-V305 HydrophobicContact CD2-CG1 3.62Å; Q297-V305 PolarHBondContact NE2-O 2.76Å; L302-V305 HydrophobicContact CB-CG2 4.09Å; L302-V305 WeakPolarHBondContact O-CB 3.32Å; L302-V305 WeakPolarHBondContact O-CG2 3.48Å; L302-V305 PolarHBondContact O-N 3.41Å; V305-P307 WeakPolarHBondContact O-CD 3.41Å; V305-Y377 WeakPolarHBondContact CA-OH 3.23Å; V305-L381 HydrophobicContact CG1-CD1 3.82Å; V305-L381 HydrophobicContact CG2-CD1 4.34Å; V305-L381 HydrophobicContact CG2-CD2 4.08Å; V305-F387 HydrophobicContact CG1-CE2 4.42Å; V305-F387 HydrophobicContact CG2-CD2 3.85Å; V305-F387 HydrophobicContact CG2-CE2 4.2Å
306	E	91	Very high	88.6	Confident	85 Å²	85	50.3 Å²	50.3	40%	0.397	26%	0.264	S	S	.	.			trans	-104.1	106	171.9	176.1	46.6	-108.2	0	0	108.9	M308 H309 L310 Y377	E306-M308 HydrophobicContact CG-CB 4.43Å; E306-M308 PolarHBondContact O-N 3.09Å; E306-M308 VanDerWaalsContact O-N 3.09Å; E306-M308 WeakPolarHBondContact OE1-CG 3.36Å; E306-M308 PolarHBondContact OE1-N 3.46Å; E306-M308 VanDerWaalsContact OE1-N 3.11Å; E306-H309 WeakPolarHBondContact CG-ND1 3.3Å; E306-H309 PolarHBondContact O-N 3.09Å; E306-L310 PolarHBondContact O-N 2.96Å; E306-Y377 PolarHBondContact N-OH 3.02Å
307	P	89	Confident	88.9	Confident	8 Å²	8	50.3 Å²	50.3	5%	0.052	26%	0.264	C	S	.	.	H	α-helix	trans	-55.7	-30.2	-174.8	-26.1	34.2	0	0	0	113.9	L293 K294 V305 H309 L310 F311	L293-P307 HydrophobicContact CD2-CB 4.34Å; L293-P307 HydrophobicContact CD2-CG 3.92Å; K294-P307 HydrophobicContact CG-CG 4.33Å; V305-P307 WeakPolarHBondContact O-CD 3.41Å; P307-H309 VanDerWaalsContact C-N 3.33Å; P307-H309 PolarHBondContact O-N 3.4Å; P307-L310 PolarHBondContact O-N 2.98Å; P307-F311 HydrophobicContact CB-CD2 4.23Å; P307-F311 WeakPolarHBondContact O-CD2 3.34Å; P307-F311 PolarHBondContact O-N 3.45Å
308	M	89.3	Confident	89.1	Confident	99 Å²	99	49 Å²	49	49%	0.488	26%	0.259	S	S	.	.	H	α-helix	trans	-68.6	-28.5	178.2	-61.2	-71.8	82.2	0	0	113.3	E306 G312	E306-M308 HydrophobicContact CG-CB 4.43Å; E306-M308 PolarHBondContact O-N 3.09Å; E306-M308 VanDerWaalsContact O-N 3.09Å; E306-M308 WeakPolarHBondContact OE1-CG 3.36Å; E306-M308 PolarHBondContact OE1-N 3.46Å; E306-M308 VanDerWaalsContact OE1-N 3.11Å; M308-G312 VanDerWaalsContact O-CA 3.3Å; M308-G312 WeakPolarHBondContact O-CA 3.47Å; M308-G312 PolarHBondContact O-N 2.85Å; M308-G312 VanDerWaalsContact O-N 3.14Å
309	H	89.6	Confident	89.4	Confident	122 Å²	122	48.9 Å²	48.9	57%	0.565	25%	0.246	S	C	*	.	H	α-helix	trans	-80.7	-26.9	176.3	-71.4	99.3	0	0	0	112.8	E306 P307 A374 Y377	E306-H309 WeakPolarHBondContact CG-ND1 3.3Å; E306-H309 PolarHBondContact O-N 3.09Å; P307-H309 VanDerWaalsContact C-N 3.33Å; P307-H309 PolarHBondContact O-N 3.4Å; H309-A374 WeakPolarHBondContact O-CA 3.35Å; H309-A374 WeakPolarHBondContact O-CB 3.24Å; H309-Y377 HydrophobicContact CB-CD1 3.66Å; H309-Y377 HydrophobicContact CB-CE1 3.74Å; H309-Y377 HydrophobicContact CB-CG 4.3Å
310	L	91	Very high	89.9	Confident	1 Å²	1	44.9 Å²	44.9	1%	0.005	22%	0.224	C	C	.	.	H	α-helix	trans	-88.5	-38.6	-179.8	-175.8	59.2	0	0	0	113.1	E306 P307 Y377 L378 L381 F387 L409	E306-L310 PolarHBondContact O-N 2.96Å; P307-L310 PolarHBondContact O-N 2.98Å; L310-Y377 HydrophobicContact CB-CD1 4.22Å; L310-Y377 HydrophobicContact CB-CE1 4.4Å; L310-L378 HydrophobicContact CD1-CB 3.89Å; L310-L378 HydrophobicContact CD1-CD1 4.23Å; L310-L378 HydrophobicContact CD1-CG 4.48Å; L310-L381 HydrophobicContact CD2-CD1 4.37Å; L310-F387 HydrophobicContact CD2-CE2 4.34Å; L310-F387 HydrophobicContact CD2-CZ 4.13Å; L310-L409 HydrophobicContact CD1-CD1 4.29Å; L310-L409 WeakPolarHBondContact O-CD2 3.16Å
311	F	92.5	Very high	90.3	Very high	2 Å²	2	43.6 Å²	43.6	1%	0.009	21%	0.211	C	C	.	.	H	α-helix	trans	-110.1	-6.8	-175.1	-54.1	-70.2	0	0	0	114.1	L285 F289 M290 L293 P307 N313 L314 Y367 L405 L409	L285-F311 HydrophobicContact CD1-CD1 3.87Å; L285-F311 HydrophobicContact CD1-CE1 3.65Å; L285-F311 HydrophobicContact CD2-CD1 4.35Å; L285-F311 HydrophobicContact CG-CD1 3.93Å; L285-F311 HydrophobicContact CG-CE1 4.14Å; F289-F311 HydrophobicContact CB-CE1 3.98Å; F289-F311 HydrophobicContact CB-CZ 3.8Å; M290-F311 HydrophobicContact CB-CD2 3.91Å; M290-F311 HydrophobicContact CB-CE2 3.86Å; M290-F311 HydrophobicContact CB-CG 4.32Å; M290-F311 HydrophobicContact CB-CZ 4.23Å; M290-F311 HydrophobicContact CE-CB 4.14Å; M290-F311 HydrophobicContact CG-CD2 3.64Å; M290-F311 HydrophobicContact CG-CE2 3.94Å; M290-F311 HydrophobicContact CG-CG 4.26Å; L293-F311 HydrophobicContact CD2-CE2 3.98Å; P307-F311 HydrophobicContact CB-CD2 4.23Å; P307-F311 WeakPolarHBondContact O-CD2 3.34Å; P307-F311 PolarHBondContact O-N 3.45Å; F311-N313 PolarHBondContact O-N 3.24Å; F311-L314 HydrophobicContact CB-CB 4.16Å; F311-L314 HydrophobicContact CB-CD2 4.29Å; F311-L314 HydrophobicContact CD1-CD2 4.43Å; F311-L314 WeakPolarHBondContact O-CB 3.3Å; F311-L314 PolarHBondContact O-N 2.66Å; F311-Y367 WeakPolarHBondContact O-CE2 3.15Å; F311-L405 HydrophobicContact CE1-CD1 4.22Å; F311-L409 HydrophobicContact CD1-CD2 4.34Å
312	G	90.3	Very high	90.6	Very high	18 Å²	18	43.4 Å²	43.4	19%	0.186	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.6	-136.8	-179.3	0	0	0	0	0	112.8	M308 L314	M308-G312 VanDerWaalsContact O-CA 3.3Å; M308-G312 WeakPolarHBondContact O-CA 3.47Å; M308-G312 PolarHBondContact O-N 2.85Å; M308-G312 VanDerWaalsContact O-N 3.14Å; G312-L314 VanDerWaalsContact C-N 3.26Å; G312-L314 PolarHBondContact O-N 2.93Å
313	N	92.7	Very high	90.9	Very high	20 Å²	20	44.2 Å²	44.2	11%	0.107	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.8	41.8	178.1	62.7	-73.5	0	0	0	113.7	F311 D315 D316 L317 I363 N366 Y367	F311-N313 PolarHBondContact O-N 3.24Å; N313-D315 VanDerWaalsContact C-N 3.27Å; N313-D315 PolarHBondContact O-N 2.95Å; N313-D316 HydrophobicContact CB-CB 4.3Å; N313-D316 WeakPolarHBondContact O-CB 3.4Å; N313-D316 PolarHBondContact O-N 3.17Å; N313-D316 VanDerWaalsContact O-N 3.08Å; N313-L317 PolarHBondContact O-N 3.42Å; N313-I363 PolarHBondContact ND2-O 2.9Å; N313-N366 PolarHBondContact OD1-ND2 2.8Å; N313-Y367 WeakPolarHBondContact OD1-CA 3.36Å; N313-Y367 PolarHBondContact OD1-N 3.36Å; N313-Y367 VanDerWaalsContact OD1-N 3.12Å
314	L	92.3	Very high	91.1	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-55.1	-38.9	-178	-176.5	58.9	0	0	0	113.2	L282 L285 K286 M290 F311 G312 D316 L317 C318	L282-L314 HydrophobicContact CD2-CD1 3.58Å; L285-L314 HydrophobicContact CB-CD2 4.06Å; L285-L314 HydrophobicContact CD2-CD1 4.02Å; L285-L314 HydrophobicContact CD2-CD2 3.75Å; L285-L314 HydrophobicContact CG-CD2 3.68Å; K286-L314 HydrophobicContact CB-CD2 4.2Å; M290-L314 HydrophobicContact CE-CB 3.83Å; M290-L314 HydrophobicContact CE-CD2 3.99Å; M290-L314 HydrophobicContact CE-CG 4.25Å; F311-L314 HydrophobicContact CB-CB 4.16Å; F311-L314 HydrophobicContact CB-CD2 4.29Å; F311-L314 HydrophobicContact CD1-CD2 4.43Å; F311-L314 WeakPolarHBondContact O-CB 3.3Å; F311-L314 PolarHBondContact O-N 2.66Å; G312-L314 VanDerWaalsContact C-N 3.26Å; G312-L314 PolarHBondContact O-N 2.93Å; L314-D316 VanDerWaalsContact C-N 3.34Å; L314-D316 PolarHBondContact O-N 3.14Å; L314-L317 WeakPolarHBondContact O-CB 3.37Å; L314-L317 PolarHBondContact O-N 3.33Å; L314-C318 PolarHBondContact O-N 3.18Å; L314-C318 PolarHBondContact O-SG 2.68Å
315	D	92.5	Very high	91.2	Very high	64 Å²	64	33.3 Å²	33.3	34%	0.342	17%	0.165	S	C	.	.	H	α-helix	trans	-62.8	-36.3	178	-75.3	-60.3	0	0	0	113	K286 N313 C318 Y319	K286-D315 IonicContact NZ-OD1 3.88Å; K286-D315 PolarHBondContact NZ-OD1 3.41Å; N313-D315 VanDerWaalsContact C-N 3.27Å; N313-D315 PolarHBondContact O-N 2.95Å; D315-C318 PolarHBondContact O-N 2.92Å; D315-Y319 PolarHBondContact O-N 3.01Å; D315-Y319 VanDerWaalsContact O-N 3.1Å
316	D	93.5	Very high	91.2	Very high	73 Å²	73	38.7 Å²	38.7	39%	0.39	19%	0.185	S	C	.	.	H	α-helix	trans	-67.3	-40	173.9	-82	-26.7	0	0	0	111.1	N313 L314 Y319 V320 I363	N313-D316 HydrophobicContact CB-CB 4.3Å; N313-D316 WeakPolarHBondContact O-CB 3.4Å; N313-D316 PolarHBondContact O-N 3.17Å; N313-D316 VanDerWaalsContact O-N 3.08Å; L314-D316 VanDerWaalsContact C-N 3.34Å; L314-D316 PolarHBondContact O-N 3.14Å; D316-Y319 PolarHBondContact O-N 3.36Å; D316-V320 WeakPolarHBondContact O-CG2 3.43Å; D316-V320 PolarHBondContact O-N 3.43Å; D316-V320 VanDerWaalsContact O-N 3.08Å; D316-I363 HydrophobicContact CB-CD1 4.31Å; D316-I363 HydrophobicContact CB-CG2 3.78Å
317	L	93.4	Very high	90.9	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-64.6	-43.1	175.9	-73.9	171	0	0	0	111.7	L282 N313 L314 Y319 V320 S321 I363 Y364 Y367 P412	L282-L317 HydrophobicContact CD1-CB 4.34Å; L282-L317 HydrophobicContact CD2-CB 4.32Å; N313-L317 PolarHBondContact O-N 3.42Å; L314-L317 WeakPolarHBondContact O-CB 3.37Å; L314-L317 PolarHBondContact O-N 3.33Å; L317-Y319 VanDerWaalsContact C-N 3.3Å; L317-Y319 PolarHBondContact O-N 2.86Å; L317-V320 PolarHBondContact O-N 3.15Å; L317-S321 WeakPolarHBondContact O-CB 3.37Å; L317-S321 PolarHBondContact O-N 2.86Å; L317-I363 HydrophobicContact CD2-CG2 3.96Å; L317-I363 HydrophobicContact CG-CG2 4.26Å; L317-Y364 HydrophobicContact CD2-CD1 3.55Å; L317-Y364 HydrophobicContact CD2-CE1 3.69Å; L317-Y364 HydrophobicContact CD2-CG 4.04Å; L317-Y367 HydrophobicContact CD1-CD1 4.26Å; L317-Y367 HydrophobicContact CD1-CD2 3.47Å; L317-Y367 VanDerWaalsContact CD1-CD2 3.47Å; L317-Y367 HydrophobicContact CD1-CE2 4.05Å; L317-Y367 HydrophobicContact CD1-CG 3.59Å; L317-P412 HydrophobicContact CD1-CB 3.96Å; L317-P412 HydrophobicContact CD1-CG 4.17Å
318	C	93.1	Very high	90.8	Very high	9 Å²	9	36 Å²	36	6%	0.061	17%	0.172	C	C	.	.	H	α-helix	trans	-57.8	-44.5	175.6	-65.6	0	0	0	0	111	M283 L314 D315 H322	M283-C318 HydrophobicContact CE-CB 3.7Å; M283-C318 WeakPolarHBondContact CE-SG 3.19Å; L314-C318 PolarHBondContact O-N 3.18Å; L314-C318 PolarHBondContact O-SG 2.68Å; D315-C318 PolarHBondContact O-N 2.92Å; C318-H322 WeakPolarHBondContact O-CB 3.42Å; C318-H322 PolarHBondContact O-N 2.88Å
319	Y	92.7	Very high	90.5	Very high	127 Å²	127	31.3 Å²	31.3	50%	0.498	15%	0.149	S	C	.	.	H	α-helix	trans	-62.6	-49	177.6	177.5	-92	0	0	0	112.5	D315 D316 L317 S321 H322 T323	D315-Y319 PolarHBondContact O-N 3.01Å; D315-Y319 VanDerWaalsContact O-N 3.1Å; D316-Y319 PolarHBondContact O-N 3.36Å; L317-Y319 VanDerWaalsContact C-N 3.3Å; L317-Y319 PolarHBondContact O-N 2.86Å; Y319-S321 PolarHBondContact O-N 3.26Å; Y319-H322 PolarHBondContact O-N 3.35Å; Y319-T323 HydrophobicContact CD2-CG2 4.35Å; Y319-T323 HydrophobicContact CE1-CG2 4.08Å; Y319-T323 HydrophobicContact CE2-CG2 3.91Å; Y319-T323 WeakPolarHBondContact O-CB 3.35Å; Y319-T323 WeakPolarHBondContact O-CG2 3.46Å; Y319-T323 PolarHBondContact O-N 2.95Å; Y319-T323 PolarHBondContact O-OG1 2.86Å
320	V	92.7	Very high	90.2	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-62.3	-44.1	-179	171.4	0	0	0	0	111.7	D316 L317 T323 F324 H357 I363 Y364	D316-V320 WeakPolarHBondContact O-CG2 3.43Å; D316-V320 PolarHBondContact O-N 3.43Å; D316-V320 VanDerWaalsContact O-N 3.08Å; L317-V320 PolarHBondContact O-N 3.15Å; V320-T323 PolarHBondContact O-OG1 2.71Å; V320-T323 VanDerWaalsContact O-OG1 3.09Å; V320-F324 WeakPolarHBondContact O-CB 3.36Å; V320-F324 PolarHBondContact O-N 3.18Å; V320-F324 VanDerWaalsContact O-N 3.11Å; V320-H357 HydrophobicContact CG2-CB 4.44Å; V320-I363 HydrophobicContact CG2-CD1 3.69Å; V320-I363 HydrophobicContact CG2-CG2 4.34Å; V320-Y364 HydrophobicContact CG1-CE2 4.19Å
321	S	91.7	Very high	89.7	Confident	0 Å²	0	28.3 Å²	28.3	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-68.5	-45.2	179.5	-170.1	0	0	0	0	111.7	E274 L317 Y319 T323 F324 C325	E274-S321 WeakPolarHBondContact OE1-CA 3.47Å; E274-S321 VanDerWaalsContact OE1-CB 3.26Å; E274-S321 WeakPolarHBondContact OE1-CB 3.44Å; E274-S321 PolarHBondContact OE1-OG 3.33Å; L317-S321 WeakPolarHBondContact O-CB 3.37Å; L317-S321 PolarHBondContact O-N 2.86Å; Y319-S321 PolarHBondContact O-N 3.26Å; S321-T323 PolarHBondContact O-N 2.99Å; S321-F324 PolarHBondContact O-N 2.97Å; S321-C325 WeakPolarHBondContact O-CB 3.26Å; S321-C325 PolarHBondContact O-N 2.91Å
322	H	90.7	Very high	89	Confident	39 Å²	39	28.3 Å²	28.3	18%	0.181	14%	0.14	C	C	.	.	H	α-helix	trans	-60.3	-47.3	177.2	-175.6	-120.3	0	0	0	113	F230 D232 F278 C318 Y319 C325 R326	F230-H322 AromaticContact CZ-NE2 3.88Å; D232-H322 IonicContact OD2-CD2 3.94Å; D232-H322 IonicContact OD2-CE1 2.57Å; D232-H322 IonicContact OD2-NE2 3.18Å; D232-H322 PolarHBondContact OD2-NE2 3.12Å; F278-H322 HydrophobicContact CD2-CB 4.21Å; F278-H322 AromaticContact CE1-CD2 3.79Å; F278-H322 HydrophobicContact CE2-CB 3.59Å; F278-H322 HydrophobicContact CZ-CB 3.84Å; F278-H322 AromaticContact CZ-CD2 3.51Å; F278-H322 AromaticContact CZ-CG 3.95Å; C318-H322 WeakPolarHBondContact O-CB 3.42Å; C318-H322 PolarHBondContact O-N 2.88Å; Y319-H322 PolarHBondContact O-N 3.35Å; H322-C325 PolarHBondContact O-N 3.1Å; H322-R326 WeakPolarHBondContact CE1-CD 3.47Å; H322-R326 WeakPolarHBondContact NE2-CD 3.24Å; H322-R326 WeakPolarHBondContact O-CG 3.26Å; H322-R326 PolarHBondContact O-N 2.84Å
323	T	90.3	Very high	88.3	Confident	23 Å²	23	29 Å²	29	14%	0.141	14%	0.142	C	C	.	.	H	α-helix	trans	-63.1	-45.8	178.4	46.5	0	0	0	0	111.5	Y319 V320 S321 R326 E327	Y319-T323 HydrophobicContact CD2-CG2 4.35Å; Y319-T323 HydrophobicContact CE1-CG2 4.08Å; Y319-T323 HydrophobicContact CE2-CG2 3.91Å; Y319-T323 WeakPolarHBondContact O-CB 3.35Å; Y319-T323 WeakPolarHBondContact O-CG2 3.46Å; Y319-T323 PolarHBondContact O-N 2.95Å; Y319-T323 PolarHBondContact O-OG1 2.86Å; V320-T323 PolarHBondContact O-OG1 2.71Å; V320-T323 VanDerWaalsContact O-OG1 3.09Å; S321-T323 PolarHBondContact O-N 2.99Å; T323-R326 PolarHBondContact O-N 3.39Å; T323-E327 WeakPolarHBondContact O-CB 3.46Å; T323-E327 WeakPolarHBondContact O-CG 3.18Å; T323-E327 PolarHBondContact O-N 3.01Å
324	F	90.1	Very high	87.2	Confident	4 Å²	4	33.7 Å²	33.7	2%	0.018	16%	0.163	C	C	.	.	H	α-helix	trans	-63.4	-42.9	176.4	179.8	-130.6	0	0	0	112.6	L270 E274 V320 S321 L328 P350 L351 W354	L270-F324 HydrophobicContact CD2-CZ 4.34Å; L270-F324 HydrophobicContact CG-CZ 4.47Å; E274-F324 HydrophobicContact CB-CD1 4.44Å; E274-F324 HydrophobicContact CB-CE1 4.44Å; E274-F324 HydrophobicContact CG-CD1 3.69Å; E274-F324 HydrophobicContact CG-CE1 4.15Å; V320-F324 WeakPolarHBondContact O-CB 3.36Å; V320-F324 PolarHBondContact O-N 3.18Å; V320-F324 VanDerWaalsContact O-N 3.11Å; S321-F324 PolarHBondContact O-N 2.97Å; F324-L328 HydrophobicContact CE2-CD2 4.26Å; F324-L328 HydrophobicContact CZ-CD2 3.99Å; F324-L328 WeakPolarHBondContact O-CB 3.45Å; F324-L328 PolarHBondContact O-N 2.79Å; F324-P350 HydrophobicContact CD2-CB 3.91Å; F324-P350 HydrophobicContact CE2-CB 3.78Å; F324-L351 HydrophobicContact CE2-CD2 3.92Å; F324-L351 HydrophobicContact CE2-CG 4.36Å; F324-L351 HydrophobicContact CZ-CD2 3.76Å; F324-W354 HydrophobicContact CB-CB 4.22Å; F324-W354 HydrophobicContact CB-CG 4.31Å; F324-W354 AromaticContact CD1-CD1 3.9Å; F324-W354 HydrophobicContact CD1-CG 4.35Å; F324-W354 HydrophobicContact CD2-CB 3.8Å; F324-W354 HydrophobicContact CD2-CG 4.28Å; F324-W354 HydrophobicContact CE2-CB 4.38Å; F324-W354 HydrophobicContact CG-CB 4.01Å; F324-W354 AromaticContact CG-CD1 3.78Å; F324-W354 HydrophobicContact CG-CG 4.07Å
325	C	89.5	Confident	85.6	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-56.2	-51.4	172.1	-83.1	0	0	0	0	112.4	L235 E274 S321 H322 L328 I329	L235-C325 HydrophobicContact CD1-CB 4.1Å; L235-C325 HydrophobicContact CD2-CB 4.03Å; E274-C325 VanDerWaalsContact CG-SG 3.5Å; S321-C325 WeakPolarHBondContact O-CB 3.26Å; S321-C325 PolarHBondContact O-N 2.91Å; H322-C325 PolarHBondContact O-N 3.1Å; C325-L328 PolarHBondContact O-N 2.85Å; C325-I329 WeakPolarHBondContact O-CG2 3.35Å; C325-I329 PolarHBondContact O-N 3.22Å
326	R	87.2	Confident	83.9	Confident	119 Å²	119	33.9 Å²	33.9	45%	0.449	17%	0.166	S	C	.	.	H	α-helix	trans	-66.4	-40.5	-177.4	-72.1	-171.2	73.7	-112.2	-0.1	112.5	D232 L235 H322 T323 S330	D232-R326 WeakPolarHBondContact OD2-CD 3.42Å; D232-R326 IonicContact OD2-NE 3.68Å; L235-R326 HydrophobicContact CD1-CG 3.98Å; L235-R326 HydrophobicContact CD2-CG 3.99Å; L235-R326 HydrophobicContact CG-CG 4.08Å; H322-R326 WeakPolarHBondContact CE1-CD 3.47Å; H322-R326 WeakPolarHBondContact NE2-CD 3.24Å; H322-R326 WeakPolarHBondContact O-CG 3.26Å; H322-R326 PolarHBondContact O-N 2.84Å; T323-R326 PolarHBondContact O-N 3.39Å; R326-S330 WeakPolarHBondContact O-CB 3.1Å; R326-S330 PolarHBondContact O-N 2.83Å
327	E	85.4	Confident	81.8	Confident	37 Å²	37	36.5 Å²	36.5	17%	0.173	18%	0.184	C	C	.	.	H	α-helix	trans	-69.1	-41.8	176.5	-70	-163.9	144.6	0	0	112	T323 S330 N331 P350 R353	T323-E327 WeakPolarHBondContact O-CB 3.46Å; T323-E327 WeakPolarHBondContact O-CG 3.18Å; T323-E327 PolarHBondContact O-N 3.01Å; E327-S330 PolarHBondContact O-N 2.85Å; E327-N331 PolarHBondContact O-N 2.87Å; E327-N331 PolarHBondContact O-ND2 3.25Å; E327-P350 HydrophobicContact CB-CB 4.4Å; E327-P350 HydrophobicContact CB-CG 4.43Å; E327-R353 VanDerWaalsContact CD-CD 3.45Å; E327-R353 WeakPolarHBondContact OE1-CD 3.35Å; E327-R353 IonicContact OE1-CZ 3.1Å; E327-R353 IonicContact OE1-NE 2.79Å; E327-R353 IonicContact OE1-NH1 3.51Å; E327-R353 PolarHBondContact OE1-NH1 2.87Å; E327-R353 VanDerWaalsContact OE2-CB 3.23Å; E327-R353 WeakPolarHBondContact OE2-CB 3.44Å; E327-R353 WeakPolarHBondContact OE2-CD 3.21Å
328	L	85.9	Confident	79.8	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-61.7	-49.9	179.2	-178	51	0	0	0	111.2	F271 F324 C325 S330 N331 L332 L347 P350	F271-L328 HydrophobicContact CB-CD2 3.75Å; F271-L328 HydrophobicContact CB-CG 4.24Å; F271-L328 HydrophobicContact CD2-CB 4.38Å; F271-L328 HydrophobicContact CD2-CD2 4.08Å; F271-L328 HydrophobicContact CD2-CG 4.12Å; F271-L328 HydrophobicContact CG-CD2 4.4Å; F324-L328 HydrophobicContact CE2-CD2 4.26Å; F324-L328 HydrophobicContact CZ-CD2 3.99Å; F324-L328 WeakPolarHBondContact O-CB 3.45Å; F324-L328 PolarHBondContact O-N 2.79Å; C325-L328 PolarHBondContact O-N 2.85Å; L328-S330 PolarHBondContact O-N 3Å; L328-N331 PolarHBondContact O-N 2.8Å; L328-L332 HydrophobicContact CD1-CD1 3.9Å; L328-L332 HydrophobicContact CD1-CG 4.22Å; L328-L332 HydrophobicContact CG-CD1 4.03Å; L328-L332 WeakPolarHBondContact O-CB 3.35Å; L328-L332 VanDerWaalsContact O-CG 3.24Å; L328-L332 WeakPolarHBondContact O-CG 3.47Å; L328-L332 PolarHBondContact O-N 3.06Å; L328-L347 HydrophobicContact CD1-CD2 3.72Å; L328-P350 HydrophobicContact CB-CB 4.35Å; L328-P350 HydrophobicContact CB-CG 4.46Å; L328-P350 HydrophobicContact CD1-CG 4.35Å
329	I	82.9	Confident	77.8	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-68.8	-32.6	177.8	-162	57.9	0	0	0	112.7	Y234 L235 F238 L246 W268 F271 C325 L332 S333	Y234-I329 HydrophobicContact CD1-CG2 4.5Å; Y234-I329 HydrophobicContact CE1-CG2 3.69Å; L235-I329 HydrophobicContact CD2-CG2 4.08Å; F238-I329 HydrophobicContact CD1-CD1 3.95Å; F238-I329 HydrophobicContact CD1-CG1 4.24Å; F238-I329 HydrophobicContact CD2-CD1 4.28Å; F238-I329 HydrophobicContact CD2-CG1 3.69Å; F238-I329 HydrophobicContact CE1-CD1 4.09Å; F238-I329 HydrophobicContact CE1-CG1 4.21Å; F238-I329 HydrophobicContact CE2-CD1 4.41Å; F238-I329 HydrophobicContact CE2-CG1 3.67Å; F238-I329 HydrophobicContact CG-CD1 4.04Å; F238-I329 HydrophobicContact CG-CG1 3.97Å; F238-I329 HydrophobicContact CZ-CD1 4.31Å; F238-I329 HydrophobicContact CZ-CG1 3.94Å; L246-I329 HydrophobicContact CD2-CD1 4.08Å; W268-I329 HydrophobicContact CH2-CD1 4.04Å; W268-I329 HydrophobicContact CZ3-CD1 3.98Å; F271-I329 HydrophobicContact CD2-CB 4.49Å; F271-I329 HydrophobicContact CE1-CD1 4.02Å; F271-I329 HydrophobicContact CE2-CB 3.76Å; F271-I329 HydrophobicContact CE2-CG1 4.4Å; F271-I329 HydrophobicContact CE2-CG2 4.45Å; F271-I329 HydrophobicContact CZ-CB 3.88Å; F271-I329 HydrophobicContact CZ-CD1 4Å; F271-I329 HydrophobicContact CZ-CG1 4.02Å; C325-I329 WeakPolarHBondContact O-CG2 3.35Å; C325-I329 PolarHBondContact O-N 3.22Å; I329-L332 PolarHBondContact O-N 3.36Å; I329-S333 VanDerWaalsContact O-CB 3.25Å; I329-S333 WeakPolarHBondContact O-CB 3.48Å; I329-S333 PolarHBondContact O-N 2.79Å; I329-S333 PolarHBondContact O-OG 2.83Å
330	S	83.8	Confident	76	Confident	43 Å²	43	43.6 Å²	43.6	30%	0.301	23%	0.231	S	C	.	.	H	α-helix	trans	-66.4	-41.3	176.2	-175.9	0	0	0	0	112.3	R326 E327 L328 Q334	R326-S330 WeakPolarHBondContact O-CB 3.1Å; R326-S330 PolarHBondContact O-N 2.83Å; E327-S330 PolarHBondContact O-N 2.85Å; L328-S330 PolarHBondContact O-N 3Å; S330-Q334 WeakPolarHBondContact O-CG 3.39Å; S330-Q334 PolarHBondContact O-N 3.06Å; S330-Q334 VanDerWaalsContact O-N 3.15Å
331	N	80.4	Confident	74	Confident	17 Å²	17	44.2 Å²	44.2	9%	0.091	23%	0.234	C	C	.	.	H	α-helix	trans	-70.9	-41.7	176.5	-74.2	-91.9	0	0	0	110.4	E327 L328 S333 Q334 E335 V346 P350	E327-N331 PolarHBondContact O-N 2.87Å; E327-N331 PolarHBondContact O-ND2 3.25Å; L328-N331 PolarHBondContact O-N 2.8Å; N331-S333 VanDerWaalsContact C-N 3.31Å; N331-S333 PolarHBondContact O-N 2.94Å; N331-Q334 PolarHBondContact O-N 3.36Å; N331-E335 PolarHBondContact O-N 3.29Å; N331-V346 HydrophobicContact CB-CG1 3.78Å; N331-P350 HydrophobicContact CB-CG 4.35Å
332	L	77.6	Confident	72.2	Confident	1 Å²	1	44.3 Å²	44.3	1%	0.005	23%	0.234	C	C	.	.	H	α-helix	trans	-61.6	-34.9	174.9	-71.2	169.2	0	0	0	113.2	L246 V267 W268 L328 I329 S336 F341 V346	L246-L332 HydrophobicContact CD2-CB 4.48Å; V267-L332 HydrophobicContact CG1-CD1 4.37Å; V267-L332 HydrophobicContact CG1-CD2 3.97Å; W268-L332 HydrophobicContact CZ3-CD1 4.45Å; L328-L332 HydrophobicContact CD1-CD1 3.9Å; L328-L332 HydrophobicContact CD1-CG 4.22Å; L328-L332 HydrophobicContact CG-CD1 4.03Å; L328-L332 WeakPolarHBondContact O-CB 3.35Å; L328-L332 VanDerWaalsContact O-CG 3.24Å; L328-L332 WeakPolarHBondContact O-CG 3.47Å; L328-L332 PolarHBondContact O-N 3.06Å; I329-L332 PolarHBondContact O-N 3.36Å; L332-S336 WeakPolarHBondContact O-CB 3.49Å; L332-S336 PolarHBondContact O-N 2.91Å; L332-F341 HydrophobicContact CB-CE2 4.49Å; L332-F341 HydrophobicContact CD2-CE2 4.37Å; L332-F341 HydrophobicContact CD2-CZ 4.14Å; L332-V346 HydrophobicContact CD2-CG1 4.1Å; L332-V346 HydrophobicContact CG-CG1 4.42Å
333	S	75.5	Confident	70.9	Confident	33 Å²	33	43.5 Å²	43.5	23%	0.231	23%	0.233	C	C	.	.	H	α-helix	trans	-80	-21.6	178.7	-55.7	0	0	0	0	113.9	I329 N331 S336	I329-S333 VanDerWaalsContact O-CB 3.25Å; I329-S333 WeakPolarHBondContact O-CB 3.48Å; I329-S333 PolarHBondContact O-N 2.79Å; I329-S333 PolarHBondContact O-OG 2.83Å; N331-S333 VanDerWaalsContact C-N 3.31Å; N331-S333 PolarHBondContact O-N 2.94Å; S333-S336 PolarHBondContact O-OG 2.87Å
334	Q	69.9	Low	69.6	Low	118 Å²	118	42.5 Å²	42.5	55%	0.551	23%	0.227	S	C	*	.	H	α-helix	trans	-80.7	-49.1	173.8	-76.9	174.1	-12.7	0	0	110.3	S330 N331 S336 V337	S330-Q334 WeakPolarHBondContact O-CG 3.39Å; S330-Q334 PolarHBondContact O-N 3.06Å; S330-Q334 VanDerWaalsContact O-N 3.15Å; N331-Q334 PolarHBondContact O-N 3.36Å; Q334-S336 VanDerWaalsContact C-N 3.27Å; Q334-S336 PolarHBondContact O-N 2.87Å; Q334-V337 PolarHBondContact O-N 2.57Å
335	E	58.7	Low	68.4	Low	41 Å²	41	46.2 Å²	46.2	19%	0.192	25%	0.247	C	C	.	.	H	α-helix	trans	-75.6	-11.6	-176.2	-135.3	70.1	-102.1	0	0	113.8	N331 V337 S338 E340 V346 R349	N331-E335 PolarHBondContact O-N 3.29Å; E335-V337 PolarHBondContact O-N 3.15Å; E335-S338 WeakPolarHBondContact O-CB 3.36Å; E335-S338 PolarHBondContact O-N 2.8Å; E335-S338 VanDerWaalsContact OE1-CB 3.28Å; E335-S338 WeakPolarHBondContact OE1-CB 3.48Å; E335-S338 PolarHBondContact OE1-OG 2.98Å; E335-E340 HydrophobicContact CG-CB 4.37Å; E335-V346 HydrophobicContact CB-CG1 4.41Å; E335-V346 HydrophobicContact CB-CG2 3.82Å; E335-V346 HydrophobicContact CG-CG2 3.65Å; E335-R349 IonicContact OE2-NH2 2.66Å
336	S	56.3	Low	67.4	Low	28 Å²	28	46.3 Å²	46.3	20%	0.196	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67	-10.7	169.5	65.8	0	0	0	0	113.7	L246 L332 S333 Q334	L246-S336 WeakPolarHBondContact O-CB 3.49Å; L332-S336 WeakPolarHBondContact O-CB 3.49Å; L332-S336 PolarHBondContact O-N 2.91Å; S333-S336 PolarHBondContact O-OG 2.87Å; Q334-S336 VanDerWaalsContact C-N 3.27Å; Q334-S336 PolarHBondContact O-N 2.87Å
337	V	50.3	Low	66.8	Low	128 Å²	128	40.7 Å²	40.7	78%	0.776	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.3	-20.5	170.1	-172.7	0	0	0	0	111.4	Q334 E335	Q334-V337 PolarHBondContact O-N 2.57Å; E335-V337 PolarHBondContact O-N 3.15Å
338	S	52.2	Low	66.2	Low	64 Å²	64	40 Å²	40	45%	0.448	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.9	0.1	-172.3	-46.4	0	0	0	0	114.2	E335 E340	E335-S338 WeakPolarHBondContact O-CB 3.36Å; E335-S338 PolarHBondContact O-N 2.8Å; E335-S338 VanDerWaalsContact OE1-CB 3.28Å; E335-S338 WeakPolarHBondContact OE1-CB 3.48Å; E335-S338 PolarHBondContact OE1-OG 2.98Å; S338-E340 PolarHBondContact O-N 2.95Å
339	N	51.1	Low	66	Low	104 Å²	104	45.6 Å²	45.6	56%	0.556	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.6	-3.1	-170.1	-113	26.3	0	0	0	116.4	F341	N339-F341 VanDerWaalsContact C-N 3.32Å; N339-F341 PolarHBondContact O-N 2.85Å
340	E	53.7	Low	65.8	Low	117 Å²	117	45.6 Å²	45.6	55%	0.547	25%	0.245	S	C	.	.			trans	-89.8	49.4	177.2	-89.3	-159	-145.7	0	0	112.9	E335 S338 G342 S343	E335-E340 HydrophobicContact CG-CB 4.37Å; S338-E340 PolarHBondContact O-N 2.95Å; E340-G342 PolarHBondContact O-N 3.06Å; E340-S343 WeakPolarHBondContact O-CB 3.48Å; E340-S343 PolarHBondContact O-N 3.29Å; E340-S343 WeakPolarHBondContact OE2-CB 3.45Å; E340-S343 PolarHBondContact OE2-OG 3.43Å
341	F	51.7	Low	65.7	Low	13 Å²	13	44 Å²	44	6%	0.057	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	109.9	-171.5	-167.1	-96.1	0	0	0	112.9	W243 L246 R263 C264 L332 N339	W243-F341 HydrophobicContact CB-CE1 3.93Å; W243-F341 HydrophobicContact CB-CZ 4.22Å; W243-F341 HydrophobicContact CE3-CE1 4.47Å; L246-F341 HydrophobicContact CB-CE2 3.73Å; L246-F341 HydrophobicContact CB-CZ 4.18Å; L246-F341 HydrophobicContact CD2-CE2 4.39Å; R263-F341 PolarHBondContact NH1-O 2.87Å; R263-F341 PolarHBondContact NH2-O 3.09Å; C264-F341 HydrophobicContact CB-CD1 4.28Å; C264-F341 HydrophobicContact CB-CE1 4.41Å; C264-F341 PolarHBondContact SG-O 3.32Å; L332-F341 HydrophobicContact CB-CE2 4.49Å; L332-F341 HydrophobicContact CD2-CE2 4.37Å; L332-F341 HydrophobicContact CD2-CZ 4.14Å; N339-F341 VanDerWaalsContact C-N 3.32Å; N339-F341 PolarHBondContact O-N 2.85Å
342	G	54	Low	65.8	Low	1 Å²	1	49.5 Å²	49.5	1%	0.01	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	74.2	21.1	-178.6	0	0	0	0	0	115.6	R263 E340	R263-G342 VanDerWaalsContact CZ-O 3.29Å; R263-G342 VanDerWaalsContact NH1-C 3.34Å; R263-G342 PolarHBondContact NH1-O 2.95Å; E340-G342 PolarHBondContact O-N 3.06Å
343	S	62	Low	66	Low	23 Å²	23	55.4 Å²	55.4	16%	0.161	28%	0.278	C	S	.	.			trans	-44.6	138	161.4	-179.3	0	0	0	0	110	E340 D345 V346	E340-S343 WeakPolarHBondContact O-CB 3.48Å; E340-S343 PolarHBondContact O-N 3.29Å; E340-S343 WeakPolarHBondContact OE2-CB 3.45Å; E340-S343 PolarHBondContact OE2-OG 3.43Å; S343-D345 PolarHBondContact O-N 3.1Å; S343-D345 VanDerWaalsContact O-N 3.1Å; S343-V346 WeakPolarHBondContact O-CA 3.37Å; S343-V346 WeakPolarHBondContact O-CB 3.5Å; S343-V346 WeakPolarHBondContact O-CG2 3.47Å; S343-V346 PolarHBondContact O-N 2.85Å
344	T	63.7	Low	66.6	Low	1 Å²	1	54.2 Å²	54.2	1%	0.006	27%	0.269	C	S	.	.	H	α-helix	trans	-69.6	-21.1	-158.8	-53.9	0	0	0	0	112.6	V346 L347 L348 E435 L439	T344-V346 PolarHBondContact O-N 3.26Å; T344-L347 WeakPolarHBondContact O-CA 3.28Å; T344-L347 WeakPolarHBondContact O-CB 3.14Å; T344-L347 PolarHBondContact O-N 3.47Å; T344-L348 HydrophobicContact CG2-CD1 3.96Å; T344-L348 HydrophobicContact CG2-CG 4.13Å; T344-L348 WeakPolarHBondContact O-CG 3.47Å; T344-L348 PolarHBondContact O-N 3.38Å; T344-E435 WeakPolarHBondContact CA-OE1 3.17Å; T344-E435 VanDerWaalsContact CB-CD 3.49Å; T344-E435 WeakPolarHBondContact CB-OE1 3.4Å; T344-E435 HydrophobicContact CG2-CB 4.06Å; T344-E435 HydrophobicContact CG2-CG 4.49Å; T344-E435 PolarHBondContact N-OE1 3.32Å; T344-E435 PolarHBondContact OG1-OE1 3.04Å; T344-E435 PolarHBondContact OG1-OE2 3.44Å; T344-L439 HydrophobicContact CG2-CD1 3.59Å; T344-L439 HydrophobicContact CG2-CD2 3.94Å; T344-L439 HydrophobicContact CG2-CG 3.55Å
345	D	65.2	Low	67.2	Low	83 Å²	83	49.3 Å²	49.3	44%	0.444	25%	0.248	S	C	.	.	H	α-helix	trans	-64.3	-22.6	170.1	-78	-17.2	0	0	0	113.8	S343 L347 R349	S343-D345 PolarHBondContact O-N 3.1Å; S343-D345 VanDerWaalsContact O-N 3.1Å; D345-L347 VanDerWaalsContact C-N 3.3Å; D345-R349 PolarHBondContact O-N 2.96Å; D345-R349 PolarHBondContact O-NE 2.95Å
346	V	69.1	Low	68.5	Low	1 Å²	1	52.8 Å²	52.8	1%	0.006	26%	0.264	C	S	.	.	H	α-helix	trans	-70.1	-28.9	171.2	-172.3	0	0	0	0	110.9	N331 L332 E335 S343 T344 P350	N331-V346 HydrophobicContact CB-CG1 3.78Å; L332-V346 HydrophobicContact CD2-CG1 4.1Å; L332-V346 HydrophobicContact CG-CG1 4.42Å; E335-V346 HydrophobicContact CB-CG1 4.41Å; E335-V346 HydrophobicContact CB-CG2 3.82Å; E335-V346 HydrophobicContact CG-CG2 3.65Å; S343-V346 WeakPolarHBondContact O-CA 3.37Å; S343-V346 WeakPolarHBondContact O-CB 3.5Å; S343-V346 WeakPolarHBondContact O-CG2 3.47Å; S343-V346 PolarHBondContact O-N 2.85Å; T344-V346 PolarHBondContact O-N 3.26Å; V346-P350 WeakPolarHBondContact O-CD 3.24Å; V346-P350 WeakPolarHBondContact O-CG 3.47Å
347	L	74.3	Confident	69.8	Low	1 Å²	1	54.6 Å²	54.6	1%	0.005	27%	0.269	C	S	.	.	H	α-helix	trans	-88.4	-40.9	174.4	-89.1	174.2	0	0	0	112.9	V267 L270 L328 T344 D345 R349 P350 L351 I426	V267-L347 HydrophobicContact CB-CD1 4.48Å; V267-L347 HydrophobicContact CG1-CD1 4.25Å; V267-L347 HydrophobicContact CG1-CD2 4.18Å; V267-L347 HydrophobicContact CG1-CG 4.24Å; V267-L347 HydrophobicContact CG2-CD1 3.64Å; V267-L347 HydrophobicContact CG2-CG 4.45Å; L270-L347 HydrophobicContact CD2-CD2 4.07Å; L328-L347 HydrophobicContact CD1-CD2 3.72Å; T344-L347 WeakPolarHBondContact O-CA 3.28Å; T344-L347 WeakPolarHBondContact O-CB 3.14Å; T344-L347 PolarHBondContact O-N 3.47Å; D345-L347 VanDerWaalsContact C-N 3.3Å; L347-R349 VanDerWaalsContact C-N 3.28Å; L347-R349 PolarHBondContact O-N 3.44Å; L347-P350 WeakPolarHBondContact O-CD 3.35Å; L347-L351 HydrophobicContact CB-CD1 4.2Å; L347-L351 HydrophobicContact CD2-CD1 4.48Å; L347-L351 VanDerWaalsContact O-CB 3.32Å; L347-L351 WeakPolarHBondContact O-CB 3.39Å; L347-L351 VanDerWaalsContact O-CG 3.26Å; L347-L351 WeakPolarHBondContact O-CG 3.19Å; L347-L351 PolarHBondContact O-N 3.12Å; L347-I426 HydrophobicContact CD1-CD1 3.99Å; L347-I426 HydrophobicContact CD1-CG2 3.74Å
348	L	72.9	Confident	71.4	Confident	22 Å²	22	48.5 Å²	48.5	12%	0.115	23%	0.232	C	C	.	.	H	α-helix	trans	-63.8	-33.2	-175.9	-74.8	162.1	0	0	0	112.3	T344 K352 M438	T344-L348 HydrophobicContact CG2-CD1 3.96Å; T344-L348 HydrophobicContact CG2-CG 4.13Å; T344-L348 WeakPolarHBondContact O-CG 3.47Å; T344-L348 PolarHBondContact O-N 3.38Å; L348-K352 WeakPolarHBondContact O-CB 3.45Å; L348-K352 PolarHBondContact O-N 3.1Å; L348-M438 HydrophobicContact CD1-CB 3.68Å; L348-M438 HydrophobicContact CD1-CG 4.36Å; L348-M438 HydrophobicContact CD1-SD 3.8Å; L348-M438 HydrophobicContact CD2-CB 3.87Å; L348-M438 HydrophobicContact CG-CB 4.45Å
349	R	79.8	Confident	73.1	Confident	119 Å²	119	49.7 Å²	49.7	45%	0.449	23%	0.229	S	C	.	.	H	α-helix	trans	-61.1	-60	174.2	-79.1	177.9	-95.9	170.5	-10.1	111.8	E335 D345 L347 R353	E335-R349 IonicContact OE2-NH2 2.66Å; D345-R349 PolarHBondContact O-N 2.96Å; D345-R349 PolarHBondContact O-NE 2.95Å; L347-R349 VanDerWaalsContact C-N 3.28Å; L347-R349 PolarHBondContact O-N 3.44Å; R349-R353 PolarHBondContact O-N 3.17Å
350	P	80.7	Confident	74.8	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-56.3	-44.6	170.9	-27.9	34.4	0	0	0	114.8	F324 E327 L328 N331 V346 L347 K352 R353 W354	F324-P350 HydrophobicContact CD2-CB 3.91Å; F324-P350 HydrophobicContact CE2-CB 3.78Å; E327-P350 HydrophobicContact CB-CB 4.4Å; E327-P350 HydrophobicContact CB-CG 4.43Å; L328-P350 HydrophobicContact CB-CB 4.35Å; L328-P350 HydrophobicContact CB-CG 4.46Å; L328-P350 HydrophobicContact CD1-CG 4.35Å; N331-P350 HydrophobicContact CB-CG 4.35Å; V346-P350 WeakPolarHBondContact O-CD 3.24Å; V346-P350 WeakPolarHBondContact O-CG 3.47Å; L347-P350 WeakPolarHBondContact O-CD 3.35Å; P350-K352 PolarHBondContact O-N 3.23Å; P350-R353 PolarHBondContact O-N 3.23Å; P350-W354 WeakPolarHBondContact O-CB 3.42Å; P350-W354 PolarHBondContact O-N 2.84Å
351	L	81.7	Confident	76.4	Confident	9 Å²	9	43.6 Å²	43.6	5%	0.047	20%	0.2	C	C	.	.	H	α-helix	trans	-65.9	-37.7	-177.2	-73.3	170.5	0	0	0	112.5	F324 L347 S355 L423 L439	F324-L351 HydrophobicContact CE2-CD2 3.92Å; F324-L351 HydrophobicContact CE2-CG 4.36Å; F324-L351 HydrophobicContact CZ-CD2 3.76Å; L347-L351 HydrophobicContact CB-CD1 4.2Å; L347-L351 HydrophobicContact CD2-CD1 4.48Å; L347-L351 VanDerWaalsContact O-CB 3.32Å; L347-L351 WeakPolarHBondContact O-CB 3.39Å; L347-L351 VanDerWaalsContact O-CG 3.26Å; L347-L351 WeakPolarHBondContact O-CG 3.19Å; L347-L351 PolarHBondContact O-N 3.12Å; L351-S355 PolarHBondContact O-N 3.26Å; L351-L423 HydrophobicContact CD1-CD2 3.6Å; L351-L423 HydrophobicContact CD2-CD2 3.95Å; L351-L423 HydrophobicContact CG-CD2 4.46Å; L351-L439 HydrophobicContact CD1-CD2 4.43Å
352	K	80.7	Confident	78.3	Confident	132 Å²	132	47.1 Å²	47.1	57%	0.574	22%	0.217	S	C	*	.	H	α-helix	trans	-64.7	-46.7	173.9	-179.9	178.7	171.1	-177	0	111.2	L348 P350 W354 S355 E356	L348-K352 WeakPolarHBondContact O-CB 3.45Å; L348-K352 PolarHBondContact O-N 3.1Å; P350-K352 PolarHBondContact O-N 3.23Å; K352-W354 PolarHBondContact O-N 3.41Å; K352-S355 WeakPolarHBondContact O-CA 3.46Å; K352-S355 VanDerWaalsContact O-CB 3.25Å; K352-S355 WeakPolarHBondContact O-CB 3.4Å; K352-S355 PolarHBondContact O-N 3.22Å; K352-S355 VanDerWaalsContact O-N 3.14Å; K352-E356 WeakPolarHBondContact CE-OE1 3.27Å; K352-E356 WeakPolarHBondContact CG-OE1 3.44Å; K352-E356 WeakPolarHBondContact O-CG 3.35Å; K352-E356 PolarHBondContact O-N 3.19Å
353	R	83.2	Confident	80.2	Confident	126 Å²	126	47.5 Å²	47.5	48%	0.475	22%	0.219	S	C	.	.	H	α-helix	trans	-65.8	-35.3	177	-74.2	-175.4	178.6	170.8	4.9	112.7	E327 R349 P350 E356 H357	E327-R353 VanDerWaalsContact CD-CD 3.45Å; E327-R353 WeakPolarHBondContact OE1-CD 3.35Å; E327-R353 IonicContact OE1-CZ 3.1Å; E327-R353 IonicContact OE1-NE 2.79Å; E327-R353 IonicContact OE1-NH1 3.51Å; E327-R353 PolarHBondContact OE1-NH1 2.87Å; E327-R353 VanDerWaalsContact OE2-CB 3.23Å; E327-R353 WeakPolarHBondContact OE2-CB 3.44Å; E327-R353 WeakPolarHBondContact OE2-CD 3.21Å; R349-R353 PolarHBondContact O-N 3.17Å; P350-R353 PolarHBondContact O-N 3.23Å; R353-E356 PolarHBondContact O-N 2.79Å; R353-H357 WeakPolarHBondContact O-CB 3.34Å; R353-H357 PolarHBondContact O-CD2 3.41Å; R353-H357 PolarHBondContact O-N 3.02Å
354	W	87.5	Confident	81.7	Confident	8 Å²	8	46.4 Å²	46.4	3%	0.03	21%	0.211	C	C	.	.	H	α-helix	trans	-63.7	-38.5	169.9	173.5	87.8	0	0	0	112	F324 P350 K352 S358 Y364 Y416 I419 V446	F324-W354 HydrophobicContact CB-CB 4.22Å; F324-W354 HydrophobicContact CB-CG 4.31Å; F324-W354 AromaticContact CD1-CD1 3.9Å; F324-W354 HydrophobicContact CD1-CG 4.35Å; F324-W354 HydrophobicContact CD2-CB 3.8Å; F324-W354 HydrophobicContact CD2-CG 4.28Å; F324-W354 HydrophobicContact CE2-CB 4.38Å; F324-W354 HydrophobicContact CG-CB 4.01Å; F324-W354 AromaticContact CG-CD1 3.78Å; F324-W354 HydrophobicContact CG-CG 4.07Å; P350-W354 WeakPolarHBondContact O-CB 3.42Å; P350-W354 PolarHBondContact O-N 2.84Å; K352-W354 PolarHBondContact O-N 3.41Å; W354-S358 WeakPolarHBondContact O-CB 3.34Å; W354-S358 PolarHBondContact O-N 2.99Å; W354-S358 PolarHBondContact O-OG 2.86Å; W354-Y364 AromaticContact CZ2-CE2 3.78Å; W354-Y364 HydrophobicContact CZ2-CE2 3.78Å; W354-Y364 AromaticContact NE1-CE2 3.98Å; W354-Y364 PolarHBondContact NE1-OH 3.21Å; W354-Y416 AromaticContact CH2-CE2 3.88Å; W354-Y416 HydrophobicContact CH2-CE2 3.88Å; W354-Y416 HydrophobicContact CZ2-CD2 4.39Å; W354-Y416 AromaticContact CZ2-CE2 3.96Å; W354-Y416 HydrophobicContact CZ2-CE2 3.96Å; W354-I419 HydrophobicContact CH2-CG2 4.21Å; W354-V446 HydrophobicContact CH2-CG2 4.11Å; W354-V446 HydrophobicContact CZ3-CG2 3.82Å
355	S	82.7	Confident	83.1	Confident	15 Å²	15	46.4 Å²	46.4	11%	0.105	21%	0.211	C	C	.	.	H	α-helix	trans	-59.9	-48.3	170.5	-144.8	0	0	0	0	110.7	L351 K352 S358 K359 D360	L351-S355 PolarHBondContact O-N 3.26Å; K352-S355 WeakPolarHBondContact O-CA 3.46Å; K352-S355 VanDerWaalsContact O-CB 3.25Å; K352-S355 WeakPolarHBondContact O-CB 3.4Å; K352-S355 PolarHBondContact O-N 3.22Å; K352-S355 VanDerWaalsContact O-N 3.14Å; S355-S358 PolarHBondContact O-OG 3.15Å; S355-K359 WeakPolarHBondContact O-CA 3.46Å; S355-K359 PolarHBondContact O-N 2.89Å; S355-D360 PolarHBondContact O-N 3.04Å; S355-D360 PolarHBondContact OG-OD1 3.38Å
356	E	85.7	Confident	84.5	Confident	114 Å²	114	46.2 Å²	46.2	53%	0.533	21%	0.21	S	C	.	.	H	α-helix	trans	-64.8	-41.9	-180	-69.4	168.1	-173.3	0	0	112.7	K352 R353 K359	K352-E356 WeakPolarHBondContact CE-OE1 3.27Å; K352-E356 WeakPolarHBondContact CG-OE1 3.44Å; K352-E356 WeakPolarHBondContact O-CG 3.35Å; K352-E356 PolarHBondContact O-N 3.19Å; R353-E356 PolarHBondContact O-N 2.79Å; E356-K359 PolarHBondContact O-N 2.99Å
357	H	83.6	Confident	85.6	Confident	65 Å²	65	46.6 Å²	46.6	30%	0.301	21%	0.211	S	C	.	.	H	α-helix	trans	-74.5	-42.1	178.1	-71.7	-34.8	0	0	0	113	V320 R353 K359 I363	V320-H357 HydrophobicContact CG2-CB 4.44Å; R353-H357 WeakPolarHBondContact O-CB 3.34Å; R353-H357 PolarHBondContact O-CD2 3.41Å; R353-H357 PolarHBondContact O-N 3.02Å; H357-K359 PolarHBondContact O-N 2.56Å; H357-I363 WeakPolarHBondContact O-CD1 3.43Å
358	S	84.2	Confident	86.5	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-68.7	-12.9	173.8	70.2	0	0	0	0	113.5	W354 S355 G361 E362 I363	W354-S358 WeakPolarHBondContact O-CB 3.34Å; W354-S358 PolarHBondContact O-N 2.99Å; W354-S358 PolarHBondContact O-OG 2.86Å; S355-S358 PolarHBondContact O-OG 3.15Å; S358-G361 PolarHBondContact OG-N 3.08Å; S358-E362 PolarHBondContact O-N 3.46Å; S358-I363 WeakPolarHBondContact O-CG1 3.41Å; S358-I363 PolarHBondContact O-N 3.46Å; S358-I363 VanDerWaalsContact O-N 3.09Å
359	K	87.3	Confident	87.4	Confident	89 Å²	89	47.8 Å²	47.8	39%	0.387	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.6	55.1	-172.1	-44.7	-177.8	-159	95.9	0	111.2	S355 E356 H357 G361 E362 I363	S355-K359 WeakPolarHBondContact O-CA 3.46Å; S355-K359 PolarHBondContact O-N 2.89Å; E356-K359 PolarHBondContact O-N 2.99Å; H357-K359 PolarHBondContact O-N 2.56Å; K359-G361 PolarHBondContact O-N 3.49Å; K359-E362 HydrophobicContact CB-CB 4.25Å; K359-E362 WeakPolarHBondContact O-CG 2.89Å; K359-E362 PolarHBondContact O-N 2.76Å; K359-E362 VanDerWaalsContact O-N 3.12Å; K359-I363 HydrophobicContact CG-CD1 4.49Å; K359-I363 VanDerWaalsContact NZ-CG1 3.29Å
360	D	86.5	Confident	88	Confident	94 Å²	94	45.5 Å²	45.5	50%	0.503	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	50	38.8	-175.6	-60.1	-45	0	0	0	113	S355 S449	S355-D360 PolarHBondContact O-N 3.04Å; S355-D360 PolarHBondContact OG-OD1 3.38Å; D360-S449 PolarHBondContact O-OG 2.99Å
361	G	87.9	Confident	88.6	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	97.3	-12.8	178.9	0	0	0	0	0	116.5	S358 K359 I363 Y364 H365 Y416	S358-G361 PolarHBondContact OG-N 3.08Å; K359-G361 PolarHBondContact O-N 3.49Å; G361-I363 PolarHBondContact O-N 2.94Å; G361-Y364 PolarHBondContact O-N 3.1Å; G361-H365 PolarHBondContact O-CD2 2.93Å; G361-H365 PolarHBondContact O-N 3.48Å; G361-Y416 WeakPolarHBondContact CA-OH 3.38Å
362	E	91.9	Very high	88.9	Confident	87 Å²	87	47.2 Å²	47.2	41%	0.407	22%	0.222	S	C	.	.	H	α-helix	trans	-59.1	-25.5	-174.5	-69.3	-57.4	131.2	0	0	114.7	S358 K359 H365 N366 K456	S358-E362 PolarHBondContact O-N 3.46Å; K359-E362 HydrophobicContact CB-CB 4.25Å; K359-E362 WeakPolarHBondContact O-CG 2.89Å; K359-E362 PolarHBondContact O-N 2.76Å; K359-E362 VanDerWaalsContact O-N 3.12Å; E362-H365 PolarHBondContact O-N 2.71Å; E362-H365 IonicContact OE1-CE1 3.7Å; E362-H365 PolarHBondContact OE1-CE1 2.79Å; E362-H365 IonicContact OE1-ND1 2.66Å; E362-H365 PolarHBondContact OE1-ND1 3.24Å; E362-H365 IonicContact OE2-ND1 2.68Å; E362-H365 PolarHBondContact OE2-ND1 3.21Å; E362-N366 PolarHBondContact O-N 3.24Å; E362-K456 IonicContact OE1-NZ 3.51Å; E362-K456 PolarHBondContact OE1-NZ 2.89Å; E362-K456 IonicContact OE2-NZ 3.73Å; E362-K456 PolarHBondContact OE2-NZ 3.29Å
363	I	92.9	Very high	89.4	Confident	8 Å²	8	43.9 Å²	43.9	4%	0.041	22%	0.216	C	C	.	.	H	α-helix	trans	-68.1	-38.9	174	-68.9	-179.1	0	0	0	111.9	N313 D316 L317 V320 H357 S358 K359 G361 Y367	N313-I363 PolarHBondContact ND2-O 2.9Å; D316-I363 HydrophobicContact CB-CD1 4.31Å; D316-I363 HydrophobicContact CB-CG2 3.78Å; L317-I363 HydrophobicContact CD2-CG2 3.96Å; L317-I363 HydrophobicContact CG-CG2 4.26Å; V320-I363 HydrophobicContact CG2-CD1 3.69Å; V320-I363 HydrophobicContact CG2-CG2 4.34Å; H357-I363 WeakPolarHBondContact O-CD1 3.43Å; S358-I363 WeakPolarHBondContact O-CG1 3.41Å; S358-I363 PolarHBondContact O-N 3.46Å; S358-I363 VanDerWaalsContact O-N 3.09Å; K359-I363 HydrophobicContact CG-CD1 4.49Å; K359-I363 VanDerWaalsContact NZ-CG1 3.29Å; G361-I363 PolarHBondContact O-N 2.94Å; I363-Y367 PolarHBondContact O-N 3.08Å
364	Y	93.3	Very high	89.9	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-72.2	-36.8	171.8	-62.4	-91.4	0	0	0	110.6	L317 V320 W354 G361 N366 Y367 C368 Y416	L317-Y364 HydrophobicContact CD2-CD1 3.55Å; L317-Y364 HydrophobicContact CD2-CE1 3.69Å; L317-Y364 HydrophobicContact CD2-CG 4.04Å; V320-Y364 HydrophobicContact CG1-CE2 4.19Å; W354-Y364 AromaticContact CZ2-CE2 3.78Å; W354-Y364 HydrophobicContact CZ2-CE2 3.78Å; W354-Y364 AromaticContact NE1-CE2 3.98Å; W354-Y364 PolarHBondContact NE1-OH 3.21Å; G361-Y364 PolarHBondContact O-N 3.1Å; Y364-N366 PolarHBondContact O-N 3.34Å; Y364-Y367 PolarHBondContact O-N 3.24Å; Y364-C368 WeakPolarHBondContact O-CB 3.46Å; Y364-C368 PolarHBondContact O-N 3.45Å; Y364-C368 PolarHBondContact O-SG 3.38Å; Y364-Y416 AromaticContact CD1-CD2 3.62Å; Y364-Y416 HydrophobicContact CD1-CD2 3.62Å; Y364-Y416 HydrophobicContact CD1-CE2 4.43Å; Y364-Y416 HydrophobicContact CD1-CG 4.03Å; Y364-Y416 AromaticContact CD2-CD2 3.53Å; Y364-Y416 HydrophobicContact CD2-CD2 3.53Å; Y364-Y416 AromaticContact CD2-CE2 3.49Å; Y364-Y416 HydrophobicContact CD2-CE2 3.49Å; Y364-Y416 VanDerWaalsContact CD2-CE2 3.49Å; Y364-Y416 HydrophobicContact CD2-CG 4.48Å; Y364-Y416 HydrophobicContact CE1-CD2 4.01Å; Y364-Y416 AromaticContact CE2-CD2 3.92Å; Y364-Y416 HydrophobicContact CE2-CD2 3.92Å; Y364-Y416 AromaticContact CE2-CE2 3.98Å; Y364-Y416 HydrophobicContact CE2-CE2 3.98Å; Y364-Y416 AromaticContact CG-CD2 3.36Å; Y364-Y416 HydrophobicContact CG-CD2 3.36Å; Y364-Y416 AromaticContact CG-CE2 3.76Å; Y364-Y416 HydrophobicContact CG-CE2 3.76Å; Y364-Y416 AromaticContact CG-CG 3.91Å; Y364-Y416 HydrophobicContact CG-CG 3.91Å
365	H	94.1	Very high	90.1	Very high	1 Å²	1	38.1 Å²	38.1	1%	0.005	20%	0.196	C	C	.	.	H	α-helix	trans	-58.1	-46.9	175.4	-60.2	164.5	0	0	0	112.2	G361 E362 Y367 C368 L369 S449 L453 K456	G361-H365 PolarHBondContact O-CD2 2.93Å; G361-H365 PolarHBondContact O-N 3.48Å; E362-H365 PolarHBondContact O-N 2.71Å; E362-H365 IonicContact OE1-CE1 3.7Å; E362-H365 PolarHBondContact OE1-CE1 2.79Å; E362-H365 IonicContact OE1-ND1 2.66Å; E362-H365 PolarHBondContact OE1-ND1 3.24Å; E362-H365 IonicContact OE2-ND1 2.68Å; E362-H365 PolarHBondContact OE2-ND1 3.21Å; H365-Y367 VanDerWaalsContact C-N 3.3Å; H365-Y367 PolarHBondContact O-N 3.12Å; H365-C368 PolarHBondContact O-N 3.23Å; H365-L369 WeakPolarHBondContact O-CB 3.49Å; H365-L369 WeakPolarHBondContact O-CD1 3.34Å; H365-L369 VanDerWaalsContact O-CG 3.23Å; H365-L369 WeakPolarHBondContact O-CG 3.43Å; H365-L369 PolarHBondContact O-N 2.8Å; H365-S449 PolarHBondContact CE1-OG 2.71Å; H365-S449 PolarHBondContact NE2-O 3Å; H365-S449 VanDerWaalsContact NE2-O 3.16Å; H365-S449 PolarHBondContact NE2-OG 3.29Å; H365-S449 VanDerWaalsContact NE2-OG 3.13Å; H365-L453 HydrophobicContact CB-CD1 4.14Å; H365-K456 PolarHBondContact ND1-NZ 3.12Å
366	N	93.3	Very high	90.5	Very high	80 Å²	80	42.4 Å²	42.4	43%	0.428	22%	0.218	S	C	.	.	H	α-helix	trans	-62	-37.6	178.8	-170.8	92.2	0	0	0	112.1	N313 E362 Y364 N370	N313-N366 PolarHBondContact OD1-ND2 2.8Å; E362-N366 PolarHBondContact O-N 3.24Å; Y364-N366 PolarHBondContact O-N 3.34Å; N366-N370 PolarHBondContact ND2-ND2 3.41Å; N366-N370 PolarHBondContact O-N 2.93Å; N366-N370 PolarHBondContact O-ND2 3.25Å
367	Y	94	Very high	90.9	Very high	8 Å²	8	39.2 Å²	39.2	3%	0.031	20%	0.201	C	C	.	.	H	α-helix	trans	-68.5	-54.1	177	-174.4	-90.8	0	0	0	111.1	F311 N313 L317 I363 Y364 H365 L369 N370 Y371 L409 P412	F311-Y367 WeakPolarHBondContact O-CE2 3.15Å; N313-Y367 WeakPolarHBondContact OD1-CA 3.36Å; N313-Y367 PolarHBondContact OD1-N 3.36Å; N313-Y367 VanDerWaalsContact OD1-N 3.12Å; L317-Y367 HydrophobicContact CD1-CD1 4.26Å; L317-Y367 HydrophobicContact CD1-CD2 3.47Å; L317-Y367 VanDerWaalsContact CD1-CD2 3.47Å; L317-Y367 HydrophobicContact CD1-CE2 4.05Å; L317-Y367 HydrophobicContact CD1-CG 3.59Å; I363-Y367 PolarHBondContact O-N 3.08Å; Y364-Y367 PolarHBondContact O-N 3.24Å; H365-Y367 VanDerWaalsContact C-N 3.3Å; H365-Y367 PolarHBondContact O-N 3.12Å; Y367-L369 VanDerWaalsContact C-N 3.27Å; Y367-L369 PolarHBondContact O-N 3.43Å; Y367-N370 PolarHBondContact O-N 2.96Å; Y367-Y371 PolarHBondContact O-N 2.99Å; Y367-L409 WeakPolarHBondContact CE1-O 3.25Å; Y367-L409 PolarHBondContact OH-O 3.42Å; Y367-P412 HydrophobicContact CD1-CB 3.88Å; Y367-P412 HydrophobicContact CD1-CG 4.18Å; Y367-P412 HydrophobicContact CE1-CB 3.81Å; Y367-P412 HydrophobicContact CE1-CG 3.64Å
368	C	93.1	Very high	91.3	Very high	7 Å²	7	36.1 Å²	36.1	5%	0.047	19%	0.187	C	C	.	.	H	α-helix	trans	-66.5	-24.9	-174.3	-62.7	0	0	0	0	113.6	Y364 H365 L453 M457	Y364-C368 WeakPolarHBondContact O-CB 3.46Å; Y364-C368 PolarHBondContact O-N 3.45Å; Y364-C368 PolarHBondContact O-SG 3.38Å; H365-C368 PolarHBondContact O-N 3.23Å; C368-L453 HydrophobicContact CB-CD1 4.17Å; C368-L453 HydrophobicContact CB-CD2 3.8Å; C368-M457 HydrophobicContact CB-CE 3.6Å; C368-M457 WeakPolarHBondContact O-CE 3.34Å
369	L	91.7	Very high	91.7	Very high	41 Å²	41	39 Å²	39	22%	0.215	20%	0.202	C	C	.	.	H	α-helix	trans	-76	-31	171.5	-70.3	168.3	0	0	0	112.9	H365 Y367 L453 K456 M457 L460	H365-L369 WeakPolarHBondContact O-CB 3.49Å; H365-L369 WeakPolarHBondContact O-CD1 3.34Å; H365-L369 VanDerWaalsContact O-CG 3.23Å; H365-L369 WeakPolarHBondContact O-CG 3.43Å; H365-L369 PolarHBondContact O-N 2.8Å; Y367-L369 VanDerWaalsContact C-N 3.27Å; Y367-L369 PolarHBondContact O-N 3.43Å; L369-L453 HydrophobicContact CD2-CD1 4.31Å; L369-L453 HydrophobicContact CG-CD1 4.06Å; L369-K456 HydrophobicContact CD1-CB 4.22Å; L369-K456 HydrophobicContact CD1-CD 4.22Å; L369-K456 HydrophobicContact CD2-CB 3.98Å; L369-M457 HydrophobicContact CD2-CB 4.48Å; L369-M457 HydrophobicContact CD2-CG 3.84Å; L369-L460 HydrophobicContact CB-CD2 4.46Å; L369-L460 HydrophobicContact CD2-CD2 4.11Å
370	N	91.7	Very high	91.9	Very high	72 Å²	72	37.1 Å²	37.1	39%	0.385	20%	0.2	S	C	.	.	H	α-helix	trans	-87.7	-15	178	-72.4	-57.9	0	0	0	113.5	N366 Y367 D372 S373 A374	N366-N370 PolarHBondContact ND2-ND2 3.41Å; N366-N370 PolarHBondContact O-N 2.93Å; N366-N370 PolarHBondContact O-ND2 3.25Å; Y367-N370 PolarHBondContact O-N 2.96Å; N370-D372 VanDerWaalsContact C-N 3.27Å; N370-D372 PolarHBondContact O-N 2.76Å; N370-S373 WeakPolarHBondContact O-CB 3.37Å; N370-S373 PolarHBondContact O-N 3.02Å; N370-S373 VanDerWaalsContact O-N 3.1Å; N370-A374 PolarHBondContact O-N 3.44Å
371	Y	92.7	Very high	92.1	Very high	24 Å²	24	32.8 Å²	32.8	9%	0.094	18%	0.177	C	C	.	.	H	α-helix	trans	-50.3	-41.6	-179	172.2	-101.2	0	0	0	113.7	Y367 A374 L375 L409 V410 M413	Y367-Y371 PolarHBondContact O-N 2.99Å; Y371-A374 WeakPolarHBondContact O-CB 3.23Å; Y371-A374 PolarHBondContact O-N 3.36Å; Y371-L375 HydrophobicContact CD1-CD1 4.36Å; Y371-L375 HydrophobicContact CE1-CD1 3.59Å; Y371-L375 HydrophobicContact CE1-CG 4.14Å; Y371-L375 HydrophobicContact CE2-CD1 4.39Å; Y371-L375 HydrophobicContact CE2-CD2 4.32Å; Y371-L375 HydrophobicContact CE2-CG 4.21Å; Y371-L375 PolarHBondContact O-N 3.32Å; Y371-L409 HydrophobicContact CE2-CB 4.16Å; Y371-L409 WeakPolarHBondContact CE2-O 3.25Å; Y371-V410 HydrophobicContact CE2-CB 3.96Å; Y371-V410 HydrophobicContact CE2-CG2 4.27Å; Y371-V410 WeakPolarHBondContact OH-CB 3.42Å; Y371-V410 WeakPolarHBondContact OH-CG2 3.48Å; Y371-M413 HydrophobicContact CD1-SD 4.33Å
372	D	89.2	Confident	92.2	Very high	20 Å²	20	35.9 Å²	35.9	11%	0.107	19%	0.189	C	C	.	.	H	α-helix	trans	-68	-41.5	-179.6	-147.6	67.3	0	0	0	112.2	N370 A374 L375 N376 R891	N370-D372 VanDerWaalsContact C-N 3.27Å; N370-D372 PolarHBondContact O-N 2.76Å; D372-A374 VanDerWaalsContact C-N 3.29Å; D372-A374 PolarHBondContact O-N 3.1Å; D372-L375 PolarHBondContact O-N 3.04Å; D372-N376 PolarHBondContact O-N 3.42Å; D372-N376 PolarHBondContact O-ND2 3.38Å; D372-R891 VanDerWaalsContact CG-NH2 3.35Å; D372-R891 IonicContact OD1-CZ 3.81Å; D372-R891 IonicContact OD1-NE 3.59Å; D372-R891 PolarHBondContact OD1-NE 2.96Å; D372-R891 IonicContact OD1-NH1 3.58Å; D372-R891 PolarHBondContact OD1-NH1 3.44Å; D372-R891 IonicContact OD1-NH2 3.76Å; D372-R891 PolarHBondContact OD1-NH2 3.35Å; D372-R891 IonicContact OD2-CZ 3.08Å; D372-R891 IonicContact OD2-NH1 2.76Å; D372-R891 PolarHBondContact OD2-NH1 2.88Å; D372-R891 IonicContact OD2-NH2 2.93Å; D372-R891 PolarHBondContact OD2-NH2 3.01Å
373	S	91.1	Very high	92.1	Very high	63 Å²	63	39.7 Å²	39.7	44%	0.441	20%	0.204	S	C	.	.	H	α-helix	trans	-63.4	-37	172.4	-58.8	0	0	0	0	111.5	N370 Y377	N370-S373 WeakPolarHBondContact O-CB 3.37Å; N370-S373 PolarHBondContact O-N 3.02Å; N370-S373 VanDerWaalsContact O-N 3.1Å; S373-Y377 VanDerWaalsContact O-CB 3.24Å; S373-Y377 WeakPolarHBondContact O-CB 3.42Å; S373-Y377 PolarHBondContact O-N 2.84Å
374	A	93.1	Very high	91.9	Very high	7 Å²	7	43 Å²	43	6%	0.058	22%	0.221	C	C	.	.	H	α-helix	trans	-67.3	-40.2	176.4	0	0	0	0	0	112.5	H309 N370 Y371 D372 Y377 L378	H309-A374 WeakPolarHBondContact O-CA 3.35Å; H309-A374 WeakPolarHBondContact O-CB 3.24Å; N370-A374 PolarHBondContact O-N 3.44Å; Y371-A374 WeakPolarHBondContact O-CB 3.23Å; Y371-A374 PolarHBondContact O-N 3.36Å; D372-A374 VanDerWaalsContact C-N 3.29Å; D372-A374 PolarHBondContact O-N 3.1Å; A374-Y377 PolarHBondContact O-N 3.24Å; A374-L378 WeakPolarHBondContact O-CB 3.35Å; A374-L378 PolarHBondContact O-N 3.46Å
375	L	92.7	Very high	91.6	Very high	6 Å²	6	50.1 Å²	50.1	3%	0.031	25%	0.254	C	S	.	.	H	α-helix	trans	-64.1	-50	172	-73.5	-173.7	0	0	0	112	Y371 D372 Y377 L378 D379 T406	Y371-L375 HydrophobicContact CD1-CD1 4.36Å; Y371-L375 HydrophobicContact CE1-CD1 3.59Å; Y371-L375 HydrophobicContact CE1-CG 4.14Å; Y371-L375 HydrophobicContact CE2-CD1 4.39Å; Y371-L375 HydrophobicContact CE2-CD2 4.32Å; Y371-L375 HydrophobicContact CE2-CG 4.21Å; Y371-L375 PolarHBondContact O-N 3.32Å; D372-L375 PolarHBondContact O-N 3.04Å; L375-Y377 PolarHBondContact O-N 3.07Å; L375-L378 WeakPolarHBondContact O-CB 3.45Å; L375-L378 PolarHBondContact O-N 2.83Å; L375-L378 VanDerWaalsContact O-N 3.09Å; L375-D379 PolarHBondContact O-N 3.07Å; L375-T406 HydrophobicContact CD2-CG2 4.11Å
376	N	91	Very high	91.3	Very high	104 Å²	104	53.5 Å²	53.5	56%	0.556	27%	0.27	S	S	*	.	H	α-helix	trans	-59.3	-34	177.4	-77.7	-70.7	0	0	0	111.8	D372 S380	D372-N376 PolarHBondContact O-N 3.42Å; D372-N376 PolarHBondContact O-ND2 3.38Å; N376-S380 PolarHBondContact O-N 2.9Å
377	Y	92.8	Very high	91.1	Very high	48 Å²	48	49.7 Å²	49.7	19%	0.188	25%	0.25	C	C	.	.	H	α-helix	trans	-70.7	-45.4	172.9	-173.5	-128.5	0	0	0	112.1	F304 V305 E306 H309 L310 S373 A374 L375 D379 S380 L381	F304-Y377 PolarHBondContact O-OH 3.2Å; F304-Y377 VanDerWaalsContact O-OH 3.08Å; V305-Y377 WeakPolarHBondContact CA-OH 3.23Å; E306-Y377 PolarHBondContact N-OH 3.02Å; H309-Y377 HydrophobicContact CB-CD1 3.66Å; H309-Y377 HydrophobicContact CB-CE1 3.74Å; H309-Y377 HydrophobicContact CB-CG 4.3Å; L310-Y377 HydrophobicContact CB-CD1 4.22Å; L310-Y377 HydrophobicContact CB-CE1 4.4Å; S373-Y377 VanDerWaalsContact O-CB 3.24Å; S373-Y377 WeakPolarHBondContact O-CB 3.42Å; S373-Y377 PolarHBondContact O-N 2.84Å; A374-Y377 PolarHBondContact O-N 3.24Å; L375-Y377 PolarHBondContact O-N 3.07Å; Y377-D379 VanDerWaalsContact C-N 3.34Å; Y377-D379 PolarHBondContact O-N 3.11Å; Y377-S380 CarbonylContact O-C 3.51Å; Y377-S380 WeakPolarHBondContact O-CA 3.21Å; Y377-S380 VanDerWaalsContact O-CB 3.3Å; Y377-S380 WeakPolarHBondContact O-CB 3.38Å; Y377-S380 PolarHBondContact O-N 2.8Å; Y377-S380 PolarHBondContact O-OG 3.18Å; Y377-L381 HydrophobicContact CD1-CD1 4.03Å; Y377-L381 HydrophobicContact CE1-CD1 3.76Å; Y377-L381 HydrophobicContact CE1-CG 4.35Å; Y377-L381 HydrophobicContact CE2-CD2 4.12Å; Y377-L381 HydrophobicContact CE2-CG 4.28Å; Y377-L381 WeakPolarHBondContact O-CG 3.48Å; Y377-L381 PolarHBondContact O-N 3.11Å
378	L	92.9	Very high	90.9	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-56.5	-45.1	174.5	177.8	56.7	0	0	0	112	L310 A374 L375 S380 L381 R382 F387 L405 T406 L409	L310-L378 HydrophobicContact CD1-CB 3.89Å; L310-L378 HydrophobicContact CD1-CD1 4.23Å; L310-L378 HydrophobicContact CD1-CG 4.48Å; A374-L378 WeakPolarHBondContact O-CB 3.35Å; A374-L378 PolarHBondContact O-N 3.46Å; L375-L378 WeakPolarHBondContact O-CB 3.45Å; L375-L378 PolarHBondContact O-N 2.83Å; L375-L378 VanDerWaalsContact O-N 3.09Å; L378-S380 PolarHBondContact O-N 3.17Å; L378-L381 PolarHBondContact O-N 2.8Å; L378-R382 HydrophobicContact CD1-CG 4.17Å; L378-R382 WeakPolarHBondContact O-CG 3.23Å; L378-R382 PolarHBondContact O-N 2.87Å; L378-F387 HydrophobicContact CD1-CE1 3.5Å; L378-F387 VanDerWaalsContact CD1-CE1 3.5Å; L378-F387 HydrophobicContact CD1-CZ 3.79Å; L378-L405 HydrophobicContact CD1-CD2 3.78Å; L378-L405 HydrophobicContact CD2-CD2 4.17Å; L378-L405 HydrophobicContact CD2-CG 4.21Å; L378-T406 HydrophobicContact CD2-CG2 3.88Å; L378-L409 HydrophobicContact CD2-CD1 3.91Å
379	D	92	Very high	90.7	Very high	61 Å²	61	53.3 Å²	53.3	33%	0.326	27%	0.268	S	S	.	.	H	α-helix	trans	-70.5	-14.4	175.6	-73.2	-17.8	0	0	0	113.1	L375 Y377 R382 K383	L375-D379 PolarHBondContact O-N 3.07Å; Y377-D379 VanDerWaalsContact C-N 3.34Å; Y377-D379 PolarHBondContact O-N 3.11Å; D379-R382 IonicContact OD1-NH1 2.77Å; D379-R382 PolarHBondContact OD1-NH1 2.62Å; D379-K383 WeakPolarHBondContact O-CE 3.39Å; D379-K383 PolarHBondContact O-NZ 3.3Å
380	S	92.1	Very high	90.6	Very high	48 Å²	48	51.4 Å²	51.4	34%	0.336	26%	0.258	S	S	.	.	H	α-helix	trans	-80.5	-37.4	165.5	87.1	0	0	0	0	112	N376 Y377 L378 K383	N376-S380 PolarHBondContact O-N 2.9Å; Y377-S380 CarbonylContact O-C 3.51Å; Y377-S380 WeakPolarHBondContact O-CA 3.21Å; Y377-S380 VanDerWaalsContact O-CB 3.3Å; Y377-S380 WeakPolarHBondContact O-CB 3.38Å; Y377-S380 PolarHBondContact O-N 2.8Å; Y377-S380 PolarHBondContact O-OG 3.18Å; L378-S380 PolarHBondContact O-N 3.17Å; S380-K383 WeakPolarHBondContact O-CB 3.23Å
381	L	90.3	Very high	90.5	Very high	4 Å²	4	48.4 Å²	48.4	2%	0.021	24%	0.241	C	C	.	.	H	α-helix	trans	-72.7	-38.2	179.1	-65.2	176.2	0	0	0	112.5	F304 V305 L310 Y377 L378 K383 L384 F387	F304-L381 HydrophobicContact CD2-CD2 3.91Å; F304-L381 HydrophobicContact CE2-CD2 4.03Å; V305-L381 HydrophobicContact CG1-CD1 3.82Å; V305-L381 HydrophobicContact CG2-CD1 4.34Å; V305-L381 HydrophobicContact CG2-CD2 4.08Å; L310-L381 HydrophobicContact CD2-CD1 4.37Å; Y377-L381 HydrophobicContact CD1-CD1 4.03Å; Y377-L381 HydrophobicContact CE1-CD1 3.76Å; Y377-L381 HydrophobicContact CE1-CG 4.35Å; Y377-L381 HydrophobicContact CE2-CD2 4.12Å; Y377-L381 HydrophobicContact CE2-CG 4.28Å; Y377-L381 WeakPolarHBondContact O-CG 3.48Å; Y377-L381 PolarHBondContact O-N 3.11Å; L378-L381 PolarHBondContact O-N 2.8Å; L381-K383 PolarHBondContact O-N 3.11Å; L381-L384 VanDerWaalsContact O-CB 3.3Å; L381-L384 WeakPolarHBondContact O-CB 3.14Å; L381-L384 PolarHBondContact O-N 3.48Å; L381-F387 HydrophobicContact CB-CB 4.42Å; L381-F387 HydrophobicContact CB-CD1 3.77Å; L381-F387 HydrophobicContact CB-CD2 4.05Å; L381-F387 HydrophobicContact CB-CE1 4.02Å; L381-F387 HydrophobicContact CB-CE2 4.27Å; L381-F387 HydrophobicContact CB-CG 3.78Å; L381-F387 HydrophobicContact CB-CZ 4.26Å; L381-F387 HydrophobicContact CD1-CD2 4.15Å; L381-F387 HydrophobicContact CD1-CE2 3.78Å; L381-F387 HydrophobicContact CD1-CZ 4.03Å
382	R	90.6	Very high	90.3	Very high	65 Å²	65	53.7 Å²	53.7	25%	0.245	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-8.9	176	-76.4	170.9	169.1	175.2	-8.7	114.8	L378 D379 L384 F387 N388 E391	L378-R382 HydrophobicContact CD1-CG 4.17Å; L378-R382 WeakPolarHBondContact O-CG 3.23Å; L378-R382 PolarHBondContact O-N 2.87Å; D379-R382 IonicContact OD1-NH1 2.77Å; D379-R382 PolarHBondContact OD1-NH1 2.62Å; R382-L384 VanDerWaalsContact C-N 3.27Å; R382-F387 HydrophobicContact CG-CD1 4.42Å; R382-F387 HydrophobicContact CG-CE1 4.44Å; R382-N388 WeakPolarHBondContact CA-OD1 3.37Å; R382-N388 PolarHBondContact O-ND2 2.86Å; R382-N388 PolarHBondContact O-OD1 2.94Å; R382-E391 WeakPolarHBondContact CG-OE2 3.31Å; R382-E391 IonicContact CZ-OE1 2.67Å; R382-E391 VanDerWaalsContact CZ-OE1 3.31Å; R382-E391 IonicContact CZ-OE2 2.86Å; R382-E391 IonicContact NE-OE1 2.73Å; R382-E391 PolarHBondContact NE-OE1 2.86Å; R382-E391 VanDerWaalsContact NE-OE1 3.1Å; R382-E391 IonicContact NE-OE2 3.84Å; R382-E391 PolarHBondContact NE-OE2 3.12Å; R382-E391 IonicContact NH2-OE1 3.87Å; R382-E391 PolarHBondContact NH2-OE1 2.95Å; R382-E391 IonicContact NH2-OE2 2.64Å
383	K	89.5	Confident	90.2	Very high	166 Å²	166	55.7 Å²	55.7	72%	0.722	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.9	-6.7	169.9	-62.6	168.1	179.3	116.8	0	112.7	D379 S380 L381	D379-K383 WeakPolarHBondContact O-CE 3.39Å; D379-K383 PolarHBondContact O-NZ 3.3Å; S380-K383 WeakPolarHBondContact O-CB 3.23Å; L381-K383 PolarHBondContact O-N 3.11Å
384	L	89.7	Confident	90	Very high	77 Å²	77	52.7 Å²	52.7	40%	0.403	25%	0.25	S	S	.	.	S	Bend	trans	-109.6	118.4	-178.2	-55.3	173.8	0	0	0	109.6	F304 L381 R382 H386 F387 N388	F304-L384 HydrophobicContact CD2-CD1 3.59Å; F304-L384 HydrophobicContact CE2-CB 4.48Å; F304-L384 HydrophobicContact CE2-CD1 3.39Å; F304-L384 HydrophobicContact CG-CD1 4.3Å; F304-L384 HydrophobicContact CZ-CB 4.46Å; F304-L384 HydrophobicContact CZ-CD1 3.94Å; L381-L384 VanDerWaalsContact O-CB 3.3Å; L381-L384 WeakPolarHBondContact O-CB 3.14Å; L381-L384 PolarHBondContact O-N 3.48Å; R382-L384 VanDerWaalsContact C-N 3.27Å; L384-H386 VanDerWaalsContact C-N 3.32Å; L384-H386 PolarHBondContact O-N 3.39Å; L384-F387 HydrophobicContact CB-CB 4.44Å; L384-F387 WeakPolarHBondContact O-CB 3.34Å; L384-F387 PolarHBondContact O-N 3.49Å; L384-N388 PolarHBondContact O-N 2.09Å
385	E	86.6	Confident	89.8	Confident	150 Å²	150	54.6 Å²	54.6	70%	0.701	26%	0.258	S	S	*	.	H	α-helix	trans	-54.6	-44.2	-174.2	-171.6	166.4	-150.3	0	0	113	F387 N388 E389	E385-F387 VanDerWaalsContact C-N 3.26Å; E385-F387 PolarHBondContact O-N 2.86Å; E385-N388 CarbonylContact O-C 3.59Å; E385-N388 WeakPolarHBondContact O-CA 3.22Å; E385-N388 WeakPolarHBondContact O-CB 3.28Å; E385-N388 PolarHBondContact O-N 3.28Å; E385-E389 PolarHBondContact O-N 2.92Å
386	H	86.6	Confident	89.4	Confident	72 Å²	72	61.6 Å²	61.6	33%	0.333	29%	0.29	S	S	.	.	H	α-helix	trans	-61	-28.2	176.3	-63.9	-36.5	0	0	0	114.8	L218 L302 L384 E389 F390	L218-H386 HydrophobicContact CD2-CB 3.76Å; L302-H386 HydrophobicContact CD2-CB 4.22Å; L384-H386 VanDerWaalsContact C-N 3.32Å; L384-H386 PolarHBondContact O-N 3.39Å; H386-E389 WeakPolarHBondContact CA-OE2 3.49Å; H386-E389 IonicContact CE1-OE2 2.86Å; H386-E389 IonicContact CG-OE2 3.48Å; H386-E389 IonicContact ND1-OE2 3.93Å; H386-E389 PolarHBondContact ND1-OE2 3.24Å; H386-F390 PolarHBondContact O-N 3.37Å
387	F	90.4	Very high	89	Confident	0 Å²	0	58 Å²	58	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-76.6	-37.1	173.1	-173.6	-91	0	0	0	110.8	F304 V305 L310 L378 L381 R382 L384 E385 F390 E391 L405	F304-F387 HydrophobicContact CE2-CB 4.42Å; V305-F387 HydrophobicContact CG1-CE2 4.42Å; V305-F387 HydrophobicContact CG2-CD2 3.85Å; V305-F387 HydrophobicContact CG2-CE2 4.2Å; L310-F387 HydrophobicContact CD2-CE2 4.34Å; L310-F387 HydrophobicContact CD2-CZ 4.13Å; L378-F387 HydrophobicContact CD1-CE1 3.5Å; L378-F387 VanDerWaalsContact CD1-CE1 3.5Å; L378-F387 HydrophobicContact CD1-CZ 3.79Å; L381-F387 HydrophobicContact CB-CB 4.42Å; L381-F387 HydrophobicContact CB-CD1 3.77Å; L381-F387 HydrophobicContact CB-CD2 4.05Å; L381-F387 HydrophobicContact CB-CE1 4.02Å; L381-F387 HydrophobicContact CB-CE2 4.27Å; L381-F387 HydrophobicContact CB-CG 3.78Å; L381-F387 HydrophobicContact CB-CZ 4.26Å; L381-F387 HydrophobicContact CD1-CD2 4.15Å; L381-F387 HydrophobicContact CD1-CE2 3.78Å; L381-F387 HydrophobicContact CD1-CZ 4.03Å; R382-F387 HydrophobicContact CG-CD1 4.42Å; R382-F387 HydrophobicContact CG-CE1 4.44Å; L384-F387 HydrophobicContact CB-CB 4.44Å; L384-F387 WeakPolarHBondContact O-CB 3.34Å; L384-F387 PolarHBondContact O-N 3.49Å; E385-F387 VanDerWaalsContact C-N 3.26Å; E385-F387 PolarHBondContact O-N 2.86Å; F387-F390 HydrophobicContact CD2-CD1 4.31Å; F387-F390 HydrophobicContact CE2-CD1 4.1Å; F387-F390 HydrophobicContact CE2-CE1 4.39Å; F387-F390 PolarHBondContact O-N 2.9Å; F387-E391 HydrophobicContact CD1-CB 4.46Å; F387-E391 HydrophobicContact CE1-CB 4.16Å; F387-E391 WeakPolarHBondContact O-CB 3.28Å; F387-E391 PolarHBondContact O-N 3.48Å; F387-L405 HydrophobicContact CZ-CD2 4.37Å
388	N	89.9	Confident	88.5	Confident	48 Å²	48	61.9 Å²	61.9	26%	0.257	30%	0.3	S	S	.	.	H	α-helix	trans	-67.5	-33.3	174.3	-64	-29.8	0	0	0	112.6	R382 L384 E385 K392	R382-N388 WeakPolarHBondContact CA-OD1 3.37Å; R382-N388 PolarHBondContact O-ND2 2.86Å; R382-N388 PolarHBondContact O-OD1 2.94Å; L384-N388 PolarHBondContact O-N 2.09Å; E385-N388 CarbonylContact O-C 3.59Å; E385-N388 WeakPolarHBondContact O-CA 3.22Å; E385-N388 WeakPolarHBondContact O-CB 3.28Å; E385-N388 PolarHBondContact O-N 3.28Å; N388-K392 WeakPolarHBondContact O-CB 2.98Å; N388-K392 WeakPolarHBondContact O-CD 3.22Å; N388-K392 VanDerWaalsContact O-CG 3.24Å; N388-K392 WeakPolarHBondContact O-CG 3.46Å; N388-K392 PolarHBondContact O-N 3.03Å
389	E	87.5	Confident	87.9	Confident	44 Å²	44	64.4 Å²	64.4	21%	0.206	31%	0.31	C	S	.	.	H	α-helix	trans	-60.5	-45.5	170.2	-71.4	177.4	127.1	0	0	110.6	S215 L218 E385 H386 W393	S215-E389 WeakPolarHBondContact CB-OE1 3.31Å; S215-E389 PolarHBondContact OG-OE1 3.38Å; L218-E389 HydrophobicContact CD2-CB 4.48Å; E385-E389 PolarHBondContact O-N 2.92Å; H386-E389 WeakPolarHBondContact CA-OE2 3.49Å; H386-E389 IonicContact CE1-OE2 2.86Å; H386-E389 IonicContact CG-OE2 3.48Å; H386-E389 IonicContact ND1-OE2 3.93Å; H386-E389 PolarHBondContact ND1-OE2 3.24Å; E389-W393 PolarHBondContact O-N 3.41Å
390	F	89.8	Confident	87.4	Confident	1 Å²	1	61.5 Å²	61.5	0%	0.004	29%	0.294	C	S	.	.	H	α-helix	trans	-68.3	-49.4	177	168.3	-101.4	0	0	0	113.4	L222 P292 L293 L296 L302 H386 F387 K392 W393 C394	L222-F390 HydrophobicContact CD2-CD2 4.01Å; P292-F390 HydrophobicContact CB-CE2 4.13Å; L293-F390 HydrophobicContact CB-CE1 4.33Å; L293-F390 HydrophobicContact CB-CE2 4.37Å; L293-F390 HydrophobicContact CB-CZ 3.74Å; L293-F390 HydrophobicContact CD1-CE1 4.33Å; L293-F390 HydrophobicContact CD1-CZ 4.37Å; L296-F390 HydrophobicContact CD1-CD2 3.49Å; L296-F390 VanDerWaalsContact CD1-CD2 3.49Å; L296-F390 HydrophobicContact CD1-CE2 3.65Å; L302-F390 HydrophobicContact CD1-CB 3.79Å; L302-F390 HydrophobicContact CD1-CD1 4.05Å; L302-F390 HydrophobicContact CD1-CD2 3.82Å; L302-F390 HydrophobicContact CD1-CE2 4.44Å; L302-F390 HydrophobicContact CD1-CG 3.6Å; H386-F390 PolarHBondContact O-N 3.37Å; F387-F390 HydrophobicContact CD2-CD1 4.31Å; F387-F390 HydrophobicContact CE2-CD1 4.1Å; F387-F390 HydrophobicContact CE2-CE1 4.39Å; F387-F390 PolarHBondContact O-N 2.9Å; F390-K392 VanDerWaalsContact C-N 3.3Å; F390-K392 PolarHBondContact O-N 2.94Å; F390-W393 WeakPolarHBondContact O-CB 3.33Å; F390-W393 PolarHBondContact O-N 2.94Å; F390-C394 WeakPolarHBondContact CE2-SG 3.42Å; F390-C394 WeakPolarHBondContact CZ-SG 3.47Å; F390-C394 PolarHBondContact O-N 3.49Å; F390-C394 PolarHBondContact O-SG 3.32Å
391	E	90.4	Very high	86.8	Confident	9 Å²	9	65.4 Å²	65.4	4%	0.042	30%	0.301	C	S	.	.	H	α-helix	trans	-57.3	-45	-179.6	-173.5	172	-160.4	0	0	110.6	R382 F387 W393 C394 E395 L405	R382-E391 WeakPolarHBondContact CG-OE2 3.31Å; R382-E391 IonicContact CZ-OE1 2.67Å; R382-E391 VanDerWaalsContact CZ-OE1 3.31Å; R382-E391 IonicContact CZ-OE2 2.86Å; R382-E391 IonicContact NE-OE1 2.73Å; R382-E391 PolarHBondContact NE-OE1 2.86Å; R382-E391 VanDerWaalsContact NE-OE1 3.1Å; R382-E391 IonicContact NE-OE2 3.84Å; R382-E391 PolarHBondContact NE-OE2 3.12Å; R382-E391 IonicContact NH2-OE1 3.87Å; R382-E391 PolarHBondContact NH2-OE1 2.95Å; R382-E391 IonicContact NH2-OE2 2.64Å; F387-E391 HydrophobicContact CD1-CB 4.46Å; F387-E391 HydrophobicContact CE1-CB 4.16Å; F387-E391 WeakPolarHBondContact O-CB 3.28Å; F387-E391 PolarHBondContact O-N 3.48Å; E391-W393 VanDerWaalsContact C-N 3.35Å; E391-W393 PolarHBondContact O-N 3.24Å; E391-C394 PolarHBondContact O-N 3.02Å; E391-E395 WeakPolarHBondContact O-CG 3.25Å; E391-E395 PolarHBondContact O-N 3.42Å; E391-L405 HydrophobicContact CG-CB 4.47Å; E391-L405 HydrophobicContact CG-CD2 4.36Å; E391-L405 WeakPolarHBondContact OE1-CB 3.47Å
392	K	87.9	Confident	86.4	Confident	134 Å²	134	76.6 Å²	76.6	58%	0.583	34%	0.343	S	S	*	.	H	α-helix	trans	-64.6	-33.3	175.1	-72.6	174.1	-178.2	176.4	0	113.8	N388 F390 Q396	N388-K392 WeakPolarHBondContact O-CB 2.98Å; N388-K392 WeakPolarHBondContact O-CD 3.22Å; N388-K392 VanDerWaalsContact O-CG 3.24Å; N388-K392 WeakPolarHBondContact O-CG 3.46Å; N388-K392 PolarHBondContact O-N 3.03Å; F390-K392 VanDerWaalsContact C-N 3.3Å; F390-K392 PolarHBondContact O-N 2.94Å; K392-Q396 WeakPolarHBondContact O-CG 3.15Å; K392-Q396 PolarHBondContact O-N 2.84Å; K392-Q396 PolarHBondContact O-NE2 3.39Å
393	W	87.7	Confident	86.2	Confident	62 Å²	62	76.2 Å²	76.2	24%	0.235	35%	0.346	C	S	.	.	H	α-helix	trans	-68.5	-42.3	175.6	-177.7	91.5	0	0	0	110.7	L222 L225 P292 E389 F390 E391 Q396	L222-W393 HydrophobicContact CB-CD2 4.32Å; L222-W393 HydrophobicContact CB-CG 4.16Å; L222-W393 HydrophobicContact CD1-CB 4.21Å; L222-W393 HydrophobicContact CD1-CG 4.32Å; L222-W393 HydrophobicContact CD2-CB 4.36Å; L222-W393 HydrophobicContact CD2-CD2 3.93Å; L222-W393 HydrophobicContact CD2-CE3 4.08Å; L222-W393 HydrophobicContact CD2-CG 4.06Å; L222-W393 HydrophobicContact CG-CG 4.42Å; L222-W393 WeakPolarHBondContact O-CZ2 3.4Å; L225-W393 HydrophobicContact CB-CH2 4.11Å; L225-W393 HydrophobicContact CB-CZ2 4.22Å; L225-W393 HydrophobicContact CD2-CH2 4.08Å; L225-W393 HydrophobicContact CD2-CZ3 4.22Å; P292-W393 HydrophobicContact CB-CZ3 4.26Å; E389-W393 PolarHBondContact O-N 3.41Å; F390-W393 WeakPolarHBondContact O-CB 3.33Å; F390-W393 PolarHBondContact O-N 2.94Å; E391-W393 VanDerWaalsContact C-N 3.35Å; E391-W393 PolarHBondContact O-N 3.24Å; W393-Q396 PolarHBondContact O-N 2.88Å
394	C	87	Confident	86.2	Confident	1 Å²	1	72.4 Å²	72.4	1%	0.007	33%	0.33	C	S	.	.	H	α-helix	trans	-66.7	-40.8	176.1	-59.7	0	0	0	0	112.7	C288 F289 F390 E391 Q396 D397 C400	C288-C394 PolarHBondContact O-SG 2.8Å; F289-C394 HydrophobicContact CD1-CB 3.43Å; F289-C394 VanDerWaalsContact CD1-CB 3.43Å; F289-C394 HydrophobicContact CD2-CB 4.44Å; F289-C394 HydrophobicContact CE1-CB 3.28Å; F289-C394 HydrophobicContact CE2-CB 4.31Å; F289-C394 HydrophobicContact CG-CB 4.04Å; F289-C394 HydrophobicContact CZ-CB 3.76Å; F390-C394 WeakPolarHBondContact CE2-SG 3.42Å; F390-C394 WeakPolarHBondContact CZ-SG 3.47Å; F390-C394 PolarHBondContact O-N 3.49Å; F390-C394 PolarHBondContact O-SG 3.32Å; E391-C394 PolarHBondContact O-N 3.02Å; C394-Q396 PolarHBondContact O-N 3.35Å; C394-D397 WeakPolarHBondContact O-CB 3.39Å; C394-D397 PolarHBondContact O-N 2.9Å; C394-C400 PolarHBondContact O-SG 2.75Å
395	E	87.7	Confident	86.3	Confident	47 Å²	47	68.8 Å²	68.8	22%	0.22	31%	0.312	C	S	.	.	H	α-helix	trans	-66.9	-19.3	176.2	-73.9	-175	156	0	0	113.6	F289 E391 Q404 L405	F289-E395 HydrophobicContact CZ-CG 4.34Å; E391-E395 WeakPolarHBondContact O-CG 3.25Å; E391-E395 PolarHBondContact O-N 3.42Å; E395-Q404 VanDerWaalsContact OE1-CA 3.23Å; E395-Q404 WeakPolarHBondContact OE1-CA 3.24Å; E395-Q404 VanDerWaalsContact OE1-CB 3.24Å; E395-Q404 WeakPolarHBondContact OE1-CB 3.23Å; E395-Q404 WeakPolarHBondContact OE1-CG 3.49Å; E395-Q404 PolarHBondContact OE1-NE2 3.04Å; E395-L405 PolarHBondContact OE1-N 3.3Å
396	Q	85.5	Confident	86.5	Confident	153 Å²	153	62.9 Å²	62.9	72%	0.715	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.6	-12.6	174.3	-80.4	168.8	85.4	0	0	113.8	K392 W393 C394 T398	K392-Q396 WeakPolarHBondContact O-CG 3.15Å; K392-Q396 PolarHBondContact O-N 2.84Å; K392-Q396 PolarHBondContact O-NE2 3.39Å; W393-Q396 PolarHBondContact O-N 2.88Å; C394-Q396 PolarHBondContact O-N 3.35Å; Q396-T398 PolarHBondContact O-N 2.68Å
397	D	83.3	Confident	86.8	Confident	29 Å²	29	61.7 Å²	61.7	16%	0.155	28%	0.282	C	S	.	.	S	Bend	trans	-64.7	129.8	176.3	-167.2	-50.8	0	0	0	110.3	C394 R399 C400	C394-D397 WeakPolarHBondContact O-CB 3.39Å; C394-D397 PolarHBondContact O-N 2.9Å; D397-R399 VanDerWaalsContact CG-NE 3.34Å; D397-R399 PolarHBondContact O-N 3.16Å; D397-R399 VanDerWaalsContact O-N 3.08Å; D397-R399 WeakPolarHBondContact OD1-CB 3.14Å; D397-R399 WeakPolarHBondContact OD1-CG 3.45Å; D397-R399 IonicContact OD1-CZ 2.86Å; D397-R399 PolarHBondContact OD1-N 3.28Å; D397-R399 IonicContact OD1-NE 2.71Å; D397-R399 PolarHBondContact OD1-NE 2.92Å; D397-R399 IonicContact OD2-CZ 3.47Å; D397-R399 VanDerWaalsContact OD2-CZ 3.27Å; D397-R399 IonicContact OD2-NE 3.43Å; D397-R399 PolarHBondContact OD2-NE 2.7Å; D397-R399 VanDerWaalsContact OD2-NE 3.08Å; D397-R399 IonicContact OD2-NH2 3.89Å; D397-R399 PolarHBondContact OD2-NH2 3.36Å; D397-C400 WeakPolarHBondContact O-CB 3.13Å; D397-C400 PolarHBondContact O-N 2.73Å
398	T	81.3	Confident	86.9	Confident	129 Å²	129	61.8 Å²	61.8	79%	0.791	28%	0.282	S	S	*	.	G	3₁₀ helix	trans	-58.1	-27.3	-178.3	56.8	0	0	0	0	112.5	Q396 C400 R401	Q396-T398 PolarHBondContact O-N 2.68Å; T398-C400 VanDerWaalsContact C-N 3.28Å; T398-C400 PolarHBondContact O-N 3.48Å; T398-R401 PolarHBondContact O-N 3.39Å; T398-R401 VanDerWaalsContact O-N 3.16Å
399	R	80.7	Confident	87	Confident	53 Å²	53	59.5 Å²	59.5	20%	0.2	27%	0.27	C	S	.	.	G	3₁₀ helix	trans	-67.4	-27.2	177.5	-59.4	175.7	-66.8	160.9	-1.4	112.5	S228 V284 C288 D397 R401	S228-R399 PolarHBondContact O-NH1 2.88Å; V284-R399 HydrophobicContact CG2-CB 4.33Å; V284-R399 WeakPolarHBondContact CG2-O 3.22Å; C288-R399 PolarHBondContact SG-NH2 3.1Å; C288-R399 VanDerWaalsContact SG-NH2 3.39Å; D397-R399 VanDerWaalsContact CG-NE 3.34Å; D397-R399 PolarHBondContact O-N 3.16Å; D397-R399 VanDerWaalsContact O-N 3.08Å; D397-R399 WeakPolarHBondContact OD1-CB 3.14Å; D397-R399 WeakPolarHBondContact OD1-CG 3.45Å; D397-R399 IonicContact OD1-CZ 2.86Å; D397-R399 PolarHBondContact OD1-N 3.28Å; D397-R399 IonicContact OD1-NE 2.71Å; D397-R399 PolarHBondContact OD1-NE 2.92Å; D397-R399 IonicContact OD2-CZ 3.47Å; D397-R399 VanDerWaalsContact OD2-CZ 3.27Å; D397-R399 IonicContact OD2-NE 3.43Å; D397-R399 PolarHBondContact OD2-NE 2.7Å; D397-R399 VanDerWaalsContact OD2-NE 3.08Å; D397-R399 IonicContact OD2-NH2 3.89Å; D397-R399 PolarHBondContact OD2-NH2 3.36Å; R399-R401 PolarHBondContact O-N 2.87Å
400	C	81	Confident	87.3	Confident	0 Å²	0	58 Å²	58	0%	0	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-70.1	-12.3	174.5	-62.8	0	0	0	0	113	V284 C394 D397 T398 R402 L403	V284-C400 HydrophobicContact CG1-CB 4.29Å; V284-C400 VanDerWaalsContact CG1-SG 3.59Å; C394-C400 PolarHBondContact O-SG 2.75Å; D397-C400 WeakPolarHBondContact O-CB 3.13Å; D397-C400 PolarHBondContact O-N 2.73Å; T398-C400 VanDerWaalsContact C-N 3.28Å; T398-C400 PolarHBondContact O-N 3.48Å; C400-R402 PolarHBondContact O-N 3.2Å; C400-L403 WeakPolarHBondContact O-CB 3.47Å; C400-L403 PolarHBondContact O-N 3.06Å
401	R	79.8	Confident	87.5	Confident	130 Å²	130	58.2 Å²	58.2	49%	0.491	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.8	26.2	176.7	-64.7	-176.8	176.1	162.7	4.7	115.1	R239 D280 T398 R399 L403	R239-R401 VanDerWaalsContact NH2-NH2 3.12Å; D280-R401 IonicContact OD1-CZ 3.06Å; D280-R401 IonicContact OD1-NH1 2.87Å; D280-R401 IonicContact OD1-NH2 3Å; D280-R401 PolarHBondContact OD1-NH2 3.36Å; D280-R401 IonicContact OD2-CZ 2.71Å; D280-R401 IonicContact OD2-NH1 3.29Å; D280-R401 PolarHBondContact OD2-NH1 2.87Å; D280-R401 IonicContact OD2-NH2 2.71Å; D280-R401 PolarHBondContact OD2-NH2 3.3Å; T398-R401 PolarHBondContact O-N 3.39Å; T398-R401 VanDerWaalsContact O-N 3.16Å; R399-R401 PolarHBondContact O-N 2.87Å; R401-L403 VanDerWaalsContact C-N 3.28Å; R401-L403 PolarHBondContact O-N 3.42Å
402	R	81.5	Confident	87.6	Confident	239 Å²	239	57.9 Å²	57.9	90%	0.902	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.6	16.5	-174.7	-43.8	169.8	64.8	167.7	2.8	115	C400	C400-R402 PolarHBondContact O-N 3.2Å
403	L	85.9	Confident	87.8	Confident	57 Å²	57	52 Å²	52	30%	0.298	24%	0.239	S	C	.	.			trans	-75.2	143.6	163.7	-63.7	172.1	0	0	0	109.5	C400 R401 D407 L408	C400-L403 WeakPolarHBondContact O-CB 3.47Å; C400-L403 PolarHBondContact O-N 3.06Å; R401-L403 VanDerWaalsContact C-N 3.28Å; R401-L403 PolarHBondContact O-N 3.42Å; L403-D407 HydrophobicContact CB-CB 4.2Å; L403-D407 HydrophobicContact CD2-CB 4.13Å; L403-L408 HydrophobicContact CB-CD2 4.36Å; L403-L408 HydrophobicContact CB-CG 4.29Å; L403-L408 HydrophobicContact CD1-CD2 3.92Å
404	Q	90.1	Very high	88.1	Confident	85 Å²	85	52.6 Å²	52.6	40%	0.397	25%	0.245	S	C	.	.			trans	-84.1	164.2	174.4	-60.2	-147.2	-106.4	0	0	111.7	E395 T406 D407 L408	E395-Q404 VanDerWaalsContact OE1-CA 3.23Å; E395-Q404 WeakPolarHBondContact OE1-CA 3.24Å; E395-Q404 VanDerWaalsContact OE1-CB 3.24Å; E395-Q404 WeakPolarHBondContact OE1-CB 3.23Å; E395-Q404 WeakPolarHBondContact OE1-CG 3.49Å; E395-Q404 PolarHBondContact OE1-NE2 3.04Å; Q404-T406 PolarHBondContact O-N 2.97Å; Q404-D407 WeakPolarHBondContact CB-OD2 3.43Å; Q404-D407 PolarHBondContact N-OD2 3.42Å; Q404-D407 PolarHBondContact O-N 2.91Å; Q404-L408 PolarHBondContact O-N 3.4Å; Q404-L408 VanDerWaalsContact O-N 3.12Å
405	L	91.1	Very high	88.4	Confident	1 Å²	1	53 Å²	53	1%	0.005	25%	0.247	C	C	.	.	H	α-helix	trans	-55.1	-36.2	174.3	177.8	54.7	0	0	0	112.1	L285 F289 F311 L378 F387 E391 E395 L408 L409	L285-L405 HydrophobicContact CD1-CD1 3.54Å; F289-L405 HydrophobicContact CD1-CB 4.46Å; F289-L405 HydrophobicContact CD1-CD1 3.8Å; F289-L405 HydrophobicContact CD1-CD2 4.17Å; F289-L405 HydrophobicContact CD1-CG 4.37Å; F289-L405 HydrophobicContact CD2-CD1 4.48Å; F289-L405 HydrophobicContact CE1-CB 3.87Å; F289-L405 HydrophobicContact CE1-CD1 3.99Å; F289-L405 HydrophobicContact CE1-CD2 4.31Å; F289-L405 HydrophobicContact CE1-CG 4.27Å; F289-L405 HydrophobicContact CG-CD1 4.07Å; F289-L405 HydrophobicContact CZ-CB 4.27Å; F289-L405 HydrophobicContact CZ-CD1 4.43Å; F311-L405 HydrophobicContact CE1-CD1 4.22Å; L378-L405 HydrophobicContact CD1-CD2 3.78Å; L378-L405 HydrophobicContact CD2-CD2 4.17Å; L378-L405 HydrophobicContact CD2-CG 4.21Å; F387-L405 HydrophobicContact CZ-CD2 4.37Å; E391-L405 HydrophobicContact CG-CB 4.47Å; E391-L405 HydrophobicContact CG-CD2 4.36Å; E391-L405 WeakPolarHBondContact OE1-CB 3.47Å; E395-L405 PolarHBondContact OE1-N 3.3Å; L405-L408 PolarHBondContact O-N 2.89Å; L405-L409 HydrophobicContact CD1-CD1 4.15Å; L405-L409 HydrophobicContact CD1-CG 4.13Å; L405-L409 HydrophobicContact CG-CD1 4.03Å; L405-L409 HydrophobicContact CG-CG 4.47Å; L405-L409 WeakPolarHBondContact O-CB 3.35Å; L405-L409 VanDerWaalsContact O-CG 3.25Å; L405-L409 WeakPolarHBondContact O-CG 3.32Å; L405-L409 PolarHBondContact O-N 2.9Å
406	T	91.8	Very high	88.7	Confident	26 Å²	26	50.9 Å²	50.9	16%	0.16	24%	0.237	C	C	.	.	H	α-helix	trans	-64.4	-39.2	174.6	34.4	0	0	0	0	113.5	L375 L378 Q404 L408 L409 V410	L375-T406 HydrophobicContact CD2-CG2 4.11Å; L378-T406 HydrophobicContact CD2-CG2 3.88Å; Q404-T406 PolarHBondContact O-N 2.97Å; T406-L408 VanDerWaalsContact C-N 3.35Å; T406-L409 PolarHBondContact O-N 3.19Å; T406-V410 PolarHBondContact O-N 2.94Å
407	D	91.8	Very high	89	Confident	48 Å²	48	45.3 Å²	45.3	26%	0.257	21%	0.211	S	C	.	.	H	α-helix	trans	-67.8	-37.5	177.4	-58.9	-52.3	0	0	0	111.4	L403 Q404 V410 A411	L403-D407 HydrophobicContact CB-CB 4.2Å; L403-D407 HydrophobicContact CD2-CB 4.13Å; Q404-D407 WeakPolarHBondContact CB-OD2 3.43Å; Q404-D407 PolarHBondContact N-OD2 3.42Å; Q404-D407 PolarHBondContact O-N 2.91Å; D407-V410 WeakPolarHBondContact O-CG1 3.4Å; D407-A411 PolarHBondContact O-N 3.42Å
408	L	92.6	Very high	89.4	Confident	1 Å²	1	48.8 Å²	48.8	1%	0.005	23%	0.225	C	C	.	.	H	α-helix	trans	-70.3	-37.3	176.6	-65.7	170.5	0	0	0	112.2	H281 V284 L285 F289 L403 Q404 L405 T406 A411	H281-L408 HydrophobicContact CB-CD2 4.41Å; V284-L408 HydrophobicContact CB-CD2 4.48Å; V284-L408 HydrophobicContact CG1-CD1 3.77Å; V284-L408 HydrophobicContact CG1-CD2 4.16Å; L285-L408 HydrophobicContact CD1-CB 4.03Å; F289-L408 HydrophobicContact CD2-CD1 4.29Å; F289-L408 HydrophobicContact CE2-CD1 3.49Å; F289-L408 VanDerWaalsContact CE2-CD1 3.49Å; F289-L408 HydrophobicContact CZ-CD1 4.08Å; L403-L408 HydrophobicContact CB-CD2 4.36Å; L403-L408 HydrophobicContact CB-CG 4.29Å; L403-L408 HydrophobicContact CD1-CD2 3.92Å; Q404-L408 PolarHBondContact O-N 3.4Å; Q404-L408 VanDerWaalsContact O-N 3.12Å; L405-L408 PolarHBondContact O-N 2.89Å; T406-L408 VanDerWaalsContact C-N 3.35Å; L408-A411 WeakPolarHBondContact O-CB 3.29Å; L408-A411 PolarHBondContact O-N 3.09Å
409	L	93.5	Very high	90	Very high	1 Å²	1	42.8 Å²	42.8	1%	0.005	19%	0.188	C	C	.	.	H	α-helix	trans	-68.3	-32	176.9	-74.3	169.9	0	0	0	113	L285 L310 F311 Y367 Y371 L378 L405 T406 P412	L285-L409 HydrophobicContact CD1-CD2 4.27Å; L285-L409 HydrophobicContact CD1-CG 4.48Å; L285-L409 HydrophobicContact CD2-CD2 4.14Å; L310-L409 HydrophobicContact CD1-CD1 4.29Å; L310-L409 WeakPolarHBondContact O-CD2 3.16Å; F311-L409 HydrophobicContact CD1-CD2 4.34Å; Y367-L409 WeakPolarHBondContact CE1-O 3.25Å; Y367-L409 PolarHBondContact OH-O 3.42Å; Y371-L409 HydrophobicContact CE2-CB 4.16Å; Y371-L409 WeakPolarHBondContact CE2-O 3.25Å; L378-L409 HydrophobicContact CD2-CD1 3.91Å; L405-L409 HydrophobicContact CD1-CD1 4.15Å; L405-L409 HydrophobicContact CD1-CG 4.13Å; L405-L409 HydrophobicContact CG-CD1 4.03Å; L405-L409 HydrophobicContact CG-CG 4.47Å; L405-L409 WeakPolarHBondContact O-CB 3.35Å; L405-L409 VanDerWaalsContact O-CG 3.25Å; L405-L409 WeakPolarHBondContact O-CG 3.32Å; L405-L409 PolarHBondContact O-N 2.9Å; T406-L409 PolarHBondContact O-N 3.19Å; L409-P412 WeakPolarHBondContact O-CD 3.46Å
410	V	93.7	Very high	90.5	Very high	11 Å²	11	40.7 Å²	40.7	7%	0.067	18%	0.181	C	C	.	.	H	α-helix	trans	-81.4	-17.3	177.6	75.1	0	0	0	0	112.9	Y371 T406 D407 M413 Q414 V892	Y371-V410 HydrophobicContact CE2-CB 3.96Å; Y371-V410 HydrophobicContact CE2-CG2 4.27Å; Y371-V410 WeakPolarHBondContact OH-CB 3.42Å; Y371-V410 WeakPolarHBondContact OH-CG2 3.48Å; T406-V410 PolarHBondContact O-N 2.94Å; D407-V410 WeakPolarHBondContact O-CG1 3.4Å; V410-M413 WeakPolarHBondContact O-CB 3.49Å; V410-M413 PolarHBondContact O-N 3.35Å; V410-Q414 HydrophobicContact CG2-CG 4.25Å; V410-Q414 PolarHBondContact O-N 3.08Å; V410-Q414 VanDerWaalsContact O-N 3.13Å; V410-V892 HydrophobicContact CG2-CG1 4.5Å; V410-V892 HydrophobicContact CG2-CG2 4.12Å
411	A	93.3	Very high	91.1	Very high	7 Å²	7	46.2 Å²	46.2	6%	0.058	21%	0.21	C	C	.	.	H	α-helix	trans	-56.7	-41.8	-173.8	0	0	0	0	0	115.2	H281 D407 L408 M413 Q414 H415	H281-A411 HydrophobicContact CB-CB 3.88Å; D407-A411 PolarHBondContact O-N 3.42Å; L408-A411 WeakPolarHBondContact O-CB 3.29Å; L408-A411 PolarHBondContact O-N 3.09Å; A411-M413 VanDerWaalsContact C-N 3.31Å; A411-M413 PolarHBondContact O-N 3.1Å; A411-Q414 PolarHBondContact O-N 3.42Å; A411-H415 WeakPolarHBondContact O-CB 3.49Å; A411-H415 PolarHBondContact O-N 3.39Å
412	P	92.9	Very high	91.7	Very high	1 Å²	1	40.7 Å²	40.7	1%	0.006	19%	0.19	C	C	.	.	H	α-helix	trans	-63.6	-34.3	178.5	-23.2	35.4	0	0	0	113.7	F277 L282 L317 Y367 L409 Y416	F277-P412 HydrophobicContact CE2-CB 4.02Å; F277-P412 HydrophobicContact CE2-CG 3.98Å; F277-P412 HydrophobicContact CZ-CB 3.95Å; F277-P412 HydrophobicContact CZ-CG 4.23Å; L282-P412 HydrophobicContact CD2-CG 4.06Å; L317-P412 HydrophobicContact CD1-CB 3.96Å; L317-P412 HydrophobicContact CD1-CG 4.17Å; Y367-P412 HydrophobicContact CD1-CB 3.88Å; Y367-P412 HydrophobicContact CD1-CG 4.18Å; Y367-P412 HydrophobicContact CE1-CB 3.81Å; Y367-P412 HydrophobicContact CE1-CG 3.64Å; L409-P412 WeakPolarHBondContact O-CD 3.46Å; P412-Y416 PolarHBondContact O-N 3.5Å; P412-Y416 VanDerWaalsContact O-N 3.09Å
413	M	92.4	Very high	92.2	Very high	11 Å²	11	29.4 Å²	29.4	5%	0.054	15%	0.148	C	C	.	.	H	α-helix	trans	-70	-46.1	176.5	-176.5	175.5	170.3	0	0	110.8	Y371 V410 A411 H415 Y416 M417 M457 L888	Y371-M413 HydrophobicContact CD1-SD 4.33Å; V410-M413 WeakPolarHBondContact O-CB 3.49Å; V410-M413 PolarHBondContact O-N 3.35Å; A411-M413 VanDerWaalsContact C-N 3.31Å; A411-M413 PolarHBondContact O-N 3.1Å; M413-H415 VanDerWaalsContact C-N 3.32Å; M413-H415 PolarHBondContact O-N 3.26Å; M413-Y416 PolarHBondContact O-N 2.94Å; M413-M417 WeakPolarHBondContact O-CG 3.49Å; M413-M417 PolarHBondContact O-N 3.45Å; M413-M457 HydrophobicContact CE-CE 3.96Å; M413-M457 HydrophobicContact SD-CE 4.44Å; M413-L888 HydrophobicContact CE-CB 3.94Å; M413-L888 HydrophobicContact CE-CD2 3.61Å; M413-L888 HydrophobicContact CE-CG 3.52Å
414	Q	93.9	Very high	92.5	Very high	75 Å²	75	28.7 Å²	28.7	35%	0.35	15%	0.147	S	C	.	.	H	α-helix	trans	-63.9	-35.8	174.9	-64.8	-173.9	12.7	0	0	112.9	V410 A411 K418	V410-Q414 HydrophobicContact CG2-CG 4.25Å; V410-Q414 PolarHBondContact O-N 3.08Å; V410-Q414 VanDerWaalsContact O-N 3.13Å; A411-Q414 PolarHBondContact O-N 3.42Å; Q414-K418 WeakPolarHBondContact O-CG 3.45Å; Q414-K418 PolarHBondContact O-N 3.44Å
415	H	93.5	Very high	92.4	Very high	9 Å²	9	26.1 Å²	26.1	4%	0.042	14%	0.139	C	C	.	.	H	α-helix	trans	-67.5	-47	178.6	-172.2	62.4	0	0	0	111.4	E274 F277 A411 M413 M417 K418 I419	E274-H415 IonicContact OE1-NE2 3.87Å; E274-H415 IonicContact OE2-CD2 3.51Å; E274-H415 IonicContact OE2-CE1 3.79Å; E274-H415 IonicContact OE2-NE2 2.69Å; E274-H415 PolarHBondContact OE2-NE2 2.85Å; F277-H415 HydrophobicContact CD1-CB 4.36Å; F277-H415 AromaticContact CD1-CD2 3.19Å; F277-H415 WeakPolarHBondContact CD1-CD2 3.47Å; F277-H415 AromaticContact CD1-CG 3.69Å; F277-H415 AromaticContact CD1-NE2 3.49Å; F277-H415 WeakPolarHBondContact CD1-NE2 3.34Å; F277-H415 HydrophobicContact CD2-CB 3.78Å; F277-H415 AromaticContact CD2-CG 3.86Å; F277-H415 HydrophobicContact CE1-CB 4.45Å; F277-H415 AromaticContact CE1-CD2 3.46Å; F277-H415 VanDerWaalsContact CE1-CD2 3.46Å; F277-H415 WeakPolarHBondContact CE1-CD2 3.49Å; F277-H415 HydrophobicContact CE2-CB 3.92Å; F277-H415 HydrophobicContact CG-CB 4.01Å; F277-H415 AromaticContact CG-CD2 3.57Å; F277-H415 AromaticContact CG-CG 3.54Å; F277-H415 AromaticContact CG-ND1 3.91Å; F277-H415 AromaticContact CG-NE2 3.9Å; F277-H415 HydrophobicContact CZ-CB 4.23Å; A411-H415 WeakPolarHBondContact O-CB 3.49Å; A411-H415 PolarHBondContact O-N 3.39Å; M413-H415 VanDerWaalsContact C-N 3.32Å; M413-H415 PolarHBondContact O-N 3.26Å; H415-M417 PolarHBondContact O-N 2.73Å; H415-K418 WeakPolarHBondContact O-CB 3.41Å; H415-K418 PolarHBondContact O-N 3.47Å; H415-I419 PolarHBondContact O-N 3.26Å
416	Y	92.9	Very high	92.3	Very high	3 Å²	3	26 Å²	26	1%	0.012	14%	0.138	C	C	.	.	H	α-helix	trans	-59.4	-35.6	178.5	-162.1	-112.2	0	0	0	112.7	W354 G361 Y364 P412 M413 K418 P420 S449 L450	W354-Y416 AromaticContact CH2-CE2 3.88Å; W354-Y416 HydrophobicContact CH2-CE2 3.88Å; W354-Y416 HydrophobicContact CZ2-CD2 4.39Å; W354-Y416 AromaticContact CZ2-CE2 3.96Å; W354-Y416 HydrophobicContact CZ2-CE2 3.96Å; G361-Y416 WeakPolarHBondContact CA-OH 3.38Å; Y364-Y416 AromaticContact CD1-CD2 3.62Å; Y364-Y416 HydrophobicContact CD1-CD2 3.62Å; Y364-Y416 HydrophobicContact CD1-CE2 4.43Å; Y364-Y416 HydrophobicContact CD1-CG 4.03Å; Y364-Y416 AromaticContact CD2-CD2 3.53Å; Y364-Y416 HydrophobicContact CD2-CD2 3.53Å; Y364-Y416 AromaticContact CD2-CE2 3.49Å; Y364-Y416 HydrophobicContact CD2-CE2 3.49Å; Y364-Y416 VanDerWaalsContact CD2-CE2 3.49Å; Y364-Y416 HydrophobicContact CD2-CG 4.48Å; Y364-Y416 HydrophobicContact CE1-CD2 4.01Å; Y364-Y416 AromaticContact CE2-CD2 3.92Å; Y364-Y416 HydrophobicContact CE2-CD2 3.92Å; Y364-Y416 AromaticContact CE2-CE2 3.98Å; Y364-Y416 HydrophobicContact CE2-CE2 3.98Å; Y364-Y416 AromaticContact CG-CD2 3.36Å; Y364-Y416 HydrophobicContact CG-CD2 3.36Å; Y364-Y416 AromaticContact CG-CE2 3.76Å; Y364-Y416 HydrophobicContact CG-CE2 3.76Å; Y364-Y416 AromaticContact CG-CG 3.91Å; Y364-Y416 HydrophobicContact CG-CG 3.91Å; P412-Y416 PolarHBondContact O-N 3.5Å; P412-Y416 VanDerWaalsContact O-N 3.09Å; M413-Y416 PolarHBondContact O-N 2.94Å; Y416-K418 VanDerWaalsContact C-N 3.29Å; Y416-K418 PolarHBondContact O-N 3.26Å; Y416-P420 WeakPolarHBondContact O-CD 3.33Å; Y416-S449 WeakPolarHBondContact OH-CB 3.39Å; Y416-S449 PolarHBondContact OH-OG 3.45Å; Y416-L450 HydrophobicContact CD1-CD1 4.11Å; Y416-L450 HydrophobicContact CE1-CB 4.47Å; Y416-L450 HydrophobicContact CE1-CD1 4.43Å
417	M	91.8	Very high	92.1	Very high	35 Å²	35	28 Å²	28	17%	0.172	14%	0.143	C	C	.	.	H	α-helix	trans	-68.1	-20.2	173.2	-66.8	179.6	79.5	0	0	114.4	M413 H415 L450 L888 F889	M413-M417 WeakPolarHBondContact O-CG 3.49Å; M413-M417 PolarHBondContact O-N 3.45Å; H415-M417 PolarHBondContact O-N 2.73Å; M417-L450 HydrophobicContact CG-CD1 4.19Å; M417-L888 HydrophobicContact CE-CB 4.18Å; M417-L888 HydrophobicContact CE-CD2 4.01Å; M417-L888 HydrophobicContact CG-CD2 4.19Å; M417-L888 HydrophobicContact SD-CB 4.27Å; M417-L888 HydrophobicContact SD-CD2 3.55Å; M417-L888 VanDerWaalsContact SD-CD2 3.55Å; M417-F889 HydrophobicContact CE-CD2 4.36Å; M417-F889 HydrophobicContact CE-CE2 3.88Å
418	K	92.9	Very high	92	Very high	102 Å²	102	32.9 Å²	32.9	44%	0.443	16%	0.158	S	C	.	.	H	α-helix	trans	-86	-27.7	179.7	-70.6	166.5	-171.7	171.2	0	113.2	Q414 H415 Y416 L421 L422	Q414-K418 WeakPolarHBondContact O-CG 3.45Å; Q414-K418 PolarHBondContact O-N 3.44Å; H415-K418 WeakPolarHBondContact O-CB 3.41Å; H415-K418 PolarHBondContact O-N 3.47Å; Y416-K418 VanDerWaalsContact C-N 3.29Å; Y416-K418 PolarHBondContact O-N 3.26Å; K418-L421 WeakPolarHBondContact O-CB 3.35Å; K418-L421 PolarHBondContact O-N 3.04Å; K418-L422 HydrophobicContact CB-CD1 4.45Å; K418-L422 PolarHBondContact O-N 3.48Å; K418-L422 VanDerWaalsContact O-N 3.14Å
419	I	92.4	Very high	91.6	Very high	3 Å²	3	35.6 Å²	35.6	2%	0.015	17%	0.168	C	C	.	.	H	α-helix	trans	-52.8	-45.9	-177.5	-60	-58.5	0	0	0	112.8	L270 W354 H415 L421 L422 L423 V446	L270-I419 HydrophobicContact CD1-CD1 4.12Å; W354-I419 HydrophobicContact CH2-CG2 4.21Å; H415-I419 PolarHBondContact O-N 3.26Å; I419-L421 VanDerWaalsContact C-N 3.29Å; I419-L421 PolarHBondContact O-N 2.96Å; I419-L422 HydrophobicContact CD1-CD1 4.47Å; I419-L422 PolarHBondContact O-N 2.83Å; I419-L423 HydrophobicContact CG2-CD1 3.83Å; I419-L423 HydrophobicContact CG2-CG 4.22Å; I419-L423 WeakPolarHBondContact O-CG 3.42Å; I419-L423 PolarHBondContact O-N 3.45Å; I419-V446 HydrophobicContact CG2-CG1 4.28Å
420	P	92.3	Very high	91.1	Very high	10 Å²	10	35.5 Å²	35.5	7%	0.065	17%	0.168	C	C	.	.	H	α-helix	trans	-59	-35.6	175.2	-25.5	35.5	0	0	0	114.2	Y416 S424 V446 E447	Y416-P420 WeakPolarHBondContact O-CD 3.33Å; P420-S424 VanDerWaalsContact O-CB 3.22Å; P420-S424 WeakPolarHBondContact O-CB 3.38Å; P420-S424 PolarHBondContact O-N 2.93Å; P420-V446 HydrophobicContact CG-CB 4.47Å; P420-V446 HydrophobicContact CG-CG1 3.84Å; P420-E447 HydrophobicContact CB-CG 4.22Å
421	L	93.6	Very high	90.4	Very high	116 Å²	116	37.8 Å²	37.8	61%	0.607	19%	0.188	S	C	*	.	H	α-helix	trans	-71.1	-39.5	-178.3	-54	178.8	0	0	0	111.6	K418 I419 S425	K418-L421 WeakPolarHBondContact O-CB 3.35Å; K418-L421 PolarHBondContact O-N 3.04Å; I419-L421 VanDerWaalsContact C-N 3.29Å; I419-L421 PolarHBondContact O-N 2.96Å; L421-S425 WeakPolarHBondContact O-CB 3.48Å; L421-S425 PolarHBondContact O-N 3.09Å; L421-S425 PolarHBondContact O-OG 3.39Å
422	L	92.1	Very high	89.9	Confident	13 Å²	13	40.5 Å²	40.5	7%	0.068	21%	0.205	C	C	.	.	H	α-helix	trans	-66.9	-49.2	175.3	-66.4	162.7	0	0	0	110.4	E269 L270 S273 K418 I419 S424 S425 I426	E269-L422 HydrophobicContact CB-CD2 4.32Å; E269-L422 HydrophobicContact CG-CD2 3.75Å; L270-L422 HydrophobicContact CD1-CB 4.11Å; L270-L422 HydrophobicContact CD1-CD1 3.9Å; S273-L422 WeakPolarHBondContact OG-CD1 3.41Å; K418-L422 HydrophobicContact CB-CD1 4.45Å; K418-L422 PolarHBondContact O-N 3.48Å; K418-L422 VanDerWaalsContact O-N 3.14Å; I419-L422 HydrophobicContact CD1-CD1 4.47Å; I419-L422 PolarHBondContact O-N 2.83Å; L422-S424 VanDerWaalsContact C-N 3.33Å; L422-S424 PolarHBondContact O-N 3.48Å; L422-S425 WeakPolarHBondContact O-CB 3.32Å; L422-S425 PolarHBondContact O-N 3.3Å; L422-S425 VanDerWaalsContact O-N 3.12Å; L422-I426 WeakPolarHBondContact O-CG1 3.39Å; L422-I426 PolarHBondContact O-N 3.41Å
423	L	90.9	Very high	89.4	Confident	2 Å²	2	43.9 Å²	43.9	1%	0.01	23%	0.229	C	C	.	.	H	α-helix	trans	-60.2	-40.3	176	-68.2	177	0	0	0	112.6	L270 L351 I419 S425 I426 R427 L443 V446	L270-L423 HydrophobicContact CD2-CD2 4.31Å; L351-L423 HydrophobicContact CD1-CD2 3.6Å; L351-L423 HydrophobicContact CD2-CD2 3.95Å; L351-L423 HydrophobicContact CG-CD2 4.46Å; I419-L423 HydrophobicContact CG2-CD1 3.83Å; I419-L423 HydrophobicContact CG2-CG 4.22Å; I419-L423 WeakPolarHBondContact O-CG 3.42Å; I419-L423 PolarHBondContact O-N 3.45Å; L423-S425 VanDerWaalsContact C-N 3.31Å; L423-S425 PolarHBondContact O-N 3.09Å; L423-I426 PolarHBondContact O-N 3.4Å; L423-R427 WeakPolarHBondContact O-CB 3.32Å; L423-R427 PolarHBondContact O-N 2.88Å; L423-L443 HydrophobicContact CB-CD1 4.42Å; L423-V446 HydrophobicContact CD1-CG2 4.29Å
424	S	92.1	Very high	89	Confident	42 Å²	42	45.7 Å²	45.7	29%	0.294	25%	0.246	S	C	.	.	H	α-helix	trans	-65.9	-35.6	176.5	-161.5	0	0	0	0	111.9	P420 L422 R427 R428	P420-S424 VanDerWaalsContact O-CB 3.22Å; P420-S424 WeakPolarHBondContact O-CB 3.38Å; P420-S424 PolarHBondContact O-N 2.93Å; L422-S424 VanDerWaalsContact C-N 3.33Å; L422-S424 PolarHBondContact O-N 3.48Å; S424-R427 PolarHBondContact OG-NH2 2.7Å; S424-R428 WeakPolarHBondContact O-CB 3.2Å; S424-R428 PolarHBondContact O-N 2.92Å
425	S	89.8	Confident	88.4	Confident	31 Å²	31	43.6 Å²	43.6	22%	0.217	24%	0.236	C	C	.	.	H	α-helix	trans	-69	-43.2	176.2	-60.4	0	0	0	0	112.1	L421 L422 L423 R428 Y429	L421-S425 WeakPolarHBondContact O-CB 3.48Å; L421-S425 PolarHBondContact O-N 3.09Å; L421-S425 PolarHBondContact O-OG 3.39Å; L422-S425 WeakPolarHBondContact O-CB 3.32Å; L422-S425 PolarHBondContact O-N 3.3Å; L422-S425 VanDerWaalsContact O-N 3.12Å; L423-S425 VanDerWaalsContact C-N 3.31Å; L423-S425 PolarHBondContact O-N 3.09Å; S425-R428 WeakPolarHBondContact O-CB 3.36Å; S425-R428 PolarHBondContact O-N 3.41Å; S425-Y429 WeakPolarHBondContact O-CD2 3.48Å
426	I	88.2	Confident	88	Confident	0 Å²	0	46 Å²	46	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-58.6	-53.6	172.4	-65.4	164.3	0	0	0	109.7	A266 V267 L270 L347 L422 L423 R428 Y429 T430 L439	A266-I426 HydrophobicContact CB-CG1 3.71Å; V267-I426 HydrophobicContact CG2-CG1 4.47Å; V267-I426 HydrophobicContact CG2-CG2 4.38Å; L270-I426 HydrophobicContact CB-CD1 4.1Å; L270-I426 HydrophobicContact CD2-CD1 3.69Å; L347-I426 HydrophobicContact CD1-CD1 3.99Å; L347-I426 HydrophobicContact CD1-CG2 3.74Å; L422-I426 WeakPolarHBondContact O-CG1 3.39Å; L422-I426 PolarHBondContact O-N 3.41Å; L423-I426 PolarHBondContact O-N 3.4Å; I426-R428 VanDerWaalsContact C-N 3.25Å; I426-R428 PolarHBondContact O-N 3.42Å; I426-Y429 PolarHBondContact O-N 2.89Å; I426-T430 PolarHBondContact O-N 3.48Å; I426-T430 PolarHBondContact O-OG1 2.83Å; I426-L439 HydrophobicContact CG2-CD1 3.96Å
427	R	88.2	Confident	87.7	Confident	67 Å²	67	51.5 Å²	51.5	25%	0.253	27%	0.273	S	S	.	.	H	α-helix	trans	-53.8	-39.8	179.1	180	-176.5	60.3	166.4	-4.1	112.8	L423 S424 Y429 T430 Q436 L439 T440	L423-R427 WeakPolarHBondContact O-CB 3.32Å; L423-R427 PolarHBondContact O-N 2.88Å; S424-R427 PolarHBondContact OG-NH2 2.7Å; R427-Y429 PolarHBondContact O-N 3.27Å; R427-T430 PolarHBondContact O-N 2.83Å; R427-Q436 HydrophobicContact CG-CB 4.36Å; R427-Q436 HydrophobicContact CG-CG 4.3Å; R427-Q436 PolarHBondContact O-NE2 3.47Å; R427-L439 HydrophobicContact CB-CB 4.16Å; R427-L439 HydrophobicContact CB-CD1 4.13Å; R427-L439 HydrophobicContact CG-CB 4.31Å; R427-T440 WeakPolarHBondContact CD-OG1 3.36Å; R427-T440 PolarHBondContact NH1-OG1 2.93Å
428	R	88.2	Confident	87.4	Confident	151 Å²	151	54.1 Å²	54.1	57%	0.57	29%	0.286	S	S	*	.	H	α-helix	trans	-59.5	-31.7	178	-178.9	175.7	65.9	-162.3	-3.3	112.5	S424 S425 I426	S424-R428 WeakPolarHBondContact O-CB 3.2Å; S424-R428 PolarHBondContact O-N 2.92Å; S425-R428 WeakPolarHBondContact O-CB 3.36Å; S425-R428 PolarHBondContact O-N 3.41Å; I426-R428 VanDerWaalsContact C-N 3.25Å; I426-R428 PolarHBondContact O-N 3.42Å
429	Y	84	Confident	87.2	Confident	57 Å²	57	49.3 Å²	49.3	22%	0.224	27%	0.265	C	S	.	.	H	α-helix	trans	-98.2	-26.2	-179	-59.7	-57.3	0	0	0	113.6	R259 R262 A266 S425 I426 R427 A431	R259-Y429 WeakPolarHBondContact CD-O 3.48Å; R259-Y429 WeakPolarHBondContact CG-O 3.48Å; R259-Y429 PolarHBondContact NE-O 3.28Å; R262-Y429 HydrophobicContact CB-CD1 3.75Å; R262-Y429 HydrophobicContact CB-CD2 3.93Å; R262-Y429 HydrophobicContact CB-CE1 3.79Å; R262-Y429 HydrophobicContact CB-CE2 3.98Å; R262-Y429 HydrophobicContact CB-CG 3.82Å; R262-Y429 HydrophobicContact CG-CE1 4.36Å; R262-Y429 WeakPolarHBondContact O-CD2 3.3Å; A266-Y429 HydrophobicContact CB-CD2 4.35Å; S425-Y429 WeakPolarHBondContact O-CD2 3.48Å; I426-Y429 PolarHBondContact O-N 2.89Å; R427-Y429 PolarHBondContact O-N 3.27Å; Y429-A431 PolarHBondContact O-N 2.79Å
430	T	83.8	Confident	87	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	28%	0.278	C	S	.	.			trans	-47.3	135.6	167.9	-61.8	0	0	0	0	112.1	R259 I426 R427 E435 Q436 L439	R259-T430 PolarHBondContact NH2-O 3.03Å; I426-T430 PolarHBondContact O-N 3.48Å; I426-T430 PolarHBondContact O-OG1 2.83Å; R427-T430 PolarHBondContact O-N 2.83Å; T430-E435 HydrophobicContact CG2-CB 3.37Å; T430-E435 HydrophobicContact CG2-CG 4.32Å; T430-E435 VanDerWaalsContact CG2-OE2 3.28Å; T430-E435 WeakPolarHBondContact CG2-OE2 3.48Å; T430-Q436 HydrophobicContact CG2-CG 3.79Å; T430-Q436 PolarHBondContact O-NE2 3.24Å; T430-Q436 VanDerWaalsContact O-NE2 3.09Å; T430-L439 HydrophobicContact CG2-CD1 4.18Å; T430-L439 VanDerWaalsContact OG1-CD1 3.28Å; T430-L439 WeakPolarHBondContact OG1-CD1 3.27Å
431	A	79.3	Confident	86.9	Confident	58 Å²	58	53.7 Å²	53.7	48%	0.479	30%	0.298	S	S	.	.			trans	-103.1	-33.8	-169.5	0	0	0	0	0	114.5	Y429	Y429-A431 PolarHBondContact O-N 2.79Å
432	C	82.2	Confident	86.6	Confident	64 Å²	64	49.6 Å²	49.6	43%	0.432	28%	0.279	S	S	.	.			trans	-79.8	138.2	178.1	180	0	0	0	0	111.4	E435 Q436	C432-E435 HydrophobicContact CB-CB 4.1Å; C432-E435 HydrophobicContact CB-CG 3.7Å; C432-E435 WeakPolarHBondContact CB-OE2 3.49Å; C432-E435 PolarHBondContact N-OE2 3.02Å; C432-E435 PolarHBondContact O-N 3.18Å; C432-Q436 WeakPolarHBondContact O-CG 3.27Å; C432-Q436 PolarHBondContact O-N 2.81Å
433	S	83.4	Confident	86.6	Confident	73 Å²	73	49.2 Å²	49.2	51%	0.51	28%	0.277	S	S	.	.	H	α-helix	trans	-62.4	-45.1	178.9	-164.9	0	0	0	0	112	E435 Q436 E437	S433-E435 VanDerWaalsContact C-N 3.31Å; S433-E435 PolarHBondContact O-N 3.13Å; S433-Q436 CarbonylContact O-C 3.58Å; S433-Q436 PolarHBondContact O-N 2.9Å; S433-Q436 VanDerWaalsContact O-N 3.07Å; S433-E437 WeakPolarHBondContact O-CG 3.4Å; S433-E437 PolarHBondContact O-N 3.01Å; S433-E437 PolarHBondContact OG-OE1 3.12Å
434	A	83.4	Confident	86.6	Confident	48 Å²	48	51.9 Å²	51.9	40%	0.397	29%	0.293	S	S	.	.	H	α-helix	trans	-61.1	-39.8	-179.6	0	0	0	0	0	112.1	E437 M438	A434-E437 PolarHBondContact O-N 3.22Å; A434-M438 WeakPolarHBondContact O-CG 3.29Å; A434-M438 PolarHBondContact O-N 2.96Å
435	E	80.9	Confident	86.6	Confident	32 Å²	32	55.7 Å²	55.7	15%	0.15	30%	0.304	C	S	.	.	H	α-helix	trans	-64.6	-43.5	172.9	-63.8	-176.8	117.3	0	0	112.1	T344 T430 C432 S433 E437 M438 L439	T344-E435 WeakPolarHBondContact CA-OE1 3.17Å; T344-E435 VanDerWaalsContact CB-CD 3.49Å; T344-E435 WeakPolarHBondContact CB-OE1 3.4Å; T344-E435 HydrophobicContact CG2-CB 4.06Å; T344-E435 HydrophobicContact CG2-CG 4.49Å; T344-E435 PolarHBondContact N-OE1 3.32Å; T344-E435 PolarHBondContact OG1-OE1 3.04Å; T344-E435 PolarHBondContact OG1-OE2 3.44Å; T430-E435 HydrophobicContact CG2-CB 3.37Å; T430-E435 HydrophobicContact CG2-CG 4.32Å; T430-E435 VanDerWaalsContact CG2-OE2 3.28Å; T430-E435 WeakPolarHBondContact CG2-OE2 3.48Å; C432-E435 HydrophobicContact CB-CB 4.1Å; C432-E435 HydrophobicContact CB-CG 3.7Å; C432-E435 WeakPolarHBondContact CB-OE2 3.49Å; C432-E435 PolarHBondContact N-OE2 3.02Å; C432-E435 PolarHBondContact O-N 3.18Å; S433-E435 VanDerWaalsContact C-N 3.31Å; S433-E435 PolarHBondContact O-N 3.13Å; E435-E437 VanDerWaalsContact C-N 3.31Å; E435-E437 PolarHBondContact O-N 3.16Å; E435-M438 PolarHBondContact O-N 3.48Å; E435-L439 WeakPolarHBondContact O-CB 3.31Å; E435-L439 WeakPolarHBondContact O-CG 3.46Å; E435-L439 PolarHBondContact O-N 2.88Å
436	Q	85.8	Confident	86.7	Confident	58 Å²	58	54.6 Å²	54.6	27%	0.271	30%	0.297	S	S	.	.	H	α-helix	trans	-64.2	-34.2	176.6	-75	-167.3	-42.2	0	0	112.6	R427 T430 C432 S433 T440	R427-Q436 HydrophobicContact CG-CB 4.36Å; R427-Q436 HydrophobicContact CG-CG 4.3Å; R427-Q436 PolarHBondContact O-NE2 3.47Å; T430-Q436 HydrophobicContact CG2-CG 3.79Å; T430-Q436 PolarHBondContact O-NE2 3.24Å; T430-Q436 VanDerWaalsContact O-NE2 3.09Å; C432-Q436 WeakPolarHBondContact O-CG 3.27Å; C432-Q436 PolarHBondContact O-N 2.81Å; S433-Q436 CarbonylContact O-C 3.58Å; S433-Q436 PolarHBondContact O-N 2.9Å; S433-Q436 VanDerWaalsContact O-N 3.07Å; Q436-T440 VanDerWaalsContact O-CB 3.29Å; Q436-T440 WeakPolarHBondContact O-CB 3.42Å; Q436-T440 PolarHBondContact O-N 3.2Å; Q436-T440 PolarHBondContact O-OG1 3.33Å
437	E	87.2	Confident	87	Confident	120 Å²	120	59 Å²	59	56%	0.561	32%	0.317	S	S	*	.	H	α-helix	trans	-68.2	-46.7	174.1	-74.2	164.6	-131.6	0	0	111.1	S433 A434 E435 L439 T440 A441	S433-E437 WeakPolarHBondContact O-CG 3.4Å; S433-E437 PolarHBondContact O-N 3.01Å; S433-E437 PolarHBondContact OG-OE1 3.12Å; A434-E437 PolarHBondContact O-N 3.22Å; E435-E437 VanDerWaalsContact C-N 3.31Å; E435-E437 PolarHBondContact O-N 3.16Å; E437-L439 PolarHBondContact O-N 3.22Å; E437-T440 WeakPolarHBondContact O-CB 3.47Å; E437-T440 PolarHBondContact O-N 2.89Å; E437-T440 VanDerWaalsContact O-N 3.14Å; E437-A441 PolarHBondContact O-N 3.5Å
438	M	85.4	Confident	87.2	Confident	90 Å²	90	60.4 Å²	60.4	44%	0.443	33%	0.329	S	S	.	.	H	α-helix	trans	-64.5	-39.5	176.2	-69.7	-162.8	-115.8	0	0	112.7	L348 A434 E435 A441 C442	L348-M438 HydrophobicContact CD1-CB 3.68Å; L348-M438 HydrophobicContact CD1-CG 4.36Å; L348-M438 HydrophobicContact CD1-SD 3.8Å; L348-M438 HydrophobicContact CD2-CB 3.87Å; L348-M438 HydrophobicContact CG-CB 4.45Å; A434-M438 WeakPolarHBondContact O-CG 3.29Å; A434-M438 PolarHBondContact O-N 2.96Å; E435-M438 PolarHBondContact O-N 3.48Å; M438-A441 PolarHBondContact O-N 3.42Å; M438-C442 PolarHBondContact O-N 3.18Å; M438-C442 PolarHBondContact O-SG 3.45Å
439	L	87.2	Confident	87.5	Confident	1 Å²	1	53.8 Å²	53.8	1%	0.005	31%	0.306	C	S	.	.	H	α-helix	trans	-64.6	-37.9	170.6	-77	171.6	0	0	0	112.3	T344 L351 I426 R427 T430 E435 E437 C442 L443	T344-L439 HydrophobicContact CG2-CD1 3.59Å; T344-L439 HydrophobicContact CG2-CD2 3.94Å; T344-L439 HydrophobicContact CG2-CG 3.55Å; L351-L439 HydrophobicContact CD1-CD2 4.43Å; I426-L439 HydrophobicContact CG2-CD1 3.96Å; R427-L439 HydrophobicContact CB-CB 4.16Å; R427-L439 HydrophobicContact CB-CD1 4.13Å; R427-L439 HydrophobicContact CG-CB 4.31Å; T430-L439 HydrophobicContact CG2-CD1 4.18Å; T430-L439 VanDerWaalsContact OG1-CD1 3.28Å; T430-L439 WeakPolarHBondContact OG1-CD1 3.27Å; E435-L439 WeakPolarHBondContact O-CB 3.31Å; E435-L439 WeakPolarHBondContact O-CG 3.46Å; E435-L439 PolarHBondContact O-N 2.88Å; E437-L439 PolarHBondContact O-N 3.22Å; L439-C442 PolarHBondContact O-N 2.86Å; L439-L443 VanDerWaalsContact O-CB 3.24Å; L439-L443 WeakPolarHBondContact O-CB 3.04Å; L439-L443 PolarHBondContact O-N 3.44Å
440	T	90	Very high	88	Confident	46 Å²	46	52.2 Å²	52.2	28%	0.282	30%	0.302	S	S	.	.	H	α-helix	trans	-63.8	-44.1	175.1	-62.5	0	0	0	0	110.8	R427 Q436 E437 C442 L443 T444	R427-T440 WeakPolarHBondContact CD-OG1 3.36Å; R427-T440 PolarHBondContact NH1-OG1 2.93Å; Q436-T440 VanDerWaalsContact O-CB 3.29Å; Q436-T440 WeakPolarHBondContact O-CB 3.42Å; Q436-T440 PolarHBondContact O-N 3.2Å; Q436-T440 PolarHBondContact O-OG1 3.33Å; E437-T440 WeakPolarHBondContact O-CB 3.47Å; E437-T440 PolarHBondContact O-N 2.89Å; E437-T440 VanDerWaalsContact O-N 3.14Å; T440-C442 VanDerWaalsContact C-N 3.32Å; T440-C442 PolarHBondContact O-N 2.64Å; T440-L443 PolarHBondContact O-N 3.47Å; T440-T444 WeakPolarHBondContact O-CB 3Å; T440-T444 PolarHBondContact O-N 2.89Å; T440-T444 PolarHBondContact O-OG1 3.38Å; T440-T444 VanDerWaalsContact O-OG1 3.08Å
441	A	89	Confident	88.5	Confident	58 Å²	58	58 Å²	58	48%	0.479	33%	0.327	S	S	.	.	H	α-helix	trans	-60.3	-40.4	175.6	0	0	0	0	0	112.4	E437 M438 K445	E437-A441 PolarHBondContact O-N 3.5Å; M438-A441 PolarHBondContact O-N 3.42Å; A441-K445 WeakPolarHBondContact O-CG 3.14Å; A441-K445 PolarHBondContact O-N 3.35Å; A441-K445 VanDerWaalsContact O-N 3.14Å
442	C	87.6	Confident	89.2	Confident	31 Å²	31	57.5 Å²	57.5	21%	0.209	32%	0.32	C	S	.	.	H	α-helix	trans	-67.7	-45.9	175.3	-64.2	0	0	0	0	112.2	M438 L439 T440 T444 K445 V446	M438-C442 PolarHBondContact O-N 3.18Å; M438-C442 PolarHBondContact O-SG 3.45Å; L439-C442 PolarHBondContact O-N 2.86Å; T440-C442 VanDerWaalsContact C-N 3.32Å; T440-C442 PolarHBondContact O-N 2.64Å; C442-T444 PolarHBondContact O-N 2.87Å; C442-K445 WeakPolarHBondContact O-CB 3.19Å; C442-K445 PolarHBondContact O-N 3.01Å; C442-V446 PolarHBondContact O-N 2.88Å
443	L	91.6	Very high	89.7	Confident	4 Å²	4	54.6 Å²	54.6	2%	0.021	30%	0.3	C	S	.	.	H	α-helix	trans	-58.6	-47.2	176.1	173.7	151.2	0	0	0	111.3	L423 L439 T440 K445 V446 E447	L423-L443 HydrophobicContact CB-CD1 4.42Å; L439-L443 VanDerWaalsContact O-CB 3.24Å; L439-L443 WeakPolarHBondContact O-CB 3.04Å; L439-L443 PolarHBondContact O-N 3.44Å; T440-L443 PolarHBondContact O-N 3.47Å; L443-K445 VanDerWaalsContact C-N 3.29Å; L443-K445 PolarHBondContact O-N 2.87Å; L443-V446 PolarHBondContact O-N 3.43Å; L443-V446 VanDerWaalsContact O-N 3.11Å; L443-E447 VanDerWaalsContact CD2-CD 3.41Å; L443-E447 HydrophobicContact CD2-CG 4.25Å; L443-E447 WeakPolarHBondContact CD2-OE1 3.38Å; L443-E447 VanDerWaalsContact CD2-OE2 3.31Å; L443-E447 WeakPolarHBondContact CD2-OE2 3.26Å; L443-E447 WeakPolarHBondContact O-CG 3.42Å; L443-E447 PolarHBondContact O-N 2.93Å
444	T	92.4	Very high	90.2	Very high	58 Å²	58	52 Å²	52	36%	0.356	28%	0.28	S	S	.	.	H	α-helix	trans	-63.8	-30.5	177.6	-64	0	0	0	0	112.5	T440 C442 N448	T440-T444 WeakPolarHBondContact O-CB 3Å; T440-T444 PolarHBondContact O-N 2.89Å; T440-T444 PolarHBondContact O-OG1 3.38Å; T440-T444 VanDerWaalsContact O-OG1 3.08Å; C442-T444 PolarHBondContact O-N 2.87Å; T444-N448 WeakPolarHBondContact CG2-ND2 3.38Å; T444-N448 VanDerWaalsContact O-CB 3.28Å; T444-N448 WeakPolarHBondContact O-CB 3.32Å; T444-N448 VanDerWaalsContact O-CG 3.28Å; T444-N448 PolarHBondContact O-N 3.49Å; T444-N448 PolarHBondContact O-ND2 2.87Å
445	K	91.2	Very high	90.6	Very high	122 Å²	122	53.2 Å²	53.2	53%	0.53	28%	0.28	S	S	.	.	H	α-helix	trans	-63.9	-49	169.6	-76.3	179.4	174.6	-167.5	0	111.8	A441 C442 L443 N448 S449	A441-K445 WeakPolarHBondContact O-CG 3.14Å; A441-K445 PolarHBondContact O-N 3.35Å; A441-K445 VanDerWaalsContact O-N 3.14Å; C442-K445 WeakPolarHBondContact O-CB 3.19Å; C442-K445 PolarHBondContact O-N 3.01Å; L443-K445 VanDerWaalsContact C-N 3.29Å; L443-K445 PolarHBondContact O-N 2.87Å; K445-N448 PolarHBondContact O-N 2.82Å; K445-S449 WeakPolarHBondContact O-CB 3.45Å; K445-S449 PolarHBondContact O-N 3.49Å
446	V	92.1	Very high	91.1	Very high	9 Å²	9	54.1 Å²	54.1	6%	0.055	28%	0.283	C	S	.	.	H	α-helix	trans	-67	-39.5	-178.7	-173.6	0	0	0	0	111.3	W354 I419 P420 L423 C442 L443 S449 L450	W354-V446 HydrophobicContact CH2-CG2 4.11Å; W354-V446 HydrophobicContact CZ3-CG2 3.82Å; I419-V446 HydrophobicContact CG2-CG1 4.28Å; P420-V446 HydrophobicContact CG-CB 4.47Å; P420-V446 HydrophobicContact CG-CG1 3.84Å; L423-V446 HydrophobicContact CD1-CG2 4.29Å; C442-V446 PolarHBondContact O-N 2.88Å; L443-V446 PolarHBondContact O-N 3.43Å; L443-V446 VanDerWaalsContact O-N 3.11Å; V446-S449 WeakPolarHBondContact O-CB 3.33Å; V446-S449 PolarHBondContact O-N 3.37Å; V446-L450 WeakPolarHBondContact O-CB 3.2Å; V446-L450 PolarHBondContact O-N 2.94Å
447	E	93.5	Very high	91.4	Very high	92 Å²	92	52.5 Å²	52.5	43%	0.43	28%	0.276	S	S	.	.	H	α-helix	trans	-63.4	-43.5	174.4	-71.7	-179.4	157.5	0	0	112.4	P420 L443 S449 L450 K451	P420-E447 HydrophobicContact CB-CG 4.22Å; L443-E447 VanDerWaalsContact CD2-CD 3.41Å; L443-E447 HydrophobicContact CD2-CG 4.25Å; L443-E447 WeakPolarHBondContact CD2-OE1 3.38Å; L443-E447 VanDerWaalsContact CD2-OE2 3.31Å; L443-E447 WeakPolarHBondContact CD2-OE2 3.26Å; L443-E447 WeakPolarHBondContact O-CG 3.42Å; L443-E447 PolarHBondContact O-N 2.93Å; E447-S449 VanDerWaalsContact C-N 3.32Å; E447-S449 PolarHBondContact O-N 2.9Å; E447-L450 PolarHBondContact O-N 3.48Å; E447-K451 WeakPolarHBondContact O-CB 3.21Å; E447-K451 PolarHBondContact O-N 2.77Å
448	N	93.8	Very high	91.5	Very high	96 Å²	96	52.8 Å²	52.8	51%	0.513	27%	0.272	S	S	.	.	H	α-helix	trans	-66.1	-34.5	174.7	-78.3	-42.4	0	0	0	112.3	T444 K445 S452	T444-N448 WeakPolarHBondContact CG2-ND2 3.38Å; T444-N448 VanDerWaalsContact O-CB 3.28Å; T444-N448 WeakPolarHBondContact O-CB 3.32Å; T444-N448 VanDerWaalsContact O-CG 3.28Å; T444-N448 PolarHBondContact O-N 3.49Å; T444-N448 PolarHBondContact O-ND2 2.87Å; K445-N448 PolarHBondContact O-N 2.82Å; N448-S452 WeakPolarHBondContact O-CB 3.35Å; N448-S452 PolarHBondContact O-N 2.89Å
449	S	94.1	Very high	91.8	Very high	12 Å²	12	53.4 Å²	53.4	8%	0.084	27%	0.269	C	S	.	.	H	α-helix	trans	-66	-49.6	174.6	-162.1	0	0	0	0	111.1	D360 H365 Y416 K445 V446 E447 K451 S452 L453	D360-S449 PolarHBondContact O-OG 2.99Å; H365-S449 PolarHBondContact CE1-OG 2.71Å; H365-S449 PolarHBondContact NE2-O 3Å; H365-S449 VanDerWaalsContact NE2-O 3.16Å; H365-S449 PolarHBondContact NE2-OG 3.29Å; H365-S449 VanDerWaalsContact NE2-OG 3.13Å; Y416-S449 WeakPolarHBondContact OH-CB 3.39Å; Y416-S449 PolarHBondContact OH-OG 3.45Å; K445-S449 WeakPolarHBondContact O-CB 3.45Å; K445-S449 PolarHBondContact O-N 3.49Å; V446-S449 WeakPolarHBondContact O-CB 3.33Å; V446-S449 PolarHBondContact O-N 3.37Å; E447-S449 VanDerWaalsContact C-N 3.32Å; E447-S449 PolarHBondContact O-N 2.9Å; S449-K451 VanDerWaalsContact C-N 3.31Å; S449-K451 PolarHBondContact O-N 2.91Å; S449-S452 CarbonylContact O-C 3.55Å; S449-S452 WeakPolarHBondContact O-CA 3.34Å; S449-S452 VanDerWaalsContact O-CB 3.27Å; S449-S452 WeakPolarHBondContact O-CB 3.29Å; S449-S452 PolarHBondContact O-N 2.98Å; S449-L453 PolarHBondContact O-N 3.34Å
450	L	94.4	Very high	91.9	Very high	24 Å²	24	55.4 Å²	55.4	13%	0.126	28%	0.28	C	S	.	.	H	α-helix	trans	-59	-40	174.8	-176	63	0	0	0	112.3	Y416 M417 V446 E447 L453 E454	Y416-L450 HydrophobicContact CD1-CD1 4.11Å; Y416-L450 HydrophobicContact CE1-CB 4.47Å; Y416-L450 HydrophobicContact CE1-CD1 4.43Å; M417-L450 HydrophobicContact CG-CD1 4.19Å; V446-L450 WeakPolarHBondContact O-CB 3.2Å; V446-L450 PolarHBondContact O-N 2.94Å; E447-L450 PolarHBondContact O-N 3.48Å; L450-L453 HydrophobicContact CD1-CD2 4.48Å; L450-L453 WeakPolarHBondContact O-CB 3.46Å; L450-L453 PolarHBondContact O-N 2.97Å; L450-E454 PolarHBondContact O-N 3.41Å
451	K	93.4	Very high	91.8	Very high	122 Å²	122	56.5 Å²	56.5	53%	0.53	28%	0.28	S	S	.	.	H	α-helix	trans	-63.8	-40.4	172.5	-175.7	178.7	177.5	-177.7	0	112.3	E447 S449 L453 E454 D455	E447-K451 WeakPolarHBondContact O-CB 3.21Å; E447-K451 PolarHBondContact O-N 2.77Å; S449-K451 VanDerWaalsContact C-N 3.31Å; S449-K451 PolarHBondContact O-N 2.91Å; K451-L453 VanDerWaalsContact C-N 3.27Å; K451-L453 PolarHBondContact O-N 3.13Å; K451-E454 PolarHBondContact O-N 3.31Å; K451-D455 PolarHBondContact O-N 3.08Å
452	S	94.7	Very high	91.9	Very high	48 Å²	48	54.8 Å²	54.8	34%	0.336	26%	0.263	S	S	.	.	H	α-helix	trans	-61.4	-36.6	172.3	-167.1	0	0	0	0	111.6	N448 S449 D455 K456	N448-S452 WeakPolarHBondContact O-CB 3.35Å; N448-S452 PolarHBondContact O-N 2.89Å; S449-S452 CarbonylContact O-C 3.55Å; S449-S452 WeakPolarHBondContact O-CA 3.34Å; S449-S452 VanDerWaalsContact O-CB 3.27Å; S449-S452 WeakPolarHBondContact O-CB 3.29Å; S449-S452 PolarHBondContact O-N 2.98Å; S452-D455 PolarHBondContact O-N 2.93Å; S452-K456 WeakPolarHBondContact O-CB 3.47Å; S452-K456 WeakPolarHBondContact O-CG 3.46Å; S452-K456 PolarHBondContact O-N 3.43Å
453	L	93.4	Very high	92.1	Very high	2 Å²	2	55.8 Å²	55.8	1%	0.01	26%	0.264	C	S	.	.	H	α-helix	trans	-64	-45.6	172	-174.9	56.9	0	0	0	112.3	H365 C368 L369 S449 L450 K451 D455 K456 M457	H365-L453 HydrophobicContact CB-CD1 4.14Å; C368-L453 HydrophobicContact CB-CD1 4.17Å; C368-L453 HydrophobicContact CB-CD2 3.8Å; L369-L453 HydrophobicContact CD2-CD1 4.31Å; L369-L453 HydrophobicContact CG-CD1 4.06Å; S449-L453 PolarHBondContact O-N 3.34Å; L450-L453 HydrophobicContact CD1-CD2 4.48Å; L450-L453 WeakPolarHBondContact O-CB 3.46Å; L450-L453 PolarHBondContact O-N 2.97Å; K451-L453 VanDerWaalsContact C-N 3.27Å; K451-L453 PolarHBondContact O-N 3.13Å; L453-D455 VanDerWaalsContact C-N 3.31Å; L453-D455 PolarHBondContact O-N 3.23Å; L453-K456 PolarHBondContact O-N 3.2Å; L453-M457 HydrophobicContact CD1-CE 4Å; L453-M457 HydrophobicContact CD1-CG 4.23Å; L453-M457 HydrophobicContact CD2-CE 4.04Å; L453-M457 HydrophobicContact CG-CE 3.9Å; L453-M457 HydrophobicContact CG-CG 4.42Å; L453-M457 HydrophobicContact CG-SD 4.22Å; L453-M457 WeakPolarHBondContact O-CB 3.4Å; L453-M457 WeakPolarHBondContact O-CG 3.38Å; L453-M457 PolarHBondContact O-N 3.02Å
454	E	92.3	Very high	91.9	Very high	19 Å²	19	59 Å²	59	9%	0.089	28%	0.279	C	S	.	.	H	α-helix	trans	-57.6	-44.2	175.5	-65.1	-154.7	128.9	0	0	111.9	L450 K451 M457 R458 L888	L450-E454 PolarHBondContact O-N 3.41Å; K451-E454 PolarHBondContact O-N 3.31Å; E454-M457 PolarHBondContact O-N 3.21Å; E454-R458 VanDerWaalsContact O-CB 3.29Å; E454-R458 WeakPolarHBondContact O-CB 3.4Å; E454-R458 PolarHBondContact O-N 3.46Å; E454-L888 HydrophobicContact CG-CD1 3.79Å
455	D	91.9	Very high	91.8	Very high	73 Å²	73	57.8 Å²	57.8	39%	0.39	27%	0.268	S	S	.	.	H	α-helix	trans	-70.1	-37.9	179.5	-74.7	-30	0	0	0	111.9	K451 S452 L453 R458 W459	K451-D455 PolarHBondContact O-N 3.08Å; S452-D455 PolarHBondContact O-N 2.93Å; L453-D455 VanDerWaalsContact C-N 3.31Å; L453-D455 PolarHBondContact O-N 3.23Å; D455-R458 PolarHBondContact O-N 2.84Å; D455-R458 IonicContact OD1-CZ 3.66Å; D455-R458 IonicContact OD1-NH1 2.64Å; D455-R458 IonicContact OD1-NH2 3.39Å; D455-R458 PolarHBondContact OD1-NH2 2.95Å; D455-W459 WeakPolarHBondContact O-CB 3.4Å; D455-W459 PolarHBondContact O-N 2.94Å
456	K	92.9	Very high	91.7	Very high	52 Å²	52	52 Å²	52	23%	0.226	24%	0.243	C	C	.	.	H	α-helix	trans	-63.8	-44.1	171.7	-73.4	170.6	-171.4	174.8	0	112.1	E362 H365 L369 S452 L453 W459 L460	E362-K456 IonicContact OE1-NZ 3.51Å; E362-K456 PolarHBondContact OE1-NZ 2.89Å; E362-K456 IonicContact OE2-NZ 3.73Å; E362-K456 PolarHBondContact OE2-NZ 3.29Å; H365-K456 PolarHBondContact ND1-NZ 3.12Å; L369-K456 HydrophobicContact CD1-CB 4.22Å; L369-K456 HydrophobicContact CD1-CD 4.22Å; L369-K456 HydrophobicContact CD2-CB 3.98Å; S452-K456 WeakPolarHBondContact O-CB 3.47Å; S452-K456 WeakPolarHBondContact O-CG 3.46Å; S452-K456 PolarHBondContact O-N 3.43Å; L453-K456 PolarHBondContact O-N 3.2Å; K456-W459 PolarHBondContact O-N 2.91Å; K456-L460 WeakPolarHBondContact O-CB 3.49Å; K456-L460 PolarHBondContact O-N 3.08Å
457	M	91.4	Very high	91.5	Very high	24 Å²	24	56.6 Å²	56.6	12%	0.118	26%	0.264	C	S	.	.	H	α-helix	trans	-62.7	-42.1	175.8	-77	178.2	170	0	0	111.7	C368 L369 M413 L453 E454 L460 K461 L888	C368-M457 HydrophobicContact CB-CE 3.6Å; C368-M457 WeakPolarHBondContact O-CE 3.34Å; L369-M457 HydrophobicContact CD2-CB 4.48Å; L369-M457 HydrophobicContact CD2-CG 3.84Å; M413-M457 HydrophobicContact CE-CE 3.96Å; M413-M457 HydrophobicContact SD-CE 4.44Å; L453-M457 HydrophobicContact CD1-CE 4Å; L453-M457 HydrophobicContact CD1-CG 4.23Å; L453-M457 HydrophobicContact CD2-CE 4.04Å; L453-M457 HydrophobicContact CG-CE 3.9Å; L453-M457 HydrophobicContact CG-CG 4.42Å; L453-M457 HydrophobicContact CG-SD 4.22Å; L453-M457 WeakPolarHBondContact O-CB 3.4Å; L453-M457 WeakPolarHBondContact O-CG 3.38Å; L453-M457 PolarHBondContact O-N 3.02Å; E454-M457 PolarHBondContact O-N 3.21Å; M457-L460 PolarHBondContact O-N 3.18Å; M457-K461 WeakPolarHBondContact O-CG 3.47Å; M457-K461 PolarHBondContact O-N 3.14Å; M457-L888 HydrophobicContact SD-CD1 3.9Å; M457-L888 HydrophobicContact SD-CG 4.1Å
458	R	89.7	Confident	91.3	Very high	126 Å²	126	54.9 Å²	54.9	48%	0.475	26%	0.256	S	S	.	.	H	α-helix	trans	-65.1	-41.4	176.6	-166.9	-173.3	-49.6	166.1	15.3	111.4	E454 D455 N462 L887	E454-R458 VanDerWaalsContact O-CB 3.29Å; E454-R458 WeakPolarHBondContact O-CB 3.4Å; E454-R458 PolarHBondContact O-N 3.46Å; D455-R458 PolarHBondContact O-N 2.84Å; D455-R458 IonicContact OD1-CZ 3.66Å; D455-R458 IonicContact OD1-NH1 2.64Å; D455-R458 IonicContact OD1-NH2 3.39Å; D455-R458 PolarHBondContact OD1-NH2 2.95Å; R458-N462 WeakPolarHBondContact O-CB 3.35Å; R458-N462 PolarHBondContact O-N 3.34Å; R458-N462 VanDerWaalsContact O-N 3.1Å; R458-L887 HydrophobicContact CG-CD1 4.46Å
459	W	91	Very high	91	Very high	103 Å²	103	50.3 Å²	50.3	39%	0.39	23%	0.231	S	C	.	.	H	α-helix	trans	-62.9	-43.5	173.8	176.7	83.7	0	0	0	112	D455 K456 N462 F463 P507	D455-W459 WeakPolarHBondContact O-CB 3.4Å; D455-W459 PolarHBondContact O-N 2.94Å; K456-W459 PolarHBondContact O-N 2.91Å; W459-N462 WeakPolarHBondContact O-CB 3.34Å; W459-N462 PolarHBondContact O-N 2.76Å; W459-F463 HydrophobicContact CH2-CB 4.14Å; W459-F463 AromaticContact CH2-CD1 3.68Å; W459-F463 HydrophobicContact CH2-CD1 3.68Å; W459-F463 HydrophobicContact CH2-CE1 4.18Å; W459-F463 AromaticContact CH2-CG 3.88Å; W459-F463 HydrophobicContact CH2-CG 3.88Å; W459-F463 HydrophobicContact CZ2-CB 4.03Å; W459-F463 HydrophobicContact CZ2-CD1 4.14Å; W459-F463 HydrophobicContact CZ2-CD2 4.19Å; W459-F463 AromaticContact CZ2-CG 3.87Å; W459-F463 HydrophobicContact CZ2-CG 3.87Å; W459-F463 HydrophobicContact CZ3-CB 4.46Å; W459-F463 HydrophobicContact CZ3-CD1 4.29Å; W459-F463 WeakPolarHBondContact O-CB 3.45Å; W459-F463 PolarHBondContact O-N 3.31Å; W459-P507 HydrophobicContact CZ2-CB 3.86Å; W459-P507 PolarHBondContact NE1-O 3.41Å
460	L	90.5	Very high	90.7	Very high	42 Å²	42	53 Å²	53	22%	0.22	24%	0.242	C	C	.	.	H	α-helix	trans	-61.4	-52.9	178.8	-178.4	60.9	0	0	0	111.3	L369 K456 M457 N462 F463 E464	L369-L460 HydrophobicContact CB-CD2 4.46Å; L369-L460 HydrophobicContact CD2-CD2 4.11Å; K456-L460 WeakPolarHBondContact O-CB 3.49Å; K456-L460 PolarHBondContact O-N 3.08Å; M457-L460 PolarHBondContact O-N 3.18Å; L460-N462 VanDerWaalsContact C-N 3.27Å; L460-N462 PolarHBondContact O-N 3.36Å; L460-F463 PolarHBondContact O-N 3.16Å; L460-E464 HydrophobicContact CD1-CG 4.27Å; L460-E464 HydrophobicContact CG-CG 4.48Å; L460-E464 WeakPolarHBondContact O-CG 3.12Å; L460-E464 PolarHBondContact O-N 3.36Å
461	K	87.9	Confident	90.3	Very high	69 Å²	69	56.4 Å²	56.4	30%	0.3	27%	0.269	S	S	.	.	H	α-helix	trans	-54.1	-42.2	175.3	-72.1	176.6	177.5	-179	0	112.4	M457 E464 R465 R891	M457-K461 WeakPolarHBondContact O-CG 3.47Å; M457-K461 PolarHBondContact O-N 3.14Å; K461-E464 WeakPolarHBondContact CA-OE2 3.44Å; K461-R465 WeakPolarHBondContact O-CB 3.37Å; K461-R465 PolarHBondContact O-N 3.06Å; K461-R465 VanDerWaalsContact O-N 3.1Å; K461-R891 VanDerWaalsContact CE-CZ 3.44Å
462	N	90.8	Very high	90.1	Very high	22 Å²	22	52 Å²	52	12%	0.118	25%	0.25	C	S	.	.	H	α-helix	trans	-64	-44.8	174.5	166	85.4	0	0	0	111.8	R458 W459 L460 R465 L466 R509 Q510 L511	R458-N462 WeakPolarHBondContact O-CB 3.35Å; R458-N462 PolarHBondContact O-N 3.34Å; R458-N462 VanDerWaalsContact O-N 3.1Å; W459-N462 WeakPolarHBondContact O-CB 3.34Å; W459-N462 PolarHBondContact O-N 2.76Å; L460-N462 VanDerWaalsContact C-N 3.27Å; L460-N462 PolarHBondContact O-N 3.36Å; N462-R465 PolarHBondContact O-N 3.05Å; N462-L466 VanDerWaalsContact O-CG 3.26Å; N462-L466 WeakPolarHBondContact O-CG 3.12Å; N462-L466 PolarHBondContact O-N 3.48Å; N462-R509 PolarHBondContact ND2-O 3.06Å; N462-Q510 WeakPolarHBondContact OD1-CA 3.2Å; N462-L511 PolarHBondContact OD1-N 2.85Å
463	F	90.2	Very high	89.8	Confident	52 Å²	52	50.6 Å²	50.6	23%	0.228	24%	0.238	C	C	.	.	H	α-helix	trans	-67.6	-39.1	-178.9	-176.8	-121.7	0	0	0	112.6	W459 L460 L466 Q467 P507	W459-F463 HydrophobicContact CH2-CB 4.14Å; W459-F463 AromaticContact CH2-CD1 3.68Å; W459-F463 HydrophobicContact CH2-CD1 3.68Å; W459-F463 HydrophobicContact CH2-CE1 4.18Å; W459-F463 AromaticContact CH2-CG 3.88Å; W459-F463 HydrophobicContact CH2-CG 3.88Å; W459-F463 HydrophobicContact CZ2-CB 4.03Å; W459-F463 HydrophobicContact CZ2-CD1 4.14Å; W459-F463 HydrophobicContact CZ2-CD2 4.19Å; W459-F463 AromaticContact CZ2-CG 3.87Å; W459-F463 HydrophobicContact CZ2-CG 3.87Å; W459-F463 HydrophobicContact CZ3-CB 4.46Å; W459-F463 HydrophobicContact CZ3-CD1 4.29Å; W459-F463 WeakPolarHBondContact O-CB 3.45Å; W459-F463 PolarHBondContact O-N 3.31Å; L460-F463 PolarHBondContact O-N 3.16Å; F463-L466 PolarHBondContact O-N 2.97Å; F463-Q467 WeakPolarHBondContact O-CG 3.45Å; F463-Q467 PolarHBondContact O-N 2.96Å; F463-P507 HydrophobicContact CD2-CB 4.21Å; F463-P507 HydrophobicContact CE2-CB 3.98Å
464	E	88.7	Confident	89.4	Confident	73 Å²	73	54.3 Å²	54.3	34%	0.341	26%	0.257	S	S	.	.	H	α-helix	trans	-59.8	-48.2	171.3	-69.1	165.5	156.5	0	0	110.9	L460 K461 L466 Q467 E468	L460-E464 HydrophobicContact CD1-CG 4.27Å; L460-E464 HydrophobicContact CG-CG 4.48Å; L460-E464 WeakPolarHBondContact O-CG 3.12Å; L460-E464 PolarHBondContact O-N 3.36Å; K461-E464 WeakPolarHBondContact CA-OE2 3.44Å; E464-L466 VanDerWaalsContact C-N 3.34Å; E464-L466 PolarHBondContact O-N 3.13Å; E464-Q467 PolarHBondContact O-N 3.18Å; E464-Q467 VanDerWaalsContact O-N 3.17Å; E464-E468 PolarHBondContact O-N 3.47Å
465	R	89.4	Confident	89.1	Confident	31 Å²	31	55.2 Å²	55.2	12%	0.117	26%	0.26	C	S	.	.	H	α-helix	trans	-63	-36.8	176.1	-174	59.2	176.1	162.1	7.5	112.6	K461 N462 E468 I469 L511 E514 S560 T562	K461-R465 WeakPolarHBondContact O-CB 3.37Å; K461-R465 PolarHBondContact O-N 3.06Å; K461-R465 VanDerWaalsContact O-N 3.1Å; N462-R465 PolarHBondContact O-N 3.05Å; R465-E468 IonicContact CZ-OE2 3.46Å; R465-E468 IonicContact NH1-OE1 3.5Å; R465-E468 PolarHBondContact NH1-OE1 2.99Å; R465-E468 IonicContact NH1-OE2 3.72Å; R465-E468 PolarHBondContact NH1-OE2 3.09Å; R465-E468 PolarHBondContact O-N 2.93Å; R465-I469 HydrophobicContact CG-CD1 3.95Å; R465-I469 WeakPolarHBondContact O-CB 3.43Å; R465-I469 WeakPolarHBondContact O-CD1 3.26Å; R465-I469 VanDerWaalsContact O-CG1 3.24Å; R465-I469 WeakPolarHBondContact O-CG1 3.34Å; R465-I469 PolarHBondContact O-N 2.73Å; R465-L511 HydrophobicContact CG-CD2 3.76Å; R465-E514 IonicContact CZ-OE1 3.58Å; R465-E514 IonicContact CZ-OE2 3.06Å; R465-E514 IonicContact NE-OE1 2.69Å; R465-E514 PolarHBondContact NE-OE1 3.36Å; R465-E514 IonicContact NE-OE2 2.82Å; R465-E514 PolarHBondContact NE-OE2 3.12Å; R465-E514 VanDerWaalsContact NH2-CD 3.27Å; R465-E514 IonicContact NH2-OE1 2.79Å; R465-E514 PolarHBondContact NH2-OE1 3.17Å; R465-E514 IonicContact NH2-OE2 3.68Å; R465-E514 PolarHBondContact NH2-OE2 3.23Å; R465-S560 PolarHBondContact NH1-OG 3.3Å; R465-T562 PolarHBondContact NH1-OG1 3.21Å; R465-T562 PolarHBondContact NH2-OG1 2.92Å; R465-T562 VanDerWaalsContact NH2-OG1 3.15Å
466	L	90.2	Very high	88.7	Confident	2 Å²	2	52.1 Å²	52.1	1%	0.01	24%	0.244	C	C	.	.	H	α-helix	trans	-63.3	-40	173.6	-72.5	171.8	0	0	0	112.1	N462 F463 E464 Q470 I504 R509 F533	N462-L466 VanDerWaalsContact O-CG 3.26Å; N462-L466 WeakPolarHBondContact O-CG 3.12Å; N462-L466 PolarHBondContact O-N 3.48Å; F463-L466 PolarHBondContact O-N 2.97Å; E464-L466 VanDerWaalsContact C-N 3.34Å; E464-L466 PolarHBondContact O-N 3.13Å; L466-Q470 WeakPolarHBondContact O-CB 3.46Å; L466-Q470 PolarHBondContact O-N 3.43Å; L466-I504 HydrophobicContact CB-CG2 4.23Å; L466-I504 HydrophobicContact CD2-CG2 3.64Å; L466-R509 HydrophobicContact CD1-CB 4.49Å; L466-R509 WeakPolarHBondContact CD1-O 3.42Å; L466-F533 HydrophobicContact CD2-CD1 4.11Å; L466-F533 HydrophobicContact CD2-CE1 3.56Å
467	Q	88.1	Confident	88.3	Confident	104 Å²	104	50.5 Å²	50.5	49%	0.486	24%	0.239	S	C	.	.	H	α-helix	trans	-66.6	-43.1	174.2	-70	-176.8	37.3	0	0	111.8	F463 E464 Q470 S471	F463-Q467 WeakPolarHBondContact O-CG 3.45Å; F463-Q467 PolarHBondContact O-N 2.96Å; E464-Q467 PolarHBondContact O-N 3.18Å; E464-Q467 VanDerWaalsContact O-N 3.17Å; Q467-Q470 PolarHBondContact O-N 3.49Å; Q467-S471 PolarHBondContact O-N 3.22Å
468	E	88.2	Confident	87.8	Confident	56 Å²	56	51.3 Å²	51.3	26%	0.262	25%	0.245	S	C	.	.	H	α-helix	trans	-58.2	-51.6	176.3	-165.4	-155.3	149.9	0	0	110.7	E464 R465 Q470 S471 Q472 T562	E464-E468 PolarHBondContact O-N 3.47Å; R465-E468 IonicContact CZ-OE2 3.46Å; R465-E468 IonicContact NH1-OE1 3.5Å; R465-E468 PolarHBondContact NH1-OE1 2.99Å; R465-E468 IonicContact NH1-OE2 3.72Å; R465-E468 PolarHBondContact NH1-OE2 3.09Å; R465-E468 PolarHBondContact O-N 2.93Å; E468-Q470 VanDerWaalsContact C-N 3.33Å; E468-Q470 PolarHBondContact O-N 3.48Å; E468-S471 PolarHBondContact O-N 2.59Å; E468-S471 VanDerWaalsContact O-N 3.1Å; E468-S471 PolarHBondContact O-OG 3.48Å; E468-Q472 WeakPolarHBondContact O-CG 3.43Å; E468-Q472 PolarHBondContact O-N 3.45Å; E468-Q472 VanDerWaalsContact O-N 3.07Å; E468-Q472 PolarHBondContact OE1-NE2 3.37Å; E468-T562 PolarHBondContact OE1-OG1 3.11Å
469	I	88.3	Confident	87.3	Confident	0 Å²	0	48 Å²	48	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-58.6	-44.7	176.9	-67.1	164.3	0	0	0	110.5	R465 S471 Q472 L473 I504 L511 F531	R465-I469 HydrophobicContact CG-CD1 3.95Å; R465-I469 WeakPolarHBondContact O-CB 3.43Å; R465-I469 WeakPolarHBondContact O-CD1 3.26Å; R465-I469 VanDerWaalsContact O-CG1 3.24Å; R465-I469 WeakPolarHBondContact O-CG1 3.34Å; R465-I469 PolarHBondContact O-N 2.73Å; I469-S471 VanDerWaalsContact C-N 3.29Å; I469-S471 PolarHBondContact O-N 3.3Å; I469-Q472 PolarHBondContact O-N 3.09Å; I469-L473 WeakPolarHBondContact O-CB 3.35Å; I469-L473 PolarHBondContact O-N 3.06Å; I469-I504 HydrophobicContact CG2-CD1 3.79Å; I469-L511 HydrophobicContact CD1-CD2 3.73Å; I469-F531 HydrophobicContact CB-CE1 4.5Å; I469-F531 HydrophobicContact CD1-CD1 3.61Å; I469-F531 HydrophobicContact CD1-CE1 3.51Å; I469-F531 HydrophobicContact CD1-CZ 4.48Å; I469-F531 HydrophobicContact CG1-CD1 4.22Å; I469-F531 HydrophobicContact CG1-CE1 3.62Å; I469-F531 HydrophobicContact CG1-CZ 4.21Å; I469-F531 HydrophobicContact CG2-CD1 4.42Å; I469-F531 HydrophobicContact CG2-CE1 4.04Å; I469-F531 HydrophobicContact CG2-CE2 4.39Å; I469-F531 HydrophobicContact CG2-CZ 4.01Å
470	Q	87.7	Confident	86.9	Confident	68 Å²	68	48.5 Å²	48.5	32%	0.318	25%	0.248	S	C	.	.	H	α-helix	trans	-61.2	-37.5	177.5	-172.2	-176.6	-1	0	0	112.3	L466 Q467 E468 Q472	L466-Q470 WeakPolarHBondContact O-CB 3.46Å; L466-Q470 PolarHBondContact O-N 3.43Å; Q467-Q470 PolarHBondContact O-N 3.49Å; E468-Q470 VanDerWaalsContact C-N 3.33Å; E468-Q470 PolarHBondContact O-N 3.48Å; Q470-Q472 VanDerWaalsContact C-N 3.32Å
471	S	85.9	Confident	86.4	Confident	97 Å²	97	49.1 Å²	49.1	68%	0.678	25%	0.251	S	S	*	.	H	α-helix	trans	-70	-27.8	177.3	77.9	0	0	0	0	113.5	Q467 E468 I469	Q467-S471 PolarHBondContact O-N 3.22Å; E468-S471 PolarHBondContact O-N 2.59Å; E468-S471 VanDerWaalsContact O-N 3.1Å; E468-S471 PolarHBondContact O-OG 3.48Å; I469-S471 VanDerWaalsContact C-N 3.29Å; I469-S471 PolarHBondContact O-N 3.3Å
472	Q	88.1	Confident	86	Confident	30 Å²	30	51.5 Å²	51.5	14%	0.14	26%	0.264	C	S	.	.	H	α-helix	trans	-93.9	-9.3	-178.9	-68.9	170.8	8.1	0	0	113.4	E468 I469 Q470 F567	E468-Q472 WeakPolarHBondContact O-CG 3.43Å; E468-Q472 PolarHBondContact O-N 3.45Å; E468-Q472 VanDerWaalsContact O-N 3.07Å; E468-Q472 PolarHBondContact OE1-NE2 3.37Å; I469-Q472 PolarHBondContact O-N 3.09Å; Q470-Q472 VanDerWaalsContact C-N 3.32Å; Q472-F567 HydrophobicContact CB-CD2 3.95Å; Q472-F567 HydrophobicContact CB-CE2 4.39Å; Q472-F567 PolarHBondContact O-N 2.93Å
473	L	88.3	Confident	85.4	Confident	17 Å²	17	55.9 Å²	55.9	9%	0.089	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	123.1	-172.2	-170.6	67.8	0	0	0	113.6	I469 W475 I504 L538 T540 F567 V569	I469-L473 WeakPolarHBondContact O-CB 3.35Å; I469-L473 PolarHBondContact O-N 3.06Å; L473-W475 HydrophobicContact CD2-CZ2 3.69Å; L473-I504 HydrophobicContact CD2-CD1 3.41Å; L473-I504 VanDerWaalsContact CD2-CD1 3.41Å; L473-I504 HydrophobicContact CD2-CG1 4.46Å; L473-L538 HydrophobicContact CD1-CD2 4.45Å; L473-L538 HydrophobicContact CD2-CD2 3.93Å; L473-T540 HydrophobicContact CD1-CG2 3.77Å; L473-F567 WeakPolarHBondContact CA-O 3.45Å; L473-F567 HydrophobicContact CD1-CB 3.65Å; L473-V569 HydrophobicContact CD1-CG2 3.63Å; L473-V569 HydrophobicContact CD2-CG2 4.06Å; L473-V569 HydrophobicContact CG-CG2 3.97Å
474	I	86.4	Confident	85	Confident	80 Å²	80	65.1 Å²	65.1	41%	0.41	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	123.4	169.7	-61.1	-178.8	0	0	0	109.6	V566 F567 V568 V569	I474-V566 HydrophobicContact CD1-CG1 3.49Å; I474-V566 VanDerWaalsContact CD1-CG1 3.49Å; I474-V566 HydrophobicContact CG1-CG1 3.84Å; I474-F567 PolarHBondContact N-O 3.03Å; I474-V568 HydrophobicContact CB-CG2 4.42Å; I474-V569 PolarHBondContact O-N 3.07Å
475	W	85.6	Confident	84.7	Confident	39 Å²	39	64.8 Å²	64.8	15%	0.148	33%	0.329	C	S	.	.			trans	-89.5	114.9	166.1	-64.7	90.5	0	0	0	109	L473 Q498 L503 L538 V569 V573	L473-W475 HydrophobicContact CD2-CZ2 3.69Å; W475-Q498 HydrophobicContact CB-CB 4.01Å; W475-Q498 HydrophobicContact CB-CG 3.94Å; W475-L503 HydrophobicContact CH2-CD2 3.89Å; W475-L503 HydrophobicContact CZ2-CB 4.35Å; W475-L503 HydrophobicContact CZ2-CD2 4.26Å; W475-L538 HydrophobicContact CH2-CD1 3.98Å; W475-L538 HydrophobicContact CZ3-CD1 4.47Å; W475-V569 HydrophobicContact CD2-CG2 3.85Å; W475-V569 HydrophobicContact CE3-CB 4.11Å; W475-V569 HydrophobicContact CE3-CG1 4.1Å; W475-V569 HydrophobicContact CE3-CG2 3.66Å; W475-V569 HydrophobicContact CG-CG2 4.47Å; W475-V569 HydrophobicContact CH2-CG2 4.13Å; W475-V569 HydrophobicContact CZ2-CG2 4.32Å; W475-V569 HydrophobicContact CZ3-CB 4.31Å; W475-V569 HydrophobicContact CZ3-CG1 3.89Å; W475-V569 HydrophobicContact CZ3-CG2 3.81Å; W475-V573 HydrophobicContact CH2-CG1 3.9Å; W475-V573 HydrophobicContact CZ3-CG1 4.21Å
476	P	83.5	Confident	84.5	Confident	7 Å²	7	71.5 Å²	71.5	5%	0.045	36%	0.36	C	S	.	.			trans	-69	156.7	178.7	-14.2	27.4	0	0	0	112.3	E480 L481 Q498 V568 V569	P476-E480 HydrophobicContact CB-CB 3.69Å; P476-E480 HydrophobicContact CB-CG 4.45Å; P476-L481 HydrophobicContact CB-CD1 4.48Å; P476-L481 HydrophobicContact CB-CG 4.18Å; P476-L481 HydrophobicContact CG-CG 4.36Å; P476-Q498 VanDerWaalsContact O-CG 3.24Å; P476-Q498 WeakPolarHBondContact O-CG 3.46Å; P476-Q498 PolarHBondContact O-NE2 3.48Å; P476-V568 HydrophobicContact CG-CG1 3.74Å; P476-V569 VanDerWaalsContact CG-O 3.3Å; P476-V569 WeakPolarHBondContact CG-O 3.07Å
477	S	83.4	Confident	84.2	Confident	18 Å²	18	71.8 Å²	71.8	13%	0.126	36%	0.361	C	S	.	.			trans	-62.4	159.1	169	64.1	0	0	0	0	111.4	S479 E480 L481	S477-S479 PolarHBondContact O-N 3.34Å; S477-E480 WeakPolarHBondContact CB-OE1 3.25Å; S477-E480 PolarHBondContact N-OE1 3.02Å; S477-E480 PolarHBondContact O-N 3.04Å; S477-E480 WeakPolarHBondContact OG-CG 3.1Å; S477-E480 PolarHBondContact OG-OE1 2.68Å; S477-L481 PolarHBondContact O-N 3.26Å
478	V	81.2	Confident	84.1	Confident	41 Å²	41	68.9 Å²	68.9	25%	0.248	35%	0.351	C	S	.	.	H	α-helix	trans	-56.1	-37.9	177.1	-178.6	0	0	0	0	111	E480 L481 E482 I487 L495	V478-E480 VanDerWaalsContact C-N 3.29Å; V478-E480 PolarHBondContact O-N 2.88Å; V478-L481 PolarHBondContact O-N 3.4Å; V478-E482 PolarHBondContact O-N 3.23Å; V478-I487 HydrophobicContact CB-CD1 4.07Å; V478-I487 HydrophobicContact CG1-CD1 4.07Å; V478-L495 HydrophobicContact CG2-CB 4.46Å
479	S	79.5	Confident	83.9	Confident	56 Å²	56	72.4 Å²	72.4	39%	0.392	37%	0.368	S	S	.	.	H	α-helix	trans	-59.7	-31.3	176.1	-47.5	0	0	0	0	114.4	S477 P483	S477-S479 PolarHBondContact O-N 3.34Å; S479-P483 WeakPolarHBondContact O-CA 3.48Å
480	E	82.3	Confident	83.9	Confident	115 Å²	115	80.1 Å²	80.1	54%	0.537	40%	0.402	S	S	.	.	H	α-helix	trans	-83.8	-33.9	178.7	-73.5	165.4	-87.3	0	0	112.4	P476 S477 V478	P476-E480 HydrophobicContact CB-CB 3.69Å; P476-E480 HydrophobicContact CB-CG 4.45Å; S477-E480 WeakPolarHBondContact CB-OE1 3.25Å; S477-E480 PolarHBondContact N-OE1 3.02Å; S477-E480 PolarHBondContact O-N 3.04Å; S477-E480 WeakPolarHBondContact OG-CG 3.1Å; S477-E480 PolarHBondContact OG-OE1 2.68Å; V478-E480 VanDerWaalsContact C-N 3.29Å; V478-E480 PolarHBondContact O-N 2.88Å
481	L	80	Confident	83.7	Confident	54 Å²	54	80.1 Å²	80.1	28%	0.283	40%	0.403	S	S	.	.	H	α-helix	trans	-71.7	-44.5	177.4	-77.4	156.1	0	0	0	111.4	P476 S477 V478 Y570	P476-L481 HydrophobicContact CB-CD1 4.48Å; P476-L481 HydrophobicContact CB-CG 4.18Å; P476-L481 HydrophobicContact CG-CG 4.36Å; S477-L481 PolarHBondContact O-N 3.26Å; V478-L481 PolarHBondContact O-N 3.4Å; L481-Y570 WeakPolarHBondContact CD2-O 3.48Å
482	E	80.8	Confident	83.6	Confident	120 Å²	120	80.1 Å²	80.1	56%	0.561	39%	0.389	S	S	*	.			trans	-130.2	78.5	-179.6	-60	-155.4	139.8	0	0	112	V478 R484 V485	V478-E482 PolarHBondContact O-N 3.23Å; E482-R484 PolarHBondContact O-N 2.9Å; E482-V485 HydrophobicContact CB-CB 4.45Å; E482-V485 HydrophobicContact CB-CG2 3.64Å; E482-V485 PolarHBondContact O-N 3.4Å; E482-V485 WeakPolarHBondContact OE2-CG2 3.3Å
483	P	78.2	Confident	83.2	Confident	113 Å²	113	85.8 Å²	85.8	73%	0.734	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	7.7	-176.9	28.6	-37.5	0	0	0	115.1	S479	S479-P483 WeakPolarHBondContact O-CA 3.48Å
484	R	80.9	Confident	82.8	Confident	246 Å²	246	89.2 Å²	89.2	93%	0.928	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.3	-5.5	172.6	-64	-172.5	-65.5	174.5	0.6	113.1	E482	E482-R484 PolarHBondContact O-N 2.9Å
485	V	83.2	Confident	82.5	Confident	67 Å²	67	88.5 Å²	88.5	41%	0.406	44%	0.437	S	S	.	.			trans	-80.4	125.3	178.6	173.7	0	0	0	0	110	E482 I487	E482-V485 HydrophobicContact CB-CB 4.45Å; E482-V485 HydrophobicContact CB-CG2 3.64Å; E482-V485 PolarHBondContact O-N 3.4Å; E482-V485 WeakPolarHBondContact OE2-CG2 3.3Å; V485-I487 HydrophobicContact CG1-CG1 3.98Å; V485-I487 PolarHBondContact O-N 2.91Å
486	F	85.4	Confident	82.1	Confident	172 Å²	172	91.1 Å²	91.1	75%	0.754	45%	0.453	S	S	*	.			trans	-75.4	113.7	170.2	178.4	-97.1	0	0	0	110	P488	F486-P488 HydrophobicContact CD1-CG 4.5Å; F486-P488 HydrophobicContact CE1-CG 4.08Å
487	I	82.4	Confident	81.6	Confident	8 Å²	8	98.8 Å²	98.8	4%	0.041	48%	0.481	C	S	.	.			trans	-106.8	119.8	174.6	-57.3	-178.3	0	0	0	108.8	V478 V485 L491 R492 L495	V478-I487 HydrophobicContact CB-CD1 4.07Å; V478-I487 HydrophobicContact CG1-CD1 4.07Å; V485-I487 HydrophobicContact CG1-CG1 3.98Å; V485-I487 PolarHBondContact O-N 2.91Å; I487-L491 HydrophobicContact CG2-CB 4.21Å; I487-R492 HydrophobicContact CG2-CG 3.9Å; I487-R492 PolarHBondContact O-NH1 3.22Å; I487-R492 PolarHBondContact O-NH2 2.73Å; I487-L495 HydrophobicContact CD1-CD1 4.45Å; I487-L495 HydrophobicContact CG2-CD1 3.97Å
488	P	86.2	Confident	81.3	Confident	43 Å²	43	99.6 Å²	99.6	28%	0.279	48%	0.483	S	S	.	.			trans	-60.1	143.5	171.2	-24.1	34	0	0	0	112.5	F486 F490 L491 R492	F486-P488 HydrophobicContact CD1-CG 4.5Å; F486-P488 HydrophobicContact CE1-CG 4.08Å; P488-F490 VanDerWaalsContact C-N 3.33Å; P488-F490 HydrophobicContact CB-CD1 3.75Å; P488-F490 HydrophobicContact CB-CE1 3.43Å; P488-F490 VanDerWaalsContact CB-CE1 3.43Å; P488-F490 HydrophobicContact CB-CZ 4.21Å; P488-F490 HydrophobicContact CG-CE1 4.23Å; P488-F490 PolarHBondContact O-N 3.5Å; P488-L491 HydrophobicContact CG-CD1 4.48Å; P488-L491 PolarHBondContact O-N 2.8Å; P488-R492 PolarHBondContact O-N 3.14Å
489	E	84.2	Confident	80.9	Confident	129 Å²	129	103.9 Å²	103.9	60%	0.603	51%	0.511	S	S	*	.	H	α-helix	trans	-54.9	-45	-173.4	-169.3	57.7	-120.6	0	0	113.1	L491 R492	E489-L491 PolarHBondContact O-N 2.67Å; E489-R492 WeakPolarHBondContact O-CB 3.48Å; E489-R492 PolarHBondContact O-N 3.26Å; E489-R492 WeakPolarHBondContact OE1-CD 3.48Å; E489-R492 IonicContact OE2-CZ 2.83Å; E489-R492 IonicContact OE2-NE 2.68Å; E489-R492 IonicContact OE2-NH1 2.62Å; E489-R492 PolarHBondContact OE2-NH1 2.95Å
490	F	88.1	Confident	80.6	Confident	162 Å²	162	102.9 Å²	102.9	71%	0.711	50%	0.504	S	S	*	.	H	α-helix	trans	-62.7	-16.4	-180	73.2	-89.1	0	0	0	114.4	P488	P488-F490 VanDerWaalsContact C-N 3.33Å; P488-F490 HydrophobicContact CB-CD1 3.75Å; P488-F490 HydrophobicContact CB-CE1 3.43Å; P488-F490 VanDerWaalsContact CB-CE1 3.43Å; P488-F490 HydrophobicContact CB-CZ 4.21Å; P488-F490 HydrophobicContact CG-CE1 4.23Å; P488-F490 PolarHBondContact O-N 3.5Å
491	L	85	Confident	80	Confident	68 Å²	68	100.9 Å²	100.9	36%	0.356	50%	0.495	S	S	.	.	H	α-helix	trans	-96.7	-16.5	173.4	-63.8	-178.2	0	0	0	113.3	I487 P488 E489 Q493 S494 L495	I487-L491 HydrophobicContact CG2-CB 4.21Å; P488-L491 HydrophobicContact CG-CD1 4.48Å; P488-L491 PolarHBondContact O-N 2.8Å; E489-L491 PolarHBondContact O-N 2.67Å; L491-Q493 PolarHBondContact O-N 3.31Å; L491-S494 PolarHBondContact O-N 2.96Å; L491-S494 VanDerWaalsContact O-N 3.14Å; L491-L495 HydrophobicContact CB-CD1 4.05Å; L491-L495 WeakPolarHBondContact O-CB 3.43Å; L491-L495 WeakPolarHBondContact O-CG 3.25Å; L491-L495 PolarHBondContact O-N 2.71Å
492	R	82.9	Confident	79.7	Confident	98 Å²	98	108 Å²	108	37%	0.37	52%	0.518	S	S	.	.	H	α-helix	trans	-56.2	-50.3	-178.3	-74.4	-170.5	167.3	96.2	13.4	111.2	I487 P488 E489 S494 L495 I496	I487-R492 HydrophobicContact CG2-CG 3.9Å; I487-R492 PolarHBondContact O-NH1 3.22Å; I487-R492 PolarHBondContact O-NH2 2.73Å; P488-R492 PolarHBondContact O-N 3.14Å; E489-R492 WeakPolarHBondContact O-CB 3.48Å; E489-R492 PolarHBondContact O-N 3.26Å; E489-R492 WeakPolarHBondContact OE1-CD 3.48Å; E489-R492 IonicContact OE2-CZ 2.83Å; E489-R492 IonicContact OE2-NE 2.68Å; E489-R492 IonicContact OE2-NH1 2.62Å; E489-R492 PolarHBondContact OE2-NH1 2.95Å; R492-S494 PolarHBondContact O-N 3.16Å; R492-S494 VanDerWaalsContact O-N 3.16Å; R492-L495 PolarHBondContact O-N 3.45Å; R492-I496 WeakPolarHBondContact O-CG1 3.5Å; R492-I496 PolarHBondContact O-N 2.85Å; R492-I496 VanDerWaalsContact O-N 3.08Å
493	Q	79.3	Confident	79.4	Confident	149 Å²	149	104.8 Å²	104.8	70%	0.696	50%	0.504	S	S	*	.	H	α-helix	trans	-58.6	-31.6	-179	-171.3	55.4	63.2	0	0	113.4	L491	L491-Q493 PolarHBondContact O-N 3.31Å
494	S	80.4	Confident	79.5	Confident	89 Å²	89	99.5 Å²	99.5	62%	0.622	47%	0.47	S	S	*	.	H	α-helix	trans	-81.8	-22.5	177.7	-55.1	0	0	0	0	113.8	L491 R492	L491-S494 PolarHBondContact O-N 2.96Å; L491-S494 VanDerWaalsContact O-N 3.14Å; R492-S494 PolarHBondContact O-N 3.16Å; R492-S494 VanDerWaalsContact O-N 3.16Å
495	L	80.7	Confident	79.1	Confident	65 Å²	65	89.6 Å²	89.6	34%	0.34	44%	0.44	S	S	.	.	H	α-helix	trans	-106.8	4.5	-175.6	-63.8	175.3	0	0	0	114	V478 I487 L491 R492 R497	V478-L495 HydrophobicContact CG2-CB 4.46Å; I487-L495 HydrophobicContact CD1-CD1 4.45Å; I487-L495 HydrophobicContact CG2-CD1 3.97Å; L491-L495 HydrophobicContact CB-CD1 4.05Å; L491-L495 WeakPolarHBondContact O-CB 3.43Å; L491-L495 WeakPolarHBondContact O-CG 3.25Å; L491-L495 PolarHBondContact O-N 2.71Å; R492-L495 PolarHBondContact O-N 3.45Å; L495-R497 VanDerWaalsContact C-N 3.31Å
496	I	77.3	Confident	78.9	Confident	93 Å²	93	89.8 Å²	89.8	48%	0.477	44%	0.439	S	S	.	.	S	Bend	trans	-62.1	-37.7	171.5	-78.3	164.5	0	0	0	111.6	R492	R492-I496 WeakPolarHBondContact O-CG1 3.5Å; R492-I496 PolarHBondContact O-N 2.85Å; R492-I496 VanDerWaalsContact O-N 3.08Å
497	R	72.1	Confident	78.5	Confident	169 Å²	169	84.4 Å²	84.4	64%	0.638	42%	0.421	S	S	*	.	S	Bend	trans	-109.7	143.1	-179.3	-75.2	-173.6	174	-104.4	4.5	111.6	L495 E501	L495-R497 VanDerWaalsContact C-N 3.31Å; R497-E501 WeakPolarHBondContact CB-OE1 3.5Å; R497-E501 VanDerWaalsContact CD-OE1 3.29Å; R497-E501 WeakPolarHBondContact CD-OE1 3.36Å; R497-E501 VanDerWaalsContact CG-OE1 3.26Å; R497-E501 WeakPolarHBondContact CG-OE1 3.35Å; R497-E501 IonicContact CZ-OE1 3.1Å; R497-E501 IonicContact NE-OE1 2.7Å; R497-E501 IonicContact NH1-OE1 3.68Å; R497-E501 PolarHBondContact NH1-OE1 2.92Å; R497-E501 IonicContact NH1-OE2 2.7Å; R497-E501 PolarHBondContact NH1-OE2 2.92Å
498	Q	76.8	Confident	78.5	Confident	35 Å²	35	92.5 Å²	92.5	16%	0.164	46%	0.456	C	S	.	.			trans	-88.1	131.7	175.5	-63.9	-68.2	-8.3	0	0	110.4	W475 P476 C500 E501	W475-Q498 HydrophobicContact CB-CB 4.01Å; W475-Q498 HydrophobicContact CB-CG 3.94Å; P476-Q498 VanDerWaalsContact O-CG 3.24Å; P476-Q498 WeakPolarHBondContact O-CG 3.46Å; P476-Q498 PolarHBondContact O-NE2 3.48Å; Q498-C500 PolarHBondContact O-N 3Å; Q498-C500 VanDerWaalsContact O-N 3.09Å; Q498-E501 WeakPolarHBondContact O-CG 3.41Å; Q498-E501 PolarHBondContact O-N 3.33Å; Q498-E501 VanDerWaalsContact O-N 3.12Å
499	P	74.2	Confident	78.6	Confident	130 Å²	130	91.3 Å²	91.3	84%	0.844	45%	0.446	S	S	*	.	G	3₁₀ helix	trans	-64.4	-16.8	177	27.1	-34.7	0	0	0	112.8	E501	P499-E501 VanDerWaalsContact C-N 3.3Å; P499-E501 PolarHBondContact O-N 2.9Å
500	C	72.2	Confident	78.9	Confident	36 Å²	36	90.1 Å²	90.1	24%	0.243	44%	0.441	C	S	.	.	G	3₁₀ helix	trans	-81.8	10.1	174.6	59.1	0	0	0	0	115	Q498 R502 L503	Q498-C500 PolarHBondContact O-N 3Å; Q498-C500 VanDerWaalsContact O-N 3.09Å; C500-R502 PolarHBondContact O-N 2.87Å; C500-L503 HydrophobicContact CB-CB 3.98Å; C500-L503 HydrophobicContact CB-CD2 4.24Å; C500-L503 WeakPolarHBondContact O-CB 3.44Å; C500-L503 PolarHBondContact O-N 3.28Å
501	E	69.6	Low	79	Confident	72 Å²	72	83.9 Å²	83.9	34%	0.336	42%	0.415	S	S	.	.	G	3₁₀ helix	trans	-49.4	-32	172.3	-85.9	178.3	-156.1	0	0	113.5	R497 Q498 P499	R497-E501 WeakPolarHBondContact CB-OE1 3.5Å; R497-E501 VanDerWaalsContact CD-OE1 3.29Å; R497-E501 WeakPolarHBondContact CD-OE1 3.36Å; R497-E501 VanDerWaalsContact CG-OE1 3.26Å; R497-E501 WeakPolarHBondContact CG-OE1 3.35Å; R497-E501 IonicContact CZ-OE1 3.1Å; R497-E501 IonicContact NE-OE1 2.7Å; R497-E501 IonicContact NH1-OE1 3.68Å; R497-E501 PolarHBondContact NH1-OE1 2.92Å; R497-E501 IonicContact NH1-OE2 2.7Å; R497-E501 PolarHBondContact NH1-OE2 2.92Å; Q498-E501 WeakPolarHBondContact O-CG 3.41Å; Q498-E501 PolarHBondContact O-N 3.33Å; Q498-E501 VanDerWaalsContact O-N 3.12Å; P499-E501 VanDerWaalsContact C-N 3.3Å; P499-E501 PolarHBondContact O-N 2.9Å
502	R	73.3	Confident	79.3	Confident	205 Å²	205	83.8 Å²	83.8	77%	0.774	41%	0.414	S	S	*	.	G	3₁₀ helix	trans	-97.7	9.7	177.3	-60.3	-174.7	-174.7	176.8	2.1	114.5	C500 I504 A505	C500-R502 PolarHBondContact O-N 2.87Å; R502-I504 VanDerWaalsContact C-N 3.32Å; R502-I504 PolarHBondContact O-N 2.95Å; R502-A505 HydrophobicContact CB-CB 4.35Å; R502-A505 VanDerWaalsContact O-CB 3.26Å; R502-A505 WeakPolarHBondContact O-CB 3.35Å; R502-A505 PolarHBondContact O-N 3.04Å; R502-A505 VanDerWaalsContact O-N 3.11Å
503	L	75.8	Confident	79.8	Confident	51 Å²	51	81.5 Å²	81.5	27%	0.267	41%	0.407	S	S	.	.	S	Bend	trans	-57.1	-44.2	-174.2	177.5	60.1	0	0	0	111.9	W475 C500 A505 R509 F536 V573	W475-L503 HydrophobicContact CH2-CD2 3.89Å; W475-L503 HydrophobicContact CZ2-CB 4.35Å; W475-L503 HydrophobicContact CZ2-CD2 4.26Å; C500-L503 HydrophobicContact CB-CB 3.98Å; C500-L503 HydrophobicContact CB-CD2 4.24Å; C500-L503 WeakPolarHBondContact O-CB 3.44Å; C500-L503 PolarHBondContact O-N 3.28Å; L503-A505 VanDerWaalsContact C-N 3.32Å; L503-A505 PolarHBondContact O-N 3.09Å; L503-R509 PolarHBondContact O-NH1 3.28Å; L503-F536 HydrophobicContact CD2-CE2 4.36Å; L503-F536 HydrophobicContact CD2-CZ 4.26Å; L503-F536 HydrophobicContact CG-CZ 4.44Å; L503-V573 HydrophobicContact CD2-CG1 4.14Å; L503-V573 HydrophobicContact CD2-CG2 4.48Å
504	I	79.4	Confident	80.4	Confident	2 Å²	2	77 Å²	77	1%	0.01	39%	0.386	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-24.1	-178.5	-61.9	-175.1	0	0	0	112.5	L466 I469 L473 R502 N506 F533 L538	L466-I504 HydrophobicContact CB-CG2 4.23Å; L466-I504 HydrophobicContact CD2-CG2 3.64Å; I469-I504 HydrophobicContact CG2-CD1 3.79Å; L473-I504 HydrophobicContact CD2-CD1 3.41Å; L473-I504 VanDerWaalsContact CD2-CD1 3.41Å; L473-I504 HydrophobicContact CD2-CG1 4.46Å; R502-I504 VanDerWaalsContact C-N 3.32Å; R502-I504 PolarHBondContact O-N 2.95Å; I504-N506 PolarHBondContact O-N 2.6Å; I504-F533 HydrophobicContact CD1-CZ 4.08Å; I504-F533 HydrophobicContact CG1-CZ 4.39Å; I504-L538 HydrophobicContact CD1-CD2 3.93Å
505	A	72	Confident	80.9	Confident	38 Å²	38	73.4 Å²	73.4	31%	0.314	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	3.3	-172	0	0	0	0	0	116	R502 L503 P507	R502-A505 HydrophobicContact CB-CB 4.35Å; R502-A505 VanDerWaalsContact O-CB 3.26Å; R502-A505 WeakPolarHBondContact O-CB 3.35Å; R502-A505 PolarHBondContact O-N 3.04Å; R502-A505 VanDerWaalsContact O-N 3.11Å; L503-A505 VanDerWaalsContact C-N 3.32Å; L503-A505 PolarHBondContact O-N 3.09Å; A505-P507 WeakPolarHBondContact O-CD 3Å
506	N	80.8	Confident	81.4	Confident	72 Å²	72	75.9 Å²	75.9	39%	0.385	37%	0.372	S	S	.	.			trans	-80.1	114.4	-174.4	-176	-10.8	0	0	0	110.7	I504 K508 R509	I504-N506 PolarHBondContact O-N 2.6Å; N506-K508 PolarHBondContact O-N 3.38Å; N506-K508 WeakPolarHBondContact OD1-CB 3.28Å; N506-K508 PolarHBondContact OD1-N 3.33Å; N506-R509 HydrophobicContact CB-CB 4.4Å; N506-R509 WeakPolarHBondContact O-CB 3.5Å; N506-R509 PolarHBondContact O-N 3.27Å
507	P	75.7	Confident	82.1	Confident	58 Å²	58	71.7 Å²	71.7	38%	0.377	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-10.7	-178.4	26.2	-35.3	0	0	0	114.4	W459 F463 A505	W459-P507 HydrophobicContact CZ2-CB 3.86Å; W459-P507 PolarHBondContact NE1-O 3.41Å; F463-P507 HydrophobicContact CD2-CB 4.21Å; F463-P507 HydrophobicContact CE2-CB 3.98Å; A505-P507 WeakPolarHBondContact O-CD 3Å
508	K	82.3	Confident	83	Confident	179 Å²	179	66 Å²	66	78%	0.778	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.9	-5	175.3	-61.3	-173.7	178	-177.3	0	113.9	N506	N506-K508 PolarHBondContact O-N 3.38Å; N506-K508 WeakPolarHBondContact OD1-CB 3.28Å; N506-K508 PolarHBondContact OD1-N 3.33Å
509	R	88.4	Confident	83.7	Confident	18 Å²	18	64.5 Å²	64.5	7%	0.068	33%	0.328	C	S	.	.			trans	-86.1	148.6	179.3	-178.9	161.4	-77.1	158.8	-3.2	111.1	N462 L466 L503 N506 F533 D534 D535	N462-R509 PolarHBondContact ND2-O 3.06Å; L466-R509 HydrophobicContact CD1-CB 4.49Å; L466-R509 WeakPolarHBondContact CD1-O 3.42Å; L503-R509 PolarHBondContact O-NH1 3.28Å; N506-R509 HydrophobicContact CB-CB 4.4Å; N506-R509 WeakPolarHBondContact O-CB 3.5Å; N506-R509 PolarHBondContact O-N 3.27Å; R509-F533 HydrophobicContact CG-CB 4.13Å; R509-F533 HydrophobicContact CG-CD1 3.88Å; R509-F533 HydrophobicContact CG-CG 4.29Å; R509-D534 WeakPolarHBondContact CA-OD1 3.33Å; R509-D534 WeakPolarHBondContact CG-OD1 3.23Å; R509-D535 IonicContact CZ-OD1 2.83Å; R509-D535 VanDerWaalsContact CZ-OD1 3.25Å; R509-D535 IonicContact CZ-OD2 3.86Å; R509-D535 IonicContact NE-OD1 3.07Å; R509-D535 PolarHBondContact NE-OD1 2.99Å; R509-D535 IonicContact NE-OD2 3.72Å; R509-D535 IonicContact NH2-OD1 3.64Å; R509-D535 PolarHBondContact NH2-OD1 2.98Å; R509-D535 IonicContact NH2-OD2 2.73Å; R509-D535 PolarHBondContact NH2-OD2 2.85Å
510	Q	90.4	Very high	84.4	Confident	103 Å²	103	60.2 Å²	60.2	48%	0.481	30%	0.297	S	S	.	.			trans	-124.5	131.7	177.3	-66.8	-178.1	-19.4	0	0	110.7	N462 L512 F533 D534	N462-Q510 WeakPolarHBondContact OD1-CA 3.2Å; Q510-L512 HydrophobicContact CB-CD2 4.16Å; Q510-F533 CarbonylContact O-C 3.58Å; Q510-F533 WeakPolarHBondContact O-CA 3.38Å; Q510-D534 HydrophobicContact CB-CB 4.39Å; Q510-D534 PolarHBondContact N-OD1 2.93Å; Q510-D534 PolarHBondContact O-N 3.16Å
511	L	91.6	Very high	84.8	Confident	32 Å²	32	61.4 Å²	61.4	17%	0.168	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	114	166.7	-177.6	69.1	0	0	0	108.1	N462 R465 I469 E514 F531 F533	N462-L511 PolarHBondContact OD1-N 2.85Å; R465-L511 HydrophobicContact CG-CD2 3.76Å; I469-L511 HydrophobicContact CD1-CD2 3.73Å; L511-E514 HydrophobicContact CD1-CB 4.45Å; L511-E514 HydrophobicContact CD2-CG 4.36Å; L511-F531 HydrophobicContact CD1-CB 3.94Å; L511-F531 HydrophobicContact CD1-CD1 4.18Å; L511-F533 HydrophobicContact CB-CD1 4.33Å; L511-F533 HydrophobicContact CB-CE1 4.27Å; L511-F533 HydrophobicContact CD1-CD1 4.02Å; L511-F533 HydrophobicContact CD1-CE1 3.65Å; L511-F533 HydrophobicContact CD1-CZ 4.08Å
512	L	90.7	Very high	85.1	Confident	65 Å²	65	61.9 Å²	61.9	34%	0.34	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	-32.5	-175.2	-59.1	-177.9	0	0	0	112.7	Q510 L532 D534	Q510-L512 HydrophobicContact CB-CD2 4.16Å; L512-L532 HydrophobicContact CB-CG 4.34Å; L512-L532 PolarHBondContact N-O 3.4Å; L512-D534 HydrophobicContact CD1-CB 4.26Å
513	H	91.9	Very high	85.2	Confident	50 Å²	50	58.2 Å²	58.2	23%	0.231	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.8	155.9	174.2	-163.5	35.7	0	0	0	111	L532 W626 K629	H513-L532 HydrophobicContact CB-CB 4.24Å; H513-L532 HydrophobicContact CB-CD2 4.28Å; H513-L532 PolarHBondContact N-O 3.49Å; H513-L532 PolarHBondContact O-N 2.9Å; H513-W626 AromaticContact CD2-CD2 3.62Å; H513-W626 AromaticContact CD2-CE2 3.58Å; H513-W626 AromaticContact CD2-CE3 3.88Å; H513-W626 AromaticContact CD2-CZ2 3.82Å; H513-W626 AromaticContact NE2-CE2 3.77Å; H513-W626 AromaticContact NE2-NE1 3.75Å; H513-K629 HydrophobicContact CB-CB 4.19Å; H513-K629 HydrophobicContact CB-CG 4.17Å
514	E	92.2	Very high	85.6	Confident	54 Å²	54	63.1 Å²	63.1	25%	0.252	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	157.3	174	64.1	179	151.6	0	0	111.1	R465 L511 F529 A530 F531	R465-E514 IonicContact CZ-OE1 3.58Å; R465-E514 IonicContact CZ-OE2 3.06Å; R465-E514 IonicContact NE-OE1 2.69Å; R465-E514 PolarHBondContact NE-OE1 3.36Å; R465-E514 IonicContact NE-OE2 2.82Å; R465-E514 PolarHBondContact NE-OE2 3.12Å; R465-E514 VanDerWaalsContact NH2-CD 3.27Å; R465-E514 IonicContact NH2-OE1 2.79Å; R465-E514 PolarHBondContact NH2-OE1 3.17Å; R465-E514 IonicContact NH2-OE2 3.68Å; R465-E514 PolarHBondContact NH2-OE2 3.23Å; L511-E514 HydrophobicContact CD1-CB 4.45Å; L511-E514 HydrophobicContact CD2-CG 4.36Å; E514-F529 HydrophobicContact CB-CE1 3.89Å; E514-F529 HydrophobicContact CB-CZ 4.34Å; E514-F529 HydrophobicContact CG-CE1 4.29Å; E514-F529 HydrophobicContact CG-CZ 4.37Å; E514-F529 WeakPolarHBondContact OE2-CE1 3.12Å; E514-A530 VanDerWaalsContact CA-O 3.26Å; E514-A530 WeakPolarHBondContact CA-O 3.47Å; E514-F531 HydrophobicContact CB-CD1 3.94Å; E514-F531 WeakPolarHBondContact OE2-CD1 3.44Å; E514-F531 VanDerWaalsContact OE2-CE1 3.24Å; E514-F531 WeakPolarHBondContact OE2-CE1 3.36Å
515	G	91.4	Very high	85.9	Confident	14 Å²	14	67.7 Å²	67.7	14%	0.144	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	163	174.9	176.3	0	0	0	0	0	115.4	A530	G515-A530 PolarHBondContact N-O 2.88Å; G515-A530 VanDerWaalsContact N-O 3.12Å; G515-A530 PolarHBondContact O-N 3.29Å
516	F	91	Very high	86.8	Confident	117 Å²	117	66.8 Å²	66.8	51%	0.513	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	138.9	174.7	-56.5	-79.6	0	0	0	111.9	I528 F529 I542 I561	F516-I528 WeakPolarHBondContact CA-O 3.47Å; F516-F529 AromaticContact CD1-CD2 3.71Å; F516-F529 HydrophobicContact CD1-CD2 3.71Å; F516-F529 HydrophobicContact CD1-CE2 4.23Å; F516-F529 HydrophobicContact CD2-CE2 4.41Å; F516-F529 AromaticContact CE1-CD2 3.88Å; F516-F529 HydrophobicContact CE1-CD2 3.88Å; F516-F529 HydrophobicContact CE1-CE2 4.22Å; F516-F529 HydrophobicContact CE2-CE2 4.42Å; F516-F529 HydrophobicContact CG-CD2 4.1Å; F516-F529 HydrophobicContact CG-CE2 4.32Å; F516-F529 HydrophobicContact CZ-CD2 4.43Å; F516-F529 HydrophobicContact CZ-CE2 4.31Å; F516-I542 HydrophobicContact CD1-CD1 3.74Å; F516-I542 HydrophobicContact CE1-CD1 3.45Å; F516-I542 VanDerWaalsContact CE1-CD1 3.45Å; F516-I561 HydrophobicContact CD2-CG2 4.36Å; F516-I561 HydrophobicContact CE2-CG2 3.27Å; F516-I561 HydrophobicContact CZ-CG2 3.46Å; F516-I561 VanDerWaalsContact CZ-CG2 3.46Å
517	L	92.1	Very high	87.2	Confident	6 Å²	6	69.2 Å²	69.2	3%	0.031	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	163.3	167	-67.1	172.7	0	0	0	108.8	I528 A530 L615 A617 W626	L517-I528 HydrophobicContact CB-CD1 3.95Å; L517-I528 HydrophobicContact CB-CG1 3.89Å; L517-I528 PolarHBondContact N-O 3.44Å; L517-I528 WeakPolarHBondContact O-CG1 3.36Å; L517-I528 PolarHBondContact O-N 3Å; L517-I528 VanDerWaalsContact O-O 3.06Å; L517-A530 HydrophobicContact CD1-CB 4.04Å; L517-L615 HydrophobicContact CD1-CB 4.35Å; L517-L615 HydrophobicContact CD1-CD1 4.17Å; L517-L615 HydrophobicContact CD1-CD2 4.3Å; L517-A617 HydrophobicContact CD2-CB 3.9Å; L517-W626 HydrophobicContact CD1-CD2 4.21Å; L517-W626 HydrophobicContact CD1-CZ2 4.24Å; L517-W626 HydrophobicContact CD2-CG 4.49Å
518	T	91.7	Very high	88	Confident	49 Å²	49	66.5 Å²	66.5	30%	0.301	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	123.2	167.9	-59.8	0	0	0	0	109.2	T525 I526 L615 Q616	T518-T525 HydrophobicContact CG2-CG2 4.29Å; T518-I526 WeakPolarHBondContact CA-O 3.19Å; T518-L615 CarbonylContact O-C 3.56Å; T518-L615 WeakPolarHBondContact O-CA 3.42Å; T518-Q616 PolarHBondContact N-O 2.96Å; T518-Q616 PolarHBondContact O-N 3.5Å
519	L	91.6	Very high	88.5	Confident	4 Å²	4	58.2 Å²	58.2	2%	0.021	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	130.1	177.6	174.1	58.4	0	0	0	110.4	T525 I526 I528 V539 Y570 Y613 L615	L519-T525 CarbonylContact O-C 3.59Å; L519-I526 PolarHBondContact N-O 3.08Å; L519-I526 PolarHBondContact O-N 3.18Å; L519-I528 HydrophobicContact CB-CD1 3.85Å; L519-I528 HydrophobicContact CB-CG1 4.17Å; L519-I528 HydrophobicContact CB-CG2 4.18Å; L519-V539 HydrophobicContact CD2-CG1 4.27Å; L519-Y570 HydrophobicContact CD2-CD1 3.85Å; L519-Y570 HydrophobicContact CD2-CE1 3.63Å; L519-Y613 HydrophobicContact CD1-CD1 3.85Å; L519-Y613 HydrophobicContact CD1-CG 4.27Å; L519-Y613 HydrophobicContact CD2-CD1 3.81Å; L519-Y613 HydrophobicContact CD2-CE1 4.18Å; L519-L615 HydrophobicContact CB-CD2 4.29Å; L519-L615 HydrophobicContact CD1-CD2 4.02Å
520	N	87.9	Confident	88.7	Confident	39 Å²	39	57.5 Å²	57.5	21%	0.209	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	100.3	176.8	-64.8	18.3	0	0	0	110	G522 L594 T614 Q616	N520-G522 PolarHBondContact O-N 3.4Å; N520-G522 VanDerWaalsContact O-N 3.09Å; N520-L594 WeakPolarHBondContact ND2-CD2 3.49Å; N520-T614 PolarHBondContact N-O 3.31Å; N520-Q616 PolarHBondContact ND2-NE2 3.28Å; N520-Q616 PolarHBondContact OD1-NE2 2.88Å
521	D	81.7	Confident	88.9	Confident	62 Å²	62	52.6 Å²	52.6	33%	0.332	29%	0.293	S	S	.	.			trans	-88	47.6	-179.4	-160.7	53.2	0	0	0	111.2	T523 K524 I526 Y570 R571	D521-T523 PolarHBondContact O-N 3.45Å; D521-K524 PolarHBondContact N-O 2.67Å; D521-I526 HydrophobicContact CB-CD1 3.6Å; D521-Y570 PolarHBondContact OD1-OH 2.69Å; D521-Y570 PolarHBondContact OD2-OH 3.46Å; D521-R571 VanDerWaalsContact CG-NH2 3.28Å; D521-R571 IonicContact OD1-CZ 3.64Å; D521-R571 IonicContact OD1-NE 3.92Å; D521-R571 IonicContact OD1-NH2 2.67Å; D521-R571 PolarHBondContact OD1-NH2 3.15Å; D521-R571 IonicContact OD2-NH2 3.91Å; D521-R571 PolarHBondContact OD2-NH2 3.15Å
522	G	75.4	Confident	89	Confident	82 Å²	82	51 Å²	51	85%	0.845	29%	0.285	S	S	*	.	S	Bend	trans	68.3	-50	-179.5	0	0	0	0	0	116	N520	N520-G522 PolarHBondContact O-N 3.4Å; N520-G522 VanDerWaalsContact O-N 3.09Å
523	T	74.6	Confident	89.2	Confident	128 Å²	128	48 Å²	48	79%	0.785	27%	0.269	S	S	*	.	S	Bend	trans	-107.4	-17.6	-175.6	59.2	0	0	0	0	113.7	D521	D521-T523 PolarHBondContact O-N 3.45Å
524	K	84.4	Confident	89.2	Confident	154 Å²	154	46.4 Å²	46.4	67%	0.67	26%	0.262	S	S	*	.			trans	-145.9	143.2	-175.2	-62.5	-177	-176.3	178.6	0	110.9	D521	D521-K524 PolarHBondContact N-O 2.67Å
525	T	86.4	Confident	89.1	Confident	97 Å²	97	45.9 Å²	45.9	60%	0.595	26%	0.261	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84	142.6	164.4	51.6	0	0	0	0	109.6	T518 L519	T518-T525 HydrophobicContact CG2-CG2 4.29Å; L519-T525 CarbonylContact O-C 3.59Å
526	I	90	Very high	89.1	Confident	20 Å²	20	45.7 Å²	45.7	10%	0.103	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	122.4	-174.4	-58.2	160.8	0	0	0	109	T518 L519 D521 I528 R541 Y570	T518-I526 WeakPolarHBondContact CA-O 3.19Å; L519-I526 PolarHBondContact N-O 3.08Å; L519-I526 PolarHBondContact O-N 3.18Å; D521-I526 HydrophobicContact CB-CD1 3.6Å; I526-I528 HydrophobicContact CG2-CG2 3.88Å; I526-I528 PolarHBondContact O-N 2.98Å; I526-R541 VanDerWaalsContact CD1-NH2 3.32Å; I526-R541 HydrophobicContact CG2-CG 3.84Å; I526-Y570 HydrophobicContact CD1-CE1 3.76Å; I526-Y570 WeakPolarHBondContact CD1-OH 3.48Å
527	E	90.5	Very high	89.2	Confident	123 Å²	123	40.3 Å²	40.3	58%	0.575	23%	0.233	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-62.7	119.1	165.7	-67	-176.4	175.1	0	0	109.3	K544	E527-K544 IonicContact OE2-NZ 3.7Å; E527-K544 PolarHBondContact OE2-NZ 3.39Å
528	I	91.8	Very high	89.3	Confident	0 Å²	0	40 Å²	40	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	155.7	175.7	57.6	159.5	0	0	0	111.1	F516 L517 L519 I526 V539 T540 R541 L615	F516-I528 WeakPolarHBondContact CA-O 3.47Å; L517-I528 HydrophobicContact CB-CD1 3.95Å; L517-I528 HydrophobicContact CB-CG1 3.89Å; L517-I528 PolarHBondContact N-O 3.44Å; L517-I528 WeakPolarHBondContact O-CG1 3.36Å; L517-I528 PolarHBondContact O-N 3Å; L517-I528 VanDerWaalsContact O-O 3.06Å; L519-I528 HydrophobicContact CB-CD1 3.85Å; L519-I528 HydrophobicContact CB-CG1 4.17Å; L519-I528 HydrophobicContact CB-CG2 4.18Å; I526-I528 HydrophobicContact CG2-CG2 3.88Å; I526-I528 PolarHBondContact O-N 2.98Å; I528-V539 HydrophobicContact CB-CG1 4.24Å; I528-V539 HydrophobicContact CD1-CG1 3.71Å; I528-V539 HydrophobicContact CG2-CG1 4.05Å; I528-T540 CarbonylContact C-O 3.46Å; I528-T540 WeakPolarHBondContact CA-O 3.45Å; I528-T540 WeakPolarHBondContact CB-O 3.37Å; I528-R541 HydrophobicContact CG2-CG 4.44Å; I528-L615 HydrophobicContact CD1-CD2 3.66Å
529	F	92.8	Very high	89.3	Confident	6 Å²	6	37.9 Å²	37.9	3%	0.026	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	125.8	163.3	-155.4	-93	0	0	0	108.2	E514 F516 F531 T540 I542 I561 T562 F567	E514-F529 HydrophobicContact CB-CE1 3.89Å; E514-F529 HydrophobicContact CB-CZ 4.34Å; E514-F529 HydrophobicContact CG-CE1 4.29Å; E514-F529 HydrophobicContact CG-CZ 4.37Å; E514-F529 WeakPolarHBondContact OE2-CE1 3.12Å; F516-F529 AromaticContact CD1-CD2 3.71Å; F516-F529 HydrophobicContact CD1-CD2 3.71Å; F516-F529 HydrophobicContact CD1-CE2 4.23Å; F516-F529 HydrophobicContact CD2-CE2 4.41Å; F516-F529 AromaticContact CE1-CD2 3.88Å; F516-F529 HydrophobicContact CE1-CD2 3.88Å; F516-F529 HydrophobicContact CE1-CE2 4.22Å; F516-F529 HydrophobicContact CE2-CE2 4.42Å; F516-F529 HydrophobicContact CG-CD2 4.1Å; F516-F529 HydrophobicContact CG-CE2 4.32Å; F516-F529 HydrophobicContact CZ-CD2 4.43Å; F516-F529 HydrophobicContact CZ-CE2 4.31Å; F529-F531 HydrophobicContact CD1-CD1 4.19Å; F529-F531 HydrophobicContact CD1-CD2 4.26Å; F529-F531 AromaticContact CD1-CE1 3.68Å; F529-F531 HydrophobicContact CD1-CE1 3.68Å; F529-F531 AromaticContact CD1-CE2 3.75Å; F529-F531 HydrophobicContact CD1-CE2 3.75Å; F529-F531 HydrophobicContact CD1-CG 4.48Å; F529-F531 AromaticContact CD1-CZ 3.45Å; F529-F531 HydrophobicContact CD1-CZ 3.45Å; F529-F531 VanDerWaalsContact CD1-CZ 3.45Å; F529-F531 HydrophobicContact CE1-CD1 4.03Å; F529-F531 AromaticContact CE1-CE1 3.5Å; F529-F531 HydrophobicContact CE1-CE1 3.5Å; F529-F531 HydrophobicContact CE1-CE2 4.43Å; F529-F531 AromaticContact CE1-CZ 3.74Å; F529-F531 HydrophobicContact CE1-CZ 3.74Å; F529-T540 PolarHBondContact N-O 3.34Å; F529-T540 PolarHBondContact O-N 3.01Å; F529-T540 PolarHBondContact O-OG1 3.06Å; F529-I542 HydrophobicContact CB-CD1 4Å; F529-I542 HydrophobicContact CB-CG1 4Å; F529-I542 HydrophobicContact CD2-CD1 4.23Å; F529-I561 HydrophobicContact CE2-CG2 4.44Å; F529-T562 HydrophobicContact CE1-CG2 3.96Å; F529-T562 HydrophobicContact CE2-CG2 3.98Å; F529-T562 HydrophobicContact CZ-CG2 3.54Å; F529-F567 HydrophobicContact CB-CD1 3.88Å; F529-F567 HydrophobicContact CB-CE1 3.5Å; F529-F567 VanDerWaalsContact CB-CE1 3.5Å; F529-F567 AromaticContact CD1-CE1 3.85Å; F529-F567 HydrophobicContact CD1-CE1 3.85Å; F529-F567 HydrophobicContact CD1-CZ 4.17Å; F529-F567 HydrophobicContact CD2-CE1 4.2Å; F529-F567 HydrophobicContact CG-CD1 4.36Å; F529-F567 AromaticContact CG-CE1 3.6Å; F529-F567 HydrophobicContact CG-CE1 3.6Å; F529-F567 HydrophobicContact CG-CZ 4.21Å
530	A	93.1	Very high	89.3	Confident	2 Å²	2	37.7 Å²	37.7	2%	0.017	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	137.2	-178.8	0	0	0	0	0	110.1	E514 G515 L517 L537 L538 W626	E514-A530 VanDerWaalsContact CA-O 3.26Å; E514-A530 WeakPolarHBondContact CA-O 3.47Å; G515-A530 PolarHBondContact N-O 2.88Å; G515-A530 VanDerWaalsContact N-O 3.12Å; G515-A530 PolarHBondContact O-N 3.29Å; L517-A530 HydrophobicContact CD1-CB 4.04Å; A530-L537 HydrophobicContact CB-CD1 4.4Å; A530-L538 WeakPolarHBondContact CA-O 3.42Å; A530-W626 HydrophobicContact CB-CH2 3.6Å; A530-W626 HydrophobicContact CB-CZ2 4.04Å; A530-W626 HydrophobicContact CB-CZ3 4.28Å
531	F	93.8	Very high	89.4	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	121.8	172.3	-54.2	-91.2	0	0	0	108.7	I469 L511 E514 F529 F533 L538 T540 F567	I469-F531 HydrophobicContact CB-CE1 4.5Å; I469-F531 HydrophobicContact CD1-CD1 3.61Å; I469-F531 HydrophobicContact CD1-CE1 3.51Å; I469-F531 HydrophobicContact CD1-CZ 4.48Å; I469-F531 HydrophobicContact CG1-CD1 4.22Å; I469-F531 HydrophobicContact CG1-CE1 3.62Å; I469-F531 HydrophobicContact CG1-CZ 4.21Å; I469-F531 HydrophobicContact CG2-CD1 4.42Å; I469-F531 HydrophobicContact CG2-CE1 4.04Å; I469-F531 HydrophobicContact CG2-CE2 4.39Å; I469-F531 HydrophobicContact CG2-CZ 4.01Å; L511-F531 HydrophobicContact CD1-CB 3.94Å; L511-F531 HydrophobicContact CD1-CD1 4.18Å; E514-F531 HydrophobicContact CB-CD1 3.94Å; E514-F531 WeakPolarHBondContact OE2-CD1 3.44Å; E514-F531 VanDerWaalsContact OE2-CE1 3.24Å; E514-F531 WeakPolarHBondContact OE2-CE1 3.36Å; F529-F531 HydrophobicContact CD1-CD1 4.19Å; F529-F531 HydrophobicContact CD1-CD2 4.26Å; F529-F531 AromaticContact CD1-CE1 3.68Å; F529-F531 HydrophobicContact CD1-CE1 3.68Å; F529-F531 AromaticContact CD1-CE2 3.75Å; F529-F531 HydrophobicContact CD1-CE2 3.75Å; F529-F531 HydrophobicContact CD1-CG 4.48Å; F529-F531 AromaticContact CD1-CZ 3.45Å; F529-F531 HydrophobicContact CD1-CZ 3.45Å; F529-F531 VanDerWaalsContact CD1-CZ 3.45Å; F529-F531 HydrophobicContact CE1-CD1 4.03Å; F529-F531 AromaticContact CE1-CE1 3.5Å; F529-F531 HydrophobicContact CE1-CE1 3.5Å; F529-F531 HydrophobicContact CE1-CE2 4.43Å; F529-F531 AromaticContact CE1-CZ 3.74Å; F529-F531 HydrophobicContact CE1-CZ 3.74Å; F531-F533 HydrophobicContact CB-CD2 4.44Å; F531-F533 HydrophobicContact CB-CE2 3.61Å; F531-F533 HydrophobicContact CB-CZ 3.72Å; F531-F533 HydrophobicContact CG-CZ 4.43Å; F531-L538 HydrophobicContact CB-CB 4.26Å; F531-L538 HydrophobicContact CD2-CD2 3.93Å; F531-L538 HydrophobicContact CD2-CG 4.39Å; F531-L538 PolarHBondContact N-O 3.42Å; F531-L538 PolarHBondContact O-N 2.91Å; F531-T540 HydrophobicContact CD2-CG2 4.1Å; F531-T540 HydrophobicContact CE2-CG2 3.89Å; F531-F567 HydrophobicContact CE2-CD1 4.26Å; F531-F567 HydrophobicContact CE2-CD2 4.42Å; F531-F567 HydrophobicContact CE2-CG 4.14Å; F531-F567 HydrophobicContact CZ-CD1 4.25Å; F531-F567 AromaticContact CZ-CD2 3.92Å; F531-F567 HydrophobicContact CZ-CD2 3.92Å; F531-F567 HydrophobicContact CZ-CE1 4.31Å; F531-F567 AromaticContact CZ-CE2 3.98Å; F531-F567 HydrophobicContact CZ-CE2 3.98Å; F531-F567 HydrophobicContact CZ-CG 4.06Å; F531-F567 HydrophobicContact CZ-CZ 4.18Å
532	L	94.6	Very high	89.5	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	114.2	177.2	177	59.5	0	0	0	109.5	L512 H513 L537 L576 W626 K629 L630	L512-L532 HydrophobicContact CB-CG 4.34Å; L512-L532 PolarHBondContact N-O 3.4Å; H513-L532 HydrophobicContact CB-CB 4.24Å; H513-L532 HydrophobicContact CB-CD2 4.28Å; H513-L532 PolarHBondContact N-O 3.49Å; H513-L532 PolarHBondContact O-N 2.9Å; L532-L537 HydrophobicContact CB-CD1 4.24Å; L532-L537 HydrophobicContact CD1-CB 4.49Å; L532-L537 HydrophobicContact CD1-CD1 4.31Å; L532-L576 HydrophobicContact CD1-CD2 3.72Å; L532-W626 HydrophobicContact CB-CZ3 4.06Å; L532-K629 HydrophobicContact CD2-CB 3.93Å; L532-L630 HydrophobicContact CD1-CD2 3.8Å; L532-L630 HydrophobicContact CD2-CD2 3.98Å; L532-L630 HydrophobicContact CD2-CG 4.27Å; L532-L630 HydrophobicContact CG-CD2 4.47Å
533	F	93.6	Very high	89.5	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	174.9	174.9	-57.2	-79.8	0	0	0	111.3	L466 I504 R509 Q510 L511 F531 D535 F536 L538	L466-F533 HydrophobicContact CD2-CD1 4.11Å; L466-F533 HydrophobicContact CD2-CE1 3.56Å; I504-F533 HydrophobicContact CD1-CZ 4.08Å; I504-F533 HydrophobicContact CG1-CZ 4.39Å; R509-F533 HydrophobicContact CG-CB 4.13Å; R509-F533 HydrophobicContact CG-CD1 3.88Å; R509-F533 HydrophobicContact CG-CG 4.29Å; Q510-F533 CarbonylContact O-C 3.58Å; Q510-F533 WeakPolarHBondContact O-CA 3.38Å; L511-F533 HydrophobicContact CB-CD1 4.33Å; L511-F533 HydrophobicContact CB-CE1 4.27Å; L511-F533 HydrophobicContact CD1-CD1 4.02Å; L511-F533 HydrophobicContact CD1-CE1 3.65Å; L511-F533 HydrophobicContact CD1-CZ 4.08Å; F531-F533 HydrophobicContact CB-CD2 4.44Å; F531-F533 HydrophobicContact CB-CE2 3.61Å; F531-F533 HydrophobicContact CB-CZ 3.72Å; F531-F533 HydrophobicContact CG-CZ 4.43Å; F533-D535 PolarHBondContact O-N 2.78Å; F533-F536 HydrophobicContact CB-CD1 3.93Å; F533-F536 HydrophobicContact CB-CE1 3.74Å; F533-F536 HydrophobicContact CB-CZ 4.49Å; F533-F536 WeakPolarHBondContact CB-O 3.07Å; F533-F536 AromaticContact CD2-CD1 3.97Å; F533-F536 HydrophobicContact CD2-CD1 3.97Å; F533-F536 HydrophobicContact CD2-CD2 4.2Å; F533-F536 AromaticContact CD2-CE1 3.31Å; F533-F536 HydrophobicContact CD2-CE1 3.31Å; F533-F536 AromaticContact CD2-CE2 3.68Å; F533-F536 HydrophobicContact CD2-CE2 3.68Å; F533-F536 HydrophobicContact CD2-CG 4.36Å; F533-F536 AromaticContact CD2-CZ 3.18Å; F533-F536 HydrophobicContact CD2-CZ 3.18Å; F533-F536 HydrophobicContact CE2-CE1 4.05Å; F533-F536 AromaticContact CE2-CE2 3.89Å; F533-F536 HydrophobicContact CE2-CE2 3.89Å; F533-F536 AromaticContact CE2-CZ 3.46Å; F533-F536 HydrophobicContact CE2-CZ 3.46Å; F533-F536 VanDerWaalsContact CE2-CZ 3.46Å; F533-F536 HydrophobicContact CG-CD1 4.26Å; F533-F536 AromaticContact CG-CE1 3.63Å; F533-F536 HydrophobicContact CG-CE1 3.63Å; F533-F536 AromaticContact CG-CZ 3.94Å; F533-F536 HydrophobicContact CG-CZ 3.94Å; F533-F536 HydrophobicContact CZ-CZ 4.41Å; F533-F536 PolarHBondContact N-O 3.13Å; F533-L538 HydrophobicContact CE2-CB 3.94Å; F533-L538 HydrophobicContact CE2-CD2 4.18Å
534	D	91.8	Very high	89.1	Confident	17 Å²	17	41.9 Å²	41.9	9%	0.091	20%	0.195	C	C	.	.	S	Bend	trans	-71.8	-5.2	178.3	70.7	-78.1	0	0	0	115.3	R509 Q510 L512 F637 K640	R509-D534 WeakPolarHBondContact CA-OD1 3.33Å; R509-D534 WeakPolarHBondContact CG-OD1 3.23Å; Q510-D534 HydrophobicContact CB-CB 4.39Å; Q510-D534 PolarHBondContact N-OD1 2.93Å; Q510-D534 PolarHBondContact O-N 3.16Å; L512-D534 HydrophobicContact CD1-CB 4.26Å; D534-F637 WeakPolarHBondContact O-CD2 3.42Å; D534-K640 IonicContact OD2-NZ 3.76Å; D534-K640 PolarHBondContact OD2-NZ 3.01Å
535	D	90	Very high	87.5	Confident	43 Å²	43	37.7 Å²	37.7	23%	0.23	18%	0.184	C	C	.	.	S	Bend	trans	-137.1	-12.2	178.9	57.1	-13.5	0	0	0	116.2	R509 F533 L576 F637	R509-D535 IonicContact CZ-OD1 2.83Å; R509-D535 VanDerWaalsContact CZ-OD1 3.25Å; R509-D535 IonicContact CZ-OD2 3.86Å; R509-D535 IonicContact NE-OD1 3.07Å; R509-D535 PolarHBondContact NE-OD1 2.99Å; R509-D535 IonicContact NE-OD2 3.72Å; R509-D535 IonicContact NH2-OD1 3.64Å; R509-D535 PolarHBondContact NH2-OD1 2.98Å; R509-D535 IonicContact NH2-OD2 2.73Å; R509-D535 PolarHBondContact NH2-OD2 2.85Å; F533-D535 PolarHBondContact O-N 2.78Å; D535-L576 PolarHBondContact O-N 3.49Å; D535-F637 HydrophobicContact CB-CD2 3.87Å; D535-F637 HydrophobicContact CB-CE2 3.44Å; D535-F637 VanDerWaalsContact CB-CE2 3.44Å; D535-F637 HydrophobicContact CB-CZ 4.24Å
536	F	92.3	Very high	85.1	Confident	10 Å²	10	38.9 Å²	38.9	4%	0.044	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.5	161	174.8	72.2	-68.1	0	0	0	113.6	L503 F533 L538 V573 I574	L503-F536 HydrophobicContact CD2-CE2 4.36Å; L503-F536 HydrophobicContact CD2-CZ 4.26Å; L503-F536 HydrophobicContact CG-CZ 4.44Å; F533-F536 HydrophobicContact CB-CD1 3.93Å; F533-F536 HydrophobicContact CB-CE1 3.74Å; F533-F536 HydrophobicContact CB-CZ 4.49Å; F533-F536 WeakPolarHBondContact CB-O 3.07Å; F533-F536 AromaticContact CD2-CD1 3.97Å; F533-F536 HydrophobicContact CD2-CD1 3.97Å; F533-F536 HydrophobicContact CD2-CD2 4.2Å; F533-F536 AromaticContact CD2-CE1 3.31Å; F533-F536 HydrophobicContact CD2-CE1 3.31Å; F533-F536 AromaticContact CD2-CE2 3.68Å; F533-F536 HydrophobicContact CD2-CE2 3.68Å; F533-F536 HydrophobicContact CD2-CG 4.36Å; F533-F536 AromaticContact CD2-CZ 3.18Å; F533-F536 HydrophobicContact CD2-CZ 3.18Å; F533-F536 HydrophobicContact CE2-CE1 4.05Å; F533-F536 AromaticContact CE2-CE2 3.89Å; F533-F536 HydrophobicContact CE2-CE2 3.89Å; F533-F536 AromaticContact CE2-CZ 3.46Å; F533-F536 HydrophobicContact CE2-CZ 3.46Å; F533-F536 VanDerWaalsContact CE2-CZ 3.46Å; F533-F536 HydrophobicContact CG-CD1 4.26Å; F533-F536 AromaticContact CG-CE1 3.63Å; F533-F536 HydrophobicContact CG-CE1 3.63Å; F533-F536 AromaticContact CG-CZ 3.94Å; F533-F536 HydrophobicContact CG-CZ 3.94Å; F533-F536 HydrophobicContact CZ-CZ 4.41Å; F533-F536 PolarHBondContact N-O 3.13Å; F536-L538 HydrophobicContact CD2-CB 4.3Å; F536-L538 HydrophobicContact CE2-CB 3.81Å; F536-L538 HydrophobicContact CE2-CD1 4.34Å; F536-L538 HydrophobicContact CE2-CG 4.5Å; F536-V573 HydrophobicContact CD2-CB 3.56Å; F536-V573 HydrophobicContact CD2-CG1 3.45Å; F536-V573 VanDerWaalsContact CD2-CG1 3.45Å; F536-V573 HydrophobicContact CE2-CB 4.07Å; F536-V573 HydrophobicContact CE2-CG1 3.41Å; F536-V573 VanDerWaalsContact CE2-CG1 3.41Å; F536-V573 HydrophobicContact CG-CB 4.38Å; F536-I574 CarbonylContact C-O 3.49Å; F536-I574 WeakPolarHBondContact CA-O 3.29Å; F536-I574 WeakPolarHBondContact CB-O 3.38Å
537	L	93.6	Very high	82.9	Confident	4 Å²	4	47.7 Å²	47.7	2%	0.021	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	130.7	167.1	-179.9	65.9	0	0	0	109.9	A530 L532 I574 L600 W626 L630	A530-L537 HydrophobicContact CB-CD1 4.4Å; L532-L537 HydrophobicContact CB-CD1 4.24Å; L532-L537 HydrophobicContact CD1-CB 4.49Å; L532-L537 HydrophobicContact CD1-CD1 4.31Å; L537-I574 HydrophobicContact CB-CB 4.46Å; L537-I574 PolarHBondContact N-O 3.11Å; L537-I574 PolarHBondContact O-N 3.16Å; L537-L600 HydrophobicContact CD2-CD1 3.63Å; L537-W626 HydrophobicContact CD1-CZ3 4.2Å; L537-L630 HydrophobicContact CD1-CD2 4.44Å; L537-L630 HydrophobicContact CD2-CD2 4.29Å
538	L	92.8	Very high	80.4	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	127.7	175.2	-177.4	65.1	0	0	0	110.2	L473 W475 I504 A530 F531 F533 F536 T540 V569 V573	L473-L538 HydrophobicContact CD1-CD2 4.45Å; L473-L538 HydrophobicContact CD2-CD2 3.93Å; W475-L538 HydrophobicContact CH2-CD1 3.98Å; W475-L538 HydrophobicContact CZ3-CD1 4.47Å; I504-L538 HydrophobicContact CD1-CD2 3.93Å; A530-L538 WeakPolarHBondContact CA-O 3.42Å; F531-L538 HydrophobicContact CB-CB 4.26Å; F531-L538 HydrophobicContact CD2-CD2 3.93Å; F531-L538 HydrophobicContact CD2-CG 4.39Å; F531-L538 PolarHBondContact N-O 3.42Å; F531-L538 PolarHBondContact O-N 2.91Å; F533-L538 HydrophobicContact CE2-CB 3.94Å; F533-L538 HydrophobicContact CE2-CD2 4.18Å; F536-L538 HydrophobicContact CD2-CB 4.3Å; F536-L538 HydrophobicContact CE2-CB 3.81Å; F536-L538 HydrophobicContact CE2-CD1 4.34Å; F536-L538 HydrophobicContact CE2-CG 4.5Å; L538-T540 HydrophobicContact CD2-CG2 4.01Å; L538-T540 HydrophobicContact CG-CG2 3.86Å; L538-V569 HydrophobicContact CD1-CG1 4Å; L538-V569 HydrophobicContact CD1-CG2 4.04Å; L538-V573 HydrophobicContact CD1-CG1 3.69Å
539	V	92.8	Very high	77.5	Confident	4 Å²	4	61 Å²	61	2%	0.024	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	120.1	176.5	178.6	0	0	0	0	109.7	L519 I528 Y570	L519-V539 HydrophobicContact CD2-CG1 4.27Å; I528-V539 HydrophobicContact CB-CG1 4.24Å; I528-V539 HydrophobicContact CD1-CG1 3.71Å; I528-V539 HydrophobicContact CG2-CG1 4.05Å; V539-Y570 HydrophobicContact CG1-CD1 4.28Å; V539-Y570 PolarHBondContact O-N 3Å
540	T	91.7	Very high	74.7	Confident	0 Å²	0	65.5 Å²	65.5	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	148.6	-178.9	72.8	0	0	0	0	111.8	L473 I528 F529 F531 L538 F567 V568	L473-T540 HydrophobicContact CD1-CG2 3.77Å; I528-T540 CarbonylContact C-O 3.46Å; I528-T540 WeakPolarHBondContact CA-O 3.45Å; I528-T540 WeakPolarHBondContact CB-O 3.37Å; F529-T540 PolarHBondContact N-O 3.34Å; F529-T540 PolarHBondContact O-N 3.01Å; F529-T540 PolarHBondContact O-OG1 3.06Å; F531-T540 HydrophobicContact CD2-CG2 4.1Å; F531-T540 HydrophobicContact CE2-CG2 3.89Å; L538-T540 HydrophobicContact CD2-CG2 4.01Å; L538-T540 HydrophobicContact CG-CG2 3.86Å; T540-F567 HydrophobicContact CG2-CB 4.22Å; T540-F567 WeakPolarHBondContact OG1-CD1 3.41Å; T540-V568 CarbonylContact C-O 3.59Å; T540-V568 VanDerWaalsContact CA-O 3.27Å; T540-V568 WeakPolarHBondContact CA-O 3.43Å
541	R	89.5	Confident	71.9	Confident	104 Å²	104	75.4 Å²	75.4	39%	0.392	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	143.8	164.7	-75.6	174.3	176.9	-164.3	-1.2	109.2	I526 I528 V568 Y570	I526-R541 VanDerWaalsContact CD1-NH2 3.32Å; I526-R541 HydrophobicContact CG2-CG 3.84Å; I528-R541 HydrophobicContact CG2-CG 4.44Å; R541-V568 PolarHBondContact N-O 2.64Å; R541-V568 PolarHBondContact O-N 3.34Å; R541-Y570 HydrophobicContact CG-CD2 4.33Å; R541-Y570 HydrophobicContact CG-CG 4.07Å; R541-Y570 VanDerWaalsContact NE-CE2 3.34Å; R541-Y570 VanDerWaalsContact NH2-CZ 3.26Å; R541-Y570 PolarHBondContact NH2-OH 3.45Å
542	I	83.4	Confident	69.3	Low	36 Å²	36	79.9 Å²	79.9	19%	0.185	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	109.2	-179.7	-47	-178.7	0	0	0	110	F516 F529 K544 F567	F516-I542 HydrophobicContact CD1-CD1 3.74Å; F516-I542 HydrophobicContact CE1-CD1 3.45Å; F516-I542 VanDerWaalsContact CE1-CD1 3.45Å; F529-I542 HydrophobicContact CB-CD1 4Å; F529-I542 HydrophobicContact CB-CG1 4Å; F529-I542 HydrophobicContact CD2-CD1 4.23Å; I542-K544 HydrophobicContact CG2-CG 4.25Å; I542-K544 PolarHBondContact O-N 2.9Å; I542-F567 HydrophobicContact CD1-CE1 4.27Å; I542-F567 HydrophobicContact CG1-CD1 4.22Å; I542-F567 HydrophobicContact CG1-CE1 3.97Å
543	K	76.7	Confident	66.4	Low	119 Å²	119	88.7 Å²	88.7	52%	0.517	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	95.7	158.9	-79.7	-174.5	-176.5	168.3	0	107.6	V566 V568	K543-V566 HydrophobicContact CB-CB 4.26Å; K543-V566 PolarHBondContact N-O 3.48Å; K543-V566 PolarHBondContact O-N 3.33Å; K543-V566 VanDerWaalsContact O-N 3.12Å; K543-V568 HydrophobicContact CB-CG2 4.21Å; K543-V568 HydrophobicContact CD-CG2 3.6Å; K543-V568 HydrophobicContact CG-CG2 3.72Å
544	K	65.8	Low	63.4	Low	141 Å²	141	94.3 Å²	94.3	61%	0.613	46%	0.464	S	S	*	.	P	Polyproline II helix	trans	-55.5	128	165.1	-69	165.6	-175.2	154.6	0	107.1	E527 I542	E527-K544 IonicContact OE2-NZ 3.7Å; E527-K544 PolarHBondContact OE2-NZ 3.39Å; I542-K544 HydrophobicContact CG2-CG 4.25Å; I542-K544 PolarHBondContact O-N 2.9Å
545	P	51.2	Low	60.8	Low	65 Å²	65	98.8 Å²	98.8	42%	0.422	49%	0.494	S	S	.	.	P	Polyproline II helix	trans	-61.1	151.6	-179.1	28.2	-37.5	0	0	0	110	K547 G564	P545-K547 PolarHBondContact O-N 2.73Å; P545-K547 VanDerWaalsContact O-N 3.09Å; P545-G564 VanDerWaalsContact CD-O 3.3Å; P545-G564 WeakPolarHBondContact CD-O 3.49Å; P545-G564 VanDerWaalsContact CG-O 3.26Å; P545-G564 WeakPolarHBondContact CG-O 3.14Å
546	P	35.6	Very low	58.1	Low	123 Å²	123	103.8 Å²	103.8	80%	0.799	52%	0.52	S	S	*	.	P	Polyproline II helix	trans	-58.9	119.9	176.7	25.1	-33.3	0	0	0	109.1	K548	P546-K548 PolarHBondContact O-N 3.39Å
547	K	43	Very low	55.5	Low	205 Å²	205	107.6 Å²	107.6	89%	0.891	54%	0.544	S	S	*	.			trans	-61.2	89.7	-173	-71.7	-171.4	175.7	-172.3	0	111.9	P545 K549	P545-K547 PolarHBondContact O-N 2.73Å; P545-K547 VanDerWaalsContact O-N 3.09Å; K547-K549 PolarHBondContact O-N 2.89Å
548	K	38.2	Very low	52.6	Low	201 Å²	201	111.7 Å²	111.7	87%	0.874	59%	0.587	S	S	*	*			trans	-62	118.6	155.4	-81.1	-171.1	173.9	-177.9	0	107.2	P546 S550	P546-K548 PolarHBondContact O-N 3.39Å; K548-S550 PolarHBondContact O-N 3.24Å; K548-S550 VanDerWaalsContact O-N 3.09Å
549	K	31.7	Very low	50.1	Low	202 Å²	202	118.8 Å²	118.8	88%	0.878	61%	0.614	S	S	*	*			trans	-64.8	108	173.2	-66.3	179.9	179.4	-180	0	108.4	K547	K547-K549 PolarHBondContact O-N 2.89Å
550	S	33.2	Very low	48	Very low	99 Å²	99	121 Å²	121	69%	0.692	63%	0.63	S	S	*	*			trans	-122.3	108.5	167.7	-163.8	0	0	0	0	108.2	K548 S552	K548-S550 PolarHBondContact O-N 3.24Å; K548-S550 VanDerWaalsContact O-N 3.09Å; S550-S552 PolarHBondContact O-N 3.44Å
551	F	34.5	Very low	46.1	Very low	211 Å²	211	127.4 Å²	127.4	93%	0.925	66%	0.663	S	S	*	*			trans	-82.6	93.1	174.3	-92.7	-93.4	0	0	0	109.2
552	S	38.9	Very low	44.6	Very low	93 Å²	93	122.8 Å²	122.8	65%	0.65	65%	0.646	S	S	*	*			trans	-168.3	82.1	164.4	58.8	0	0	0	0	109.7	S550	S550-S552 PolarHBondContact O-N 3.44Å
553	E	33.9	Very low	43.2	Very low	185 Å²	185	126.2 Å²	126.2	86%	0.864	66%	0.661	S	S	*	*			trans	-75.1	138.4	166.1	-67.1	-173.3	153.4	0	0	109.3
554	N	31.5	Very low	42.3	Very low	118 Å²	118	122.8 Å²	122.8	63%	0.631	66%	0.659	S	S	*	*			trans	-137	93.7	165.6	-154.6	37.3	0	0	0	107.1	L556	N554-L556 PolarHBondContact O-N 3.38Å
555	P	35.6	Very low	42.5	Very low	111 Å²	111	116.6 Å²	116.6	72%	0.721	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71	-1.6	-161.1	-23.3	35.1	0	0	0	117
556	L	34.4	Very low	44	Very low	149 Å²	149	115.7 Å²	115.7	78%	0.78	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.6	6.5	-162.8	-64	171.7	0	0	0	115.1	N554	N554-L556 PolarHBondContact O-N 3.38Å
557	T	37.5	Very low	46.5	Very low	89 Å²	89	110 Å²	110	55%	0.546	59%	0.592	S	S	.	*	S	Bend	trans	-102.2	132.7	166.2	39.8	0	0	0	0	109.1	R559	T557-R559 PolarHBondContact O-N 2.9Å
558	G	32.7	Very low	48.7	Very low	90 Å²	90	101 Å²	101	93%	0.928	55%	0.554	S	S	*	*			trans	-69.7	66.5	176.2	0	0	0	0	0	112.2	S560	G558-S560 PolarHBondContact O-N 2.97Å
559	R	40.2	Very low	51.1	Low	149 Å²	149	91.7 Å²	91.7	56%	0.562	51%	0.514	S	S	*	.			trans	-57	131.1	-178.6	-72	177.8	172.8	-99.6	-0.7	110.3	T557 I561 E563	T557-R559 PolarHBondContact O-N 2.9Å; R559-I561 PolarHBondContact O-N 2.89Å; R559-E563 WeakPolarHBondContact CB-OE2 3.45Å; R559-E563 WeakPolarHBondContact CD-OE2 3.14Å; R559-E563 WeakPolarHBondContact CG-OE2 3.42Å; R559-E563 IonicContact CZ-OE1 2.92Å; R559-E563 IonicContact CZ-OE2 3.75Å; R559-E563 IonicContact NE-OE2 3.25Å; R559-E563 IonicContact NH1-OE1 3.22Å; R559-E563 PolarHBondContact NH1-OE1 3.11Å; R559-E563 IonicContact NH1-OE2 2.81Å; R559-E563 PolarHBondContact NH1-OE2 2.89Å
560	S	48.2	Very low	53.6	Low	50 Å²	50	83.3 Å²	83.3	35%	0.35	48%	0.477	S	S	.	.			trans	-54.9	134.6	171.5	179.5	0	0	0	0	109.5	R465 G558 T562 E563	R465-S560 PolarHBondContact NH1-OG 3.3Å; G558-S560 PolarHBondContact O-N 2.97Å; S560-T562 PolarHBondContact O-N 3.45Å; S560-T562 PolarHBondContact OG-OG1 3.19Å; S560-E563 WeakPolarHBondContact O-CB 3.32Å; S560-E563 PolarHBondContact O-N 2.89Å
561	I	52.2	Low	55.9	Low	135 Å²	135	82.5 Å²	82.5	69%	0.692	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.6	-17.8	178.5	-82.1	173.6	0	0	0	112.6	F516 F529 R559	F516-I561 HydrophobicContact CD2-CG2 4.36Å; F516-I561 HydrophobicContact CE2-CG2 3.27Å; F516-I561 HydrophobicContact CZ-CG2 3.46Å; F516-I561 VanDerWaalsContact CZ-CG2 3.46Å; F529-I561 HydrophobicContact CE2-CG2 4.44Å; R559-I561 PolarHBondContact O-N 2.89Å
562	T	58.2	Low	58.4	Low	7 Å²	7	79.1 Å²	79.1	4%	0.043	45%	0.446	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.4	-1.8	179.5	67.2	0	0	0	0	115	R465 E468 F529 S560 G564 G565 F567	R465-T562 PolarHBondContact NH1-OG1 3.21Å; R465-T562 PolarHBondContact NH2-OG1 2.92Å; R465-T562 VanDerWaalsContact NH2-OG1 3.15Å; E468-T562 PolarHBondContact OE1-OG1 3.11Å; F529-T562 HydrophobicContact CE1-CG2 3.96Å; F529-T562 HydrophobicContact CE2-CG2 3.98Å; F529-T562 HydrophobicContact CZ-CG2 3.54Å; S560-T562 PolarHBondContact O-N 3.45Å; S560-T562 PolarHBondContact OG-OG1 3.19Å; T562-G564 PolarHBondContact O-N 3.19Å; T562-G565 PolarHBondContact O-N 3.14Å; T562-F567 HydrophobicContact CG2-CE2 4.07Å; T562-F567 HydrophobicContact CG2-CZ 3.55Å
563	E	54.7	Low	60.7	Low	109 Å²	109	77.2 Å²	77.2	51%	0.509	43%	0.43	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	113.3	-168.1	-166.8	-169.6	-177.5	0	0	112.5	R559 S560 G565	R559-E563 WeakPolarHBondContact CB-OE2 3.45Å; R559-E563 WeakPolarHBondContact CD-OE2 3.14Å; R559-E563 WeakPolarHBondContact CG-OE2 3.42Å; R559-E563 IonicContact CZ-OE1 2.92Å; R559-E563 IonicContact CZ-OE2 3.75Å; R559-E563 IonicContact NE-OE2 3.25Å; R559-E563 IonicContact NH1-OE1 3.22Å; R559-E563 PolarHBondContact NH1-OE1 3.11Å; R559-E563 IonicContact NH1-OE2 2.81Å; R559-E563 PolarHBondContact NH1-OE2 2.89Å; S560-E563 WeakPolarHBondContact O-CB 3.32Å; S560-E563 PolarHBondContact O-N 2.89Å; E563-G565 VanDerWaalsContact C-N 3.3Å; E563-G565 PolarHBondContact O-N 3.17Å
564	G	57.8	Low	63.5	Low	46 Å²	46	68.6 Å²	68.6	47%	0.474	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.1	-1.9	-177.9	0	0	0	0	0	115.5	P545 T562	P545-G564 VanDerWaalsContact CD-O 3.3Å; P545-G564 WeakPolarHBondContact CD-O 3.49Å; P545-G564 VanDerWaalsContact CG-O 3.26Å; P545-G564 WeakPolarHBondContact CG-O 3.14Å; T562-G564 PolarHBondContact O-N 3.19Å
565	G	68.5	Low	66.3	Low	12 Å²	12	64.7 Å²	64.7	12%	0.124	37%	0.374	C	S	.	.	P	Polyproline II helix	trans	-70	137.8	170.4	0	0	0	0	0	111.7	T562 E563	T562-G565 PolarHBondContact O-N 3.14Å; E563-G565 VanDerWaalsContact C-N 3.3Å; E563-G565 PolarHBondContact O-N 3.17Å
566	V	83.4	Confident	68.9	Low	46 Å²	46	59.4 Å²	59.4	28%	0.279	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	119.6	172.9	179.8	0	0	0	0	108.9	I474 K543	I474-V566 HydrophobicContact CD1-CG1 3.49Å; I474-V566 VanDerWaalsContact CD1-CG1 3.49Å; I474-V566 HydrophobicContact CG1-CG1 3.84Å; K543-V566 HydrophobicContact CB-CB 4.26Å; K543-V566 PolarHBondContact N-O 3.48Å; K543-V566 PolarHBondContact O-N 3.33Å; K543-V566 VanDerWaalsContact O-N 3.12Å
567	F	88.6	Confident	71.5	Confident	2 Å²	2	54.8 Å²	54.8	1%	0.009	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	131.1	179.3	-63.1	-69.9	0	0	0	110	Q472 L473 I474 F529 F531 T540 I542 T562	Q472-F567 HydrophobicContact CB-CD2 3.95Å; Q472-F567 HydrophobicContact CB-CE2 4.39Å; Q472-F567 PolarHBondContact O-N 2.93Å; L473-F567 WeakPolarHBondContact CA-O 3.45Å; L473-F567 HydrophobicContact CD1-CB 3.65Å; I474-F567 PolarHBondContact N-O 3.03Å; F529-F567 HydrophobicContact CB-CD1 3.88Å; F529-F567 HydrophobicContact CB-CE1 3.5Å; F529-F567 VanDerWaalsContact CB-CE1 3.5Å; F529-F567 AromaticContact CD1-CE1 3.85Å; F529-F567 HydrophobicContact CD1-CE1 3.85Å; F529-F567 HydrophobicContact CD1-CZ 4.17Å; F529-F567 HydrophobicContact CD2-CE1 4.2Å; F529-F567 HydrophobicContact CG-CD1 4.36Å; F529-F567 AromaticContact CG-CE1 3.6Å; F529-F567 HydrophobicContact CG-CE1 3.6Å; F529-F567 HydrophobicContact CG-CZ 4.21Å; F531-F567 HydrophobicContact CE2-CD1 4.26Å; F531-F567 HydrophobicContact CE2-CD2 4.42Å; F531-F567 HydrophobicContact CE2-CG 4.14Å; F531-F567 HydrophobicContact CZ-CD1 4.25Å; F531-F567 AromaticContact CZ-CD2 3.92Å; F531-F567 HydrophobicContact CZ-CD2 3.92Å; F531-F567 HydrophobicContact CZ-CE1 4.31Å; F531-F567 AromaticContact CZ-CE2 3.98Å; F531-F567 HydrophobicContact CZ-CE2 3.98Å; F531-F567 HydrophobicContact CZ-CG 4.06Å; F531-F567 HydrophobicContact CZ-CZ 4.18Å; T540-F567 HydrophobicContact CG2-CB 4.22Å; T540-F567 WeakPolarHBondContact OG1-CD1 3.41Å; I542-F567 HydrophobicContact CD1-CE1 4.27Å; I542-F567 HydrophobicContact CG1-CD1 4.22Å; I542-F567 HydrophobicContact CG1-CE1 3.97Å; T562-F567 HydrophobicContact CG2-CE2 4.07Å; T562-F567 HydrophobicContact CG2-CZ 3.55Å
568	V	88.2	Confident	73.9	Confident	18 Å²	18	54.5 Å²	54.5	11%	0.109	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	118.8	176	-176.2	0	0	0	0	107.9	I474 P476 T540 R541 K543 Y570	I474-V568 HydrophobicContact CB-CG2 4.42Å; P476-V568 HydrophobicContact CG-CG1 3.74Å; T540-V568 CarbonylContact C-O 3.59Å; T540-V568 VanDerWaalsContact CA-O 3.27Å; T540-V568 WeakPolarHBondContact CA-O 3.43Å; R541-V568 PolarHBondContact N-O 2.64Å; R541-V568 PolarHBondContact O-N 3.34Å; K543-V568 HydrophobicContact CB-CG2 4.21Å; K543-V568 HydrophobicContact CD-CG2 3.6Å; K543-V568 HydrophobicContact CG-CG2 3.72Å; V568-Y570 PolarHBondContact O-N 2.79Å
569	V	88.4	Confident	76.7	Confident	5 Å²	5	50.5 Å²	50.5	3%	0.03	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.6	126.4	179.1	-179.6	0	0	0	0	109.6	L473 I474 W475 P476 L538 R571	L473-V569 HydrophobicContact CD1-CG2 3.63Å; L473-V569 HydrophobicContact CD2-CG2 4.06Å; L473-V569 HydrophobicContact CG-CG2 3.97Å; I474-V569 PolarHBondContact O-N 3.07Å; W475-V569 HydrophobicContact CD2-CG2 3.85Å; W475-V569 HydrophobicContact CE3-CB 4.11Å; W475-V569 HydrophobicContact CE3-CG1 4.1Å; W475-V569 HydrophobicContact CE3-CG2 3.66Å; W475-V569 HydrophobicContact CG-CG2 4.47Å; W475-V569 HydrophobicContact CH2-CG2 4.13Å; W475-V569 HydrophobicContact CZ2-CG2 4.32Å; W475-V569 HydrophobicContact CZ3-CB 4.31Å; W475-V569 HydrophobicContact CZ3-CG1 3.89Å; W475-V569 HydrophobicContact CZ3-CG2 3.81Å; P476-V569 VanDerWaalsContact CG-O 3.3Å; P476-V569 WeakPolarHBondContact CG-O 3.07Å; L538-V569 HydrophobicContact CD1-CG1 4Å; L538-V569 HydrophobicContact CD1-CG2 4.04Å; V569-R571 VanDerWaalsContact CG1-O 3.26Å; V569-R571 WeakPolarHBondContact CG1-O 3.29Å
570	Y	84.5	Confident	79.1	Confident	25 Å²	25	45.8 Å²	45.8	10%	0.098	25%	0.25	C	C	.	.			trans	-90.4	-43.1	-171.1	178.5	-145.6	0	0	0	113.3	L481 L519 D521 I526 V539 R541 V568	L481-Y570 WeakPolarHBondContact CD2-O 3.48Å; L519-Y570 HydrophobicContact CD2-CD1 3.85Å; L519-Y570 HydrophobicContact CD2-CE1 3.63Å; D521-Y570 PolarHBondContact OD1-OH 2.69Å; D521-Y570 PolarHBondContact OD2-OH 3.46Å; I526-Y570 HydrophobicContact CD1-CE1 3.76Å; I526-Y570 WeakPolarHBondContact CD1-OH 3.48Å; V539-Y570 HydrophobicContact CG1-CD1 4.28Å; V539-Y570 PolarHBondContact O-N 3Å; R541-Y570 HydrophobicContact CG-CD2 4.33Å; R541-Y570 HydrophobicContact CG-CG 4.07Å; R541-Y570 VanDerWaalsContact NE-CE2 3.34Å; R541-Y570 VanDerWaalsContact NH2-CZ 3.26Å; R541-Y570 PolarHBondContact NH2-OH 3.45Å; V568-Y570 PolarHBondContact O-N 2.79Å
571	R	82.6	Confident	81.2	Confident	83 Å²	83	44.4 Å²	44.4	31%	0.313	24%	0.238	S	C	.	.	S	Bend	trans	-141.7	175.4	177.8	-63.6	-167.1	-178.2	-70.6	7.1	108.5	D521 V569 Y613	D521-R571 VanDerWaalsContact CG-NH2 3.28Å; D521-R571 IonicContact OD1-CZ 3.64Å; D521-R571 IonicContact OD1-NE 3.92Å; D521-R571 IonicContact OD1-NH2 2.67Å; D521-R571 PolarHBondContact OD1-NH2 3.15Å; D521-R571 IonicContact OD2-NH2 3.91Å; D521-R571 PolarHBondContact OD2-NH2 3.15Å; V569-R571 VanDerWaalsContact CG1-O 3.26Å; V569-R571 WeakPolarHBondContact CG1-O 3.29Å; R571-Y613 WeakPolarHBondContact CB-OH 3.36Å; R571-Y613 VanDerWaalsContact CD-OH 3.3Å; R571-Y613 WeakPolarHBondContact CD-OH 3.27Å
572	Q	85.6	Confident	83	Confident	140 Å²	140	43.4 Å²	43.4	65%	0.654	23%	0.23	S	C	*	.			trans	-52.9	150.4	177.5	69.6	-179.7	2.1	0	0	112.7
573	V	88.8	Confident	84.5	Confident	52 Å²	52	45.9 Å²	45.9	32%	0.315	24%	0.243	S	C	.	.			trans	-61	138	171.2	-73.7	0	0	0	0	111.1	W475 L503 F536 L538	W475-V573 HydrophobicContact CH2-CG1 3.9Å; W475-V573 HydrophobicContact CZ3-CG1 4.21Å; L503-V573 HydrophobicContact CD2-CG1 4.14Å; L503-V573 HydrophobicContact CD2-CG2 4.48Å; F536-V573 HydrophobicContact CD2-CB 3.56Å; F536-V573 HydrophobicContact CD2-CG1 3.45Å; F536-V573 VanDerWaalsContact CD2-CG1 3.45Å; F536-V573 HydrophobicContact CE2-CB 4.07Å; F536-V573 HydrophobicContact CE2-CG1 3.41Å; F536-V573 VanDerWaalsContact CE2-CG1 3.41Å; F536-V573 HydrophobicContact CG-CB 4.38Å; L538-V573 HydrophobicContact CD1-CG1 3.69Å
574	I	90.9	Very high	85.9	Confident	5 Å²	5	42.2 Å²	42.2	3%	0.026	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	105.6	-175.5	-43.3	175.1	0	0	0	108.7	F536 L537 F579 L602 Y613	F536-I574 CarbonylContact C-O 3.49Å; F536-I574 WeakPolarHBondContact CA-O 3.29Å; F536-I574 WeakPolarHBondContact CB-O 3.38Å; L537-I574 HydrophobicContact CB-CB 4.46Å; L537-I574 PolarHBondContact N-O 3.11Å; L537-I574 PolarHBondContact O-N 3.16Å; I574-F579 HydrophobicContact CG2-CD1 3.56Å; I574-F579 HydrophobicContact CG2-CE1 4.14Å; I574-F579 HydrophobicContact CG2-CG 4.39Å; I574-L602 HydrophobicContact CD1-CD1 4.36Å; I574-L602 HydrophobicContact CD1-CD2 4.21Å; I574-L602 HydrophobicContact CG1-CD2 4.24Å; I574-L602 HydrophobicContact CG2-CD1 4.41Å; I574-L602 HydrophobicContact CG2-CD2 3.91Å; I574-L602 HydrophobicContact CG2-CG 3.9Å; I574-Y613 HydrophobicContact CD1-CD2 4.36Å; I574-Y613 HydrophobicContact CD1-CE1 4.14Å; I574-Y613 HydrophobicContact CD1-CE2 3.99Å
575	A	91	Very high	86.8	Confident	35 Å²	35	41.5 Å²	41.5	29%	0.289	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.2	144.4	178	0	0	0	0	0	111.6	D577 R578 F579	A575-D577 WeakPolarHBondContact CB-OD1 3.14Å; A575-D577 PolarHBondContact O-N 3.27Å; A575-D577 VanDerWaalsContact O-N 3.15Å; A575-R578 HydrophobicContact CB-CG 4.01Å; A575-R578 PolarHBondContact O-N 2.67Å; A575-F579 WeakPolarHBondContact O-CD1 3.25Å
576	L	90.5	Very high	87.1	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-16.6	-172.9	-62	177.7	0	0	0	114.2	L532 D535 R578 F579 Q634 F637	L532-L576 HydrophobicContact CD1-CD2 3.72Å; D535-L576 PolarHBondContact O-N 3.49Å; L576-R578 VanDerWaalsContact C-N 3.34Å; L576-F579 HydrophobicContact CD2-CE1 3.95Å; L576-F579 HydrophobicContact CD2-CZ 3.87Å; L576-Q634 WeakPolarHBondContact O-CG 3.44Å; L576-Q634 PolarHBondContact O-NE2 2.94Å; L576-F637 HydrophobicContact CB-CB 4.15Å; L576-F637 HydrophobicContact CB-CD1 3.77Å; L576-F637 HydrophobicContact CB-CE1 4.4Å; L576-F637 HydrophobicContact CB-CG 4.06Å; L576-F637 HydrophobicContact CD1-CB 3.95Å; L576-F637 HydrophobicContact CD1-CG 4.28Å
577	D	88.5	Confident	86.5	Confident	53 Å²	53	50.6 Å²	50.6	28%	0.283	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90	7.9	173.3	67.9	-39.3	0	0	0	113.7	A575 F637 L641	A575-D577 WeakPolarHBondContact CB-OD1 3.14Å; A575-D577 PolarHBondContact O-N 3.27Å; A575-D577 VanDerWaalsContact O-N 3.15Å; D577-F637 HydrophobicContact CB-CD1 4.24Å; D577-F637 HydrophobicContact CB-CE1 3.92Å; D577-L641 HydrophobicContact CB-CD1 4.44Å
578	R	88.6	Confident	86	Confident	82 Å²	82	55.4 Å²	55.4	31%	0.309	29%	0.289	S	S	.	.	S	Bend	trans	-122.5	17.1	-172	-56.4	-63.6	149.3	-157.7	-4.2	115.4	A575 L576 L602 I603 T604	A575-R578 HydrophobicContact CB-CG 4.01Å; A575-R578 PolarHBondContact O-N 2.67Å; L576-R578 VanDerWaalsContact C-N 3.34Å; R578-L602 CarbonylContact O-C 3.49Å; R578-L602 VanDerWaalsContact O-CA 3.3Å; R578-L602 WeakPolarHBondContact O-CA 3.4Å; R578-I603 WeakPolarHBondContact CD-O 3.29Å; R578-I603 PolarHBondContact O-N 2.89Å; R578-T604 PolarHBondContact NH1-O 2.83Å
579	F	91.4	Very high	85.5	Confident	6 Å²	6	54.8 Å²	54.8	3%	0.026	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	154.6	169.6	61.6	-87.2	0	0	0	113.8	I574 A575 L576 I581 L600 V601 L602 L630 Q634	I574-F579 HydrophobicContact CG2-CD1 3.56Å; I574-F579 HydrophobicContact CG2-CE1 4.14Å; I574-F579 HydrophobicContact CG2-CG 4.39Å; A575-F579 WeakPolarHBondContact O-CD1 3.25Å; L576-F579 HydrophobicContact CD2-CE1 3.95Å; L576-F579 HydrophobicContact CD2-CZ 3.87Å; F579-I581 HydrophobicContact CD2-CG1 3.87Å; F579-I581 HydrophobicContact CE2-CD1 4.11Å; F579-I581 HydrophobicContact CE2-CG1 3.69Å; F579-L600 HydrophobicContact CD2-CB 4.31Å; F579-L600 HydrophobicContact CD2-CD1 4.29Å; F579-L600 HydrophobicContact CD2-CD2 3.94Å; F579-L600 HydrophobicContact CD2-CG 4.41Å; F579-L600 HydrophobicContact CE2-CD1 4.31Å; F579-L600 HydrophobicContact CE2-CD2 4.1Å; F579-V601 CarbonylContact C-O 3.56Å; F579-V601 WeakPolarHBondContact CA-O 3.04Å; F579-V601 WeakPolarHBondContact CB-O 3.38Å; F579-L602 HydrophobicContact CB-CD1 4.37Å; F579-L602 HydrophobicContact CB-CG 4.45Å; F579-L630 HydrophobicContact CE2-CD2 4.24Å; F579-L630 HydrophobicContact CZ-CD2 4.02Å; F579-Q634 PolarHBondContact O-NE2 3.34Å
580	T	90.3	Very high	84.9	Confident	50 Å²	50	59.4 Å²	59.4	31%	0.307	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	147.3	166.2	55.6	0	0	0	0	110.2	H582 L600 V601 I603	T580-H582 WeakPolarHBondContact CB-NE2 3.36Å; T580-H582 PolarHBondContact OG1-NE2 3.46Å; T580-L600 WeakPolarHBondContact O-CA 3.39Å; T580-V601 PolarHBondContact N-O 2.96Å; T580-V601 PolarHBondContact O-N 3.3Å; T580-V601 VanDerWaalsContact O-N 3.09Å; T580-I603 HydrophobicContact CG2-CD1 3.89Å
581	I	93	Very high	84.4	Confident	21 Å²	21	62.2 Å²	62.2	11%	0.108	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	111	-175.1	-54.6	156.7	0	0	0	109	F579 I598 L600 L630 R631	F579-I581 HydrophobicContact CD2-CG1 3.87Å; F579-I581 HydrophobicContact CE2-CD1 4.11Å; F579-I581 HydrophobicContact CE2-CG1 3.69Å; I581-I598 HydrophobicContact CG2-CG2 3.98Å; I581-L600 HydrophobicContact CB-CD2 4.29Å; I581-L600 HydrophobicContact CG1-CD2 3.95Å; I581-L600 HydrophobicContact CG2-CD2 4.15Å; I581-L630 HydrophobicContact CD1-CB 3.61Å; I581-L630 HydrophobicContact CG1-CB 4.41Å; I581-R631 HydrophobicContact CD1-CG 3.79Å
582	H	89.9	Confident	84	Confident	115 Å²	115	63.8 Å²	63.8	53%	0.532	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	122.7	176	-60.2	-95.4	0	0	0	109.1	T580 V599	T580-H582 WeakPolarHBondContact CB-NE2 3.36Å; T580-H582 PolarHBondContact OG1-NE2 3.46Å; H582-V599 HydrophobicContact CB-CB 4.2Å; H582-V599 PolarHBondContact N-O 3.14Å; H582-V599 PolarHBondContact O-N 3.33Å
583	D	89.1	Confident	83.7	Confident	59 Å²	59	60.2 Å²	60.2	32%	0.316	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	116.6	175.5	-175.8	3.8	0	0	0	108	K623 Q624 I627	D583-K623 WeakPolarHBondContact OD1-CE 3.21Å; D583-K623 IonicContact OD1-NZ 2.68Å; D583-K623 PolarHBondContact OD1-NZ 3.24Å; D583-Q624 PolarHBondContact OD2-NE2 3.27Å; D583-I627 HydrophobicContact CB-CD1 3.9Å; D583-I627 VanDerWaalsContact CG-CD1 3.44Å; D583-I627 WeakPolarHBondContact OD1-CD1 3.42Å
584	L	83.4	Confident	83.4	Confident	31 Å²	31	59 Å²	59	16%	0.162	35%	0.35	C	S	.	.	P	Polyproline II helix	trans	-82.2	121.5	176.9	-72.4	173.7	0	0	0	109.8	E588 A589 L594 A597 V599 K623	L584-E588 HydrophobicContact CD2-CB 4.33Å; L584-A589 HydrophobicContact CB-CB 4.42Å; L584-L594 HydrophobicContact CD1-CD1 3.91Å; L584-A597 HydrophobicContact CB-CB 4.48Å; L584-A597 HydrophobicContact CD1-CB 3.78Å; L584-A597 PolarHBondContact N-O 2.99Å; L584-V599 HydrophobicContact CD1-CG2 3.61Å; L584-V599 HydrophobicContact CG-CG2 4.03Å; L584-K623 PolarHBondContact O-NZ 2.87Å
585	G	77.8	Confident	82.8	Confident	31 Å²	31	68.1 Å²	68.1	32%	0.32	38%	0.384	S	S	.	.	P	Polyproline II helix	trans	-63.1	153.6	175.2	0	0	0	0	0	111.5	V587 E588 A589	G585-V587 PolarHBondContact O-N 3.46Å; G585-V587 VanDerWaalsContact O-N 3.09Å; G585-E588 PolarHBondContact N-OE2 2.7Å; G585-E588 PolarHBondContact O-N 3.34Å; G585-A589 WeakPolarHBondContact O-CB 3.32Å; G585-A589 PolarHBondContact O-N 2.87Å
586	I	75.1	Confident	82.5	Confident	126 Å²	126	68.3 Å²	68.3	65%	0.646	38%	0.38	S	S	*	.	H	α-helix	trans	-53.7	-36.8	-177.4	-62.8	170.2	0	0	0	111.6	T590	I586-T590 VanDerWaalsContact O-CB 3.27Å; I586-T590 WeakPolarHBondContact O-CB 3.24Å; I586-T590 PolarHBondContact O-N 3.3Å; I586-T590 PolarHBondContact O-OG1 3.16Å
587	V	71	Confident	82.3	Confident	123 Å²	123	68.3 Å²	68.3	75%	0.745	38%	0.38	S	S	*	.	H	α-helix	trans	-66	-49.8	177.5	-176.2	0	0	0	0	111.5	G585 T590 A591	G585-V587 PolarHBondContact O-N 3.46Å; G585-V587 VanDerWaalsContact O-N 3.09Å; V587-T590 PolarHBondContact O-N 3.05Å; V587-A591 WeakPolarHBondContact O-CB 3.16Å; V587-A591 PolarHBondContact O-N 3.44Å
588	E	78.3	Confident	82.5	Confident	103 Å²	103	65.9 Å²	65.9	48%	0.481	37%	0.367	S	S	.	.	H	α-helix	trans	-67.4	-40.7	-178.5	-56.5	172	135.8	0	0	111.8	L584 G585 A591 N592	L584-E588 HydrophobicContact CD2-CB 4.33Å; G585-E588 PolarHBondContact N-OE2 2.7Å; G585-E588 PolarHBondContact O-N 3.34Å; E588-A591 PolarHBondContact O-N 3.48Å; E588-N592 PolarHBondContact O-N 3.42Å; E588-N592 PolarHBondContact O-ND2 3.48Å
589	A	76.7	Confident	82.7	Confident	6 Å²	6	62.9 Å²	62.9	5%	0.05	36%	0.358	C	S	.	.	H	α-helix	trans	-60.7	-49.5	173.9	0	0	0	0	0	110.3	L584 G585 A591 N592 G593 L594	L584-A589 HydrophobicContact CB-CB 4.42Å; G585-A589 WeakPolarHBondContact O-CB 3.32Å; G585-A589 PolarHBondContact O-N 2.87Å; A589-A591 PolarHBondContact O-N 2.81Å; A589-N592 CarbonylContact O-C 3.23Å; A589-N592 PolarHBondContact O-N 3.08Å; A589-G593 PolarHBondContact O-N 3.15Å; A589-G593 VanDerWaalsContact O-N 3.11Å; A589-L594 CarbonylContact C-O 3.57Å; A589-L594 VanDerWaalsContact C-O 3.23Å; A589-L594 HydrophobicContact CB-CB 4.42Å; A589-L594 WeakPolarHBondContact CB-O 3.42Å; A589-L594 PolarHBondContact O-N 3.44Å; A589-L594 VanDerWaalsContact O-O 3.07Å
590	T	75.9	Confident	82.7	Confident	101 Å²	101	62.6 Å²	62.6	62%	0.62	36%	0.357	S	S	*	.	H	α-helix	trans	-61.3	-43	178.3	-57.2	0	0	0	0	112.1	I586 V587 N592 G593	I586-T590 VanDerWaalsContact O-CB 3.27Å; I586-T590 WeakPolarHBondContact O-CB 3.24Å; I586-T590 PolarHBondContact O-N 3.3Å; I586-T590 PolarHBondContact O-OG1 3.16Å; V587-T590 PolarHBondContact O-N 3.05Å; T590-N592 PolarHBondContact O-N 2.82Å; T590-G593 PolarHBondContact O-N 2.77Å
591	A	73.9	Confident	82.9	Confident	85 Å²	85	61.3 Å²	61.3	70%	0.702	35%	0.349	S	S	*	.	H	α-helix	trans	-60.7	-31	177.7	0	0	0	0	0	113.1	V587 E588 A589	V587-A591 WeakPolarHBondContact O-CB 3.16Å; V587-A591 PolarHBondContact O-N 3.44Å; E588-A591 PolarHBondContact O-N 3.48Å; A589-A591 PolarHBondContact O-N 2.81Å
592	N	75.2	Confident	82.8	Confident	116 Å²	116	60.8 Å²	60.8	62%	0.62	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.5	7.3	177.1	-69.1	-78.5	0	0	0	113.6	E588 A589 T590 L594	E588-N592 PolarHBondContact O-N 3.42Å; E588-N592 PolarHBondContact O-ND2 3.48Å; A589-N592 CarbonylContact O-C 3.23Å; A589-N592 PolarHBondContact O-N 3.08Å; T590-N592 PolarHBondContact O-N 2.82Å; N592-L594 HydrophobicContact CB-CD1 4.11Å; N592-L594 HydrophobicContact CB-CG 4.03Å; N592-L594 PolarHBondContact O-N 2.94Å
593	G	78.4	Confident	82.9	Confident	64 Å²	64	57.7 Å²	57.7	66%	0.66	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.3	11.7	-177.3	0	0	0	0	0	115.1	A589 T590	A589-G593 PolarHBondContact O-N 3.15Å; A589-G593 VanDerWaalsContact O-N 3.11Å; T590-G593 PolarHBondContact O-N 2.77Å
594	L	81.5	Confident	82.9	Confident	27 Å²	27	56.5 Å²	56.5	14%	0.141	33%	0.328	C	S	.	.			trans	-89.6	149.9	179.9	-54.8	177.3	0	0	0	110.6	N520 L584 A589 N592 A597 T614	N520-L594 WeakPolarHBondContact ND2-CD2 3.49Å; L584-L594 HydrophobicContact CD1-CD1 3.91Å; A589-L594 CarbonylContact C-O 3.57Å; A589-L594 VanDerWaalsContact C-O 3.23Å; A589-L594 HydrophobicContact CB-CB 4.42Å; A589-L594 WeakPolarHBondContact CB-O 3.42Å; A589-L594 PolarHBondContact O-N 3.44Å; A589-L594 VanDerWaalsContact O-O 3.07Å; N592-L594 HydrophobicContact CB-CD1 4.11Å; N592-L594 HydrophobicContact CB-CG 4.03Å; N592-L594 PolarHBondContact O-N 2.94Å; L594-A597 HydrophobicContact CB-CB 3.91Å; L594-A597 HydrophobicContact CD1-CB 4.22Å; L594-T614 HydrophobicContact CD1-CG2 3.75Å; L594-T614 HydrophobicContact CD2-CG2 4.39Å
595	R	79.2	Confident	83.1	Confident	196 Å²	196	64.9 Å²	64.9	74%	0.74	36%	0.357	S	S	*	.	S	Bend	trans	-122.2	133.6	173.7	-64.9	-175.8	-179.1	174.9	1.3	110.6	A597 Q616	R595-A597 VanDerWaalsContact C-N 3.31Å; R595-A597 PolarHBondContact O-N 3.01Å; R595-Q616 WeakPolarHBondContact O-CB 3.31Å; R595-Q616 PolarHBondContact O-OE1 3.36Å
596	N	83.8	Confident	83.6	Confident	40 Å²	40	71.9 Å²	71.9	21%	0.214	38%	0.379	C	S	.	.	S	Bend	trans	46.9	51.6	175.7	-28.5	-51.2	0	0	0	112.2	A617 A618 N619 K623	N596-A617 HydrophobicContact CB-CB 4.42Å; N596-A617 PolarHBondContact ND2-O 2.89Å; N596-A617 PolarHBondContact O-N 3.08Å; N596-A618 PolarHBondContact ND2-O 3.14Å; N596-N619 VanDerWaalsContact ND2-CA 3.33Å; N596-N619 WeakPolarHBondContact ND2-CA 3.4Å; N596-N619 PolarHBondContact ND2-N 2.86Å; N596-K623 HydrophobicContact CB-CB 4.09Å; N596-K623 HydrophobicContact CB-CD 4.38Å; N596-K623 HydrophobicContact CB-CG 4.5Å; N596-K623 WeakPolarHBondContact O-CG 3.34Å
597	A	88.1	Confident	84.2	Confident	0 Å²	0	74 Å²	74	0%	0	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	144.3	-164.7	0	0	0	0	0	113.9	L584 L594 R595 L615 Q616 K623	L584-A597 HydrophobicContact CB-CB 4.48Å; L584-A597 HydrophobicContact CD1-CB 3.78Å; L584-A597 PolarHBondContact N-O 2.99Å; L594-A597 HydrophobicContact CB-CB 3.91Å; L594-A597 HydrophobicContact CD1-CB 4.22Å; R595-A597 VanDerWaalsContact C-N 3.31Å; R595-A597 PolarHBondContact O-N 3.01Å; A597-L615 CarbonylContact C-O 3.57Å; A597-L615 VanDerWaalsContact CA-O 3.23Å; A597-L615 WeakPolarHBondContact CA-O 3.24Å; A597-Q616 HydrophobicContact CB-CG 4.18Å; A597-K623 WeakPolarHBondContact O-CE 3.11Å
598	I	92.1	Very high	85	Confident	1 Å²	1	74.3 Å²	74.3	1%	0.005	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	133.3	176.8	-48.1	170.9	0	0	0	107.1	I581 L600 L615 K623 W626 I627	I581-I598 HydrophobicContact CG2-CG2 3.98Å; I598-L600 HydrophobicContact CG2-CD2 4.05Å; I598-L615 HydrophobicContact CB-CB 4.48Å; I598-L615 PolarHBondContact N-O 3.4Å; I598-L615 PolarHBondContact O-N 2.86Å; I598-K623 HydrophobicContact CD1-CG 3.95Å; I598-K623 HydrophobicContact CG1-CG 3.56Å; I598-W626 HydrophobicContact CD1-CB 3.62Å; I598-I627 HydrophobicContact CD1-CD1 4.46Å; I598-I627 HydrophobicContact CD1-CG1 3.87Å; I598-I627 HydrophobicContact CG1-CD1 4.17Å; I598-I627 HydrophobicContact CG1-CG1 3.99Å; I598-I627 HydrophobicContact CG2-CG1 4.2Å
599	V	92	Very high	85.6	Confident	20 Å²	20	74.3 Å²	74.3	12%	0.121	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	120.4	177.6	176	0	0	0	0	109.8	H582 L584 V601 V612 Y613 T614	H582-V599 HydrophobicContact CB-CB 4.2Å; H582-V599 PolarHBondContact N-O 3.14Å; H582-V599 PolarHBondContact O-N 3.33Å; L584-V599 HydrophobicContact CD1-CG2 3.61Å; L584-V599 HydrophobicContact CG-CG2 4.03Å; V599-V601 HydrophobicContact CG1-CG2 4.2Å; V599-V612 HydrophobicContact CG1-CG1 3.43Å; V599-V612 VanDerWaalsContact CG1-CG1 3.43Å; V599-Y613 WeakPolarHBondContact CA-O 3.38Å; V599-T614 HydrophobicContact CG2-CG2 4.24Å
600	L	93	Very high	86.2	Confident	0 Å²	0	77.8 Å²	77.8	0%	0	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	116.8	173.5	-50.2	-176.2	0	0	0	109.5	L537 F579 T580 I581 I598 V612 Y613 L615 L630	L537-L600 HydrophobicContact CD2-CD1 3.63Å; F579-L600 HydrophobicContact CD2-CB 4.31Å; F579-L600 HydrophobicContact CD2-CD1 4.29Å; F579-L600 HydrophobicContact CD2-CD2 3.94Å; F579-L600 HydrophobicContact CD2-CG 4.41Å; F579-L600 HydrophobicContact CE2-CD1 4.31Å; F579-L600 HydrophobicContact CE2-CD2 4.1Å; T580-L600 WeakPolarHBondContact O-CA 3.39Å; I581-L600 HydrophobicContact CB-CD2 4.29Å; I581-L600 HydrophobicContact CG1-CD2 3.95Å; I581-L600 HydrophobicContact CG2-CD2 4.15Å; I598-L600 HydrophobicContact CG2-CD2 4.05Å; L600-V612 CarbonylContact O-C 3.55Å; L600-V612 WeakPolarHBondContact O-CA 3.22Å; L600-Y613 PolarHBondContact N-O 2.84Å; L600-Y613 PolarHBondContact O-N 3.06Å; L600-L615 HydrophobicContact CD1-CD1 3.66Å; L600-L615 HydrophobicContact CG-CD1 3.95Å; L600-L630 HydrophobicContact CD2-CD1 4.35Å
601	V	92.7	Very high	86.7	Confident	23 Å²	23	74.2 Å²	74.2	14%	0.139	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	117.3	175.9	-178.8	0	0	0	0	108.6	F579 T580 V599 I609 V612	F579-V601 CarbonylContact C-O 3.56Å; F579-V601 WeakPolarHBondContact CA-O 3.04Å; F579-V601 WeakPolarHBondContact CB-O 3.38Å; T580-V601 PolarHBondContact N-O 2.96Å; T580-V601 PolarHBondContact O-N 3.3Å; T580-V601 VanDerWaalsContact O-N 3.09Å; V599-V601 HydrophobicContact CG1-CG2 4.2Å; V601-I609 HydrophobicContact CG1-CD1 4.13Å; V601-I609 HydrophobicContact CG1-CG1 4.12Å; V601-I609 HydrophobicContact CG1-CG2 3.69Å; V601-V612 HydrophobicContact CG1-CG2 4.46Å; V601-V612 HydrophobicContact CG2-CG1 4.41Å; V601-V612 HydrophobicContact CG2-CG2 4.33Å
602	L	92.4	Very high	87.5	Confident	10 Å²	10	74.1 Å²	74.1	5%	0.052	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	129.7	-176.5	-80.7	66.5	0	0	0	111	I574 R578 F579 I609 T610 G611 Y613	I574-L602 HydrophobicContact CD1-CD1 4.36Å; I574-L602 HydrophobicContact CD1-CD2 4.21Å; I574-L602 HydrophobicContact CG1-CD2 4.24Å; I574-L602 HydrophobicContact CG2-CD1 4.41Å; I574-L602 HydrophobicContact CG2-CD2 3.91Å; I574-L602 HydrophobicContact CG2-CG 3.9Å; R578-L602 CarbonylContact O-C 3.49Å; R578-L602 VanDerWaalsContact O-CA 3.3Å; R578-L602 WeakPolarHBondContact O-CA 3.4Å; F579-L602 HydrophobicContact CB-CD1 4.37Å; F579-L602 HydrophobicContact CB-CG 4.45Å; L602-I609 VanDerWaalsContact O-CA 3.29Å; L602-I609 WeakPolarHBondContact O-CA 3.5Å; L602-T610 PolarHBondContact O-N 3.49Å; L602-G611 PolarHBondContact N-O 3.39Å; L602-Y613 HydrophobicContact CD1-CD2 3.43Å; L602-Y613 VanDerWaalsContact CD1-CD2 3.43Å; L602-Y613 HydrophobicContact CD1-CE2 3.64Å; L602-Y613 HydrophobicContact CD2-CD2 4.38Å; L602-Y613 HydrophobicContact CD2-CE2 3.69Å; L602-Y613 HydrophobicContact CG-CE2 4.32Å
603	I	91.6	Very high	88.2	Confident	49 Å²	49	69.5 Å²	69.5	25%	0.251	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	124.9	-174.7	-51.8	-178	0	0	0	109.2	R578 T580 I609	R578-I603 WeakPolarHBondContact CD-O 3.29Å; R578-I603 PolarHBondContact O-N 2.89Å; T580-I603 HydrophobicContact CG2-CD1 3.89Å; I603-I609 HydrophobicContact CG1-CG1 4.37Å
604	T	89.8	Confident	88.9	Confident	35 Å²	35	67.9 Å²	67.9	22%	0.215	33%	0.328	C	S	.	.			trans	-73.7	178	179.4	64.2	0	0	0	0	112.7	R578 F606 Q607 Q608 T610	R578-T604 PolarHBondContact NH1-O 2.83Å; T604-F606 PolarHBondContact O-N 2.85Å; T604-F606 PolarHBondContact OG1-N 2.9Å; T604-Q607 PolarHBondContact O-N 3.06Å; T604-Q608 WeakPolarHBondContact CG2-O 3.26Å; T604-Q608 PolarHBondContact N-O 3.34Å; T604-Q608 WeakPolarHBondContact OG1-CB 3.48Å; T604-Q608 PolarHBondContact OG1-N 3.4Å; T604-Q608 PolarHBondContact OG1-O 3.23Å; T604-Q608 VanDerWaalsContact OG1-O 3.14Å; T604-T610 HydrophobicContact CG2-CG2 3.38Å
605	R	86.1	Confident	89.4	Confident	207 Å²	207	66.9 Å²	66.9	78%	0.781	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-20.8	170.2	-161.9	173.3	-169.7	153.1	3.1	113.5
606	F	89.3	Confident	90	Very high	177 Å²	177	59 Å²	59	78%	0.776	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.1	22.1	-179	-52	-69.5	0	0	0	112.5	T604 Q608	T604-F606 PolarHBondContact O-N 2.85Å; T604-F606 PolarHBondContact OG1-N 2.9Å; F606-Q608 PolarHBondContact O-N 3.04Å
607	Q	86.4	Confident	90.4	Very high	172 Å²	172	57.5 Å²	57.5	80%	0.804	29%	0.287	S	S	*	.	S	Bend	trans	60.6	-4	-178.3	-55.6	-177.4	5.4	0	0	115.9	T604 I609	T604-Q607 PolarHBondContact O-N 3.06Å; Q607-I609 PolarHBondContact O-N 2.89Å
608	Q	89.1	Confident	90.4	Very high	128 Å²	128	61.9 Å²	61.9	60%	0.598	32%	0.323	S	S	*	.			trans	-61.5	126.7	171.8	-174.7	-174.1	16.9	0	0	110.6	T604 F606 T610	T604-Q608 WeakPolarHBondContact CG2-O 3.26Å; T604-Q608 PolarHBondContact N-O 3.34Å; T604-Q608 WeakPolarHBondContact OG1-CB 3.48Å; T604-Q608 PolarHBondContact OG1-N 3.4Å; T604-Q608 PolarHBondContact OG1-O 3.23Å; T604-Q608 VanDerWaalsContact OG1-O 3.14Å; F606-Q608 PolarHBondContact O-N 3.04Å; Q608-T610 HydrophobicContact CG-CG2 4.38Å
609	I	90.5	Very high	90.3	Very high	103 Å²	103	64.8 Å²	64.8	53%	0.528	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	126.6	168.2	-62.3	169.6	0	0	0	108.5	V601 L602 I603 Q607	V601-I609 HydrophobicContact CG1-CD1 4.13Å; V601-I609 HydrophobicContact CG1-CG1 4.12Å; V601-I609 HydrophobicContact CG1-CG2 3.69Å; L602-I609 VanDerWaalsContact O-CA 3.29Å; L602-I609 WeakPolarHBondContact O-CA 3.5Å; I603-I609 HydrophobicContact CG1-CG1 4.37Å; Q607-I609 PolarHBondContact O-N 2.89Å
610	T	88.6	Confident	90.1	Very high	80 Å²	80	66.6 Å²	66.6	49%	0.491	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	-9.4	-176.9	45.1	0	0	0	0	114.8	L602 T604 Q608	L602-T610 PolarHBondContact O-N 3.49Å; T604-T610 HydrophobicContact CG2-CG2 3.38Å; Q608-T610 HydrophobicContact CG-CG2 4.38Å
611	G	86.6	Confident	90	Very high	25 Å²	25	72.7 Å²	72.7	26%	0.258	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-179.7	165.1	176.2	0	0	0	0	0	113	L602	L602-G611 PolarHBondContact N-O 3.39Å
612	V	91	Very high	90	Very high	84 Å²	84	73.6 Å²	73.6	51%	0.509	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	129.5	178	-176.5	0	0	0	0	108.3	V599 L600 V601	V599-V612 HydrophobicContact CG1-CG1 3.43Å; V599-V612 VanDerWaalsContact CG1-CG1 3.43Å; L600-V612 CarbonylContact O-C 3.55Å; L600-V612 WeakPolarHBondContact O-CA 3.22Å; V601-V612 HydrophobicContact CG1-CG2 4.46Å; V601-V612 HydrophobicContact CG2-CG1 4.41Å; V601-V612 HydrophobicContact CG2-CG2 4.33Å
613	Y	90.8	Very high	90	Very high	19 Å²	19	73.2 Å²	73.2	8%	0.075	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	109.4	176.6	-71.4	-117.3	0	0	0	108.8	L519 R571 I574 V599 L600 L602	L519-Y613 HydrophobicContact CD1-CD1 3.85Å; L519-Y613 HydrophobicContact CD1-CG 4.27Å; L519-Y613 HydrophobicContact CD2-CD1 3.81Å; L519-Y613 HydrophobicContact CD2-CE1 4.18Å; R571-Y613 WeakPolarHBondContact CB-OH 3.36Å; R571-Y613 VanDerWaalsContact CD-OH 3.3Å; R571-Y613 WeakPolarHBondContact CD-OH 3.27Å; I574-Y613 HydrophobicContact CD1-CD2 4.36Å; I574-Y613 HydrophobicContact CD1-CE1 4.14Å; I574-Y613 HydrophobicContact CD1-CE2 3.99Å; V599-Y613 WeakPolarHBondContact CA-O 3.38Å; L600-Y613 PolarHBondContact N-O 2.84Å; L600-Y613 PolarHBondContact O-N 3.06Å; L602-Y613 HydrophobicContact CD1-CD2 3.43Å; L602-Y613 VanDerWaalsContact CD1-CD2 3.43Å; L602-Y613 HydrophobicContact CD1-CE2 3.64Å; L602-Y613 HydrophobicContact CD2-CD2 4.38Å; L602-Y613 HydrophobicContact CD2-CE2 3.69Å; L602-Y613 HydrophobicContact CG-CE2 4.32Å
614	T	92.1	Very high	90.1	Very high	30 Å²	30	74.4 Å²	74.4	18%	0.184	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	103.3	173	-57.6	0	0	0	0	108.9	N520 L594 V599	N520-T614 PolarHBondContact N-O 3.31Å; L594-T614 HydrophobicContact CD1-CG2 3.75Å; L594-T614 HydrophobicContact CD2-CG2 4.39Å; V599-T614 HydrophobicContact CG2-CG2 4.24Å
615	L	93	Very high	90.2	Very high	5 Å²	5	79.1 Å²	79.1	3%	0.026	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	139.3	-178.1	-58.5	168.7	0	0	0	109.5	L517 T518 L519 I528 A597 I598 L600	L517-L615 HydrophobicContact CD1-CB 4.35Å; L517-L615 HydrophobicContact CD1-CD1 4.17Å; L517-L615 HydrophobicContact CD1-CD2 4.3Å; T518-L615 CarbonylContact O-C 3.56Å; T518-L615 WeakPolarHBondContact O-CA 3.42Å; L519-L615 HydrophobicContact CB-CD2 4.29Å; L519-L615 HydrophobicContact CD1-CD2 4.02Å; I528-L615 HydrophobicContact CD1-CD2 3.66Å; A597-L615 CarbonylContact C-O 3.57Å; A597-L615 VanDerWaalsContact CA-O 3.23Å; A597-L615 WeakPolarHBondContact CA-O 3.24Å; I598-L615 HydrophobicContact CB-CB 4.48Å; I598-L615 PolarHBondContact N-O 3.4Å; I598-L615 PolarHBondContact O-N 2.86Å; L600-L615 HydrophobicContact CD1-CD1 3.66Å; L600-L615 HydrophobicContact CG-CD1 3.95Å
616	Q	91.4	Very high	90.6	Very high	31 Å²	31	69.7 Å²	69.7	15%	0.145	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	130.1	174.4	-63.3	-175.5	83	0	0	109.9	T518 N520 R595 A597	T518-Q616 PolarHBondContact N-O 2.96Å; T518-Q616 PolarHBondContact O-N 3.5Å; N520-Q616 PolarHBondContact ND2-NE2 3.28Å; N520-Q616 PolarHBondContact OD1-NE2 2.88Å; R595-Q616 WeakPolarHBondContact O-CB 3.31Å; R595-Q616 PolarHBondContact O-OE1 3.36Å; A597-Q616 HydrophobicContact CB-CG 4.18Å
617	A	92	Very high	90.8	Very high	8 Å²	8	61.3 Å²	61.3	7%	0.066	33%	0.326	C	S	.	.			trans	-95.3	157.7	175.8	0	0	0	0	0	112.1	L517 N596 N619 D622 K623	L517-A617 HydrophobicContact CD2-CB 3.9Å; N596-A617 HydrophobicContact CB-CB 4.42Å; N596-A617 PolarHBondContact ND2-O 2.89Å; N596-A617 PolarHBondContact O-N 3.08Å; A617-N619 VanDerWaalsContact C-N 3.26Å; A617-N619 PolarHBondContact O-N 3.47Å; A617-D622 HydrophobicContact CB-CB 4.45Å; A617-K623 HydrophobicContact CB-CB 3.89Å
618	A	89	Confident	91.2	Very high	92 Å²	92	57.3 Å²	57.3	76%	0.76	31%	0.307	S	S	*	.	S	Bend	trans	-61.2	-32.1	-178.2	0	0	0	0	0	113.6	N596	N596-A618 PolarHBondContact ND2-O 3.14Å
619	N	89.2	Confident	91.5	Very high	62 Å²	62	54.9 Å²	54.9	33%	0.332	30%	0.295	S	S	.	.	S	Bend	trans	-150.4	167.1	176.5	62.1	72.2	0	0	0	110.5	N596 A617 L621 D622 K623	N596-N619 VanDerWaalsContact ND2-CA 3.33Å; N596-N619 WeakPolarHBondContact ND2-CA 3.4Å; N596-N619 PolarHBondContact ND2-N 2.86Å; A617-N619 VanDerWaalsContact C-N 3.26Å; A617-N619 PolarHBondContact O-N 3.47Å; N619-L621 VanDerWaalsContact C-N 3.33Å; N619-L621 PolarHBondContact O-N 3.14Å; N619-L621 WeakPolarHBondContact OD1-CA 3.45Å; N619-L621 WeakPolarHBondContact OD1-CB 3.04Å; N619-L621 PolarHBondContact OD1-N 3.16Å; N619-D622 PolarHBondContact ND2-OD2 3.33Å; N619-D622 PolarHBondContact O-N 2.74Å; N619-D622 PolarHBondContact OD1-N 3.16Å; N619-D622 PolarHBondContact OD1-OD2 3.38Å; N619-K623 PolarHBondContact O-N 3.11Å; N619-K623 VanDerWaalsContact O-N 3.09Å
620	E	87.7	Confident	91.7	Very high	59 Å²	59	50 Å²	50	28%	0.276	27%	0.27	S	S	.	.	H	α-helix	trans	-66	-30	-179	-171.2	64.1	-156.9	0	0	113	K623 Q624	E620-K623 WeakPolarHBondContact O-CB 3.48Å; E620-K623 PolarHBondContact O-N 2.79Å; E620-K623 WeakPolarHBondContact OE1-CD 3.43Å; E620-K623 IonicContact OE1-NZ 3.73Å; E620-K623 PolarHBondContact OE1-NZ 3.05Å; E620-K623 WeakPolarHBondContact OE2-CD 3.28Å; E620-K623 IonicContact OE2-NZ 2.93Å; E620-K623 PolarHBondContact OE2-NZ 3.23Å; E620-Q624 HydrophobicContact CG-CG 4.38Å; E620-Q624 WeakPolarHBondContact O-CB 3.18Å; E620-Q624 VanDerWaalsContact O-CG 3.3Å; E620-Q624 WeakPolarHBondContact O-CG 3.46Å; E620-Q624 PolarHBondContact O-N 3.36Å; E620-Q624 PolarHBondContact OE1-NE2 3.17Å
621	L	91.6	Very high	91.9	Very high	127 Å²	127	51.8 Å²	51.8	67%	0.665	27%	0.267	S	S	*	.	H	α-helix	trans	-66.5	-42.1	177.8	-61.1	175.3	0	0	0	111.2	N619 Q624 R625	N619-L621 VanDerWaalsContact C-N 3.33Å; N619-L621 PolarHBondContact O-N 3.14Å; N619-L621 WeakPolarHBondContact OD1-CA 3.45Å; N619-L621 WeakPolarHBondContact OD1-CB 3.04Å; N619-L621 PolarHBondContact OD1-N 3.16Å; L621-Q624 PolarHBondContact O-N 3.1Å; L621-R625 WeakPolarHBondContact O-CB 3.47Å; L621-R625 WeakPolarHBondContact O-CD 3.4Å; L621-R625 VanDerWaalsContact O-CG 3.25Å; L621-R625 WeakPolarHBondContact O-CG 3.42Å; L621-R625 PolarHBondContact O-N 2.97Å
622	D	91.6	Very high	92.3	Very high	42 Å²	42	54.5 Å²	54.5	23%	0.225	28%	0.276	C	S	.	.	H	α-helix	trans	-71.2	-35.2	176.1	-67.5	-33.9	0	0	0	111.9	A617 N619 R625 W626	A617-D622 HydrophobicContact CB-CB 4.45Å; N619-D622 PolarHBondContact ND2-OD2 3.33Å; N619-D622 PolarHBondContact O-N 2.74Å; N619-D622 PolarHBondContact OD1-N 3.16Å; N619-D622 PolarHBondContact OD1-OD2 3.38Å; D622-R625 PolarHBondContact O-N 3Å; D622-R625 WeakPolarHBondContact OD1-CD 3.44Å; D622-R625 IonicContact OD1-CZ 3.56Å; D622-R625 IonicContact OD1-NE 3.68Å; D622-R625 IonicContact OD1-NH1 3.81Å; D622-R625 PolarHBondContact OD1-NH1 3.4Å; D622-W626 WeakPolarHBondContact O-CB 3.18Å; D622-W626 PolarHBondContact O-N 3.43Å
623	K	92.5	Very high	92.4	Very high	3 Å²	3	50.7 Å²	50.7	1%	0.013	25%	0.253	C	S	.	.	H	α-helix	trans	-57.3	-50	168.9	-177.9	-144	-171.8	-164.1	0	111.3	D583 L584 N596 A597 I598 A617 N619 E620 W626 I627	D583-K623 WeakPolarHBondContact OD1-CE 3.21Å; D583-K623 IonicContact OD1-NZ 2.68Å; D583-K623 PolarHBondContact OD1-NZ 3.24Å; L584-K623 PolarHBondContact O-NZ 2.87Å; N596-K623 HydrophobicContact CB-CB 4.09Å; N596-K623 HydrophobicContact CB-CD 4.38Å; N596-K623 HydrophobicContact CB-CG 4.5Å; N596-K623 WeakPolarHBondContact O-CG 3.34Å; A597-K623 WeakPolarHBondContact O-CE 3.11Å; I598-K623 HydrophobicContact CD1-CG 3.95Å; I598-K623 HydrophobicContact CG1-CG 3.56Å; A617-K623 HydrophobicContact CB-CB 3.89Å; N619-K623 PolarHBondContact O-N 3.11Å; N619-K623 VanDerWaalsContact O-N 3.09Å; E620-K623 WeakPolarHBondContact O-CB 3.48Å; E620-K623 PolarHBondContact O-N 2.79Å; E620-K623 WeakPolarHBondContact OE1-CD 3.43Å; E620-K623 IonicContact OE1-NZ 3.73Å; E620-K623 PolarHBondContact OE1-NZ 3.05Å; E620-K623 WeakPolarHBondContact OE2-CD 3.28Å; E620-K623 IonicContact OE2-NZ 2.93Å; E620-K623 PolarHBondContact OE2-NZ 3.23Å; K623-W626 PolarHBondContact O-N 2.91Å; K623-I627 HydrophobicContact CD-CD1 4.23Å; K623-I627 HydrophobicContact CG-CD1 4Å; K623-I627 WeakPolarHBondContact O-CG1 3.46Å; K623-I627 PolarHBondContact O-N 2.95Å
624	Q	93.3	Very high	92.5	Very high	74 Å²	74	51.4 Å²	51.4	35%	0.346	26%	0.257	S	S	.	.	H	α-helix	trans	-66.3	-37.8	-180	-67.7	-61	-26.1	0	0	111.9	D583 E620 L621 I627 E628	D583-Q624 PolarHBondContact OD2-NE2 3.27Å; E620-Q624 HydrophobicContact CG-CG 4.38Å; E620-Q624 WeakPolarHBondContact O-CB 3.18Å; E620-Q624 VanDerWaalsContact O-CG 3.3Å; E620-Q624 WeakPolarHBondContact O-CG 3.46Å; E620-Q624 PolarHBondContact O-N 3.36Å; E620-Q624 PolarHBondContact OE1-NE2 3.17Å; L621-Q624 PolarHBondContact O-N 3.1Å; Q624-I627 PolarHBondContact O-N 3.12Å; Q624-E628 WeakPolarHBondContact O-CB 3.48Å; Q624-E628 PolarHBondContact O-N 3.31Å
625	R	93.6	Very high	92.5	Very high	134 Å²	134	55.3 Å²	55.3	51%	0.506	27%	0.273	S	S	.	.	H	α-helix	trans	-58.2	-46.2	169.1	-74.6	161.9	168.6	176.1	-5.2	112.1	L621 D622 E628 K629	L621-R625 WeakPolarHBondContact O-CB 3.47Å; L621-R625 WeakPolarHBondContact O-CD 3.4Å; L621-R625 VanDerWaalsContact O-CG 3.25Å; L621-R625 WeakPolarHBondContact O-CG 3.42Å; L621-R625 PolarHBondContact O-N 2.97Å; D622-R625 PolarHBondContact O-N 3Å; D622-R625 WeakPolarHBondContact OD1-CD 3.44Å; D622-R625 IonicContact OD1-CZ 3.56Å; D622-R625 IonicContact OD1-NE 3.68Å; D622-R625 IonicContact OD1-NH1 3.81Å; D622-R625 PolarHBondContact OD1-NH1 3.4Å; R625-E628 PolarHBondContact O-N 3.38Å; R625-K629 WeakPolarHBondContact O-CB 3.46Å; R625-K629 VanDerWaalsContact O-CG 3.31Å; R625-K629 WeakPolarHBondContact O-CG 3.45Å; R625-K629 PolarHBondContact O-N 3.29Å
626	W	94.4	Very high	92.5	Very high	8 Å²	8	57.7 Å²	57.7	3%	0.03	29%	0.294	C	S	.	.	H	α-helix	trans	-61.3	-45.2	176.2	-88.9	105.2	0	0	0	111.7	H513 L517 A530 L532 L537 I598 D622 K623 K629 L630	H513-W626 AromaticContact CD2-CD2 3.62Å; H513-W626 AromaticContact CD2-CE2 3.58Å; H513-W626 AromaticContact CD2-CE3 3.88Å; H513-W626 AromaticContact CD2-CZ2 3.82Å; H513-W626 AromaticContact NE2-CE2 3.77Å; H513-W626 AromaticContact NE2-NE1 3.75Å; L517-W626 HydrophobicContact CD1-CD2 4.21Å; L517-W626 HydrophobicContact CD1-CZ2 4.24Å; L517-W626 HydrophobicContact CD2-CG 4.49Å; A530-W626 HydrophobicContact CB-CH2 3.6Å; A530-W626 HydrophobicContact CB-CZ2 4.04Å; A530-W626 HydrophobicContact CB-CZ3 4.28Å; L532-W626 HydrophobicContact CB-CZ3 4.06Å; L537-W626 HydrophobicContact CD1-CZ3 4.2Å; I598-W626 HydrophobicContact CD1-CB 3.62Å; D622-W626 WeakPolarHBondContact O-CB 3.18Å; D622-W626 PolarHBondContact O-N 3.43Å; K623-W626 PolarHBondContact O-N 2.91Å; W626-K629 PolarHBondContact O-N 3.05Å; W626-L630 HydrophobicContact CE3-CD1 4.27Å; W626-L630 HydrophobicContact CE3-CG 4.3Å; W626-L630 WeakPolarHBondContact O-CB 3.05Å; W626-L630 WeakPolarHBondContact O-CD1 3.38Å; W626-L630 WeakPolarHBondContact O-CG 3.29Å; W626-L630 PolarHBondContact O-N 3.31Å
627	I	93.4	Very high	92.5	Very high	1 Å²	1	57.6 Å²	57.6	1%	0.005	29%	0.293	C	S	.	.	H	α-helix	trans	-61.1	-46.4	176.4	-67.2	163.4	0	0	0	111.1	D583 I598 K623 Q624 R631	D583-I627 HydrophobicContact CB-CD1 3.9Å; D583-I627 VanDerWaalsContact CG-CD1 3.44Å; D583-I627 WeakPolarHBondContact OD1-CD1 3.42Å; I598-I627 HydrophobicContact CD1-CD1 4.46Å; I598-I627 HydrophobicContact CD1-CG1 3.87Å; I598-I627 HydrophobicContact CG1-CD1 4.17Å; I598-I627 HydrophobicContact CG1-CG1 3.99Å; I598-I627 HydrophobicContact CG2-CG1 4.2Å; K623-I627 HydrophobicContact CD-CD1 4.23Å; K623-I627 HydrophobicContact CG-CD1 4Å; K623-I627 WeakPolarHBondContact O-CG1 3.46Å; K623-I627 PolarHBondContact O-N 2.95Å; Q624-I627 PolarHBondContact O-N 3.12Å; I627-R631 HydrophobicContact CG2-CG 4.46Å; I627-R631 VanDerWaalsContact CG2-CZ 3.41Å; I627-R631 WeakPolarHBondContact O-CB 3.49Å; I627-R631 WeakPolarHBondContact O-CG 2.97Å; I627-R631 PolarHBondContact O-N 2.96Å
628	E	94.8	Very high	92.4	Very high	88 Å²	88	61.3 Å²	61.3	41%	0.411	31%	0.309	S	S	.	.	H	α-helix	trans	-60	-51.8	177.7	-171.3	-135.3	115.1	0	0	111.2	Q624 R625 L630 R631 N632	Q624-E628 WeakPolarHBondContact O-CB 3.48Å; Q624-E628 PolarHBondContact O-N 3.31Å; R625-E628 PolarHBondContact O-N 3.38Å; E628-L630 PolarHBondContact O-N 2.87Å; E628-R631 PolarHBondContact O-N 3.44Å; E628-N632 VanDerWaalsContact O-CB 3.26Å; E628-N632 WeakPolarHBondContact O-CB 3.35Å; E628-N632 PolarHBondContact O-N 3.38Å; E628-N632 PolarHBondContact O-ND2 2.8Å; E628-N632 PolarHBondContact OE1-ND2 3.48Å
629	K	94.2	Very high	92.4	Very high	77 Å²	77	60 Å²	60	34%	0.335	29%	0.287	S	S	.	.	H	α-helix	trans	-65.2	-40.4	179.8	-64.6	-59	176.3	-136.2	0	112.4	H513 L532 R625 W626 S633	H513-K629 HydrophobicContact CB-CB 4.19Å; H513-K629 HydrophobicContact CB-CG 4.17Å; L532-K629 HydrophobicContact CD2-CB 3.93Å; R625-K629 WeakPolarHBondContact O-CB 3.46Å; R625-K629 VanDerWaalsContact O-CG 3.31Å; R625-K629 WeakPolarHBondContact O-CG 3.45Å; R625-K629 PolarHBondContact O-N 3.29Å; W626-K629 PolarHBondContact O-N 3.05Å; K629-S633 VanDerWaalsContact O-CB 3.23Å; K629-S633 WeakPolarHBondContact O-CB 3.43Å; K629-S633 PolarHBondContact O-N 2.62Å; K629-S633 PolarHBondContact O-OG 2.99Å; K629-S633 VanDerWaalsContact O-OG 3.11Å
630	L	94.4	Very high	92.4	Very high	1 Å²	1	61.3 Å²	61.3	1%	0.005	29%	0.29	C	S	.	.	H	α-helix	trans	-62.7	-50.2	175.7	-73.2	166.2	0	0	0	111.1	L532 L537 F579 I581 L600 W626 E628 N632 S633 Q634	L532-L630 HydrophobicContact CD1-CD2 3.8Å; L532-L630 HydrophobicContact CD2-CD2 3.98Å; L532-L630 HydrophobicContact CD2-CG 4.27Å; L532-L630 HydrophobicContact CG-CD2 4.47Å; L537-L630 HydrophobicContact CD1-CD2 4.44Å; L537-L630 HydrophobicContact CD2-CD2 4.29Å; F579-L630 HydrophobicContact CE2-CD2 4.24Å; F579-L630 HydrophobicContact CZ-CD2 4.02Å; I581-L630 HydrophobicContact CD1-CB 3.61Å; I581-L630 HydrophobicContact CG1-CB 4.41Å; L600-L630 HydrophobicContact CD2-CD1 4.35Å; W626-L630 HydrophobicContact CE3-CD1 4.27Å; W626-L630 HydrophobicContact CE3-CG 4.3Å; W626-L630 WeakPolarHBondContact O-CB 3.05Å; W626-L630 WeakPolarHBondContact O-CD1 3.38Å; W626-L630 WeakPolarHBondContact O-CG 3.29Å; W626-L630 PolarHBondContact O-N 3.31Å; E628-L630 PolarHBondContact O-N 2.87Å; L630-N632 PolarHBondContact O-N 3Å; L630-S633 PolarHBondContact O-N 3.1Å; L630-S633 PolarHBondContact O-OG 3.49Å; L630-Q634 WeakPolarHBondContact O-CB 3.38Å; L630-Q634 PolarHBondContact O-N 2.68Å
631	R	94.2	Very high	92.3	Very high	118 Å²	118	61.3 Å²	61.3	45%	0.445	29%	0.292	S	S	.	.	H	α-helix	trans	-60.1	-47.2	177.4	-73.6	177	178.4	159.5	3.7	112.1	I581 I627 E628 S633 Q634 Q635	I581-R631 HydrophobicContact CD1-CG 3.79Å; I627-R631 HydrophobicContact CG2-CG 4.46Å; I627-R631 VanDerWaalsContact CG2-CZ 3.41Å; I627-R631 WeakPolarHBondContact O-CB 3.49Å; I627-R631 WeakPolarHBondContact O-CG 2.97Å; I627-R631 PolarHBondContact O-N 2.96Å; E628-R631 PolarHBondContact O-N 3.44Å; R631-S633 PolarHBondContact O-N 3.02Å; R631-Q634 PolarHBondContact O-N 2.76Å; R631-Q635 PolarHBondContact O-N 3.07Å
632	N	94.8	Very high	92.1	Very high	82 Å²	82	60.8 Å²	60.8	44%	0.439	28%	0.284	S	S	.	.	H	α-helix	trans	-64	-41.3	179.6	-69.5	-12.2	0	0	0	111.9	E628 L630 A636	E628-N632 VanDerWaalsContact O-CB 3.26Å; E628-N632 WeakPolarHBondContact O-CB 3.35Å; E628-N632 PolarHBondContact O-N 3.38Å; E628-N632 PolarHBondContact O-ND2 2.8Å; E628-N632 PolarHBondContact OE1-ND2 3.48Å; L630-N632 PolarHBondContact O-N 3Å; N632-A636 WeakPolarHBondContact O-CB 3.44Å; N632-A636 PolarHBondContact O-N 3.03Å
633	S	93.1	Very high	91.8	Very high	4 Å²	4	67.2 Å²	67.2	3%	0.028	31%	0.305	C	S	.	.	H	α-helix	trans	-64.7	-41.2	175	71.3	0	0	0	0	112.2	K629 L630 R631 A636 F637	K629-S633 VanDerWaalsContact O-CB 3.23Å; K629-S633 WeakPolarHBondContact O-CB 3.43Å; K629-S633 PolarHBondContact O-N 2.62Å; K629-S633 PolarHBondContact O-OG 2.99Å; K629-S633 VanDerWaalsContact O-OG 3.11Å; L630-S633 PolarHBondContact O-N 3.1Å; L630-S633 PolarHBondContact O-OG 3.49Å; R631-S633 PolarHBondContact O-N 3.02Å; S633-A636 PolarHBondContact O-N 3.41Å; S633-F637 VanDerWaalsContact O-CB 3.28Å; S633-F637 WeakPolarHBondContact O-CB 3.43Å; S633-F637 PolarHBondContact O-N 3.36Å
634	Q	92.9	Very high	91.4	Very high	34 Å²	34	74 Å²	74	16%	0.159	33%	0.334	C	S	.	.	H	α-helix	trans	-65	-43.6	178.1	177.4	167.8	71.8	0	0	111.7	L576 F579 L630 R631 F637 Q638	L576-Q634 WeakPolarHBondContact O-CG 3.44Å; L576-Q634 PolarHBondContact O-NE2 2.94Å; F579-Q634 PolarHBondContact O-NE2 3.34Å; L630-Q634 WeakPolarHBondContact O-CB 3.38Å; L630-Q634 PolarHBondContact O-N 2.68Å; R631-Q634 PolarHBondContact O-N 2.76Å; Q634-F637 PolarHBondContact O-N 3.45Å; Q634-Q638 WeakPolarHBondContact O-CB 3.1Å; Q634-Q638 VanDerWaalsContact O-CG 3.31Å; Q634-Q638 WeakPolarHBondContact O-CG 3.44Å; Q634-Q638 PolarHBondContact O-N 2.99Å
635	Q	92.7	Very high	90.7	Very high	111 Å²	111	76.8 Å²	76.8	52%	0.519	35%	0.351	S	S	.	.	H	α-helix	trans	-62	-50.4	173.1	-179	-177.8	-27.7	0	0	111.2	R631 F637 Q638 E639	R631-Q635 PolarHBondContact O-N 3.07Å; Q635-F637 VanDerWaalsContact C-N 3.27Å; Q635-F637 PolarHBondContact O-N 2.7Å; Q635-Q638 PolarHBondContact O-N 3.21Å; Q635-Q638 VanDerWaalsContact O-N 3.12Å; Q635-E639 PolarHBondContact NE2-OE1 3.34Å; Q635-E639 PolarHBondContact O-N 3Å
636	A	92.4	Very high	89.5	Confident	56 Å²	56	78.6 Å²	78.6	46%	0.463	36%	0.359	S	S	.	.	H	α-helix	trans	-59.3	-38.4	-179.7	0	0	0	0	0	112	N632 S633 E639 K640	N632-A636 WeakPolarHBondContact O-CB 3.44Å; N632-A636 PolarHBondContact O-N 3.03Å; S633-A636 PolarHBondContact O-N 3.41Å; A636-E639 PolarHBondContact O-N 3.42Å; A636-K640 WeakPolarHBondContact O-CB 3.09Å; A636-K640 PolarHBondContact O-N 3.41Å
637	F	90.6	Very high	87.6	Confident	29 Å²	29	80.9 Å²	80.9	13%	0.127	39%	0.385	C	S	.	.	H	α-helix	trans	-67.6	-42.5	174.5	-173.9	-112	0	0	0	112.5	D534 D535 L576 D577 S633 Q634 Q635 E639 K640 L641	D534-F637 WeakPolarHBondContact O-CD2 3.42Å; D535-F637 HydrophobicContact CB-CD2 3.87Å; D535-F637 HydrophobicContact CB-CE2 3.44Å; D535-F637 VanDerWaalsContact CB-CE2 3.44Å; D535-F637 HydrophobicContact CB-CZ 4.24Å; L576-F637 HydrophobicContact CB-CB 4.15Å; L576-F637 HydrophobicContact CB-CD1 3.77Å; L576-F637 HydrophobicContact CB-CE1 4.4Å; L576-F637 HydrophobicContact CB-CG 4.06Å; L576-F637 HydrophobicContact CD1-CB 3.95Å; L576-F637 HydrophobicContact CD1-CG 4.28Å; D577-F637 HydrophobicContact CB-CD1 4.24Å; D577-F637 HydrophobicContact CB-CE1 3.92Å; S633-F637 VanDerWaalsContact O-CB 3.28Å; S633-F637 WeakPolarHBondContact O-CB 3.43Å; S633-F637 PolarHBondContact O-N 3.36Å; Q634-F637 PolarHBondContact O-N 3.45Å; Q635-F637 VanDerWaalsContact C-N 3.27Å; Q635-F637 PolarHBondContact O-N 2.7Å; F637-E639 PolarHBondContact O-N 2.84Å; F637-K640 WeakPolarHBondContact O-CB 3.28Å; F637-K640 PolarHBondContact O-N 3.11Å; F637-L641 HydrophobicContact CD1-CD1 3.92Å; F637-L641 HydrophobicContact CD1-CG 4.47Å; F637-L641 HydrophobicContact CE1-CD1 3.59Å; F637-L641 HydrophobicContact CE1-CG 4.22Å; F637-L641 HydrophobicContact CZ-CD1 4.07Å; F637-L641 HydrophobicContact CZ-CD2 4.41Å; F637-L641 HydrophobicContact CZ-CG 4.29Å; F637-L641 WeakPolarHBondContact O-CG 3.28Å; F637-L641 PolarHBondContact O-N 3.16Å
638	Q	90.4	Very high	85.5	Confident	86 Å²	86	88.1 Å²	88.1	40%	0.402	42%	0.422	S	S	.	.	H	α-helix	trans	-62.5	-40.5	173.7	-73.9	179.1	21.5	0	0	112.2	Q634 Q635 L641 K642	Q634-Q638 WeakPolarHBondContact O-CB 3.1Å; Q634-Q638 VanDerWaalsContact O-CG 3.31Å; Q634-Q638 WeakPolarHBondContact O-CG 3.44Å; Q634-Q638 PolarHBondContact O-N 2.99Å; Q635-Q638 PolarHBondContact O-N 3.21Å; Q635-Q638 VanDerWaalsContact O-N 3.12Å; Q638-L641 PolarHBondContact O-N 3.28Å; Q638-K642 VanDerWaalsContact O-CG 3.31Å; Q638-K642 WeakPolarHBondContact O-CG 3.16Å; Q638-K642 PolarHBondContact O-N 2.83Å
639	E	89.8	Confident	82.8	Confident	65 Å²	65	90.5 Å²	90.5	30%	0.304	44%	0.438	S	S	.	.	H	α-helix	trans	-64.2	-42.3	172.6	-74.2	-175.6	-143.2	0	0	112	Q635 A636 F637 L641 K642 R643	Q635-E639 PolarHBondContact NE2-OE1 3.34Å; Q635-E639 PolarHBondContact O-N 3Å; A636-E639 PolarHBondContact O-N 3.42Å; F637-E639 PolarHBondContact O-N 2.84Å; E639-L641 VanDerWaalsContact C-N 3.28Å; E639-L641 PolarHBondContact O-N 3.11Å; E639-K642 PolarHBondContact O-N 2.91Å; E639-R643 WeakPolarHBondContact O-CB 3.38Å; E639-R643 VanDerWaalsContact O-CG 3.28Å; E639-R643 WeakPolarHBondContact O-CG 3.24Å; E639-R643 PolarHBondContact O-N 3Å; E639-R643 IonicContact OE2-CZ 3.01Å; E639-R643 IonicContact OE2-NH2 3.4Å; E639-R643 PolarHBondContact OE2-NH2 3.33Å
640	K	87.8	Confident	80.2	Confident	88 Å²	88	94.8 Å²	94.8	38%	0.383	46%	0.461	S	S	.	.	H	α-helix	trans	-62.2	-34.3	175.8	-170.6	173	-174.5	168.4	0	112	D534 A636 F637 K644	D534-K640 IonicContact OD2-NZ 3.76Å; D534-K640 PolarHBondContact OD2-NZ 3.01Å; A636-K640 WeakPolarHBondContact O-CB 3.09Å; A636-K640 PolarHBondContact O-N 3.41Å; F637-K640 WeakPolarHBondContact O-CB 3.28Å; F637-K640 PolarHBondContact O-N 3.11Å; K640-K644 WeakPolarHBondContact O-CG 3.5Å; K640-K644 PolarHBondContact O-N 2.96Å
641	L	86	Confident	77.1	Confident	60 Å²	60	102 Å²	102	31%	0.314	50%	0.5	S	S	.	.	H	α-helix	trans	-71.5	-47.1	170.7	-72.9	174.6	0	0	0	112.2	D577 F637 Q638 E639 R643 K644 L645	D577-L641 HydrophobicContact CB-CD1 4.44Å; F637-L641 HydrophobicContact CD1-CD1 3.92Å; F637-L641 HydrophobicContact CD1-CG 4.47Å; F637-L641 HydrophobicContact CE1-CD1 3.59Å; F637-L641 HydrophobicContact CE1-CG 4.22Å; F637-L641 HydrophobicContact CZ-CD1 4.07Å; F637-L641 HydrophobicContact CZ-CD2 4.41Å; F637-L641 HydrophobicContact CZ-CG 4.29Å; F637-L641 WeakPolarHBondContact O-CG 3.28Å; F637-L641 PolarHBondContact O-N 3.16Å; Q638-L641 PolarHBondContact O-N 3.28Å; E639-L641 VanDerWaalsContact C-N 3.28Å; E639-L641 PolarHBondContact O-N 3.11Å; L641-R643 PolarHBondContact O-N 3.03Å; L641-K644 WeakPolarHBondContact O-CB 3.27Å; L641-K644 PolarHBondContact O-N 2.86Å; L641-K644 VanDerWaalsContact O-N 3.1Å; L641-L645 WeakPolarHBondContact O-CG 3.21Å; L641-L645 PolarHBondContact O-N 2.99Å
642	K	86.9	Confident	74.1	Confident	116 Å²	116	104.9 Å²	104.9	50%	0.504	52%	0.518	S	S	.	.	H	α-helix	trans	-56	-48.2	175.6	-74	170	-177.5	176.7	0	111.3	Q638 E639 K644 L645 Y646	Q638-K642 VanDerWaalsContact O-CG 3.31Å; Q638-K642 WeakPolarHBondContact O-CG 3.16Å; Q638-K642 PolarHBondContact O-N 2.83Å; E639-K642 PolarHBondContact O-N 2.91Å; K642-K644 VanDerWaalsContact C-N 3.26Å; K642-K644 PolarHBondContact O-N 3.22Å; K642-L645 PolarHBondContact O-N 2.94Å; K642-Y646 HydrophobicContact CB-CD2 4.29Å; K642-Y646 HydrophobicContact CB-CE2 4.25Å; K642-Y646 HydrophobicContact CG-CE2 4.49Å; K642-Y646 WeakPolarHBondContact O-CD2 3.47Å; K642-Y646 PolarHBondContact O-N 3.32Å
643	R	85.2	Confident	71.2	Confident	176 Å²	176	109.6 Å²	109.6	66%	0.664	54%	0.537	S	S	*	.	H	α-helix	trans	-61.1	-31.4	177.2	-67.1	176.5	-150.1	-165.2	8.2	112.7	E639 L641 G647	E639-R643 WeakPolarHBondContact O-CB 3.38Å; E639-R643 VanDerWaalsContact O-CG 3.28Å; E639-R643 WeakPolarHBondContact O-CG 3.24Å; E639-R643 PolarHBondContact O-N 3Å; E639-R643 IonicContact OE2-CZ 3.01Å; E639-R643 IonicContact OE2-NH2 3.4Å; E639-R643 PolarHBondContact OE2-NH2 3.33Å; L641-R643 PolarHBondContact O-N 3.03Å; R643-G647 VanDerWaalsContact O-CA 3.25Å; R643-G647 WeakPolarHBondContact O-CA 3.36Å; R643-G647 PolarHBondContact O-N 3.5Å
644	K	84.2	Confident	68.2	Low	146 Å²	146	116.6 Å²	116.6	64%	0.635	58%	0.58	S	S	*	*	H	α-helix	trans	-76.2	-30.1	172.6	-76.6	178.2	175.4	-174	0	114	K640 L641 K642	K640-K644 WeakPolarHBondContact O-CG 3.5Å; K640-K644 PolarHBondContact O-N 2.96Å; L641-K644 WeakPolarHBondContact O-CB 3.27Å; L641-K644 PolarHBondContact O-N 2.86Å; L641-K644 VanDerWaalsContact O-N 3.1Å; K642-K644 VanDerWaalsContact C-N 3.26Å; K642-K644 PolarHBondContact O-N 3.22Å
645	L	79.5	Confident	65.4	Low	133 Å²	133	120.7 Å²	120.7	70%	0.696	60%	0.603	S	S	*	*	H	α-helix	trans	-76.9	-42.1	178.3	-75.9	161.2	0	0	0	111.9	L641 K642	L641-L645 WeakPolarHBondContact O-CG 3.21Å; L641-L645 PolarHBondContact O-N 2.99Å; K642-L645 PolarHBondContact O-N 2.94Å
646	Y	68	Low	62.4	Low	172 Å²	172	125.1 Å²	125.1	68%	0.675	62%	0.621	S	S	*	*	H	α-helix	trans	-85.5	-19.8	176.6	-60	-64.7	0	0	0	113.2	K642 I648 D649	K642-Y646 HydrophobicContact CB-CD2 4.29Å; K642-Y646 HydrophobicContact CB-CE2 4.25Å; K642-Y646 HydrophobicContact CG-CE2 4.49Å; K642-Y646 WeakPolarHBondContact O-CD2 3.47Å; K642-Y646 PolarHBondContact O-N 3.32Å; Y646-I648 PolarHBondContact O-N 2.84Å; Y646-D649 PolarHBondContact O-N 3.48Å
647	G	53.8	Low	59.4	Low	56 Å²	56	130.6 Å²	130.6	58%	0.577	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.9	27.4	-179.9	0	0	0	0	0	115.8	R643	R643-G647 VanDerWaalsContact O-CA 3.25Å; R643-G647 WeakPolarHBondContact O-CA 3.36Å; R643-G647 PolarHBondContact O-N 3.5Å
648	I	49.5	Very low	56.5	Low	152 Å²	152	135 Å²	135	78%	0.779	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.3	-14.9	168.3	-69.4	177.6	0	0	0	110.7	Y646	Y646-I648 PolarHBondContact O-N 2.84Å
649	D	38.5	Very low	53.5	Low	139 Å²	139	140.4 Å²	140.4	74%	0.743	69%	0.693	S	S	*	*	S	Bend	trans	-128.1	26.4	-163.4	-141.3	8.3	0	0	0	113.6	Y646	Y646-D649 PolarHBondContact O-N 3.48Å
650	M	39.6	Very low	50.6	Low	167 Å²	167	145 Å²	145	82%	0.823	72%	0.719	S	S	*	*	S	Bend	trans	-130	15.3	-178.8	-77.1	-69.2	143.6	0	0	114.6
651	D	30	Very low	47.9	Very low	153 Å²	153	148 Å²	148	82%	0.818	74%	0.737	S	S	*	*	S	Bend	trans	-125.2	31.7	176.5	-91.3	-51.5	0	0	0	112.5
652	Q	29.9	Very low	45.2	Very low	178 Å²	178	152.9 Å²	152.9	83%	0.832	76%	0.764	S	S	*	*			trans	-161.4	45.8	174	-130	158.8	111.9	0	0	119.4
653	H	33.9	Very low	42.4	Very low	180 Å²	180	151.7 Å²	151.7	83%	0.833	78%	0.776	S	S	*	*			trans	-138.9	58.4	166.4	-95.8	-4.9	0	0	0	116.1	N655	H653-N655 PolarHBondContact O-N 3.32Å
654	T	30.8	Very low	40	Very low	152 Å²	152	152.8 Å²	152.8	93%	0.933	79%	0.785	S	S	*	*			trans	-69.7	80.9	146.5	51.1	0	0	0	0	109.6
655	N	33	Very low	37.5	Very low	119 Å²	119	153.8 Å²	153.8	64%	0.636	80%	0.797	S	S	*	*			trans	-138.7	125.4	173.8	-149.7	-16.7	0	0	0	113.8	H653 H657	H653-N655 PolarHBondContact O-N 3.32Å; N655-H657 PolarHBondContact O-N 3.29Å; N655-H657 VanDerWaalsContact O-N 3.13Å
656	K	31.2	Very low	35.3	Very low	205 Å²	205	156.2 Å²	156.2	89%	0.891	80%	0.802	S	S	*	*			trans	-88.6	61.8	-168.4	-63.5	174.9	179.8	173.4	0	111.7
657	H	28.5	Very low	33.3	Very low	170 Å²	170	155.6 Å²	155.6	79%	0.787	81%	0.81	S	S	*	*			trans	-140.8	7.2	-176.3	-123.4	-72.1	0	0	0	119.5	N655 K659	N655-H657 PolarHBondContact O-N 3.29Å; N655-H657 VanDerWaalsContact O-N 3.13Å; H657-K659 VanDerWaalsContact C-N 3.31Å; H657-K659 PolarHBondContact O-N 3.19Å
658	S	30.3	Very low	32.2	Very low	122 Å²	122	158.1 Å²	158.1	85%	0.853	82%	0.818	S	S	*	*			trans	-89.9	50.9	173.1	44.1	0	0	0	0	113.5
659	K	28.1	Very low	31.1	Very low	199 Å²	199	155.3 Å²	155.3	87%	0.865	81%	0.812	S	S	*	*			trans	-113.4	61	170.9	-91.2	-165.1	176.5	-176.3	0	112.1	H657	H657-K659 VanDerWaalsContact C-N 3.31Å; H657-K659 PolarHBondContact O-N 3.19Å
660	L	28.7	Very low	30.5	Very low	162 Å²	162	157.2 Å²	157.2	85%	0.848	82%	0.817	S	S	*	*	S	Bend	trans	-165.3	167.2	155.5	-132.4	67.2	0	0	0	109.9
661	I	30.2	Very low	30	Very low	150 Å²	150	155.4 Å²	155.4	77%	0.769	82%	0.815	S	S	*	*	S	Bend	trans	62.3	62.4	178.1	-38	178.8	0	0	0	114.8
662	N	29.3	Very low	29.7	Very low	164 Å²	164	153.1 Å²	153.1	88%	0.877	81%	0.811	S	S	*	*				-167.8	96.2	120.3	-102.9	-18.9	0	0	0	111.1
663	A	29	Very low	29.7	Very low	91 Å²	91	152.8 Å²	152.8	75%	0.752	81%	0.813	S	S	*	*			trans	-135.6	141.7	169.9	0	0	0	0	0	108.6
664	K	33.8	Very low	29.2	Very low	198 Å²	198	147.9 Å²	147.9	86%	0.861	80%	0.804	S	S	*	*			trans	71.8	104.8	-164.8	-48.9	174.1	-179	178.5	0	111.4
665	N	32.2	Very low	28.9	Very low	167 Å²	167	148 Å²	148	89%	0.893	80%	0.799	S	S	*	*			cis	-138.5	-178.8	49.8	-80.4	-29.1	0	0	0	114.3
666	K	32.6	Very low	28.8	Very low	184 Å²	184	150 Å²	150	80%	0.8	81%	0.81	S	S	*	*			trans	-146.8	133.9	-154.6	175.3	-174	178.4	-174.1	0	111.7
667	L	27.2	Very low	28.7	Very low	160 Å²	160	150.6 Å²	150.6	84%	0.838	81%	0.808	S	S	*	*			trans	65.5	159.7	174.5	-100.9	59	0	0	0	114.9
668	S	30.2	Very low	28.6	Very low	108 Å²	108	150 Å²	150	76%	0.755	81%	0.81	S	S	*	*			cis	-144.5	169.2	4.3	46.2	0	0	0	0	114
669	S	26.3	Very low	28.4	Very low	93 Å²	93	149.4 Å²	149.4	65%	0.65	81%	0.805	S	S	*	*			trans	-61.2	155.3	-175.7	49.8	0	0	0	0	119.9
670	Q	26.4	Very low	28.6	Very low	180 Å²	180	147 Å²	147	84%	0.841	81%	0.807	S	S	*	*			trans	69.7	150.1	154.5	-68.7	168.2	6	0	0	116.4
671	T	29.1	Very low	28.6	Very low	129 Å²	129	144.3 Å²	144.3	79%	0.791	80%	0.803	S	S	*	*			cis	-153	154.7	10.9	-14.8	0	0	0	0	112.7
672	S	22.6	Very low	28.4	Very low	105 Å²	105	145.2 Å²	145.2	73%	0.734	81%	0.808	S	S	*	*			trans	17.2	124.2	148	-179.5	0	0	0	0	122
673	I	29.9	Very low	28.5	Very low	170 Å²	170	142.9 Å²	142.9	87%	0.872	81%	0.805	S	S	*	*				-172	164.5	120.7	-97	158.3	0	0	0	109.2
674	A	24.6	Very low	28.3	Very low	77 Å²	77	146.4 Å²	146.4	64%	0.636	81%	0.81	S	S	*	*			trans	-103.9	179.7	-173.8	0	0	0	0	0	113.9
675	D	24.5	Very low	28	Very low	155 Å²	155	140.4 Å²	140.4	83%	0.829	80%	0.804	S	S	*	*			trans	63.3	111	168.7	-56.2	-27.4	0	0	0	118.6
676	D	30.5	Very low	28	Very low	161 Å²	161	139.6 Å²	139.6	86%	0.861	80%	0.798	S	S	*	*				-154.8	170	124.9	-139	-27.1	0	0	0	112.7
677	Y	29.5	Very low	27.9	Very low	217 Å²	217	140.1 Å²	140.1	85%	0.851	80%	0.8	S	S	*	*			trans	-90.1	162	-156.1	-93.9	-111.1	0	0	0	117.8
678	L	26.2	Very low	27.9	Very low	158 Å²	158	138.7 Å²	138.7	83%	0.827	79%	0.794	S	S	*	*			trans	-63.1	132.8	165.2	-68.3	160.7	0	0	0	112
679	S	26.2	Very low	27.9	Very low	109 Å²	109	139.6 Å²	139.6	76%	0.762	80%	0.8	S	S	*	*				164.6	122.2	121.3	-76.5	0	0	0	0	114.4
680	T	30.8	Very low	28	Very low	148 Å²	148	141.7 Å²	141.7	91%	0.908	80%	0.803	S	S	*	*			trans	-148.8	107.9	131.7	-39.6	0	0	0	0	109.9
681	S	29.4	Very low	28.1	Very low	107 Å²	107	140.5 Å²	140.5	75%	0.748	80%	0.802	S	S	*	*			trans	-106.3	139.8	166	48.3	0	0	0	0	109.6
682	L	26.4	Very low	28.1	Very low	168 Å²	168	142.5 Å²	142.5	88%	0.88	80%	0.802	S	S	*	*			trans	-70.1	145.3	178.9	-70	101.3	0	0	0	111.8
683	S	30	Very low	28.5	Very low	115 Å²	115	143.1 Å²	143.1	80%	0.804	80%	0.797	S	S	*	*			trans	-137.9	147.1	161	59.4	0	0	0	0	109.9
684	L	26.6	Very low	28.5	Very low	166 Å²	166	141 Å²	141	87%	0.869	79%	0.787	S	S	*	*			trans	-117.2	145.5	173.9	-83.2	78.2	0	0	0	108.9
685	G	26.5	Very low	28.9	Very low	71 Å²	71	146.3 Å²	146.3	73%	0.732	80%	0.796	S	S	*	*			trans	-170.7	54.5	-172.6	0	0	0	0	0	117.6
686	I	32.1	Very low	28.9	Very low	150 Å²	150	143.9 Å²	143.9	77%	0.769	79%	0.791	S	S	*	*			trans	34.8	116.4	138.9	-55.6	162.4	0	0	0	117.8
687	K	31.3	Very low	28.8	Very low	195 Å²	195	142.1 Å²	142.1	85%	0.848	79%	0.786	S	S	*	*				-175.3	159.3	97.4	-139.6	153.5	-171.7	177.6	0	114.2
688	D	26.9	Very low	28.8	Very low	131 Å²	131	137.9 Å²	137.9	70%	0.701	78%	0.778	S	S	*	*			trans	-99.3	160.3	-166.2	-38.7	-95.7	0	0	0	114.8
689	S	30.4	Very low	29	Very low	127 Å²	127	137.1 Å²	137.1	89%	0.888	77%	0.774	S	S	*	*			trans	-153.9	150.2	151.9	-84.5	0	0	0	0	108.9
690	I	27.6	Very low	28.9	Very low	137 Å²	137	137.2 Å²	137.2	70%	0.703	77%	0.774	S	S	*	*			trans	-141	161.8	-159.2	-83.1	172.5	0	0	0	111.5
691	D	28.2	Very low	28.9	Very low	154 Å²	154	140.6 Å²	140.6	82%	0.824	78%	0.776	S	S	*	*			trans	67.5	154.9	178.2	-60.3	-35.6	0	0	0	115.9
692	E	30.7	Very low	28.9	Very low	172 Å²	172	139.3 Å²	139.3	80%	0.804	78%	0.78	S	S	*	*			cis	-125.6	178.3	10.7	-87.6	-163.2	124.5	0	0	110.9
693	L	30.8	Very low	28.8	Very low	118 Å²	118	138.6 Å²	138.6	62%	0.618	78%	0.777	S	S	*	*			cis	-161.4	178.3	2.1	-128.9	173.4	0	0	0	110.3
694	N	30.4	Very low	28.8	Very low	125 Å²	125	140 Å²	140	67%	0.668	77%	0.774	S	S	*	*			trans	67.8	131.4	158.9	-69.9	-51.8	0	0	0	119.3
695	K	32	Very low	29	Very low	189 Å²	189	137.9 Å²	137.9	82%	0.822	77%	0.768	S	S	*	*			cis	-160	160.4	-14.1	-156.9	170.5	-178.9	177.9	0	109.7
696	S	23.9	Very low	29	Very low	104 Å²	104	141.2 Å²	141.2	73%	0.727	77%	0.768	S	S	*	*			trans	-114.1	179.6	-176.5	-65.9	0	0	0	0	113.8
697	T	28.3	Very low	28.9	Very low	123 Å²	123	140.6 Å²	140.6	76%	0.755	76%	0.762	S	S	*	*			trans	77.5	144.5	172.4	81.3	0	0	0	0	115.5
698	D	30.1	Very low	29	Very low	129 Å²	129	137.1 Å²	137.1	69%	0.69	75%	0.747	S	S	*	*			cis	-153	154	36.7	-96.2	-63.6	0	0	0	118.5
699	L	29.9	Very low	29.3	Very low	142 Å²	142	138.3 Å²	138.3	74%	0.743	75%	0.754	S	S	*	*			trans	32.6	112.2	141.8	-64.5	164.4	0	0	0	124.6
700	C	24.9	Very low	29.4	Very low	111 Å²	111	136.8 Å²	136.8	75%	0.75	74%	0.743	S	S	*	*				36.5	115.5	120.9	-58.6	0	0	0	0	122.5
701	K	30.6	Very low	29.5	Very low	219 Å²	219	136.5 Å²	136.5	95%	0.952	74%	0.739	S	S	*	*				167.8	163.1	124.2	-94.8	162.5	-175.5	174.4	0	111.6
702	G	29.7	Very low	29.4	Very low	80 Å²	80	136 Å²	136	83%	0.825	74%	0.735	S	S	*	*			trans	124.8	124.4	161.6	0	0	0	0	0	114
703	N	24.5	Very low	29.1	Very low	153 Å²	153	132.3 Å²	132.3	82%	0.818	73%	0.729	S	S	*	*			trans	-127.6	160.9	177.9	-140.8	8.3	0	0	0	108
704	I	29.3	Very low	28.8	Very low	145 Å²	145	132.2 Å²	132.2	74%	0.744	73%	0.728	S	S	*	*			trans	76.1	155.6	164.6	-64	158.5	0	0	0	116.5
705	T	31.6	Very low	28.5	Very low	121 Å²	121	134.5 Å²	134.5	74%	0.742	73%	0.732	S	S	*	*			trans	70.5	88	178.1	34	0	0	0	0	117.3
706	D	25.8	Very low	28.5	Very low	140 Å²	140	134.6 Å²	134.6	75%	0.749	73%	0.733	S	S	*	*				-3.7	148.7	114.3	-55.3	-84.7	0	0	0	115.9
707	Q	30.5	Very low	28.7	Very low	137 Å²	137	136.1 Å²	136.1	64%	0.64	73%	0.732	S	S	*	*			cis	-173.1	153.6	43.3	-151.5	169.5	83	0	0	111.9
708	K	33	Very low	28.6	Very low	122 Å²	122	136.9 Å²	136.9	53%	0.53	73%	0.73	S	S	.	*			trans	63.4	150.7	162.9	-74.4	146.2	-177.9	164.4	0	117.4	E711	K708-E711 VanDerWaalsContact CE-CD 3.41Å; K708-E711 VanDerWaalsContact CE-OE1 3.24Å; K708-E711 WeakPolarHBondContact CE-OE1 3.47Å; K708-E711 WeakPolarHBondContact CE-OE2 3.48Å; K708-E711 IonicContact NZ-OE1 3.31Å
709	N	32.3	Very low	28.7	Very low	157 Å²	157	139.5 Å²	139.5	84%	0.84	74%	0.735	S	S	*	*	S	Bend	cis	-97.4	155.6	-3.2	-66	-33.6	0	0	0	110.8
710	S	33.5	Very low	28.6	Very low	94 Å²	94	137.4 Å²	137.4	66%	0.657	73%	0.732	S	S	*	*			cis	-157.6	114.5	-15.6	44.8	0	0	0	0	105.2
711	E	29.2	Very low	28.7	Very low	131 Å²	131	141.3 Å²	141.3	61%	0.612	74%	0.736	S	S	*	*				51.7	104.8	101.3	-71.5	179.7	139	0	0	112.5	K708	K708-E711 VanDerWaalsContact CE-CD 3.41Å; K708-E711 VanDerWaalsContact CE-OE1 3.24Å; K708-E711 WeakPolarHBondContact CE-OE1 3.47Å; K708-E711 WeakPolarHBondContact CE-OE2 3.48Å; K708-E711 IonicContact NZ-OE1 3.31Å
712	L	26.4	Very low	28.5	Very low	143 Å²	143	135.8 Å²	135.8	75%	0.749	72%	0.721	S	S	*	*				57.6	84	64.6	-160.2	146.7	0	0	0	108.7	L714	L712-L714 HydrophobicContact CD2-CG 4.38Å
713	S	24.9	Very low	28.4	Very low	96 Å²	96	138.9 Å²	138.9	67%	0.671	72%	0.718	S	S	*	*				85.3	154.3	95.6	-174.5	0	0	0	0	112.4
714	L	24.4	Very low	28.5	Very low	115 Å²	115	138.9 Å²	138.9	60%	0.602	71%	0.713	S	S	*	*				161.4	114.6	116.3	-82.1	174.5	0	0	0	112.8	L712	L712-L714 HydrophobicContact CD2-CG 4.38Å
715	K	24	Very low	28.4	Very low	173 Å²	173	137.8 Å²	137.8	75%	0.752	71%	0.713	S	S	*	*			trans	66.4	159.1	139.1	-62.6	169.3	175.1	162	0	119.1
716	K	31.8	Very low	28.3	Very low	192 Å²	192	139.3 Å²	139.3	84%	0.835	71%	0.712	S	S	*	*			trans	70.6	141.4	173.7	-52.6	-177.5	-178.5	177.2	0	113.2
717	L	28.1	Very low	28.5	Very low	135 Å²	135	139 Å²	139	71%	0.707	71%	0.706	S	S	*	*			cis	-144.9	130.8	-5.3	-145.2	45.9	0	0	0	106.4
718	I	26.8	Very low	28.6	Very low	139 Å²	139	138.1 Å²	138.1	71%	0.713	70%	0.702	S	S	*	*				35.6	127.2	93.8	-58.7	175.8	0	0	0	113.6
719	K	30.7	Very low	28.6	Very low	185 Å²	185	138.8 Å²	138.8	80%	0.804	71%	0.707	S	S	*	*			trans	68	91.3	166.6	-78.8	-178.5	176.6	-175.7	0	118.4
720	S	28.2	Very low	28.7	Very low	97 Å²	97	137.6 Å²	137.6	68%	0.678	70%	0.696	S	S	*	*				56	130.6	109.2	68.6	0	0	0	0	121.7
721	K	28.3	Very low	28.7	Very low	194 Å²	194	141.5 Å²	141.5	84%	0.843	70%	0.704	S	S	*	*			trans	80.9	123.2	135.8	-92.5	-165.8	173.1	-172.3	0	120
722	T	26.4	Very low	28.8	Very low	103 Å²	103	138.8 Å²	138.8	63%	0.632	71%	0.711	S	S	*	*				94	111.3	121.2	-67.2	0	0	0	0	119.1
723	L	27.6	Very low	29.2	Very low	145 Å²	145	137.9 Å²	137.9	76%	0.759	72%	0.717	S	S	*	*			trans	67.6	164	152	-60.8	171.4	0	0	0	118.2
724	Q	25.5	Very low	29.7	Very low	153 Å²	153	136.6 Å²	136.6	72%	0.715	72%	0.718	S	S	*	*			cis	-175.3	149.6	-36.9	-166.5	-178.4	21.6	0	0	108.1
725	T	27.1	Very low	30.3	Very low	121 Å²	121	138.8 Å²	138.8	74%	0.742	73%	0.731	S	S	*	*			trans	65	161.3	167.6	2.7	0	0	0	0	114.4
726	E	28.9	Very low	31	Very low	153 Å²	153	136.8 Å²	136.8	72%	0.715	73%	0.728	S	S	*	*			cis	-128.3	-156.9	-0.9	-53	180	78.1	0	0	109.9
727	Q	30.8	Very low	31	Very low	134 Å²	134	134.6 Å²	134.6	63%	0.626	73%	0.726	S	S	*	*			cis	-159.9	175.4	-8	-137.2	-173.3	72.8	0	0	105.6
728	Q	31.9	Very low	31.8	Very low	118 Å²	118	133.3 Å²	133.3	55%	0.551	73%	0.725	S	S	*	*			cis	-158	-151.4	-3	-157.8	-150.1	99.9	0	0	107.8	Q730	Q728-Q730 VanDerWaalsContact OE1-NE2 3.17Å
729	H	34.1	Very low	32.1	Very low	137 Å²	137	134.4 Å²	134.4	63%	0.634	73%	0.727	S	S	*	*			trans	61.2	91.9	171.9	-72.3	73.1	0	0	0	115.9
730	Q	33.2	Very low	32.1	Very low	131 Å²	131	134.9 Å²	134.9	61%	0.612	73%	0.733	S	S	*	*				83.2	137.5	83.4	-75.1	165.6	38.2	0	0	112.5	Q728	Q728-Q730 VanDerWaalsContact OE1-NE2 3.17Å
731	Q	33.6	Very low	32.4	Very low	177 Å²	177	135.6 Å²	135.6	83%	0.827	73%	0.729	S	S	*	*			cis	-162	144.8	10.6	-134.3	171.2	12.5	0	0	112.8
732	G	32.1	Very low	32.7	Very low	73 Å²	73	133 Å²	133	75%	0.753	72%	0.724	S	S	*	*			trans	77.9	153.7	161	0	0	0	0	0	119.2
733	S	35.7	Very low	33.1	Very low	125 Å²	125	134.6 Å²	134.6	87%	0.874	73%	0.729	S	S	*	*			cis	-171.5	134.9	-11	52.9	0	0	0	0	113.3
734	G	34.2	Very low	33.4	Very low	69 Å²	69	131.6 Å²	131.6	71%	0.711	72%	0.72	S	S	*	*			trans	76.6	149.4	162.7	0	0	0	0	0	118.4
735	D	38.4	Very low	33.7	Very low	160 Å²	160	130.4 Å²	130.4	86%	0.856	72%	0.719	S	S	*	*			cis	-159	165.4	-11.9	-104.9	-31.7	0	0	0	113
736	D	37.6	Very low	33.9	Very low	132 Å²	132	131.6 Å²	131.6	71%	0.706	72%	0.716	S	S	*	*			trans	62.2	88.5	161.6	-81.3	-46.5	0	0	0	123.7
737	N	32.8	Very low	34	Very low	146 Å²	146	130.7 Å²	130.7	78%	0.781	72%	0.715	S	S	*	*				73.9	137	114.3	-81.8	-46.4	0	0	0	124.9
738	P	43.6	Very low	34	Very low	108 Å²	108	130.4 Å²	130.4	70%	0.701	72%	0.717	S	S	*	*			trans	-122.9	-176.9	175	44.7	-32.4	0	0	0	114.6
739	Q	34	Very low	33.8	Very low	161 Å²	161	131.1 Å²	131.1	75%	0.752	73%	0.725	S	S	*	*				172.5	137.9	124	-96.6	-179.8	-91.6	0	0	113.1	D741	Q739-D741 PolarHBondContact NE2-OD2 3.08Å
740	E	30	Very low	33.7	Very low	196 Å²	196	130.2 Å²	130.2	92%	0.916	73%	0.729	S	S	*	*			trans	-138.4	126.7	151.3	-80.2	-169.1	153.7	0	0	106.8
741	D	35.5	Very low	33.7	Very low	111 Å²	111	129.6 Å²	129.6	59%	0.594	73%	0.734	S	S	*	*			trans	-137.5	120.5	178	-74.2	-71.4	0	0	0	109.3	Q739	Q739-D741 PolarHBondContact NE2-OD2 3.08Å
742	D	34.2	Very low	33.5	Very low	140 Å²	140	128 Å²	128	75%	0.749	73%	0.731	S	S	*	*				172	116.5	113.6	-105.9	-36.9	0	0	0	113.4
743	N	33.8	Very low	33.5	Very low	136 Å²	136	129.2 Å²	129.2	73%	0.727	73%	0.729	S	S	*	*				31.7	149.7	120.1	-65.4	-56.4	0	0	0	122.5
744	S	34	Very low	33.3	Very low	82 Å²	82	128.1 Å²	128.1	57%	0.573	72%	0.721	S	S	*	*			cis	-177.1	171.4	-14.3	59.3	0	0	0	0	111.8
745	N	32.3	Very low	33.2	Very low	129 Å²	129	132.7 Å²	132.7	69%	0.69	72%	0.724	S	S	*	*			trans	68	154.7	148.3	-66.5	5.3	0	0	0	120.8
746	E	31.7	Very low	32.8	Very low	146 Å²	146	130.6 Å²	130.6	68%	0.682	72%	0.716	S	S	*	*			cis	-161.1	147.6	-15.5	-112.9	-179.8	139	0	0	113.9
747	L	30.9	Very low	32.4	Very low	133 Å²	133	130.7 Å²	130.7	70%	0.696	72%	0.722	S	S	*	*			trans	54.2	138.9	136.8	-70.5	172.3	0	0	0	127.5
748	L	31.1	Very low	32.2	Very low	129 Å²	129	129.5 Å²	129.5	68%	0.675	72%	0.72	S	S	*	*			trans	88	98.5	133.7	-73.9	165.2	0	0	0	125
749	N	27	Very low	31.5	Very low	132 Å²	132	130.5 Å²	130.5	71%	0.706	72%	0.724	S	S	*	*				72.7	150.4	112.4	-93	7.1	0	0	0	126
750	T	31.2	Very low	31	Very low	118 Å²	118	131.7 Å²	131.7	72%	0.724	73%	0.73	S	S	*	*			trans	69.2	137.8	150.5	44.1	0	0	0	0	119.2
751	T	33.2	Very low	31	Very low	118 Å²	118	128.8 Å²	128.8	72%	0.724	73%	0.725	S	S	*	*			cis	-162.8	170.1	-9.8	1	0	0	0	0	112.5
752	D	29.8	Very low	30.7	Very low	144 Å²	144	129.9 Å²	129.9	77%	0.77	73%	0.73	S	S	*	*			trans	95.2	129.2	142.8	-81.2	-0.2	0	0	0	125.8
753	S	33.1	Very low	30.2	Very low	99 Å²	99	134 Å²	134	69%	0.692	74%	0.737	S	S	*	*			trans	85.7	110.9	136.4	-74.8	0	0	0	0	124.2
754	S	30.6	Very low	29.9	Very low	102 Å²	102	132.1 Å²	132.1	71%	0.713	74%	0.741	S	S	*	*			trans	70.7	148	137.1	-63.4	0	0	0	0	119.8
755	Q	32.8	Very low	29.7	Very low	165 Å²	165	134.3 Å²	134.3	77%	0.771	75%	0.751	S	S	*	*			cis	-159.8	156.4	-11.9	-117.9	-175.5	53.9	0	0	110.7
756	V	28.8	Very low	29.6	Very low	116 Å²	116	133.8 Å²	133.8	70%	0.703	75%	0.752	S	S	*	*			trans	46	115.6	150.9	-177.2	0	0	0	0	119.6
757	T	29.8	Very low	29.5	Very low	133 Å²	133	133.5 Å²	133.5	82%	0.816	76%	0.755	S	S	*	*				-163	141.4	108.5	-70.1	0	0	0	0	110.6
758	T	28.3	Very low	29.6	Very low	122 Å²	122	134.7 Å²	134.7	75%	0.748	76%	0.762	S	S	*	*			trans	-76.8	151.8	-179.6	50.6	0	0	0	0	112.3
759	V	28.9	Very low	29.6	Very low	128 Å²	128	134.4 Å²	134.4	78%	0.776	77%	0.765	S	S	*	*				-165.2	138.5	68.4	160.1	0	0	0	0	110.3
760	E	22.9	Very low	29.6	Very low	187 Å²	187	134.2 Å²	134.2	87%	0.874	77%	0.769	S	S	*	*			trans	-144.3	125.3	164.9	-159.5	-176.8	-132.2	0	0	108.5
761	V	31.2	Very low	29.5	Very low	134 Å²	134	135.2 Å²	135.2	81%	0.812	77%	0.769	S	S	*	*			trans	-144.7	137.7	169.8	-171.7	0	0	0	0	110.4
762	N	28	Very low	29.2	Very low	134 Å²	134	135 Å²	135	72%	0.717	77%	0.767	S	S	*	*			trans	-73.1	166.8	-168.6	-73.1	-69.5	0	0	0	116.7
763	Y	24.4	Very low	29.2	Very low	228 Å²	228	135.1 Å²	135.1	89%	0.894	77%	0.767	S	S	*	*			trans	-34.4	142.9	160.9	-57.5	-96.5	0	0	0	115.7
764	A	28.8	Very low	29.1	Very low	96 Å²	96	137.4 Å²	137.4	79%	0.793	77%	0.77	S	S	*	*			trans	-141.7	126	159.4	0	0	0	0	0	110.9
765	T	27.8	Very low	29.7	Very low	128 Å²	128	137.3 Å²	137.3	79%	0.785	77%	0.767	S	S	*	*			trans	-85.7	139.7	176	-51.9	0	0	0	0	110.3
766	V	32.1	Very low	29.7	Very low	117 Å²	117	136.9 Å²	136.9	71%	0.709	77%	0.77	S	S	*	*			trans	-119.8	101.1	172.9	-177.2	0	0	0	0	110.6
767	N	29.7	Very low	29.9	Very low	140 Å²	140	135.8 Å²	135.8	75%	0.749	76%	0.764	S	S	*	*			trans	-92.4	126.1	158.6	-76.3	-24.6	0	0	0	108.1
768	N	31.9	Very low	30	Very low	159 Å²	159	135.8 Å²	135.8	85%	0.85	76%	0.759	S	S	*	*			trans	-96.9	99.6	170.6	-91.6	2.1	0	0	0	110.3
769	T	30.2	Very low	30.2	Very low	122 Å²	122	137.1 Å²	137.1	75%	0.748	76%	0.758	S	S	*	*			trans	-122.9	145.7	166.6	-4.4	0	0	0	0	110.2	I771	T769-I771 PolarHBondContact O-N 3.17Å
770	V	27.1	Very low	30.3	Very low	128 Å²	128	137.1 Å²	137.1	78%	0.776	75%	0.754	S	S	*	*			trans	-37.5	127.6	179.3	-179.4	0	0	0	0	113.8	V772	V770-V772 HydrophobicContact CG1-CG2 4.08Å
771	I	30.5	Very low	30.8	Very low	140 Å²	140	133.5 Å²	133.5	72%	0.718	75%	0.745	S	S	*	*			trans	-101.7	120.8	161.7	-65.3	178.8	0	0	0	108.8	T769 N773	T769-I771 PolarHBondContact O-N 3.17Å; I771-N773 VanDerWaalsContact CG2-OD1 3.3Å; I771-N773 WeakPolarHBondContact CG2-OD1 3.11Å
772	V	27	Very low	30.9	Very low	113 Å²	113	136.7 Å²	136.7	69%	0.685	75%	0.748	S	S	*	*			trans	-105.9	124.9	160.4	172.6	0	0	0	0	106.5	V770 I774	V770-V772 HydrophobicContact CG1-CG2 4.08Å; V772-I774 HydrophobicContact CG1-CD1 4.39Å; V772-I774 HydrophobicContact CG1-CG1 4.41Å
773	N	28.7	Very low	31.1	Very low	147 Å²	147	137.4 Å²	137.4	79%	0.786	75%	0.752	S	S	*	*			trans	-114.8	115.3	176.1	-88	4.8	0	0	0	111.2	I771	I771-N773 VanDerWaalsContact CG2-OD1 3.3Å; I771-N773 WeakPolarHBondContact CG2-OD1 3.11Å
774	I	31.9	Very low	31.6	Very low	147 Å²	147	135.1 Å²	135.1	75%	0.754	75%	0.754	S	S	*	*			trans	-154.2	149.9	175.2	-64.8	-179.4	0	0	0	104.2	V772	V772-I774 HydrophobicContact CG1-CD1 4.39Å; V772-I774 HydrophobicContact CG1-CG1 4.41Å
775	P	42.8	Very low	31.8	Very low	99 Å²	99	139.2 Å²	139.2	64%	0.643	76%	0.757	S	S	*	*			cis	-120.6	-167.6	-1.9	33.3	-14	0	0	0	112.8	T777	P775-T777 HydrophobicContact CG-CG2 4.26Å
776	D	32.4	Very low	32.6	Very low	156 Å²	156	138.5 Å²	138.5	83%	0.834	75%	0.754	S	S	*	*				-136.5	172.6	123.6	-138.1	-34.6	0	0	0	110.4
777	T	34.3	Very low	32.6	Very low	94 Å²	94	139.7 Å²	139.7	58%	0.577	76%	0.757	S	S	*	*			trans	-123	163.6	-146.1	58.5	0	0	0	0	118.5	P775	P775-T777 HydrophobicContact CG-CG2 4.26Å
778	N	30.4	Very low	32.8	Very low	133 Å²	133	138.4 Å²	138.4	71%	0.711	75%	0.75	S	S	*	*			trans	102.8	129.6	142.5	-86.8	-50.6	0	0	0	123.5
779	M	33.8	Very low	32.8	Very low	149 Å²	149	136.2 Å²	136.2	73%	0.734	74%	0.742	S	S	*	*			trans	86.5	111	141.5	-69.1	-67.6	175.7	0	0	124
780	N	30.6	Very low	33	Very low	129 Å²	129	138.4 Å²	138.4	69%	0.69	75%	0.749	S	S	*	*			trans	79.3	107.3	130.3	-84.3	-15.3	0	0	0	124
781	T	32.8	Very low	33.1	Very low	111 Å²	111	137.9 Å²	137.9	68%	0.681	75%	0.75	S	S	*	*				51.5	118.8	125.6	61	0	0	0	0	121.5
782	K	34.4	Very low	33.2	Very low	201 Å²	201	134.7 Å²	134.7	87%	0.874	75%	0.752	S	S	*	*				-173.7	157.8	101.6	-99.7	166.7	-174.4	176.6	0	114.2
783	N	31.3	Very low	33.3	Very low	149 Å²	149	137 Å²	137	80%	0.797	76%	0.761	S	S	*	*			trans	-68.3	158.9	-176.4	-39.7	-13.9	0	0	0	113.3
784	L	35.3	Very low	33.5	Very low	179 Å²	179	136.9 Å²	136.9	94%	0.937	77%	0.765	S	S	*	*				-163.7	162.7	117.4	-103.9	161.6	0	0	0	111.3
785	E	32.5	Very low	33.3	Very low	182 Å²	182	137 Å²	137	85%	0.85	77%	0.767	S	S	*	*			trans	-105.4	167.7	-165.5	-96.5	-178.8	133.5	0	0	114
786	P	45.9	Very low	33	Very low	114 Å²	114	143.7 Å²	143.7	74%	0.74	78%	0.782	S	S	*	*			trans	-90.7	177.4	-174.5	38.9	-37.6	0	0	0	112.9
787	D	31.9	Very low	32.8	Very low	141 Å²	141	141 Å²	141	75%	0.754	78%	0.775	S	S	*	*			trans	-159.6	150.5	139.2	-134.8	-4	0	0	0	118.9
788	N	32.7	Very low	32.8	Very low	113 Å²	113	140.8 Å²	140.8	60%	0.604	78%	0.778	S	S	*	*			trans	58.1	108.9	142.9	-88.6	-46.9	0	0	0	126.8
789	T	31.8	Very low	32.8	Very low	113 Å²	113	141.9 Å²	141.9	69%	0.693	78%	0.783	S	S	*	*				52.2	130.4	119.9	56.6	0	0	0	0	124.4
790	L	34.5	Very low	32.8	Very low	169 Å²	169	143.1 Å²	143.1	89%	0.885	79%	0.787	S	S	*	*				-161.7	174	97.1	-132.6	84.4	0	0	0	112.3
791	S	30.6	Very low	33	Very low	116 Å²	116	142.3 Å²	142.3	81%	0.811	79%	0.792	S	S	*	*			trans	-126.7	160.8	-176.7	57.4	0	0	0	0	113.1
792	G	31.7	Very low	32.9	Very low	73 Å²	73	144.8 Å²	144.8	75%	0.753	80%	0.799	S	S	*	*			trans	179.3	120.8	171.8	0	0	0	0	0	114.4
793	N	28.2	Very low	33.3	Very low	163 Å²	163	140 Å²	140	87%	0.872	79%	0.789	S	S	*	*			trans	-109.4	144.7	167.4	-67.9	-10.2	0	0	0	109.3
794	T	34.4	Very low	33.3	Very low	143 Å²	143	139.9 Å²	139.9	88%	0.877	79%	0.788	S	S	*	*			trans	-168.7	148.8	138.8	16.6	0	0	0	0	111.8
795	D	27.2	Very low	33.1	Very low	149 Å²	149	137.6 Å²	137.6	80%	0.797	78%	0.777	S	S	*	*			trans	-81	160.2	176	-46.6	-93.8	0	0	0	113
796	Y	36.1	Very low	33.1	Very low	240 Å²	240	135.1 Å²	135.1	94%	0.941	77%	0.769	S	S	*	*			trans	-149.4	158.6	148	-107.7	-77.2	0	0	0	110.9
797	S	29.3	Very low	32.4	Very low	101 Å²	101	138.6 Å²	138.6	71%	0.706	77%	0.773	S	S	*	*			trans	-138.5	163.4	-169.8	176.1	0	0	0	0	112
798	S	32.8	Very low	32.5	Very low	89 Å²	89	139.7 Å²	139.7	62%	0.622	78%	0.777	S	S	*	*			trans	99.6	140.5	149.2	-50.3	0	0	0	0	119.8
799	D	30.8	Very low	32.4	Very low	155 Å²	155	145.2 Å²	145.2	83%	0.829	79%	0.789	S	S	*	*			trans	67.9	153.7	156.2	-51.2	-37	0	0	0	118.8
800	E	33.9	Very low	32.7	Very low	175 Å²	175	145.1 Å²	145.1	82%	0.818	79%	0.791	S	S	*	*			cis	-152.4	163.7	14.8	-156.4	178.4	-152.8	0	0	114
801	S	35.3	Very low	32.4	Very low	112 Å²	112	143 Å²	143	78%	0.783	78%	0.78	S	S	*	*			trans	88.5	151.8	150.9	82.3	0	0	0	0	122.6
802	I	30.2	Very low	32.3	Very low	164 Å²	164	143.3 Å²	143.3	84%	0.841	77%	0.773	S	S	*	*			trans	-163.9	155.7	-158.6	-91	170.2	0	0	0	106.6
803	P	42.1	Very low	32.2	Very low	101 Å²	101	146.8 Å²	146.8	66%	0.656	77%	0.774	S	S	*	*			cis	-139.9	-166.1	21.1	44.6	-25	0	0	0	116.9
804	N	31.5	Very low	32.2	Very low	145 Å²	145	146.8 Å²	146.8	78%	0.775	77%	0.773	S	S	*	*			trans	18.6	151.1	138.3	-56.1	-21.9	0	0	0	121.4
805	N	32.1	Very low	31.8	Very low	132 Å²	132	145.1 Å²	145.1	71%	0.706	77%	0.767	S	S	*	*			cis	-168.4	172.3	38.2	-152.3	-5.3	0	0	0	115.4
806	N	32.3	Very low	31.9	Very low	129 Å²	129	144.7 Å²	144.7	69%	0.69	77%	0.765	S	S	*	*			trans	73.6	112.9	155.6	-74.7	-35.2	0	0	0	123.1
807	K	30.7	Very low	31.6	Very low	188 Å²	188	140.1 Å²	140.1	82%	0.817	75%	0.751	S	S	*	*			trans	10.2	129.3	135.5	-65.7	172.5	174.6	173.4	0	119.5
808	I	34.4	Very low	31.8	Very low	164 Å²	164	141.9 Å²	141.9	84%	0.841	75%	0.753	S	S	*	*				-169.3	151.4	106.5	-95.2	154.9	0	0	0	110.5
809	R	30.1	Very low	31.6	Very low	228 Å²	228	146.1 Å²	146.1	86%	0.86	76%	0.76	S	S	*	*			trans	-126.8	144.4	164.3	-95.9	-168.5	-178.2	-159.4	3.1	106.2
810	P	38.7	Very low	31.6	Very low	112 Å²	112	145.3 Å²	145.3	73%	0.727	76%	0.761	S	S	*	*				-150.3	155.3	79.4	40.4	-22.2	0	0	0	117.9
811	N	28.1	Very low	31.7	Very low	123 Å²	123	142.2 Å²	142.2	66%	0.658	76%	0.756	S	S	*	*			trans	44.8	142.1	141.5	-85.3	49.5	0	0	0	125.7
812	D	27.6	Very low	31.2	Very low	124 Å²	124	144.4 Å²	144.4	66%	0.663	76%	0.759	S	S	*	*			trans	63.1	95.4	143.4	-51.1	-25.2	0	0	0	120
813	N	30.5	Very low	31.2	Very low	145 Å²	145	146.5 Å²	146.5	78%	0.775	76%	0.758	S	S	*	*				-170	142	96.1	-100.4	-71.7	0	0	0	115.6
814	L	27	Very low	30.3	Very low	164 Å²	164	149.2 Å²	149.2	86%	0.859	77%	0.765	S	S	*	*			trans	12.6	120.7	151.2	-66.2	160.2	0	0	0	121
815	S	27.3	Very low	30.3	Very low	107 Å²	107	148.9 Å²	148.9	75%	0.748	76%	0.762	S	S	*	*			trans	-156.8	141.2	142.6	87.3	0	0	0	0	115.7
816	L	29.8	Very low	30	Very low	141 Å²	141	153.6 Å²	153.6	74%	0.738	77%	0.77	S	S	*	*			trans	70.4	127.4	143.5	-69.1	162.2	0	0	0	125
817	H	28.9	Very low	29.8	Very low	143 Å²	143	153.4 Å²	153.4	66%	0.662	77%	0.768	S	S	*	*			trans	52.9	123.4	143.4	-68.8	-17.2	0	0	0	121.2
818	N	32.5	Very low	29.5	Very low	138 Å²	138	155.7 Å²	155.7	74%	0.738	77%	0.772	S	S	*	*				-153.4	140.1	65.3	-84.5	-54.9	0	0	0	111
819	K	29.7	Very low	29.2	Very low	179 Å²	179	156.8 Å²	156.8	78%	0.778	77%	0.773	S	S	*	*				66.9	87	71.8	-86.2	-171	175.1	179.6	0	115.6
820	T	30.8	Very low	29	Very low	137 Å²	137	151 Å²	151	84%	0.84	77%	0.768	S	S	*	*			trans	-142.9	141.6	149.1	40.2	0	0	0	0	108.9
821	P	35.8	Very low	28.5	Very low	110 Å²	110	152.8 Å²	152.8	71%	0.714	77%	0.77	S	S	*	*			trans	-99.1	151.8	178.9	36.7	-32.9	0	0	0	113.2
822	D	24	Very low	28.4	Very low	159 Å²	159	153 Å²	153	85%	0.85	77%	0.771	S	S	*	*			trans	-68	141.1	173.6	-66.5	-73.5	0	0	0	113.1
823	Y	30.1	Very low	28.5	Very low	208 Å²	208	152.3 Å²	152.3	82%	0.816	77%	0.774	S	S	*	*			trans	-131	117.7	162.6	-101.9	-85.1	0	0	0	110.9	I825	Y823-I825 PolarHBondContact O-N 2.87Å
824	I	24.9	Very low	28.3	Very low	158 Å²	158	151.3 Å²	151.3	81%	0.81	77%	0.768	S	S	*	*			trans	-79	113.9	179.5	-61.3	170.7	0	0	0	109.3
825	I	31.8	Very low	28.2	Very low	137 Å²	137	153.2 Å²	153.2	70%	0.703	77%	0.77	S	S	*	*			trans	-111.2	113.2	169.9	-62.7	-179.2	0	0	0	109.9	Y823	Y823-I825 PolarHBondContact O-N 2.87Å
826	R	24.1	Very low	28.3	Very low	232 Å²	232	151.8 Å²	151.8	88%	0.875	77%	0.765	S	S	*	*			trans	-84.1	114.3	162.4	-73	175.3	171.6	159.5	-4.1	109.2
827	N	28.1	Very low	28.1	Very low	124 Å²	124	150.9 Å²	150.9	66%	0.663	77%	0.765	S	S	*	*			trans	-141.5	120.9	154	-88.1	-40.1	0	0	0	107.2
828	R	25	Very low	28	Very low	236 Å²	236	151.6 Å²	151.6	89%	0.891	77%	0.773	S	S	*	*				54.3	77.8	72.1	-75.7	-165.6	171.2	-165.5	0.2	112.6
829	H	29.2	Very low	27.7	Very low	188 Å²	188	151.8 Å²	151.8	87%	0.87	77%	0.774	S	S	*	*			trans	-117.1	118.3	145.6	-81	-79.1	0	0	0	109.1
830	S	24.2	Very low	27.6	Very low	106 Å²	106	150.5 Å²	150.5	74%	0.741	77%	0.774	S	S	*	*			trans	-127.5	154.9	166.3	-177.1	0	0	0	0	106.4
831	L	28	Very low	27.4	Very low	149 Å²	149	148.5 Å²	148.5	78%	0.78	77%	0.766	S	S	*	*			trans	67.4	120.7	-170.1	-48.3	166.1	0	0	0	110.9
832	D	27.9	Very low	26.9	Very low	128 Å²	128	150 Å²	150	68%	0.684	77%	0.768	S	S	*	*				-151.1	118.5	71.1	-163.4	35.9	0	0	0	113.2	N834	D832-N834 VanDerWaalsContact CG-ND2 3.26Å; D832-N834 PolarHBondContact O-N 3.05Å; D832-N834 PolarHBondContact OD1-ND2 3.01Å; D832-N834 VanDerWaalsContact OD1-ND2 3.16Å; D832-N834 PolarHBondContact OD2-ND2 3.23Å
833	P	28	Very low	27.2	Very low	110 Å²	110	148 Å²	148	71%	0.714	76%	0.762	S	S	*	*			trans	-94.8	52.7	-173.9	37.9	-35.8	0	0	0	113.6	F835	P833-F835 VanDerWaalsContact C-N 3.33Å; P833-F835 PolarHBondContact O-N 3.16Å
834	N	27.2	Very low	27	Very low	123 Å²	123	147.3 Å²	147.3	66%	0.658	76%	0.763	S	S	*	*			trans	-86.9	55.1	-174.9	-88.6	-53.1	0	0	0	115	D832 A836	D832-N834 VanDerWaalsContact CG-ND2 3.26Å; D832-N834 PolarHBondContact O-N 3.05Å; D832-N834 PolarHBondContact OD1-ND2 3.01Å; D832-N834 VanDerWaalsContact OD1-ND2 3.16Å; D832-N834 PolarHBondContact OD2-ND2 3.23Å; N834-A836 PolarHBondContact O-N 2.84Å
835	F	25.3	Very low	27.1	Very low	205 Å²	205	149.4 Å²	149.4	90%	0.899	76%	0.762	S	S	*	*			trans	-94.3	63.9	164.6	-108.1	-80.5	0	0	0	110.9	P833 T837	P833-F835 VanDerWaalsContact C-N 3.33Å; P833-F835 PolarHBondContact O-N 3.16Å; F835-T837 PolarHBondContact O-N 2.91Å
836	A	29.1	Very low	26.8	Very low	77 Å²	77	147.4 Å²	147.4	64%	0.636	76%	0.76	S	S	*	*			trans	-76.3	88.1	175.4	0	0	0	0	0	110.9	N834 L838	N834-A836 PolarHBondContact O-N 2.84Å; A836-L838 PolarHBondContact O-N 3.48Å
837	T	25.9	Very low	27.1	Very low	122 Å²	122	143.3 Å²	143.3	75%	0.748	76%	0.756	S	S	*	*			trans	-60.4	105.7	158.9	45.9	0	0	0	0	108.3	F835 N839	F835-T837 PolarHBondContact O-N 2.91Å; T837-N839 VanDerWaalsContact C-N 3.29Å; T837-N839 PolarHBondContact O-N 3.28Å
838	L	27.2	Very low	27.1	Very low	158 Å²	158	142.7 Å²	142.7	83%	0.827	76%	0.761	S	S	*	*			trans	-69	88.1	175.1	-75.5	172.5	0	0	0	109.8	A836 I840	A836-L838 PolarHBondContact O-N 3.48Å; L838-I840 PolarHBondContact O-N 2.93Å
839	N	25.4	Very low	27.4	Very low	142 Å²	142	138.8 Å²	138.8	76%	0.759	76%	0.756	S	S	*	*			trans	-52.3	120.1	153.8	-90.7	-22.5	0	0	0	107.4	T837 S841	T837-N839 VanDerWaalsContact C-N 3.29Å; T837-N839 PolarHBondContact O-N 3.28Å; N839-S841 PolarHBondContact O-N 3.19Å
840	I	26.7	Very low	27.3	Very low	151 Å²	151	133.2 Å²	133.2	77%	0.774	75%	0.75	S	S	*	*			trans	-73.1	82.1	163.6	-58.5	177.5	0	0	0	106.1	L838 N842	L838-I840 PolarHBondContact O-N 2.93Å; I840-N842 PolarHBondContact O-N 3.36Å
841	S	27.1	Very low	27.5	Very low	95 Å²	95	135.3 Å²	135.3	66%	0.664	75%	0.751	S	S	*	*			trans	-69.7	98.9	170.6	54	0	0	0	0	108	N839 T843	N839-S841 PolarHBondContact O-N 3.19Å; S841-T843 PolarHBondContact O-N 2.69Å
842	N	26	Very low	27.6	Very low	143 Å²	143	134.3 Å²	134.3	77%	0.765	75%	0.751	S	S	*	*			trans	-57	101.4	167.2	-85.3	-8.7	0	0	0	108.8	I840 K844	I840-N842 PolarHBondContact O-N 3.36Å; N842-K844 PolarHBondContact O-N 3.44Å; N842-K844 VanDerWaalsContact O-N 3.11Å
843	T	29.4	Very low	27.5	Very low	117 Å²	117	132.6 Å²	132.6	72%	0.718	75%	0.75	S	S	*	*			trans	-62.9	109.5	166.3	43.4	0	0	0	0	107.5	S841 Y845	S841-T843 PolarHBondContact O-N 2.69Å; T843-Y845 PolarHBondContact O-N 2.73Å
844	K	26	Very low	27.5	Very low	192 Å²	192	133.5 Å²	133.5	84%	0.835	75%	0.753	S	S	*	*			trans	-58.8	109.1	178.5	-64.3	176.3	178.1	-179.7	0	109.7	N842	N842-K844 PolarHBondContact O-N 3.44Å; N842-K844 VanDerWaalsContact O-N 3.11Å
845	Y	27.5	Very low	27.5	Very low	202 Å²	202	133.8 Å²	133.8	79%	0.792	77%	0.765	S	S	*	*			trans	-91.8	101.6	149.6	-91.9	-92.2	0	0	0	107.3	T843	T843-Y845 PolarHBondContact O-N 2.73Å
846	S	26.3	Very low	27.6	Very low	95 Å²	95	129 Å²	129	66%	0.664	76%	0.756	S	S	*	*			trans	-104.4	81.6	175.4	54.3	0	0	0	0	108.8	S848	S846-S848 VanDerWaalsContact C-N 3.32Å; S846-S848 PolarHBondContact O-N 3.09Å
847	D	28.9	Very low	27.5	Very low	147 Å²	147	131.7 Å²	131.7	79%	0.786	77%	0.765	S	S	*	*			trans	-71.7	92.5	169.7	-75.3	-25.3	0	0	0	108.9	I849	D847-I849 PolarHBondContact O-N 2.94Å
848	S	29.8	Very low	27.7	Very low	111 Å²	111	132.1 Å²	132.1	78%	0.776	77%	0.767	S	S	*	*			trans	-71.8	112.6	175.4	53	0	0	0	0	110.2	S846 G850	S846-S848 VanDerWaalsContact C-N 3.32Å; S846-S848 PolarHBondContact O-N 3.09Å; S848-G850 PolarHBondContact O-N 2.83Å
849	I	30.1	Very low	27.6	Very low	153 Å²	153	132.3 Å²	132.3	79%	0.785	77%	0.766	S	S	*	*			trans	-64.9	106.9	169.7	-63.4	175	0	0	0	108.6	D847 I851	D847-I849 PolarHBondContact O-N 2.94Å; I849-I851 HydrophobicContact CG2-CD1 4.4Å; I849-I851 HydrophobicContact CG2-CG1 3.81Å
850	G	27.6	Very low	27.8	Very low	72 Å²	72	133.3 Å²	133.3	74%	0.742	77%	0.772	S	S	*	*			trans	-84.9	116.1	168.9	0	0	0	0	0	110.4	S848	S848-G850 PolarHBondContact O-N 2.83Å
851	I	27.3	Very low	28	Very low	150 Å²	150	131.5 Å²	131.5	77%	0.769	77%	0.772	S	S	*	*			trans	-104.9	111.8	177.8	-49.5	177.8	0	0	0	109.3	I849	I849-I851 HydrophobicContact CG2-CD1 4.4Å; I849-I851 HydrophobicContact CG2-CG1 3.81Å
852	T	30.8	Very low	28.5	Very low	127 Å²	127	132.1 Å²	132.1	78%	0.779	77%	0.774	S	S	*	*			trans	-136.6	89.5	168.2	55.2	0	0	0	0	111.5
853	S	26.9	Very low	28.6	Very low	93 Å²	93	132.6 Å²	132.6	65%	0.65	78%	0.777	S	S	*	*			trans	45	127.1	132.4	56.8	0	0	0	0	122
854	T	27.1	Very low	28.7	Very low	129 Å²	129	133.8 Å²	133.8	79%	0.791	78%	0.784	S	S	*	*			trans	69.6	109.3	136.6	55.6	0	0	0	0	121
855	S	28.5	Very low	28.7	Very low	128 Å²	128	133.1 Å²	133.1	90%	0.895	78%	0.783	S	S	*	*			trans	-152.6	145.7	134.2	-75.1	0	0	0	0	108.4
856	S	25.8	Very low	28.8	Very low	104 Å²	104	131.3 Å²	131.3	73%	0.727	79%	0.786	S	S	*	*			trans	-158	157.5	-168.9	56.8	0	0	0	0	112.8
857	V	27.5	Very low	29	Very low	134 Å²	134	135.3 Å²	135.3	81%	0.812	79%	0.794	S	S	*	*			trans	75.3	141.4	174.4	-166.5	0	0	0	0	111.6
858	T	29.2	Very low	28.7	Very low	131 Å²	131	136.2 Å²	136.2	80%	0.804	80%	0.797	S	S	*	*			cis	-136	167.3	22.5	-25	0	0	0	0	114.3
859	M	26.5	Very low	28.6	Very low	163 Å²	163	136.4 Å²	136.4	80%	0.803	79%	0.794	S	S	*	*			trans	-55.6	154.5	173.6	-57.2	-67	-171.1	0	0	116.3
860	N	29.9	Very low	28.5	Very low	163 Å²	163	135.2 Å²	135.2	87%	0.872	80%	0.796	S	S	*	*				-170.7	146.1	114.1	-95.2	-20.8	0	0	0	113.4
861	S	30.4	Very low	28.5	Very low	113 Å²	113	137.9 Å²	137.9	79%	0.79	80%	0.797	S	S	*	*			trans	-141	160.2	170.3	-54.6	0	0	0	0	107.9
862	P	38.3	Very low	28.6	Very low	108 Å²	108	136.5 Å²	136.5	70%	0.701	80%	0.796	S	S	*	*				-155.2	163	88.2	39.9	-21.6	0	0	0	117.2
863	N	27.3	Very low	28.3	Very low	153 Å²	153	139.6 Å²	139.6	82%	0.818	80%	0.802	S	S	*	*			trans	54.8	138.3	147.1	-61.1	-8.8	0	0	0	119.8
864	T	32.1	Very low	28.3	Very low	141 Å²	141	144.2 Å²	144.2	87%	0.865	81%	0.81	S	S	*	*				-144.1	171.5	62.3	43	0	0	0	0	116.1
865	H	24.7	Very low	28.2	Very low	179 Å²	179	146.4 Å²	146.4	83%	0.829	81%	0.811	S	S	*	*			trans	-52.7	151.7	177.8	-85.5	-109.6	0	0	0	115.9
866	I	30.8	Very low	28.1	Very low	164 Å²	164	148.2 Å²	148.2	84%	0.841	81%	0.809	S	S	*	*				-156.1	169.2	123.3	-104.7	158.7	0	0	0	110.2
867	Q	28.8	Very low	28	Very low	179 Å²	179	148.8 Å²	148.8	84%	0.836	81%	0.808	S	S	*	*			trans	-73.4	155.7	-154.2	-66.9	162.9	-63.2	0	0	117.5
868	I	22.9	Very low	27.8	Very low	166 Å²	166	145.8 Å²	145.8	85%	0.851	80%	0.797	S	S	*	*			trans	-74.6	131.6	164	-61.4	161.8	0	0	0	109.9
869	T	28.8	Very low	27.5	Very low	115 Å²	115	144.7 Å²	144.7	71%	0.706	79%	0.793	S	S	*	*			trans	-139.9	136.7	155.2	48.4	0	0	0	0	110.3	V871	T869-V871 PolarHBondContact O-N 2.83Å
870	P	26.7	Very low	27.4	Very low	127 Å²	127	144.8 Å²	144.8	83%	0.825	79%	0.794	S	S	*	*			trans	-83.9	111.9	178.9	31.7	-31.8	0	0	0	110.7
871	V	28.8	Very low	27.2	Very low	129 Å²	129	146 Å²	146	78%	0.782	79%	0.792	S	S	*	*			trans	-91.5	133.1	171	178.6	0	0	0	0	109.6	T869	T869-V871 PolarHBondContact O-N 2.83Å
872	T	28.5	Very low	26.9	Very low	120 Å²	120	145.4 Å²	145.4	74%	0.736	79%	0.788	S	S	*	*			trans	-71.8	137.2	-171.5	38.9	0	0	0	0	114.2	K874	T872-K874 PolarHBondContact O-N 3.49Å
873	E	24.4	Very low	26.5	Very low	192 Å²	192	144.4 Å²	144.4	90%	0.897	78%	0.782	S	S	*	*			trans	9.7	92	145.6	-166.2	171.4	-144.5	0	0	116.3
874	K	27.9	Very low	26.7	Very low	191 Å²	191	141.3 Å²	141.3	83%	0.83	77%	0.77	S	S	*	*			trans	-109	121	161.2	-78.1	-173.5	175.8	179	0	109.6	T872 I876	T872-K874 PolarHBondContact O-N 3.49Å; K874-I876 PolarHBondContact O-N 3.16Å; K874-I876 VanDerWaalsContact O-N 3.15Å
875	Q	24.7	Very low	26.8	Very low	175 Å²	175	135.8 Å²	135.8	82%	0.818	74%	0.737	S	S	*	*			trans	-54.9	117.5	175.8	-70.7	175.1	-26.2	0	0	110.5	V877	Q875-V877 HydrophobicContact CB-CG2 4.28Å; Q875-V877 PolarHBondContact O-N 2.89Å
876	I	26.3	Very low	27.6	Very low	165 Å²	165	133.2 Å²	133.2	85%	0.846	73%	0.729	S	S	*	*			trans	-72.7	89.6	163	-60.1	178.3	0	0	0	106.5	K874 A878	K874-I876 PolarHBondContact O-N 3.16Å; K874-I876 VanDerWaalsContact O-N 3.15Å; I876-A878 VanDerWaalsContact C-N 3.31Å; I876-A878 PolarHBondContact O-N 3.01Å
877	V	23.1	Very low	28.4	Very low	116 Å²	116	129 Å²	129	70%	0.703	71%	0.708	S	S	*	*			trans	-69	93.7	170.4	180	0	0	0	0	107.3	Q875	Q875-V877 HydrophobicContact CB-CG2 4.28Å; Q875-V877 PolarHBondContact O-N 2.89Å
878	A	23.1	Very low	29.2	Very low	71 Å²	71	120.7 Å²	120.7	59%	0.587	67%	0.669	S	S	*	*			trans	-56.1	134.3	170.6	0	0	0	0	0	109.1	I876 I880	I876-A878 VanDerWaalsContact C-N 3.31Å; I876-A878 PolarHBondContact O-N 3.01Å; A878-I880 PolarHBondContact O-N 3.12Å
879	P	24.4	Very low	30	Very low	109 Å²	109	118.1 Å²	118.1	71%	0.708	65%	0.652	S	S	*	*			trans	-62.6	124.7	-179.4	25.7	-33.5	0	0	0	109.4	F881	P879-F881 PolarHBondContact O-N 3.14Å
880	I	24.4	Very low	30.9	Very low	164 Å²	164	116.7 Å²	116.7	84%	0.841	64%	0.64	S	S	*	*			trans	-64.8	107.3	177.9	-60.5	172	0	0	0	107.6	A878 S882	A878-I880 PolarHBondContact O-N 3.12Å; I880-S882 PolarHBondContact O-N 3.46Å
881	F	25.8	Very low	31.7	Very low	188 Å²	188	114.4 Å²	114.4	83%	0.825	62%	0.615	S	S	*	*			trans	-60.2	111.2	171.1	-100.7	-102.7	0	0	0	108.9	P879	P879-F881 PolarHBondContact O-N 3.14Å
882	S	24.1	Very low	32.2	Very low	101 Å²	101	109.9 Å²	109.9	71%	0.706	59%	0.588	S	S	*	*			trans	-66.5	126.4	169.7	-170.4	0	0	0	0	108.5	I880 P884	I880-S882 PolarHBondContact O-N 3.46Å; S882-P884 WeakPolarHBondContact O-CD 3.31Å
883	P	29.3	Very low	32.7	Very low	88 Å²	88	107.9 Å²	107.9	57%	0.571	58%	0.575	S	S	*	*			trans	-70.2	124	-173.3	26.4	-33.6	0	0	0	111.6	S885	P883-S885 VanDerWaalsContact C-N 3.35Å; P883-S885 PolarHBondContact O-N 3.34Å
884	P	30.3	Very low	33.5	Very low	88 Å²	88	105.4 Å²	105.4	57%	0.571	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.9	91.3	168.7	30.5	-31.6	0	0	0	108.5	S882	S882-P884 WeakPolarHBondContact O-CD 3.31Å
885	S	34.9	Very low	34.1	Very low	24 Å²	24	100.5 Å²	100.5	17%	0.168	54%	0.544	C	S	.	.	T	Hydrogen-bonded Turn	trans	-156.9	-11.1	-179.4	-46.1	0	0	0	0	116	P883 L887 L888 F889	P883-S885 VanDerWaalsContact C-N 3.35Å; P883-S885 PolarHBondContact O-N 3.34Å; S885-L887 VanDerWaalsContact C-N 3.31Å; S885-L887 PolarHBondContact O-N 2.92Å; S885-L888 PolarHBondContact O-N 3.42Å; S885-F889 PolarHBondContact O-N 2.87Å; S885-F889 VanDerWaalsContact O-N 3.07Å
886	L	41.5	Very low	34.4	Very low	126 Å²	126	97.1 Å²	97.1	66%	0.66	53%	0.531	S	S	*	.	H	α-helix	trans	-58.4	-39.7	-167.7	-67.8	175.3	0	0	0	113.1	L888 F889 D890	L886-L888 PolarHBondContact O-N 2.96Å; L886-F889 PolarHBondContact O-N 3.47Å; L886-D890 PolarHBondContact O-N 2.95Å
887	L	46.9	Very low	34.3	Very low	76 Å²	76	97.7 Å²	97.7	40%	0.398	53%	0.53	S	S	.	.	H	α-helix	trans	-70.3	-15.4	-179.5	-65	-179.8	0	0	0	114.6	R458 S885	R458-L887 HydrophobicContact CG-CD1 4.46Å; S885-L887 VanDerWaalsContact C-N 3.31Å; S885-L887 PolarHBondContact O-N 2.92Å
888	L	45.6	Very low	34.4	Very low	4 Å²	4	100.6 Å²	100.6	2%	0.021	53%	0.534	C	S	.	.	H	α-helix	trans	-90.5	-47.2	171	-83.6	73.1	0	0	0	110.5	M413 M417 E454 M457 S885 L886 D890 R891 V892	M413-L888 HydrophobicContact CE-CB 3.94Å; M413-L888 HydrophobicContact CE-CD2 3.61Å; M413-L888 HydrophobicContact CE-CG 3.52Å; M417-L888 HydrophobicContact CE-CB 4.18Å; M417-L888 HydrophobicContact CE-CD2 4.01Å; M417-L888 HydrophobicContact CG-CD2 4.19Å; M417-L888 HydrophobicContact SD-CB 4.27Å; M417-L888 HydrophobicContact SD-CD2 3.55Å; M417-L888 VanDerWaalsContact SD-CD2 3.55Å; E454-L888 HydrophobicContact CG-CD1 3.79Å; M457-L888 HydrophobicContact SD-CD1 3.9Å; M457-L888 HydrophobicContact SD-CG 4.1Å; S885-L888 PolarHBondContact O-N 3.42Å; L886-L888 PolarHBondContact O-N 2.96Å; L888-D890 VanDerWaalsContact C-N 3.34Å; L888-D890 PolarHBondContact O-N 3.15Å; L888-R891 PolarHBondContact O-N 3.13Å; L888-V892 PolarHBondContact O-N 3.03Å
889	F	41.4	Very low	34.5	Very low	111 Å²	111	101.6 Å²	101.6	49%	0.487	53%	0.534	S	S	.	.	H	α-helix	trans	-60.7	-39.3	-178.9	-86.5	-76.4	0	0	0	113.1	M417 S885 L886 R891 V892 T893	M417-F889 HydrophobicContact CE-CD2 4.36Å; M417-F889 HydrophobicContact CE-CE2 3.88Å; S885-F889 PolarHBondContact O-N 2.87Å; S885-F889 VanDerWaalsContact O-N 3.07Å; L886-F889 PolarHBondContact O-N 3.47Å; F889-R891 PolarHBondContact O-N 2.88Å; F889-R891 VanDerWaalsContact O-N 3.12Å; F889-V892 PolarHBondContact O-N 2.92Å; F889-T893 PolarHBondContact O-N 3.48Å; F889-T893 PolarHBondContact O-OG1 3.27Å
890	D	46.4	Very low	34.6	Very low	86 Å²	86	106.2 Å²	106.2	46%	0.46	54%	0.544	S	S	.	.	H	α-helix	trans	-56.8	-28.5	178.7	-78	-20.1	0	0	0	113.5	L886 L888 T893 Q894	L886-D890 PolarHBondContact O-N 2.95Å; L888-D890 VanDerWaalsContact C-N 3.34Å; L888-D890 PolarHBondContact O-N 3.15Å; D890-T893 PolarHBondContact O-OG1 3.24Å; D890-Q894 WeakPolarHBondContact O-CG 3.24Å; D890-Q894 PolarHBondContact O-NE2 2.86Å
891	R	43.8	Very low	34.4	Very low	78 Å²	78	106.4 Å²	106.4	29%	0.294	54%	0.541	S	S	.	.	H	α-helix	trans	-88	-28.8	175	-90	-168.2	170.4	173.6	-13.1	113.9	D372 K461 L888 F889	D372-R891 VanDerWaalsContact CG-NH2 3.35Å; D372-R891 IonicContact OD1-CZ 3.81Å; D372-R891 IonicContact OD1-NE 3.59Å; D372-R891 PolarHBondContact OD1-NE 2.96Å; D372-R891 IonicContact OD1-NH1 3.58Å; D372-R891 PolarHBondContact OD1-NH1 3.44Å; D372-R891 IonicContact OD1-NH2 3.76Å; D372-R891 PolarHBondContact OD1-NH2 3.35Å; D372-R891 IonicContact OD2-CZ 3.08Å; D372-R891 IonicContact OD2-NH1 2.76Å; D372-R891 PolarHBondContact OD2-NH1 2.88Å; D372-R891 IonicContact OD2-NH2 2.93Å; D372-R891 PolarHBondContact OD2-NH2 3.01Å; K461-R891 VanDerWaalsContact CE-CZ 3.44Å; L888-R891 PolarHBondContact O-N 3.13Å; F889-R891 PolarHBondContact O-N 2.88Å; F889-R891 VanDerWaalsContact O-N 3.12Å
892	V	40.2	Very low	34.5	Very low	35 Å²	35	104.9 Å²	104.9	21%	0.212	54%	0.538	C	S	.	.	H	α-helix	trans	-74.8	-30	179.4	178.4	0	0	0	0	111.4	V410 L888 F889	V410-V892 HydrophobicContact CG2-CG1 4.5Å; V410-V892 HydrophobicContact CG2-CG2 4.12Å; L888-V892 PolarHBondContact O-N 3.03Å; F889-V892 PolarHBondContact O-N 2.92Å
893	T	38.2	Very low	34.5	Very low	78 Å²	78	106 Å²	106	48%	0.479	54%	0.541	S	S	.	.	H	α-helix	trans	-78.5	-42.1	175.7	51.5	0	0	0	0	113	F889 D890 H895 N896	F889-T893 PolarHBondContact O-N 3.48Å; F889-T893 PolarHBondContact O-OG1 3.27Å; D890-T893 PolarHBondContact O-OG1 3.24Å; T893-H895 VanDerWaalsContact C-N 3.26Å; T893-H895 PolarHBondContact O-N 2.88Å; T893-H895 VanDerWaalsContact O-N 3.14Å; T893-N896 PolarHBondContact O-N 2.66Å; T893-N896 VanDerWaalsContact O-N 3.16Å
894	Q	40.8	Very low	34.3	Very low	139 Å²	139	112.1 Å²	112.1	65%	0.65	55%	0.552	S	S	*	*	H	α-helix	trans	-61.3	-24.9	-171.9	-79.1	172.9	19.2	0	0	115.3	D890	D890-Q894 WeakPolarHBondContact O-CG 3.24Å; D890-Q894 PolarHBondContact O-NE2 2.86Å
895	H	40.2	Very low	34	Very low	89 Å²	89	117.2 Å²	117.2	41%	0.412	57%	0.569	S	S	.	*	T	Hydrogen-bonded Turn	trans	-90.8	-10	179.6	-81	-90.1	0	0	0	114.9	T893	T893-H895 VanDerWaalsContact C-N 3.26Å; T893-H895 PolarHBondContact O-N 2.88Å; T893-H895 VanDerWaalsContact O-N 3.14Å
896	N	30.8	Very low	33.6	Very low	104 Å²	104	122.6 Å²	122.6	56%	0.556	60%	0.6	S	S	*	*	S	Bend	trans	-106.2	4	-174.9	-78.9	33	0	0	0	114.3	T893 F898	T893-N896 PolarHBondContact O-N 2.66Å; T893-N896 VanDerWaalsContact O-N 3.16Å; N896-F898 PolarHBondContact O-N 2.78Å
897	E	24.6	Very low	32.8	Very low	176 Å²	176	124.2 Å²	124.2	82%	0.822	60%	0.604	S	S	*	*			trans	-87.5	69.5	172.7	-67.1	-161	149	0	0	112.6
898	F	24.9	Very low	31.9	Very low	177 Å²	177	130 Å²	130	78%	0.776	63%	0.627	S	S	*	*			trans	-76.3	131.6	162.6	-92.4	-82.1	0	0	0	110.8	N896 F900	N896-F898 PolarHBondContact O-N 2.78Å; F898-F900 PolarHBondContact O-N 2.83Å
899	P	26.5	Very low	31	Very low	93 Å²	93	135.1 Å²	135.1	60%	0.604	66%	0.663	S	S	*	*			trans	-75	125.3	178.6	29.5	-33.6	0	0	0	111.3	E901	P899-E901 PolarHBondContact O-N 2.59Å
900	F	26.2	Very low	30.6	Very low	206 Å²	206	135.4 Å²	135.4	90%	0.904	68%	0.676	S	S	*	*			trans	-75.9	75.5	167.2	-111.6	-83	0	0	0	110.3	F898 M902	F898-F900 PolarHBondContact O-N 2.83Å; F900-M902 PolarHBondContact O-N 3.21Å
901	E	20.9	Very low	30	Very low	168 Å²	168	136.9 Å²	136.9	79%	0.785	69%	0.69	S	S	*	*			trans	-74.6	71.9	175.7	-170	161	-147.7	0	0	110.9	P899 T903	P899-E901 PolarHBondContact O-N 2.59Å; E901-T903 PolarHBondContact O-N 3.4Å
902	M	26.8	Very low	29.2	Very low	155 Å²	155	141.3 Å²	141.3	76%	0.764	72%	0.719	S	S	*	*			trans	-78.4	86.8	179.6	-164.3	176.2	-161.4	0	0	110.8	F900 R904	F900-M902 PolarHBondContact O-N 3.21Å; M902-R904 PolarHBondContact O-N 3.44Å
903	T	23.5	Very low	28.6	Very low	124 Å²	124	144.3 Å²	144.3	76%	0.761	74%	0.741	S	S	*	*			trans	-59.6	103.7	175.3	51.1	0	0	0	0	111.8	E901	E901-T903 PolarHBondContact O-N 3.4Å
904	R	27	Very low	28.4	Very low	217 Å²	217	146.3 Å²	146.3	82%	0.819	76%	0.755	S	S	*	*			trans	-125.5	107.8	156.2	-82	-164.5	170.5	-152.2	-2.2	110.2	M902 V906	M902-R904 PolarHBondContact O-N 3.44Å; R904-V906 PolarHBondContact O-N 3.48Å
905	Q	23	Very low	27.9	Very low	196 Å²	196	146.5 Å²	146.5	92%	0.916	76%	0.759	S	S	*	*			trans	-64.9	120.2	165.3	-67	174.7	-18.5	0	0	109.3
906	V	25.5	Very low	27.4	Very low	136 Å²	136	150.3 Å²	150.3	82%	0.824	78%	0.782	S	S	*	*			trans	-136.8	112.8	151.7	-177.1	0	0	0	0	106.6	R904	R904-V906 PolarHBondContact O-N 3.48Å
907	Q	24.8	Very low	27.3	Very low	160 Å²	160	153.5 Å²	153.5	75%	0.748	79%	0.793	S	S	*	*			trans	-78.5	137	167.6	-65.7	173.9	-46.3	0	0	108.6
908	F	28.3	Very low	27.7	Very low	199 Å²	199	148.6 Å²	148.6	87%	0.873	78%	0.783	S	S	*	*				173.8	158.4	119.7	-95.2	-66.2	0	0	0	111
909	S	27	Very low	28.2	Very low	110 Å²	110	145.9 Å²	145.9	77%	0.769	78%	0.783	S	S	*	*			trans	-93.1	151.7	-169.7	-54.6	0	0	0	0	113.5
910	P	32.6	Very low	28.2	Very low	118 Å²	118	147.3 Å²	147.3	77%	0.766	79%	0.794	S	S	*	*			trans	-70.3	172.9	163.7	34.8	-37.5	0	0	0	110.8
911	P	34.1	Very low	28.2	Very low	116 Å²	116	142.3 Å²	142.3	75%	0.753	79%	0.79	S	S	*	*			cis	-143.4	-179.9	26.2	44.1	-26	0	0	0	117.4
912	L	28.3	Very low	28.6	Very low	172 Å²	172	140 Å²	140	90%	0.901	79%	0.793	S	S	*	*			trans	-171.8	153.8	137	-107	167.9	0	0	0	111.8
913	S	26.6	Very low	28.7	Very low	97 Å²	97	140.6 Å²	140.6	68%	0.678	80%	0.798	S	S	*	*			trans	-159.9	142.2	169.6	55.9	0	0	0	0	112.9
914	P	34.4	Very low	29.2	Very low	120 Å²	120	139.7 Å²	139.7	78%	0.779	79%	0.794	S	S	*	*			trans	-114.6	125.5	154.5	33.5	-22.8	0	0	0	109.7
915	I	29.3	Very low	29.4	Very low	143 Å²	143	136.4 Å²	136.4	73%	0.733	79%	0.792	S	S	*	*				69	109.4	67.2	-61.4	169	0	0	0	112.8
916	L	30.2	Very low	29.6	Very low	170 Å²	170	132.9 Å²	132.9	89%	0.89	78%	0.78	S	S	*	*			trans	-151	91.2	143.3	-114.9	174.6	0	0	0	111.2
917	H	29.6	Very low	29.9	Very low	170 Å²	170	133.4 Å²	133.4	79%	0.787	78%	0.776	S	S	*	*			trans	38.5	144.1	154.3	-100	-84.9	0	0	0	125.5
918	A	32.9	Very low	30.3	Very low	73 Å²	73	132.4 Å²	132.4	60%	0.603	78%	0.782	S	S	*	*			trans	-122.4	165.7	149	0	0	0	0	0	109.7
919	P	35.7	Very low	30.4	Very low	121 Å²	121	127.2 Å²	127.2	79%	0.786	78%	0.775	S	S	*	*				-139.6	136.8	123.1	31.9	-16.6	0	0	0	111.9
920	C	26.2	Very low	30.6	Very low	123 Å²	123	131.6 Å²	131.6	83%	0.831	78%	0.784	S	S	*	*				82	93.4	62.8	-69.7	0	0	0	0	115.7
921	A	26.1	Very low	30.4	Very low	100 Å²	100	130.5 Å²	130.5	83%	0.826	78%	0.779	S	S	*	*			trans	61.1	118.3	138.7	0	0	0	0	0	122.6
922	S	29.6	Very low	30.3	Very low	120 Å²	120	131.9 Å²	131.9	84%	0.839	79%	0.785	S	S	*	*				-167.8	155.2	126.8	47.2	0	0	0	0	113.7
923	L	28.9	Very low	30.6	Very low	168 Å²	168	132.9 Å²	132.9	88%	0.88	78%	0.778	S	S	*	*			trans	-135.8	168	164.9	-80.8	173	0	0	0	105.3
924	P	33.9	Very low	30.7	Very low	105 Å²	105	134.4 Å²	134.4	68%	0.682	78%	0.778	S	S	*	*			cis	-140.2	-173	18.5	44	-24.8	0	0	0	116
925	L	29.9	Very low	30.5	Very low	147 Å²	147	135.7 Å²	135.7	77%	0.77	78%	0.778	S	S	*	*			trans	36.9	148.9	139.8	-63.9	165.6	0	0	0	121
926	D	28.3	Very low	30.9	Very low	123 Å²	123	135 Å²	135	66%	0.658	78%	0.782	S	S	*	*			cis	-166	179.3	16.4	-141.2	-32.7	0	0	0	113.4
927	I	31.8	Very low	30.8	Very low	146 Å²	146	135 Å²	135	75%	0.749	78%	0.783	S	S	*	*			trans	71.4	145	159.1	-63.3	154.4	0	0	0	115.8
928	T	32.7	Very low	30.9	Very low	140 Å²	140	138 Å²	138	86%	0.859	79%	0.788	S	S	*	*			cis	-128.8	173.9	13.5	-19.9	0	0	0	0	112.8
929	A	30.1	Very low	30.8	Very low	90 Å²	90	141.1 Å²	141.1	74%	0.744	79%	0.792	S	S	*	*			trans	-121.4	170.4	-173.5	0	0	0	0	0	115.6
930	Q	31.1	Very low	30.3	Very low	202 Å²	202	144.1 Å²	144.1	94%	0.944	80%	0.8	S	S	*	*			trans	-139.1	152.2	149.6	-101.6	-171.7	-1.6	0	0	109.9
931	S	28.1	Very low	30.3	Very low	95 Å²	95	142.4 Å²	142.4	66%	0.664	79%	0.79	S	S	*	*			trans	-148.3	155.1	-168.4	56.2	0	0	0	0	113
932	V	32.9	Very low	30.6	Very low	144 Å²	144	145.9 Å²	145.9	87%	0.873	79%	0.789	S	S	*	*			trans	-137.3	149.6	161.7	-177.5	0	0	0	0	108.6
933	Y	33.4	Very low	30.5	Very low	193 Å²	193	148.6 Å²	148.6	76%	0.757	79%	0.79	S	S	*	*			trans	-86.3	178.8	-169.4	-70.4	-104.2	0	0	0	112.3
934	D	29.9	Very low	30.4	Very low	129 Å²	129	147.2 Å²	147.2	69%	0.69	78%	0.784	S	S	*	*			cis	-159.9	172.8	18.4	-143.8	-15.6	0	0	0	116
935	L	30.1	Very low	30.2	Very low	148 Å²	148	149.5 Å²	149.5	78%	0.775	79%	0.789	S	S	*	*			trans	70.4	110.8	155.6	-110.5	70.6	0	0	0	122.2
936	P	37.3	Very low	30.2	Very low	127 Å²	127	146.7 Å²	146.7	83%	0.825	78%	0.781	S	S	*	*			trans	-121.5	-169.7	166.9	42.7	-31.3	0	0	0	114.6
937	D	28.1	Very low	30.3	Very low	170 Å²	170	147.5 Å²	147.5	91%	0.909	79%	0.786	S	S	*	*			trans	-60.1	161.6	-176	-90.1	-55.9	0	0	0	117.8
938	R	32.8	Very low	30.1	Very low	233 Å²	233	148 Å²	148	88%	0.879	79%	0.79	S	S	*	*			trans	-104.8	113.1	-170.2	-139.3	-170.5	179.6	-173.3	0.4	114.7
939	M	30.2	Very low	29.7	Very low	140 Å²	140	146.4 Å²	146.4	69%	0.69	78%	0.784	S	S	*	*			trans	64.7	102.6	148.5	-59.6	-101.9	63.9	0	0	120.1
940	L	24.3	Very low	29.5	Very low	184 Å²	184	147.4 Å²	147.4	96%	0.963	79%	0.786	S	S	*	*			trans	-139.1	100.9	141.7	-102.7	175.8	0	0	0	110.8
941	S	27.1	Very low	29.5	Very low	87 Å²	87	147.6 Å²	147.6	61%	0.608	78%	0.783	S	S	*	*			trans	-164.3	150.3	165.4	56.9	0	0	0	0	106.6
942	Q	32.2	Very low	29.5	Very low	173 Å²	173	151.5 Å²	151.5	81%	0.808	80%	0.796	S	S	*	*			cis	-133.6	143.4	34.9	-77.5	171	4.6	0	0	110.2
943	M	28	Very low	29.3	Very low	176 Å²	176	150.8 Å²	150.8	87%	0.867	79%	0.788	S	S	*	*				51.3	134.8	90.1	-76.5	-175.8	178.8	0	0	115
944	N	25.4	Very low	29.2	Very low	140 Å²	140	147.6 Å²	147.6	75%	0.749	78%	0.784	S	S	*	*			cis	-168.9	-177.2	-10.1	-161.6	1	0	0	0	109.5
945	I	31.2	Very low	29.1	Very low	153 Å²	153	150 Å²	150	79%	0.785	80%	0.795	S	S	*	*			trans	90.4	137.9	160.7	-57.9	156.1	0	0	0	118.5
946	S	29.9	Very low	29.1	Very low	88 Å²	88	149.3 Å²	149.3	62%	0.615	79%	0.791	S	S	*	*			trans	76	97.4	161.4	-163.8	0	0	0	0	120.1
947	D	29.4	Very low	28.8	Very low	140 Å²	140	150.1 Å²	150.1	75%	0.749	79%	0.789	S	S	*	*				70.4	146.9	120.3	-46.4	-40.6	0	0	0	124.5
948	D	27.8	Very low	29	Very low	156 Å²	156	152.3 Å²	152.3	83%	0.834	79%	0.79	S	S	*	*			trans	55.2	110.6	158.8	-71.9	-16.4	0	0	0	122.4
949	S	24.5	Very low	28.9	Very low	106 Å²	106	153 Å²	153	74%	0.741	79%	0.792	S	S	*	*			trans	-51.9	163.3	154	63	0	0	0	0	114.2
950	S	26	Very low	29.1	Very low	111 Å²	111	151 Å²	151	78%	0.776	79%	0.792	S	S	*	*			trans	85.4	81	172.5	79.9	0	0	0	0	117.4
951	K	31.1	Very low	29.6	Very low	206 Å²	206	149.5 Å²	149.5	90%	0.896	78%	0.784	S	S	*	*			trans	-151.8	38.9	150	-116.4	157.6	-157	163.4	0	116.3	N953	K951-N953 PolarHBondContact O-N 3.45Å
952	L	28.6	Very low	29.9	Very low	177 Å²	177	155.1 Å²	155.1	93%	0.927	80%	0.797	S	S	*	*	S	Bend	trans	-88.8	61.6	150.7	-160.5	101.3	0	0	0	109.8
953	N	28.3	Very low	29.9	Very low	130 Å²	130	149.7 Å²	149.7	70%	0.695	79%	0.787	S	S	*	*	S	Bend	trans	-155.8	137	168.4	-121.1	-27.2	0	0	0	110.8	K951	K951-N953 PolarHBondContact O-N 3.45Å
954	N	30.2	Very low	30.4	Very low	126 Å²	126	152 Å²	152	67%	0.674	79%	0.788	S	S	*	*			trans	59.2	69.1	170.2	-61.3	-32.3	0	0	0	117.9	I956	N954-I956 VanDerWaalsContact C-N 3.27Å
955	L	28.5	Very low	31.1	Very low	179 Å²	179	150.6 Å²	150.6	94%	0.937	79%	0.789	S	S	*	*			trans	-96.7	54.9	138.7	-131.2	171.6	0	0	0	110.2
956	I	30.5	Very low	31.4	Very low	133 Å²	133	147.6 Å²	147.6	68%	0.682	79%	0.787	S	S	*	*			trans	-92.6	108.2	167	-66.4	178.8	0	0	0	108.3	N954	N954-I956 VanDerWaalsContact C-N 3.27Å
957	N	30	Very low	31.7	Very low	145 Å²	145	148.7 Å²	148.7	78%	0.775	80%	0.795	S	S	*	*			trans	33.8	111.9	153.5	-64	-21.6	0	0	0	119.9
958	K	32.5	Very low	32.3	Very low	215 Å²	215	147.6 Å²	147.6	94%	0.935	80%	0.795	S	S	*	*			trans	-133.9	95.9	142.3	-82	-167.1	176.4	177.7	0	112.6
959	R	32.3	Very low	33.2	Very low	247 Å²	247	145.7 Å²	145.7	93%	0.932	79%	0.792	S	S	*	*			trans	-134.5	94.3	152.8	-113.8	-174.4	-179	-173	1.4	110.3
960	S	34	Very low	33.8	Very low	99 Å²	99	147.3 Å²	147.3	69%	0.692	80%	0.797	S	S	*	*			trans	35.8	117.5	152.3	-58.3	0	0	0	0	123.7
961	I	34.7	Very low	34.3	Very low	153 Å²	153	148.5 Å²	148.5	79%	0.785	79%	0.794	S	S	*	*				67.1	105.6	122.2	-57	164.2	0	0	0	119
962	K	32.4	Very low	34.6	Very low	205 Å²	205	149.7 Å²	149.7	89%	0.891	79%	0.793	S	S	*	*				178.6	137.6	101.9	-126.2	166.1	-177.7	178.2	0	114.2
963	G	32.4	Very low	35.2	Very low	58 Å²	58	149.2 Å²	149.2	60%	0.598	78%	0.783	S	S	*	*			trans	106.1	111.8	145.6	0	0	0	0	0	121.3
964	Y	39.1	Very low	35.8	Very low	226 Å²	226	148.2 Å²	148.2	89%	0.886	78%	0.778	S	S	*	*			trans	51.5	114.1	141.4	-56.3	-68.9	0	0	0	120.5
965	S	39.6	Very low	36.3	Very low	109 Å²	109	148.1 Å²	148.1	76%	0.762	78%	0.778	S	S	*	*				91.2	138.5	57.6	74.4	0	0	0	0	113.9
966	A	38.2	Very low	37	Very low	90 Å²	90	148.1 Å²	148.1	74%	0.744	77%	0.773	S	S	*	*			cis	-158.2	149.3	11.3	0	0	0	0	0	115.1
967	S	35.4	Very low	37.6	Very low	111 Å²	111	146.7 Å²	146.7	78%	0.776	78%	0.775	S	S	*	*				24.3	159.1	125.5	-66.7	0	0	0	0	124.5
968	P	42.5	Very low	38.3	Very low	118 Å²	118	151.1 Å²	151.1	77%	0.766	80%	0.799	S	S	*	*			cis	-143.9	-139.4	-25.5	46.3	-24	0	0	0	114
969	P	46.1	Very low	38.6	Very low	116 Å²	116	148 Å²	148	75%	0.753	79%	0.792	S	S	*	*			trans	-139.4	-162.3	-132.3	39.9	-12.8	0	0	0	116.7
970	V	38.3	Very low	38.9	Very low	140 Å²	140	142.7 Å²	142.7	85%	0.848	78%	0.784	S	S	*	*			trans	155.7	149.8	148.4	149.7	0	0	0	0	110.3
971	N	35.6	Very low	39.2	Very low	135 Å²	135	145.2 Å²	145.2	72%	0.722	79%	0.789	S	S	*	*			cis	-170.4	167.6	-35.7	-167.2	0.6	0	0	0	108.3
972	R	37.2	Very low	39.4	Very low	231 Å²	231	144.7 Å²	144.7	87%	0.872	79%	0.79	S	S	*	*			trans	84.3	156.7	172.7	-53.6	175.8	176.7	178.6	-1	118.4
973	K	40.9	Very low	39.9	Very low	167 Å²	167	140.9 Å²	140.9	73%	0.726	78%	0.783	S	S	*	*				-175.8	159.1	-50.6	-124.9	-178.9	158.3	-84.9	0	111.8
974	N	41.1	Very low	40.4	Very low	110 Å²	110	146.5 Å²	146.5	59%	0.588	80%	0.796	S	S	*	*			trans	78.1	98.4	153.9	-75.3	47.4	0	0	0	121.8
975	D	42.1	Very low	40.5	Very low	123 Å²	123	140.8 Å²	140.8	66%	0.658	79%	0.789	S	S	*	*				64.5	138.1	95.8	-48.1	-27.4	0	0	0	124.5
976	E	41.5	Very low	40.5	Very low	179 Å²	179	143.2 Å²	143.2	84%	0.836	79%	0.791	S	S	*	*			trans	93	107.8	138.3	-83.8	170.6	-177.9	0	0	124.9
977	S	43.3	Very low	40.7	Very low	103 Å²	103	147.7 Å²	147.7	72%	0.72	80%	0.795	S	S	*	*			trans	49.5	115.5	135.5	64.4	0	0	0	0	122.7
978	N	44.8	Very low	41.2	Very low	239 Å²	239	151 Å²	151	100%	1.278	80%	0.797	S	S	*	*				-156.1	0	103.8	-134.2	5.6	0	0	0	110.8

Retrieved 978 of 978 residues in 287.3 ms (Link to these results)

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