A0A087YAS1_POEFO Loading...

Pre-mRNA-splicing factor CWC22 homolog

AlphaFold DB , UniProt , Accession A0A087YAS1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,002 aa.

						>A0A087YAS1_POEFO|A0A087YAS1
MDSPVRSESSSPKQRERNGPSDDESSPGAQKPQPANAREKSSKKESSPEGSNKSKSSSASSSDGSSSDDDEHQRALVKIRSSVAQIPRARSKESDRSSSRETKRSREEDGSESKENNRSRSRERDGSKSKGRERSGSRSSREARSRSRSREQRRSRSRSRERGRSRSRSRGRERSRSKGRDRSRSRGRDRSRSRERDWNRDRFDRRRYARDRYDDRRDDRDRRFDRRANRDEDSERRRRGRSGSPPADKESAAGEEPPVKKKKEELDPILTRTGGAYIPPAKLRMMQQQITDKSSLAYQRMSWEALKKSINGLINKVNVSNIVNIIQELLQENIVRGRGLLARSVLQAQAASPIFTHVYASVVAIINSKFPQIGELILKRLILSFRRSYRRNLKQQCLTASKFVAHLINQNVAHEVLCLEMLTLLLERPTDDSVEVAISFLKECGLKLTEVSPRGINAIFERLRNILHESSIDKRVQYMIEVMFAIRKDGFKDHPVIPEGLDLVDEDDQFTHMLPLDDEYNPEDILNVFKLDPDFLENEEKYKTIKRDILDEGSSDSGEEGDGSDDEDEEEDENEEAGEDEKVTIFDKTEVNLVAFRRTIYLAIQSSLDFEECAHKLIKMDFPDSQTKELCNMILDCCAQQRTYEKFFGLLAGRFCLLKKEYMESFEAIFSEQYDTIHRLETNKLRNVARLFAHLLYTDSVPWSVLECIRMSEETTTSSSRIFVKILFQELCAYMGLPKLNQRLKDPTLQTFFEGLFPRDNPRNTRFAINFFTSIGLGGLTDELREHLKNAPKMIMTQNQEVESSDSSSSSSSSSSSESSSSDSSSDSDSDSSSSSSSSSNSDVDSKRKKKKRKGRVEEKKKKGKDKKKKEKVDKRRKGGRSDNDNDAEKQAKKDRRERERDLEERVRRDPRGRRREDRSEEEERQEEEQEGQRRKADRQRDDGSERDRGREGDRGRDRDGGRGREREYEEKREKERDGERDRERNKENRDRNREREERRRR
					

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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	33.7	Very low	36.1	Very low	225 Å²	225	138.5 Å²	138.5	100%	1.108	79%	0.786	S	S	*	*				0	118.1	0	-62.4	174.7	170.7	0	0	108.6
2	D	34.5	Very low	37.9	Very low	145 Å²	145	136.7 Å²	136.7	78%	0.775	78%	0.784	S	S	*	*			cis	-155.7	166.8	-16.2	-104.1	-52.7	0	0	0	110.9
3	S	33.7	Very low	37.6	Very low	98 Å²	98	138.4 Å²	138.4	69%	0.685	78%	0.777	S	S	*	*			trans	-74.3	162.4	174.5	-52.5	0	0	0	0	112.5
4	P	62.3	Low	37.5	Very low	129 Å²	129	138.6 Å²	138.6	84%	0.838	77%	0.768	S	S	*	*				-123.8	-170.8	104	6.9	13.9	0	0	0	113.5
5	V	39.8	Very low	37	Very low	117 Å²	117	142.2 Å²	142.2	71%	0.709	77%	0.766	S	S	*	*			trans	-152.7	167.7	-159.9	143.2	0	0	0	0	110.9
6	R	38.6	Very low	36.9	Very low	222 Å²	222	140 Å²	140	84%	0.838	75%	0.749	S	S	*	*			trans	84.5	157.9	166.3	-89.1	166.7	-171.7	-143.7	2.2	118
7	S	34.3	Very low	36.8	Very low	88 Å²	88	143.8 Å²	143.8	62%	0.615	75%	0.75	S	S	*	*			cis	-157.7	152.3	6.5	23.5	0	0	0	0	114.6
8	E	34.4	Very low	36.5	Very low	179 Å²	179	143.6 Å²	143.6	84%	0.836	75%	0.75	S	S	*	*			trans	68.5	157.3	149.6	-70.6	158.7	-146.5	0	0	118.2
9	S	30.4	Very low	36.4	Very low	97 Å²	97	139.8 Å²	139.8	68%	0.678	75%	0.749	S	S	*	*			cis	-150.4	166.9	19	67.4	0	0	0	0	115.9
10	S	30	Very low	37.5	Very low	110 Å²	110	139.2 Å²	139.2	77%	0.769	75%	0.753	S	S	*	*			trans	72.9	140	148.8	68.7	0	0	0	0	123.6
11	S	26	Very low	37.3	Very low	114 Å²	114	136.9 Å²	136.9	80%	0.797	75%	0.748	S	S	*	*			trans	-146.1	-154.3	168.6	-41.5	0	0	0	0	106
12	P	56.8	Low	37.4	Very low	116 Å²	116	133.7 Å²	133.7	75%	0.753	74%	0.735	S	S	*	*			cis	-110.8	-117.6	-33.8	18.4	5.1	0	0	0	112.2
13	K	34.2	Very low	37.3	Very low	159 Å²	159	134.3 Å²	134.3	69%	0.691	74%	0.739	S	S	*	*			cis	-171.4	123.8	0.2	-152.2	-172.5	-168.8	-158.1	0	116.2
14	Q	36.1	Very low	37.2	Very low	142 Å²	142	137.1 Å²	137.1	66%	0.664	74%	0.741	S	S	*	*			trans	66.4	171.8	146.3	-71.3	173.7	-29.7	0	0	119.1
15	R	31	Very low	35.7	Very low	192 Å²	192	135.6 Å²	135.6	73%	0.725	73%	0.733	S	S	*	*			cis	-164.2	133.9	27.7	-154.6	160.9	-178.9	-133.4	-23.3	118.5
16	E	35.2	Very low	35.3	Very low	107 Å²	107	135.7 Å²	135.7	50%	0.5	74%	0.739	S	S	.	*			trans	53.4	132.5	140.3	-68	174.1	-135.2	0	0	128.4
17	R	34.8	Very low	35.7	Very low	204 Å²	204	131.1 Å²	131.1	77%	0.77	74%	0.738	S	S	*	*				71.5	158	127.9	-68.7	-179.5	172.1	-163.8	-5.8	121.2
18	N	32.1	Very low	35.4	Very low	141 Å²	141	130.7 Å²	130.7	75%	0.754	75%	0.747	S	S	*	*			cis	-155.3	174.7	1.4	-117.3	6.4	0	0	0	111.6
19	G	33.4	Very low	35.1	Very low	71 Å²	71	126.8 Å²	126.8	73%	0.732	75%	0.746	S	S	*	*			trans	-86.8	-161.2	177.1	0	0	0	0	0	116.3
20	P	58.1	Low	35.2	Very low	128 Å²	128	131.7 Å²	131.7	83%	0.831	76%	0.758	S	S	*	*			cis	-149.3	-152.4	33.7	45.9	-23.7	0	0	0	117.9
21	S	33.5	Very low	35.3	Very low	91 Å²	91	136 Å²	136	64%	0.636	76%	0.763	S	S	*	*			trans	87	111.5	155.3	56.9	0	0	0	0	125.4
22	D	35.6	Very low	36.1	Very low	157 Å²	157	136.6 Å²	136.6	84%	0.84	76%	0.764	S	S	*	*				83	111.8	119.7	-49.4	-12.9	0	0	0	127.2
23	D	33	Very low	34.8	Very low	159 Å²	159	139.7 Å²	139.7	85%	0.85	77%	0.768	S	S	*	*				77.3	156.1	129.1	-115.1	-33.5	0	0	0	129.4
24	E	32.8	Very low	35.5	Very low	157 Å²	157	137.8 Å²	137.8	73%	0.734	77%	0.772	S	S	*	*			trans	80	106.4	159.2	-72.2	-113.5	67.5	0	0	125.5
25	S	30.2	Very low	35.1	Very low	96 Å²	96	135.3 Å²	135.3	67%	0.671	78%	0.776	S	S	*	*				67.6	106.9	121.4	-65.7	0	0	0	0	127.1
26	S	31.5	Very low	35	Very low	119 Å²	119	134 Å²	134	83%	0.832	78%	0.784	S	S	*	*				36.3	155.3	122.2	-85.1	0	0	0	0	123.8
27	P	45.6	Very low	34.7	Very low	127 Å²	127	133.7 Å²	133.7	83%	0.825	80%	0.799	S	S	*	*			cis	-153.3	165.9	40	42	-20.6	0	0	0	121.7
28	G	28.2	Very low	34.5	Very low	78 Å²	78	135 Å²	135	80%	0.804	80%	0.804	S	S	*	*			trans	93.4	152.6	144.5	0	0	0	0	0	120.6
29	A	29.6	Very low	34.4	Very low	97 Å²	97	136 Å²	136	80%	0.802	80%	0.804	S	S	*	*			cis	-163.5	126.5	-17.4	0	0	0	0	0	114.8
30	Q	30.8	Very low	34.3	Very low	200 Å²	200	141.7 Å²	141.7	94%	0.935	81%	0.809	S	S	*	*			trans	49.6	160.5	143.5	-65.9	-177.4	-10.3	0	0	126.3
31	K	32.3	Very low	32.8	Very low	201 Å²	201	140.6 Å²	140.6	87%	0.874	80%	0.804	S	S	*	*			trans	-96.4	-177.2	178.1	-67.2	-179.6	177.5	178.4	0	110.6
32	P	44.2	Very low	32.5	Very low	126 Å²	126	141.8 Å²	141.8	82%	0.818	81%	0.812	S	S	*	*			cis	-146	-149.2	20	44.9	-20.7	0	0	0	117.5
33	Q	28.5	Very low	32.2	Very low	182 Å²	182	143.7 Å²	143.7	85%	0.85	81%	0.813	S	S	*	*			trans	-87.1	-172.4	-174	-43.9	171.7	-48.7	0	0	113
34	P	49.1	Very low	32	Very low	119 Å²	119	144 Å²	144	77%	0.773	81%	0.807	S	S	*	*			cis	-140.8	-173.6	-2.5	43	-23.6	0	0	0	118
35	A	27.9	Very low	31.7	Very low	89 Å²	89	143.9 Å²	143.9	74%	0.736	81%	0.806	S	S	*	*			trans	94.8	115.1	147.7	0	0	0	0	0	123.3
36	N	29.1	Very low	31.4	Very low	166 Å²	166	144.1 Å²	144.1	89%	0.888	81%	0.808	S	S	*	*			trans	37.8	118.7	147.4	-67.1	-5.2	0	0	0	123.2
37	A	29.3	Very low	31.2	Very low	99 Å²	99	143.9 Å²	143.9	82%	0.818	81%	0.806	S	S	*	*				-176.4	136.4	100.9	0	0	0	0	0	115.4
38	R	29.2	Very low	31.2	Very low	231 Å²	231	143.6 Å²	143.6	87%	0.872	80%	0.804	S	S	*	*			trans	53	142.6	152	-87.5	-174.2	175.8	-179	-2.1	124.5
39	E	30.6	Very low	31.1	Very low	162 Å²	162	148.6 Å²	148.6	76%	0.757	81%	0.807	S	S	*	*			trans	81.9	104.8	151.4	-71.9	179.8	179.7	0	0	123.1
40	K	31	Very low	31	Very low	192 Å²	192	146.1 Å²	146.1	84%	0.835	79%	0.791	S	S	*	*			trans	57.5	75.4	140.6	-67	-175.1	176.3	178.4	0	120.3
41	S	27.7	Very low	31	Very low	105 Å²	105	141.8 Å²	141.8	73%	0.734	78%	0.783	S	S	*	*				0.4	147.8	115.1	57.9	0	0	0	0	118.6
42	S	27.5	Very low	30.8	Very low	116 Å²	116	138.1 Å²	138.1	81%	0.811	77%	0.773	S	S	*	*			cis	-176.2	162	-1.7	43.5	0	0	0	0	111.3
43	K	28.6	Very low	30.2	Very low	196 Å²	196	140.9 Å²	140.9	85%	0.852	77%	0.772	S	S	*	*			trans	-130	122.5	169.2	-150.5	178	-169.6	178.6	0	110.1
44	K	27.9	Very low	30.2	Very low	167 Å²	167	136.8 Å²	136.8	73%	0.726	76%	0.763	S	S	*	*			trans	61.3	146.7	163.7	-88.5	172.9	150.3	-106.6	0	121.1
45	E	26.9	Very low	29.2	Very low	154 Å²	154	140.6 Å²	140.6	72%	0.72	77%	0.767	S	S	*	*			trans	70.4	148.9	150	-79.8	149.8	-127.9	0	0	118.9
46	S	24.6	Very low	29.3	Very low	100 Å²	100	141.2 Å²	141.2	70%	0.699	77%	0.766	S	S	*	*			cis	-160	156.2	5.7	46.4	0	0	0	0	114.2
47	S	27.3	Very low	29.3	Very low	115 Å²	115	138.6 Å²	138.6	80%	0.804	76%	0.761	S	S	*	*			trans	57.5	179.1	144.3	-62.7	0	0	0	0	120.4
48	P	45.3	Very low	29.2	Very low	121 Å²	121	139.3 Å²	139.3	79%	0.786	76%	0.76	S	S	*	*			cis	-110	-152.8	-13.6	36.8	-17.6	0	0	0	111.2
49	E	26.3	Very low	29.1	Very low	183 Å²	183	132.9 Å²	132.9	86%	0.855	76%	0.756	S	S	*	*			cis	-149.2	179.1	-1	-119.7	-129.8	103.7	0	0	107.5
50	G	28	Very low	29	Very low	45 Å²	45	130.3 Å²	130.3	46%	0.464	76%	0.756	S	S	.	*			cis	174.6	134.1	-0.5	0	0	0	0	0	114.6
51	S	29.7	Very low	28.9	Very low	109 Å²	109	126.3 Å²	126.3	76%	0.762	75%	0.753	S	S	*	*			trans	70.3	156.5	169.3	90.2	0	0	0	0	118.3
52	N	29.5	Very low	28.9	Very low	124 Å²	124	126.9 Å²	126.9	66%	0.663	76%	0.757	S	S	*	*			cis	-159.6	133.1	7.1	-140.2	-33.2	0	0	0	113.6
53	K	30.4	Very low	28.9	Very low	184 Å²	184	129.5 Å²	129.5	80%	0.8	76%	0.762	S	S	*	*			trans	61.5	147.5	158.6	-71.5	161.8	-172.7	175.5	0	120.5
54	S	29.6	Very low	28.9	Very low	96 Å²	96	124.1 Å²	124.1	67%	0.671	76%	0.761	S	S	*	*			cis	-172.1	144.9	-12.6	52.8	0	0	0	0	114.5
55	K	27.9	Very low	29	Very low	198 Å²	198	122.2 Å²	122.2	86%	0.861	77%	0.769	S	S	*	*			trans	65.8	122	158.7	-67.2	-179.7	178.6	-176.2	0	117.8
56	S	29	Very low	29.2	Very low	102 Å²	102	119.9 Å²	119.9	71%	0.713	77%	0.77	S	S	*	*			cis	94.9	137.1	38.3	72.2	0	0	0	0	114.4
57	S	28.9	Very low	29.3	Very low	111 Å²	111	120.1 Å²	120.1	78%	0.776	77%	0.772	S	S	*	*			cis	175.9	128.2	-14.3	47.7	0	0	0	0	112.4
58	S	26.7	Very low	29.4	Very low	114 Å²	114	120.8 Å²	120.8	80%	0.797	77%	0.766	S	S	*	*			trans	179	128.5	160.2	49.9	0	0	0	0	109.2
59	A	28.8	Very low	29.1	Very low	96 Å²	96	122.2 Å²	122.2	79%	0.793	77%	0.767	S	S	*	*				68.3	133.5	62.1	0	0	0	0	0	113.5
60	S	28.4	Very low	29.5	Very low	108 Å²	108	120.1 Å²	120.1	76%	0.755	76%	0.762	S	S	*	*			cis	-165.9	154.9	-4	47.2	0	0	0	0	113.2
61	S	27.3	Very low	29.9	Very low	109 Å²	109	125.9 Å²	125.9	76%	0.762	78%	0.777	S	S	*	*			trans	-11.2	140.8	162.2	56.2	0	0	0	0	122.4
62	S	28.9	Very low	30.3	Very low	117 Å²	117	128.4 Å²	128.4	82%	0.818	78%	0.776	S	S	*	*			trans	-164.6	151	134.3	44	0	0	0	0	112.6
63	D	27.1	Very low	30.7	Very low	171 Å²	171	130.2 Å²	130.2	91%	0.914	78%	0.781	S	S	*	*			trans	-86.6	168.1	-173.4	-47.8	-91.3	0	0	0	115
64	G	27.6	Very low	31	Very low	82 Å²	82	131.1 Å²	131.1	85%	0.845	78%	0.779	S	S	*	*			trans	157.9	100.6	163	0	0	0	0	0	116.8
65	S	30.5	Very low	31.3	Very low	127 Å²	127	129.5 Å²	129.5	89%	0.888	77%	0.772	S	S	*	*			trans	-87.8	171.2	169	55.4	0	0	0	0	111.4
66	S	30.7	Very low	31.7	Very low	105 Å²	105	126.3 Å²	126.3	73%	0.734	76%	0.763	S	S	*	*			cis	-163.6	145	-9.3	148.4	0	0	0	0	108.6
67	S	27.8	Very low	32.2	Very low	106 Å²	106	126.9 Å²	126.9	74%	0.741	76%	0.762	S	S	*	*			trans	-158.6	119.5	158.7	-49.6	0	0	0	0	112.2
68	D	29.7	Very low	32.5	Very low	129 Å²	129	130 Å²	130	69%	0.69	76%	0.762	S	S	*	*			trans	62.1	100.5	136.7	-44.2	-13.5	0	0	0	122.1	D70	D68-D70 PolarHBondContact O-N 3.17Å
69	D	39	Very low	32.8	Very low	150 Å²	150	131.2 Å²	131.2	80%	0.802	76%	0.758	S	S	*	*				62.8	-24.4	128.1	-64.2	-53.5	0	0	0	124.3	E71	D69-E71 VanDerWaalsContact C-N 3.29Å; D69-E71 PolarHBondContact O-N 3.36Å; D69-E71 VanDerWaalsContact O-N 3.11Å
70	D	34.9	Very low	33.1	Very low	140 Å²	140	138 Å²	138	75%	0.749	76%	0.763	S	S	*	*	S	Bend	trans	-75.3	-4.7	-163.7	-130	-33	0	0	0	116	D68	D68-D70 PolarHBondContact O-N 3.17Å
71	E	35.5	Very low	33.4	Very low	165 Å²	165	137.5 Å²	137.5	77%	0.771	76%	0.759	S	S	*	*	S	Bend	trans	-100.2	-32.3	-170.5	-160.2	154.5	-133.9	0	0	115.1	D69 Q73 R74	D69-E71 VanDerWaalsContact C-N 3.29Å; D69-E71 PolarHBondContact O-N 3.36Å; D69-E71 VanDerWaalsContact O-N 3.11Å; E71-Q73 VanDerWaalsContact C-N 3.32Å; E71-Q73 PolarHBondContact O-N 2.68Å; E71-R74 PolarHBondContact O-N 3.37Å; E71-R74 VanDerWaalsContact O-N 3.13Å
72	H	37.6	Very low	33.6	Very low	163 Å²	163	137 Å²	137	76%	0.755	76%	0.756	S	S	*	*	H	α-helix	trans	-63.8	-33.4	-176.7	-96.9	-88.8	0	0	0	113.7	R74 A75	H72-R74 PolarHBondContact O-N 3.11Å; H72-A75 PolarHBondContact O-N 2.88Å
73	Q	38.7	Very low	33.7	Very low	162 Å²	162	138.6 Å²	138.6	76%	0.757	76%	0.761	S	S	*	*	H	α-helix	trans	-74.7	-12.3	179.7	-65.6	-175.4	0.2	0	0	113.4	E71	E71-Q73 VanDerWaalsContact C-N 3.32Å; E71-Q73 PolarHBondContact O-N 2.68Å
74	R	36.4	Very low	33.7	Very low	202 Å²	202	134.8 Å²	134.8	76%	0.762	75%	0.753	S	S	*	*	H	α-helix	trans	-89	-20.5	175.7	-74.3	-178.3	167.7	-122.3	-5.7	114	E71 H72	E71-R74 PolarHBondContact O-N 3.37Å; E71-R74 VanDerWaalsContact O-N 3.13Å; H72-R74 PolarHBondContact O-N 3.11Å
75	A	36.3	Very low	33.7	Very low	63 Å²	63	139.1 Å²	139.1	52%	0.521	75%	0.751	S	S	.	*	H	α-helix	trans	-70.4	-47.8	175.3	0	0	0	0	0	112	H72 V77 K78	H72-A75 PolarHBondContact O-N 2.88Å; A75-V77 VanDerWaalsContact C-N 3.28Å; A75-V77 PolarHBondContact O-N 3.09Å; A75-K78 PolarHBondContact O-N 3.29Å
76	L	36.2	Very low	33.6	Very low	130 Å²	130	140 Å²	140	68%	0.681	74%	0.744	S	S	*	*	G	3₁₀ helix	trans	-65.3	-24.6	-172.3	-69.9	169.6	0	0	0	114.5	K78	L76-K78 VanDerWaalsContact C-N 3.28Å; L76-K78 PolarHBondContact O-N 3.4Å
77	V	38.7	Very low	34	Very low	114 Å²	114	140.3 Å²	140.3	69%	0.691	74%	0.744	S	S	*	*	G	3₁₀ helix	trans	-73.1	-19.6	179.7	179.6	0	0	0	0	112.4	A75	A75-V77 VanDerWaalsContact C-N 3.28Å; A75-V77 PolarHBondContact O-N 3.09Å
78	K	35.2	Very low	33.9	Very low	176 Å²	176	147.3 Å²	147.3	77%	0.765	75%	0.754	S	S	*	*	G	3₁₀ helix	trans	-92.9	-9.1	-170.8	-127	178.5	-177.1	-177.7	0	115.9	A75 L76	A75-K78 PolarHBondContact O-N 3.29Å; L76-K78 VanDerWaalsContact C-N 3.28Å; L76-K78 PolarHBondContact O-N 3.4Å
79	I	34.3	Very low	33.8	Very low	140 Å²	140	146.1 Å²	146.1	72%	0.718	76%	0.762	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.8	-26.8	-179.7	-62.3	177.4	0	0	0	111.5	S81	I79-S81 PolarHBondContact O-N 3.33Å
80	R	34.2	Very low	33.3	Very low	238 Å²	238	151 Å²	151	90%	0.898	77%	0.769	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79	34.2	-178.2	-73	-175.1	164.8	179	-5	114.9
81	S	35.2	Very low	33	Very low	98 Å²	98	149.9 Å²	149.9	69%	0.685	77%	0.773	S	S	*	*	T	Hydrogen-bonded Turn	trans	-145.9	13	-173.7	67.8	0	0	0	0	118.1	I79	I79-S81 PolarHBondContact O-N 3.33Å
82	S	31.4	Very low	32.7	Very low	100 Å²	100	151.5 Å²	151.5	70%	0.699	78%	0.777	S	S	*	*			trans	-145.3	36.7	-170.7	64.9	0	0	0	0	118.1
83	V	30.6	Very low	32.1	Very low	150 Å²	150	152.3 Å²	152.3	91%	0.909	78%	0.781	S	S	*	*			trans	-135.5	82.8	161	-172	0	0	0	0	110.9
84	A	27.3	Very low	31.6	Very low	91 Å²	91	149 Å²	149	75%	0.752	78%	0.776	S	S	*	*			trans	-159.5	96.7	167.2	0	0	0	0	0	111.6
85	Q	28.4	Very low	31.1	Very low	172 Å²	172	146.6 Å²	146.6	80%	0.804	78%	0.778	S	S	*	*			trans	160.1	124.1	134.3	-89.1	173.6	28.8	0	0	114
86	I	27.1	Very low	30.6	Very low	145 Å²	145	155.7 Å²	155.7	74%	0.744	80%	0.799	S	S	*	*			trans	70.7	141.6	135	-59.7	169.9	0	0	0	118
87	P	38.7	Very low	30.1	Very low	112 Å²	112	155.2 Å²	155.2	73%	0.727	81%	0.806	S	S	*	*			cis	-126.4	176.1	-19.2	36.1	-19.6	0	0	0	114.3
88	R	26.6	Very low	29.4	Very low	254 Å²	254	154.5 Å²	154.5	96%	0.958	81%	0.807	S	S	*	*			trans	-112.8	134.8	149.3	-98.4	-175	171	178.4	-2.2	109.8
89	A	28.3	Very low	28.9	Very low	103 Å²	103	150.7 Å²	150.7	85%	0.851	80%	0.802	S	S	*	*			trans	-89	165.4	-178.4	0	0	0	0	0	112.5
90	R	28.1	Very low	28.5	Very low	252 Å²	252	153.8 Å²	153.8	95%	0.951	81%	0.805	S	S	*	*			trans	-127.6	137.8	-175.4	-144.9	-176.4	-170.3	-159	3.1	110.6
91	S	28	Very low	28.1	Very low	118 Å²	118	148.4 Å²	148.4	83%	0.825	79%	0.79	S	S	*	*			trans	-155.3	156.6	172.8	49.1	0	0	0	0	112.5
92	K	28.5	Very low	27.6	Very low	198 Å²	198	148.8 Å²	148.8	86%	0.861	79%	0.788	S	S	*	*			cis	-171.7	119	-35.4	-163.1	-176.7	-175.3	-172.1	0	108.5
93	E	25.8	Very low	27.5	Very low	181 Å²	181	151.8 Å²	151.8	85%	0.846	79%	0.789	S	S	*	*			trans	-166.6	116.5	162.1	-107.8	162.9	-165.7	0	0	106.8
94	S	27.8	Very low	27.4	Very low	93 Å²	93	155.4 Å²	155.4	65%	0.65	79%	0.786	S	S	*	*				70.6	131.9	88.3	82.6	0	0	0	0	113.3
95	D	26.3	Very low	27.5	Very low	150 Å²	150	156 Å²	156	80%	0.802	79%	0.785	S	S	*	*			cis	173.4	132.5	-14.1	-116.9	-39.6	0	0	0	105.1
96	R	25.2	Very low	27.6	Very low	254 Å²	254	156.9 Å²	156.9	96%	0.958	78%	0.781	S	S	*	*			trans	168.6	158.3	136.8	-94.1	164	-173.8	-161.3	0.9	113.4
97	S	25.9	Very low	27.9	Very low	120 Å²	120	155.7 Å²	155.7	84%	0.839	77%	0.772	S	S	*	*			trans	-125.8	138	-167.6	49.1	0	0	0	0	113
98	S	23.9	Very low	27.7	Very low	100 Å²	100	158 Å²	158	70%	0.699	77%	0.773	S	S	*	*			trans	-174.5	131.6	150.5	-166.7	0	0	0	0	106.4
99	S	25.2	Very low	28	Very low	95 Å²	95	153.5 Å²	153.5	66%	0.664	77%	0.768	S	S	*	*			cis	80	136.7	35.1	102.4	0	0	0	0	114.5
100	R	26.2	Very low	28	Very low	205 Å²	205	151.3 Å²	151.3	77%	0.774	76%	0.756	S	S	*	*			trans	70.7	149	169.1	-63.2	-170.8	120.8	119	17.9	117.6
101	E	25.2	Very low	28.3	Very low	125 Å²	125	145 Å²	145	58%	0.584	75%	0.75	S	S	*	*			cis	-169.7	147.7	-21	-117.6	167.1	-171.3	0	0	110.5
102	T	25.2	Very low	28.3	Very low	106 Å²	106	148 Å²	148	65%	0.65	75%	0.751	S	S	*	*			trans	66	158.7	149.6	63	0	0	0	0	120.5
103	K	28.4	Very low	28.4	Very low	163 Å²	163	142.9 Å²	142.9	71%	0.709	74%	0.74	S	S	*	*			cis	-162.8	139.6	-11.9	-113.4	160.4	-168.6	162.5	0	110.8
104	R	29.4	Very low	28.7	Very low	226 Å²	226	143 Å²	143	85%	0.853	74%	0.738	S	S	*	*			trans	57.5	147.9	137	-70.5	179.1	-179.6	-173.2	-3	120.1
105	S	29.8	Very low	28.8	Very low	105 Å²	105	146.1 Å²	146.1	73%	0.734	74%	0.742	S	S	*	*			cis	-163.5	-157.4	-2.7	39	0	0	0	0	108.1
106	R	31.2	Very low	28.9	Very low	189 Å²	189	145 Å²	145	71%	0.713	74%	0.736	S	S	*	*			cis	-167.9	135.9	14.6	-166.5	-174.7	177.7	-139.3	-19.7	111.1
107	E	33.2	Very low	29	Very low	120 Å²	120	139.3 Å²	139.3	56%	0.561	73%	0.725	S	S	*	*			trans	57.2	152.7	156.6	-73.6	151.8	-150.2	0	0	119.5
108	E	33.9	Very low	29.1	Very low	160 Å²	160	144.4 Å²	144.4	75%	0.748	73%	0.726	S	S	*	*			cis	-152.3	169	0.7	-136	155.7	-143	0	0	112.4
109	D	31.7	Very low	29.3	Very low	161 Å²	161	144.7 Å²	144.7	86%	0.861	73%	0.728	S	S	*	*			trans	-2.6	156.4	173.8	-72.6	-25	0	0	0	124.7
110	G	29.7	Very low	29.5	Very low	57 Å²	57	151.3 Å²	151.3	59%	0.588	74%	0.738	S	S	*	*			cis	162.2	159.6	-5.2	0	0	0	0	0	115.6
111	S	33.8	Very low	29.5	Very low	119 Å²	119	146.3 Å²	146.3	83%	0.832	73%	0.734	S	S	*	*			trans	64.5	148.2	167.5	73.4	0	0	0	0	119.6
112	E	28.8	Very low	29.7	Very low	181 Å²	181	150.3 Å²	150.3	85%	0.846	74%	0.744	S	S	*	*			cis	-157.4	175	-13.7	-121.3	-173.4	152.6	0	0	113.9
113	S	30.8	Very low	29.9	Very low	90 Å²	90	152.7 Å²	152.7	63%	0.629	75%	0.748	S	S	*	*			trans	-41.9	168.7	176.2	56.7	0	0	0	0	121
114	K	31.5	Very low	29.8	Very low	185 Å²	185	156.8 Å²	156.8	80%	0.804	76%	0.759	S	S	*	*			cis	-165.7	148.4	-2.7	-116.4	166.5	-176.1	173.8	0	113.5
115	E	28.9	Very low	29.8	Very low	157 Å²	157	153.6 Å²	153.6	73%	0.734	76%	0.759	S	S	*	*			trans	26	140.9	141.3	-72.3	-172.1	-145.6	0	0	127.9
116	N	29.5	Very low	29.7	Very low	126 Å²	126	152.2 Å²	152.2	67%	0.674	76%	0.761	S	S	*	*			trans	72.3	94.8	132.9	-77.6	-47.5	0	0	0	125.3
117	N	27.7	Very low	29.5	Very low	136 Å²	136	149.5 Å²	149.5	73%	0.727	77%	0.771	S	S	*	*				53.1	142.7	100.1	-149.2	-4.7	0	0	0	123
118	R	27.4	Very low	29.4	Very low	226 Å²	226	153.4 Å²	153.4	85%	0.853	79%	0.786	S	S	*	*			trans	97.7	121.5	160.3	-63.8	-176.3	171.6	163.6	-1.6	122.2
119	S	28.8	Very low	29.2	Very low	106 Å²	106	150.7 Å²	150.7	74%	0.741	79%	0.785	S	S	*	*			trans	-53.4	152.3	169.5	42.9	0	0	0	0	120.2
120	R	27.5	Very low	29.3	Very low	234 Å²	234	153.1 Å²	153.1	88%	0.883	79%	0.788	S	S	*	*				175.5	138.7	121.9	-99.8	173.6	174	167.8	-1.4	117.4
121	S	28	Very low	29.2	Very low	100 Å²	100	154.2 Å²	154.2	70%	0.699	80%	0.799	S	S	*	*			trans	55.3	128.6	132.2	-55.8	0	0	0	0	126.3
122	R	28.6	Very low	29	Very low	209 Å²	209	158.6 Å²	158.6	79%	0.789	80%	0.797	S	S	*	*			trans	83.5	122.7	133.8	-80.8	-171.1	162.4	135.8	3.2	124.4
123	E	28.7	Very low	29.1	Very low	157 Å²	157	155.1 Å²	155.1	73%	0.734	78%	0.781	S	S	*	*				55.9	122.8	128.6	-63.9	163.2	-146.8	0	0	122.6
124	R	27.3	Very low	29	Very low	248 Å²	248	161 Å²	161	94%	0.936	79%	0.789	S	S	*	*			trans	-165.5	167.2	131.8	-117.9	178.1	-179.9	-166.2	-1.1	116.1
125	D	29	Very low	29	Very low	160 Å²	160	157.2 Å²	157.2	86%	0.856	79%	0.786	S	S	*	*			trans	-70.4	154	-170	-72.7	-83.3	0	0	0	118.5
126	G	27	Very low	28.9	Very low	75 Å²	75	153 Å²	153	77%	0.773	78%	0.784	S	S	*	*			trans	-91.6	-162.6	175.9	0	0	0	0	0	117.4
127	S	28.8	Very low	28.8	Very low	132 Å²	132	152.6 Å²	152.6	92%	0.923	79%	0.792	S	S	*	*			trans	-160.7	173.3	173.6	49.6	0	0	0	0	112
128	K	30.6	Very low	28.8	Very low	203 Å²	203	157.4 Å²	157.4	88%	0.883	80%	0.799	S	S	*	*			trans	-103	161.8	-163.1	-56.3	167.3	179.1	168.8	0	113.4
129	S	29.8	Very low	28.8	Very low	103 Å²	103	152 Å²	152	72%	0.72	80%	0.796	S	S	*	*				177.8	146.5	111	51.6	0	0	0	0	115.7
130	K	32.4	Very low	28.8	Very low	212 Å²	212	151.7 Å²	151.7	92%	0.922	79%	0.794	S	S	*	*			trans	46.2	126.4	152.2	-58.6	160.9	-176.1	175.1	0	118.1
131	G	27.5	Very low	28.8	Very low	79 Å²	79	150.6 Å²	150.6	81%	0.814	79%	0.79	S	S	*	*			cis	-178.9	-157.2	5.2	0	0	0	0	0	108.6
132	R	31.1	Very low	28.7	Very low	212 Å²	212	153.6 Å²	153.6	80%	0.8	79%	0.793	S	S	*	*			cis	-160.9	164.8	-6.9	-152.9	-174.9	167.7	177.6	-4.5	111
133	E	30.4	Very low	28.7	Very low	108 Å²	108	147.5 Å²	147.5	51%	0.505	79%	0.788	S	S	.	*			trans	-14.1	146.7	160.2	-66	172.1	-106.8	0	0	119.8
134	R	29.5	Very low	28.6	Very low	213 Å²	213	151.7 Å²	151.7	80%	0.804	80%	0.797	S	S	*	*			cis	-169.9	-168.4	13.7	-112.9	-177.5	-130.4	-158.7	3.3	107.8
135	S	29.7	Very low	28.6	Very low	105 Å²	105	144.2 Å²	144.2	73%	0.734	78%	0.783	S	S	*	*				179.1	148	-52.3	58.7	0	0	0	0	108.5
136	G	26.8	Very low	28.5	Very low	68 Å²	68	147.7 Å²	147.7	70%	0.701	78%	0.784	S	S	*	*			cis	168.9	-173	-1.1	0	0	0	0	0	112.7
137	S	28.6	Very low	28.6	Very low	118 Å²	118	148.5 Å²	148.5	83%	0.825	78%	0.778	S	S	*	*			trans	63.3	116.2	161.5	54.5	0	0	0	0	124.6
138	R	27.7	Very low	28.7	Very low	237 Å²	237	153.6 Å²	153.6	89%	0.894	78%	0.776	S	S	*	*				54.4	111.4	128.5	-68	-174.8	176.4	174.5	-1	123.8
139	S	28.1	Very low	28.6	Very low	112 Å²	112	148.9 Å²	148.9	78%	0.783	77%	0.769	S	S	*	*				58.9	134.6	127	68.1	0	0	0	0	124.7
140	S	27.5	Very low	28.6	Very low	101 Å²	101	154.5 Å²	154.5	71%	0.706	78%	0.775	S	S	*	*			trans	112.3	114.8	137.2	-160.8	0	0	0	0	120.3
141	R	27.9	Very low	28.5	Very low	211 Å²	211	151.5 Å²	151.5	80%	0.796	76%	0.764	S	S	*	*			trans	65.5	123	144.1	-71.5	-179.8	-175	-164.6	5.1	123.7
142	E	26.9	Very low	28.6	Very low	163 Å²	163	154 Å²	154	76%	0.762	75%	0.754	S	S	*	*				83.6	124.1	127.9	-70.6	-177.4	91.2	0	0	124.2
143	A	27	Very low	28.4	Very low	81 Å²	81	153.9 Å²	153.9	67%	0.669	75%	0.754	S	S	*	*			trans	99.6	119	130.8	0	0	0	0	0	122.8
144	R	27.2	Very low	28.3	Very low	244 Å²	244	160.1 Å²	160.1	92%	0.921	77%	0.773	S	S	*	*			trans	73.6	150.3	139.5	-68.6	170.9	-173.2	-176.4	2.7	117.4
145	S	28	Very low	28.2	Very low	92 Å²	92	155.4 Å²	155.4	64%	0.643	77%	0.773	S	S	*	*			cis	-169.9	177.5	-7.7	50.7	0	0	0	0	112.6
146	R	26	Very low	28.1	Very low	233 Å²	233	161.7 Å²	161.7	88%	0.879	78%	0.78	S	S	*	*			trans	89	148.1	163.9	-60	170.4	174.5	155.8	-2.6	118
147	S	29.6	Very low	28.1	Very low	92 Å²	92	163.3 Å²	163.3	64%	0.643	78%	0.78	S	S	*	*			cis	-179.1	159.2	-36.6	52.7	0	0	0	0	112.8
148	R	29.6	Very low	28	Very low	238 Å²	238	168.9 Å²	168.9	90%	0.898	78%	0.783	S	S	*	*			trans	87.3	145.3	161.5	-64	179.1	177.1	175.6	-1.8	117.5
149	S	29.9	Very low	28	Very low	105 Å²	105	163.2 Å²	163.2	73%	0.734	78%	0.78	S	S	*	*			cis	-170.2	172.3	-9.1	45.8	0	0	0	0	114.3
150	R	28.2	Very low	28	Very low	221 Å²	221	169 Å²	169	83%	0.834	79%	0.785	S	S	*	*			trans	83.6	112.7	177.5	-68.3	-178	163	152.6	-2.6	115.1
151	E	30.5	Very low	28	Very low	149 Å²	149	171.4 Å²	171.4	70%	0.696	79%	0.785	S	S	*	*				86.7	137.6	62.2	-78.2	-168.8	103.5	0	0	112.5
152	Q	31	Very low	28	Very low	130 Å²	130	171.9 Å²	171.9	61%	0.607	79%	0.787	S	S	*	*			cis	-157.3	165.3	5.2	-127	-176.1	65.4	0	0	106.5
153	R	27.3	Very low	28	Very low	211 Å²	211	167.5 Å²	167.5	80%	0.796	79%	0.785	S	S	*	*			cis	-135.6	-178.4	15.5	-66	-170.4	169.9	150.2	4.1	108.5
154	R	27.9	Very low	28	Very low	239 Å²	239	175.1 Å²	175.1	90%	0.902	80%	0.797	S	S	*	*			cis	70.4	133.2	35.8	-51.9	-176.2	177.2	178	-0.5	115.2
155	S	27.5	Very low	28.1	Very low	114 Å²	114	168.8 Å²	168.8	80%	0.797	79%	0.79	S	S	*	*			cis	-156.2	160.5	3.8	38.8	0	0	0	0	109.8
156	R	26.9	Very low	28	Very low	237 Å²	237	175.9 Å²	175.9	89%	0.894	80%	0.802	S	S	*	*			cis	99.7	93.7	26.3	-141.5	-177.1	-157.3	-171.6	7.4	116.7
157	S	27.6	Very low	28.1	Very low	101 Å²	101	169.8 Å²	169.8	71%	0.706	80%	0.795	S	S	*	*			trans	87.2	141.1	135.7	74.6	0	0	0	0	126
158	R	26.4	Very low	28	Very low	235 Å²	235	176.5 Å²	176.5	89%	0.887	81%	0.807	S	S	*	*			trans	96	145.2	143.8	-80.8	173.7	175.3	179.4	-1.5	123.3
159	S	27.5	Very low	27.9	Very low	119 Å²	119	169.5 Å²	169.5	83%	0.832	79%	0.794	S	S	*	*			trans	65.1	161.8	160.1	32.1	0	0	0	0	120.1
160	R	27.1	Very low	27.8	Very low	234 Å²	234	176.4 Å²	176.4	88%	0.883	80%	0.804	S	S	*	*			cis	-174.8	156.5	-45.5	-137.4	-177.2	-172	179.9	2.2	108
161	E	27.1	Very low	27.8	Very low	151 Å²	151	169.3 Å²	169.3	71%	0.706	80%	0.8	S	S	*	*			trans	69	161.2	178.4	-57.1	-168.5	-163	0	0	115.7
162	R	27.9	Very low	27.6	Very low	220 Å²	220	173.2 Å²	173.2	83%	0.83	81%	0.808	S	S	*	*			cis	-156.3	137.2	15.7	-157.3	171.8	-114.9	-159.5	-5.2	115
163	G	26.9	Very low	27.5	Very low	71 Å²	71	173.2 Å²	173.2	73%	0.732	81%	0.808	S	S	*	*			trans	78.9	158.2	159.5	0	0	0	0	0	118.5
164	R	27.9	Very low	27.5	Very low	242 Å²	242	173.7 Å²	173.7	91%	0.913	81%	0.81	S	S	*	*			cis	-159.1	151.2	-9.7	-100.2	-177.6	173.2	173.8	-2.6	110
165	S	28.4	Very low	27.5	Very low	110 Å²	110	167.2 Å²	167.2	77%	0.769	80%	0.801	S	S	*	*			trans	55.6	131.5	160.6	42.3	0	0	0	0	119.5
166	R	25.9	Very low	27.5	Very low	241 Å²	241	173.8 Å²	173.8	91%	0.909	81%	0.809	S	S	*	*			cis	61.6	134.5	48.7	-63.5	-174.7	174.4	169.6	-1.5	112.7
167	S	28.5	Very low	27.5	Very low	105 Å²	105	167.8 Å²	167.8	73%	0.734	80%	0.803	S	S	*	*			cis	-154.8	143.7	20.5	-31.5	0	0	0	0	111.6
168	R	27.3	Very low	27.6	Very low	234 Å²	234	173.4 Å²	173.4	88%	0.883	82%	0.815	S	S	*	*				60.7	110.5	100	-74.8	-172.1	169.5	175.8	-3.8	120.9
169	S	28.2	Very low	27.6	Very low	91 Å²	91	165.6 Å²	165.6	64%	0.636	81%	0.807	S	S	*	*				86.5	132.7	114.5	-58.8	0	0	0	0	124.7
170	R	28.3	Very low	27.6	Very low	250 Å²	250	170.8 Å²	170.8	94%	0.943	81%	0.809	S	S	*	*			trans	72.5	151.7	152.7	-63.4	161.4	178.1	173.1	-3	117.5
171	G	26.8	Very low	27.5	Very low	72 Å²	72	164.7 Å²	164.7	74%	0.742	79%	0.794	S	S	*	*			cis	160.1	179.8	-8.8	0	0	0	0	0	114.2
172	R	28	Very low	27.5	Very low	231 Å²	231	167.2 Å²	167.2	87%	0.872	80%	0.797	S	S	*	*			trans	79.8	134	170.7	-82.6	-177.3	165	165.4	-0.6	121.1
173	E	27.9	Very low	27.5	Very low	129 Å²	129	161.2 Å²	161.2	60%	0.603	79%	0.789	S	S	*	*				24.5	148.5	124.6	-65.5	173.5	-110.2	0	0	120
174	R	26.6	Very low	27.5	Very low	221 Å²	221	169.1 Å²	169.1	83%	0.834	80%	0.796	S	S	*	*			cis	-166.4	168.1	37.3	-141.7	165.4	-144.7	-162.3	-4.1	113.2
175	S	29	Very low	27.5	Very low	103 Å²	103	163.1 Å²	163.1	72%	0.72	79%	0.791	S	S	*	*			trans	-76.6	152.1	177.7	57.7	0	0	0	0	116
176	R	27.2	Very low	27.5	Very low	253 Å²	253	170.1 Å²	170.1	96%	0.955	80%	0.801	S	S	*	*			trans	-168.3	169.5	138	-111	163.1	-173.7	171.9	1.4	114
177	S	27.9	Very low	27.6	Very low	111 Å²	111	162.3 Å²	162.3	78%	0.776	80%	0.796	S	S	*	*			trans	-139.2	155.7	-166.1	52.1	0	0	0	0	113.6
178	K	28.6	Very low	27.6	Very low	218 Å²	218	167.6 Å²	167.6	95%	0.948	80%	0.799	S	S	*	*			trans	145.3	153.2	169	-88.4	171.6	179.2	-173.3	0	108.8
179	G	26.3	Very low	27.7	Very low	71 Å²	71	162.3 Å²	162.3	73%	0.732	79%	0.789	S	S	*	*			cis	156.5	114.3	-14.1	0	0	0	0	0	115.7
180	R	26.9	Very low	27.8	Very low	229 Å²	229	167.3 Å²	167.3	86%	0.864	79%	0.794	S	S	*	*			trans	63.8	141.4	150.4	-102.3	-179	176.4	-179.2	0.7	123.3
181	D	26.9	Very low	27.8	Very low	105 Å²	105	160.2 Å²	160.2	56%	0.561	78%	0.782	S	S	*	*			trans	66	154	148.4	-68.1	-60	0	0	0	118.2
182	R	26.7	Very low	27.9	Very low	204 Å²	204	168.1 Å²	168.1	77%	0.77	79%	0.79	S	S	*	*			cis	-161.8	141.5	-3.9	-124.6	163.7	-141.3	-170.2	4.8	115.3
183	S	27.2	Very low	28	Very low	95 Å²	95	162 Å²	162	66%	0.664	78%	0.783	S	S	*	*			trans	50.8	127.4	138.9	66.3	0	0	0	0	126.5
184	R	26.2	Very low	28	Very low	237 Å²	237	166.3 Å²	166.3	89%	0.894	79%	0.793	S	S	*	*				64.8	121	129	-67.3	175.8	173.4	168.7	-2.5	123.2
185	S	28	Very low	28.1	Very low	115 Å²	115	163.2 Å²	163.2	80%	0.804	79%	0.789	S	S	*	*				177.2	118.9	122.6	-84	0	0	0	0	111
186	R	29.7	Very low	28.1	Very low	257 Å²	257	168.4 Å²	168.4	97%	0.97	79%	0.792	S	S	*	*				87.1	114.6	82	-94.2	-172	173.5	179.9	-0.1	115.5
187	G	27.8	Very low	28.3	Very low	78 Å²	78	161.2 Å²	161.2	80%	0.804	77%	0.773	S	S	*	*			trans	-161	146.8	163	0	0	0	0	0	108.7
188	R	28.9	Very low	28.2	Very low	215 Å²	215	166.3 Å²	166.3	81%	0.811	78%	0.775	S	S	*	*			trans	-162.4	121.3	-164	-179.8	-154.7	-167.1	-170.7	7	115.1
189	D	28.3	Very low	28.3	Very low	124 Å²	124	163.1 Å²	163.1	66%	0.663	77%	0.768	S	S	*	*			trans	-161.1	135.8	147.6	-94.3	-43.6	0	0	0	107.6
190	R	29.8	Very low	28.4	Very low	195 Å²	195	169.7 Å²	169.7	74%	0.736	77%	0.771	S	S	*	*				71	125.6	72.1	-72.7	-166.8	179.6	124.7	-19.6	113.4
191	S	28.7	Very low	28.6	Very low	101 Å²	101	164.4 Å²	164.4	71%	0.706	76%	0.76	S	S	*	*			cis	-159	152.4	1.8	-73.3	0	0	0	0	114.2
192	R	29.6	Very low	28.7	Very low	238 Å²	238	169.1 Å²	169.1	90%	0.898	77%	0.77	S	S	*	*			trans	13	154.5	141.8	-65.5	-177.4	172.4	161.5	-4.7	121.9
193	S	30.6	Very low	28.9	Very low	104 Å²	104	167.9 Å²	167.9	73%	0.727	77%	0.771	S	S	*	*			cis	180	164.6	-10.5	-90.1	0	0	0	0	111.4
194	R	27.1	Very low	29.1	Very low	218 Å²	218	168.8 Å²	168.8	82%	0.823	77%	0.768	S	S	*	*			trans	124.4	121.7	163.4	-74.2	-166	152.1	138.5	1.7	113.8
195	E	28.7	Very low	29.3	Very low	157 Å²	157	166 Å²	166	73%	0.734	76%	0.757	S	S	*	*				69.5	140.4	86.4	-64.4	173.7	136.2	0	0	114.4
196	R	29.2	Very low	29.5	Very low	212 Å²	212	169.3 Å²	169.3	80%	0.8	75%	0.752	S	S	*	*			cis	-170.6	164.5	-22.8	-161.3	-179.7	-171.3	-131.9	15.9	109.1
197	D	30.7	Very low	29.5	Very low	101 Å²	101	168.8 Å²	168.8	54%	0.54	75%	0.75	S	S	.	*			trans	90.5	150.4	140.1	-106.4	-41	0	0	0	124.9
198	W	26.3	Very low	29.7	Very low	218 Å²	218	175.4 Å²	175.4	83%	0.826	75%	0.752	S	S	*	*			trans	41.9	123.9	167.9	-68.6	78.4	0	0	0	124.9
199	N	31	Very low	29.8	Very low	151 Å²	151	169.5 Å²	169.5	81%	0.807	75%	0.75	S	S	*	*				-174.3	120.7	117.4	-106.9	-70.2	0	0	0	117.7
200	R	29	Very low	29.9	Very low	210 Å²	210	172.7 Å²	172.7	79%	0.792	75%	0.753	S	S	*	*			trans	38.8	128.6	131.5	-152.4	168.8	-172.4	175.9	2.6	126.7
201	D	29.9	Very low	30.1	Very low	118 Å²	118	170.5 Å²	170.5	63%	0.631	76%	0.756	S	S	*	*			trans	38.5	105.4	147.8	-61.3	-51.9	0	0	0	125.6
202	R	30.5	Very low	30.5	Very low	203 Å²	203	174 Å²	174	77%	0.766	75%	0.753	S	S	*	*				52	111.6	99.5	-154	-173.3	-151	-152.7	6.7	122.5
203	F	30.1	Very low	30.7	Very low	179 Å²	179	170.7 Å²	170.7	79%	0.785	74%	0.742	S	S	*	*				166	169.2	116.2	-108.1	-71.6	0	0	0	117.2
204	D	31.2	Very low	30.7	Very low	114 Å²	114	171.9 Å²	171.9	61%	0.61	74%	0.74	S	S	*	*			trans	79.1	140.6	165.7	-133.9	13.1	0	0	0	115
205	R	31	Very low	31	Very low	177 Å²	177	166.4 Å²	166.4	67%	0.668	73%	0.727	S	S	*	*			cis	-152	146	27.4	-88.6	-172.4	168.7	172	4.9	117.9
206	R	31.4	Very low	31.1	Very low	186 Å²	186	169 Å²	169	70%	0.702	73%	0.73	S	S	*	*			trans	49.8	136	132.7	-59	174.5	178.1	-174.9	-5.8	123.6
207	R	30.6	Very low	31.1	Very low	245 Å²	245	168.9 Å²	168.9	93%	0.925	73%	0.73	S	S	*	*				-157.9	161.8	100.8	-116.1	-176.8	-179.7	-165.1	-0.2	114.1
208	Y	30.6	Very low	31.1	Very low	217 Å²	217	170 Å²	170	85%	0.851	74%	0.736	S	S	*	*			trans	-106.8	177.4	178	-81.9	-112.1	0	0	0	109
209	A	31.2	Very low	31.3	Very low	92 Å²	92	165.1 Å²	165.1	76%	0.76	73%	0.726	S	S	*	*			cis	-169	178.2	28.6	0	0	0	0	0	109.3
210	R	30.4	Very low	31.2	Very low	191 Å²	191	167 Å²	167	72%	0.721	72%	0.722	S	S	*	*			cis	-178.6	146.8	-15.2	154.9	-175.5	174	-146.6	1.6	109.6
211	D	34.3	Very low	31.4	Very low	149 Å²	149	164 Å²	164	80%	0.797	72%	0.722	S	S	*	*			trans	-95.8	173.1	-178.6	-42.5	-92.3	0	0	0	116.8
212	R	36.4	Very low	31.3	Very low	175 Å²	175	169.5 Å²	169.5	66%	0.66	73%	0.733	S	S	*	*			trans	171	146	150.3	-98.2	169.7	173.3	-150.8	-7.4	109.3
213	Y	34.7	Very low	31.3	Very low	167 Å²	167	170.2 Å²	170.2	66%	0.655	74%	0.736	S	S	*	*			cis	-145.1	175.6	-1.4	-100.8	-66.5	0	0	0	106.1
214	D	31.6	Very low	31.3	Very low	130 Å²	130	171.5 Å²	171.5	70%	0.695	74%	0.742	S	S	*	*			cis	-154.4	159.7	21	-142.2	-11.3	0	0	0	116.8
215	D	32.2	Very low	31.3	Very low	103 Å²	103	172.4 Å²	172.4	55%	0.551	75%	0.747	S	S	*	*			trans	31.6	142.5	157.4	-118.3	-16.3	0	0	0	128.9
216	R	31.4	Very low	31.3	Very low	211 Å²	211	176.1 Å²	176.1	80%	0.796	76%	0.761	S	S	*	*			trans	67.3	143	156.8	-72.4	156.3	-139.6	-149.8	7.7	119.6
217	R	28.5	Very low	31.1	Very low	210 Å²	210	178.6 Å²	178.6	79%	0.792	77%	0.77	S	S	*	*			cis	-154.5	153.8	15.9	-147	-167.5	173.4	150.5	3.9	113.2
218	D	30.8	Very low	30.9	Very low	123 Å²	123	170.7 Å²	170.7	66%	0.658	76%	0.757	S	S	*	*			trans	50.2	119.9	161.9	-54.5	-24.8	0	0	0	119.4
219	D	31	Very low	30.8	Very low	116 Å²	116	167.9 Å²	167.9	62%	0.62	76%	0.757	S	S	*	*				68	131.2	77.7	-104.9	-19.4	0	0	0	114.4
220	R	29.6	Very low	30.6	Very low	191 Å²	191	173.7 Å²	173.7	72%	0.721	76%	0.759	S	S	*	*			cis	-157.1	179.5	2.3	-160.6	172.8	-79.6	179.7	2	112
221	D	31.6	Very low	30.5	Very low	148 Å²	148	170.6 Å²	170.6	79%	0.791	76%	0.757	S	S	*	*			trans	93.3	129.3	152.1	-66.5	-37.4	0	0	0	120.9
222	R	27.5	Very low	30.2	Very low	232 Å²	232	172.6 Å²	172.6	88%	0.875	76%	0.761	S	S	*	*			trans	-136.9	133	168.7	-80.9	-178.8	169.9	-179.6	-1.3	108.5
223	R	30.9	Very low	29.8	Very low	219 Å²	219	171.7 Å²	171.7	83%	0.826	77%	0.769	S	S	*	*			trans	46.9	134.4	151.2	-62.5	-176.1	174.5	-157.2	-2.7	119.1
224	F	30.1	Very low	29.6	Very low	205 Å²	205	168.4 Å²	168.4	90%	0.899	77%	0.771	S	S	*	*				-154.7	134	109.9	-122.3	-77.8	0	0	0	112.5
225	D	31.9	Very low	29.7	Very low	134 Å²	134	170.7 Å²	170.7	72%	0.717	78%	0.778	S	S	*	*			trans	-82.1	140.6	168.2	-72.3	-85.5	0	0	0	111
226	R	30.9	Very low	29.6	Very low	255 Å²	255	175.8 Å²	175.8	96%	0.962	79%	0.789	S	S	*	*			trans	-149.3	148.4	147.9	-113	173.6	-170.4	-162.7	1.4	111.1
227	R	27.8	Very low	29.5	Very low	238 Å²	238	176.4 Å²	176.4	90%	0.898	79%	0.791	S	S	*	*			trans	-105.7	158.1	-164.2	-71.4	177.6	164.5	-179.3	-6.3	113.6
228	A	26.5	Very low	29.6	Very low	79 Å²	79	178.7 Å²	178.7	65%	0.653	80%	0.8	S	S	*	*			trans	82.3	135.7	137.5	0	0	0	0	0	120.4
229	N	26.6	Very low	29.5	Very low	158 Å²	158	184.7 Å²	184.7	85%	0.845	81%	0.814	S	S	*	*			trans	70.1	149.2	161.8	-51.7	-12.6	0	0	0	114.2
230	R	27.7	Very low	29.3	Very low	214 Å²	214	182.8 Å²	182.8	81%	0.808	82%	0.821	S	S	*	*			cis	-160.1	142.9	33	-175.7	170.2	-177.7	170.8	3	114
231	D	28.3	Very low	29.2	Very low	126 Å²	126	185.5 Å²	185.5	67%	0.674	83%	0.832	S	S	*	*			trans	48.4	158.1	155.4	-50.9	-9.3	0	0	0	121.4
232	E	29.3	Very low	29	Very low	191 Å²	191	184 Å²	184	89%	0.893	83%	0.833	S	S	*	*			trans	-77.5	148.5	177.3	-59.6	157.2	113.5	0	0	112.1
233	D	27.1	Very low	29.1	Very low	155 Å²	155	176.7 Å²	176.7	83%	0.829	83%	0.829	S	S	*	*				169.7	-178.5	121.8	-168.1	18	0	0	0	109.7
234	S	31.4	Very low	28.9	Very low	99 Å²	99	172 Å²	172	69%	0.692	83%	0.83	S	S	*	*			trans	82.5	56.2	172.6	73.9	0	0	0	0	117.3	R236	S234-R236 PolarHBondContact O-N 3.34Å
235	E	33.3	Very low	29.7	Very low	178 Å²	178	168.1 Å²	168.1	83%	0.832	83%	0.825	S	S	*	*				-53.6	95.8	129.5	-88.2	-149.8	151.7	0	0	109.2
236	R	29.2	Very low	30.3	Very low	210 Å²	210	167.8 Å²	167.8	79%	0.792	83%	0.831	S	S	*	*			trans	177.3	137.4	136.7	-95.9	146.2	-164.1	-122.3	-5.1	114	S234	S234-R236 PolarHBondContact O-N 3.34Å
237	R	30.5	Very low	30.3	Very low	223 Å²	223	159.4 Å²	159.4	84%	0.842	82%	0.816	S	S	*	*			trans	65.4	78.3	152.4	-62.7	173.6	176	-177.1	-2.3	117.8	R239	R237-R239 PolarHBondContact O-N 2.96Å
238	R	29.8	Very low	30.6	Very low	259 Å²	259	154.9 Å²	154.9	98%	0.977	81%	0.809	S	S	*	*			trans	-68.3	102.2	136.2	-83.8	-173.4	172.5	-175.9	-0.9	109.9
239	R	29.3	Very low	30.8	Very low	249 Å²	249	159.1 Å²	159.1	94%	0.94	81%	0.813	S	S	*	*			trans	-159.2	122.4	155.2	-129.7	-178.9	-174.1	-162.8	1.4	109.4	R237	R237-R239 PolarHBondContact O-N 2.96Å
240	G	26.4	Very low	30.8	Very low	76 Å²	76	158.5 Å²	158.5	78%	0.784	81%	0.805	S	S	*	*			trans	-165.6	3.8	-167.6	0	0	0	0	0	119.5
241	R	26.2	Very low	30.8	Very low	248 Å²	248	154.4 Å²	154.4	94%	0.936	81%	0.809	S	S	*	*			trans	-168.2	142.9	159.9	-111.2	177.3	173.6	-166	-4.4	108.5
242	S	27.5	Very low	30.8	Very low	117 Å²	117	153.3 Å²	153.3	82%	0.818	82%	0.818	S	S	*	*			cis	-144.3	152.5	0.3	50	0	0	0	0	110.8
243	G	29.7	Very low	30.8	Very low	77 Å²	77	149.3 Å²	149.3	79%	0.794	82%	0.817	S	S	*	*			trans	161.1	122.3	166.8	0	0	0	0	0	113.5
244	S	27.3	Very low	31	Very low	122 Å²	122	145.4 Å²	145.4	85%	0.853	81%	0.813	S	S	*	*			trans	-121.1	136.2	159.1	-66.6	0	0	0	0	108.1
245	P	47.8	Very low	30.8	Very low	122 Å²	122	150.2 Å²	150.2	79%	0.792	83%	0.825	S	S	*	*			trans	-83.6	-179.3	176.5	41.7	-39.8	0	0	0	110
246	P	44.3	Very low	30.7	Very low	128 Å²	128	150.2 Å²	150.2	83%	0.831	83%	0.825	S	S	*	*			cis	-129.7	-167.9	35	42.1	-20.8	0	0	0	113.6
247	A	30.6	Very low	30.9	Very low	78 Å²	78	146.1 Å²	146.1	65%	0.645	83%	0.826	S	S	*	*			cis	-153.7	167.3	14.7	0	0	0	0	0	115.2
248	D	33.1	Very low	31.2	Very low	143 Å²	143	141 Å²	141	77%	0.765	82%	0.821	S	S	*	*			trans	52.6	105	144.3	-57.4	-27.8	0	0	0	123.7
249	K	30.9	Very low	31.9	Very low	168 Å²	168	135.3 Å²	135.3	73%	0.73	82%	0.815	S	S	*	*				54.9	125.7	116.9	-82.8	-173	160.7	-139	0	123.4
250	E	26.6	Very low	32.3	Very low	146 Å²	146	132.8 Å²	132.8	68%	0.682	81%	0.811	S	S	*	*				96	153.7	126	-82.3	175	-146.8	0	0	122.9
251	S	27.9	Very low	33.2	Very low	128 Å²	128	138.8 Å²	138.8	90%	0.895	82%	0.815	S	S	*	*			trans	68.7	141.6	-177.5	74	0	0	0	0	117.1
252	A	29.1	Very low	33.7	Very low	103 Å²	103	136.6 Å²	136.6	85%	0.851	81%	0.813	S	S	*	*			trans	-139.5	123.2	175.9	0	0	0	0	0	109.5
253	A	28.8	Very low	34.3	Very low	107 Å²	107	140.3 Å²	140.3	88%	0.884	81%	0.814	S	S	*	*			trans	-169	146.4	163.5	0	0	0	0	0	109.4
254	G	30.7	Very low	34.9	Very low	72 Å²	72	145.1 Å²	145.1	74%	0.742	82%	0.816	S	S	*	*			trans	94.3	113.8	158.3	0	0	0	0	0	117.9
255	E	27.5	Very low	35.6	Very low	200 Å²	200	148.2 Å²	148.2	94%	0.935	82%	0.817	S	S	*	*			trans	70.1	164.5	141.9	-56.7	-173.9	150	0	0	120
256	E	32	Very low	35.3	Very low	179 Å²	179	149.8 Å²	149.8	84%	0.836	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-81.7	144.8	-151.7	-56.2	-178.8	127.7	0	0	114.3	P258	E256-P258 VanDerWaalsContact O-CD 3.28Å; E256-P258 WeakPolarHBondContact O-CD 3.28Å
257	P	33.8	Very low	35.6	Very low	124 Å²	124	147 Å²	147	81%	0.805	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-74.1	116.5	174.3	29.5	-33.1	0	0	0	111.6
258	P	36.3	Very low	36.6	Very low	114 Å²	114	146.9 Å²	146.9	74%	0.74	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-73.8	149.8	-175.1	29.3	-35.6	0	0	0	113.3	E256 K260	E256-P258 VanDerWaalsContact O-CD 3.28Å; E256-P258 WeakPolarHBondContact O-CD 3.28Å; P258-K260 PolarHBondContact O-N 2.81Å; P258-K260 VanDerWaalsContact O-N 3.17Å
259	V	44	Very low	37.5	Very low	141 Å²	141	140.8 Å²	140.8	86%	0.855	76%	0.755	S	S	*	*			trans	-59.3	113.5	-173.1	-178.5	0	0	0	0	112.6
260	K	37.9	Very low	38.4	Very low	196 Å²	196	137.5 Å²	137.5	85%	0.852	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-95.9	121.7	161.6	-73.8	179.1	179.9	171.5	0	109.2	P258 K262	P258-K260 PolarHBondContact O-N 2.81Å; P258-K260 VanDerWaalsContact O-N 3.17Å; K260-K262 PolarHBondContact O-N 3.27Å
261	K	45.2	Very low	39.6	Very low	202 Å²	202	133.8 Å²	133.8	88%	0.878	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-50.4	127.7	-171.2	-61	-179	179.3	-175.7	0	111.5
262	K	37.7	Very low	40.5	Very low	202 Å²	202	139.3 Å²	139.3	88%	0.878	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-55.3	141	165.7	-71.2	-175.8	177.3	-178.5	0	108.5	K260	K260-K262 PolarHBondContact O-N 3.27Å
263	K	39.3	Very low	41.1	Very low	195 Å²	195	139.7 Å²	139.7	85%	0.848	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-66.4	132.5	153.4	-79.5	-176.3	173.4	-178.1	0	106.8	E265	K263-E265 PolarHBondContact O-N 3.45Å
264	E	41.4	Very low	42.1	Very low	177 Å²	177	138.5 Å²	138.5	83%	0.827	72%	0.724	S	S	*	*	P	Polyproline II helix	trans	-60.7	123.5	166.9	-69.8	160.7	176.8	0	0	108	L266	E264-L266 PolarHBondContact O-N 3.1Å; E264-L266 VanDerWaalsContact O-N 3.11Å
265	E	42.9	Very low	42.7	Very low	187 Å²	187	138.7 Å²	138.7	87%	0.874	73%	0.726	S	S	*	*			trans	-74.3	102	173.9	-66.1	-170.8	129.1	0	0	107.2	K263 D267	K263-E265 PolarHBondContact O-N 3.45Å; E265-D267 PolarHBondContact O-N 3.38Å
266	L	42.3	Very low	43.5	Very low	155 Å²	155	132.9 Å²	132.9	81%	0.812	71%	0.712	S	S	*	*			trans	-57.4	110.4	-178.1	-72	167.8	0	0	0	110.2	E264	E264-L266 PolarHBondContact O-N 3.1Å; E264-L266 VanDerWaalsContact O-N 3.11Å
267	D	49.2	Very low	44.8	Very low	69 Å²	69	133.5 Å²	133.5	37%	0.369	71%	0.708	S	S	.	*			trans	-49.3	128.5	-178.9	-86.2	-56.6	0	0	0	111.5	E265 I269 L270	E265-D267 PolarHBondContact O-N 3.38Å; D267-I269 HydrophobicContact CB-CB 4.35Å; D267-I269 PolarHBondContact O-N 3.13Å; D267-L270 HydrophobicContact CB-CB 4.19Å; D267-L270 HydrophobicContact CB-CD1 4.22Å; D267-L270 HydrophobicContact CB-CG 4.36Å; D267-L270 PolarHBondContact O-N 3.21Å
268	P	52.3	Low	46.4	Very low	76 Å²	76	130.3 Å²	130.3	49%	0.494	68%	0.684	S	S	.	*	G	3₁₀ helix	trans	-53.6	-31.1	171.4	-27.6	35.8	0	0	0	112.5	T271	P268-T271 PolarHBondContact O-N 2.97Å; P268-T271 PolarHBondContact O-OG1 2.88Å
269	I	52.2	Low	48	Very low	15 Å²	15	128 Å²	128	8%	0.077	67%	0.668	C	S	.	*	G	3₁₀ helix	trans	-60.7	-40.6	174.8	-56.1	170.5	0	0	0	111.7	D267 T271 M286 I290 A297 R300 M301	D267-I269 HydrophobicContact CB-CB 4.35Å; D267-I269 PolarHBondContact O-N 3.13Å; I269-T271 PolarHBondContact O-N 3.47Å; I269-M286 HydrophobicContact CD1-CE 3.58Å; I269-M286 HydrophobicContact CD1-SD 4Å; I269-M286 HydrophobicContact CG1-CE 4.06Å; I269-M286 HydrophobicContact CG1-SD 4.32Å; I269-I290 HydrophobicContact CD1-CD1 4.18Å; I269-A297 HydrophobicContact CD1-CB 4.03Å; I269-R300 HydrophobicContact CG2-CG 4.48Å; I269-R300 PolarHBondContact O-NE 3.47Å; I269-R300 PolarHBondContact O-NH1 2.88Å; I269-R300 PolarHBondContact O-NH2 3.18Å; I269-R300 VanDerWaalsContact O-NH2 3.09Å; I269-M301 HydrophobicContact CD1-CE 3.44Å; I269-M301 VanDerWaalsContact CD1-CE 3.44Å; I269-M301 HydrophobicContact CG1-CE 4.19Å
270	L	48.8	Very low	48.9	Very low	99 Å²	99	124.6 Å²	124.6	52%	0.518	65%	0.65	S	S	.	*	G	3₁₀ helix	trans	-74.7	-10.8	-174.7	-90.3	166.4	0	0	0	113.6	D267 R272 L296	D267-L270 HydrophobicContact CB-CB 4.19Å; D267-L270 HydrophobicContact CB-CD1 4.22Å; D267-L270 HydrophobicContact CB-CG 4.36Å; D267-L270 PolarHBondContact O-N 3.21Å; L270-R272 PolarHBondContact O-N 3.31Å; L270-L296 HydrophobicContact CD2-CD2 3.97Å
271	T	52.8	Low	50.2	Low	68 Å²	68	118.2 Å²	118.2	42%	0.417	63%	0.634	S	S	.	*			trans	-60.9	138.2	178.3	65.2	0	0	0	0	112.1	P268 I269 T273 R300	P268-T271 PolarHBondContact O-N 2.97Å; P268-T271 PolarHBondContact O-OG1 2.88Å; I269-T271 PolarHBondContact O-N 3.47Å; T271-T273 PolarHBondContact O-N 3.44Å; T271-R300 PolarHBondContact O-NH2 2.81Å
272	R	47.2	Very low	51.2	Low	244 Å²	244	115.4 Å²	115.4	92%	0.921	62%	0.621	S	S	*	*	S	Bend	trans	-78.2	-0.6	-169.3	-158.8	171.1	70.5	176.6	1.5	114.2	L270	L270-R272 PolarHBondContact O-N 3.31Å
273	T	40	Very low	52.7	Low	112 Å²	112	107.8 Å²	107.8	69%	0.687	59%	0.59	S	S	*	*	S	Bend	trans	-141.9	102.9	-174.5	49	0	0	0	0	109	T271 G275	T271-T273 PolarHBondContact O-N 3.44Å; T273-G275 VanDerWaalsContact C-N 3.3Å; T273-G275 PolarHBondContact O-N 2.97Å
274	G	50.6	Low	54.1	Low	82 Å²	82	106.4 Å²	106.4	85%	0.845	58%	0.579	S	S	*	*			trans	-69.3	78.8	-176.7	0	0	0	0	0	113.2
275	G	43.8	Very low	55.2	Low	75 Å²	75	103.5 Å²	103.5	77%	0.773	57%	0.567	S	S	*	*			trans	-121	0.4	-175.9	0	0	0	0	0	115.3	T273	T273-G275 VanDerWaalsContact C-N 3.3Å; T273-G275 PolarHBondContact O-N 2.97Å
276	A	44.1	Very low	56.2	Low	78 Å²	78	96.4 Å²	96.4	65%	0.645	54%	0.535	S	S	*	.			trans	-96.9	115.4	174.6	0	0	0	0	0	110.2	I278	A276-I278 PolarHBondContact O-N 3Å; A276-I278 VanDerWaalsContact O-N 3.15Å
277	Y	59	Low	57.2	Low	192 Å²	192	92.9 Å²	92.9	75%	0.753	51%	0.514	S	S	*	.			trans	-71.6	105.6	171	175.3	-103.1	0	0	0	109.8	P279	Y277-P279 WeakPolarHBondContact O-CD 3.1Å
278	I	66.6	Low	57.8	Low	57 Å²	57	97.1 Å²	97.1	29%	0.292	53%	0.531	S	S	.	.			trans	-84	119.3	173.6	-57.3	176.6	0	0	0	108	A276 K282 L283	A276-I278 PolarHBondContact O-N 3Å; A276-I278 VanDerWaalsContact O-N 3.15Å; I278-K282 HydrophobicContact CG2-CB 4.38Å; I278-L283 HydrophobicContact CG2-CB 3.99Å; I278-L283 HydrophobicContact CG2-CG 4.3Å
279	P	70.2	Confident	58.2	Low	65 Å²	65	100.8 Å²	100.8	42%	0.422	54%	0.542	S	S	.	.			trans	-59.5	139.5	179.3	-25.8	35.6	0	0	0	112.1	Y277 A281 K282 L283	Y277-P279 WeakPolarHBondContact O-CD 3.1Å; P279-A281 VanDerWaalsContact C-N 3.26Å; P279-A281 PolarHBondContact O-N 2.9Å; P279-A281 VanDerWaalsContact O-N 3.08Å; P279-K282 WeakPolarHBondContact O-CA 3.48Å; P279-K282 PolarHBondContact O-N 3.15Å; P279-L283 PolarHBondContact O-N 3.47Å
280	P	64.6	Low	58.6	Low	71 Å²	71	101.6 Å²	101.6	46%	0.461	55%	0.546	S	S	.	.	H	α-helix	trans	-55.5	-31.9	-172.7	-30.3	35.8	0	0	0	115.9	R284	P280-R284 PolarHBondContact O-N 3.26Å
281	A	65.1	Low	59	Low	62 Å²	62	102.3 Å²	102.3	51%	0.512	56%	0.555	S	S	.	*	H	α-helix	trans	-69	-41.9	174.4	0	0	0	0	0	112.3	P279 L283 R284 M285	P279-A281 VanDerWaalsContact C-N 3.26Å; P279-A281 PolarHBondContact O-N 2.9Å; P279-A281 VanDerWaalsContact O-N 3.08Å; A281-L283 VanDerWaalsContact C-N 3.33Å; A281-R284 PolarHBondContact O-N 3.28Å; A281-M285 WeakPolarHBondContact O-CG 3.13Å; A281-M285 PolarHBondContact O-N 3.11Å
282	K	66.1	Low	59.6	Low	143 Å²	143	103.9 Å²	103.9	62%	0.622	56%	0.56	S	S	*	*	H	α-helix	trans	-70	-31.9	175.8	-171.7	168.9	-176.8	174.3	0	111.8	I278 P279 M286	I278-K282 HydrophobicContact CG2-CB 4.38Å; P279-K282 WeakPolarHBondContact O-CA 3.48Å; P279-K282 PolarHBondContact O-N 3.15Å; K282-M286 WeakPolarHBondContact O-CB 3.28Å; K282-M286 PolarHBondContact O-N 3.37Å
283	L	67.8	Low	60.6	Low	41 Å²	41	98.3 Å²	98.3	22%	0.215	54%	0.543	C	S	.	.	H	α-helix	trans	-63.4	-49	172.4	-151	171.8	0	0	0	110.3	I278 P279 A281 M285 M286 Q287 M301	I278-L283 HydrophobicContact CG2-CB 3.99Å; I278-L283 HydrophobicContact CG2-CG 4.3Å; P279-L283 PolarHBondContact O-N 3.47Å; A281-L283 VanDerWaalsContact C-N 3.33Å; L283-M285 PolarHBondContact O-N 3.26Å; L283-M286 PolarHBondContact O-N 3.32Å; L283-M286 VanDerWaalsContact O-N 3.13Å; L283-Q287 VanDerWaalsContact CD2-CD 3.5Å; L283-Q287 HydrophobicContact CD2-CG 3.84Å; L283-Q287 WeakPolarHBondContact O-CG 3.47Å; L283-Q287 PolarHBondContact O-N 3.25Å; L283-M301 HydrophobicContact CD2-SD 4.02Å
284	R	69.1	Low	61.9	Low	166 Å²	166	96.7 Å²	96.7	63%	0.626	54%	0.536	S	S	*	.	H	α-helix	trans	-58.8	-45.8	174.7	-83.6	-174.3	-94.9	170.7	-12.4	113.3	P280 A281 M286 Q287 Q288	P280-R284 PolarHBondContact O-N 3.26Å; A281-R284 PolarHBondContact O-N 3.28Å; R284-M286 VanDerWaalsContact C-N 3.28Å; R284-M286 PolarHBondContact O-N 3.01Å; R284-Q287 WeakPolarHBondContact O-CB 3.34Å; R284-Q287 PolarHBondContact O-N 2.94Å; R284-Q288 WeakPolarHBondContact O-CG 3.47Å; R284-Q288 PolarHBondContact O-N 2.91Å
285	M	65.5	Low	63.3	Low	117 Å²	117	94.9 Å²	94.9	58%	0.576	51%	0.511	S	S	*	.	H	α-helix	trans	-60.2	-37.2	174.7	-73.3	172	166	0	0	112.5	A281 L283 Q288 Q289	A281-M285 WeakPolarHBondContact O-CG 3.13Å; A281-M285 PolarHBondContact O-N 3.11Å; L283-M285 PolarHBondContact O-N 3.26Å; M285-Q288 PolarHBondContact O-N 3.39Å; M285-Q289 VanDerWaalsContact O-CG 3.29Å; M285-Q289 WeakPolarHBondContact O-CG 3.23Å; M285-Q289 PolarHBondContact O-N 3.39Å
286	M	62.5	Low	65.1	Low	38 Å²	38	94.6 Å²	94.6	19%	0.187	49%	0.491	C	S	.	.	H	α-helix	trans	-74.7	-31	177.3	-162	175.7	-167	0	0	112.5	I269 K282 L283 R284 Q289 I290 M301	I269-M286 HydrophobicContact CD1-CE 3.58Å; I269-M286 HydrophobicContact CD1-SD 4Å; I269-M286 HydrophobicContact CG1-CE 4.06Å; I269-M286 HydrophobicContact CG1-SD 4.32Å; K282-M286 WeakPolarHBondContact O-CB 3.28Å; K282-M286 PolarHBondContact O-N 3.37Å; L283-M286 PolarHBondContact O-N 3.32Å; L283-M286 VanDerWaalsContact O-N 3.13Å; R284-M286 VanDerWaalsContact C-N 3.28Å; R284-M286 PolarHBondContact O-N 3.01Å; M286-Q289 PolarHBondContact O-N 2.93Å; M286-I290 WeakPolarHBondContact O-CG1 3.39Å; M286-I290 PolarHBondContact O-N 3.3Å; M286-M301 HydrophobicContact CB-CE 4.06Å; M286-M301 HydrophobicContact CG-CE 3.74Å; M286-M301 HydrophobicContact SD-CE 3.81Å
287	Q	62.9	Low	66.7	Low	80 Å²	80	91.5 Å²	91.5	37%	0.374	47%	0.466	S	S	.	.	H	α-helix	trans	-64.7	-42.2	170.3	-72.8	170.1	-53.6	0	0	111.4	L283 R284 Q289 I290 M301	L283-Q287 VanDerWaalsContact CD2-CD 3.5Å; L283-Q287 HydrophobicContact CD2-CG 3.84Å; L283-Q287 WeakPolarHBondContact O-CG 3.47Å; L283-Q287 PolarHBondContact O-N 3.25Å; R284-Q287 WeakPolarHBondContact O-CB 3.34Å; R284-Q287 PolarHBondContact O-N 2.94Å; Q287-Q289 PolarHBondContact O-N 3.42Å; Q287-I290 PolarHBondContact O-N 2.94Å; Q287-M301 HydrophobicContact CG-SD 3.53Å; Q287-M301 VanDerWaalsContact CG-SD 3.53Å
288	Q	63	Low	67.9	Low	158 Å²	158	85.8 Å²	85.8	74%	0.738	44%	0.443	S	S	*	.	H	α-helix	trans	-65.6	-18.9	175.8	-70.7	170.4	-40	0	0	113.4	R284 M285	R284-Q288 WeakPolarHBondContact O-CG 3.47Å; R284-Q288 PolarHBondContact O-N 2.91Å; M285-Q288 PolarHBondContact O-N 3.39Å
289	Q	61	Low	68.8	Low	154 Å²	154	83.4 Å²	83.4	72%	0.72	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.4	-7.5	178.6	-73.9	170.7	-9	0	0	113.9	M285 M286 Q287	M285-Q289 VanDerWaalsContact O-CG 3.29Å; M285-Q289 WeakPolarHBondContact O-CG 3.23Å; M285-Q289 PolarHBondContact O-N 3.39Å; M286-Q289 PolarHBondContact O-N 2.93Å; Q287-Q289 PolarHBondContact O-N 3.42Å
290	I	60.8	Low	69.4	Low	32 Å²	32	82.4 Å²	82.4	16%	0.164	42%	0.419	C	S	.	.			trans	-108.1	88.6	179	-58.6	165.7	0	0	0	108.6	I269 M286 Q287 D292 A297 Y298 M301	I269-I290 HydrophobicContact CD1-CD1 4.18Å; M286-I290 WeakPolarHBondContact O-CG1 3.39Å; M286-I290 PolarHBondContact O-N 3.3Å; Q287-I290 PolarHBondContact O-N 2.94Å; I290-D292 VanDerWaalsContact C-N 3.3Å; I290-A297 HydrophobicContact CD1-CB 4.11Å; I290-Y298 HydrophobicContact CG2-CD2 4.25Å; I290-M301 HydrophobicContact CD1-CE 3.78Å
291	T	56.9	Low	70.3	Confident	114 Å²	114	80.2 Å²	80.2	70%	0.699	40%	0.402	S	S	*	.			trans	-67.1	-31.2	176	46.2	0	0	0	0	113	K293	T291-K293 PolarHBondContact O-N 2.88Å; T291-K293 VanDerWaalsContact O-N 3.09Å
292	D	64.5	Low	71.3	Confident	100 Å²	100	78.2 Å²	78.2	54%	0.535	39%	0.385	S	S	.	.			trans	-85.8	91.1	-164.9	-63.4	7.5	0	0	0	110.6	I290 S294 S295 Y298	I290-D292 VanDerWaalsContact C-N 3.3Å; D292-S294 PolarHBondContact O-N 3.49Å; D292-S294 VanDerWaalsContact O-N 3.11Å; D292-S295 WeakPolarHBondContact O-CB 3.21Å; D292-S295 PolarHBondContact O-N 3.02Å; D292-Y298 WeakPolarHBondContact O-CB 3.49Å
293	K	68.4	Low	72.4	Confident	127 Å²	127	72.7 Å²	72.7	55%	0.552	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	-28.2	-177.5	-62.7	173.8	-175	171.4	0	113.7	T291 S295 Y298 F535 L536	T291-K293 PolarHBondContact O-N 2.88Å; T291-K293 VanDerWaalsContact O-N 3.09Å; K293-S295 VanDerWaalsContact C-N 3.35Å; K293-Y298 HydrophobicContact CB-CD1 4.36Å; K293-Y298 HydrophobicContact CB-CE1 4.23Å; K293-Y298 HydrophobicContact CG-CE1 4.41Å; K293-Y298 HydrophobicContact CG-CE2 4.43Å; K293-Y298 WeakPolarHBondContact O-CD1 3.12Å; K293-F535 WeakPolarHBondContact O-CD1 3.32Å; K293-F535 VanDerWaalsContact O-CE1 3.23Å; K293-F535 WeakPolarHBondContact O-CE1 3.49Å; K293-L536 HydrophobicContact CB-CD2 3.92Å
294	S	67.8	Low	73.4	Confident	79 Å²	79	74.5 Å²	74.5	55%	0.552	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79	-12.6	175.6	54	0	0	0	0	114.2	D292 Q299	D292-S294 PolarHBondContact O-N 3.49Å; D292-S294 VanDerWaalsContact O-N 3.11Å; S294-Q299 PolarHBondContact O-NE2 3.16Å
295	S	79.7	Confident	74.3	Confident	44 Å²	44	68.6 Å²	68.6	31%	0.308	35%	0.354	S	S	.	.	S	Bend	trans	-63.2	141.4	-176.1	179.4	0	0	0	0	112.7	D292 K293 A297 Y298 Q299	D292-S295 WeakPolarHBondContact O-CB 3.21Å; D292-S295 PolarHBondContact O-N 3.02Å; K293-S295 VanDerWaalsContact C-N 3.35Å; S295-A297 PolarHBondContact O-N 2.89Å; S295-A297 VanDerWaalsContact O-N 3.15Å; S295-A297 PolarHBondContact OG-N 3.32Å; S295-Y298 WeakPolarHBondContact O-CB 3.41Å; S295-Y298 PolarHBondContact O-N 3.3Å; S295-Q299 PolarHBondContact O-N 3.35Å
296	L	81.3	Confident	75.5	Confident	68 Å²	68	63 Å²	63	36%	0.356	33%	0.327	S	S	.	.	H	α-helix	trans	-52.5	-37	173.6	-172.4	155.4	0	0	0	111.8	L270 R300 L531	L270-L296 HydrophobicContact CD2-CD2 3.97Å; L296-R300 WeakPolarHBondContact O-CB 3.47Å; L296-R300 PolarHBondContact O-N 2.76Å; L296-L531 HydrophobicContact CB-CD1 3.84Å; L296-L531 HydrophobicContact CD1-CD1 4.38Å; L296-L531 HydrophobicContact CG-CD1 4.08Å
297	A	78.6	Confident	76.9	Confident	14 Å²	14	66.2 Å²	66.2	12%	0.116	34%	0.339	C	S	.	.	H	α-helix	trans	-65.9	-44.8	176.9	0	0	0	0	0	112	I269 I290 S295 M301	I269-A297 HydrophobicContact CD1-CB 4.03Å; I290-A297 HydrophobicContact CD1-CB 4.11Å; S295-A297 PolarHBondContact O-N 2.89Å; S295-A297 VanDerWaalsContact O-N 3.15Å; S295-A297 PolarHBondContact OG-N 3.32Å; A297-M301 WeakPolarHBondContact O-CG 3.25Å; A297-M301 PolarHBondContact O-N 3.2Å
298	Y	82.5	Confident	78.3	Confident	72 Å²	72	68.3 Å²	68.3	28%	0.282	35%	0.347	S	S	.	.	H	α-helix	trans	-63.6	-51.7	176.2	-173.6	-87.9	0	0	0	111.3	I290 D292 K293 S295 R300 M301 S302 F535	I290-Y298 HydrophobicContact CG2-CD2 4.25Å; D292-Y298 WeakPolarHBondContact O-CB 3.49Å; K293-Y298 HydrophobicContact CB-CD1 4.36Å; K293-Y298 HydrophobicContact CB-CE1 4.23Å; K293-Y298 HydrophobicContact CG-CE1 4.41Å; K293-Y298 HydrophobicContact CG-CE2 4.43Å; K293-Y298 WeakPolarHBondContact O-CD1 3.12Å; S295-Y298 WeakPolarHBondContact O-CB 3.41Å; S295-Y298 PolarHBondContact O-N 3.3Å; Y298-R300 VanDerWaalsContact C-N 3.31Å; Y298-R300 PolarHBondContact O-N 2.96Å; Y298-M301 PolarHBondContact O-N 3.13Å; Y298-M301 VanDerWaalsContact O-N 3.16Å; Y298-S302 PolarHBondContact O-N 3.48Å; Y298-F535 AromaticContact CD1-CE1 3.89Å; Y298-F535 HydrophobicContact CD1-CE1 3.89Å; Y298-F535 HydrophobicContact CD1-CZ 4.36Å; Y298-F535 AromaticContact CE1-CE1 3.89Å; Y298-F535 HydrophobicContact CE1-CE1 3.89Å; Y298-F535 HydrophobicContact CE1-CZ 4.13Å
299	Q	85.6	Confident	79.7	Confident	6 Å²	6	62.7 Å²	62.7	3%	0.028	33%	0.325	C	S	.	.	H	α-helix	trans	-56.2	-45.8	178.6	-68.6	-167.2	19.6	0	0	111.4	S294 S295 S302 W303 F529 D532 F535	S294-Q299 PolarHBondContact O-NE2 3.16Å; S295-Q299 PolarHBondContact O-N 3.35Å; Q299-S302 PolarHBondContact O-N 2.99Å; Q299-S302 PolarHBondContact O-OG 3.36Å; Q299-W303 WeakPolarHBondContact O-CB 3.29Å; Q299-W303 PolarHBondContact O-N 2.85Å; Q299-F529 HydrophobicContact CB-CE2 3.87Å; Q299-F529 HydrophobicContact CB-CZ 3.75Å; Q299-D532 PolarHBondContact NE2-O 3.06Å; Q299-D532 PolarHBondContact OE1-O 3.41Å; Q299-F535 HydrophobicContact CG-CB 4.48Å; Q299-F535 HydrophobicContact CG-CD1 3.69Å; Q299-F535 HydrophobicContact CG-CD2 4.47Å; Q299-F535 HydrophobicContact CG-CE1 4.01Å; Q299-F535 HydrophobicContact CG-CG 3.94Å
300	R	84.1	Confident	81.3	Confident	44 Å²	44	55.4 Å²	55.4	17%	0.166	29%	0.291	C	S	.	.	H	α-helix	trans	-65.9	-39.4	178.2	-175.2	169.4	169.7	179	-10.6	112.6	I269 T271 L296 Y298 W303 E304 F529	I269-R300 HydrophobicContact CG2-CG 4.48Å; I269-R300 PolarHBondContact O-NE 3.47Å; I269-R300 PolarHBondContact O-NH1 2.88Å; I269-R300 PolarHBondContact O-NH2 3.18Å; I269-R300 VanDerWaalsContact O-NH2 3.09Å; T271-R300 PolarHBondContact O-NH2 2.81Å; L296-R300 WeakPolarHBondContact O-CB 3.47Å; L296-R300 PolarHBondContact O-N 2.76Å; Y298-R300 VanDerWaalsContact C-N 3.31Å; Y298-R300 PolarHBondContact O-N 2.96Å; R300-W303 PolarHBondContact O-N 2.96Å; R300-E304 IonicContact NE-OE1 2.68Å; R300-E304 WeakPolarHBondContact O-CG 3.36Å; R300-E304 PolarHBondContact O-N 2.9Å; R300-F529 HydrophobicContact CB-CD1 4.25Å; R300-F529 HydrophobicContact CB-CE1 3.86Å; R300-F529 HydrophobicContact CB-CE2 4.27Å; R300-F529 HydrophobicContact CB-CZ 3.88Å; R300-F529 HydrophobicContact CG-CD1 4.27Å; R300-F529 HydrophobicContact CG-CE1 4.36Å
301	M	83.4	Confident	82.9	Confident	25 Å²	25	57.6 Å²	57.6	12%	0.123	30%	0.303	C	S	.	.	H	α-helix	trans	-62	-46.2	171.9	-77.4	-145.5	-165.7	0	0	111.9	I269 L283 M286 Q287 I290 A297 Y298 W303 E304 A305	I269-M301 HydrophobicContact CD1-CE 3.44Å; I269-M301 VanDerWaalsContact CD1-CE 3.44Å; I269-M301 HydrophobicContact CG1-CE 4.19Å; L283-M301 HydrophobicContact CD2-SD 4.02Å; M286-M301 HydrophobicContact CB-CE 4.06Å; M286-M301 HydrophobicContact CG-CE 3.74Å; M286-M301 HydrophobicContact SD-CE 3.81Å; Q287-M301 HydrophobicContact CG-SD 3.53Å; Q287-M301 VanDerWaalsContact CG-SD 3.53Å; I290-M301 HydrophobicContact CD1-CE 3.78Å; A297-M301 WeakPolarHBondContact O-CG 3.25Å; A297-M301 PolarHBondContact O-N 3.2Å; Y298-M301 PolarHBondContact O-N 3.13Å; Y298-M301 VanDerWaalsContact O-N 3.16Å; M301-W303 VanDerWaalsContact C-N 3.3Å; M301-W303 PolarHBondContact O-N 3.24Å; M301-E304 PolarHBondContact O-N 3.29Å; M301-A305 WeakPolarHBondContact O-CB 3.26Å; M301-A305 PolarHBondContact O-N 3.44Å
302	S	86.5	Confident	84.6	Confident	20 Å²	20	53.7 Å²	53.7	14%	0.14	29%	0.286	C	S	.	.	H	α-helix	trans	-60.9	-39.6	179	79	0	0	0	0	111.7	Y298 Q299 A305 L306 R336	Y298-S302 PolarHBondContact O-N 3.48Å; Q299-S302 PolarHBondContact O-N 2.99Å; Q299-S302 PolarHBondContact O-OG 3.36Å; S302-A305 PolarHBondContact O-N 2.9Å; S302-L306 VanDerWaalsContact O-CB 3.27Å; S302-L306 WeakPolarHBondContact O-CB 3.4Å; S302-L306 PolarHBondContact O-N 3.48Å; S302-R336 PolarHBondContact OG-NH1 2.93Å; S302-R336 PolarHBondContact OG-NH2 3.49Å
303	W	88.9	Confident	85.9	Confident	28 Å²	28	49.2 Å²	49.2	11%	0.106	26%	0.262	C	S	.	.	H	α-helix	trans	-67.2	-41.4	176	-179.4	-96.1	0	0	0	112.5	Q299 R300 M301 A305 K307 R336 L340 L526 F529	Q299-W303 WeakPolarHBondContact O-CB 3.29Å; Q299-W303 PolarHBondContact O-N 2.85Å; R300-W303 PolarHBondContact O-N 2.96Å; M301-W303 VanDerWaalsContact C-N 3.3Å; M301-W303 PolarHBondContact O-N 3.24Å; W303-A305 VanDerWaalsContact C-N 3.32Å; W303-K307 WeakPolarHBondContact O-CB 3.44Å; W303-K307 PolarHBondContact O-N 2.95Å; W303-R336 HydrophobicContact CE3-CG 4.45Å; W303-R336 HydrophobicContact CZ3-CG 4.14Å; W303-R336 WeakPolarHBondContact CZ3-O 3.46Å; W303-L340 HydrophobicContact CD2-CD1 4.04Å; W303-L340 HydrophobicContact CE3-CD1 4.19Å; W303-L340 HydrophobicContact CH2-CD1 3.77Å; W303-L340 HydrophobicContact CH2-CG 3.88Å; W303-L340 HydrophobicContact CZ2-CD1 3.59Å; W303-L340 HydrophobicContact CZ2-CD2 3.85Å; W303-L340 HydrophobicContact CZ2-CG 3.69Å; W303-L340 HydrophobicContact CZ3-CD1 4.05Å; W303-L526 WeakPolarHBondContact CH2-O 3.5Å; W303-F529 HydrophobicContact CB-CD2 3.69Å; W303-F529 HydrophobicContact CB-CE2 4.21Å; W303-F529 AromaticContact CD1-CD2 3.99Å; W303-F529 HydrophobicContact CD2-CD2 4.19Å; W303-F529 HydrophobicContact CG-CB 4.2Å; W303-F529 AromaticContact CG-CD2 3.68Å; W303-F529 HydrophobicContact CG-CD2 3.68Å; W303-F529 HydrophobicContact CG-CG 4.37Å
304	E	88.1	Confident	87.2	Confident	79 Å²	79	43.1 Å²	43.1	37%	0.369	24%	0.236	S	C	.	.	H	α-helix	trans	-70.4	-26.6	174.8	-74.4	-171.2	-153	0	0	113.2	R300 M301 K308	R300-E304 IonicContact NE-OE1 2.68Å; R300-E304 WeakPolarHBondContact O-CG 3.36Å; R300-E304 PolarHBondContact O-N 2.9Å; M301-E304 PolarHBondContact O-N 3.29Å; E304-K308 WeakPolarHBondContact O-CD 3.23Å; E304-K308 WeakPolarHBondContact O-CE 3.46Å; E304-K308 WeakPolarHBondContact O-CG 3.16Å; E304-K308 PolarHBondContact O-N 3Å
305	A	88.6	Confident	88.3	Confident	42 Å²	42	43.9 Å²	43.9	35%	0.347	23%	0.233	S	C	.	.	H	α-helix	trans	-72.6	-56.2	171.7	0	0	0	0	0	111.1	M301 S302 W303 K307 K308 S309	M301-A305 WeakPolarHBondContact O-CB 3.26Å; M301-A305 PolarHBondContact O-N 3.44Å; S302-A305 PolarHBondContact O-N 2.9Å; W303-A305 VanDerWaalsContact C-N 3.32Å; A305-K307 VanDerWaalsContact C-N 3.26Å; A305-K307 PolarHBondContact O-N 2.99Å; A305-K308 CarbonylContact O-C 3.46Å; A305-K308 WeakPolarHBondContact O-CA 3.42Å; A305-K308 WeakPolarHBondContact O-CB 3.48Å; A305-K308 PolarHBondContact O-N 3.25Å; A305-S309 PolarHBondContact O-N 3Å
306	L	90.7	Very high	88.9	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-53.8	-41.7	177.2	178.7	153.6	0	0	0	111.8	S302 K308 S309 I310 N333 L340	S302-L306 VanDerWaalsContact O-CB 3.27Å; S302-L306 WeakPolarHBondContact O-CB 3.4Å; S302-L306 PolarHBondContact O-N 3.48Å; L306-K308 VanDerWaalsContact C-N 3.34Å; L306-K308 PolarHBondContact O-N 3.09Å; L306-S309 PolarHBondContact O-N 3.07Å; L306-I310 HydrophobicContact CD2-CD1 3.53Å; L306-I310 HydrophobicContact CD2-CG1 4.37Å; L306-I310 HydrophobicContact CG-CD1 4Å; L306-I310 WeakPolarHBondContact O-CG1 3.03Å; L306-I310 PolarHBondContact O-N 2.81Å; L306-N333 HydrophobicContact CD1-CB 4.16Å; L306-L340 HydrophobicContact CD2-CD1 3.62Å
307	K	92.4	Very high	89.5	Confident	104 Å²	104	44.5 Å²	44.5	45%	0.452	23%	0.229	S	C	.	.	H	α-helix	trans	-61.5	-36.9	174.1	-178.4	178.1	173.4	-172.6	0	113.5	W303 A305 N311 L340	W303-K307 WeakPolarHBondContact O-CB 3.44Å; W303-K307 PolarHBondContact O-N 2.95Å; A305-K307 VanDerWaalsContact C-N 3.26Å; A305-K307 PolarHBondContact O-N 2.99Å; K307-N311 VanDerWaalsContact O-CB 3.25Å; K307-N311 WeakPolarHBondContact O-CB 3.24Å; K307-N311 PolarHBondContact O-N 2.79Å; K307-L340 HydrophobicContact CB-CD1 3.86Å; K307-L340 HydrophobicContact CD-CD2 4.1Å; K307-L340 HydrophobicContact CG-CD1 4.33Å; K307-L340 HydrophobicContact CG-CD2 4.14Å
308	K	92.1	Very high	90	Very high	124 Å²	124	47.3 Å²	47.3	54%	0.539	24%	0.242	S	C	.	.	H	α-helix	trans	-74.3	-39.7	176.1	-70.9	162.3	-168	156.9	0	110.7	E304 A305 L306 G312	E304-K308 WeakPolarHBondContact O-CD 3.23Å; E304-K308 WeakPolarHBondContact O-CE 3.46Å; E304-K308 WeakPolarHBondContact O-CG 3.16Å; E304-K308 PolarHBondContact O-N 3Å; A305-K308 CarbonylContact O-C 3.46Å; A305-K308 WeakPolarHBondContact O-CA 3.42Å; A305-K308 WeakPolarHBondContact O-CB 3.48Å; A305-K308 PolarHBondContact O-N 3.25Å; L306-K308 VanDerWaalsContact C-N 3.34Å; L306-K308 PolarHBondContact O-N 3.09Å; K308-G312 PolarHBondContact O-N 2.76Å
309	S	92.6	Very high	90.4	Very high	40 Å²	40	46 Å²	46	28%	0.28	24%	0.241	S	C	.	.	H	α-helix	trans	-61.3	-61.5	178.6	-168.1	0	0	0	0	111.5	A305 L306 N311 G312 L313 E332	A305-S309 PolarHBondContact O-N 3Å; L306-S309 PolarHBondContact O-N 3.07Å; S309-N311 VanDerWaalsContact C-N 3.29Å; S309-N311 PolarHBondContact O-N 3.05Å; S309-G312 CarbonylContact O-C 3.6Å; S309-G312 WeakPolarHBondContact O-CA 3.4Å; S309-G312 PolarHBondContact O-N 3.47Å; S309-L313 WeakPolarHBondContact O-CG 3.37Å; S309-L313 PolarHBondContact O-N 3.02Å; S309-E332 WeakPolarHBondContact CB-OE1 3.27Å; S309-E332 PolarHBondContact OG-OE1 3.12Å
310	I	93.8	Very high	90.5	Very high	1 Å²	1	51.3 Å²	51.3	1%	0.005	28%	0.279	C	S	.	.	H	α-helix	trans	-55.4	-42.9	178.5	-63.9	178.7	0	0	0	111.5	L306 L313 I314 L329 I334 L341 S344	L306-I310 HydrophobicContact CD2-CD1 3.53Å; L306-I310 HydrophobicContact CD2-CG1 4.37Å; L306-I310 HydrophobicContact CG-CD1 4Å; L306-I310 WeakPolarHBondContact O-CG1 3.03Å; L306-I310 PolarHBondContact O-N 2.81Å; I310-L313 PolarHBondContact O-N 3.27Å; I310-I314 HydrophobicContact CG2-CG1 4.34Å; I310-I314 WeakPolarHBondContact O-CB 3.45Å; I310-I314 VanDerWaalsContact O-CG1 3.31Å; I310-I314 WeakPolarHBondContact O-CG1 3.32Å; I310-I314 PolarHBondContact O-N 3.34Å; I310-L329 HydrophobicContact CB-CD1 4.39Å; I310-L329 HydrophobicContact CG1-CD1 3.95Å; I310-L329 HydrophobicContact CG2-CD1 4.17Å; I310-I334 HydrophobicContact CD1-CG2 4.45Å; I310-L341 HydrophobicContact CD1-CB 4.46Å; I310-L341 HydrophobicContact CG2-CB 4.02Å; I310-L341 HydrophobicContact CG2-CG 4.11Å; I310-S344 WeakPolarHBondContact CG2-OG 3.26Å
311	N	93.6	Very high	90.9	Very high	78 Å²	78	51.6 Å²	51.6	42%	0.417	28%	0.284	S	S	.	.	H	α-helix	trans	-68.3	-33.5	176.4	-171.6	59.6	0	0	0	112.5	K307 S309 N315	K307-N311 VanDerWaalsContact O-CB 3.25Å; K307-N311 WeakPolarHBondContact O-CB 3.24Å; K307-N311 PolarHBondContact O-N 2.79Å; S309-N311 VanDerWaalsContact C-N 3.29Å; S309-N311 PolarHBondContact O-N 3.05Å; N311-N315 PolarHBondContact O-N 3.07Å; N311-N315 PolarHBondContact O-ND2 3.46Å; N311-N315 PolarHBondContact OD1-ND2 3.44Å
312	G	92.6	Very high	91.3	Very high	32 Å²	32	50.6 Å²	50.6	33%	0.33	28%	0.278	S	S	.	.	H	α-helix	trans	-65.1	-46	173	0	0	0	0	0	112.1	K308 S309 N315 K316	K308-G312 PolarHBondContact O-N 2.76Å; S309-G312 CarbonylContact O-C 3.6Å; S309-G312 WeakPolarHBondContact O-CA 3.4Å; S309-G312 PolarHBondContact O-N 3.47Å; G312-N315 PolarHBondContact O-N 3.39Å; G312-K316 WeakPolarHBondContact O-CG 3Å; G312-K316 PolarHBondContact O-N 3.38Å
313	L	93.1	Very high	91.4	Very high	6 Å²	6	53.1 Å²	53.1	3%	0.031	29%	0.293	C	S	.	.	H	α-helix	trans	-61.9	-51.9	177.8	-64.9	174.7	0	0	0	111.8	S309 I310 N315 K316 V317 I325 E328 L329	S309-L313 WeakPolarHBondContact O-CG 3.37Å; S309-L313 PolarHBondContact O-N 3.02Å; I310-L313 PolarHBondContact O-N 3.27Å; L313-N315 PolarHBondContact O-N 2.74Å; L313-K316 WeakPolarHBondContact O-CB 3.38Å; L313-K316 PolarHBondContact O-N 3.41Å; L313-V317 WeakPolarHBondContact O-CG2 3.22Å; L313-V317 PolarHBondContact O-N 2.95Å; L313-I325 HydrophobicContact CB-CG2 4.03Å; L313-I325 HydrophobicContact CD2-CD1 4.27Å; L313-I325 HydrophobicContact CD2-CG2 4.34Å; L313-E328 HydrophobicContact CD1-CB 4.21Å; L313-E328 HydrophobicContact CD2-CB 3.65Å; L313-E328 HydrophobicContact CD2-CG 4.39Å; L313-E328 WeakPolarHBondContact CD2-OE2 3.4Å; L313-L329 HydrophobicContact CD1-CB 3.94Å; L313-L329 HydrophobicContact CD1-CD1 3.87Å
314	I	94.6	Very high	91.5	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-62.7	-26.9	-179.3	-66	-57.5	0	0	0	112.8	I310 V317 L329 V345 A348 Y359 V362	I310-I314 HydrophobicContact CG2-CG1 4.34Å; I310-I314 WeakPolarHBondContact O-CB 3.45Å; I310-I314 VanDerWaalsContact O-CG1 3.31Å; I310-I314 WeakPolarHBondContact O-CG1 3.32Å; I310-I314 PolarHBondContact O-N 3.34Å; I314-V317 HydrophobicContact CD1-CG2 4.46Å; I314-L329 HydrophobicContact CD1-CD2 4.21Å; I314-V345 HydrophobicContact CD1-CG2 3.8Å; I314-V345 HydrophobicContact CG1-CG2 4.14Å; I314-V345 HydrophobicContact CG2-CG2 4.29Å; I314-A348 HydrophobicContact CG2-CB 3.72Å; I314-Y359 HydrophobicContact CG2-CE1 4.23Å; I314-Y359 WeakPolarHBondContact O-CE1 3.48Å; I314-V362 HydrophobicContact CD1-CG1 4.18Å
315	N	92.8	Very high	91.7	Very high	94 Å²	94	53 Å²	53	50%	0.503	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85	-6	173.9	-72.4	-64	0	0	0	114.2	N311 G312 L313	N311-N315 PolarHBondContact O-N 3.07Å; N311-N315 PolarHBondContact O-ND2 3.46Å; N311-N315 PolarHBondContact OD1-ND2 3.44Å; G312-N315 PolarHBondContact O-N 3.39Å; L313-N315 PolarHBondContact O-N 2.74Å
316	K	92.1	Very high	91.9	Very high	116 Å²	116	51.5 Å²	51.5	50%	0.504	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.7	-15.3	175.2	-73.7	172.3	178	-176.2	0	114.1	G312 L313 N318 N321 I325 E328	G312-K316 WeakPolarHBondContact O-CG 3Å; G312-K316 PolarHBondContact O-N 3.38Å; L313-K316 WeakPolarHBondContact O-CB 3.38Å; L313-K316 PolarHBondContact O-N 3.41Å; K316-N318 PolarHBondContact O-N 3.4Å; K316-N321 PolarHBondContact O-ND2 3.47Å; K316-I325 HydrophobicContact CB-CD1 3.9Å; K316-I325 HydrophobicContact CD-CD1 3.86Å; K316-E328 IonicContact NZ-OE2 4Å
317	V	92.9	Very high	91.8	Very high	10 Å²	10	56 Å²	56	6%	0.061	30%	0.304	C	S	.	.			trans	-63	131.5	-170.1	-158.1	0	0	0	0	111.5	L313 I314 I322 I325 V358 V362	L313-V317 WeakPolarHBondContact O-CG2 3.22Å; L313-V317 PolarHBondContact O-N 2.95Å; I314-V317 HydrophobicContact CD1-CG2 4.46Å; V317-I322 HydrophobicContact CG1-CB 4.26Å; V317-I322 HydrophobicContact CG1-CG1 4.07Å; V317-I325 HydrophobicContact CG2-CG2 3.96Å; V317-V358 HydrophobicContact CB-CG1 4.22Å; V317-V358 HydrophobicContact CG1-CG1 3.52Å; V317-V362 HydrophobicContact CG1-CG2 3.64Å; V317-V362 HydrophobicContact CG2-CG2 4.27Å
318	N	90.1	Very high	91.8	Very high	73 Å²	73	54.9 Å²	54.9	39%	0.39	30%	0.3	S	S	.	.			trans	-143.3	165.5	171.4	-170.4	16.8	0	0	0	108.5	K316 S320 N321 I322	K316-N318 PolarHBondContact O-N 3.4Å; N318-S320 VanDerWaalsContact C-N 3.31Å; N318-S320 PolarHBondContact O-N 2.91Å; N318-N321 PolarHBondContact N-OD1 3.29Å; N318-N321 PolarHBondContact O-N 2.84Å; N318-N321 PolarHBondContact O-OD1 2.98Å; N318-I322 PolarHBondContact O-N 3.35Å; N318-I322 VanDerWaalsContact O-N 3.16Å
319	V	89.5	Confident	91.8	Very high	45 Å²	45	49 Å²	49	27%	0.273	28%	0.275	S	S	.	.	G	3₁₀ helix	trans	-52.4	-49.1	-178.3	-176.7	0	0	0	0	111.4	N321 I322 V358 L501	V319-N321 VanDerWaalsContact C-N 3.29Å; V319-N321 PolarHBondContact O-N 3.39Å; V319-I322 WeakPolarHBondContact O-CG2 3.43Å; V319-V358 HydrophobicContact CG2-CG2 3.97Å; V319-L501 HydrophobicContact CB-CD2 4.39Å; V319-L501 HydrophobicContact CG1-CD2 4.06Å; V319-L501 HydrophobicContact CG1-CG 4.09Å; V319-L501 HydrophobicContact CG2-CD1 4.21Å; V319-L501 HydrophobicContact CG2-CD2 4.25Å; V319-L501 HydrophobicContact CG2-CG 4.29Å
320	S	89.3	Confident	91.6	Very high	117 Å²	117	48 Å²	48	82%	0.818	27%	0.266	S	S	*	.	G	3₁₀ helix	trans	-75	-4.9	-175.2	-40.6	0	0	0	0	116	N318	N318-S320 VanDerWaalsContact C-N 3.31Å; N318-S320 PolarHBondContact O-N 2.91Å
321	N	91.3	Very high	91.4	Very high	50 Å²	50	53.1 Å²	53.1	27%	0.267	29%	0.29	S	S	.	.	G	3₁₀ helix	trans	-127.7	3.6	-178.8	76.1	8	0	0	0	114.1	K316 N318 V319 V323 N324 I325	K316-N321 PolarHBondContact O-ND2 3.47Å; N318-N321 PolarHBondContact N-OD1 3.29Å; N318-N321 PolarHBondContact O-N 2.84Å; N318-N321 PolarHBondContact O-OD1 2.98Å; V319-N321 VanDerWaalsContact C-N 3.29Å; V319-N321 PolarHBondContact O-N 3.39Å; N321-V323 VanDerWaalsContact C-N 3.29Å; N321-V323 PolarHBondContact O-N 3.25Å; N321-N324 PolarHBondContact O-N 2.98Å; N321-I325 HydrophobicContact CB-CG1 4.36Å; N321-I325 WeakPolarHBondContact O-CG1 3.37Å; N321-I325 PolarHBondContact O-N 2.99Å
322	I	91.4	Very high	91.2	Very high	3 Å²	3	51.9 Å²	51.9	2%	0.015	28%	0.282	C	S	.	.	H	α-helix	trans	-56.7	-40.6	-172.5	-171.2	167.8	0	0	0	112.6	V317 N318 V319 I325 I326 V358 V362 I365 L501 L503	V317-I322 HydrophobicContact CG1-CB 4.26Å; V317-I322 HydrophobicContact CG1-CG1 4.07Å; N318-I322 PolarHBondContact O-N 3.35Å; N318-I322 VanDerWaalsContact O-N 3.16Å; V319-I322 WeakPolarHBondContact O-CG2 3.43Å; I322-I325 PolarHBondContact O-N 3.22Å; I322-I326 HydrophobicContact CD1-CD1 4.41Å; I322-I326 HydrophobicContact CG1-CD1 3.7Å; I322-I326 HydrophobicContact CG1-CG1 4.46Å; I322-I326 WeakPolarHBondContact O-CB 3.14Å; I322-I326 WeakPolarHBondContact O-CD1 3.44Å; I322-I326 WeakPolarHBondContact O-CG1 3.11Å; I322-I326 PolarHBondContact O-N 3.47Å; I322-V358 HydrophobicContact CD1-CG1 4.3Å; I322-V362 HydrophobicContact CD1-CG2 3.77Å; I322-V362 HydrophobicContact CG1-CG2 3.85Å; I322-I365 HydrophobicContact CD1-CD1 4.35Å; I322-L501 HydrophobicContact CD1-CD2 3.91Å; I322-L503 HydrophobicContact CD1-CD1 4.37Å; I322-L503 HydrophobicContact CG2-CD1 3.52Å
323	V	89.5	Confident	91	Very high	73 Å²	73	51 Å²	51	44%	0.442	27%	0.27	S	S	.	.	H	α-helix	trans	-60.5	-55.8	178.3	-178	0	0	0	0	111	N321 I325 I326 Q327	N321-V323 VanDerWaalsContact C-N 3.29Å; N321-V323 PolarHBondContact O-N 3.25Å; V323-I325 VanDerWaalsContact C-N 3.34Å; V323-I325 PolarHBondContact O-N 3.49Å; V323-I326 PolarHBondContact O-N 3.34Å; V323-I326 VanDerWaalsContact O-N 3.08Å; V323-Q327 PolarHBondContact O-N 3.39Å
324	N	90.9	Very high	90.9	Very high	97 Å²	97	50.8 Å²	50.8	52%	0.519	27%	0.268	S	S	.	.	H	α-helix	trans	-61.6	-41.3	-179.4	-55.7	39.4	0	0	0	111.7	N321 I326 Q327 E328	N321-N324 PolarHBondContact O-N 2.98Å; N324-I326 VanDerWaalsContact C-N 3.28Å; N324-I326 PolarHBondContact O-N 2.87Å; N324-Q327 PolarHBondContact O-N 2.88Å; N324-E328 PolarHBondContact O-N 2.92Å
325	I	92.8	Very high	90.6	Very high	9 Å²	9	53.8 Å²	53.8	5%	0.046	29%	0.287	C	S	.	.	H	α-helix	trans	-66.8	-31.2	177.4	-63.5	-66.9	0	0	0	111.3	L313 K316 V317 N321 I322 V323 L329	L313-I325 HydrophobicContact CB-CG2 4.03Å; L313-I325 HydrophobicContact CD2-CD1 4.27Å; L313-I325 HydrophobicContact CD2-CG2 4.34Å; K316-I325 HydrophobicContact CB-CD1 3.9Å; K316-I325 HydrophobicContact CD-CD1 3.86Å; V317-I325 HydrophobicContact CG2-CG2 3.96Å; N321-I325 HydrophobicContact CB-CG1 4.36Å; N321-I325 WeakPolarHBondContact O-CG1 3.37Å; N321-I325 PolarHBondContact O-N 2.99Å; I322-I325 PolarHBondContact O-N 3.22Å; V323-I325 VanDerWaalsContact C-N 3.34Å; V323-I325 PolarHBondContact O-N 3.49Å; I325-L329 WeakPolarHBondContact O-CB 3.49Å; I325-L329 PolarHBondContact O-N 3.08Å
326	I	91.4	Very high	90.4	Very high	10 Å²	10	51.8 Å²	51.8	5%	0.051	27%	0.272	C	S	.	.	H	α-helix	trans	-74.3	-37.3	174.2	-73.2	168.6	0	0	0	111.5	I322 V323 N324 L329 L330 V362 I365	I322-I326 HydrophobicContact CD1-CD1 4.41Å; I322-I326 HydrophobicContact CG1-CD1 3.7Å; I322-I326 HydrophobicContact CG1-CG1 4.46Å; I322-I326 WeakPolarHBondContact O-CB 3.14Å; I322-I326 WeakPolarHBondContact O-CD1 3.44Å; I322-I326 WeakPolarHBondContact O-CG1 3.11Å; I322-I326 PolarHBondContact O-N 3.47Å; V323-I326 PolarHBondContact O-N 3.34Å; V323-I326 VanDerWaalsContact O-N 3.08Å; N324-I326 VanDerWaalsContact C-N 3.28Å; N324-I326 PolarHBondContact O-N 2.87Å; I326-L329 PolarHBondContact O-N 3.23Å; I326-L329 VanDerWaalsContact O-N 3.17Å; I326-L330 HydrophobicContact CG2-CD1 3.8Å; I326-L330 HydrophobicContact CG2-CG 4.2Å; I326-L330 WeakPolarHBondContact O-CB 3.46Å; I326-L330 VanDerWaalsContact O-CG 3.32Å; I326-L330 WeakPolarHBondContact O-CG 3.43Å; I326-L330 PolarHBondContact O-N 3.38Å; I326-V362 HydrophobicContact CD1-CG2 4.34Å; I326-I365 HydrophobicContact CD1-CB 3.91Å; I326-I365 HydrophobicContact CD1-CD1 3.33Å; I326-I365 HydrophobicContact CD1-CG1 4.22Å; I326-I365 HydrophobicContact CD1-CG2 3.97Å; I326-I365 HydrophobicContact CG2-CG2 3.94Å
327	Q	90.3	Very high	90.3	Very high	94 Å²	94	46.3 Å²	46.3	44%	0.439	25%	0.248	S	C	.	.	H	α-helix	trans	-60.3	-49.6	170	-69.3	170.3	-18.3	0	0	111	V323 N324 L329 L330 Q331	V323-Q327 PolarHBondContact O-N 3.39Å; N324-Q327 PolarHBondContact O-N 2.88Å; Q327-L329 PolarHBondContact O-N 2.93Å; Q327-L330 PolarHBondContact O-N 3.06Å; Q327-Q331 VanDerWaalsContact O-CG 3.26Å; Q327-Q331 WeakPolarHBondContact O-CG 3.26Å; Q327-Q331 PolarHBondContact O-N 2.9Å; Q327-Q331 VanDerWaalsContact O-N 3.09Å
328	E	91.5	Very high	90.2	Very high	80 Å²	80	48.6 Å²	48.6	37%	0.374	26%	0.256	S	S	.	.	H	α-helix	trans	-56.6	-35.7	172.2	-76.1	-179.1	-143.2	0	0	112.1	L313 K316 N324	L313-E328 HydrophobicContact CD1-CB 4.21Å; L313-E328 HydrophobicContact CD2-CB 3.65Å; L313-E328 HydrophobicContact CD2-CG 4.39Å; L313-E328 WeakPolarHBondContact CD2-OE2 3.4Å; K316-E328 IonicContact NZ-OE2 4Å; N324-E328 PolarHBondContact O-N 2.92Å
329	L	91.7	Very high	90.2	Very high	1 Å²	1	45.1 Å²	45.1	1%	0.005	24%	0.237	C	C	.	.	H	α-helix	trans	-77.6	-37.9	-178.3	-174.9	60.2	0	0	0	113.3	I310 L313 I314 I325 I326 Q327 Q331 E332 I334 L341 V362 I366	I310-L329 HydrophobicContact CB-CD1 4.39Å; I310-L329 HydrophobicContact CG1-CD1 3.95Å; I310-L329 HydrophobicContact CG2-CD1 4.17Å; L313-L329 HydrophobicContact CD1-CB 3.94Å; L313-L329 HydrophobicContact CD1-CD1 3.87Å; I314-L329 HydrophobicContact CD1-CD2 4.21Å; I325-L329 WeakPolarHBondContact O-CB 3.49Å; I325-L329 PolarHBondContact O-N 3.08Å; I326-L329 PolarHBondContact O-N 3.23Å; I326-L329 VanDerWaalsContact O-N 3.17Å; Q327-L329 PolarHBondContact O-N 2.93Å; L329-Q331 VanDerWaalsContact C-N 3.27Å; L329-E332 PolarHBondContact O-N 3.23Å; L329-I334 HydrophobicContact CD1-CG2 4Å; L329-I334 HydrophobicContact CG-CG2 4.13Å; L329-I334 VanDerWaalsContact O-CG2 3.24Å; L329-I334 WeakPolarHBondContact O-CG2 3.18Å; L329-L341 HydrophobicContact CD1-CD1 4.11Å; L329-L341 HydrophobicContact CD2-CD1 4.22Å; L329-L341 HydrophobicContact CG-CD1 4.35Å; L329-V362 HydrophobicContact CD2-CG1 4.45Å; L329-I366 HydrophobicContact CD2-CD1 3.8Å
330	L	89.6	Confident	90.3	Very high	19 Å²	19	43.4 Å²	43.4	10%	0.099	23%	0.226	C	C	.	.	H	α-helix	trans	-70.1	-26.1	174.3	-72	168.6	0	0	0	111.8	I326 Q327 E332 I334 F370 Y542 I549	I326-L330 HydrophobicContact CG2-CD1 3.8Å; I326-L330 HydrophobicContact CG2-CG 4.2Å; I326-L330 WeakPolarHBondContact O-CB 3.46Å; I326-L330 VanDerWaalsContact O-CG 3.32Å; I326-L330 WeakPolarHBondContact O-CG 3.43Å; I326-L330 PolarHBondContact O-N 3.38Å; Q327-L330 PolarHBondContact O-N 3.06Å; L330-E332 PolarHBondContact O-N 2.81Å; L330-I334 HydrophobicContact CD2-CD1 4.01Å; L330-F370 HydrophobicContact CD2-CD2 4.48Å; L330-F370 HydrophobicContact CD2-CE2 3.84Å; L330-Y542 PolarHBondContact O-OH 3.35Å; L330-I549 HydrophobicContact CD1-CG2 4.06Å
331	Q	89.1	Confident	90.6	Very high	108 Å²	108	37.8 Å²	37.8	51%	0.505	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-26.8	173.3	-74.8	173.3	27.7	0	0	113.6	Q327 L329 K546 L550	Q327-Q331 VanDerWaalsContact O-CG 3.26Å; Q327-Q331 WeakPolarHBondContact O-CG 3.26Å; Q327-Q331 PolarHBondContact O-N 2.9Å; Q327-Q331 VanDerWaalsContact O-N 3.09Å; L329-Q331 VanDerWaalsContact C-N 3.27Å; Q331-K546 PolarHBondContact O-NZ 3.34Å; Q331-L550 HydrophobicContact CG-CD1 4.39Å
332	E	88.4	Confident	90.7	Very high	53 Å²	53	35.4 Å²	35.4	25%	0.248	18%	0.175	C	C	.	.	S	Bend	trans	-86.1	152.7	173.7	-75.3	-83.2	-166.8	0	0	111.6	S309 L329 L330 I334 Y542	S309-E332 WeakPolarHBondContact CB-OE1 3.27Å; S309-E332 PolarHBondContact OG-OE1 3.12Å; L329-E332 PolarHBondContact O-N 3.23Å; L330-E332 PolarHBondContact O-N 2.81Å; E332-I334 PolarHBondContact O-N 2.85Å; E332-Y542 VanDerWaalsContact O-CE1 3.22Å; E332-Y542 WeakPolarHBondContact O-CE1 3.3Å; E332-Y542 PolarHBondContact O-OH 3.09Å
333	N	89.4	Confident	90.8	Very high	14 Å²	14	40.4 Å²	40.4	8%	0.075	19%	0.193	C	C	.	.			trans	-76.3	80.7	-178.2	-171.4	-28.6	0	0	0	112.2	L306 V335 R336 G337 N538 Y542	L306-N333 HydrophobicContact CD1-CB 4.16Å; N333-V335 VanDerWaalsContact C-N 3.29Å; N333-V335 PolarHBondContact O-N 2.75Å; N333-V335 PolarHBondContact OD1-N 2.66Å; N333-R336 HydrophobicContact CB-CB 4.33Å; N333-R336 PolarHBondContact O-N 2.8Å; N333-R336 VanDerWaalsContact OD1-CB 3.26Å; N333-R336 WeakPolarHBondContact OD1-CB 3.49Å; N333-R336 PolarHBondContact OD1-N 3.44Å; N333-G337 PolarHBondContact O-N 2.78Å; N333-N538 PolarHBondContact ND2-O 3.41Å; N333-Y542 HydrophobicContact CB-CD1 3.85Å; N333-Y542 HydrophobicContact CB-CD2 4.45Å; N333-Y542 HydrophobicContact CB-CE1 4.25Å; N333-Y542 HydrophobicContact CB-CG 3.98Å; N333-Y542 VanDerWaalsContact CG-CG 3.44Å; N333-Y542 WeakPolarHBondContact ND2-CB 3.29Å; N333-Y542 WeakPolarHBondContact OD1-CD2 3.43Å
334	I	89.6	Confident	91	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-18	-177.8	65.6	172.2	0	0	0	114.1	I310 L329 L330 E332 G337 R338 L341 I366 F370 I373 Y542	I310-I334 HydrophobicContact CD1-CG2 4.45Å; L329-I334 HydrophobicContact CD1-CG2 4Å; L329-I334 HydrophobicContact CG-CG2 4.13Å; L329-I334 VanDerWaalsContact O-CG2 3.24Å; L329-I334 WeakPolarHBondContact O-CG2 3.18Å; L330-I334 HydrophobicContact CD2-CD1 4.01Å; E332-I334 PolarHBondContact O-N 2.85Å; I334-G337 CarbonylContact O-C 3.6Å; I334-G337 PolarHBondContact O-N 3.09Å; I334-R338 VanDerWaalsContact O-CA 3.26Å; I334-R338 WeakPolarHBondContact O-CA 3.46Å; I334-R338 PolarHBondContact O-N 3.1Å; I334-L341 HydrophobicContact CB-CD1 3.86Å; I334-L341 HydrophobicContact CG2-CD1 3.66Å; I334-I366 HydrophobicContact CD1-CG2 4.28Å; I334-F370 HydrophobicContact CD1-CD2 3.8Å; I334-F370 HydrophobicContact CD1-CE2 3.86Å; I334-F370 HydrophobicContact CG1-CD2 4.44Å; I334-F370 HydrophobicContact CG1-CE2 4.27Å; I334-I373 HydrophobicContact CB-CD1 4.33Å; I334-I373 HydrophobicContact CD1-CD1 3.98Å; I334-I373 HydrophobicContact CG1-CD1 3.94Å; I334-Y542 HydrophobicContact CG1-CE2 4.29Å
335	V	89.1	Confident	91.2	Very high	64 Å²	64	32.7 Å²	32.7	39%	0.388	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-52.4	172.9	174.1	0	0	0	0	110	N333 G337 R338 F370 Y542	N333-V335 VanDerWaalsContact C-N 3.29Å; N333-V335 PolarHBondContact O-N 2.75Å; N333-V335 PolarHBondContact OD1-N 2.66Å; V335-G337 PolarHBondContact O-N 3.36Å; V335-R338 WeakPolarHBondContact O-CB 3.5Å; V335-R338 WeakPolarHBondContact O-CG 3.43Å; V335-R338 PolarHBondContact O-N 3.04Å; V335-F370 HydrophobicContact CG2-CD1 3.8Å; V335-F370 HydrophobicContact CG2-CE1 3.52Å; V335-F370 HydrophobicContact CG2-CZ 4.36Å; V335-Y542 HydrophobicContact CB-CD2 4.1Å; V335-Y542 HydrophobicContact CB-CE2 4.38Å; V335-Y542 HydrophobicContact CG2-CD2 3.93Å; V335-Y542 HydrophobicContact CG2-CE2 3.92Å
336	R	88.9	Confident	91.3	Very high	52 Å²	52	33.8 Å²	33.8	20%	0.196	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-38.8	169.4	-173.9	175.6	70.1	142	-7.4	110.7	S302 W303 N333 R338 E539	S302-R336 PolarHBondContact OG-NH1 2.93Å; S302-R336 PolarHBondContact OG-NH2 3.49Å; W303-R336 HydrophobicContact CE3-CG 4.45Å; W303-R336 HydrophobicContact CZ3-CG 4.14Å; W303-R336 WeakPolarHBondContact CZ3-O 3.46Å; N333-R336 HydrophobicContact CB-CB 4.33Å; N333-R336 PolarHBondContact O-N 2.8Å; N333-R336 VanDerWaalsContact OD1-CB 3.26Å; N333-R336 WeakPolarHBondContact OD1-CB 3.49Å; N333-R336 PolarHBondContact OD1-N 3.44Å; R336-R338 VanDerWaalsContact C-N 3.32Å; R336-R338 PolarHBondContact O-N 3.13Å; R336-E539 IonicContact NH2-OE1 3.73Å
337	G	88.8	Confident	91.4	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-2.3	179.2	0	0	0	0	0	116.3	N333 I334 V335 G339 L340 L341	N333-G337 PolarHBondContact O-N 2.78Å; I334-G337 CarbonylContact O-C 3.6Å; I334-G337 PolarHBondContact O-N 3.09Å; V335-G337 PolarHBondContact O-N 3.36Å; G337-G339 VanDerWaalsContact C-N 3.3Å; G337-G339 PolarHBondContact O-N 2.77Å; G337-G339 VanDerWaalsContact O-N 3.1Å; G337-L340 CarbonylContact O-C 3.59Å; G337-L340 WeakPolarHBondContact O-CA 3.27Å; G337-L340 WeakPolarHBondContact O-CB 3.44Å; G337-L340 PolarHBondContact O-N 3.39Å; G337-L341 PolarHBondContact O-N 2.8Å
338	R	90.9	Very high	91.5	Very high	58 Å²	58	34.3 Å²	34.3	22%	0.219	16%	0.159	C	C	.	.	H	α-helix	trans	-56.7	-39.1	-162.4	74.1	-175.2	-157.8	-173.1	8.3	114.4	I334 V335 R336 A342 I373 L376 E523 L526	I334-R338 VanDerWaalsContact O-CA 3.26Å; I334-R338 WeakPolarHBondContact O-CA 3.46Å; I334-R338 PolarHBondContact O-N 3.1Å; V335-R338 WeakPolarHBondContact O-CB 3.5Å; V335-R338 WeakPolarHBondContact O-CG 3.43Å; V335-R338 PolarHBondContact O-N 3.04Å; R336-R338 VanDerWaalsContact C-N 3.32Å; R336-R338 PolarHBondContact O-N 3.13Å; R338-A342 VanDerWaalsContact O-CB 3.26Å; R338-A342 WeakPolarHBondContact O-CB 3.47Å; R338-A342 PolarHBondContact O-N 2.97Å; R338-I373 HydrophobicContact CB-CD1 4.35Å; R338-I373 HydrophobicContact CB-CG1 4.07Å; R338-L376 HydrophobicContact CB-CD2 4.34Å; R338-L376 HydrophobicContact CG-CD2 3.88Å; R338-E523 IonicContact CZ-OE2 3.39Å; R338-E523 IonicContact NE-OE2 2.75Å; R338-E523 IonicContact NH2-OE1 3.69Å; R338-E523 PolarHBondContact NH2-OE1 2.92Å; R338-E523 IonicContact NH2-OE2 3.5Å; R338-E523 PolarHBondContact NH2-OE2 3.08Å; R338-L526 HydrophobicContact CG-CD1 3.88Å; R338-L526 VanDerWaalsContact NE-CD1 3.28Å
339	G	91.4	Very high	91.7	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-67.4	-37.3	175	0	0	0	0	0	113.4	G337 R343 R380 N527	G337-G339 VanDerWaalsContact C-N 3.3Å; G337-G339 PolarHBondContact O-N 2.77Å; G337-G339 VanDerWaalsContact O-N 3.1Å; G339-R343 VanDerWaalsContact O-CB 3.23Å; G339-R343 WeakPolarHBondContact O-CB 3.31Å; G339-R343 PolarHBondContact O-N 2.9Å; G339-R343 VanDerWaalsContact O-N 3.14Å; G339-R380 PolarHBondContact O-NH1 3.49Å; G339-N527 VanDerWaalsContact C-OD1 3.3Å; G339-N527 PolarHBondContact O-OD1 3.02Å
340	L	92.1	Very high	91.7	Very high	9 Å²	9	33.3 Å²	33.3	5%	0.047	16%	0.164	C	C	.	.	H	α-helix	trans	-70	-44.9	176.1	-62.3	174.8	0	0	0	111.6	W303 L306 K307 G337 R343 S344	W303-L340 HydrophobicContact CD2-CD1 4.04Å; W303-L340 HydrophobicContact CE3-CD1 4.19Å; W303-L340 HydrophobicContact CH2-CD1 3.77Å; W303-L340 HydrophobicContact CH2-CG 3.88Å; W303-L340 HydrophobicContact CZ2-CD1 3.59Å; W303-L340 HydrophobicContact CZ2-CD2 3.85Å; W303-L340 HydrophobicContact CZ2-CG 3.69Å; W303-L340 HydrophobicContact CZ3-CD1 4.05Å; L306-L340 HydrophobicContact CD2-CD1 3.62Å; K307-L340 HydrophobicContact CB-CD1 3.86Å; K307-L340 HydrophobicContact CD-CD2 4.1Å; K307-L340 HydrophobicContact CG-CD1 4.33Å; K307-L340 HydrophobicContact CG-CD2 4.14Å; G337-L340 CarbonylContact O-C 3.59Å; G337-L340 WeakPolarHBondContact O-CA 3.27Å; G337-L340 WeakPolarHBondContact O-CB 3.44Å; G337-L340 PolarHBondContact O-N 3.39Å; L340-R343 CarbonylContact O-C 3.55Å; L340-R343 WeakPolarHBondContact O-CB 3.39Å; L340-R343 PolarHBondContact O-N 2.84Å; L340-S344 PolarHBondContact O-N 2.86Å; L340-S344 PolarHBondContact O-OG 3.25Å
341	L	94.1	Very high	91.8	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-63.6	-50.4	178.8	-170.7	157.5	0	0	0	111.2	I310 L329 I334 G337 R343 S344 V345 I366 I373 I377	I310-L341 HydrophobicContact CD1-CB 4.46Å; I310-L341 HydrophobicContact CG2-CB 4.02Å; I310-L341 HydrophobicContact CG2-CG 4.11Å; L329-L341 HydrophobicContact CD1-CD1 4.11Å; L329-L341 HydrophobicContact CD2-CD1 4.22Å; L329-L341 HydrophobicContact CG-CD1 4.35Å; I334-L341 HydrophobicContact CB-CD1 3.86Å; I334-L341 HydrophobicContact CG2-CD1 3.66Å; G337-L341 PolarHBondContact O-N 2.8Å; L341-R343 PolarHBondContact O-N 3.09Å; L341-S344 WeakPolarHBondContact CA-OG 3.42Å; L341-S344 PolarHBondContact O-N 2.81Å; L341-S344 VanDerWaalsContact O-N 3.13Å; L341-S344 PolarHBondContact O-OG 3.1Å; L341-V345 HydrophobicContact CD2-CG2 3.99Å; L341-V345 WeakPolarHBondContact O-CG2 3.3Å; L341-V345 PolarHBondContact O-N 2.99Å; L341-I366 HydrophobicContact CD1-CD1 4.11Å; L341-I366 HydrophobicContact CD2-CD1 4.08Å; L341-I373 HydrophobicContact CD2-CG2 4.1Å; L341-I377 HydrophobicContact CD2-CD1 4Å
342	A	94.2	Very high	91.9	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-59.2	-32.9	176.1	0	0	0	0	0	112	R338 L346 L376 I377	R338-A342 VanDerWaalsContact O-CB 3.26Å; R338-A342 WeakPolarHBondContact O-CB 3.47Å; R338-A342 PolarHBondContact O-N 2.97Å; A342-L346 WeakPolarHBondContact O-CB 3.38Å; A342-L346 WeakPolarHBondContact O-CD1 3.38Å; A342-L346 VanDerWaalsContact O-CG 3.24Å; A342-L346 WeakPolarHBondContact O-CG 3.34Å; A342-L346 PolarHBondContact O-N 2.85Å; A342-L376 HydrophobicContact CB-CD2 4.44Å; A342-L376 HydrophobicContact CB-CG 4.38Å; A342-I377 HydrophobicContact CB-CD1 4.39Å; A342-I377 HydrophobicContact CB-CG1 3.48Å; A342-I377 VanDerWaalsContact CB-CG1 3.48Å
343	R	93.2	Very high	92	Very high	108 Å²	108	32.5 Å²	32.5	41%	0.408	18%	0.182	S	C	.	.	H	α-helix	trans	-71.9	-46.4	173.6	176.6	177.1	173.2	158.3	5.7	112.5	G339 L340 L341 L346 Q347	G339-R343 VanDerWaalsContact O-CB 3.23Å; G339-R343 WeakPolarHBondContact O-CB 3.31Å; G339-R343 PolarHBondContact O-N 2.9Å; G339-R343 VanDerWaalsContact O-N 3.14Å; L340-R343 CarbonylContact O-C 3.55Å; L340-R343 WeakPolarHBondContact O-CB 3.39Å; L340-R343 PolarHBondContact O-N 2.84Å; L341-R343 PolarHBondContact O-N 3.09Å; R343-L346 PolarHBondContact O-N 3Å; R343-Q347 HydrophobicContact CG-CG 4.25Å; R343-Q347 WeakPolarHBondContact O-CB 3.42Å; R343-Q347 VanDerWaalsContact O-CG 3.28Å; R343-Q347 WeakPolarHBondContact O-CG 3.43Å; R343-Q347 PolarHBondContact O-N 2.91Å
344	S	94.1	Very high	92.1	Very high	8 Å²	8	38 Å²	38	6%	0.056	21%	0.21	C	C	.	.	H	α-helix	trans	-65.8	-41	-178.3	52.2	0	0	0	0	111.8	I310 L340 L341 Q347 A348	I310-S344 WeakPolarHBondContact CG2-OG 3.26Å; L340-S344 PolarHBondContact O-N 2.86Å; L340-S344 PolarHBondContact O-OG 3.25Å; L341-S344 WeakPolarHBondContact CA-OG 3.42Å; L341-S344 PolarHBondContact O-N 2.81Å; L341-S344 VanDerWaalsContact O-N 3.13Å; L341-S344 PolarHBondContact O-OG 3.1Å; S344-Q347 PolarHBondContact O-N 2.92Å; S344-A348 VanDerWaalsContact O-CB 3.24Å; S344-A348 WeakPolarHBondContact O-CB 3.26Å; S344-A348 PolarHBondContact O-N 3.33Å
345	V	95.1	Very high	92.3	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-60.3	-50.6	174.9	174.6	0	0	0	0	110.9	I314 L341 Q347 A348 Q349 V363 F403	I314-V345 HydrophobicContact CD1-CG2 3.8Å; I314-V345 HydrophobicContact CG1-CG2 4.14Å; I314-V345 HydrophobicContact CG2-CG2 4.29Å; L341-V345 HydrophobicContact CD2-CG2 3.99Å; L341-V345 WeakPolarHBondContact O-CG2 3.3Å; L341-V345 PolarHBondContact O-N 2.99Å; V345-Q347 VanDerWaalsContact C-N 3.33Å; V345-Q347 PolarHBondContact O-N 3.29Å; V345-A348 PolarHBondContact O-N 2.92Å; V345-Q349 VanDerWaalsContact O-CB 3.32Å; V345-Q349 WeakPolarHBondContact O-CB 3.21Å; V345-Q349 PolarHBondContact O-N 3.06Å; V345-V363 HydrophobicContact CG1-CG2 3.92Å; V345-F403 HydrophobicContact CG1-CE1 4.04Å; V345-F403 HydrophobicContact CG1-CZ 3.66Å
346	L	93.9	Very high	92.5	Very high	32 Å²	32	38.8 Å²	38.8	17%	0.168	21%	0.208	C	C	.	.	H	α-helix	trans	-64.6	-33.7	178.8	-72.4	169.8	0	0	0	113.2	A342 R343 A350 R380 L381 F403	A342-L346 WeakPolarHBondContact O-CB 3.38Å; A342-L346 WeakPolarHBondContact O-CD1 3.38Å; A342-L346 VanDerWaalsContact O-CG 3.24Å; A342-L346 WeakPolarHBondContact O-CG 3.34Å; A342-L346 PolarHBondContact O-N 2.85Å; R343-L346 PolarHBondContact O-N 3Å; L346-A350 VanDerWaalsContact O-CB 3.27Å; L346-A350 WeakPolarHBondContact O-CB 2.95Å; L346-A350 PolarHBondContact O-N 3.15Å; L346-R380 HydrophobicContact CD1-CB 3.55Å; L346-L381 HydrophobicContact CD2-CB 4.11Å; L346-L381 HydrophobicContact CD2-CD1 3.91Å; L346-F403 HydrophobicContact CD2-CD1 3.97Å; L346-F403 HydrophobicContact CD2-CE1 3.8Å
347	Q	93.6	Very high	92.7	Very high	110 Å²	110	38.6 Å²	38.6	51%	0.514	21%	0.209	S	C	.	.	H	α-helix	trans	-75.4	-38.8	176.4	-70.4	-162.1	-95.4	0	0	112.6	R343 S344 V345 A351	R343-Q347 HydrophobicContact CG-CG 4.25Å; R343-Q347 WeakPolarHBondContact O-CB 3.42Å; R343-Q347 VanDerWaalsContact O-CG 3.28Å; R343-Q347 WeakPolarHBondContact O-CG 3.43Å; R343-Q347 PolarHBondContact O-N 2.91Å; S344-Q347 PolarHBondContact O-N 2.92Å; V345-Q347 VanDerWaalsContact C-N 3.33Å; V345-Q347 PolarHBondContact O-N 3.29Å; Q347-A351 WeakPolarHBondContact O-CB 3.24Å; Q347-A351 PolarHBondContact O-N 3.38Å; Q347-A351 VanDerWaalsContact O-N 3.11Å
348	A	93.5	Very high	92.9	Very high	4 Å²	4	38.6 Å²	38.6	3%	0.033	21%	0.209	C	C	.	.	H	α-helix	trans	-68	-43.5	176.7	0	0	0	0	0	111.5	I314 S344 V345 A350 A351 S352 Y359	I314-A348 HydrophobicContact CG2-CB 3.72Å; S344-A348 VanDerWaalsContact O-CB 3.24Å; S344-A348 WeakPolarHBondContact O-CB 3.26Å; S344-A348 PolarHBondContact O-N 3.33Å; V345-A348 PolarHBondContact O-N 2.92Å; A348-A350 PolarHBondContact O-N 3.1Å; A348-A351 PolarHBondContact O-N 3.4Å; A348-S352 WeakPolarHBondContact O-CB 3.49Å; A348-S352 PolarHBondContact O-N 2.66Å; A348-Y359 HydrophobicContact CB-CE1 4.17Å; A348-Y359 HydrophobicContact CB-CE2 4.32Å
349	Q	94.4	Very high	93.1	Very high	4 Å²	4	36.2 Å²	36.2	2%	0.019	20%	0.2	C	C	.	.	H	α-helix	trans	-62.6	-42.9	175.9	-169.9	-79.3	-31	0	0	112.4	V345 A351 S352 P353 T356 Y359 T399 F403	V345-Q349 VanDerWaalsContact O-CB 3.32Å; V345-Q349 WeakPolarHBondContact O-CB 3.21Å; V345-Q349 PolarHBondContact O-N 3.06Å; Q349-A351 VanDerWaalsContact C-N 3.29Å; Q349-A351 PolarHBondContact O-N 2.86Å; Q349-S352 CarbonylContact O-C 3.59Å; Q349-S352 PolarHBondContact O-N 2.88Å; Q349-P353 WeakPolarHBondContact O-CA 3.41Å; Q349-T356 HydrophobicContact CG-CG2 3.75Å; Q349-T356 PolarHBondContact NE2-OG1 3.43Å; Q349-Y359 HydrophobicContact CB-CD2 3.81Å; Q349-Y359 HydrophobicContact CB-CE2 4.32Å; Q349-Y359 HydrophobicContact CG-CD2 4.09Å; Q349-T399 PolarHBondContact NE2-O 3.46Å; Q349-T399 PolarHBondContact OE1-O 3.24Å; Q349-F403 HydrophobicContact CB-CD1 4.4Å; Q349-F403 HydrophobicContact CG-CB 4.06Å; Q349-F403 HydrophobicContact CG-CD1 3.96Å; Q349-F403 HydrophobicContact CG-CD2 4.21Å; Q349-F403 HydrophobicContact CG-CE1 4.48Å; Q349-F403 HydrophobicContact CG-CG 3.83Å
350	A	91.9	Very high	93.3	Very high	57 Å²	57	36.2 Å²	36.2	47%	0.471	20%	0.2	S	C	.	.	H	α-helix	trans	-69.2	-25.7	178	0	0	0	0	0	113.4	L346 A348	L346-A350 VanDerWaalsContact O-CB 3.27Å; L346-A350 WeakPolarHBondContact O-CB 2.95Å; L346-A350 PolarHBondContact O-N 3.15Å; A348-A350 PolarHBondContact O-N 3.1Å
351	A	92.1	Very high	93.3	Very high	79 Å²	79	35.9 Å²	35.9	65%	0.653	20%	0.199	S	C	*	.	H	α-helix	trans	-82.4	-36.5	173.5	0	0	0	0	0	112.7	Q347 A348 Q349	Q347-A351 WeakPolarHBondContact O-CB 3.24Å; Q347-A351 PolarHBondContact O-N 3.38Å; Q347-A351 VanDerWaalsContact O-N 3.11Å; A348-A351 PolarHBondContact O-N 3.4Å; Q349-A351 VanDerWaalsContact C-N 3.29Å; Q349-A351 PolarHBondContact O-N 2.86Å
352	S	91.7	Very high	93.3	Very high	46 Å²	46	36 Å²	36	32%	0.322	20%	0.199	S	C	.	.			trans	-129.6	67.7	-171.6	-59.8	0	0	0	0	112.5	A348 Q349 I354 F355	A348-S352 WeakPolarHBondContact O-CB 3.49Å; A348-S352 PolarHBondContact O-N 2.66Å; Q349-S352 CarbonylContact O-C 3.59Å; Q349-S352 PolarHBondContact O-N 2.88Å; S352-I354 PolarHBondContact O-N 2.89Å; S352-F355 PolarHBondContact O-N 3.2Å
353	P	90.6	Very high	93.3	Very high	38 Å²	38	36 Å²	36	25%	0.247	20%	0.2	C	C	.	.	G	3₁₀ helix	trans	-66.8	-11.4	-172	-20.7	34.3	0	0	0	114.9	Q349 T356 T399 K402	Q349-P353 WeakPolarHBondContact O-CA 3.41Å; P353-T356 VanDerWaalsContact C-OG1 3.31Å; P353-T356 WeakPolarHBondContact CA-OG1 3.21Å; P353-T356 WeakPolarHBondContact O-CB 3.41Å; P353-T356 PolarHBondContact O-N 2.73Å; P353-T356 PolarHBondContact O-OG1 3.29Å; P353-T399 HydrophobicContact CB-CG2 4.01Å; P353-T399 HydrophobicContact CG-CG2 3.41Å; P353-T399 VanDerWaalsContact CG-CG2 3.41Å; P353-K402 VanDerWaalsContact O-CE 3.3Å; P353-K402 WeakPolarHBondContact O-CE 3.4Å
354	I	92.1	Very high	93.4	Very high	130 Å²	130	31.2 Å²	31.2	67%	0.667	18%	0.183	S	C	*	.	G	3₁₀ helix	trans	-60	-48.7	174.8	-59.5	174.6	0	0	0	109.7	S352 T356 H357	S352-I354 PolarHBondContact O-N 2.89Å; I354-T356 PolarHBondContact O-N 3.22Å; I354-T356 VanDerWaalsContact O-N 3.14Å; I354-H357 PolarHBondContact O-CE1 3.15Å; I354-H357 PolarHBondContact O-ND1 3.37Å
355	F	91.8	Very high	93.3	Very high	80 Å²	80	32.4 Å²	32.4	35%	0.351	19%	0.188	S	C	.	.	G	3₁₀ helix	trans	-81.2	16	-177.1	-57.7	-69.8	0	0	0	114.3	S352 H357 V358 Y359	S352-F355 PolarHBondContact O-N 3.2Å; F355-H357 PolarHBondContact O-N 3.26Å; F355-V358 HydrophobicContact CB-CB 4.45Å; F355-V358 HydrophobicContact CB-CG2 4.32Å; F355-V358 HydrophobicContact CD1-CG2 4.27Å; F355-V358 WeakPolarHBondContact O-CB 3.42Å; F355-V358 PolarHBondContact O-N 2.92Å; F355-Y359 HydrophobicContact CB-CD2 4.3Å; F355-Y359 HydrophobicContact CB-CE2 3.86Å; F355-Y359 WeakPolarHBondContact O-CD2 3.22Å; F355-Y359 PolarHBondContact O-N 3.05Å
356	T	94.1	Very high	93.2	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-59	-32.4	-176.9	-55.1	0	0	0	0	113.2	Q349 P353 I354 Y359 A360 K402 F403	Q349-T356 HydrophobicContact CG-CG2 3.75Å; Q349-T356 PolarHBondContact NE2-OG1 3.43Å; P353-T356 VanDerWaalsContact C-OG1 3.31Å; P353-T356 WeakPolarHBondContact CA-OG1 3.21Å; P353-T356 WeakPolarHBondContact O-CB 3.41Å; P353-T356 PolarHBondContact O-N 2.73Å; P353-T356 PolarHBondContact O-OG1 3.29Å; I354-T356 PolarHBondContact O-N 3.22Å; I354-T356 VanDerWaalsContact O-N 3.14Å; T356-Y359 PolarHBondContact O-N 2.91Å; T356-A360 WeakPolarHBondContact O-CB 3.5Å; T356-A360 PolarHBondContact O-N 3.01Å; T356-K402 HydrophobicContact CG2-CG 4.24Å; T356-F403 HydrophobicContact CG2-CB 3.7Å; T356-F403 HydrophobicContact CG2-CD2 3.61Å; T356-F403 HydrophobicContact CG2-CG 3.97Å
357	H	93.3	Very high	93.2	Very high	47 Å²	47	31.1 Å²	31.1	22%	0.218	18%	0.182	C	C	.	.	H	α-helix	trans	-63.9	-44.5	173.8	54.1	-76.4	0	0	0	111.6	I354 F355 A360 S361 P498 L501	I354-H357 PolarHBondContact O-CE1 3.15Å; I354-H357 PolarHBondContact O-ND1 3.37Å; F355-H357 PolarHBondContact O-N 3.26Å; H357-A360 PolarHBondContact O-N 2.86Å; H357-S361 PolarHBondContact O-N 3.08Å; H357-S361 VanDerWaalsContact O-N 3.11Å; H357-S361 PolarHBondContact O-OG 3.15Å; H357-P498 HydrophobicContact CB-CG 4.34Å; H357-L501 HydrophobicContact CB-CD1 4.35Å
358	V	93.7	Very high	93.1	Very high	0 Å²	0	27 Å²	27	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-62.2	-46.1	173.9	-166.6	0	0	0	0	111	V317 V319 I322 F355 A360 S361 V362 L501	V317-V358 HydrophobicContact CB-CG1 4.22Å; V317-V358 HydrophobicContact CG1-CG1 3.52Å; V319-V358 HydrophobicContact CG2-CG2 3.97Å; I322-V358 HydrophobicContact CD1-CG1 4.3Å; F355-V358 HydrophobicContact CB-CB 4.45Å; F355-V358 HydrophobicContact CB-CG2 4.32Å; F355-V358 HydrophobicContact CD1-CG2 4.27Å; F355-V358 WeakPolarHBondContact O-CB 3.42Å; F355-V358 PolarHBondContact O-N 2.92Å; V358-A360 VanDerWaalsContact C-N 3.35Å; V358-A360 PolarHBondContact O-N 3.5Å; V358-S361 WeakPolarHBondContact O-CB 3.08Å; V358-S361 PolarHBondContact O-N 3.49Å; V358-S361 VanDerWaalsContact O-N 3.17Å; V358-V362 PolarHBondContact O-N 3.13Å; V358-L501 HydrophobicContact CG2-CD1 4.38Å
359	Y	94.7	Very high	93	Very high	9 Å²	9	31 Å²	31	4%	0.035	18%	0.181	C	C	.	.	H	α-helix	trans	-63.9	-35.9	178.1	-63.7	-46.3	0	0	0	113.3	I314 A348 Q349 F355 T356 S361 V363	I314-Y359 HydrophobicContact CG2-CE1 4.23Å; I314-Y359 WeakPolarHBondContact O-CE1 3.48Å; A348-Y359 HydrophobicContact CB-CE1 4.17Å; A348-Y359 HydrophobicContact CB-CE2 4.32Å; Q349-Y359 HydrophobicContact CB-CD2 3.81Å; Q349-Y359 HydrophobicContact CB-CE2 4.32Å; Q349-Y359 HydrophobicContact CG-CD2 4.09Å; F355-Y359 HydrophobicContact CB-CD2 4.3Å; F355-Y359 HydrophobicContact CB-CE2 3.86Å; F355-Y359 WeakPolarHBondContact O-CD2 3.22Å; F355-Y359 PolarHBondContact O-N 3.05Å; T356-Y359 PolarHBondContact O-N 2.91Å; Y359-S361 VanDerWaalsContact C-N 3.32Å; Y359-V363 WeakPolarHBondContact O-CG2 3.3Å; Y359-V363 PolarHBondContact O-N 3.43Å; Y359-V363 VanDerWaalsContact O-N 3.11Å
360	A	94.6	Very high	92.8	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-65.7	-37.3	174.1	0	0	0	0	0	112	T356 H357 V358 V363 A364 F403 H406 L407 Q410	T356-A360 WeakPolarHBondContact O-CB 3.5Å; T356-A360 PolarHBondContact O-N 3.01Å; H357-A360 PolarHBondContact O-N 2.86Å; V358-A360 VanDerWaalsContact C-N 3.35Å; V358-A360 PolarHBondContact O-N 3.5Å; A360-V363 PolarHBondContact O-N 3.36Å; A360-A364 PolarHBondContact O-N 2.87Å; A360-F403 HydrophobicContact CB-CD2 4.44Å; A360-F403 HydrophobicContact CB-CE2 4.16Å; A360-H406 HydrophobicContact CB-CB 3.54Å; A360-L407 HydrophobicContact CB-CD2 4.01Å; A360-L407 HydrophobicContact CB-CG 4.29Å; A360-Q410 HydrophobicContact CB-CG 4.39Å
361	S	92.5	Very high	92.9	Very high	2 Å²	2	31 Å²	31	1%	0.014	18%	0.175	C	C	.	.	H	α-helix	trans	-67.6	-41.5	178.2	-46.1	0	0	0	0	111.6	H357 V358 Y359 V363 A364 I365 Q410	H357-S361 PolarHBondContact O-N 3.08Å; H357-S361 VanDerWaalsContact O-N 3.11Å; H357-S361 PolarHBondContact O-OG 3.15Å; V358-S361 WeakPolarHBondContact O-CB 3.08Å; V358-S361 PolarHBondContact O-N 3.49Å; V358-S361 VanDerWaalsContact O-N 3.17Å; Y359-S361 VanDerWaalsContact C-N 3.32Å; S361-V363 VanDerWaalsContact C-N 3.31Å; S361-V363 PolarHBondContact O-N 3.48Å; S361-A364 WeakPolarHBondContact O-CB 3.49Å; S361-A364 PolarHBondContact O-N 3.29Å; S361-I365 WeakPolarHBondContact O-CD1 3.47Å; S361-I365 WeakPolarHBondContact O-CG1 3.16Å; S361-I365 PolarHBondContact O-N 3.46Å; S361-I365 VanDerWaalsContact O-N 3.11Å; S361-Q410 PolarHBondContact OG-NE2 3.19Å
362	V	93.7	Very high	92.9	Very high	2 Å²	2	33.3 Å²	33.3	1%	0.012	17%	0.172	C	C	.	.	H	α-helix	trans	-58.7	-42.7	170.1	173.1	0	0	0	0	111.4	I314 V317 I322 I326 L329 V358 A364 I366	I314-V362 HydrophobicContact CD1-CG1 4.18Å; V317-V362 HydrophobicContact CG1-CG2 3.64Å; V317-V362 HydrophobicContact CG2-CG2 4.27Å; I322-V362 HydrophobicContact CD1-CG2 3.77Å; I322-V362 HydrophobicContact CG1-CG2 3.85Å; I326-V362 HydrophobicContact CD1-CG2 4.34Å; L329-V362 HydrophobicContact CD2-CG1 4.45Å; V358-V362 PolarHBondContact O-N 3.13Å; V362-A364 VanDerWaalsContact C-N 3.35Å; V362-I366 HydrophobicContact CG1-CD1 3.66Å; V362-I366 HydrophobicContact CG1-CG1 4.49Å; V362-I366 WeakPolarHBondContact O-CB 3.3Å; V362-I366 WeakPolarHBondContact O-CD1 3.29Å; V362-I366 VanDerWaalsContact O-CG1 3.23Å; V362-I366 WeakPolarHBondContact O-CG1 3.47Å; V362-I366 PolarHBondContact O-N 3.23Å; V362-I366 VanDerWaalsContact O-N 3.08Å
363	V	95	Very high	92.9	Very high	1 Å²	1	31.3 Å²	31.3	1%	0.006	16%	0.158	C	C	.	.	H	α-helix	trans	-67.1	-35.9	177.5	173.5	0	0	0	0	111.6	V345 Y359 A360 S361 I366 N367 I377 F403 L407 V412	V345-V363 HydrophobicContact CG1-CG2 3.92Å; Y359-V363 WeakPolarHBondContact O-CG2 3.3Å; Y359-V363 PolarHBondContact O-N 3.43Å; Y359-V363 VanDerWaalsContact O-N 3.11Å; A360-V363 PolarHBondContact O-N 3.36Å; S361-V363 VanDerWaalsContact C-N 3.31Å; S361-V363 PolarHBondContact O-N 3.48Å; V363-I366 PolarHBondContact O-N 3.03Å; V363-N367 WeakPolarHBondContact O-CB 3.25Å; V363-N367 PolarHBondContact O-N 3.28Å; V363-I377 HydrophobicContact CG1-CD1 4.18Å; V363-I377 HydrophobicContact CG1-CG2 4.42Å; V363-I377 HydrophobicContact CG2-CD1 3.79Å; V363-I377 HydrophobicContact CG2-CG2 4.37Å; V363-F403 HydrophobicContact CG2-CZ 4.16Å; V363-L407 HydrophobicContact CB-CD2 3.84Å; V363-L407 HydrophobicContact CG1-CD2 3.66Å; V363-V412 HydrophobicContact CG1-CG1 4.24Å
364	A	94.1	Very high	93.1	Very high	7 Å²	7	29.5 Å²	29.5	6%	0.058	15%	0.146	C	C	.	.	H	α-helix	trans	-62.6	-47.4	176.8	0	0	0	0	0	112.5	A360 S361 V362 I366 N367 S368 Q410 V412 V504	A360-A364 PolarHBondContact O-N 2.87Å; S361-A364 WeakPolarHBondContact O-CB 3.49Å; S361-A364 PolarHBondContact O-N 3.29Å; V362-A364 VanDerWaalsContact C-N 3.35Å; A364-I366 PolarHBondContact O-N 2.92Å; A364-N367 WeakPolarHBondContact O-CA 3.41Å; A364-N367 WeakPolarHBondContact O-CB 3.4Å; A364-N367 PolarHBondContact O-N 2.92Å; A364-S368 PolarHBondContact O-N 2.97Å; A364-Q410 HydrophobicContact CB-CB 4.06Å; A364-V412 HydrophobicContact CB-CG2 3.75Å; A364-V504 HydrophobicContact CB-CG2 4.48Å
365	I	92.6	Very high	93.1	Very high	32 Å²	32	26.2 Å²	26.2	16%	0.164	13%	0.128	C	C	.	.	H	α-helix	trans	-68.9	-34.9	179.6	-58.6	156.3	0	0	0	111.4	I322 I326 S361 N367 S368 L503 V504	I322-I365 HydrophobicContact CD1-CD1 4.35Å; I326-I365 HydrophobicContact CD1-CB 3.91Å; I326-I365 HydrophobicContact CD1-CD1 3.33Å; I326-I365 HydrophobicContact CD1-CG1 4.22Å; I326-I365 HydrophobicContact CD1-CG2 3.97Å; I326-I365 HydrophobicContact CG2-CG2 3.94Å; S361-I365 WeakPolarHBondContact O-CD1 3.47Å; S361-I365 WeakPolarHBondContact O-CG1 3.16Å; S361-I365 PolarHBondContact O-N 3.46Å; S361-I365 VanDerWaalsContact O-N 3.11Å; I365-N367 VanDerWaalsContact C-N 3.27Å; I365-N367 PolarHBondContact O-N 3.29Å; I365-S368 PolarHBondContact O-OG 3.02Å; I365-L503 HydrophobicContact CD1-CB 3.82Å; I365-L503 HydrophobicContact CD1-CD1 3.88Å; I365-L503 HydrophobicContact CG1-CB 4.21Å; I365-V504 HydrophobicContact CB-CG2 4.13Å; I365-V504 HydrophobicContact CG1-CG2 3.45Å; I365-V504 VanDerWaalsContact CG1-CG2 3.45Å
366	I	92.9	Very high	93.2	Very high	2 Å²	2	22.6 Å²	22.6	1%	0.01	11%	0.112	C	C	.	.	H	α-helix	trans	-68.2	-30.2	170	-67.3	167.7	0	0	0	111.1	L329 I334 L341 V362 V363 A364 F370 I373	L329-I366 HydrophobicContact CD2-CD1 3.8Å; I334-I366 HydrophobicContact CD1-CG2 4.28Å; L341-I366 HydrophobicContact CD1-CD1 4.11Å; L341-I366 HydrophobicContact CD2-CD1 4.08Å; V362-I366 HydrophobicContact CG1-CD1 3.66Å; V362-I366 HydrophobicContact CG1-CG1 4.49Å; V362-I366 WeakPolarHBondContact O-CB 3.3Å; V362-I366 WeakPolarHBondContact O-CD1 3.29Å; V362-I366 VanDerWaalsContact O-CG1 3.23Å; V362-I366 WeakPolarHBondContact O-CG1 3.47Å; V362-I366 PolarHBondContact O-N 3.23Å; V362-I366 VanDerWaalsContact O-N 3.08Å; V363-I366 PolarHBondContact O-N 3.03Å; A364-I366 PolarHBondContact O-N 2.92Å; I366-F370 CarbonylContact O-C 3.17Å; I366-F370 VanDerWaalsContact O-CA 3.31Å; I366-F370 WeakPolarHBondContact O-CA 3.29Å; I366-F370 WeakPolarHBondContact O-CB 3.48Å; I366-F370 PolarHBondContact O-N 3.13Å; I366-I373 HydrophobicContact CG2-CB 3.95Å; I366-I373 HydrophobicContact CG2-CD1 4.32Å; I366-I373 HydrophobicContact CG2-CG2 3.77Å
367	N	94.6	Very high	93.3	Very high	4 Å²	4	22.6 Å²	22.6	2%	0.021	11%	0.112	C	C	.	.	H	α-helix	trans	-80.1	-31.1	-174.3	178.2	71.2	0	0	0	113.8	V363 A364 I365 F370 P371 V412 F510 H512	V363-N367 WeakPolarHBondContact O-CB 3.25Å; V363-N367 PolarHBondContact O-N 3.28Å; A364-N367 WeakPolarHBondContact O-CA 3.41Å; A364-N367 WeakPolarHBondContact O-CB 3.4Å; A364-N367 PolarHBondContact O-N 2.92Å; I365-N367 VanDerWaalsContact C-N 3.27Å; I365-N367 PolarHBondContact O-N 3.29Å; N367-F370 CarbonylContact O-C 3.49Å; N367-P371 VanDerWaalsContact O-CA 3.3Å; N367-P371 WeakPolarHBondContact O-CA 3.47Å; N367-P371 VanDerWaalsContact O-CD 3.3Å; N367-P371 WeakPolarHBondContact O-CD 3.23Å; N367-P371 VanDerWaalsContact O-CG 3.3Å; N367-P371 WeakPolarHBondContact O-CG 3.44Å; N367-V412 HydrophobicContact CB-CG1 4.35Å; N367-V412 HydrophobicContact CB-CG2 4.46Å; N367-F510 PolarHBondContact ND2-O 3.32Å; N367-H512 PolarHBondContact OD1-CD2 3.17Å; N367-H512 PolarHBondContact OD1-NE2 3.1Å
368	S	91.7	Very high	93.3	Very high	23 Å²	23	20.4 Å²	20.4	16%	0.161	10%	0.102	C	C	.	.	H	α-helix	trans	-63.4	-50.6	171.8	54.6	0	0	0	0	111	A364 I365 D508	A364-S368 PolarHBondContact O-N 2.97Å; I365-S368 PolarHBondContact O-OG 3.02Å; S368-D508 WeakPolarHBondContact CA-O 3.47Å; S368-D508 WeakPolarHBondContact CB-O 3.46Å
369	K	89.9	Confident	93.4	Very high	87 Å²	87	22.3 Å²	22.3	38%	0.378	11%	0.11	S	C	.	.	H	α-helix	trans	-79.1	-27.7	179.8	-53.5	-51.4	-174.5	-164.8	0	114.1	D508 I549	K369-D508 IonicContact NZ-OD2 2.68Å; K369-D508 PolarHBondContact NZ-OD2 3.14Å; K369-I549 HydrophobicContact CB-CD1 4.08Å; K369-I549 HydrophobicContact CG-CG2 4.23Å
370	F	91.9	Very high	93.3	Very high	24 Å²	24	22.7 Å²	22.7	11%	0.105	11%	0.112	C	C	.	.			trans	-137.6	74.4	178.4	-60.3	-85.4	0	0	0	113.7	L330 I334 V335 I366 N367 Q372 I373 Y542 I545 I549	L330-F370 HydrophobicContact CD2-CD2 4.48Å; L330-F370 HydrophobicContact CD2-CE2 3.84Å; I334-F370 HydrophobicContact CD1-CD2 3.8Å; I334-F370 HydrophobicContact CD1-CE2 3.86Å; I334-F370 HydrophobicContact CG1-CD2 4.44Å; I334-F370 HydrophobicContact CG1-CE2 4.27Å; V335-F370 HydrophobicContact CG2-CD1 3.8Å; V335-F370 HydrophobicContact CG2-CE1 3.52Å; V335-F370 HydrophobicContact CG2-CZ 4.36Å; I366-F370 CarbonylContact O-C 3.17Å; I366-F370 VanDerWaalsContact O-CA 3.31Å; I366-F370 WeakPolarHBondContact O-CA 3.29Å; I366-F370 WeakPolarHBondContact O-CB 3.48Å; I366-F370 PolarHBondContact O-N 3.13Å; N367-F370 CarbonylContact O-C 3.49Å; F370-Q372 PolarHBondContact O-N 2.87Å; F370-I373 HydrophobicContact CB-CB 4.35Å; F370-I373 HydrophobicContact CB-CD1 3.73Å; F370-I373 HydrophobicContact CB-CG1 3.92Å; F370-I373 HydrophobicContact CG-CD1 4.08Å; F370-I373 PolarHBondContact O-N 3.19Å; F370-Y542 HydrophobicContact CE1-CE2 4.49Å; F370-Y542 HydrophobicContact CZ-CE2 4.08Å; F370-I545 HydrophobicContact CE1-CG2 3.88Å; F370-I545 HydrophobicContact CZ-CG2 3.73Å; F370-I549 HydrophobicContact CE1-CD1 4.45Å; F370-I549 HydrophobicContact CE2-CD1 3.59Å; F370-I549 HydrophobicContact CZ-CD1 3.52Å
371	P	93.4	Very high	93.3	Very high	39 Å²	39	22.8 Å²	22.8	25%	0.253	11%	0.112	S	C	.	.	H	α-helix	trans	-53.6	-33.4	-176.6	-28.9	33.7	0	0	0	115.3	N367 I373 G374 E375 F510 H512	N367-P371 VanDerWaalsContact O-CA 3.3Å; N367-P371 WeakPolarHBondContact O-CA 3.47Å; N367-P371 VanDerWaalsContact O-CD 3.3Å; N367-P371 WeakPolarHBondContact O-CD 3.23Å; N367-P371 VanDerWaalsContact O-CG 3.3Å; N367-P371 WeakPolarHBondContact O-CG 3.44Å; P371-I373 PolarHBondContact O-N 2.93Å; P371-G374 PolarHBondContact O-N 2.91Å; P371-E375 WeakPolarHBondContact O-CB 3.47Å; P371-E375 PolarHBondContact O-N 3.24Å; P371-F510 HydrophobicContact CB-CB 4.33Å; P371-F510 HydrophobicContact CB-CD1 3.86Å; P371-F510 HydrophobicContact CB-CD2 4.35Å; P371-F510 HydrophobicContact CB-CE1 4.27Å; P371-F510 HydrophobicContact CB-CG 3.9Å; P371-F510 HydrophobicContact CG-CB 4.11Å; P371-F510 HydrophobicContact CG-CD1 4.43Å; P371-F510 HydrophobicContact CG-CD2 4.14Å; P371-F510 HydrophobicContact CG-CG 3.95Å; P371-H512 PolarHBondContact O-CE1 3.47Å; P371-H512 VanDerWaalsContact O-CE1 3.22Å; P371-H512 PolarHBondContact O-NE2 3.1Å
372	Q	91.1	Very high	93.4	Very high	127 Å²	127	22.7 Å²	22.7	59%	0.593	11%	0.111	S	C	*	.	H	α-helix	trans	-61.8	-27.7	177.5	-62	-176.9	18.4	0	0	113.5	F370 L376	F370-Q372 PolarHBondContact O-N 2.87Å; Q372-L376 WeakPolarHBondContact O-CB 3.32Å; Q372-L376 PolarHBondContact O-N 3.14Å; Q372-L376 VanDerWaalsContact O-N 3.13Å
373	I	93.1	Very high	93.3	Very high	4 Å²	4	24 Å²	24	2%	0.021	12%	0.118	C	C	.	.	H	α-helix	trans	-78.5	-42.7	179.1	-56.8	-177.9	0	0	0	109.6	I334 R338 L341 I366 F370 P371 L376 I377	I334-I373 HydrophobicContact CB-CD1 4.33Å; I334-I373 HydrophobicContact CD1-CD1 3.98Å; I334-I373 HydrophobicContact CG1-CD1 3.94Å; R338-I373 HydrophobicContact CB-CD1 4.35Å; R338-I373 HydrophobicContact CB-CG1 4.07Å; L341-I373 HydrophobicContact CD2-CG2 4.1Å; I366-I373 HydrophobicContact CG2-CB 3.95Å; I366-I373 HydrophobicContact CG2-CD1 4.32Å; I366-I373 HydrophobicContact CG2-CG2 3.77Å; F370-I373 HydrophobicContact CB-CB 4.35Å; F370-I373 HydrophobicContact CB-CD1 3.73Å; F370-I373 HydrophobicContact CB-CG1 3.92Å; F370-I373 HydrophobicContact CG-CD1 4.08Å; F370-I373 PolarHBondContact O-N 3.19Å; P371-I373 PolarHBondContact O-N 2.93Å; I373-L376 PolarHBondContact O-N 2.97Å; I373-I377 HydrophobicContact CG2-CD1 4.18Å; I373-I377 VanDerWaalsContact O-CG1 3.29Å; I373-I377 WeakPolarHBondContact O-CG1 3.15Å; I373-I377 PolarHBondContact O-N 2.87Å
374	G	93.4	Very high	93.2	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-59.3	-45.6	171.3	0	0	0	0	0	112.1	P371 L376 I377 L378	P371-G374 PolarHBondContact O-N 2.91Å; G374-L376 PolarHBondContact O-N 3.43Å; G374-I377 PolarHBondContact O-N 2.84Å; G374-L378 WeakPolarHBondContact O-CB 3.26Å; G374-L378 PolarHBondContact O-N 3.24Å
375	E	93.5	Very high	93.2	Very high	60 Å²	60	25.9 Å²	25.9	28%	0.28	13%	0.131	S	C	.	.	H	α-helix	trans	-57.8	-46.9	176.1	-158.6	-158.3	-167.6	0	0	112	P371 I377 L378 K379 L514	P371-E375 WeakPolarHBondContact O-CB 3.47Å; P371-E375 PolarHBondContact O-N 3.24Å; E375-I377 VanDerWaalsContact C-N 3.35Å; E375-I377 PolarHBondContact O-N 2.82Å; E375-L378 PolarHBondContact O-N 3.21Å; E375-K379 HydrophobicContact CG-CD 4.29Å; E375-K379 WeakPolarHBondContact O-CB 3.44Å; E375-K379 VanDerWaalsContact O-CG 3.29Å; E375-K379 WeakPolarHBondContact O-CG 3.31Å; E375-K379 PolarHBondContact O-N 3.39Å; E375-K379 WeakPolarHBondContact OE1-CE 3.45Å; E375-K379 IonicContact OE1-NZ 3.55Å; E375-K379 PolarHBondContact OE1-NZ 3.36Å; E375-K379 IonicContact OE2-NZ 2.74Å; E375-K379 PolarHBondContact OE2-NZ 3.49Å; E375-L514 HydrophobicContact CG-CD1 4.24Å
376	L	93.8	Very high	93.2	Very high	5 Å²	5	26.5 Å²	26.5	3%	0.026	13%	0.131	C	C	.	.	H	α-helix	trans	-64.2	-37.9	178.8	178.9	61.5	0	0	0	112.3	R338 A342 Q372 I373 G374 R380 E523	R338-L376 HydrophobicContact CB-CD2 4.34Å; R338-L376 HydrophobicContact CG-CD2 3.88Å; A342-L376 HydrophobicContact CB-CD2 4.44Å; A342-L376 HydrophobicContact CB-CG 4.38Å; Q372-L376 WeakPolarHBondContact O-CB 3.32Å; Q372-L376 PolarHBondContact O-N 3.14Å; Q372-L376 VanDerWaalsContact O-N 3.13Å; I373-L376 PolarHBondContact O-N 2.97Å; G374-L376 PolarHBondContact O-N 3.43Å; L376-R380 HydrophobicContact CD1-CG 4.39Å; L376-R380 WeakPolarHBondContact O-CB 3.44Å; L376-R380 VanDerWaalsContact O-CG 3.25Å; L376-R380 WeakPolarHBondContact O-CG 3.42Å; L376-R380 PolarHBondContact O-N 2.88Å; L376-R380 VanDerWaalsContact O-N 3.13Å; L376-E523 HydrophobicContact CD1-CB 3.97Å; L376-E523 HydrophobicContact CD1-CG 4.1Å
377	I	95.1	Very high	93.1	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-63.8	-48.1	174.5	-70.3	169.6	0	0	0	110.1	L341 A342 V363 I373 G374 E375 R380 L381 F403	L341-I377 HydrophobicContact CD2-CD1 4Å; A342-I377 HydrophobicContact CB-CD1 4.39Å; A342-I377 HydrophobicContact CB-CG1 3.48Å; A342-I377 VanDerWaalsContact CB-CG1 3.48Å; V363-I377 HydrophobicContact CG1-CD1 4.18Å; V363-I377 HydrophobicContact CG1-CG2 4.42Å; V363-I377 HydrophobicContact CG2-CD1 3.79Å; V363-I377 HydrophobicContact CG2-CG2 4.37Å; I373-I377 HydrophobicContact CG2-CD1 4.18Å; I373-I377 VanDerWaalsContact O-CG1 3.29Å; I373-I377 WeakPolarHBondContact O-CG1 3.15Å; I373-I377 PolarHBondContact O-N 2.87Å; G374-I377 PolarHBondContact O-N 2.84Å; E375-I377 VanDerWaalsContact C-N 3.35Å; E375-I377 PolarHBondContact O-N 2.82Å; I377-R380 PolarHBondContact O-N 3.49Å; I377-L381 WeakPolarHBondContact O-CB 3.49Å; I377-L381 PolarHBondContact O-N 2.78Å; I377-F403 HydrophobicContact CG2-CE1 4.27Å; I377-F403 HydrophobicContact CG2-CZ 4.42Å
378	L	94.7	Very high	93	Very high	1 Å²	1	32.5 Å²	32.5	1%	0.005	15%	0.154	C	C	.	.	H	α-helix	trans	-65.4	-44.8	-178.4	-170.9	59.7	0	0	0	111.8	G374 E375 R380 L381 I382 L407 A413 L417 H512 L514	G374-L378 WeakPolarHBondContact O-CB 3.26Å; G374-L378 PolarHBondContact O-N 3.24Å; E375-L378 PolarHBondContact O-N 3.21Å; L378-R380 PolarHBondContact O-N 2.99Å; L378-L381 WeakPolarHBondContact O-CB 3.23Å; L378-L381 PolarHBondContact O-N 2.8Å; L378-L381 VanDerWaalsContact O-N 3.14Å; L378-I382 HydrophobicContact CD1-CD1 4.46Å; L378-I382 HydrophobicContact CG-CD1 4.07Å; L378-I382 VanDerWaalsContact O-CG1 3.3Å; L378-I382 WeakPolarHBondContact O-CG1 3.04Å; L378-I382 PolarHBondContact O-N 3.1Å; L378-L407 HydrophobicContact CD1-CD1 4.37Å; L378-A413 HydrophobicContact CD1-CB 3.83Å; L378-A413 HydrophobicContact CD2-CB 3.59Å; L378-A413 HydrophobicContact CG-CB 4.38Å; L378-L417 HydrophobicContact CD1-CD2 4.01Å; L378-H512 HydrophobicContact CD2-CB 3.77Å; L378-L514 HydrophobicContact CB-CD1 4.1Å; L378-L514 HydrophobicContact CD2-CB 4.31Å; L378-L514 HydrophobicContact CD2-CD1 3.87Å; L378-L514 HydrophobicContact CD2-CG 4.21Å; L378-L514 HydrophobicContact CG-CD1 3.95Å
379	K	94.3	Very high	92.9	Very high	39 Å²	39	34.6 Å²	34.6	17%	0.17	16%	0.159	C	C	.	.	H	α-helix	trans	-53.8	-48.7	172.2	-75.2	174.5	178.2	165.4	0	112	E375 L381 L383 L514 Y520	E375-K379 HydrophobicContact CG-CD 4.29Å; E375-K379 WeakPolarHBondContact O-CB 3.44Å; E375-K379 VanDerWaalsContact O-CG 3.29Å; E375-K379 WeakPolarHBondContact O-CG 3.31Å; E375-K379 PolarHBondContact O-N 3.39Å; E375-K379 WeakPolarHBondContact OE1-CE 3.45Å; E375-K379 IonicContact OE1-NZ 3.55Å; E375-K379 PolarHBondContact OE1-NZ 3.36Å; E375-K379 IonicContact OE2-NZ 2.74Å; E375-K379 PolarHBondContact OE2-NZ 3.49Å; K379-L381 PolarHBondContact O-N 2.8Å; K379-L383 VanDerWaalsContact O-CG 3.28Å; K379-L383 WeakPolarHBondContact O-CG 3.5Å; K379-L383 PolarHBondContact O-N 2.8Å; K379-L383 VanDerWaalsContact O-N 3.08Å; K379-L514 HydrophobicContact CG-CD1 3.65Å; K379-Y520 HydrophobicContact CB-CG 4.3Å; K379-Y520 HydrophobicContact CD-CD1 4.14Å; K379-Y520 HydrophobicContact CG-CD1 3.7Å; K379-Y520 HydrophobicContact CG-CE1 4.3Å; K379-Y520 HydrophobicContact CG-CG 3.99Å
380	R	94.2	Very high	93	Very high	17 Å²	17	38.9 Å²	38.9	6%	0.064	17%	0.172	C	C	.	.	H	α-helix	trans	-65.3	-37	177.9	-74.1	172.8	171.1	-158.2	-2.6	112.4	G339 L346 L376 I377 L378 S384 P522 E523 N527	G339-R380 PolarHBondContact O-NH1 3.49Å; L346-R380 HydrophobicContact CD1-CB 3.55Å; L376-R380 HydrophobicContact CD1-CG 4.39Å; L376-R380 WeakPolarHBondContact O-CB 3.44Å; L376-R380 VanDerWaalsContact O-CG 3.25Å; L376-R380 WeakPolarHBondContact O-CG 3.42Å; L376-R380 PolarHBondContact O-N 2.88Å; L376-R380 VanDerWaalsContact O-N 3.13Å; I377-R380 PolarHBondContact O-N 3.49Å; L378-R380 PolarHBondContact O-N 2.99Å; R380-S384 WeakPolarHBondContact O-CB 3.36Å; R380-S384 PolarHBondContact O-N 2.92Å; R380-P522 HydrophobicContact CG-CB 4.4Å; R380-P522 PolarHBondContact NE-O 3.31Å; R380-P522 PolarHBondContact NH2-O 2.88Å; R380-P522 VanDerWaalsContact NH2-O 3.08Å; R380-E523 PolarHBondContact NH2-O 2.88Å; R380-E523 VanDerWaalsContact NH2-O 3.1Å; R380-N527 PolarHBondContact NH1-OD1 3.21Å; R380-N527 PolarHBondContact NH2-OD1 2.93Å
381	L	94.5	Very high	93	Very high	2 Å²	2	45.6 Å²	45.6	1%	0.01	20%	0.197	C	C	.	.	H	α-helix	trans	-66.7	-46.9	177.2	-177.5	56.7	0	0	0	112.1	L346 I377 L378 K379 L383 S384 F385 A400 F403 V404 L407	L346-L381 HydrophobicContact CD2-CB 4.11Å; L346-L381 HydrophobicContact CD2-CD1 3.91Å; I377-L381 WeakPolarHBondContact O-CB 3.49Å; I377-L381 PolarHBondContact O-N 2.78Å; L378-L381 WeakPolarHBondContact O-CB 3.23Å; L378-L381 PolarHBondContact O-N 2.8Å; L378-L381 VanDerWaalsContact O-N 3.14Å; K379-L381 PolarHBondContact O-N 2.8Å; L381-L383 VanDerWaalsContact C-N 3.35Å; L381-L383 PolarHBondContact O-N 3.2Å; L381-S384 WeakPolarHBondContact O-CA 3.4Å; L381-S384 VanDerWaalsContact O-CB 3.31Å; L381-S384 WeakPolarHBondContact O-CB 3.39Å; L381-S384 PolarHBondContact O-N 2.79Å; L381-S384 VanDerWaalsContact O-N 3.09Å; L381-F385 PolarHBondContact O-N 3.33Å; L381-A400 HydrophobicContact CD1-CB 3.98Å; L381-F403 HydrophobicContact CD1-CB 4.24Å; L381-F403 HydrophobicContact CD1-CD1 3.88Å; L381-F403 HydrophobicContact CD2-CB 4.01Å; L381-F403 HydrophobicContact CD2-CD1 3.6Å; L381-F403 HydrophobicContact CD2-CE1 4.26Å; L381-F403 HydrophobicContact CD2-CG 3.89Å; L381-F403 HydrophobicContact CG-CD1 4.34Å; L381-V404 HydrophobicContact CD2-CB 4.46Å; L381-V404 HydrophobicContact CD2-CG2 3.53Å; L381-V404 HydrophobicContact CG-CG2 3.74Å; L381-L407 HydrophobicContact CD2-CD1 3.61Å
382	I	93.9	Very high	92.7	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-58.8	-46.8	175.5	-65.5	165.4	0	0	0	110.3	L378 S384 F385 R386 L417 L514 L516 Y520	L378-I382 HydrophobicContact CD1-CD1 4.46Å; L378-I382 HydrophobicContact CG-CD1 4.07Å; L378-I382 VanDerWaalsContact O-CG1 3.3Å; L378-I382 WeakPolarHBondContact O-CG1 3.04Å; L378-I382 PolarHBondContact O-N 3.1Å; I382-S384 VanDerWaalsContact C-N 3.29Å; I382-S384 PolarHBondContact O-N 2.62Å; I382-F385 PolarHBondContact O-N 2.87Å; I382-R386 HydrophobicContact CG2-CG 4.34Å; I382-R386 WeakPolarHBondContact O-CG 3.49Å; I382-R386 PolarHBondContact O-N 3.41Å; I382-L417 HydrophobicContact CD1-CD1 4.01Å; I382-L417 HydrophobicContact CD1-CD2 3.82Å; I382-L417 HydrophobicContact CG1-CD1 4.02Å; I382-L417 HydrophobicContact CG1-CD2 3.9Å; I382-L514 HydrophobicContact CD1-CB 3.82Å; I382-L514 HydrophobicContact CD1-CD1 4.27Å; I382-L516 HydrophobicContact CG2-CD1 4.04Å; I382-Y520 HydrophobicContact CB-CD2 4.43Å; I382-Y520 HydrophobicContact CB-CE2 4.44Å; I382-Y520 HydrophobicContact CD1-CE2 3.98Å; I382-Y520 HydrophobicContact CG2-CD2 4.09Å; I382-Y520 HydrophobicContact CG2-CE2 3.93Å
383	L	92.3	Very high	92.8	Very high	29 Å²	29	47.7 Å²	47.7	15%	0.152	21%	0.21	C	C	.	.	H	α-helix	trans	-61.9	-35.4	175.4	-70.2	171.1	0	0	0	112.7	K379 L381 R387 Y520 P522	K379-L383 VanDerWaalsContact O-CG 3.28Å; K379-L383 WeakPolarHBondContact O-CG 3.5Å; K379-L383 PolarHBondContact O-N 2.8Å; K379-L383 VanDerWaalsContact O-N 3.08Å; L381-L383 VanDerWaalsContact C-N 3.35Å; L381-L383 PolarHBondContact O-N 3.2Å; L383-R387 WeakPolarHBondContact O-CB 3.25Å; L383-R387 PolarHBondContact O-N 3.04Å; L383-Y520 WeakPolarHBondContact CD1-O 3.25Å; L383-P522 HydrophobicContact CD1-CB 3.77Å; L383-P522 HydrophobicContact CD1-CG 4.26Å
384	S	91.9	Very high	92.6	Very high	47 Å²	47	49.9 Å²	49.9	33%	0.329	22%	0.219	S	C	.	.	H	α-helix	trans	-65.7	-46.2	174.7	-166	0	0	0	0	111.7	R380 L381 I382 R387 S388	R380-S384 WeakPolarHBondContact O-CB 3.36Å; R380-S384 PolarHBondContact O-N 2.92Å; L381-S384 WeakPolarHBondContact O-CA 3.4Å; L381-S384 VanDerWaalsContact O-CB 3.31Å; L381-S384 WeakPolarHBondContact O-CB 3.39Å; L381-S384 PolarHBondContact O-N 2.79Å; L381-S384 VanDerWaalsContact O-N 3.09Å; I382-S384 VanDerWaalsContact C-N 3.29Å; I382-S384 PolarHBondContact O-N 2.62Å; S384-R387 PolarHBondContact O-N 2.76Å; S384-S388 WeakPolarHBondContact O-CB 3.38Å; S384-S388 PolarHBondContact O-N 3.1Å; S384-S388 PolarHBondContact O-OG 2.88Å
385	F	94.1	Very high	92.6	Very high	1 Å²	1	56.1 Å²	56.1	0%	0.004	25%	0.248	C	C	.	.	H	α-helix	trans	-60.2	-53.2	174.1	174	-99.5	0	0	0	111.5	L381 I382 R387 S388 Y389 C397 A400 M421 L424 L425 L516	L381-F385 PolarHBondContact O-N 3.33Å; I382-F385 PolarHBondContact O-N 2.87Å; F385-R387 PolarHBondContact O-N 2.83Å; F385-R387 VanDerWaalsContact O-N 3.17Å; F385-S388 PolarHBondContact O-N 3.19Å; F385-Y389 WeakPolarHBondContact O-CB 3.5Å; F385-Y389 PolarHBondContact O-N 3.11Å; F385-C397 WeakPolarHBondContact CE2-SG 3.39Å; F385-A400 HydrophobicContact CB-CB 4.14Å; F385-M421 HydrophobicContact CD1-CE 4.06Å; F385-M421 HydrophobicContact CD1-CG 4.2Å; F385-M421 HydrophobicContact CD1-SD 4.31Å; F385-M421 HydrophobicContact CD2-CE 3.78Å; F385-M421 HydrophobicContact CE1-CB 4.4Å; F385-M421 HydrophobicContact CE1-CE 4.03Å; F385-M421 HydrophobicContact CE1-CG 3.76Å; F385-M421 HydrophobicContact CE1-SD 4.37Å; F385-M421 HydrophobicContact CE2-CE 3.73Å; F385-M421 HydrophobicContact CG-CE 3.95Å; F385-M421 HydrophobicContact CZ-CB 4.4Å; F385-M421 HydrophobicContact CZ-CE 3.86Å; F385-M421 HydrophobicContact CZ-CG 4.19Å; F385-L424 HydrophobicContact CE1-CD2 4.28Å; F385-L424 HydrophobicContact CZ-CD2 4.38Å; F385-L425 HydrophobicContact CZ-CD1 4.27Å; F385-L425 HydrophobicContact CZ-CD2 4.26Å; F385-L425 HydrophobicContact CZ-CG 4.24Å; F385-L516 HydrophobicContact CD1-CD1 4.01Å; F385-L516 HydrophobicContact CE1-CD1 4.17Å
386	R	92.8	Very high	92.4	Very high	45 Å²	45	58.2 Å²	58.2	17%	0.17	26%	0.258	C	S	.	.	H	α-helix	trans	-60.2	-27.6	177.8	-67.5	177.8	90.2	-170.7	2.5	113.2	I382 R390 L516 D517 D518	I382-R386 HydrophobicContact CG2-CG 4.34Å; I382-R386 WeakPolarHBondContact O-CG 3.49Å; I382-R386 PolarHBondContact O-N 3.41Å; R386-R390 WeakPolarHBondContact O-CB 3.46Å; R386-R390 WeakPolarHBondContact O-CG 3.3Å; R386-R390 PolarHBondContact O-N 2.78Å; R386-R390 PolarHBondContact O-NE 3.08Å; R386-L516 WeakPolarHBondContact CD-O 3.15Å; R386-L516 HydrophobicContact CG-CD1 3.9Å; R386-L516 PolarHBondContact NE-O 2.83Å; R386-L516 VanDerWaalsContact NE-O 3.1Å; R386-L516 PolarHBondContact NH1-O 2.81Å; R386-D517 IonicContact CZ-OD1 2.89Å; R386-D517 IonicContact NE-OD1 3.66Å; R386-D517 VanDerWaalsContact NH1-C 3.28Å; R386-D517 PolarHBondContact NH1-O 3.32Å; R386-D517 VanDerWaalsContact NH2-CA 3.31Å; R386-D517 PolarHBondContact NH2-O 3.47Å; R386-D517 IonicContact NH2-OD1 3.52Å; R386-D517 PolarHBondContact NH2-OD1 2.91Å; R386-D518 PolarHBondContact NH1-O 2.96Å
387	R	91.8	Very high	92.4	Very high	130 Å²	130	58.3 Å²	58.3	49%	0.491	26%	0.259	S	S	.	.	H	α-helix	trans	-79.3	-36.3	174.6	-176	-176.4	-65.6	167.8	-0.3	111.9	L383 S384 F385 R391	L383-R387 WeakPolarHBondContact O-CB 3.25Å; L383-R387 PolarHBondContact O-N 3.04Å; S384-R387 PolarHBondContact O-N 2.76Å; F385-R387 PolarHBondContact O-N 2.83Å; F385-R387 VanDerWaalsContact O-N 3.17Å; R387-R391 WeakPolarHBondContact O-CB 3.07Å; R387-R391 WeakPolarHBondContact O-CD 3.23Å; R387-R391 VanDerWaalsContact O-CG 3.24Å; R387-R391 WeakPolarHBondContact O-CG 3.46Å; R387-R391 PolarHBondContact O-N 3.3Å
388	S	90.9	Very high	92.3	Very high	2 Å²	2	59.6 Å²	59.6	1%	0.014	27%	0.266	C	S	.	.	H	α-helix	trans	-73.1	-44.9	179.3	-57.5	0	0	0	0	111.6	S384 F385 R391 N392 L393 Q396	S384-S388 WeakPolarHBondContact O-CB 3.38Å; S384-S388 PolarHBondContact O-N 3.1Å; S384-S388 PolarHBondContact O-OG 2.88Å; F385-S388 PolarHBondContact O-N 3.19Å; S388-R391 CarbonylContact O-C 3.33Å; S388-R391 PolarHBondContact O-N 3.5Å; S388-R391 VanDerWaalsContact O-N 3.16Å; S388-N392 PolarHBondContact O-N 3.39Å; S388-L393 PolarHBondContact O-N 3.22Å; S388-Q396 WeakPolarHBondContact OG-CB 3.36Å
389	Y	91	Very high	92.3	Very high	67 Å²	67	60.1 Å²	60.1	26%	0.263	27%	0.269	S	S	.	.	H	α-helix	trans	-59.3	-52.3	173.9	-178.4	-93.8	0	0	0	111.4	F385 R391 N392 L424 L425	F385-Y389 WeakPolarHBondContact O-CB 3.5Å; F385-Y389 PolarHBondContact O-N 3.11Å; Y389-R391 PolarHBondContact O-N 3.14Å; Y389-N392 PolarHBondContact O-N 2.88Å; Y389-N392 PolarHBondContact O-OD1 3.32Å; Y389-L424 HydrophobicContact CD1-CD2 4.03Å; Y389-L424 HydrophobicContact CD2-CD2 3.89Å; Y389-L424 HydrophobicContact CE1-CD2 3.76Å; Y389-L424 HydrophobicContact CE1-CG 4.31Å; Y389-L424 HydrophobicContact CE2-CD2 3.61Å; Y389-L424 HydrophobicContact CG-CD2 4.09Å; Y389-L424 PolarHBondContact OH-O 3.03Å; Y389-L425 HydrophobicContact CD2-CD2 3.98Å; Y389-L425 HydrophobicContact CE2-CD2 3.96Å
390	R	90.7	Very high	92.3	Very high	178 Å²	178	58.4 Å²	58.4	67%	0.672	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-10.1	176.2	-75.9	-175.4	-73.7	-176.9	-9.1	115	R386	R386-R390 WeakPolarHBondContact O-CB 3.46Å; R386-R390 WeakPolarHBondContact O-CG 3.3Å; R386-R390 PolarHBondContact O-N 2.78Å; R386-R390 PolarHBondContact O-NE 3.08Å
391	R	92.2	Very high	92.3	Very high	165 Å²	165	57.6 Å²	57.6	62%	0.623	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.3	4.5	176.1	-68.8	176.8	175.1	-171.5	-3.8	113.1	R387 S388 Y389 L393	R387-R391 WeakPolarHBondContact O-CB 3.07Å; R387-R391 WeakPolarHBondContact O-CD 3.23Å; R387-R391 VanDerWaalsContact O-CG 3.24Å; R387-R391 WeakPolarHBondContact O-CG 3.46Å; R387-R391 PolarHBondContact O-N 3.3Å; S388-R391 CarbonylContact O-C 3.33Å; S388-R391 PolarHBondContact O-N 3.5Å; S388-R391 VanDerWaalsContact O-N 3.16Å; Y389-R391 PolarHBondContact O-N 3.14Å; R391-L393 HydrophobicContact CB-CD1 3.93Å; R391-L393 HydrophobicContact CB-CG 3.83Å; R391-L393 PolarHBondContact O-N 3.11Å
392	N	87.8	Confident	92.3	Very high	140 Å²	140	59.1 Å²	59.1	75%	0.749	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	52	33.4	-174.1	-58.6	-32.4	0	0	0	113.9	S388 Y389 K394	S388-N392 PolarHBondContact O-N 3.39Å; Y389-N392 PolarHBondContact O-N 2.88Å; Y389-N392 PolarHBondContact O-OD1 3.32Å; N392-K394 PolarHBondContact O-N 3.08Å
393	L	92.3	Very high	92.4	Very high	69 Å²	69	59.1 Å²	59.1	36%	0.361	27%	0.266	S	S	.	.			trans	-85.4	74.9	-179.3	-66.7	176.4	0	0	0	111	S388 R391 Q395 Q396 C397	S388-L393 PolarHBondContact O-N 3.22Å; R391-L393 HydrophobicContact CB-CD1 3.93Å; R391-L393 HydrophobicContact CB-CG 3.83Å; R391-L393 PolarHBondContact O-N 3.11Å; L393-Q395 VanDerWaalsContact C-N 3.32Å; L393-Q395 PolarHBondContact O-N 2.94Å; L393-Q395 VanDerWaalsContact O-N 3.15Å; L393-Q396 HydrophobicContact CB-CB 4.3Å; L393-Q396 VanDerWaalsContact CD1-OE1 3.32Å; L393-Q396 PolarHBondContact O-N 3.42Å; L393-C397 PolarHBondContact O-N 3.5Å
394	K	90.3	Very high	92.5	Very high	50 Å²	50	57.8 Å²	57.8	22%	0.217	26%	0.259	C	S	.	.	H	α-helix	trans	-40.3	-53	-176.3	-173	-176.8	-166.8	162.8	0	114	N392 Q396 C397 L398 D432 E435	N392-K394 PolarHBondContact O-N 3.08Å; K394-Q396 PolarHBondContact O-N 3.26Å; K394-C397 WeakPolarHBondContact O-CA 3.48Å; K394-C397 WeakPolarHBondContact O-CB 3.5Å; K394-C397 PolarHBondContact O-N 3.28Å; K394-C397 VanDerWaalsContact O-N 3.13Å; K394-L398 HydrophobicContact CG-CD1 4.23Å; K394-L398 WeakPolarHBondContact O-CG 3.39Å; K394-L398 PolarHBondContact O-N 3.37Å; K394-D432 HydrophobicContact CD-CB 4.24Å; K394-D432 WeakPolarHBondContact CD-OD1 3.38Å; K394-D432 VanDerWaalsContact CE-OD1 3.25Å; K394-D432 WeakPolarHBondContact CE-OD1 3.47Å; K394-D432 HydrophobicContact CG-CB 4.43Å; K394-D432 IonicContact NZ-OD1 3.42Å; K394-D432 PolarHBondContact NZ-OD1 2.87Å; K394-E435 WeakPolarHBondContact CE-OE1 3.34Å; K394-E435 IonicContact NZ-OE1 2.68Å; K394-E435 PolarHBondContact NZ-OE1 3.01Å; K394-E435 IonicContact NZ-OE2 2.67Å; K394-E435 PolarHBondContact NZ-OE2 3.18Å
395	Q	91.6	Very high	92.7	Very high	132 Å²	132	55.5 Å²	55.5	62%	0.617	24%	0.243	S	C	*	.	H	α-helix	trans	-61.7	-43.3	-176.5	-170.3	63.9	21.6	0	0	112.7	L393 C397 L398 T399	L393-Q395 VanDerWaalsContact C-N 3.32Å; L393-Q395 PolarHBondContact O-N 2.94Å; L393-Q395 VanDerWaalsContact O-N 3.15Å; Q395-C397 VanDerWaalsContact C-N 3.3Å; Q395-L398 PolarHBondContact O-N 3.09Å; Q395-T399 WeakPolarHBondContact O-CG2 3.37Å; Q395-T399 PolarHBondContact O-N 2.97Å; Q395-T399 VanDerWaalsContact O-N 3.07Å; Q395-T399 PolarHBondContact O-OG1 3.31Å
396	Q	90.7	Very high	92.7	Very high	103 Å²	103	56.2 Å²	56.2	48%	0.481	25%	0.246	S	C	.	.	H	α-helix	trans	-70.9	-30.2	177.6	-64.9	-178.9	-7.2	0	0	111.6	S388 L393 K394 T399 A400	S388-Q396 WeakPolarHBondContact OG-CB 3.36Å; L393-Q396 HydrophobicContact CB-CB 4.3Å; L393-Q396 VanDerWaalsContact CD1-OE1 3.32Å; L393-Q396 PolarHBondContact O-N 3.42Å; K394-Q396 PolarHBondContact O-N 3.26Å; Q396-T399 PolarHBondContact O-OG1 2.99Å; Q396-A400 WeakPolarHBondContact O-CB 3.49Å; Q396-A400 PolarHBondContact O-N 2.91Å
397	C	92.9	Very high	92.8	Very high	7 Å²	7	54.1 Å²	54.1	5%	0.047	24%	0.238	C	C	.	.	H	α-helix	trans	-63.1	-49.5	171.9	-145.6	0	0	0	0	111	F385 L393 K394 Q395 A400 S401 V436	F385-C397 WeakPolarHBondContact CE2-SG 3.39Å; L393-C397 PolarHBondContact O-N 3.5Å; K394-C397 WeakPolarHBondContact O-CA 3.48Å; K394-C397 WeakPolarHBondContact O-CB 3.5Å; K394-C397 PolarHBondContact O-N 3.28Å; K394-C397 VanDerWaalsContact O-N 3.13Å; Q395-C397 VanDerWaalsContact C-N 3.3Å; C397-A400 PolarHBondContact O-N 3.38Å; C397-S401 WeakPolarHBondContact O-CB 3.46Å; C397-S401 PolarHBondContact O-N 3.45Å; C397-S401 PolarHBondContact O-OG 3.39Å; C397-V436 HydrophobicContact CB-CG1 4.45Å; C397-V436 HydrophobicContact CB-CG2 4.09Å
398	L	93	Very high	92.9	Very high	27 Å²	27	48.1 Å²	48.1	14%	0.141	22%	0.216	C	C	.	.	H	α-helix	trans	-59.9	-46.3	177	-72.9	170.5	0	0	0	112.9	K394 Q395 S401 K402 V436	K394-L398 HydrophobicContact CG-CD1 4.23Å; K394-L398 WeakPolarHBondContact O-CG 3.39Å; K394-L398 PolarHBondContact O-N 3.37Å; Q395-L398 PolarHBondContact O-N 3.09Å; L398-S401 PolarHBondContact O-OG 2.96Å; L398-K402 WeakPolarHBondContact O-CB 3.01Å; L398-K402 PolarHBondContact O-N 2.84Å; L398-V436 HydrophobicContact CD2-CB 4.23Å; L398-V436 HydrophobicContact CD2-CG2 3.77Å; L398-V436 HydrophobicContact CG-CG2 3.94Å
399	T	94.4	Very high	93	Very high	13 Å²	13	48.1 Å²	48.1	8%	0.08	22%	0.216	C	C	.	.	H	α-helix	trans	-67.6	-41.1	179.8	58	0	0	0	0	111.5	Q349 P353 Q395 Q396 F403	Q349-T399 PolarHBondContact NE2-O 3.46Å; Q349-T399 PolarHBondContact OE1-O 3.24Å; P353-T399 HydrophobicContact CB-CG2 4.01Å; P353-T399 HydrophobicContact CG-CG2 3.41Å; P353-T399 VanDerWaalsContact CG-CG2 3.41Å; Q395-T399 WeakPolarHBondContact O-CG2 3.37Å; Q395-T399 PolarHBondContact O-N 2.97Å; Q395-T399 VanDerWaalsContact O-N 3.07Å; Q395-T399 PolarHBondContact O-OG1 3.31Å; Q396-T399 PolarHBondContact O-OG1 2.99Å; T399-F403 PolarHBondContact O-N 3.19Å; T399-F403 VanDerWaalsContact O-N 3.16Å
400	A	94.3	Very high	93.1	Very high	3 Å²	3	45.5 Å²	45.5	3%	0.025	21%	0.206	C	C	.	.	H	α-helix	trans	-66.5	-43.8	177.4	0	0	0	0	0	112	L381 F385 Q396 C397 F403 V404	L381-A400 HydrophobicContact CD1-CB 3.98Å; F385-A400 HydrophobicContact CB-CB 4.14Å; Q396-A400 WeakPolarHBondContact O-CB 3.49Å; Q396-A400 PolarHBondContact O-N 2.91Å; C397-A400 PolarHBondContact O-N 3.38Å; A400-F403 PolarHBondContact O-N 3.35Å; A400-V404 WeakPolarHBondContact O-CG2 3.4Å; A400-V404 PolarHBondContact O-N 3.32Å
401	S	94.3	Very high	93.1	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-65.5	-42.2	178.2	66	0	0	0	0	111.9	C397 L398 F403 V404 A405 F440	C397-S401 WeakPolarHBondContact O-CB 3.46Å; C397-S401 PolarHBondContact O-N 3.45Å; C397-S401 PolarHBondContact O-OG 3.39Å; L398-S401 PolarHBondContact O-OG 2.96Å; S401-F403 PolarHBondContact O-N 2.91Å; S401-V404 PolarHBondContact O-N 3.37Å; S401-A405 PolarHBondContact O-N 3.36Å; S401-F440 WeakPolarHBondContact O-CD2 3.32Å; S401-F440 WeakPolarHBondContact O-CE2 3.33Å
402	K	94.8	Very high	93.2	Very high	34 Å²	34	31.1 Å²	31.1	15%	0.148	16%	0.155	C	C	.	.	H	α-helix	trans	-59.8	-34.1	173.8	-176.7	170.4	170.7	70.7	0	112.1	P353 T356 L398 A405 H406 E443	P353-K402 VanDerWaalsContact O-CE 3.3Å; P353-K402 WeakPolarHBondContact O-CE 3.4Å; T356-K402 HydrophobicContact CG2-CG 4.24Å; L398-K402 WeakPolarHBondContact O-CB 3.01Å; L398-K402 PolarHBondContact O-N 2.84Å; K402-A405 PolarHBondContact O-N 3.24Å; K402-H406 PolarHBondContact NZ-NE2 2.63Å; K402-H406 PolarHBondContact O-CD2 3.3Å; K402-H406 PolarHBondContact O-N 2.72Å; K402-E443 HydrophobicContact CG-CG 4.32Å; K402-E443 IonicContact NZ-OE1 3.53Å; K402-E443 PolarHBondContact NZ-OE1 3.05Å; K402-E443 IonicContact NZ-OE2 2.68Å; K402-E443 PolarHBondContact NZ-OE2 3.34Å
403	F	95.8	Very high	93.5	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-73.3	-40.8	176	-164.8	-159.1	0	0	0	113	V345 L346 Q349 T356 A360 V363 I377 L381 T399 A400 S401 A405 H406 L407	V345-F403 HydrophobicContact CG1-CE1 4.04Å; V345-F403 HydrophobicContact CG1-CZ 3.66Å; L346-F403 HydrophobicContact CD2-CD1 3.97Å; L346-F403 HydrophobicContact CD2-CE1 3.8Å; Q349-F403 HydrophobicContact CB-CD1 4.4Å; Q349-F403 HydrophobicContact CG-CB 4.06Å; Q349-F403 HydrophobicContact CG-CD1 3.96Å; Q349-F403 HydrophobicContact CG-CD2 4.21Å; Q349-F403 HydrophobicContact CG-CE1 4.48Å; Q349-F403 HydrophobicContact CG-CG 3.83Å; T356-F403 HydrophobicContact CG2-CB 3.7Å; T356-F403 HydrophobicContact CG2-CD2 3.61Å; T356-F403 HydrophobicContact CG2-CG 3.97Å; A360-F403 HydrophobicContact CB-CD2 4.44Å; A360-F403 HydrophobicContact CB-CE2 4.16Å; V363-F403 HydrophobicContact CG2-CZ 4.16Å; I377-F403 HydrophobicContact CG2-CE1 4.27Å; I377-F403 HydrophobicContact CG2-CZ 4.42Å; L381-F403 HydrophobicContact CD1-CB 4.24Å; L381-F403 HydrophobicContact CD1-CD1 3.88Å; L381-F403 HydrophobicContact CD2-CB 4.01Å; L381-F403 HydrophobicContact CD2-CD1 3.6Å; L381-F403 HydrophobicContact CD2-CE1 4.26Å; L381-F403 HydrophobicContact CD2-CG 3.89Å; L381-F403 HydrophobicContact CG-CD1 4.34Å; T399-F403 PolarHBondContact O-N 3.19Å; T399-F403 VanDerWaalsContact O-N 3.16Å; A400-F403 PolarHBondContact O-N 3.35Å; S401-F403 PolarHBondContact O-N 2.91Å; F403-A405 VanDerWaalsContact C-N 3.26Å; F403-A405 PolarHBondContact O-N 3.42Å; F403-H406 PolarHBondContact O-N 2.92Å; F403-L407 HydrophobicContact CD1-CD1 4.47Å; F403-L407 HydrophobicContact CD2-CD1 4.02Å; F403-L407 HydrophobicContact CD2-CG 4Å; F403-L407 HydrophobicContact CE1-CD1 4.36Å; F403-L407 HydrophobicContact CE2-CD1 3.93Å; F403-L407 HydrophobicContact CE2-CD2 4.05Å; F403-L407 HydrophobicContact CE2-CG 3.89Å; F403-L407 HydrophobicContact CG-CD1 4.3Å; F403-L407 HydrophobicContact CZ-CD1 4.1Å; F403-L407 HydrophobicContact CZ-CG 4.48Å; F403-L407 VanDerWaalsContact O-CG 3.32Å; F403-L407 WeakPolarHBondContact O-CG 3.11Å; F403-L407 PolarHBondContact O-N 2.94Å; F403-L407 VanDerWaalsContact O-N 3.08Å
404	V	95.6	Very high	93.6	Very high	0 Å²	0	24 Å²	24	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-58.2	-41.6	171.7	175.6	0	0	0	0	110.5	L381 A400 S401 L407 I408 L417 M421 F440	L381-V404 HydrophobicContact CD2-CB 4.46Å; L381-V404 HydrophobicContact CD2-CG2 3.53Å; L381-V404 HydrophobicContact CG-CG2 3.74Å; A400-V404 WeakPolarHBondContact O-CG2 3.4Å; A400-V404 PolarHBondContact O-N 3.32Å; S401-V404 PolarHBondContact O-N 3.37Å; V404-L407 PolarHBondContact O-N 3.44Å; V404-I408 HydrophobicContact CG1-CD1 3.67Å; V404-I408 HydrophobicContact CG1-CG1 4.32Å; V404-I408 WeakPolarHBondContact O-CD1 3.28Å; V404-I408 VanDerWaalsContact O-CG1 3.29Å; V404-I408 WeakPolarHBondContact O-CG1 3.3Å; V404-I408 PolarHBondContact O-N 2.94Å; V404-L417 HydrophobicContact CG1-CD2 3.94Å; V404-L417 HydrophobicContact CG1-CG 4.29Å; V404-M421 HydrophobicContact CB-CE 4.22Å; V404-M421 HydrophobicContact CB-SD 4.34Å; V404-M421 HydrophobicContact CG1-CE 4.29Å; V404-M421 HydrophobicContact CG1-SD 3.87Å; V404-M421 HydrophobicContact CG2-CE 4.16Å; V404-M421 HydrophobicContact CG2-SD 4.16Å; V404-F440 HydrophobicContact CB-CE2 4.03Å; V404-F440 HydrophobicContact CB-CZ 4.36Å; V404-F440 HydrophobicContact CG1-CE2 4.02Å; V404-F440 HydrophobicContact CG1-CZ 3.93Å
405	A	95.1	Very high	93.7	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-58.7	-53.4	179.5	0	0	0	0	0	112.4	S401 K402 F403 L407 I408 N409 F440 E443 C444	S401-A405 PolarHBondContact O-N 3.36Å; K402-A405 PolarHBondContact O-N 3.24Å; F403-A405 VanDerWaalsContact C-N 3.26Å; F403-A405 PolarHBondContact O-N 3.42Å; A405-L407 VanDerWaalsContact C-N 3.27Å; A405-L407 PolarHBondContact O-N 3.48Å; A405-I408 PolarHBondContact O-N 3.5Å; A405-I408 VanDerWaalsContact O-N 3.1Å; A405-N409 PolarHBondContact O-N 2.93Å; A405-N409 PolarHBondContact O-OD1 3.01Å; A405-F440 HydrophobicContact CB-CD2 3.82Å; A405-F440 HydrophobicContact CB-CE2 3.85Å; A405-E443 HydrophobicContact CB-CB 3.68Å; A405-C444 HydrophobicContact CB-CB 3.82Å
406	H	94.7	Very high	93.7	Very high	15 Å²	15	19.3 Å²	19.3	7%	0.069	10%	0.098	C	C	.	.	H	α-helix	trans	-67.8	-26.2	-179.8	-63.6	-61.4	0	0	0	112.9	A360 K402 F403 Q410 E443	A360-H406 HydrophobicContact CB-CB 3.54Å; K402-H406 PolarHBondContact NZ-NE2 2.63Å; K402-H406 PolarHBondContact O-CD2 3.3Å; K402-H406 PolarHBondContact O-N 2.72Å; F403-H406 PolarHBondContact O-N 2.92Å; H406-Q410 WeakPolarHBondContact O-CB 3.37Å; H406-Q410 WeakPolarHBondContact O-CG 3.47Å; H406-Q410 PolarHBondContact O-N 3.4Å; H406-E443 IonicContact CE1-OE2 2.58Å; H406-E443 PolarHBondContact CE1-OE2 2.97Å; H406-E443 IonicContact NE2-OE2 3.95Å
407	L	94.9	Very high	93.8	Very high	1 Å²	1	14.6 Å²	14.6	1%	0.005	8%	0.076	C	C	.	.	H	α-helix	trans	-72.8	-26.1	171.3	-70.3	172	0	0	0	113.6	A360 V363 L378 L381 F403 V404 A405 V412 A413	A360-L407 HydrophobicContact CB-CD2 4.01Å; A360-L407 HydrophobicContact CB-CG 4.29Å; V363-L407 HydrophobicContact CB-CD2 3.84Å; V363-L407 HydrophobicContact CG1-CD2 3.66Å; L378-L407 HydrophobicContact CD1-CD1 4.37Å; L381-L407 HydrophobicContact CD2-CD1 3.61Å; F403-L407 HydrophobicContact CD1-CD1 4.47Å; F403-L407 HydrophobicContact CD2-CD1 4.02Å; F403-L407 HydrophobicContact CD2-CG 4Å; F403-L407 HydrophobicContact CE1-CD1 4.36Å; F403-L407 HydrophobicContact CE2-CD1 3.93Å; F403-L407 HydrophobicContact CE2-CD2 4.05Å; F403-L407 HydrophobicContact CE2-CG 3.89Å; F403-L407 HydrophobicContact CG-CD1 4.3Å; F403-L407 HydrophobicContact CZ-CD1 4.1Å; F403-L407 HydrophobicContact CZ-CG 4.48Å; F403-L407 VanDerWaalsContact O-CG 3.32Å; F403-L407 WeakPolarHBondContact O-CG 3.11Å; F403-L407 PolarHBondContact O-N 2.94Å; F403-L407 VanDerWaalsContact O-N 3.08Å; V404-L407 PolarHBondContact O-N 3.44Å; A405-L407 VanDerWaalsContact C-N 3.27Å; A405-L407 PolarHBondContact O-N 3.48Å; L407-V412 HydrophobicContact CB-CB 4.38Å; L407-V412 HydrophobicContact CD2-CB 4.11Å; L407-V412 HydrophobicContact CD2-CG1 4.27Å; L407-V412 HydrophobicContact CD2-CG2 4.18Å; L407-V412 WeakPolarHBondContact O-CA 3.37Å; L407-V412 WeakPolarHBondContact O-CB 3.14Å; L407-V412 PolarHBondContact O-N 2.73Å; L407-A413 HydrophobicContact CB-CB 4.36Å; L407-A413 PolarHBondContact O-N 3.18Å; L407-A413 VanDerWaalsContact O-N 3.08Å
408	I	93.6	Very high	93.8	Very high	4 Å²	4	14.2 Å²	14.2	2%	0.021	7%	0.074	C	C	.	.	H	α-helix	trans	-76.4	-41.5	170.5	-63.4	151.9	0	0	0	110.3	V404 A405 Q410 N411 A413 C418 F440 K447	V404-I408 HydrophobicContact CG1-CD1 3.67Å; V404-I408 HydrophobicContact CG1-CG1 4.32Å; V404-I408 WeakPolarHBondContact O-CD1 3.28Å; V404-I408 VanDerWaalsContact O-CG1 3.29Å; V404-I408 WeakPolarHBondContact O-CG1 3.3Å; V404-I408 PolarHBondContact O-N 2.94Å; A405-I408 PolarHBondContact O-N 3.5Å; A405-I408 VanDerWaalsContact O-N 3.1Å; I408-Q410 VanDerWaalsContact C-N 3.31Å; I408-Q410 PolarHBondContact O-N 3.37Å; I408-N411 PolarHBondContact O-N 3.22Å; I408-A413 HydrophobicContact CG1-CB 4.05Å; I408-C418 HydrophobicContact CD1-CB 3.51Å; I408-F440 HydrophobicContact CD1-CZ 4.33Å; I408-K447 HydrophobicContact CG2-CG 4.37Å
409	N	93.4	Very high	93.8	Very high	2 Å²	2	14.5 Å²	14.5	1%	0.011	8%	0.075	C	C	.	.	H	α-helix	trans	-58.6	-45.5	177.1	-68.9	10.3	0	0	0	111.4	A405 N411 E443 C444 K447 V496	A405-N409 PolarHBondContact O-N 2.93Å; A405-N409 PolarHBondContact O-OD1 3.01Å; N409-N411 PolarHBondContact O-N 2.78Å; N409-E443 PolarHBondContact ND2-O 3.45Å; N409-C444 WeakPolarHBondContact OD1-CA 3.35Å; N409-K447 PolarHBondContact O-NZ 3.13Å; N409-V496 HydrophobicContact CB-CG1 3.66Å; N409-V496 VanDerWaalsContact CB-O 3.24Å; N409-V496 WeakPolarHBondContact CB-O 3.46Å; N409-V496 PolarHBondContact ND2-O 2.93Å
410	Q	91.9	Very high	93.7	Very high	12 Å²	12	16.9 Å²	16.9	6%	0.056	9%	0.085	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.3	17.7	174	-70.9	-73.6	19.2	0	0	114.1	A360 S361 A364 H406 I408 V412 I497 L501	A360-Q410 HydrophobicContact CB-CG 4.39Å; S361-Q410 PolarHBondContact OG-NE2 3.19Å; A364-Q410 HydrophobicContact CB-CB 4.06Å; H406-Q410 WeakPolarHBondContact O-CB 3.37Å; H406-Q410 WeakPolarHBondContact O-CG 3.47Å; H406-Q410 PolarHBondContact O-N 3.4Å; I408-Q410 VanDerWaalsContact C-N 3.31Å; I408-Q410 PolarHBondContact O-N 3.37Å; Q410-V412 HydrophobicContact CB-CG2 4.47Å; Q410-V412 PolarHBondContact O-N 3.3Å; Q410-I497 HydrophobicContact CG-CG1 4.31Å; Q410-I497 VanDerWaalsContact OE1-CD1 3.25Å; Q410-L501 PolarHBondContact NE2-O 3.04Å
411	N	92.1	Very high	93.7	Very high	40 Å²	40	16.8 Å²	16.8	21%	0.214	8%	0.084	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.1	13.8	176.6	-73.2	-20.1	0	0	0	116.8	I408 N409 K447 Q509 T511	I408-N411 PolarHBondContact O-N 3.22Å; N409-N411 PolarHBondContact O-N 2.78Å; N411-K447 PolarHBondContact ND2-NZ 2.93Å; N411-K447 WeakPolarHBondContact OD1-CE 3.21Å; N411-K447 PolarHBondContact OD1-NZ 3.43Å; N411-Q509 HydrophobicContact CB-CB 4.47Å; N411-Q509 VanDerWaalsContact CB-OE1 3.22Å; N411-Q509 PolarHBondContact ND2-OE1 2.76Å; N411-T511 HydrophobicContact CB-CG2 4.25Å; N411-T511 WeakPolarHBondContact O-CA 3.38Å; N411-T511 WeakPolarHBondContact O-CG2 3.33Å
412	V	94.1	Very high	93.6	Very high	1 Å²	1	16.8 Å²	16.8	1%	0.006	8%	0.084	C	C	.	.	S	Bend	trans	-72.7	-35.9	175.6	-179	0	0	0	0	111.2	V363 A364 N367 L407 Q410 H512	V363-V412 HydrophobicContact CG1-CG1 4.24Å; A364-V412 HydrophobicContact CB-CG2 3.75Å; N367-V412 HydrophobicContact CB-CG1 4.35Å; N367-V412 HydrophobicContact CB-CG2 4.46Å; L407-V412 HydrophobicContact CB-CB 4.38Å; L407-V412 HydrophobicContact CD2-CB 4.11Å; L407-V412 HydrophobicContact CD2-CG1 4.27Å; L407-V412 HydrophobicContact CD2-CG2 4.18Å; L407-V412 WeakPolarHBondContact O-CA 3.37Å; L407-V412 WeakPolarHBondContact O-CB 3.14Å; L407-V412 PolarHBondContact O-N 2.73Å; Q410-V412 HydrophobicContact CB-CG2 4.47Å; Q410-V412 PolarHBondContact O-N 3.3Å; V412-H512 WeakPolarHBondContact O-CB 3.47Å; V412-H512 PolarHBondContact O-CD2 2.89Å; V412-H512 PolarHBondContact O-N 3.27Å
413	A	94.8	Very high	93.5	Very high	3 Å²	3	17.5 Å²	17.5	3%	0.025	9%	0.092	C	C	.	.	B	Isolated β-bridge	trans	-118.7	132.1	-177.4	0	0	0	0	0	111.3	L378 L407 I408	L378-A413 HydrophobicContact CD1-CB 3.83Å; L378-A413 HydrophobicContact CD2-CB 3.59Å; L378-A413 HydrophobicContact CG-CB 4.38Å; L407-A413 HydrophobicContact CB-CB 4.36Å; L407-A413 PolarHBondContact O-N 3.18Å; L407-A413 VanDerWaalsContact O-N 3.08Å; I408-A413 HydrophobicContact CG1-CB 4.05Å
414	H	94.4	Very high	93.4	Very high	57 Å²	57	19.4 Å²	19.4	26%	0.264	10%	0.102	S	C	.	.			trans	-69.5	141.3	179.3	-169.9	-104.4	0	0	0	112.7	V416 L417 H512 M513	H414-V416 WeakPolarHBondContact ND1-CG2 3.34Å; H414-V416 PolarHBondContact ND1-N 2.88Å; H414-V416 PolarHBondContact O-N 2.88Å; H414-L417 PolarHBondContact O-N 2.78Å; H414-H512 WeakPolarHBondContact CB-O 3.28Å; H414-H512 PolarHBondContact N-O 3.4Å; H414-M513 HydrophobicContact CB-SD 3.5Å; H414-M513 WeakPolarHBondContact CB-SD 3.27Å; H414-M513 VanDerWaalsContact CD2-SD 3.56Å
415	E	90.8	Very high	93.1	Very high	32 Å²	32	19.5 Å²	19.5	15%	0.15	10%	0.102	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.4	-25.1	-176.2	59.1	176.5	-128.6	0	0	116	L417 C418 L419 L448 V451 S452	E415-L417 PolarHBondContact O-N 2.73Å; E415-C418 WeakPolarHBondContact O-CA 3.41Å; E415-C418 WeakPolarHBondContact O-CB 3.33Å; E415-C418 PolarHBondContact O-N 3.47Å; E415-L419 PolarHBondContact O-N 3.01Å; E415-L419 VanDerWaalsContact O-N 3.12Å; E415-L448 HydrophobicContact CB-CD2 4.04Å; E415-V451 WeakPolarHBondContact OE2-CB 3.24Å; E415-V451 WeakPolarHBondContact OE2-CG1 3.47Å; E415-S452 WeakPolarHBondContact OE1-CB 3.42Å; E415-S452 PolarHBondContact OE1-OG 3.28Å
416	V	92.6	Very high	92.9	Very high	52 Å²	52	19.9 Å²	19.9	32%	0.315	10%	0.104	S	C	.	.	H	α-helix	trans	-58	-39.1	179.4	164.9	0	0	0	0	111.1	H414 C418 L419 E420	H414-V416 WeakPolarHBondContact ND1-CG2 3.34Å; H414-V416 PolarHBondContact ND1-N 2.88Å; H414-V416 PolarHBondContact O-N 2.88Å; V416-C418 PolarHBondContact O-N 2.79Å; V416-L419 PolarHBondContact O-N 3.26Å; V416-L419 VanDerWaalsContact O-N 3.16Å; V416-E420 HydrophobicContact CG1-CG 4.29Å; V416-E420 WeakPolarHBondContact CG1-OE1 3.43Å; V416-E420 WeakPolarHBondContact O-CB 3.39Å; V416-E420 WeakPolarHBondContact O-CG 3.4Å; V416-E420 PolarHBondContact O-N 3.03Å
417	L	92.6	Very high	92.7	Very high	3 Å²	3	25 Å²	25	2%	0.016	13%	0.128	C	C	.	.	H	α-helix	trans	-57.8	-36.6	173.7	177.2	62.1	0	0	0	111.8	L378 I382 V404 H414 E415 M421 L516	L378-L417 HydrophobicContact CD1-CD2 4.01Å; I382-L417 HydrophobicContact CD1-CD1 4.01Å; I382-L417 HydrophobicContact CD1-CD2 3.82Å; I382-L417 HydrophobicContact CG1-CD1 4.02Å; I382-L417 HydrophobicContact CG1-CD2 3.9Å; V404-L417 HydrophobicContact CG1-CD2 3.94Å; V404-L417 HydrophobicContact CG1-CG 4.29Å; H414-L417 PolarHBondContact O-N 2.78Å; E415-L417 PolarHBondContact O-N 2.73Å; L417-M421 HydrophobicContact CD1-CG 4.29Å; L417-M421 HydrophobicContact CD1-SD 4.04Å; L417-M421 HydrophobicContact CG-SD 4.02Å; L417-M421 VanDerWaalsContact O-CB 3.32Å; L417-M421 WeakPolarHBondContact O-CB 3.28Å; L417-M421 VanDerWaalsContact O-CG 3.22Å; L417-M421 WeakPolarHBondContact O-CG 3.38Å; L417-M421 PolarHBondContact O-N 3.08Å; L417-L516 HydrophobicContact CD1-CB 4.08Å; L417-L516 HydrophobicContact CD1-CD1 4.2Å
418	C	93.4	Very high	92.2	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-66.9	-47.4	176.7	-159.1	0	0	0	0	111.9	I408 E415 V416 E420 M421 L422 F440 C444 L448	I408-C418 HydrophobicContact CD1-CB 3.51Å; E415-C418 WeakPolarHBondContact O-CA 3.41Å; E415-C418 WeakPolarHBondContact O-CB 3.33Å; E415-C418 PolarHBondContact O-N 3.47Å; V416-C418 PolarHBondContact O-N 2.79Å; C418-E420 VanDerWaalsContact C-N 3.34Å; C418-E420 PolarHBondContact O-N 2.99Å; C418-M421 PolarHBondContact O-N 2.87Å; C418-L422 WeakPolarHBondContact O-CB 3.24Å; C418-L422 WeakPolarHBondContact O-CG 3.35Å; C418-L422 PolarHBondContact O-N 3.44Å; C418-F440 HydrophobicContact CB-CE1 4.43Å; C418-F440 HydrophobicContact CB-CZ 4.21Å; C418-F440 WeakPolarHBondContact SG-CE1 3.46Å; C418-F440 WeakPolarHBondContact SG-CZ 2.98Å; C418-C444 PolarHBondContact SG-SG 3.08Å; C418-L448 HydrophobicContact CB-CD2 4.15Å
419	L	92.4	Very high	91.7	Very high	33 Å²	33	35.7 Å²	35.7	17%	0.173	18%	0.176	C	C	.	.	H	α-helix	trans	-63.6	-41.2	179.1	-59.8	179.4	0	0	0	111.1	E415 V416 T423 L448 I459	E415-L419 PolarHBondContact O-N 3.01Å; E415-L419 VanDerWaalsContact O-N 3.12Å; V416-L419 PolarHBondContact O-N 3.26Å; V416-L419 VanDerWaalsContact O-N 3.16Å; L419-T423 WeakPolarHBondContact O-CB 3.39Å; L419-T423 VanDerWaalsContact O-CG2 3.31Å; L419-T423 WeakPolarHBondContact O-CG2 3.5Å; L419-T423 PolarHBondContact O-N 3.1Å; L419-T423 PolarHBondContact O-OG1 2.92Å; L419-L448 HydrophobicContact CD2-CD2 4.16Å; L419-I459 HydrophobicContact CD2-CD1 3.49Å; L419-I459 VanDerWaalsContact CD2-CD1 3.49Å
420	E	92.9	Very high	91.4	Very high	63 Å²	63	39.4 Å²	39.4	29%	0.294	20%	0.198	S	C	.	.	H	α-helix	trans	-63.9	-48.5	174.6	-71.9	173.9	177.3	0	0	111.6	V416 C418 L422 T423 L424 P515 L516	V416-E420 HydrophobicContact CG1-CG 4.29Å; V416-E420 WeakPolarHBondContact CG1-OE1 3.43Å; V416-E420 WeakPolarHBondContact O-CB 3.39Å; V416-E420 WeakPolarHBondContact O-CG 3.4Å; V416-E420 PolarHBondContact O-N 3.03Å; C418-E420 VanDerWaalsContact C-N 3.34Å; C418-E420 PolarHBondContact O-N 2.99Å; E420-L422 PolarHBondContact O-N 3.33Å; E420-T423 WeakPolarHBondContact CA-OG1 2.98Å; E420-T423 PolarHBondContact O-N 3.26Å; E420-T423 PolarHBondContact O-OG1 3.38Å; E420-L424 WeakPolarHBondContact O-CB 3.35Å; E420-L424 PolarHBondContact O-N 3.42Å; E420-P515 WeakPolarHBondContact OE2-CA 3.41Å; E420-L516 HydrophobicContact CB-CB 3.9Å; E420-L516 HydrophobicContact CB-CD2 4.18Å; E420-L516 WeakPolarHBondContact OE2-CB 3.39Å; E420-L516 PolarHBondContact OE2-N 3.36Å
421	M	92.9	Very high	91.2	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-60.1	-42.7	176.1	-76.4	175.1	55.7	0	0	112.4	F385 V404 L417 C418 L425 F440 L516	F385-M421 HydrophobicContact CD1-CE 4.06Å; F385-M421 HydrophobicContact CD1-CG 4.2Å; F385-M421 HydrophobicContact CD1-SD 4.31Å; F385-M421 HydrophobicContact CD2-CE 3.78Å; F385-M421 HydrophobicContact CE1-CB 4.4Å; F385-M421 HydrophobicContact CE1-CE 4.03Å; F385-M421 HydrophobicContact CE1-CG 3.76Å; F385-M421 HydrophobicContact CE1-SD 4.37Å; F385-M421 HydrophobicContact CE2-CE 3.73Å; F385-M421 HydrophobicContact CG-CE 3.95Å; F385-M421 HydrophobicContact CZ-CB 4.4Å; F385-M421 HydrophobicContact CZ-CE 3.86Å; F385-M421 HydrophobicContact CZ-CG 4.19Å; V404-M421 HydrophobicContact CB-CE 4.22Å; V404-M421 HydrophobicContact CB-SD 4.34Å; V404-M421 HydrophobicContact CG1-CE 4.29Å; V404-M421 HydrophobicContact CG1-SD 3.87Å; V404-M421 HydrophobicContact CG2-CE 4.16Å; V404-M421 HydrophobicContact CG2-SD 4.16Å; L417-M421 HydrophobicContact CD1-CG 4.29Å; L417-M421 HydrophobicContact CD1-SD 4.04Å; L417-M421 HydrophobicContact CG-SD 4.02Å; L417-M421 VanDerWaalsContact O-CB 3.32Å; L417-M421 WeakPolarHBondContact O-CB 3.28Å; L417-M421 VanDerWaalsContact O-CG 3.22Å; L417-M421 WeakPolarHBondContact O-CG 3.38Å; L417-M421 PolarHBondContact O-N 3.08Å; C418-M421 PolarHBondContact O-N 2.87Å; M421-L425 WeakPolarHBondContact O-CB 3.42Å; M421-L425 WeakPolarHBondContact O-CD1 3.4Å; M421-L425 VanDerWaalsContact O-CG 3.22Å; M421-L425 WeakPolarHBondContact O-CG 3.01Å; M421-L425 PolarHBondContact O-N 2.89Å; M421-F440 HydrophobicContact CB-CE1 3.75Å; M421-F440 HydrophobicContact CB-CZ 4.34Å; M421-F440 HydrophobicContact CE-CE1 3.94Å; M421-F440 HydrophobicContact CE-CE2 4.23Å; M421-F440 HydrophobicContact CE-CZ 3.73Å; M421-F440 HydrophobicContact SD-CE1 4.48Å; M421-F440 HydrophobicContact SD-CZ 4.16Å; M421-L516 HydrophobicContact CB-CD2 4.45Å; M421-L516 HydrophobicContact CG-CD1 3.86Å; M421-L516 HydrophobicContact CG-CD2 3.83Å; M421-L516 HydrophobicContact CG-CG 4.41Å
422	L	93.5	Very high	91.1	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-68.5	-38.4	177.3	-75.2	165.7	0	0	0	112.2	C418 E420 L426 A437 F440 L441 L448 I459	C418-L422 WeakPolarHBondContact O-CB 3.24Å; C418-L422 WeakPolarHBondContact O-CG 3.35Å; C418-L422 PolarHBondContact O-N 3.44Å; E420-L422 PolarHBondContact O-N 3.33Å; L422-L426 VanDerWaalsContact O-CB 3.31Å; L422-L426 WeakPolarHBondContact O-CB 3.36Å; L422-L426 VanDerWaalsContact O-CG 3.25Å; L422-L426 WeakPolarHBondContact O-CG 3.42Å; L422-L426 PolarHBondContact O-N 3.37Å; L422-L426 VanDerWaalsContact O-N 3.1Å; L422-A437 HydrophobicContact CD2-CB 3.99Å; L422-F440 HydrophobicContact CD1-CD1 4.23Å; L422-F440 HydrophobicContact CD1-CE1 4.33Å; L422-F440 HydrophobicContact CD2-CD1 3.67Å; L422-F440 HydrophobicContact CD2-CE1 4.4Å; L422-F440 HydrophobicContact CG-CD1 3.66Å; L422-F440 HydrophobicContact CG-CE1 3.88Å; L422-L441 HydrophobicContact CD1-CD1 4.1Å; L422-L441 HydrophobicContact CD2-CB 4.34Å; L422-L448 HydrophobicContact CD1-CD1 4.06Å; L422-I459 HydrophobicContact CB-CD1 3.93Å; L422-I459 HydrophobicContact CB-CG1 4.18Å; L422-I459 HydrophobicContact CD1-CD1 3.68Å; L422-I459 HydrophobicContact CG-CD1 4.43Å
423	T	92.4	Very high	90.9	Very high	50 Å²	50	44.6 Å²	44.6	31%	0.307	23%	0.227	S	C	.	.	H	α-helix	trans	-68.9	-35.8	176.4	50.7	0	0	0	0	112.6	L419 E420 L426 E427 R462	L419-T423 WeakPolarHBondContact O-CB 3.39Å; L419-T423 VanDerWaalsContact O-CG2 3.31Å; L419-T423 WeakPolarHBondContact O-CG2 3.5Å; L419-T423 PolarHBondContact O-N 3.1Å; L419-T423 PolarHBondContact O-OG1 2.92Å; E420-T423 WeakPolarHBondContact CA-OG1 2.98Å; E420-T423 PolarHBondContact O-N 3.26Å; E420-T423 PolarHBondContact O-OG1 3.38Å; T423-L426 PolarHBondContact O-N 3.11Å; T423-E427 PolarHBondContact O-N 3.17Å; T423-R462 PolarHBondContact O-NH1 3.28Å
424	L	92.4	Very high	90.7	Very high	40 Å²	40	44.4 Å²	44.4	21%	0.209	23%	0.226	C	C	.	.	H	α-helix	trans	-69.6	-38.8	174.1	173.1	144.5	0	0	0	112.9	F385 Y389 E420 L426 L516	F385-L424 HydrophobicContact CE1-CD2 4.28Å; F385-L424 HydrophobicContact CZ-CD2 4.38Å; Y389-L424 HydrophobicContact CD1-CD2 4.03Å; Y389-L424 HydrophobicContact CD2-CD2 3.89Å; Y389-L424 HydrophobicContact CE1-CD2 3.76Å; Y389-L424 HydrophobicContact CE1-CG 4.31Å; Y389-L424 HydrophobicContact CE2-CD2 3.61Å; Y389-L424 HydrophobicContact CG-CD2 4.09Å; Y389-L424 PolarHBondContact OH-O 3.03Å; E420-L424 WeakPolarHBondContact O-CB 3.35Å; E420-L424 PolarHBondContact O-N 3.42Å; L424-L426 VanDerWaalsContact C-N 3.3Å; L424-L426 PolarHBondContact O-N 2.7Å; L424-L516 HydrophobicContact CB-CD2 4.27Å; L424-L516 HydrophobicContact CD1-CD2 3.99Å
425	L	91.3	Very high	90.6	Very high	1 Å²	1	43 Å²	43	1%	0.005	22%	0.219	C	C	.	.	H	α-helix	trans	-68.1	-30.2	175.2	-71.9	165.2	0	0	0	112.6	F385 Y389 M421 S433 V436 A437	F385-L425 HydrophobicContact CZ-CD1 4.27Å; F385-L425 HydrophobicContact CZ-CD2 4.26Å; F385-L425 HydrophobicContact CZ-CG 4.24Å; Y389-L425 HydrophobicContact CD2-CD2 3.98Å; Y389-L425 HydrophobicContact CE2-CD2 3.96Å; M421-L425 WeakPolarHBondContact O-CB 3.42Å; M421-L425 WeakPolarHBondContact O-CD1 3.4Å; M421-L425 VanDerWaalsContact O-CG 3.22Å; M421-L425 WeakPolarHBondContact O-CG 3.01Å; M421-L425 PolarHBondContact O-N 2.89Å; L425-S433 WeakPolarHBondContact O-CB 3.42Å; L425-S433 PolarHBondContact O-OG 3.16Å; L425-V436 HydrophobicContact CD1-CB 4.5Å; L425-V436 HydrophobicContact CD1-CG1 3.83Å; L425-V436 HydrophobicContact CD2-CB 4.21Å; L425-V436 HydrophobicContact CD2-CG1 3.97Å; L425-A437 HydrophobicContact CB-CB 3.99Å; L425-A437 HydrophobicContact CD1-CB 4.2Å
426	L	90.7	Very high	90.7	Very high	9 Å²	9	41.6 Å²	41.6	5%	0.047	21%	0.213	C	C	.	.	H	α-helix	trans	-102	-3.3	-176.9	-60.6	177.3	0	0	0	114.8	L422 T423 L424 R428 V434 A437 I459 L463 I466	L422-L426 VanDerWaalsContact O-CB 3.31Å; L422-L426 WeakPolarHBondContact O-CB 3.36Å; L422-L426 VanDerWaalsContact O-CG 3.25Å; L422-L426 WeakPolarHBondContact O-CG 3.42Å; L422-L426 PolarHBondContact O-N 3.37Å; L422-L426 VanDerWaalsContact O-N 3.1Å; T423-L426 PolarHBondContact O-N 3.11Å; L424-L426 VanDerWaalsContact C-N 3.3Å; L424-L426 PolarHBondContact O-N 2.7Å; L426-R428 VanDerWaalsContact C-N 3.3Å; L426-V434 HydrophobicContact CD2-CG2 4.15Å; L426-A437 HydrophobicContact CD2-CB 3.8Å; L426-A437 HydrophobicContact CG-CB 4.1Å; L426-I459 HydrophobicContact CD1-CG2 4Å; L426-L463 HydrophobicContact CD1-CD2 3.97Å; L426-L463 HydrophobicContact CD1-CG 4.13Å; L426-L463 HydrophobicContact CD2-CD2 3.78Å; L426-I466 HydrophobicContact CB-CD1 4.41Å; L426-I466 HydrophobicContact CD2-CD1 3.94Å
427	E	89.1	Confident	90.8	Very high	121 Å²	121	39.2 Å²	39.2	57%	0.565	20%	0.199	S	C	*	.	H	α-helix	trans	-63.5	-39.9	172.3	-172.8	-157.8	120.4	0	0	110.8	T423	T423-E427 PolarHBondContact O-N 3.17Å
428	R	84.5	Confident	90.9	Very high	172 Å²	172	39.1 Å²	39.1	65%	0.649	20%	0.198	S	C	*	.	S	Bend	trans	-126	84.9	179.5	-60.6	-175.7	-168.1	-161.2	0.7	108.3	L426 T430 S433	L426-R428 VanDerWaalsContact C-N 3.3Å; R428-T430 PolarHBondContact O-N 3.23Å; R428-S433 PolarHBondContact O-OG 2.89Å
429	P	83.7	Confident	90.9	Very high	59 Å²	59	40.9 Å²	40.9	38%	0.383	21%	0.21	S	C	.	.			trans	-65.4	108.3	-176	26.5	-34.6	0	0	0	110.2	V434 I466	P429-V434 HydrophobicContact CB-CG2 3.82Å; P429-I466 HydrophobicContact CB-CD1 3.88Å; P429-I466 HydrophobicContact CB-CG1 4.02Å; P429-I466 HydrophobicContact CB-CG2 4.33Å; P429-I466 HydrophobicContact CG-CD1 4.35Å; P429-I466 HydrophobicContact CG-CG1 4.1Å
430	T	86.6	Confident	91	Very high	79 Å²	79	39.3 Å²	39.3	49%	0.485	20%	0.202	S	C	.	.			trans	-114.7	154.9	167.3	62.7	0	0	0	0	108.2	R428 D432 S433 V434	R428-T430 PolarHBondContact O-N 3.23Å; T430-D432 PolarHBondContact O-N 3.17Å; T430-D432 VanDerWaalsContact O-N 3.16Å; T430-S433 PolarHBondContact N-OG 3.31Å; T430-S433 PolarHBondContact O-N 2.85Å; T430-S433 PolarHBondContact O-OG 2.9Å; T430-S433 VanDerWaalsContact OG1-CB 3.28Å; T430-S433 WeakPolarHBondContact OG1-CB 3.32Å; T430-S433 PolarHBondContact OG1-N 3.02Å; T430-S433 PolarHBondContact OG1-OG 3.42Å; T430-V434 WeakPolarHBondContact O-CG2 3.42Å; T430-V434 PolarHBondContact O-N 2.97Å
431	D	87.8	Confident	91	Very high	75 Å²	75	36.3 Å²	36.3	40%	0.401	19%	0.188	S	C	.	.	H	α-helix	trans	-55.9	-39.4	-175.3	-54.6	-37.3	0	0	0	112.2	E435 V476	D431-E435 VanDerWaalsContact O-CB 3.28Å; D431-E435 WeakPolarHBondContact O-CB 3.45Å; D431-E435 PolarHBondContact O-N 3.41Å; D431-V476 HydrophobicContact CB-CG2 3.66Å; D431-V476 WeakPolarHBondContact OD1-CG2 3.22Å
432	D	89.6	Confident	91.1	Very high	79 Å²	79	38.8 Å²	38.8	42%	0.422	20%	0.199	S	C	.	.	H	α-helix	trans	-71.3	-39.5	175.7	-76.5	-8.6	0	0	0	113.5	K394 T430 V436	K394-D432 HydrophobicContact CD-CB 4.24Å; K394-D432 WeakPolarHBondContact CD-OD1 3.38Å; K394-D432 VanDerWaalsContact CE-OD1 3.25Å; K394-D432 WeakPolarHBondContact CE-OD1 3.47Å; K394-D432 HydrophobicContact CG-CB 4.43Å; K394-D432 IonicContact NZ-OD1 3.42Å; K394-D432 PolarHBondContact NZ-OD1 2.87Å; T430-D432 PolarHBondContact O-N 3.17Å; T430-D432 VanDerWaalsContact O-N 3.16Å; D432-V436 VanDerWaalsContact O-CG2 3.28Å; D432-V436 WeakPolarHBondContact O-CG2 3.37Å; D432-V436 PolarHBondContact O-N 2.89Å
433	S	90.7	Very high	91	Very high	8 Å²	8	40.5 Å²	40.5	6%	0.056	21%	0.207	C	C	.	.	H	α-helix	trans	-72.5	-34.4	179.8	71.8	0	0	0	0	112.4	L425 R428 T430 V436 A437	L425-S433 WeakPolarHBondContact O-CB 3.42Å; L425-S433 PolarHBondContact O-OG 3.16Å; R428-S433 PolarHBondContact O-OG 2.89Å; T430-S433 PolarHBondContact N-OG 3.31Å; T430-S433 PolarHBondContact O-N 2.85Å; T430-S433 PolarHBondContact O-OG 2.9Å; T430-S433 VanDerWaalsContact OG1-CB 3.28Å; T430-S433 WeakPolarHBondContact OG1-CB 3.32Å; T430-S433 PolarHBondContact OG1-N 3.02Å; T430-S433 PolarHBondContact OG1-OG 3.42Å; S433-V436 PolarHBondContact O-N 3.27Å; S433-A437 WeakPolarHBondContact O-CB 3.36Å; S433-A437 PolarHBondContact O-N 3.48Å
434	V	91.1	Very high	91	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-72.1	-37.7	174.4	-179	0	0	0	0	110.8	L426 P429 T430 A437 I438 V476 I480	L426-V434 HydrophobicContact CD2-CG2 4.15Å; P429-V434 HydrophobicContact CB-CG2 3.82Å; T430-V434 WeakPolarHBondContact O-CG2 3.42Å; T430-V434 PolarHBondContact O-N 2.97Å; V434-A437 PolarHBondContact O-N 2.82Å; V434-I438 HydrophobicContact CG1-CD1 3.7Å; V434-I438 HydrophobicContact CG1-CG1 4.31Å; V434-I438 WeakPolarHBondContact O-CB 3.48Å; V434-I438 VanDerWaalsContact O-CG1 3.29Å; V434-I438 WeakPolarHBondContact O-CG1 3.31Å; V434-I438 PolarHBondContact O-N 3.25Å; V434-V476 HydrophobicContact CB-CG1 3.77Å; V434-V476 HydrophobicContact CG1-CG1 3.42Å; V434-V476 VanDerWaalsContact CG1-CG1 3.42Å; V434-V476 HydrophobicContact CG2-CG1 4.47Å; V434-I480 HydrophobicContact CG1-CD1 4.26Å; V434-I480 HydrophobicContact CG1-CG1 4.26Å
435	E	91.9	Very high	91	Very high	26 Å²	26	36.2 Å²	36.2	12%	0.121	18%	0.183	C	C	.	.	H	α-helix	trans	-60.6	-43.4	171.4	176	165.2	150.7	0	0	112.2	K394 D431 S439 R475 M479	K394-E435 WeakPolarHBondContact CE-OE1 3.34Å; K394-E435 IonicContact NZ-OE1 2.68Å; K394-E435 PolarHBondContact NZ-OE1 3.01Å; K394-E435 IonicContact NZ-OE2 2.67Å; K394-E435 PolarHBondContact NZ-OE2 3.18Å; D431-E435 VanDerWaalsContact O-CB 3.28Å; D431-E435 WeakPolarHBondContact O-CB 3.45Å; D431-E435 PolarHBondContact O-N 3.41Å; E435-S439 WeakPolarHBondContact O-CB 3.46Å; E435-S439 PolarHBondContact O-N 3.11Å; E435-R475 IonicContact OE1-NH2 2.65Å; E435-R475 PolarHBondContact OE1-NH2 2.79Å; E435-R475 IonicContact OE2-CZ 3.06Å; E435-R475 VanDerWaalsContact OE2-CZ 3.23Å; E435-R475 IonicContact OE2-NE 3.07Å; E435-R475 PolarHBondContact OE2-NE 3.4Å; E435-R475 IonicContact OE2-NH2 3.89Å; E435-R475 PolarHBondContact OE2-NH2 2.95Å; E435-M479 HydrophobicContact CB-CE 4.29Å; E435-M479 HydrophobicContact CB-SD 4.22Å; E435-M479 HydrophobicContact CG-CE 3.91Å; E435-M479 HydrophobicContact CG-SD 4.06Å
436	V	93.7	Very high	91.1	Very high	3 Å²	3	38.1 Å²	38.1	2%	0.018	19%	0.192	C	C	.	.	H	α-helix	trans	-63.9	-45.7	173.5	175.3	0	0	0	0	111.2	C397 L398 L425 D432 S433 I438 S439 F440	C397-V436 HydrophobicContact CB-CG1 4.45Å; C397-V436 HydrophobicContact CB-CG2 4.09Å; L398-V436 HydrophobicContact CD2-CB 4.23Å; L398-V436 HydrophobicContact CD2-CG2 3.77Å; L398-V436 HydrophobicContact CG-CG2 3.94Å; L425-V436 HydrophobicContact CD1-CB 4.5Å; L425-V436 HydrophobicContact CD1-CG1 3.83Å; L425-V436 HydrophobicContact CD2-CB 4.21Å; L425-V436 HydrophobicContact CD2-CG1 3.97Å; D432-V436 VanDerWaalsContact O-CG2 3.28Å; D432-V436 WeakPolarHBondContact O-CG2 3.37Å; D432-V436 PolarHBondContact O-N 2.89Å; S433-V436 PolarHBondContact O-N 3.27Å; V436-I438 PolarHBondContact O-N 3.37Å; V436-S439 PolarHBondContact O-N 2.77Å; V436-F440 VanDerWaalsContact O-CB 3.27Å; V436-F440 WeakPolarHBondContact O-CB 3.33Å; V436-F440 PolarHBondContact O-N 3.2Å
437	A	94.4	Very high	91.1	Very high	2 Å²	2	38.9 Å²	38.9	2%	0.017	20%	0.196	C	C	.	.	H	α-helix	trans	-60.8	-42.1	179.3	0	0	0	0	0	112.4	L422 L425 L426 S433 V434 F440 L441	L422-A437 HydrophobicContact CD2-CB 3.99Å; L425-A437 HydrophobicContact CB-CB 3.99Å; L425-A437 HydrophobicContact CD1-CB 4.2Å; L426-A437 HydrophobicContact CD2-CB 3.8Å; L426-A437 HydrophobicContact CG-CB 4.1Å; S433-A437 WeakPolarHBondContact O-CB 3.36Å; S433-A437 PolarHBondContact O-N 3.48Å; V434-A437 PolarHBondContact O-N 2.82Å; A437-F440 PolarHBondContact O-N 3.38Å; A437-L441 WeakPolarHBondContact O-CB 3.46Å; A437-L441 PolarHBondContact O-N 3.39Å
438	I	93.5	Very high	91.3	Very high	1 Å²	1	33.2 Å²	33.2	1%	0.005	17%	0.169	C	C	.	.	H	α-helix	trans	-69.3	-44	177.1	-68.9	168.1	0	0	0	110.6	V434 V436 F440 L441 K442 M479 I480 M483	V434-I438 HydrophobicContact CG1-CD1 3.7Å; V434-I438 HydrophobicContact CG1-CG1 4.31Å; V434-I438 WeakPolarHBondContact O-CB 3.48Å; V434-I438 VanDerWaalsContact O-CG1 3.29Å; V434-I438 WeakPolarHBondContact O-CG1 3.31Å; V434-I438 PolarHBondContact O-N 3.25Å; V436-I438 PolarHBondContact O-N 3.37Å; I438-F440 PolarHBondContact O-N 3.48Å; I438-L441 PolarHBondContact O-N 3.03Å; I438-K442 WeakPolarHBondContact O-CG 3.48Å; I438-K442 PolarHBondContact O-N 3.49Å; I438-M479 HydrophobicContact CB-CE 4.25Å; I438-M479 HydrophobicContact CD1-CB 3.69Å; I438-M479 HydrophobicContact CG2-CE 3.96Å; I438-I480 HydrophobicContact CD1-CG1 3.75Å; I438-M483 HydrophobicContact CG2-CB 4.25Å; I438-M483 HydrophobicContact CG2-CG 4.42Å; I438-M483 HydrophobicContact CG2-SD 4Å
439	S	93.1	Very high	91.6	Very high	37 Å²	37	27.6 Å²	27.6	26%	0.259	15%	0.154	S	C	.	.	H	α-helix	trans	-63	-29.7	176	-168.5	0	0	0	0	112.8	E435 V436 E443	E435-S439 WeakPolarHBondContact O-CB 3.46Å; E435-S439 PolarHBondContact O-N 3.11Å; V436-S439 PolarHBondContact O-N 2.77Å; S439-E443 VanDerWaalsContact O-CG 3.31Å; S439-E443 WeakPolarHBondContact O-CG 3.21Å
440	F	94.9	Very high	92	Very high	0 Å²	0	30 Å²	30	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-75.6	-48.5	174.9	-175.9	-140.7	0	0	0	111.1	S401 V404 A405 I408 C418 M421 L422 V436 A437 I438 K442 E443 C444	S401-F440 WeakPolarHBondContact O-CD2 3.32Å; S401-F440 WeakPolarHBondContact O-CE2 3.33Å; V404-F440 HydrophobicContact CB-CE2 4.03Å; V404-F440 HydrophobicContact CB-CZ 4.36Å; V404-F440 HydrophobicContact CG1-CE2 4.02Å; V404-F440 HydrophobicContact CG1-CZ 3.93Å; A405-F440 HydrophobicContact CB-CD2 3.82Å; A405-F440 HydrophobicContact CB-CE2 3.85Å; I408-F440 HydrophobicContact CD1-CZ 4.33Å; C418-F440 HydrophobicContact CB-CE1 4.43Å; C418-F440 HydrophobicContact CB-CZ 4.21Å; C418-F440 WeakPolarHBondContact SG-CE1 3.46Å; C418-F440 WeakPolarHBondContact SG-CZ 2.98Å; M421-F440 HydrophobicContact CB-CE1 3.75Å; M421-F440 HydrophobicContact CB-CZ 4.34Å; M421-F440 HydrophobicContact CE-CE1 3.94Å; M421-F440 HydrophobicContact CE-CE2 4.23Å; M421-F440 HydrophobicContact CE-CZ 3.73Å; M421-F440 HydrophobicContact SD-CE1 4.48Å; M421-F440 HydrophobicContact SD-CZ 4.16Å; L422-F440 HydrophobicContact CD1-CD1 4.23Å; L422-F440 HydrophobicContact CD1-CE1 4.33Å; L422-F440 HydrophobicContact CD2-CD1 3.67Å; L422-F440 HydrophobicContact CD2-CE1 4.4Å; L422-F440 HydrophobicContact CG-CD1 3.66Å; L422-F440 HydrophobicContact CG-CE1 3.88Å; V436-F440 VanDerWaalsContact O-CB 3.27Å; V436-F440 WeakPolarHBondContact O-CB 3.33Å; V436-F440 PolarHBondContact O-N 3.2Å; A437-F440 PolarHBondContact O-N 3.38Å; I438-F440 PolarHBondContact O-N 3.48Å; F440-K442 VanDerWaalsContact C-N 3.28Å; F440-K442 PolarHBondContact O-N 3.04Å; F440-E443 PolarHBondContact O-N 3.4Å; F440-E443 VanDerWaalsContact O-N 3.15Å; F440-C444 PolarHBondContact O-N 2.96Å; F440-C444 PolarHBondContact O-SG 2.79Å
441	L	94	Very high	92.2	Very high	1 Å²	1	30.4 Å²	30.4	1%	0.005	16%	0.162	C	C	.	.	H	α-helix	trans	-66	-24.6	-178.7	-173.7	61.5	0	0	0	113.7	L422 A437 I438 G445 L448 I456 I459 F460 L463 M483	L422-L441 HydrophobicContact CD1-CD1 4.1Å; L422-L441 HydrophobicContact CD2-CB 4.34Å; A437-L441 WeakPolarHBondContact O-CB 3.46Å; A437-L441 PolarHBondContact O-N 3.39Å; I438-L441 PolarHBondContact O-N 3.03Å; L441-G445 WeakPolarHBondContact O-CA 3.24Å; L441-G445 PolarHBondContact O-N 2.82Å; L441-L448 HydrophobicContact CD1-CD1 4.17Å; L441-I456 HydrophobicContact CD1-CD1 3.71Å; L441-I456 HydrophobicContact CD1-CG1 4.17Å; L441-I459 HydrophobicContact CD2-CG2 4.03Å; L441-F460 HydrophobicContact CD2-CE1 4.39Å; L441-F460 HydrophobicContact CD2-CE2 4Å; L441-F460 HydrophobicContact CD2-CZ 3.89Å; L441-L463 HydrophobicContact CD2-CD1 3.87Å; L441-M483 HydrophobicContact CB-SD 4.24Å; L441-M483 HydrophobicContact CD2-CE 4.45Å; L441-M483 HydrophobicContact CD2-CG 4.06Å; L441-M483 HydrophobicContact CD2-SD 4.24Å; L441-M483 HydrophobicContact CG-CE 4.12Å; L441-M483 HydrophobicContact CG-SD 4.19Å
442	K	93.4	Very high	92.4	Very high	52 Å²	52	27.7 Å²	27.7	23%	0.226	15%	0.149	C	C	.	.	H	α-helix	trans	-62.4	-44.1	170.4	-78.1	-174.8	-179.4	-150.9	0	112.7	I438 F440 M483 I486 H494	I438-K442 WeakPolarHBondContact O-CG 3.48Å; I438-K442 PolarHBondContact O-N 3.49Å; F440-K442 VanDerWaalsContact C-N 3.28Å; F440-K442 PolarHBondContact O-N 3.04Å; K442-M483 HydrophobicContact CG-CE 4.2Å; K442-M483 HydrophobicContact CG-SD 3.72Å; K442-I486 HydrophobicContact CD-CD1 3.93Å; K442-I486 VanDerWaalsContact CE-CD1 3.41Å; K442-I486 HydrophobicContact CG-CD1 3.99Å; K442-H494 VanDerWaalsContact O-CB 3.32Å; K442-H494 WeakPolarHBondContact O-CB 3.45Å
443	E	92.1	Very high	92.5	Very high	35 Å²	35	26.9 Å²	26.9	16%	0.164	15%	0.148	C	C	.	.	H	α-helix	trans	-82.7	-28	-168.7	-52.1	-80.1	-171.6	0	0	112.7	K402 A405 H406 N409 S439 F440	K402-E443 HydrophobicContact CG-CG 4.32Å; K402-E443 IonicContact NZ-OE1 3.53Å; K402-E443 PolarHBondContact NZ-OE1 3.05Å; K402-E443 IonicContact NZ-OE2 2.68Å; K402-E443 PolarHBondContact NZ-OE2 3.34Å; A405-E443 HydrophobicContact CB-CB 3.68Å; H406-E443 IonicContact CE1-OE2 2.58Å; H406-E443 PolarHBondContact CE1-OE2 2.97Å; H406-E443 IonicContact NE2-OE2 3.95Å; N409-E443 PolarHBondContact ND2-O 3.45Å; S439-E443 VanDerWaalsContact O-CG 3.31Å; S439-E443 WeakPolarHBondContact O-CG 3.21Å; F440-E443 PolarHBondContact O-N 3.4Å; F440-E443 VanDerWaalsContact O-N 3.15Å
444	C	93.3	Very high	92.6	Very high	1 Å²	1	37.2 Å²	37.2	1%	0.007	19%	0.186	C	C	.	.	H	α-helix	trans	-117.9	-0.9	-179.3	59.5	0	0	0	0	114.6	A405 N409 C418 F440 L446 K447 L448	A405-C444 HydrophobicContact CB-CB 3.82Å; N409-C444 WeakPolarHBondContact OD1-CA 3.35Å; C418-C444 PolarHBondContact SG-SG 3.08Å; F440-C444 PolarHBondContact O-N 2.96Å; F440-C444 PolarHBondContact O-SG 2.79Å; C444-L446 VanDerWaalsContact C-N 3.27Å; C444-L446 PolarHBondContact O-N 3.06Å; C444-K447 PolarHBondContact O-N 3.45Å; C444-L448 PolarHBondContact O-N 3.28Å
445	G	91.4	Very high	92.6	Very high	0 Å²	0	38 Å²	38	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-66	-25.5	-173.6	0	0	0	0	0	114.6	L441 T449 I456 F491	L441-G445 WeakPolarHBondContact O-CA 3.24Å; L441-G445 PolarHBondContact O-N 2.82Å; G445-T449 WeakPolarHBondContact O-CB 3.35Å; G445-T449 PolarHBondContact O-N 2.91Å; G445-T449 VanDerWaalsContact O-N 3.11Å; G445-T449 PolarHBondContact O-OG1 3.16Å; G445-I456 VanDerWaalsContact O-CD1 3.22Å; G445-I456 WeakPolarHBondContact O-CD1 3.37Å; G445-F491 VanDerWaalsContact C-CZ 3.5Å
446	L	92.9	Very high	92.6	Very high	40 Å²	40	36.9 Å²	36.9	21%	0.209	19%	0.188	C	C	.	.	H	α-helix	trans	-68.1	-54.9	173.1	-175.6	51.6	0	0	0	110.9	C444 L448 T449 E450 F491 V496	C444-L446 VanDerWaalsContact C-N 3.27Å; C444-L446 PolarHBondContact O-N 3.06Å; L446-L448 VanDerWaalsContact C-N 3.31Å; L446-L448 PolarHBondContact O-N 2.88Å; L446-T449 WeakPolarHBondContact O-CA 3.41Å; L446-T449 VanDerWaalsContact O-CB 3.29Å; L446-T449 WeakPolarHBondContact O-CB 3.37Å; L446-T449 PolarHBondContact O-N 2.61Å; L446-E450 PolarHBondContact O-N 3.26Å; L446-E450 VanDerWaalsContact O-N 3.09Å; L446-F491 HydrophobicContact CB-CB 3.85Å; L446-F491 HydrophobicContact CB-CD2 4.29Å; L446-F491 HydrophobicContact CB-CG 4.04Å; L446-F491 HydrophobicContact CD1-CB 4.32Å; L446-F491 HydrophobicContact CD1-CD2 4.4Å; L446-F491 HydrophobicContact CD2-CB 4.26Å; L446-F491 HydrophobicContact CG-CB 4.37Å; L446-V496 HydrophobicContact CB-CG2 4.03Å; L446-V496 HydrophobicContact CD2-CG2 3.77Å; L446-V496 HydrophobicContact CG-CG2 3.67Å
447	K	91.8	Very high	92.6	Very high	26 Å²	26	40.2 Å²	40.2	11%	0.113	21%	0.206	C	C	.	.	H	α-helix	trans	-54.9	-43.6	175.5	-170.7	68.2	167	-152.7	0	112.7	I408 N409 N411 C444 T449 E450 V451 V496	I408-K447 HydrophobicContact CG2-CG 4.37Å; N409-K447 PolarHBondContact O-NZ 3.13Å; N411-K447 PolarHBondContact ND2-NZ 2.93Å; N411-K447 WeakPolarHBondContact OD1-CE 3.21Å; N411-K447 PolarHBondContact OD1-NZ 3.43Å; C444-K447 PolarHBondContact O-N 3.45Å; K447-T449 VanDerWaalsContact C-N 3.26Å; K447-T449 PolarHBondContact O-N 3.34Å; K447-E450 PolarHBondContact O-N 2.9Å; K447-V451 HydrophobicContact CD-CG2 4.31Å; K447-V451 PolarHBondContact O-N 3.12Å; K447-V496 HydrophobicContact CB-CG1 4.21Å; K447-V496 HydrophobicContact CB-CG2 4.36Å; K447-V496 HydrophobicContact CD-CG1 3.85Å; K447-V496 HydrophobicContact CG-CG1 4.44Å
448	L	92	Very high	92.6	Very high	1 Å²	1	42.8 Å²	42.8	1%	0.005	23%	0.228	C	C	.	.	H	α-helix	trans	-65	-25.7	174.2	-76.5	-176.2	0	0	0	113.9	E415 C418 L419 L422 L441 C444 L446 S452 I456	E415-L448 HydrophobicContact CB-CD2 4.04Å; C418-L448 HydrophobicContact CB-CD2 4.15Å; L419-L448 HydrophobicContact CD2-CD2 4.16Å; L422-L448 HydrophobicContact CD1-CD1 4.06Å; L441-L448 HydrophobicContact CD1-CD1 4.17Å; C444-L448 PolarHBondContact O-N 3.28Å; L446-L448 VanDerWaalsContact C-N 3.31Å; L446-L448 PolarHBondContact O-N 2.88Å; L448-S452 CarbonylContact O-C 3.59Å; L448-S452 VanDerWaalsContact O-CA 3.32Å; L448-S452 WeakPolarHBondContact O-CA 3.39Å; L448-S452 PolarHBondContact O-N 2.9Å; L448-S452 VanDerWaalsContact O-N 3.14Å; L448-I456 HydrophobicContact CB-CB 4.18Å; L448-I456 HydrophobicContact CB-CD1 3.67Å; L448-I456 HydrophobicContact CD1-CD1 4.24Å
449	T	92.8	Very high	92.6	Very high	55 Å²	55	43 Å²	43	34%	0.337	23%	0.228	S	C	.	.	H	α-helix	trans	-77.1	-35.4	175.7	-60.9	0	0	0	0	111.3	G445 L446 K447	G445-T449 WeakPolarHBondContact O-CB 3.35Å; G445-T449 PolarHBondContact O-N 2.91Å; G445-T449 VanDerWaalsContact O-N 3.11Å; G445-T449 PolarHBondContact O-OG1 3.16Å; L446-T449 WeakPolarHBondContact O-CA 3.41Å; L446-T449 VanDerWaalsContact O-CB 3.29Å; L446-T449 WeakPolarHBondContact O-CB 3.37Å; L446-T449 PolarHBondContact O-N 2.61Å; K447-T449 VanDerWaalsContact C-N 3.26Å; K447-T449 PolarHBondContact O-N 3.34Å
450	E	90.4	Very high	92.6	Very high	110 Å²	110	41.2 Å²	41.2	51%	0.514	22%	0.216	S	C	.	.	H	α-helix	trans	-70.4	-56.8	177.9	-67.1	158.1	176.4	0	0	111.6	L446 K447	L446-E450 PolarHBondContact O-N 3.26Å; L446-E450 VanDerWaalsContact O-N 3.09Å; K447-E450 PolarHBondContact O-N 2.9Å
451	V	91.1	Very high	92.5	Very high	87 Å²	87	45.4 Å²	45.4	53%	0.527	24%	0.236	S	C	.	.	H	α-helix	trans	-89.4	-37.2	-170.9	-165.6	0	0	0	0	112.2	E415 K447 P453	E415-V451 WeakPolarHBondContact OE2-CB 3.24Å; E415-V451 WeakPolarHBondContact OE2-CG1 3.47Å; K447-V451 HydrophobicContact CD-CG2 4.31Å; K447-V451 PolarHBondContact O-N 3.12Å; V451-P453 WeakPolarHBondContact O-CD 3.27Å
452	S	92.3	Very high	92.3	Very high	17 Å²	17	50.6 Å²	50.6	12%	0.119	26%	0.255	C	S	.	.			trans	-123.6	49.2	-173.1	-136.8	0	0	0	0	115.3	E415 L448 R454 G455 I456	E415-S452 WeakPolarHBondContact OE1-CB 3.42Å; E415-S452 PolarHBondContact OE1-OG 3.28Å; L448-S452 CarbonylContact O-C 3.59Å; L448-S452 VanDerWaalsContact O-CA 3.32Å; L448-S452 WeakPolarHBondContact O-CA 3.39Å; L448-S452 PolarHBondContact O-N 2.9Å; L448-S452 VanDerWaalsContact O-N 3.14Å; S452-R454 PolarHBondContact O-N 2.94Å; S452-G455 PolarHBondContact O-N 2.88Å; S452-I456 PolarHBondContact O-N 3.43Å
453	P	91.9	Very high	92.2	Very high	62 Å²	62	48.2 Å²	48.2	40%	0.403	25%	0.245	S	C	.	.	H	α-helix	trans	-56.4	-25.6	-173.8	21	-32.9	0	0	0	113.7	V451 N457	V451-P453 WeakPolarHBondContact O-CD 3.27Å; P453-N457 WeakPolarHBondContact O-CB 3.48Å; P453-N457 VanDerWaalsContact O-CG 3.32Å; P453-N457 PolarHBondContact O-N 2.95Å; P453-N457 PolarHBondContact O-ND2 2.88Å
454	R	92.8	Very high	92.1	Very high	226 Å²	226	51 Å²	51	85%	0.853	25%	0.254	S	S	*	.	H	α-helix	trans	-74.7	-38.6	174.7	-64.9	-176.9	67.2	-169.2	-1.3	113	S452 A458	S452-R454 PolarHBondContact O-N 2.94Å; R454-A458 PolarHBondContact O-N 3Å
455	G	91.2	Very high	92	Very high	16 Å²	16	53.9 Å²	53.9	17%	0.165	27%	0.269	C	S	.	.	H	α-helix	trans	-67.1	-51.7	179	0	0	0	0	0	111.8	S452 N457 A458 I459	S452-G455 PolarHBondContact O-N 2.88Å; G455-N457 VanDerWaalsContact C-N 3.31Å; G455-N457 PolarHBondContact O-N 3.27Å; G455-A458 WeakPolarHBondContact O-CB 3.37Å; G455-A458 PolarHBondContact O-N 3.14Å; G455-A458 VanDerWaalsContact O-N 3.11Å; G455-I459 PolarHBondContact O-N 3.37Å; G455-I459 VanDerWaalsContact O-N 3.14Å
456	I	92.3	Very high	91.8	Very high	2 Å²	2	54.5 Å²	54.5	1%	0.01	27%	0.272	C	S	.	.	H	α-helix	trans	-63.6	-34.3	178.9	-170.9	152.2	0	0	0	112.8	L441 G445 L448 S452 A458 I459 F460	L441-I456 HydrophobicContact CD1-CD1 3.71Å; L441-I456 HydrophobicContact CD1-CG1 4.17Å; G445-I456 VanDerWaalsContact O-CD1 3.22Å; G445-I456 WeakPolarHBondContact O-CD1 3.37Å; L448-I456 HydrophobicContact CB-CB 4.18Å; L448-I456 HydrophobicContact CB-CD1 3.67Å; L448-I456 HydrophobicContact CD1-CD1 4.24Å; S452-I456 PolarHBondContact O-N 3.43Å; I456-A458 PolarHBondContact O-N 2.98Å; I456-I459 PolarHBondContact O-N 3.08Å; I456-F460 HydrophobicContact CD1-CE2 4.02Å; I456-F460 HydrophobicContact CG1-CD2 3.69Å; I456-F460 HydrophobicContact CG1-CE2 3.66Å; I456-F460 WeakPolarHBondContact O-CD2 3.06Å; I456-F460 PolarHBondContact O-N 3.23Å
457	N	93.3	Very high	91.5	Very high	74 Å²	74	54.7 Å²	54.7	40%	0.396	27%	0.273	S	S	.	.	H	α-helix	trans	-62.5	-40.5	173	-86.6	-47.8	0	0	0	112.6	P453 G455 I459 F460 E461 R487	P453-N457 WeakPolarHBondContact O-CB 3.48Å; P453-N457 VanDerWaalsContact O-CG 3.32Å; P453-N457 PolarHBondContact O-N 2.95Å; P453-N457 PolarHBondContact O-ND2 2.88Å; G455-N457 VanDerWaalsContact C-N 3.31Å; G455-N457 PolarHBondContact O-N 3.27Å; N457-I459 VanDerWaalsContact C-N 3.32Å; N457-I459 PolarHBondContact O-N 3.4Å; N457-F460 PolarHBondContact O-N 3.41Å; N457-E461 PolarHBondContact O-N 3.5Å; N457-R487 PolarHBondContact OD1-NH1 2.87Å; N457-R487 VanDerWaalsContact OD1-NH1 3.13Å; N457-R487 PolarHBondContact OD1-NH2 3.43Å
458	A	93.8	Very high	91.1	Very high	56 Å²	56	60.3 Å²	60.3	46%	0.463	30%	0.3	S	S	.	.	H	α-helix	trans	-65.5	-34.5	175.4	0	0	0	0	0	112.6	R454 G455 I456 E461 R462	R454-A458 PolarHBondContact O-N 3Å; G455-A458 WeakPolarHBondContact O-CB 3.37Å; G455-A458 PolarHBondContact O-N 3.14Å; G455-A458 VanDerWaalsContact O-N 3.11Å; I456-A458 PolarHBondContact O-N 2.98Å; A458-E461 PolarHBondContact O-N 3.07Å; A458-R462 PolarHBondContact O-N 3.44Å; A458-R462 VanDerWaalsContact O-N 3.09Å
459	I	93.9	Very high	90.2	Very high	4 Å²	4	67.2 Å²	67.2	2%	0.021	33%	0.332	C	S	.	.	H	α-helix	trans	-66.4	-46	174.1	-70.2	153	0	0	0	111.1	L419 L422 L426 L441 G455 I456 N457 E461 R462 L463	L419-I459 HydrophobicContact CD2-CD1 3.49Å; L419-I459 VanDerWaalsContact CD2-CD1 3.49Å; L422-I459 HydrophobicContact CB-CD1 3.93Å; L422-I459 HydrophobicContact CB-CG1 4.18Å; L422-I459 HydrophobicContact CD1-CD1 3.68Å; L422-I459 HydrophobicContact CG-CD1 4.43Å; L426-I459 HydrophobicContact CD1-CG2 4Å; L441-I459 HydrophobicContact CD2-CG2 4.03Å; G455-I459 PolarHBondContact O-N 3.37Å; G455-I459 VanDerWaalsContact O-N 3.14Å; I456-I459 PolarHBondContact O-N 3.08Å; N457-I459 VanDerWaalsContact C-N 3.32Å; N457-I459 PolarHBondContact O-N 3.4Å; I459-E461 VanDerWaalsContact C-N 3.29Å; I459-E461 PolarHBondContact O-N 2.93Å; I459-R462 WeakPolarHBondContact O-CB 3.36Å; I459-R462 PolarHBondContact O-N 3.01Å; I459-L463 HydrophobicContact CG2-CD1 4.41Å; I459-L463 WeakPolarHBondContact O-CG 3.07Å; I459-L463 PolarHBondContact O-N 2.99Å
460	F	93.3	Very high	89.1	Confident	1 Å²	1	67 Å²	67	0%	0.004	33%	0.333	C	S	.	.	H	α-helix	trans	-65.5	-30	175.9	-87.1	-75.2	0	0	0	113.3	L441 I456 N457 L463 R464 M483 F484 R487	L441-F460 HydrophobicContact CD2-CE1 4.39Å; L441-F460 HydrophobicContact CD2-CE2 4Å; L441-F460 HydrophobicContact CD2-CZ 3.89Å; I456-F460 HydrophobicContact CD1-CE2 4.02Å; I456-F460 HydrophobicContact CG1-CD2 3.69Å; I456-F460 HydrophobicContact CG1-CE2 3.66Å; I456-F460 WeakPolarHBondContact O-CD2 3.06Å; I456-F460 PolarHBondContact O-N 3.23Å; N457-F460 PolarHBondContact O-N 3.41Å; F460-L463 HydrophobicContact CD1-CD1 4.24Å; F460-L463 HydrophobicContact CE1-CD1 4.47Å; F460-L463 PolarHBondContact O-N 2.99Å; F460-R464 PolarHBondContact O-N 3.29Å; F460-M483 HydrophobicContact CE1-CG 3.88Å; F460-M483 HydrophobicContact CZ-CE 4.11Å; F460-M483 HydrophobicContact CZ-CG 4.07Å; F460-F484 HydrophobicContact CB-CE1 4.33Å; F460-F484 AromaticContact CD1-CD1 3.91Å; F460-F484 HydrophobicContact CD1-CD1 3.91Å; F460-F484 AromaticContact CD1-CE1 3.51Å; F460-F484 HydrophobicContact CD1-CE1 3.51Å; F460-F484 AromaticContact CD1-CZ 3.9Å; F460-F484 HydrophobicContact CD1-CZ 3.9Å; F460-F484 HydrophobicContact CE1-CD1 4.2Å; F460-F484 HydrophobicContact CE1-CE1 4.26Å; F460-F484 HydrophobicContact CG-CE1 4.32Å; F460-R487 VanDerWaalsContact CD2-NH1 3.31Å; F460-R487 HydrophobicContact CE1-CB 4.1Å; F460-R487 HydrophobicContact CE1-CG 4.41Å; F460-R487 HydrophobicContact CE2-CB 4.41Å; F460-R487 HydrophobicContact CE2-CG 4.06Å; F460-R487 HydrophobicContact CZ-CB 3.74Å; F460-R487 HydrophobicContact CZ-CG 3.89Å
461	E	92.6	Very high	88.2	Confident	87 Å²	87	68 Å²	68	41%	0.407	35%	0.352	S	S	.	.	H	α-helix	trans	-68	-43	172	-154.8	62.8	-131	0	0	111.2	N457 A458 I459 L463 R464 N465	N457-E461 PolarHBondContact O-N 3.5Å; A458-E461 PolarHBondContact O-N 3.07Å; I459-E461 VanDerWaalsContact C-N 3.29Å; I459-E461 PolarHBondContact O-N 2.93Å; E461-L463 VanDerWaalsContact C-N 3.33Å; E461-L463 PolarHBondContact O-N 3.27Å; E461-R464 WeakPolarHBondContact O-CB 3.06Å; E461-R464 PolarHBondContact O-N 3.48Å; E461-R464 VanDerWaalsContact O-N 3.12Å; E461-R464 IonicContact OE1-CZ 3.6Å; E461-R464 IonicContact OE1-NE 2.71Å; E461-R464 IonicContact OE1-NH1 2.94Å; E461-R464 PolarHBondContact OE1-NH1 3.21Å; E461-R464 IonicContact OE2-CZ 3.24Å; E461-R464 IonicContact OE2-NH1 3.86Å; E461-R464 PolarHBondContact OE2-NH1 3.18Å; E461-R464 IonicContact OE2-NH2 2.93Å; E461-N465 PolarHBondContact O-N 3.13Å; E461-N465 PolarHBondContact O-OD1 2.89Å
462	R	90.3	Very high	87.5	Confident	110 Å²	110	65.8 Å²	65.8	42%	0.415	34%	0.337	S	S	.	.	H	α-helix	trans	-58.3	-42.8	171.5	-70.8	-174.5	-176.6	-156.8	4.1	112.1	T423 A458 I459 R464 N465 I466	T423-R462 PolarHBondContact O-NH1 3.28Å; A458-R462 PolarHBondContact O-N 3.44Å; A458-R462 VanDerWaalsContact O-N 3.09Å; I459-R462 WeakPolarHBondContact O-CB 3.36Å; I459-R462 PolarHBondContact O-N 3.01Å; R462-R464 VanDerWaalsContact C-N 3.32Å; R462-R464 PolarHBondContact O-N 2.87Å; R462-N465 PolarHBondContact O-N 3.41Å; R462-I466 WeakPolarHBondContact O-CB 3.17Å; R462-I466 WeakPolarHBondContact O-CD1 3.48Å; R462-I466 VanDerWaalsContact O-CG1 3.25Å; R462-I466 WeakPolarHBondContact O-CG1 3.37Å; R462-I466 PolarHBondContact O-N 3.15Å
463	L	91	Very high	87.2	Confident	2 Å²	2	69 Å²	69	1%	0.01	35%	0.353	C	S	.	.	H	α-helix	trans	-63.4	-34.5	175.8	-69.8	173.3	0	0	0	112.7	L426 L441 I459 F460 E461 L467 I480	L426-L463 HydrophobicContact CD1-CD2 3.97Å; L426-L463 HydrophobicContact CD1-CG 4.13Å; L426-L463 HydrophobicContact CD2-CD2 3.78Å; L441-L463 HydrophobicContact CD2-CD1 3.87Å; I459-L463 HydrophobicContact CG2-CD1 4.41Å; I459-L463 WeakPolarHBondContact O-CG 3.07Å; I459-L463 PolarHBondContact O-N 2.99Å; F460-L463 HydrophobicContact CD1-CD1 4.24Å; F460-L463 HydrophobicContact CE1-CD1 4.47Å; F460-L463 PolarHBondContact O-N 2.99Å; E461-L463 VanDerWaalsContact C-N 3.33Å; E461-L463 PolarHBondContact O-N 3.27Å; L463-L467 WeakPolarHBondContact O-CB 3.38Å; L463-L467 PolarHBondContact O-N 3Å; L463-L467 VanDerWaalsContact O-N 3.08Å; L463-I480 HydrophobicContact CB-CG2 4.42Å; L463-I480 HydrophobicContact CD2-CG1 4.47Å
464	R	90.8	Very high	87	Confident	93 Å²	93	73 Å²	73	35%	0.351	36%	0.363	S	S	.	.	H	α-helix	trans	-69.8	-42.8	173.5	-172.7	-175.2	-61.6	136.8	8.1	112.2	F460 E461 R462 L467 H468 F484	F460-R464 PolarHBondContact O-N 3.29Å; E461-R464 WeakPolarHBondContact O-CB 3.06Å; E461-R464 PolarHBondContact O-N 3.48Å; E461-R464 VanDerWaalsContact O-N 3.12Å; E461-R464 IonicContact OE1-CZ 3.6Å; E461-R464 IonicContact OE1-NE 2.71Å; E461-R464 IonicContact OE1-NH1 2.94Å; E461-R464 PolarHBondContact OE1-NH1 3.21Å; E461-R464 IonicContact OE2-CZ 3.24Å; E461-R464 IonicContact OE2-NH1 3.86Å; E461-R464 PolarHBondContact OE2-NH1 3.18Å; E461-R464 IonicContact OE2-NH2 2.93Å; R462-R464 VanDerWaalsContact C-N 3.32Å; R462-R464 PolarHBondContact O-N 2.87Å; R464-L467 WeakPolarHBondContact O-CB 3.31Å; R464-L467 PolarHBondContact O-N 3.16Å; R464-H468 PolarHBondContact O-N 2.87Å; R464-F484 HydrophobicContact CB-CZ 4.2Å
465	N	89.6	Confident	86.8	Confident	62 Å²	62	68.6 Å²	68.6	33%	0.332	35%	0.347	S	S	.	.	H	α-helix	trans	-61	-46.5	175.5	-79.3	39.1	0	0	0	110.6	E461 R462 L467 H468 E469	E461-N465 PolarHBondContact O-N 3.13Å; E461-N465 PolarHBondContact O-OD1 2.89Å; R462-N465 PolarHBondContact O-N 3.41Å; N465-L467 VanDerWaalsContact C-N 3.31Å; N465-L467 PolarHBondContact O-N 3.05Å; N465-H468 PolarHBondContact O-N 3.14Å; N465-E469 PolarHBondContact ND2-OE1 2.63Å; N465-E469 VanDerWaalsContact ND2-OE1 3.17Å; N465-E469 VanDerWaalsContact O-CB 3.22Å; N465-E469 WeakPolarHBondContact O-CB 3.43Å; N465-E469 WeakPolarHBondContact O-CG 3.4Å; N465-E469 PolarHBondContact O-N 3.39Å
466	I	87.2	Confident	86.7	Confident	13 Å²	13	67.9 Å²	67.9	7%	0.067	34%	0.339	C	S	.	.	H	α-helix	trans	-52.6	-48.5	172.9	-72.1	162.8	0	0	0	111	L426 P429 R462 H468 S470 I472 I480	L426-I466 HydrophobicContact CB-CD1 4.41Å; L426-I466 HydrophobicContact CD2-CD1 3.94Å; P429-I466 HydrophobicContact CB-CD1 3.88Å; P429-I466 HydrophobicContact CB-CG1 4.02Å; P429-I466 HydrophobicContact CB-CG2 4.33Å; P429-I466 HydrophobicContact CG-CD1 4.35Å; P429-I466 HydrophobicContact CG-CG1 4.1Å; R462-I466 WeakPolarHBondContact O-CB 3.17Å; R462-I466 WeakPolarHBondContact O-CD1 3.48Å; R462-I466 VanDerWaalsContact O-CG1 3.25Å; R462-I466 WeakPolarHBondContact O-CG1 3.37Å; R462-I466 PolarHBondContact O-N 3.15Å; I466-H468 PolarHBondContact O-N 2.92Å; I466-S470 PolarHBondContact O-N 3.42Å; I466-S470 PolarHBondContact O-OG 3.24Å; I466-S470 VanDerWaalsContact O-OG 3.06Å; I466-I472 HydrophobicContact CG2-CD1 3.63Å; I466-I472 HydrophobicContact CG2-CG1 4.41Å; I466-I480 HydrophobicContact CG2-CD1 3.88Å
467	L	86.8	Confident	86.6	Confident	44 Å²	44	71.6 Å²	71.6	23%	0.23	36%	0.357	C	S	.	.	H	α-helix	trans	-60.4	-24.6	178.8	-173.4	65.2	0	0	0	114.6	L463 R464 N465 Q477 I480	L463-L467 WeakPolarHBondContact O-CB 3.38Å; L463-L467 PolarHBondContact O-N 3Å; L463-L467 VanDerWaalsContact O-N 3.08Å; R464-L467 WeakPolarHBondContact O-CB 3.31Å; R464-L467 PolarHBondContact O-N 3.16Å; N465-L467 VanDerWaalsContact C-N 3.31Å; N465-L467 PolarHBondContact O-N 3.05Å; L467-Q477 HydrophobicContact CD1-CB 4.31Å; L467-Q477 HydrophobicContact CD1-CG 3.86Å; L467-I480 HydrophobicContact CB-CG2 4.37Å; L467-I480 HydrophobicContact CD1-CG2 4.44Å; L467-I480 HydrophobicContact CD2-CG2 4.24Å
468	H	84.1	Confident	86.5	Confident	144 Å²	144	75.1 Å²	75.1	67%	0.667	37%	0.366	S	S	*	.	H	α-helix	trans	-108.3	-28.5	-176.1	-65.2	167	0	0	0	114.6	R464 N465 I466	R464-H468 PolarHBondContact O-N 2.87Å; N465-H468 PolarHBondContact O-N 3.14Å; I466-H468 PolarHBondContact O-N 2.92Å
469	E	73.6	Confident	86.3	Confident	147 Å²	147	74.7 Å²	74.7	69%	0.687	35%	0.354	S	S	*	.	H	α-helix	trans	-103.4	-23.3	-167.1	-63.2	175.2	170.6	0	0	113.4	N465	N465-E469 PolarHBondContact ND2-OE1 2.63Å; N465-E469 VanDerWaalsContact ND2-OE1 3.17Å; N465-E469 VanDerWaalsContact O-CB 3.22Å; N465-E469 WeakPolarHBondContact O-CB 3.43Å; N465-E469 WeakPolarHBondContact O-CG 3.4Å; N465-E469 PolarHBondContact O-N 3.39Å
470	S	67.9	Low	86.2	Confident	51 Å²	51	74.5 Å²	74.5	36%	0.357	35%	0.353	S	S	.	.	S	Bend	trans	-115.8	148.8	-177	68.5	0	0	0	0	113.6	I466 I472	I466-S470 PolarHBondContact O-N 3.42Å; I466-S470 PolarHBondContact O-OG 3.24Å; I466-S470 VanDerWaalsContact O-OG 3.06Å; S470-I472 VanDerWaalsContact C-N 3.26Å; S470-I472 WeakPolarHBondContact O-CG1 3.42Å; S470-I472 PolarHBondContact O-N 3.14Å
471	S	71.8	Confident	86.1	Confident	129 Å²	129	78.1 Å²	78.1	90%	0.902	37%	0.37	S	S	*	.			trans	-82	68.5	177.6	60.1	0	0	0	0	110.9
472	I	77.8	Confident	86.2	Confident	42 Å²	42	77.3 Å²	77.3	22%	0.215	37%	0.371	C	S	.	.			trans	-71.3	158.8	179.7	-9.4	172.6	0	0	0	112.2	I466 S470 V476 I480	I466-I472 HydrophobicContact CG2-CD1 3.63Å; I466-I472 HydrophobicContact CG2-CG1 4.41Å; S470-I472 VanDerWaalsContact C-N 3.26Å; S470-I472 WeakPolarHBondContact O-CG1 3.42Å; S470-I472 PolarHBondContact O-N 3.14Å; I472-V476 HydrophobicContact CG2-CB 3.67Å; I472-V476 HydrophobicContact CG2-CG1 3.75Å; I472-V476 HydrophobicContact CG2-CG2 4.21Å; I472-I480 HydrophobicContact CD1-CD1 3.88Å
473	D	85.4	Confident	86.3	Confident	84 Å²	84	72.1 Å²	72.1	45%	0.449	35%	0.352	S	S	.	.			trans	-67.8	149.9	163.5	-179	50.1	0	0	0	112.1	R475 V476 Q477	D473-R475 PolarHBondContact O-N 2.97Å; D473-R475 WeakPolarHBondContact OD2-CB 3.37Å; D473-R475 PolarHBondContact OD2-N 2.94Å; D473-V476 PolarHBondContact O-N 3.29Å; D473-Q477 PolarHBondContact O-N 2.97Å; D473-Q477 VanDerWaalsContact O-N 3.14Å
474	K	88	Confident	86.4	Confident	145 Å²	145	74.6 Å²	74.6	63%	0.63	36%	0.362	S	S	*	.	H	α-helix	trans	-58.8	-32.2	-179.8	-62.5	-180	-178.4	179.7	0	112.8	V476 Q477 Y478	K474-V476 VanDerWaalsContact C-N 3.29Å; K474-V476 PolarHBondContact O-N 3.23Å; K474-Q477 PolarHBondContact O-N 3.16Å; K474-Y478 HydrophobicContact CB-CE2 4.38Å; K474-Y478 WeakPolarHBondContact O-CD2 3.37Å; K474-Y478 PolarHBondContact O-N 3.15Å
475	R	88.9	Confident	86.5	Confident	135 Å²	135	72.2 Å²	72.2	51%	0.509	36%	0.362	S	S	.	.	H	α-helix	trans	-53.3	-49.8	172.6	176.6	-168.9	176.1	112.9	-1.9	110.6	E435 D473 Y478 M479	E435-R475 IonicContact OE1-NH2 2.65Å; E435-R475 PolarHBondContact OE1-NH2 2.79Å; E435-R475 IonicContact OE2-CZ 3.06Å; E435-R475 VanDerWaalsContact OE2-CZ 3.23Å; E435-R475 IonicContact OE2-NE 3.07Å; E435-R475 PolarHBondContact OE2-NE 3.4Å; E435-R475 IonicContact OE2-NH2 3.89Å; E435-R475 PolarHBondContact OE2-NH2 2.95Å; D473-R475 PolarHBondContact O-N 2.97Å; D473-R475 WeakPolarHBondContact OD2-CB 3.37Å; D473-R475 PolarHBondContact OD2-N 2.94Å; R475-Y478 PolarHBondContact O-N 3.04Å; R475-M479 WeakPolarHBondContact O-CG 3.36Å; R475-M479 PolarHBondContact O-N 3.23Å
476	V	88.9	Confident	86.7	Confident	1 Å²	1	70.3 Å²	70.3	1%	0.006	35%	0.352	C	S	.	.	H	α-helix	trans	-74.6	-38.2	-173.4	-174.2	0	0	0	0	110.7	D431 V434 I472 D473 K474 Y478 M479 I480	D431-V476 HydrophobicContact CB-CG2 3.66Å; D431-V476 WeakPolarHBondContact OD1-CG2 3.22Å; V434-V476 HydrophobicContact CB-CG1 3.77Å; V434-V476 HydrophobicContact CG1-CG1 3.42Å; V434-V476 VanDerWaalsContact CG1-CG1 3.42Å; V434-V476 HydrophobicContact CG2-CG1 4.47Å; I472-V476 HydrophobicContact CG2-CB 3.67Å; I472-V476 HydrophobicContact CG2-CG1 3.75Å; I472-V476 HydrophobicContact CG2-CG2 4.21Å; D473-V476 PolarHBondContact O-N 3.29Å; K474-V476 VanDerWaalsContact C-N 3.29Å; K474-V476 PolarHBondContact O-N 3.23Å; V476-Y478 PolarHBondContact O-N 2.96Å; V476-M479 PolarHBondContact O-N 3.05Å; V476-M479 VanDerWaalsContact O-N 3.16Å; V476-I480 HydrophobicContact CG1-CD1 4.28Å; V476-I480 WeakPolarHBondContact O-CG1 3.45Å; V476-I480 PolarHBondContact O-N 3.4Å
477	Q	88.6	Confident	86.9	Confident	79 Å²	79	73.5 Å²	73.5	37%	0.369	36%	0.363	S	S	.	.	H	α-helix	trans	-51.8	-54.3	168	167.6	169.5	7.4	0	0	111.2	L467 D473 K474 M479 I480 E481	L467-Q477 HydrophobicContact CD1-CB 4.31Å; L467-Q477 HydrophobicContact CD1-CG 3.86Å; D473-Q477 PolarHBondContact O-N 2.97Å; D473-Q477 VanDerWaalsContact O-N 3.14Å; K474-Q477 PolarHBondContact O-N 3.16Å; Q477-M479 VanDerWaalsContact C-N 3.27Å; Q477-M479 PolarHBondContact O-N 2.98Å; Q477-I480 PolarHBondContact O-N 3.07Å; Q477-I480 VanDerWaalsContact O-N 3.11Å; Q477-E481 HydrophobicContact CG-CG 4.47Å; Q477-E481 VanDerWaalsContact CG-OE1 3.22Å; Q477-E481 WeakPolarHBondContact CG-OE1 3.32Å; Q477-E481 PolarHBondContact NE2-OE1 3.13Å; Q477-E481 WeakPolarHBondContact O-CG 3.34Å; Q477-E481 PolarHBondContact O-N 3.39Å
478	Y	91.8	Very high	87.1	Confident	149 Å²	149	80 Å²	80	58%	0.584	39%	0.39	S	S	*	.	H	α-helix	trans	-61.3	-34.8	178.5	-71.3	-52.8	0	0	0	112.7	K474 R475 V476 E481 V482	K474-Y478 HydrophobicContact CB-CE2 4.38Å; K474-Y478 WeakPolarHBondContact O-CD2 3.37Å; K474-Y478 PolarHBondContact O-N 3.15Å; R475-Y478 PolarHBondContact O-N 3.04Å; V476-Y478 PolarHBondContact O-N 2.96Å; Y478-E481 WeakPolarHBondContact CD1-OE2 3.29Å; Y478-E481 PolarHBondContact O-N 3.01Å; Y478-V482 WeakPolarHBondContact O-CB 3.41Å; Y478-V482 VanDerWaalsContact O-CG2 3.28Å; Y478-V482 WeakPolarHBondContact O-CG2 3.24Å; Y478-V482 PolarHBondContact O-N 3.46Å
479	M	90.2	Very high	87.5	Confident	46 Å²	46	77.1 Å²	77.1	23%	0.227	38%	0.379	C	S	.	.	H	α-helix	trans	-65.5	-39.4	174.5	-70.7	-169.3	67.7	0	0	112.6	E435 I438 R475 V476 Q477 M483	E435-M479 HydrophobicContact CB-CE 4.29Å; E435-M479 HydrophobicContact CB-SD 4.22Å; E435-M479 HydrophobicContact CG-CE 3.91Å; E435-M479 HydrophobicContact CG-SD 4.06Å; I438-M479 HydrophobicContact CB-CE 4.25Å; I438-M479 HydrophobicContact CD1-CB 3.69Å; I438-M479 HydrophobicContact CG2-CE 3.96Å; R475-M479 WeakPolarHBondContact O-CG 3.36Å; R475-M479 PolarHBondContact O-N 3.23Å; V476-M479 PolarHBondContact O-N 3.05Å; V476-M479 VanDerWaalsContact O-N 3.16Å; Q477-M479 VanDerWaalsContact C-N 3.27Å; Q477-M479 PolarHBondContact O-N 2.98Å; M479-M483 PolarHBondContact O-N 2.93Å
480	I	91.5	Very high	88.3	Confident	0 Å²	0	72 Å²	72	0%	0	37%	0.367	C	S	.	.	H	α-helix	trans	-66.8	-44.1	175.4	-66.1	168.4	0	0	0	110.2	V434 I438 L463 I466 L467 I472 V476 Q477 V482 M483 F484	V434-I480 HydrophobicContact CG1-CD1 4.26Å; V434-I480 HydrophobicContact CG1-CG1 4.26Å; I438-I480 HydrophobicContact CD1-CG1 3.75Å; L463-I480 HydrophobicContact CB-CG2 4.42Å; L463-I480 HydrophobicContact CD2-CG1 4.47Å; I466-I480 HydrophobicContact CG2-CD1 3.88Å; L467-I480 HydrophobicContact CB-CG2 4.37Å; L467-I480 HydrophobicContact CD1-CG2 4.44Å; L467-I480 HydrophobicContact CD2-CG2 4.24Å; I472-I480 HydrophobicContact CD1-CD1 3.88Å; V476-I480 HydrophobicContact CG1-CD1 4.28Å; V476-I480 WeakPolarHBondContact O-CG1 3.45Å; V476-I480 PolarHBondContact O-N 3.4Å; Q477-I480 PolarHBondContact O-N 3.07Å; Q477-I480 VanDerWaalsContact O-N 3.11Å; I480-V482 PolarHBondContact O-N 3.42Å; I480-M483 WeakPolarHBondContact O-CB 3.49Å; I480-M483 PolarHBondContact O-N 3.42Å; I480-M483 VanDerWaalsContact O-N 3.1Å; I480-F484 HydrophobicContact CG2-CD2 3.85Å; I480-F484 HydrophobicContact CG2-CE2 3.67Å; I480-F484 WeakPolarHBondContact O-CD2 3.44Å; I480-F484 PolarHBondContact O-N 3.35Å
481	E	91.9	Very high	89.4	Confident	78 Å²	78	69.9 Å²	69.9	36%	0.364	35%	0.351	S	S	.	.	H	α-helix	trans	-59.1	-44.5	176	-70.9	171.9	-172.9	0	0	111.6	Q477 Y478 M483 F484 A485	Q477-E481 HydrophobicContact CG-CG 4.47Å; Q477-E481 VanDerWaalsContact CG-OE1 3.22Å; Q477-E481 WeakPolarHBondContact CG-OE1 3.32Å; Q477-E481 PolarHBondContact NE2-OE1 3.13Å; Q477-E481 WeakPolarHBondContact O-CG 3.34Å; Q477-E481 PolarHBondContact O-N 3.39Å; Y478-E481 WeakPolarHBondContact CD1-OE2 3.29Å; Y478-E481 PolarHBondContact O-N 3.01Å; E481-M483 VanDerWaalsContact C-N 3.33Å; E481-M483 PolarHBondContact O-N 3.11Å; E481-F484 PolarHBondContact O-N 3.34Å; E481-A485 PolarHBondContact O-N 2.81Å
482	V	93.6	Very high	90.1	Very high	70 Å²	70	71.5 Å²	71.5	42%	0.424	34%	0.342	S	S	.	.	H	α-helix	trans	-62.9	-36.5	173.3	166.9	0	0	0	0	112.1	Y478 I480 F484 A485 I486	Y478-V482 WeakPolarHBondContact O-CB 3.41Å; Y478-V482 VanDerWaalsContact O-CG2 3.28Å; Y478-V482 WeakPolarHBondContact O-CG2 3.24Å; Y478-V482 PolarHBondContact O-N 3.46Å; I480-V482 PolarHBondContact O-N 3.42Å; V482-F484 VanDerWaalsContact C-N 3.35Å; V482-A485 WeakPolarHBondContact O-CB 3.44Å; V482-A485 PolarHBondContact O-N 2.83Å; V482-I486 HydrophobicContact CG1-CD1 3.89Å; V482-I486 HydrophobicContact CG1-CG1 4.47Å; V482-I486 WeakPolarHBondContact O-CG1 3.16Å; V482-I486 PolarHBondContact O-N 2.99Å
483	M	93.6	Very high	90.4	Very high	0 Å²	0	76.3 Å²	76.3	0%	0	37%	0.368	C	S	.	.	H	α-helix	trans	-66.2	-36.5	175.8	-165.1	66.9	-116	0	0	112.1	I438 L441 K442 F460 M479 I480 E481 I486 R487 F491	I438-M483 HydrophobicContact CG2-CB 4.25Å; I438-M483 HydrophobicContact CG2-CG 4.42Å; I438-M483 HydrophobicContact CG2-SD 4Å; L441-M483 HydrophobicContact CB-SD 4.24Å; L441-M483 HydrophobicContact CD2-CE 4.45Å; L441-M483 HydrophobicContact CD2-CG 4.06Å; L441-M483 HydrophobicContact CD2-SD 4.24Å; L441-M483 HydrophobicContact CG-CE 4.12Å; L441-M483 HydrophobicContact CG-SD 4.19Å; K442-M483 HydrophobicContact CG-CE 4.2Å; K442-M483 HydrophobicContact CG-SD 3.72Å; F460-M483 HydrophobicContact CE1-CG 3.88Å; F460-M483 HydrophobicContact CZ-CE 4.11Å; F460-M483 HydrophobicContact CZ-CG 4.07Å; M479-M483 PolarHBondContact O-N 2.93Å; I480-M483 WeakPolarHBondContact O-CB 3.49Å; I480-M483 PolarHBondContact O-N 3.42Å; I480-M483 VanDerWaalsContact O-N 3.1Å; E481-M483 VanDerWaalsContact C-N 3.33Å; E481-M483 PolarHBondContact O-N 3.11Å; M483-I486 HydrophobicContact CE-CB 4.25Å; M483-I486 HydrophobicContact CE-CG2 4.06Å; M483-R487 WeakPolarHBondContact O-CB 3.1Å; M483-R487 PolarHBondContact O-N 3.44Å; M483-R487 VanDerWaalsContact O-N 3.11Å; M483-F491 HydrophobicContact CE-CE1 3.61Å; M483-F491 HydrophobicContact CE-CZ 4.13Å
484	F	93.3	Very high	90.6	Very high	54 Å²	54	74.1 Å²	74.1	24%	0.237	36%	0.355	C	S	.	.	H	α-helix	trans	-69.1	-33.2	171.9	-81	-69.9	0	0	0	112.9	F460 R464 I480 E481 V482 K488	F460-F484 HydrophobicContact CB-CE1 4.33Å; F460-F484 AromaticContact CD1-CD1 3.91Å; F460-F484 HydrophobicContact CD1-CD1 3.91Å; F460-F484 AromaticContact CD1-CE1 3.51Å; F460-F484 HydrophobicContact CD1-CE1 3.51Å; F460-F484 AromaticContact CD1-CZ 3.9Å; F460-F484 HydrophobicContact CD1-CZ 3.9Å; F460-F484 HydrophobicContact CE1-CD1 4.2Å; F460-F484 HydrophobicContact CE1-CE1 4.26Å; F460-F484 HydrophobicContact CG-CE1 4.32Å; R464-F484 HydrophobicContact CB-CZ 4.2Å; I480-F484 HydrophobicContact CG2-CD2 3.85Å; I480-F484 HydrophobicContact CG2-CE2 3.67Å; I480-F484 WeakPolarHBondContact O-CD2 3.44Å; I480-F484 PolarHBondContact O-N 3.35Å; E481-F484 PolarHBondContact O-N 3.34Å; V482-F484 VanDerWaalsContact C-N 3.35Å; F484-K488 WeakPolarHBondContact O-CB 3.22Å; F484-K488 PolarHBondContact O-N 2.77Å
485	A	92.7	Very high	90.6	Very high	43 Å²	43	70.6 Å²	70.6	36%	0.355	35%	0.346	S	S	.	.	H	α-helix	trans	-64.3	-53.3	172.2	0	0	0	0	0	111.5	E481 V482 R487 K488 D489	E481-A485 PolarHBondContact O-N 2.81Å; V482-A485 WeakPolarHBondContact O-CB 3.44Å; V482-A485 PolarHBondContact O-N 2.83Å; A485-R487 PolarHBondContact O-N 3.18Å; A485-K488 WeakPolarHBondContact O-CA 3.47Å; A485-K488 WeakPolarHBondContact O-CB 3.4Å; A485-K488 PolarHBondContact O-N 3.03Å; A485-D489 PolarHBondContact O-N 2.92Å
486	I	93.3	Very high	90.4	Very high	22 Å²	22	65.2 Å²	65.2	11%	0.113	33%	0.329	C	S	.	.	H	α-helix	trans	-54.6	-40.9	177.6	-68.3	165.8	0	0	0	111.6	K442 V482 M483 D489 G490 F491	K442-I486 HydrophobicContact CD-CD1 3.93Å; K442-I486 VanDerWaalsContact CE-CD1 3.41Å; K442-I486 HydrophobicContact CG-CD1 3.99Å; V482-I486 HydrophobicContact CG1-CD1 3.89Å; V482-I486 HydrophobicContact CG1-CG1 4.47Å; V482-I486 WeakPolarHBondContact O-CG1 3.16Å; V482-I486 PolarHBondContact O-N 2.99Å; M483-I486 HydrophobicContact CE-CB 4.25Å; M483-I486 HydrophobicContact CE-CG2 4.06Å; I486-D489 PolarHBondContact O-N 3.17Å; I486-G490 PolarHBondContact O-N 3.11Å; I486-G490 VanDerWaalsContact O-N 3.15Å; I486-F491 HydrophobicContact CG2-CD1 3.66Å; I486-F491 HydrophobicContact CG2-CE1 4.06Å; I486-F491 HydrophobicContact CG2-CG 4.22Å; I486-F491 PolarHBondContact O-N 3.32Å
487	R	91.1	Very high	90.3	Very high	81 Å²	81	67 Å²	67	31%	0.306	34%	0.338	S	S	.	.	H	α-helix	trans	-63.3	-43.2	174.2	-171.8	-165.5	165.8	153.5	-0.3	112.3	N457 F460 M483 A485 D489 G490 F491	N457-R487 PolarHBondContact OD1-NH1 2.87Å; N457-R487 VanDerWaalsContact OD1-NH1 3.13Å; N457-R487 PolarHBondContact OD1-NH2 3.43Å; F460-R487 VanDerWaalsContact CD2-NH1 3.31Å; F460-R487 HydrophobicContact CE1-CB 4.1Å; F460-R487 HydrophobicContact CE1-CG 4.41Å; F460-R487 HydrophobicContact CE2-CB 4.41Å; F460-R487 HydrophobicContact CE2-CG 4.06Å; F460-R487 HydrophobicContact CZ-CB 3.74Å; F460-R487 HydrophobicContact CZ-CG 3.89Å; M483-R487 WeakPolarHBondContact O-CB 3.1Å; M483-R487 PolarHBondContact O-N 3.44Å; M483-R487 VanDerWaalsContact O-N 3.11Å; A485-R487 PolarHBondContact O-N 3.18Å; R487-D489 VanDerWaalsContact C-N 3.34Å; R487-G490 PolarHBondContact O-N 2.91Å; R487-F491 HydrophobicContact CG-CE2 4.35Å
488	K	91.9	Very high	90.1	Very high	179 Å²	179	65.4 Å²	65.4	78%	0.778	33%	0.334	S	S	*	.	H	α-helix	trans	-66	-37.9	179.3	-176.2	-162.3	169.8	-154.3	0	111.7	F484 A485 G490	F484-K488 WeakPolarHBondContact O-CB 3.22Å; F484-K488 PolarHBondContact O-N 2.77Å; A485-K488 WeakPolarHBondContact O-CA 3.47Å; A485-K488 WeakPolarHBondContact O-CB 3.4Å; A485-K488 PolarHBondContact O-N 3.03Å; K488-G490 PolarHBondContact O-N 2.56Å
489	D	92.4	Very high	89.4	Confident	84 Å²	84	67.5 Å²	67.5	45%	0.449	35%	0.349	S	S	.	.	H	α-helix	trans	-80.3	-7.4	-179.8	-63.1	-41.3	0	0	0	113.1	A485 I486 R487 K492	A485-D489 PolarHBondContact O-N 2.92Å; I486-D489 PolarHBondContact O-N 3.17Å; R487-D489 VanDerWaalsContact C-N 3.34Å; D489-K492 VanDerWaalsContact O-CD 3.27Å; D489-K492 WeakPolarHBondContact O-CD 3.43Å; D489-K492 WeakPolarHBondContact O-CE 3.44Å; D489-K492 WeakPolarHBondContact O-CG 3.43Å; D489-K492 PolarHBondContact O-NZ 3.4Å
490	G	88.8	Confident	88.8	Confident	41 Å²	41	67.8 Å²	67.8	42%	0.423	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.6	29.3	171.8	0	0	0	0	0	114.6	I486 R487 K488 K492	I486-G490 PolarHBondContact O-N 3.11Å; I486-G490 VanDerWaalsContact O-N 3.15Å; R487-G490 PolarHBondContact O-N 2.91Å; K488-G490 PolarHBondContact O-N 2.56Å; G490-K492 PolarHBondContact O-N 2.84Å
491	F	91.9	Very high	88.5	Confident	6 Å²	6	67.8 Å²	67.8	3%	0.026	36%	0.364	C	S	.	.	S	Bend	trans	57.1	26.2	-179.8	-60	-93.8	0	0	0	115.3	G445 L446 M483 I486 R487 D493 H494	G445-F491 VanDerWaalsContact C-CZ 3.5Å; L446-F491 HydrophobicContact CB-CB 3.85Å; L446-F491 HydrophobicContact CB-CD2 4.29Å; L446-F491 HydrophobicContact CB-CG 4.04Å; L446-F491 HydrophobicContact CD1-CB 4.32Å; L446-F491 HydrophobicContact CD1-CD2 4.4Å; L446-F491 HydrophobicContact CD2-CB 4.26Å; L446-F491 HydrophobicContact CG-CB 4.37Å; M483-F491 HydrophobicContact CE-CE1 3.61Å; M483-F491 HydrophobicContact CE-CZ 4.13Å; I486-F491 HydrophobicContact CG2-CD1 3.66Å; I486-F491 HydrophobicContact CG2-CE1 4.06Å; I486-F491 HydrophobicContact CG2-CG 4.22Å; I486-F491 PolarHBondContact O-N 3.32Å; R487-F491 HydrophobicContact CG-CE2 4.35Å; F491-D493 VanDerWaalsContact C-N 3.27Å; F491-D493 PolarHBondContact O-N 3.02Å; F491-D493 VanDerWaalsContact O-N 3.15Å; F491-H494 CarbonylContact O-C 3.44Å; F491-H494 WeakPolarHBondContact O-CA 3.42Å; F491-H494 PolarHBondContact O-N 2.87Å
492	K	85.9	Confident	88.1	Confident	163 Å²	163	69 Å²	69	71%	0.709	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.2	-40	-177.8	-70.9	165.8	-177.9	157.6	0	114.8	D489 G490 H494	D489-K492 VanDerWaalsContact O-CD 3.27Å; D489-K492 WeakPolarHBondContact O-CD 3.43Å; D489-K492 WeakPolarHBondContact O-CE 3.44Å; D489-K492 WeakPolarHBondContact O-CG 3.43Å; D489-K492 PolarHBondContact O-NZ 3.4Å; G490-K492 PolarHBondContact O-N 2.84Å; K492-H494 PolarHBondContact O-N 3.29Å
493	D	85.8	Confident	87.7	Confident	142 Å²	142	69.1 Å²	69.1	76%	0.759	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.9	-2.9	179.1	-51.1	-38	0	0	0	113.3	F491	F491-D493 VanDerWaalsContact C-N 3.27Å; F491-D493 PolarHBondContact O-N 3.02Å; F491-D493 VanDerWaalsContact O-N 3.15Å
494	H	88.2	Confident	87.3	Confident	38 Å²	38	69.8 Å²	69.8	18%	0.176	38%	0.375	C	S	.	.	S	Bend	trans	-136.3	66.1	-175.4	-66.9	-71.4	0	0	0	110.9	K442 F491 K492	K442-H494 VanDerWaalsContact O-CB 3.32Å; K442-H494 WeakPolarHBondContact O-CB 3.45Å; F491-H494 CarbonylContact O-C 3.44Å; F491-H494 WeakPolarHBondContact O-CA 3.42Å; F491-H494 PolarHBondContact O-N 2.87Å; K492-H494 PolarHBondContact O-N 3.29Å
495	P	87.9	Confident	87	Confident	71 Å²	71	73.7 Å²	73.7	46%	0.461	40%	0.398	S	S	.	.			trans	-61.6	155.1	174	28.3	-35.8	0	0	0	111.6
496	V	86.3	Confident	86.5	Confident	23 Å²	23	79.5 Å²	79.5	14%	0.139	42%	0.418	C	S	.	.	S	Bend	trans	-60	-58.8	-178.9	-178.5	0	0	0	0	110.6	N409 L446 K447	N409-V496 HydrophobicContact CB-CG1 3.66Å; N409-V496 VanDerWaalsContact CB-O 3.24Å; N409-V496 WeakPolarHBondContact CB-O 3.46Å; N409-V496 PolarHBondContact ND2-O 2.93Å; L446-V496 HydrophobicContact CB-CG2 4.03Å; L446-V496 HydrophobicContact CD2-CG2 3.77Å; L446-V496 HydrophobicContact CG-CG2 3.67Å; K447-V496 HydrophobicContact CB-CG1 4.21Å; K447-V496 HydrophobicContact CB-CG2 4.36Å; K447-V496 HydrophobicContact CD-CG1 3.85Å; K447-V496 HydrophobicContact CG-CG1 4.44Å
497	I	85.8	Confident	86.1	Confident	38 Å²	38	86.6 Å²	86.6	20%	0.195	46%	0.456	C	S	.	.	S	Bend	trans	-122.4	130.5	174.1	-62.7	160.8	0	0	0	107.1	Q410 L501 D502	Q410-I497 HydrophobicContact CG-CG1 4.31Å; Q410-I497 VanDerWaalsContact OE1-CD1 3.25Å; I497-L501 HydrophobicContact CG2-CB 3.86Å; I497-D502 HydrophobicContact CD1-CB 4.49Å; I497-D502 HydrophobicContact CG2-CB 3.99Å
498	P	85	Confident	85.9	Confident	45 Å²	45	86.3 Å²	86.3	29%	0.292	46%	0.461	S	S	.	.			trans	-66.2	147.8	171.4	-21.1	33.9	0	0	0	112	H357 G500 L501	H357-P498 HydrophobicContact CB-CG 4.34Å; P498-G500 PolarHBondContact O-N 3.21Å; P498-L501 HydrophobicContact CB-CD1 4.37Å; P498-L501 HydrophobicContact CG-CD1 4.27Å; P498-L501 WeakPolarHBondContact O-CB 3.3Å; P498-L501 PolarHBondContact O-N 3.14Å; P498-L501 VanDerWaalsContact O-N 3.08Å
499	E	77.6	Confident	85.7	Confident	193 Å²	193	79.5 Å²	79.5	90%	0.902	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52	133.2	177.4	-64.9	173.5	-171.2	0	0	111.8
500	G	76.6	Confident	85.7	Confident	52 Å²	52	80.6 Å²	80.6	54%	0.536	43%	0.433	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.3	5.9	-176.4	0	0	0	0	0	116	P498	P498-G500 PolarHBondContact O-N 3.21Å
501	L	84.4	Confident	85.8	Confident	1 Å²	1	82 Å²	82	1%	0.005	43%	0.433	C	S	.	.			trans	-114.4	0.1	171.5	-71.1	-178.8	0	0	0	114.5	V319 I322 H357 V358 Q410 I497 P498	V319-L501 HydrophobicContact CB-CD2 4.39Å; V319-L501 HydrophobicContact CG1-CD2 4.06Å; V319-L501 HydrophobicContact CG1-CG 4.09Å; V319-L501 HydrophobicContact CG2-CD1 4.21Å; V319-L501 HydrophobicContact CG2-CD2 4.25Å; V319-L501 HydrophobicContact CG2-CG 4.29Å; I322-L501 HydrophobicContact CD1-CD2 3.91Å; H357-L501 HydrophobicContact CB-CD1 4.35Å; V358-L501 HydrophobicContact CG2-CD1 4.38Å; Q410-L501 PolarHBondContact NE2-O 3.04Å; I497-L501 HydrophobicContact CG2-CB 3.86Å; P498-L501 HydrophobicContact CB-CD1 4.37Å; P498-L501 HydrophobicContact CG-CD1 4.27Å; P498-L501 WeakPolarHBondContact O-CB 3.3Å; P498-L501 PolarHBondContact O-N 3.14Å; P498-L501 VanDerWaalsContact O-N 3.08Å
502	D	84.4	Confident	85.9	Confident	103 Å²	103	82.2 Å²	82.2	55%	0.551	43%	0.434	S	S	*	.			trans	-86.7	109.7	168	-159.5	1.5	0	0	0	108.1	I497	I497-D502 HydrophobicContact CD1-CB 4.49Å; I497-D502 HydrophobicContact CG2-CB 3.99Å
503	L	84.1	Confident	86.2	Confident	73 Å²	73	80.1 Å²	80.1	38%	0.382	43%	0.429	S	S	.	.			trans	-147.5	13.8	-161.2	-68.8	174	0	0	0	112.7	I322 I365	I322-L503 HydrophobicContact CD1-CD1 4.37Å; I322-L503 HydrophobicContact CG2-CD1 3.52Å; I365-L503 HydrophobicContact CD1-CB 3.82Å; I365-L503 HydrophobicContact CD1-CD1 3.88Å; I365-L503 HydrophobicContact CG1-CB 4.21Å
504	V	86.3	Confident	86.4	Confident	14 Å²	14	74.3 Å²	74.3	9%	0.085	40%	0.397	C	S	.	.	S	Bend	trans	-142.7	116.2	179.5	-174.7	0	0	0	0	107.7	A364 I365 D508 Q509	A364-V504 HydrophobicContact CB-CG2 4.48Å; I365-V504 HydrophobicContact CB-CG2 4.13Å; I365-V504 HydrophobicContact CG1-CG2 3.45Å; I365-V504 VanDerWaalsContact CG1-CG2 3.45Å; V504-D508 HydrophobicContact CG1-CB 4.06Å; V504-Q509 HydrophobicContact CB-CG 4.26Å; V504-Q509 HydrophobicContact CG1-CG 3.77Å; V504-Q509 PolarHBondContact O-NE2 3.01Å
505	D	86.3	Confident	86.5	Confident	135 Å²	135	74.2 Å²	74.2	72%	0.722	40%	0.4	S	S	*	.			trans	-60	146.2	-179.8	-61.9	-55.1	0	0	0	112.2	D507 D508 Q509	D505-D507 PolarHBondContact O-N 3.28Å; D505-D507 VanDerWaalsContact O-N 3.1Å; D505-D508 PolarHBondContact O-N 3.09Å; D505-Q509 WeakPolarHBondContact O-CG 3.21Å; D505-Q509 PolarHBondContact O-N 3.11Å
506	E	83.6	Confident	86.6	Confident	166 Å²	166	71 Å²	71	78%	0.776	38%	0.379	S	S	*	.	G	3₁₀ helix	trans	-55.9	-32.8	-172.3	-64.1	-165.3	138.5	0	0	113.9	Q509	E506-Q509 PolarHBondContact O-N 2.85Å
507	D	83.4	Confident	86.5	Confident	170 Å²	170	75.1 Å²	75.1	91%	0.909	40%	0.4	S	S	*	.	G	3₁₀ helix	trans	-73.4	-24.2	178.2	-73.2	-44.9	0	0	0	113.2	D505	D505-D507 PolarHBondContact O-N 3.28Å; D505-D507 VanDerWaalsContact O-N 3.1Å
508	D	87.2	Confident	86.7	Confident	76 Å²	76	77.6 Å²	77.6	41%	0.406	41%	0.414	S	S	.	.	G	3₁₀ helix	trans	-87.6	-5.1	178.2	-115.4	37.3	0	0	0	112.2	S368 K369 V504 D505 F510	S368-D508 WeakPolarHBondContact CA-O 3.47Å; S368-D508 WeakPolarHBondContact CB-O 3.46Å; K369-D508 IonicContact NZ-OD2 2.68Å; K369-D508 PolarHBondContact NZ-OD2 3.14Å; V504-D508 HydrophobicContact CG1-CB 4.06Å; D505-D508 PolarHBondContact O-N 3.09Å; D508-F510 PolarHBondContact O-N 3.36Å
509	Q	88.1	Confident	86.7	Confident	36 Å²	36	84.6 Å²	84.6	17%	0.168	44%	0.443	C	S	.	.			trans	-83.9	105.8	-173.6	-69	173.2	14.3	0	0	113.5	N411 V504 D505 E506 T511	N411-Q509 HydrophobicContact CB-CB 4.47Å; N411-Q509 VanDerWaalsContact CB-OE1 3.22Å; N411-Q509 PolarHBondContact ND2-OE1 2.76Å; V504-Q509 HydrophobicContact CB-CG 4.26Å; V504-Q509 HydrophobicContact CG1-CG 3.77Å; V504-Q509 PolarHBondContact O-NE2 3.01Å; D505-Q509 WeakPolarHBondContact O-CG 3.21Å; D505-Q509 PolarHBondContact O-N 3.11Å; E506-Q509 PolarHBondContact O-N 2.85Å; Q509-T511 PolarHBondContact O-N 3.3Å
510	F	91.3	Very high	87.2	Confident	107 Å²	107	76.6 Å²	76.6	47%	0.469	40%	0.404	S	S	.	.			trans	-82.5	106.4	176.5	-164.5	-82.1	0	0	0	113.4	N367 P371 D508 H512	N367-F510 PolarHBondContact ND2-O 3.32Å; P371-F510 HydrophobicContact CB-CB 4.33Å; P371-F510 HydrophobicContact CB-CD1 3.86Å; P371-F510 HydrophobicContact CB-CD2 4.35Å; P371-F510 HydrophobicContact CB-CE1 4.27Å; P371-F510 HydrophobicContact CB-CG 3.9Å; P371-F510 HydrophobicContact CG-CB 4.11Å; P371-F510 HydrophobicContact CG-CD1 4.43Å; P371-F510 HydrophobicContact CG-CD2 4.14Å; P371-F510 HydrophobicContact CG-CG 3.95Å; D508-F510 PolarHBondContact O-N 3.36Å; F510-H512 AromaticContact CD1-CE1 3.48Å; F510-H512 VanDerWaalsContact CD1-CE1 3.48Å; F510-H512 WeakPolarHBondContact CD1-CE1 3.45Å; F510-H512 AromaticContact CD1-ND1 3.97Å; F510-H512 AromaticContact CD1-NE2 3.62Å; F510-H512 AromaticContact CE1-CE1 3.5Å; F510-H512 AromaticContact CE1-ND1 3.74Å
511	T	92.5	Very high	87.8	Confident	69 Å²	69	80.1 Å²	80.1	42%	0.423	41%	0.411	S	S	.	.			trans	-81.3	122.9	178.7	44.1	0	0	0	0	113.1	N411 Q509	N411-T511 HydrophobicContact CB-CG2 4.25Å; N411-T511 WeakPolarHBondContact O-CA 3.38Å; N411-T511 WeakPolarHBondContact O-CG2 3.33Å; Q509-T511 PolarHBondContact O-N 3.3Å
512	H	93.8	Very high	87.7	Confident	11 Å²	11	81.8 Å²	81.8	5%	0.051	42%	0.422	C	S	.	.	B	Isolated β-bridge	trans	-90	120.1	177.8	-70.8	-75.3	0	0	0	113.6	N367 P371 L378 V412 H414 F510 L514	N367-H512 PolarHBondContact OD1-CD2 3.17Å; N367-H512 PolarHBondContact OD1-NE2 3.1Å; P371-H512 PolarHBondContact O-CE1 3.47Å; P371-H512 VanDerWaalsContact O-CE1 3.22Å; P371-H512 PolarHBondContact O-NE2 3.1Å; L378-H512 HydrophobicContact CD2-CB 3.77Å; V412-H512 WeakPolarHBondContact O-CB 3.47Å; V412-H512 PolarHBondContact O-CD2 2.89Å; V412-H512 PolarHBondContact O-N 3.27Å; H414-H512 WeakPolarHBondContact CB-O 3.28Å; H414-H512 PolarHBondContact N-O 3.4Å; F510-H512 AromaticContact CD1-CE1 3.48Å; F510-H512 VanDerWaalsContact CD1-CE1 3.48Å; F510-H512 WeakPolarHBondContact CD1-CE1 3.45Å; F510-H512 AromaticContact CD1-ND1 3.97Å; F510-H512 AromaticContact CD1-NE2 3.62Å; F510-H512 AromaticContact CE1-CE1 3.5Å; F510-H512 AromaticContact CE1-ND1 3.74Å; H512-L514 HydrophobicContact CB-CG 4.31Å; H512-L514 PolarHBondContact O-N 2.96Å
513	M	90.9	Very high	87.8	Confident	120 Å²	120	80.4 Å²	80.4	59%	0.591	41%	0.412	S	S	*	.			trans	-86.2	70.3	176.4	-66.9	-62.5	-60.5	0	0	112	H414	H414-M513 HydrophobicContact CB-SD 3.5Å; H414-M513 WeakPolarHBondContact CB-SD 3.27Å; H414-M513 VanDerWaalsContact CD2-SD 3.56Å
514	L	90.3	Very high	87.9	Confident	19 Å²	19	80.9 Å²	80.9	10%	0.099	42%	0.415	C	S	.	.			trans	-108.3	104.3	179.9	-62.6	-168.7	0	0	0	111.9	E375 L378 K379 I382 H512 Y520	E375-L514 HydrophobicContact CG-CD1 4.24Å; L378-L514 HydrophobicContact CB-CD1 4.1Å; L378-L514 HydrophobicContact CD2-CB 4.31Å; L378-L514 HydrophobicContact CD2-CD1 3.87Å; L378-L514 HydrophobicContact CD2-CG 4.21Å; L378-L514 HydrophobicContact CG-CD1 3.95Å; K379-L514 HydrophobicContact CG-CD1 3.65Å; I382-L514 HydrophobicContact CD1-CB 3.82Å; I382-L514 HydrophobicContact CD1-CD1 4.27Å; H512-L514 HydrophobicContact CB-CG 4.31Å; H512-L514 PolarHBondContact O-N 2.96Å; L514-Y520 VanDerWaalsContact C-OH 3.28Å; L514-Y520 WeakPolarHBondContact CA-OH 3.27Å; L514-Y520 HydrophobicContact CB-CE1 4.49Å; L514-Y520 WeakPolarHBondContact CB-OH 3.31Å; L514-Y520 HydrophobicContact CD1-CE1 4.45Å; L514-Y520 HydrophobicContact CD2-CE1 3.93Å
515	P	90.4	Very high	88	Confident	37 Å²	37	85.5 Å²	85.5	24%	0.24	44%	0.438	C	S	.	.			trans	-68.6	161.6	174.5	30.4	-37	0	0	0	112.3	E420 D518 Y520	E420-P515 WeakPolarHBondContact OE2-CA 3.41Å; P515-D518 HydrophobicContact CG-CB 4.27Å; P515-D518 WeakPolarHBondContact CG-OD2 3.31Å; P515-Y520 VanDerWaalsContact CD-OH 3.23Å; P515-Y520 WeakPolarHBondContact CD-OH 3.28Å; P515-Y520 VanDerWaalsContact N-OH 3.17Å; P515-Y520 VanDerWaalsContact O-CE2 3.3Å; P515-Y520 WeakPolarHBondContact O-CE2 3.32Å; P515-Y520 PolarHBondContact O-OH 2.91Å
516	L	89.4	Confident	88	Confident	3 Å²	3	81.9 Å²	81.9	2%	0.016	42%	0.419	C	S	.	.	S	Bend	trans	-68.8	-37	-174.5	-177.5	56.1	0	0	0	112.9	I382 F385 R386 L417 E420 M421 L424	I382-L516 HydrophobicContact CG2-CD1 4.04Å; F385-L516 HydrophobicContact CD1-CD1 4.01Å; F385-L516 HydrophobicContact CE1-CD1 4.17Å; R386-L516 WeakPolarHBondContact CD-O 3.15Å; R386-L516 HydrophobicContact CG-CD1 3.9Å; R386-L516 PolarHBondContact NE-O 2.83Å; R386-L516 VanDerWaalsContact NE-O 3.1Å; R386-L516 PolarHBondContact NH1-O 2.81Å; L417-L516 HydrophobicContact CD1-CB 4.08Å; L417-L516 HydrophobicContact CD1-CD1 4.2Å; E420-L516 HydrophobicContact CB-CB 3.9Å; E420-L516 HydrophobicContact CB-CD2 4.18Å; E420-L516 WeakPolarHBondContact OE2-CB 3.39Å; E420-L516 PolarHBondContact OE2-N 3.36Å; M421-L516 HydrophobicContact CB-CD2 4.45Å; M421-L516 HydrophobicContact CG-CD1 3.86Å; M421-L516 HydrophobicContact CG-CD2 3.83Å; M421-L516 HydrophobicContact CG-CG 4.41Å; L424-L516 HydrophobicContact CB-CD2 4.27Å; L424-L516 HydrophobicContact CD1-CD2 3.99Å
517	D	85.2	Confident	88.2	Confident	109 Å²	109	75 Å²	75	58%	0.583	39%	0.387	S	S	*	.	S	Bend	trans	-90.8	-14.1	-165.7	-90.5	-41	0	0	0	117	R386	R386-D517 IonicContact CZ-OD1 2.89Å; R386-D517 IonicContact NE-OD1 3.66Å; R386-D517 VanDerWaalsContact NH1-C 3.28Å; R386-D517 PolarHBondContact NH1-O 3.32Å; R386-D517 VanDerWaalsContact NH2-CA 3.31Å; R386-D517 PolarHBondContact NH2-O 3.47Å; R386-D517 IonicContact NH2-OD1 3.52Å; R386-D517 PolarHBondContact NH2-OD1 2.91Å
518	D	89	Confident	88.4	Confident	90 Å²	90	71.5 Å²	71.5	48%	0.481	37%	0.371	S	S	.	.	S	Bend	trans	-60.5	154.5	-177.3	-81.3	11.6	0	0	0	114.7	R386 P515 Y520	R386-D518 PolarHBondContact NH1-O 2.96Å; P515-D518 HydrophobicContact CG-CB 4.27Å; P515-D518 WeakPolarHBondContact CG-OD2 3.31Å; D518-Y520 HydrophobicContact CB-CE1 3.98Å; D518-Y520 HydrophobicContact CB-CE2 4.08Å; D518-Y520 PolarHBondContact O-N 3.31Å; D518-Y520 VanDerWaalsContact O-N 3.15Å
519	E	85.6	Confident	88.4	Confident	192 Å²	192	70.3 Å²	70.3	90%	0.897	36%	0.363	S	S	*	.			trans	-84.8	83.9	-179.6	-64.9	-156.8	152.7	0	0	112.1
520	Y	89.3	Confident	88.3	Confident	25 Å²	25	75.1 Å²	75.1	10%	0.098	38%	0.383	C	S	.	.			trans	-75.5	134.4	178.7	-60.5	-58.1	0	0	0	114	K379 I382 L383 L514 P515 D518 P522	K379-Y520 HydrophobicContact CB-CG 4.3Å; K379-Y520 HydrophobicContact CD-CD1 4.14Å; K379-Y520 HydrophobicContact CG-CD1 3.7Å; K379-Y520 HydrophobicContact CG-CE1 4.3Å; K379-Y520 HydrophobicContact CG-CG 3.99Å; I382-Y520 HydrophobicContact CB-CD2 4.43Å; I382-Y520 HydrophobicContact CB-CE2 4.44Å; I382-Y520 HydrophobicContact CD1-CE2 3.98Å; I382-Y520 HydrophobicContact CG2-CD2 4.09Å; I382-Y520 HydrophobicContact CG2-CE2 3.93Å; L383-Y520 WeakPolarHBondContact CD1-O 3.25Å; L514-Y520 VanDerWaalsContact C-OH 3.28Å; L514-Y520 WeakPolarHBondContact CA-OH 3.27Å; L514-Y520 HydrophobicContact CB-CE1 4.49Å; L514-Y520 WeakPolarHBondContact CB-OH 3.31Å; L514-Y520 HydrophobicContact CD1-CE1 4.45Å; L514-Y520 HydrophobicContact CD2-CE1 3.93Å; P515-Y520 VanDerWaalsContact CD-OH 3.23Å; P515-Y520 WeakPolarHBondContact CD-OH 3.28Å; P515-Y520 VanDerWaalsContact N-OH 3.17Å; P515-Y520 VanDerWaalsContact O-CE2 3.3Å; P515-Y520 WeakPolarHBondContact O-CE2 3.32Å; P515-Y520 PolarHBondContact O-OH 2.91Å; D518-Y520 HydrophobicContact CB-CE1 3.98Å; D518-Y520 HydrophobicContact CB-CE2 4.08Å; D518-Y520 PolarHBondContact O-N 3.31Å; D518-Y520 VanDerWaalsContact O-N 3.15Å; Y520-P522 WeakPolarHBondContact O-CD 3.37Å
521	N	88	Confident	88	Confident	127 Å²	127	74.7 Å²	74.7	68%	0.679	39%	0.385	S	S	*	.			trans	-78.9	121.4	165.6	-73.9	-54.3	0	0	0	110	E523	N521-E523 VanDerWaalsContact C-N 3.28Å; N521-E523 PolarHBondContact O-N 3.43Å
522	P	83	Confident	87.6	Confident	36 Å²	36	73.3 Å²	73.3	23%	0.234	38%	0.375	C	S	.	.			trans	-78.7	-8.8	178.4	30.5	-35	0	0	0	113.9	R380 L383 Y520 D524	R380-P522 HydrophobicContact CG-CB 4.4Å; R380-P522 PolarHBondContact NE-O 3.31Å; R380-P522 PolarHBondContact NH2-O 2.88Å; R380-P522 VanDerWaalsContact NH2-O 3.08Å; L383-P522 HydrophobicContact CD1-CB 3.77Å; L383-P522 HydrophobicContact CD1-CG 4.26Å; Y520-P522 WeakPolarHBondContact O-CD 3.37Å; P522-D524 PolarHBondContact O-N 3.33Å; P522-D524 VanDerWaalsContact O-N 3.09Å
523	E	87.3	Confident	87.2	Confident	74 Å²	74	78.1 Å²	78.1	35%	0.346	41%	0.407	S	S	.	.			trans	48	36.9	-175.3	-54.1	-170.3	168.1	0	0	113.8	R338 L376 R380 N521 I525 L526	R338-E523 IonicContact CZ-OE2 3.39Å; R338-E523 IonicContact NE-OE2 2.75Å; R338-E523 IonicContact NH2-OE1 3.69Å; R338-E523 PolarHBondContact NH2-OE1 2.92Å; R338-E523 IonicContact NH2-OE2 3.5Å; R338-E523 PolarHBondContact NH2-OE2 3.08Å; L376-E523 HydrophobicContact CD1-CB 3.97Å; L376-E523 HydrophobicContact CD1-CG 4.1Å; R380-E523 PolarHBondContact NH2-O 2.88Å; R380-E523 VanDerWaalsContact NH2-O 3.1Å; N521-E523 VanDerWaalsContact C-N 3.28Å; N521-E523 PolarHBondContact O-N 3.43Å; E523-I525 PolarHBondContact O-N 3.31Å; E523-L526 HydrophobicContact CB-CD1 4.02Å; E523-L526 HydrophobicContact CB-CG 4.18Å; E523-L526 WeakPolarHBondContact O-CB 3.28Å; E523-L526 PolarHBondContact O-N 3.15Å; E523-L526 WeakPolarHBondContact OE2-CD1 3.36Å
524	D	85.6	Confident	86.9	Confident	83 Å²	83	76.5 Å²	76.5	44%	0.444	40%	0.401	S	S	.	.	G	3₁₀ helix	trans	-58.8	-19.1	-175.9	-83.7	-47.1	0	0	0	113.7	P522 L526 N527	P522-D524 PolarHBondContact O-N 3.33Å; P522-D524 VanDerWaalsContact O-N 3.09Å; D524-L526 PolarHBondContact O-N 3.39Å; D524-N527 WeakPolarHBondContact CA-ND2 3.4Å; D524-N527 WeakPolarHBondContact O-CB 3.48Å; D524-N527 VanDerWaalsContact O-CG 3.27Å; D524-N527 PolarHBondContact O-N 3.3Å; D524-N527 PolarHBondContact O-ND2 2.68Å; D524-N527 PolarHBondContact OD1-ND2 2.95Å
525	I	87.7	Confident	86.7	Confident	111 Å²	111	75.8 Å²	75.8	57%	0.569	40%	0.397	S	S	*	.	G	3₁₀ helix	trans	-59.7	-32	173	-61.2	174.7	0	0	0	111.6	E523 N527 V528 K530	E523-I525 PolarHBondContact O-N 3.31Å; I525-N527 PolarHBondContact O-N 3.41Å; I525-V528 PolarHBondContact O-N 2.94Å; I525-K530 VanDerWaalsContact CG2-CE 3.44Å
526	L	86.9	Confident	86.4	Confident	59 Å²	59	77.8 Å²	77.8	31%	0.309	41%	0.405	S	S	.	.	G	3₁₀ helix	trans	-71.4	-5.5	175.9	-60.1	-175.7	0	0	0	113.6	W303 R338 E523 D524 V528	W303-L526 WeakPolarHBondContact CH2-O 3.5Å; R338-L526 HydrophobicContact CG-CD1 3.88Å; R338-L526 VanDerWaalsContact NE-CD1 3.28Å; E523-L526 HydrophobicContact CB-CD1 4.02Å; E523-L526 HydrophobicContact CB-CG 4.18Å; E523-L526 WeakPolarHBondContact O-CB 3.28Å; E523-L526 PolarHBondContact O-N 3.15Å; E523-L526 WeakPolarHBondContact OE2-CD1 3.36Å; D524-L526 PolarHBondContact O-N 3.39Å; L526-V528 VanDerWaalsContact C-N 3.26Å
527	N	86.8	Confident	86.3	Confident	21 Å²	21	82.5 Å²	82.5	11%	0.112	43%	0.428	C	S	.	.	G	3₁₀ helix	trans	-85.1	-2.8	174.7	-51.5	-26.2	0	0	0	112.1	G339 R380 D524 I525	G339-N527 VanDerWaalsContact C-OD1 3.3Å; G339-N527 PolarHBondContact O-OD1 3.02Å; R380-N527 PolarHBondContact NH1-OD1 3.21Å; R380-N527 PolarHBondContact NH2-OD1 2.93Å; D524-N527 WeakPolarHBondContact CA-ND2 3.4Å; D524-N527 WeakPolarHBondContact O-CB 3.48Å; D524-N527 VanDerWaalsContact O-CG 3.27Å; D524-N527 PolarHBondContact O-N 3.3Å; D524-N527 PolarHBondContact O-ND2 2.68Å; D524-N527 PolarHBondContact OD1-ND2 2.95Å; I525-N527 PolarHBondContact O-N 3.41Å
528	V	88.2	Confident	86.4	Confident	96 Å²	96	80 Å²	80	58%	0.582	41%	0.414	S	S	*	.	S	Bend	trans	-123.1	138	-171.4	-174.7	0	0	0	0	109.6	I525 L526 K530	I525-V528 PolarHBondContact O-N 2.94Å; L526-V528 VanDerWaalsContact C-N 3.26Å; V528-K530 PolarHBondContact O-N 3.49Å
529	F	88.3	Confident	86.2	Confident	51 Å²	51	77.7 Å²	77.7	22%	0.224	40%	0.401	C	S	.	.			trans	-61	135.8	176.7	178.2	-107.7	0	0	0	111.5	Q299 R300 W303	Q299-F529 HydrophobicContact CB-CE2 3.87Å; Q299-F529 HydrophobicContact CB-CZ 3.75Å; R300-F529 HydrophobicContact CB-CD1 4.25Å; R300-F529 HydrophobicContact CB-CE1 3.86Å; R300-F529 HydrophobicContact CB-CE2 4.27Å; R300-F529 HydrophobicContact CB-CZ 3.88Å; R300-F529 HydrophobicContact CG-CD1 4.27Å; R300-F529 HydrophobicContact CG-CE1 4.36Å; W303-F529 HydrophobicContact CB-CD2 3.69Å; W303-F529 HydrophobicContact CB-CE2 4.21Å; W303-F529 AromaticContact CD1-CD2 3.99Å; W303-F529 HydrophobicContact CD2-CD2 4.19Å; W303-F529 HydrophobicContact CG-CB 4.2Å; W303-F529 AromaticContact CG-CD2 3.68Å; W303-F529 HydrophobicContact CG-CD2 3.68Å; W303-F529 HydrophobicContact CG-CG 4.37Å
530	K	85.3	Confident	86.4	Confident	138 Å²	138	73.9 Å²	73.9	60%	0.6	38%	0.382	S	S	*	.			trans	-127.7	151	164.7	-68.2	-178	175.4	-177.9	0	108.1	I525 V528 D532	I525-K530 VanDerWaalsContact CG2-CE 3.44Å; V528-K530 PolarHBondContact O-N 3.49Å; K530-D532 PolarHBondContact O-N 3.04Å
531	L	85.1	Confident	86.4	Confident	97 Å²	97	77.3 Å²	77.3	51%	0.508	40%	0.398	S	S	.	.			trans	-67.6	127.1	163.6	-173.2	74.5	0	0	0	108.1	L296	L296-L531 HydrophobicContact CB-CD1 3.84Å; L296-L531 HydrophobicContact CD1-CD1 4.38Å; L296-L531 HydrophobicContact CG-CD1 4.08Å
532	D	83.4	Confident	86.4	Confident	41 Å²	41	71.9 Å²	71.9	22%	0.219	37%	0.368	C	S	.	.			trans	-102.9	117.2	174.5	-178.3	7.5	0	0	0	108.2	Q299 K530 D534 F535 N538	Q299-D532 PolarHBondContact NE2-O 3.06Å; Q299-D532 PolarHBondContact OE1-O 3.41Å; K530-D532 PolarHBondContact O-N 3.04Å; D532-D534 VanDerWaalsContact C-N 3.28Å; D532-D534 PolarHBondContact OD1-N 3Å; D532-D534 VanDerWaalsContact OD1-N 3.1Å; D532-F535 HydrophobicContact CB-CB 4.12Å; D532-F535 WeakPolarHBondContact O-CB 3.38Å; D532-N538 PolarHBondContact OD1-ND2 3.32Å; D532-N538 PolarHBondContact OD2-ND2 2.97Å
533	P	85.1	Confident	86.7	Confident	111 Å²	111	75.7 Å²	75.7	72%	0.721	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-33.8	176.9	27.8	-33.2	0	0	0	111.7	F535	P533-F535 VanDerWaalsContact C-N 3.27Å; P533-F535 PolarHBondContact O-N 3.23Å
534	D	85.3	Confident	86.7	Confident	87 Å²	87	76.2 Å²	76.2	47%	0.465	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.4	20.7	-170.5	-47.7	-33.3	0	0	0	111	D532 L536 E537 N538	D532-D534 VanDerWaalsContact C-N 3.28Å; D532-D534 PolarHBondContact OD1-N 3Å; D532-D534 VanDerWaalsContact OD1-N 3.1Å; D534-L536 VanDerWaalsContact C-N 3.3Å; D534-L536 PolarHBondContact O-N 3.37Å; D534-E537 PolarHBondContact O-N 3.45Å; D534-E537 VanDerWaalsContact O-N 3.13Å; D534-N538 VanDerWaalsContact O-CG 3.3Å; D534-N538 PolarHBondContact O-N 3.03Å; D534-N538 PolarHBondContact O-ND2 3.15Å
535	F	84.9	Confident	86.8	Confident	3 Å²	3	75.3 Å²	75.3	1%	0.013	38%	0.384	C	S	.	.	H	α-helix	trans	-53	-41.1	-170	172.2	-120.7	0	0	0	113.9	K293 Y298 Q299 D532 P533 N538 E539	K293-F535 WeakPolarHBondContact O-CD1 3.32Å; K293-F535 VanDerWaalsContact O-CE1 3.23Å; K293-F535 WeakPolarHBondContact O-CE1 3.49Å; Y298-F535 AromaticContact CD1-CE1 3.89Å; Y298-F535 HydrophobicContact CD1-CE1 3.89Å; Y298-F535 HydrophobicContact CD1-CZ 4.36Å; Y298-F535 AromaticContact CE1-CE1 3.89Å; Y298-F535 HydrophobicContact CE1-CE1 3.89Å; Y298-F535 HydrophobicContact CE1-CZ 4.13Å; Q299-F535 HydrophobicContact CG-CB 4.48Å; Q299-F535 HydrophobicContact CG-CD1 3.69Å; Q299-F535 HydrophobicContact CG-CD2 4.47Å; Q299-F535 HydrophobicContact CG-CE1 4.01Å; Q299-F535 HydrophobicContact CG-CG 3.94Å; D532-F535 HydrophobicContact CB-CB 4.12Å; D532-F535 WeakPolarHBondContact O-CB 3.38Å; P533-F535 VanDerWaalsContact C-N 3.27Å; P533-F535 PolarHBondContact O-N 3.23Å; F535-N538 PolarHBondContact O-N 3.05Å; F535-E539 HydrophobicContact CD2-CG 4.16Å; F535-E539 VanDerWaalsContact CE2-CD 3.44Å; F535-E539 HydrophobicContact CE2-CG 3.57Å; F535-E539 VanDerWaalsContact CE2-OE1 3.23Å; F535-E539 WeakPolarHBondContact CE2-OE1 3.49Å; F535-E539 HydrophobicContact CZ-CG 3.94Å; F535-E539 WeakPolarHBondContact CZ-OE1 3.46Å; F535-E539 PolarHBondContact O-N 3.04Å
536	L	85	Confident	86.9	Confident	79 Å²	79	73.1 Å²	73.1	41%	0.414	37%	0.37	S	S	.	.	H	α-helix	trans	-65.9	-48.7	179.8	-63.3	176.7	0	0	0	111.2	K293 D534 N538 E539 E540	K293-L536 HydrophobicContact CB-CD2 3.92Å; D534-L536 VanDerWaalsContact C-N 3.3Å; D534-L536 PolarHBondContact O-N 3.37Å; L536-N538 PolarHBondContact O-N 2.85Å; L536-E539 PolarHBondContact O-N 3.36Å; L536-E540 WeakPolarHBondContact O-CG 3.47Å; L536-E540 PolarHBondContact O-N 3.47Å
537	E	87.5	Confident	86.8	Confident	103 Å²	103	77.7 Å²	77.7	48%	0.481	38%	0.383	S	S	.	.	H	α-helix	trans	-60.6	-37.6	175.1	-56.4	-170.8	-176.1	0	0	111.5	D534 E539 E540 K541	D534-E537 PolarHBondContact O-N 3.45Å; D534-E537 VanDerWaalsContact O-N 3.13Å; E537-E539 VanDerWaalsContact C-N 3.35Å; E537-E540 PolarHBondContact O-N 3.42Å; E537-K541 HydrophobicContact CB-CD 4.47Å; E537-K541 VanDerWaalsContact CB-NZ 3.34Å; E537-K541 WeakPolarHBondContact O-CB 3.25Å; E537-K541 VanDerWaalsContact O-CD 3.28Å; E537-K541 WeakPolarHBondContact O-CD 3.33Å; E537-K541 WeakPolarHBondContact O-CG 3.48Å; E537-K541 PolarHBondContact O-N 3.3Å; E537-K541 WeakPolarHBondContact OE2-CE 3.37Å; E537-K541 IonicContact OE2-NZ 2.63Å; E537-K541 PolarHBondContact OE2-NZ 3.4Å
538	N	86.2	Confident	86.8	Confident	56 Å²	56	81.7 Å²	81.7	30%	0.299	41%	0.405	S	S	.	.	H	α-helix	trans	-73.7	-24.4	-178.6	-67.1	-22.5	0	0	0	112.9	N333 D532 D534 F535 L536 K541 Y542	N333-N538 PolarHBondContact ND2-O 3.41Å; D532-N538 PolarHBondContact OD1-ND2 3.32Å; D532-N538 PolarHBondContact OD2-ND2 2.97Å; D534-N538 VanDerWaalsContact O-CG 3.3Å; D534-N538 PolarHBondContact O-N 3.03Å; D534-N538 PolarHBondContact O-ND2 3.15Å; F535-N538 PolarHBondContact O-N 3.05Å; L536-N538 PolarHBondContact O-N 2.85Å; N538-K541 PolarHBondContact OD1-NZ 3.13Å; N538-Y542 PolarHBondContact O-N 2.75Å
539	E	86.3	Confident	86.5	Confident	42 Å²	42	78.9 Å²	78.9	20%	0.196	39%	0.386	C	S	.	.	H	α-helix	trans	-79.3	-34.5	165.8	-71.6	-157.7	154.6	0	0	112.6	R336 F535 L536 E537 Y542 K543	R336-E539 IonicContact NH2-OE1 3.73Å; F535-E539 HydrophobicContact CD2-CG 4.16Å; F535-E539 VanDerWaalsContact CE2-CD 3.44Å; F535-E539 HydrophobicContact CE2-CG 3.57Å; F535-E539 VanDerWaalsContact CE2-OE1 3.23Å; F535-E539 WeakPolarHBondContact CE2-OE1 3.49Å; F535-E539 HydrophobicContact CZ-CG 3.94Å; F535-E539 WeakPolarHBondContact CZ-OE1 3.46Å; F535-E539 PolarHBondContact O-N 3.04Å; L536-E539 PolarHBondContact O-N 3.36Å; E537-E539 VanDerWaalsContact C-N 3.35Å; E539-Y542 PolarHBondContact O-N 2.74Å; E539-K543 VanDerWaalsContact O-CG 3.25Å; E539-K543 WeakPolarHBondContact O-CG 3.24Å; E539-K543 PolarHBondContact O-N 3.01Å
540	E	88.8	Confident	86	Confident	111 Å²	111	79.7 Å²	79.7	52%	0.519	39%	0.392	S	S	.	.	H	α-helix	trans	-68.7	-46.4	176.3	-75.2	165.1	-166.2	0	0	112.2	L536 E537 Y542 K543 T544	L536-E540 WeakPolarHBondContact O-CG 3.47Å; L536-E540 PolarHBondContact O-N 3.47Å; E537-E540 PolarHBondContact O-N 3.42Å; E540-Y542 PolarHBondContact O-N 3.34Å; E540-K543 WeakPolarHBondContact O-CA 3.38Å; E540-K543 WeakPolarHBondContact O-CB 3.36Å; E540-K543 PolarHBondContact O-N 3.21Å; E540-T544 PolarHBondContact O-N 3.46Å
541	K	88.9	Confident	84.9	Confident	97 Å²	97	76.3 Å²	76.3	42%	0.422	38%	0.381	S	S	.	.	H	α-helix	trans	-57.2	-36.8	171	-67.4	158.4	-165	159.7	0	111.9	E537 N538 T544 I545	E537-K541 HydrophobicContact CB-CD 4.47Å; E537-K541 VanDerWaalsContact CB-NZ 3.34Å; E537-K541 WeakPolarHBondContact O-CB 3.25Å; E537-K541 VanDerWaalsContact O-CD 3.28Å; E537-K541 WeakPolarHBondContact O-CD 3.33Å; E537-K541 WeakPolarHBondContact O-CG 3.48Å; E537-K541 PolarHBondContact O-N 3.3Å; E537-K541 WeakPolarHBondContact OE2-CE 3.37Å; E537-K541 IonicContact OE2-NZ 2.63Å; E537-K541 PolarHBondContact OE2-NZ 3.4Å; N538-K541 PolarHBondContact OD1-NZ 3.13Å; K541-T544 PolarHBondContact O-OG1 2.98Å; K541-I545 WeakPolarHBondContact O-CD1 3.44Å; K541-I545 VanDerWaalsContact O-CG1 3.26Å; K541-I545 WeakPolarHBondContact O-CG1 3.26Å; K541-I545 PolarHBondContact O-N 3.11Å
542	Y	88.5	Confident	83.1	Confident	13 Å²	13	78.4 Å²	78.4	5%	0.051	39%	0.388	C	S	.	.	H	α-helix	trans	-73.3	-35.2	174.1	-168.2	-92	0	0	0	112.4	L330 E332 N333 I334 V335 F370 N538 E539 E540 I545 K546	L330-Y542 PolarHBondContact O-OH 3.35Å; E332-Y542 VanDerWaalsContact O-CE1 3.22Å; E332-Y542 WeakPolarHBondContact O-CE1 3.3Å; E332-Y542 PolarHBondContact O-OH 3.09Å; N333-Y542 HydrophobicContact CB-CD1 3.85Å; N333-Y542 HydrophobicContact CB-CD2 4.45Å; N333-Y542 HydrophobicContact CB-CE1 4.25Å; N333-Y542 HydrophobicContact CB-CG 3.98Å; N333-Y542 VanDerWaalsContact CG-CG 3.44Å; N333-Y542 WeakPolarHBondContact ND2-CB 3.29Å; N333-Y542 WeakPolarHBondContact OD1-CD2 3.43Å; I334-Y542 HydrophobicContact CG1-CE2 4.29Å; V335-Y542 HydrophobicContact CB-CD2 4.1Å; V335-Y542 HydrophobicContact CB-CE2 4.38Å; V335-Y542 HydrophobicContact CG2-CD2 3.93Å; V335-Y542 HydrophobicContact CG2-CE2 3.92Å; F370-Y542 HydrophobicContact CE1-CE2 4.49Å; F370-Y542 HydrophobicContact CZ-CE2 4.08Å; N538-Y542 PolarHBondContact O-N 2.75Å; E539-Y542 PolarHBondContact O-N 2.74Å; E540-Y542 PolarHBondContact O-N 3.34Å; Y542-I545 PolarHBondContact O-N 3.36Å; Y542-K546 HydrophobicContact CD1-CB 4.31Å; Y542-K546 HydrophobicContact CE1-CB 4.02Å; Y542-K546 HydrophobicContact CE1-CD 4.4Å; Y542-K546 WeakPolarHBondContact O-CB 3.5Å; Y542-K546 PolarHBondContact O-N 2.7Å
543	K	88.6	Confident	81.1	Confident	116 Å²	116	80.2 Å²	80.2	50%	0.504	42%	0.416	S	S	.	.	H	α-helix	trans	-63.6	-39.9	173.9	-72.6	162.8	-163.9	161.1	0	112.1	E539 E540 K546 R547	E539-K543 VanDerWaalsContact O-CG 3.25Å; E539-K543 WeakPolarHBondContact O-CG 3.24Å; E539-K543 PolarHBondContact O-N 3.01Å; E540-K543 WeakPolarHBondContact O-CA 3.38Å; E540-K543 WeakPolarHBondContact O-CB 3.36Å; E540-K543 PolarHBondContact O-N 3.21Å; K543-K546 PolarHBondContact O-N 3.46Å; K543-R547 PolarHBondContact O-N 3.25Å
544	T	88.9	Confident	78.8	Confident	85 Å²	85	78.4 Å²	78.4	52%	0.521	41%	0.406	S	S	.	.	H	α-helix	trans	-65.2	-44.6	176.3	54	0	0	0	0	111.5	E540 K541 R547 D548	E540-T544 PolarHBondContact O-N 3.46Å; K541-T544 PolarHBondContact O-OG1 2.98Å; T544-R547 PolarHBondContact O-N 2.83Å; T544-D548 PolarHBondContact O-N 2.99Å
545	I	87.7	Confident	76.4	Confident	64 Å²	64	79.2 Å²	79.2	33%	0.328	42%	0.419	S	S	.	.	H	α-helix	trans	-65.4	-37.8	175.5	-64.9	165.1	0	0	0	111.6	F370 K541 Y542 R547 D548 I549	F370-I545 HydrophobicContact CE1-CG2 3.88Å; F370-I545 HydrophobicContact CZ-CG2 3.73Å; K541-I545 WeakPolarHBondContact O-CD1 3.44Å; K541-I545 VanDerWaalsContact O-CG1 3.26Å; K541-I545 WeakPolarHBondContact O-CG1 3.26Å; K541-I545 PolarHBondContact O-N 3.11Å; Y542-I545 PolarHBondContact O-N 3.36Å; I545-R547 VanDerWaalsContact C-N 3.33Å; I545-D548 VanDerWaalsContact O-CB 3.32Å; I545-D548 WeakPolarHBondContact O-CB 3.22Å; I545-D548 PolarHBondContact O-N 2.94Å; I545-I549 HydrophobicContact CG2-CD1 3.61Å; I545-I549 HydrophobicContact CG2-CG1 4.42Å; I545-I549 WeakPolarHBondContact O-CG1 3.22Å; I545-I549 PolarHBondContact O-N 2.95Å
546	K	88.4	Confident	73.8	Confident	65 Å²	65	86.2 Å²	86.2	28%	0.283	46%	0.457	S	S	.	.	H	α-helix	trans	-64.8	-36.9	175.6	173.9	-179.5	169.4	172.5	0	111.7	Q331 Y542 K543 L550	Q331-K546 PolarHBondContact O-NZ 3.34Å; Y542-K546 HydrophobicContact CD1-CB 4.31Å; Y542-K546 HydrophobicContact CE1-CB 4.02Å; Y542-K546 HydrophobicContact CE1-CD 4.4Å; Y542-K546 WeakPolarHBondContact O-CB 3.5Å; Y542-K546 PolarHBondContact O-N 2.7Å; K543-K546 PolarHBondContact O-N 3.46Å; K546-L550 HydrophobicContact CG-CD1 3.82Å; K546-L550 WeakPolarHBondContact O-CB 3.49Å; K546-L550 PolarHBondContact O-N 2.97Å
547	R	86.3	Confident	71.6	Confident	155 Å²	155	87.7 Å²	87.7	59%	0.585	47%	0.474	S	S	*	.	H	α-helix	trans	-63.4	-62	171.6	-171.9	173.4	66.7	170	2.2	108.8	K543 T544 I545 I549 L550 D551	K543-R547 PolarHBondContact O-N 3.25Å; T544-R547 PolarHBondContact O-N 2.83Å; I545-R547 VanDerWaalsContact C-N 3.33Å; R547-I549 VanDerWaalsContact C-N 3.29Å; R547-I549 PolarHBondContact O-N 3.36Å; R547-L550 PolarHBondContact O-N 3.15Å; R547-D551 VanDerWaalsContact CD-OD2 3.24Å; R547-D551 WeakPolarHBondContact CD-OD2 3.36Å; R547-D551 HydrophobicContact CG-CB 3.58Å; R547-D551 WeakPolarHBondContact CG-OD2 3.43Å; R547-D551 WeakPolarHBondContact O-CA 3.37Å; R547-D551 WeakPolarHBondContact O-CB 3.41Å; R547-D551 PolarHBondContact O-N 2.89Å
548	D	85.9	Confident	69.1	Low	105 Å²	105	86 Å²	86	56%	0.561	48%	0.483	S	S	*	.	H	α-helix	trans	-32.9	-60.4	174.2	-120.3	31.1	0	0	0	112.4	T544 I545 L550 E552	T544-D548 PolarHBondContact O-N 2.99Å; I545-D548 VanDerWaalsContact O-CB 3.32Å; I545-D548 WeakPolarHBondContact O-CB 3.22Å; I545-D548 PolarHBondContact O-N 2.94Å; D548-L550 PolarHBondContact O-N 3.05Å; D548-E552 WeakPolarHBondContact O-CB 3.32Å; D548-E552 VanDerWaalsContact O-CG 3.27Å; D548-E552 WeakPolarHBondContact O-CG 3.37Å; D548-E552 PolarHBondContact O-N 2.91Å
549	I	82.3	Confident	66.5	Low	38 Å²	38	92.8 Å²	92.8	20%	0.195	51%	0.513	C	S	.	.	H	α-helix	trans	-72.7	-21.4	-172	-65	167.6	0	0	0	114.4	L330 K369 F370 I545 R547	L330-I549 HydrophobicContact CD1-CG2 4.06Å; K369-I549 HydrophobicContact CB-CD1 4.08Å; K369-I549 HydrophobicContact CG-CG2 4.23Å; F370-I549 HydrophobicContact CE1-CD1 4.45Å; F370-I549 HydrophobicContact CE2-CD1 3.59Å; F370-I549 HydrophobicContact CZ-CD1 3.52Å; I545-I549 HydrophobicContact CG2-CD1 3.61Å; I545-I549 HydrophobicContact CG2-CG1 4.42Å; I545-I549 WeakPolarHBondContact O-CG1 3.22Å; I545-I549 PolarHBondContact O-N 2.95Å; R547-I549 VanDerWaalsContact C-N 3.29Å; R547-I549 PolarHBondContact O-N 3.36Å
550	L	78.4	Confident	64.1	Low	67 Å²	67	99.8 Å²	99.8	35%	0.351	55%	0.546	S	S	.	.	H	α-helix	trans	-109.9	-19.7	-177.5	-66.9	170.1	0	0	0	113.5	Q331 K546 R547 D548	Q331-L550 HydrophobicContact CG-CD1 4.39Å; K546-L550 HydrophobicContact CG-CD1 3.82Å; K546-L550 WeakPolarHBondContact O-CB 3.49Å; K546-L550 PolarHBondContact O-N 2.97Å; R547-L550 PolarHBondContact O-N 3.15Å; D548-L550 PolarHBondContact O-N 3.05Å
551	D	61	Low	61.3	Low	68 Å²	68	98.3 Å²	98.3	36%	0.364	56%	0.561	S	S	.	*	H	α-helix	trans	-102.2	-15.5	-172.6	-150.7	32.1	0	0	0	111.3	R547 G553 S554	R547-D551 VanDerWaalsContact CD-OD2 3.24Å; R547-D551 WeakPolarHBondContact CD-OD2 3.36Å; R547-D551 HydrophobicContact CG-CB 3.58Å; R547-D551 WeakPolarHBondContact CG-OD2 3.43Å; R547-D551 WeakPolarHBondContact O-CA 3.37Å; R547-D551 WeakPolarHBondContact O-CB 3.41Å; R547-D551 PolarHBondContact O-N 2.89Å; D551-G553 PolarHBondContact O-N 3.22Å; D551-G553 VanDerWaalsContact O-N 3.12Å; D551-S554 CarbonylContact O-C 3.52Å; D551-S554 WeakPolarHBondContact O-CA 3.29Å; D551-S554 PolarHBondContact O-N 2.95Å; D551-S554 WeakPolarHBondContact OD1-CB 3.28Å
552	E	48.7	Very low	58.5	Low	140 Å²	140	102 Å²	102	65%	0.654	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57	-18	162.9	-86.8	-178.2	152.4	0	0	112.9	D548	D548-E552 WeakPolarHBondContact O-CB 3.32Å; D548-E552 VanDerWaalsContact O-CG 3.27Å; D548-E552 WeakPolarHBondContact O-CG 3.37Å; D548-E552 PolarHBondContact O-N 2.91Å
553	G	39.7	Very low	55.9	Low	79 Å²	79	104.7 Å²	104.7	81%	0.814	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97	6.7	170	0	0	0	0	0	115	D551	D551-G553 PolarHBondContact O-N 3.22Å; D551-G553 VanDerWaalsContact O-N 3.12Å
554	S	37.3	Very low	53.2	Low	73 Å²	73	105.1 Å²	105.1	51%	0.51	63%	0.634	S	S	.	*			trans	-132.5	31.7	-172.2	-171.7	0	0	0	0	112	D551 D556	D551-S554 CarbonylContact O-C 3.52Å; D551-S554 WeakPolarHBondContact O-CA 3.29Å; D551-S554 PolarHBondContact O-N 2.95Å; D551-S554 WeakPolarHBondContact OD1-CB 3.28Å; S554-D556 VanDerWaalsContact C-N 3.28Å; S554-D556 PolarHBondContact O-N 3.2Å
555	S	34.1	Very low	50.5	Low	104 Å²	104	108 Å²	108	73%	0.727	65%	0.647	S	S	*	*			trans	-81.1	66.5	178.2	-70.3	0	0	0	0	113.2
556	D	31.8	Very low	47.8	Very low	151 Å²	151	111.7 Å²	111.7	81%	0.807	67%	0.667	S	S	*	*			trans	-117.3	122.6	135.2	-173	24.6	0	0	0	108.2	S554	S554-D556 VanDerWaalsContact C-N 3.28Å; S554-D556 PolarHBondContact O-N 3.2Å
557	S	38.4	Very low	45.1	Very low	110 Å²	110	117 Å²	117	77%	0.769	69%	0.693	S	S	*	*			trans	-124	71.9	-168.3	17.6	0	0	0	0	111.3
558	G	34.5	Very low	42.5	Very low	67 Å²	67	117 Å²	117	69%	0.691	70%	0.704	S	S	*	*			trans	-89.5	97.4	173.3	0	0	0	0	0	113.5
559	E	31.8	Very low	39.8	Very low	198 Å²	198	121.7 Å²	121.7	93%	0.925	72%	0.723	S	S	*	*			trans	65	144.9	164.8	-57.5	-166.6	118.1	0	0	119.3
560	E	36.3	Very low	37.5	Very low	189 Å²	189	129 Å²	129	88%	0.883	76%	0.756	S	S	*	*			trans	-107.9	126.5	171.5	-75.7	-166.5	179.1	0	0	111.3
561	G	30.2	Very low	35	Very low	81 Å²	81	135.2 Å²	135.2	84%	0.835	78%	0.784	S	S	*	*			trans	79	106.2	132.3	0	0	0	0	0	120.7
562	D	30.4	Very low	33.6	Very low	175 Å²	175	139.9 Å²	139.9	94%	0.936	81%	0.808	S	S	*	*				-147.9	177	114	-156.4	-3.4	0	0	0	108.8
563	G	34.1	Very low	32.6	Very low	68 Å²	68	142.9 Å²	142.9	70%	0.701	82%	0.822	S	S	*	*			trans	-149.3	136.7	-178.3	0	0	0	0	0	116.4
564	S	30.5	Very low	32.1	Very low	125 Å²	125	145 Å²	145	87%	0.874	82%	0.815	S	S	*	*			trans	-151.2	168.6	166	63.8	0	0	0	0	111.9
565	D	31.7	Very low	31.8	Very low	147 Å²	147	149.3 Å²	149.3	79%	0.786	83%	0.827	S	S	*	*			trans	-77.6	176.3	-172.3	-83.1	-52.9	0	0	0	116.2
566	D	31.2	Very low	31.7	Very low	141 Å²	141	153.2 Å²	153.2	75%	0.754	83%	0.834	S	S	*	*			trans	97.2	114.5	148.1	-64.8	-30.8	0	0	0	122.3
567	E	31.5	Very low	32	Very low	176 Å²	176	150.2 Å²	150.2	82%	0.822	83%	0.83	S	S	*	*			trans	54.9	119.4	136.1	-55.5	-169.1	152.8	0	0	123.5
568	D	32	Very low	32	Very low	155 Å²	155	149.2 Å²	149.2	83%	0.829	84%	0.838	S	S	*	*			trans	27.4	122.4	138.4	-56.1	-10.2	0	0	0	122.1
569	E	30.3	Very low	32.2	Very low	204 Å²	204	154.4 Å²	154.4	95%	0.953	84%	0.844	S	S	*	*				-166.3	167.7	115.5	-108.9	175.6	-173.8	0	0	112.3
570	E	33	Very low	32.7	Very low	190 Å²	190	153 Å²	153	89%	0.888	84%	0.843	S	S	*	*			trans	-98.3	143.7	-176	-58.3	178.7	154.3	0	0	112.5
571	E	26	Very low	33.1	Very low	199 Å²	199	150.9 Å²	150.9	93%	0.93	83%	0.833	S	S	*	*				-174.4	159.5	126.5	-105.2	178.7	-177.3	0	0	111.9
572	D	32.6	Very low	33.9	Very low	165 Å²	165	156 Å²	156	88%	0.882	83%	0.832	S	S	*	*			trans	-76.2	135.6	-178.4	-65.6	-74	0	0	0	113
573	E	27	Very low	35.3	Very low	203 Å²	203	152.9 Å²	152.9	95%	0.949	82%	0.819	S	S	*	*			trans	-150	171.1	139.1	-125.1	169.7	-151.2	0	0	111.5
574	N	29.3	Very low	36.5	Very low	125 Å²	125	153.4 Å²	153.4	67%	0.668	81%	0.809	S	S	*	*			trans	-120.8	162.1	-149.9	173.7	56.3	0	0	0	113.7
575	E	31.7	Very low	38.7	Very low	162 Å²	162	154.6 Å²	154.6	76%	0.757	80%	0.804	S	S	*	*			trans	66.2	153.5	-179.7	-73.7	141.4	-152.7	0	0	114.3
576	E	31.3	Very low	40.7	Very low	186 Å²	186	155.1 Å²	155.1	87%	0.869	80%	0.799	S	S	*	*			cis	-142.5	149.3	15.3	-151.2	166.8	-135.6	0	0	110.5
577	A	38.4	Very low	42.9	Very low	88 Å²	88	152.2 Å²	152.2	73%	0.727	78%	0.784	S	S	*	*			trans	-101.5	113.6	-171.9	0	0	0	0	0	113.2	E579	A577-E579 PolarHBondContact O-N 3.02Å; A577-E579 VanDerWaalsContact O-N 3.1Å
578	G	37.2	Very low	45.5	Very low	90 Å²	90	153.2 Å²	153.2	93%	0.928	79%	0.785	S	S	*	*			trans	-82.9	61.6	-179.9	0	0	0	0	0	115.5
579	E	39.6	Very low	47.7	Very low	175 Å²	175	150.3 Å²	150.3	82%	0.818	77%	0.773	S	S	*	*	S	Bend	trans	-105.9	165.4	159.3	-73.9	-166.6	158.3	0	0	110.3	A577 E581	A577-E579 PolarHBondContact O-N 3.02Å; A577-E579 VanDerWaalsContact O-N 3.1Å; E579-E581 VanDerWaalsContact C-N 3.33Å; E579-E581 PolarHBondContact O-N 3.05Å
580	D	41.5	Very low	50.2	Low	170 Å²	170	146.4 Å²	146.4	91%	0.909	76%	0.755	S	S	*	*			trans	-61.5	89.8	171.3	-86	-54.3	0	0	0	110.9	K582	D580-K582 PolarHBondContact O-N 3.16Å
581	E	44.8	Very low	52.8	Low	143 Å²	143	141.4 Å²	141.4	67%	0.668	74%	0.737	S	S	*	*			trans	-59.9	97.2	173.6	-87.3	-136.1	128	0	0	110.6	E579 V583	E579-E581 VanDerWaalsContact C-N 3.33Å; E579-E581 PolarHBondContact O-N 3.05Å; E581-V583 PolarHBondContact O-N 2.67Å
582	K	47.5	Very low	55.6	Low	189 Å²	189	137.8 Å²	137.8	82%	0.822	73%	0.725	S	S	*	*			trans	-56.5	86.8	143.8	-69.3	170.7	-176	158.3	0	106.9	D580 T584	D580-K582 PolarHBondContact O-N 3.16Å; K582-T584 WeakPolarHBondContact O-CA 3.35Å; K582-T584 WeakPolarHBondContact O-CG2 3.25Å; K582-T584 PolarHBondContact O-N 3.03Å
583	V	60.8	Low	58.1	Low	110 Å²	110	131.5 Å²	131.5	67%	0.667	69%	0.691	S	S	*	*			trans	-38.6	100.4	-174.7	179.5	0	0	0	0	109.9	E581 I585	E581-V583 PolarHBondContact O-N 2.67Å; V583-I585 VanDerWaalsContact C-N 3.35Å; V583-I585 HydrophobicContact CG1-CG1 4.38Å; V583-I585 PolarHBondContact O-N 2.71Å
584	T	58.2	Low	61.1	Low	78 Å²	78	126 Å²	126	48%	0.479	67%	0.671	S	S	.	*			trans	-81.5	89.6	-169	36.8	0	0	0	0	107.4	K582 F586	K582-T584 WeakPolarHBondContact O-CA 3.35Å; K582-T584 WeakPolarHBondContact O-CG2 3.25Å; K582-T584 PolarHBondContact O-N 3.03Å; T584-F586 VanDerWaalsContact C-N 3.28Å; T584-F586 WeakPolarHBondContact O-CD2 3.35Å; T584-F586 WeakPolarHBondContact O-CE2 3.08Å; T584-F586 PolarHBondContact O-N 2.81Å; T584-F586 WeakPolarHBondContact OG1-CE2 3.41Å
585	I	76.9	Confident	63.9	Low	151 Å²	151	122.2 Å²	122.2	77%	0.774	66%	0.657	S	S	*	*			trans	-66.3	91.7	179.3	-56.4	177.9	0	0	0	108.3	V583 D587	V583-I585 VanDerWaalsContact C-N 3.35Å; V583-I585 HydrophobicContact CG1-CG1 4.38Å; V583-I585 PolarHBondContact O-N 2.71Å; I585-D587 VanDerWaalsContact C-N 3.34Å; I585-D587 PolarHBondContact O-N 2.98Å
586	F	74.8	Confident	66.7	Low	158 Å²	158	115.2 Å²	115.2	69%	0.693	62%	0.624	S	S	*	*			trans	-64.9	91.9	174.8	-68.9	-77.7	0	0	0	109.6	T584 K588	T584-F586 VanDerWaalsContact C-N 3.28Å; T584-F586 WeakPolarHBondContact O-CD2 3.35Å; T584-F586 WeakPolarHBondContact O-CE2 3.08Å; T584-F586 PolarHBondContact O-N 2.81Å; T584-F586 WeakPolarHBondContact OG1-CE2 3.41Å; F586-K588 PolarHBondContact O-N 3.04Å
587	D	77.4	Confident	69.5	Low	79 Å²	79	111.3 Å²	111.3	42%	0.422	60%	0.601	S	S	.	*			trans	-68.1	92.8	-178.6	-179.2	20.6	0	0	0	111.8	I585 T589	I585-D587 VanDerWaalsContact C-N 3.34Å; I585-D587 PolarHBondContact O-N 2.98Å; D587-T589 PolarHBondContact O-N 3.04Å; D587-T589 WeakPolarHBondContact OD1-CA 3.41Å; D587-T589 VanDerWaalsContact OD1-CB 3.27Å; D587-T589 WeakPolarHBondContact OD1-CB 3.24Å; D587-T589 PolarHBondContact OD1-N 3.13Å; D587-T589 PolarHBondContact OD1-OG1 3.19Å
588	K	85.3	Confident	72	Confident	197 Å²	197	115.6 Å²	115.6	86%	0.857	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.2	7.8	172.5	-62.9	178.3	-177.5	176.2	0	113.3	F586	F586-K588 PolarHBondContact O-N 3.04Å
589	T	77.6	Confident	74.6	Confident	95 Å²	95	114.2 Å²	114.2	58%	0.583	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.9	-5.5	-174.7	75.2	0	0	0	0	114.5	D587 V591	D587-T589 PolarHBondContact O-N 3.04Å; D587-T589 WeakPolarHBondContact OD1-CA 3.41Å; D587-T589 VanDerWaalsContact OD1-CB 3.27Å; D587-T589 WeakPolarHBondContact OD1-CB 3.24Å; D587-T589 PolarHBondContact OD1-N 3.13Å; D587-T589 PolarHBondContact OD1-OG1 3.19Å; T589-V591 PolarHBondContact O-N 2.75Å; T589-V591 VanDerWaalsContact OG1-CG2 3.28Å; T589-V591 WeakPolarHBondContact OG1-CG2 3.46Å
590	E	84.1	Confident	77.1	Confident	121 Å²	121	105.9 Å²	105.9	57%	0.565	53%	0.534	S	S	*	.			trans	52.3	24.4	176	-65.4	-173.6	-178.1	0	0	114.6	N592 L593 V594	E590-N592 PolarHBondContact O-N 2.92Å; E590-N592 VanDerWaalsContact O-N 3.15Å; E590-L593 HydrophobicContact CB-CB 4.35Å; E590-L593 WeakPolarHBondContact O-CB 3.33Å; E590-L593 PolarHBondContact O-N 3.03Å; E590-V594 PolarHBondContact O-N 3.11Å
591	V	86.6	Confident	79.6	Confident	85 Å²	85	103.1 Å²	103.1	52%	0.515	51%	0.511	S	S	.	.	H	α-helix	trans	-59.7	-35.1	-171	164.2	0	0	0	0	112.1	T589 V594 A595	T589-V591 PolarHBondContact O-N 2.75Å; T589-V591 VanDerWaalsContact OG1-CG2 3.28Å; T589-V591 WeakPolarHBondContact OG1-CG2 3.46Å; V591-V594 PolarHBondContact O-N 3.13Å; V591-A595 VanDerWaalsContact O-CB 3.26Å; V591-A595 WeakPolarHBondContact O-CB 3.31Å; V591-A595 PolarHBondContact O-N 3.19Å
592	N	84.8	Confident	81.8	Confident	124 Å²	124	101 Å²	101	66%	0.663	50%	0.504	S	S	*	.	H	α-helix	trans	-63.2	-41.3	175.5	-67.2	-31.4	0	0	0	112.6	E590 A595 F596	E590-N592 PolarHBondContact O-N 2.92Å; E590-N592 VanDerWaalsContact O-N 3.15Å; N592-A595 PolarHBondContact O-N 2.88Å; N592-F596 VanDerWaalsContact O-CB 3.27Å; N592-F596 WeakPolarHBondContact O-CB 3.08Å; N592-F596 PolarHBondContact O-N 2.9Å
593	L	86.3	Confident	84	Confident	32 Å²	32	92.1 Å²	92.1	17%	0.168	47%	0.466	C	S	.	.	H	α-helix	trans	-69.7	-39.8	177.8	174.2	159.4	0	0	0	111	E590 F596 R597 E629	E590-L593 HydrophobicContact CB-CB 4.35Å; E590-L593 WeakPolarHBondContact O-CB 3.33Å; E590-L593 PolarHBondContact O-N 3.03Å; L593-F596 PolarHBondContact O-N 3.24Å; L593-R597 WeakPolarHBondContact O-CG 3.27Å; L593-R597 PolarHBondContact O-N 3.04Å; L593-E629 VanDerWaalsContact CD1-OE1 3.3Å; L593-E629 WeakPolarHBondContact CD1-OE1 3.47Å; L593-E629 WeakPolarHBondContact CG-OE2 3.38Å
594	V	88.7	Confident	85.5	Confident	88 Å²	88	87.4 Å²	87.4	53%	0.533	44%	0.437	S	S	.	.	H	α-helix	trans	-66.2	-40.6	174	178.1	0	0	0	0	111.4	E590 V591 R598	E590-V594 PolarHBondContact O-N 3.11Å; V591-V594 PolarHBondContact O-N 3.13Å; V594-R598 WeakPolarHBondContact O-CB 3.47Å; V594-R598 PolarHBondContact O-N 3.4Å
595	A	89.3	Confident	87	Confident	46 Å²	46	89.3 Å²	89.3	38%	0.38	44%	0.44	S	S	.	.	H	α-helix	trans	-66.2	-40.3	175.5	0	0	0	0	0	112.2	V591 N592 R598 T599	V591-A595 VanDerWaalsContact O-CB 3.26Å; V591-A595 WeakPolarHBondContact O-CB 3.31Å; V591-A595 PolarHBondContact O-N 3.19Å; N592-A595 PolarHBondContact O-N 2.88Å; A595-R598 PolarHBondContact O-N 2.87Å; A595-T599 WeakPolarHBondContact O-CB 3.48Å; A595-T599 PolarHBondContact O-N 3.4Å; A595-T599 PolarHBondContact O-OG1 3.14Å
596	F	89.4	Confident	87.7	Confident	15 Å²	15	85.6 Å²	85.6	7%	0.066	43%	0.428	C	S	.	.	H	α-helix	trans	-59.6	-54.5	173.3	175.5	-107.5	0	0	0	111.4	N592 L593 R598 T599 I600 F622 Q626 E629 L630	N592-F596 VanDerWaalsContact O-CB 3.27Å; N592-F596 WeakPolarHBondContact O-CB 3.08Å; N592-F596 PolarHBondContact O-N 2.9Å; L593-F596 PolarHBondContact O-N 3.24Å; F596-R598 VanDerWaalsContact C-N 3.3Å; F596-R598 PolarHBondContact O-N 3.39Å; F596-T599 WeakPolarHBondContact O-CB 3.31Å; F596-T599 PolarHBondContact O-N 2.96Å; F596-I600 HydrophobicContact CD1-CD1 3.84Å; F596-I600 HydrophobicContact CD2-CD1 4.4Å; F596-I600 HydrophobicContact CE1-CD1 3.41Å; F596-I600 VanDerWaalsContact CE1-CD1 3.41Å; F596-I600 HydrophobicContact CE2-CD1 4.05Å; F596-I600 HydrophobicContact CG-CD1 4.31Å; F596-I600 HydrophobicContact CZ-CD1 3.53Å; F596-I600 HydrophobicContact CZ-CG1 4.46Å; F596-I600 WeakPolarHBondContact O-CG1 3.33Å; F596-I600 PolarHBondContact O-N 3.43Å; F596-F622 HydrophobicContact CD2-CD1 4.19Å; F596-F622 HydrophobicContact CD2-CE1 4.23Å; F596-F622 HydrophobicContact CE2-CB 4.18Å; F596-F622 AromaticContact CE2-CD1 3.54Å; F596-F622 HydrophobicContact CE2-CD1 3.54Å; F596-F622 HydrophobicContact CE2-CD2 4.28Å; F596-F622 AromaticContact CE2-CE1 3.82Å; F596-F622 HydrophobicContact CE2-CE1 3.82Å; F596-F622 AromaticContact CE2-CG 3.76Å; F596-F622 HydrophobicContact CE2-CG 3.76Å; F596-F622 HydrophobicContact CE2-CZ 4.3Å; F596-F622 HydrophobicContact CZ-CG 4.41Å; F596-Q626 HydrophobicContact CE1-CB 3.96Å; F596-Q626 HydrophobicContact CE2-CB 4.03Å; F596-Q626 HydrophobicContact CZ-CB 3.56Å; F596-Q626 HydrophobicContact CZ-CG 4.47Å; F596-E629 HydrophobicContact CD1-CB 4.39Å; F596-E629 HydrophobicContact CE1-CB 3.76Å; F596-L630 HydrophobicContact CZ-CB 4.35Å
597	R	90.9	Very high	88.5	Confident	104 Å²	104	78.9 Å²	78.9	39%	0.392	40%	0.4	S	S	.	.	H	α-helix	trans	-57.1	-40.9	175.7	-70.3	-179.2	-172.1	-171.8	6.7	112.4	L593 T599 I600 Y601 M633	L593-R597 WeakPolarHBondContact O-CG 3.27Å; L593-R597 PolarHBondContact O-N 3.04Å; R597-T599 VanDerWaalsContact C-N 3.33Å; R597-T599 PolarHBondContact O-N 2.95Å; R597-I600 PolarHBondContact O-N 2.87Å; R597-Y601 PolarHBondContact O-N 2.92Å; R597-M633 HydrophobicContact CB-CG 4.21Å; R597-M633 HydrophobicContact CG-CG 4.2Å; R597-M633 WeakPolarHBondContact O-CE 3.27Å
598	R	91.2	Very high	89.1	Confident	177 Å²	177	82 Å²	82	67%	0.668	42%	0.416	S	S	*	.	H	α-helix	trans	-64.1	-36.9	175.5	-174.8	177	-177.8	174.4	0.9	112.4	V594 A595 F596 Y601 L602	V594-R598 WeakPolarHBondContact O-CB 3.47Å; V594-R598 PolarHBondContact O-N 3.4Å; A595-R598 PolarHBondContact O-N 2.87Å; F596-R598 VanDerWaalsContact C-N 3.3Å; F596-R598 PolarHBondContact O-N 3.39Å; R598-Y601 PolarHBondContact O-N 2.8Å; R598-L602 HydrophobicContact CG-CD1 4.17Å; R598-L602 VanDerWaalsContact O-CG 3.31Å; R598-L602 WeakPolarHBondContact O-CG 3.44Å; R598-L602 PolarHBondContact O-N 3.44Å
599	T	91.5	Very high	89.4	Confident	62 Å²	62	77.6 Å²	77.6	38%	0.38	40%	0.402	S	S	.	.	H	α-helix	trans	-66.7	-45.1	177.8	-58.7	0	0	0	0	110.9	A595 F596 R597 L602 A603 M620	A595-T599 WeakPolarHBondContact O-CB 3.48Å; A595-T599 PolarHBondContact O-N 3.4Å; A595-T599 PolarHBondContact O-OG1 3.14Å; F596-T599 WeakPolarHBondContact O-CB 3.31Å; F596-T599 PolarHBondContact O-N 2.96Å; R597-T599 VanDerWaalsContact C-N 3.33Å; R597-T599 PolarHBondContact O-N 2.95Å; T599-L602 PolarHBondContact O-N 3.23Å; T599-A603 WeakPolarHBondContact O-CB 3.4Å; T599-A603 PolarHBondContact O-N 3.4Å; T599-M620 HydrophobicContact CG2-CE 4.41Å; T599-M620 HydrophobicContact CG2-SD 4.02Å
600	I	92.1	Very high	90.1	Very high	0 Å²	0	75.3 Å²	75.3	0%	0	38%	0.384	C	S	.	.	H	α-helix	trans	-62.4	-43.6	174.5	-58.1	161.7	0	0	0	110.8	F596 R597 L602 A603 I604 L617 F622 L630 M633	F596-I600 HydrophobicContact CD1-CD1 3.84Å; F596-I600 HydrophobicContact CD2-CD1 4.4Å; F596-I600 HydrophobicContact CE1-CD1 3.41Å; F596-I600 VanDerWaalsContact CE1-CD1 3.41Å; F596-I600 HydrophobicContact CE2-CD1 4.05Å; F596-I600 HydrophobicContact CG-CD1 4.31Å; F596-I600 HydrophobicContact CZ-CD1 3.53Å; F596-I600 HydrophobicContact CZ-CG1 4.46Å; F596-I600 WeakPolarHBondContact O-CG1 3.33Å; F596-I600 PolarHBondContact O-N 3.43Å; R597-I600 PolarHBondContact O-N 2.87Å; I600-L602 VanDerWaalsContact C-N 3.32Å; I600-L602 PolarHBondContact O-N 3.12Å; I600-A603 WeakPolarHBondContact O-CB 3.25Å; I600-A603 PolarHBondContact O-N 3.01Å; I600-I604 HydrophobicContact CG2-CD1 3.82Å; I600-I604 HydrophobicContact CG2-CG1 4.35Å; I600-I604 WeakPolarHBondContact O-CG1 3.47Å; I600-I604 PolarHBondContact O-N 3.45Å; I600-L617 HydrophobicContact CB-CD2 4.4Å; I600-L617 HydrophobicContact CG1-CD2 4.38Å; I600-L617 HydrophobicContact CG2-CD2 3.89Å; I600-F622 HydrophobicContact CG1-CE2 4.43Å; I600-F622 HydrophobicContact CG1-CZ 4.22Å; I600-L630 HydrophobicContact CB-CD1 4.41Å; I600-L630 HydrophobicContact CD1-CB 4.24Å; I600-L630 HydrophobicContact CD1-CD1 3.65Å; I600-L630 HydrophobicContact CG1-CD1 3.86Å; I600-L630 HydrophobicContact CG2-CD1 3.6Å; I600-M633 HydrophobicContact CB-CG 4.05Å; I600-M633 HydrophobicContact CB-SD 3.67Å; I600-M633 HydrophobicContact CD1-CB 4.16Å; I600-M633 HydrophobicContact CD1-CG 4.13Å; I600-M633 HydrophobicContact CG2-CB 4.39Å; I600-M633 HydrophobicContact CG2-CG 4.04Å; I600-M633 HydrophobicContact CG2-SD 3.32Å; I600-M633 WeakPolarHBondContact CG2-SD 3.22Å
601	Y	92.8	Very high	90.4	Very high	111 Å²	111	73.4 Å²	73.4	44%	0.435	38%	0.375	S	S	.	.	H	α-helix	trans	-56.3	-47.1	176.8	-175.5	-113.9	0	0	0	111.9	R597 R598 I604 Q605 M633	R597-Y601 PolarHBondContact O-N 2.92Å; R598-Y601 PolarHBondContact O-N 2.8Å; Y601-I604 PolarHBondContact O-N 2.69Å; Y601-Q605 VanDerWaalsContact O-CB 3.25Å; Y601-Q605 WeakPolarHBondContact O-CB 3.45Å; Y601-Q605 PolarHBondContact O-N 3.17Å; Y601-M633 HydrophobicContact CD2-CE 4.01Å; Y601-M633 HydrophobicContact CG-CE 4.21Å
602	L	92.7	Very high	90.7	Very high	98 Å²	98	73 Å²	73	51%	0.513	37%	0.368	S	S	.	.	H	α-helix	trans	-68.5	-36.6	178.7	-68.7	170.6	0	0	0	111.8	R598 T599 I600 S606	R598-L602 HydrophobicContact CG-CD1 4.17Å; R598-L602 VanDerWaalsContact O-CG 3.31Å; R598-L602 WeakPolarHBondContact O-CG 3.44Å; R598-L602 PolarHBondContact O-N 3.44Å; T599-L602 PolarHBondContact O-N 3.23Å; I600-L602 VanDerWaalsContact C-N 3.32Å; I600-L602 PolarHBondContact O-N 3.12Å; L602-S606 WeakPolarHBondContact O-CB 3.43Å; L602-S606 PolarHBondContact O-N 3.39Å; L602-S606 PolarHBondContact O-OG 2.91Å; L602-S606 VanDerWaalsContact O-OG 3.13Å
603	A	91.9	Very high	91.1	Very high	4 Å²	4	67.1 Å²	67.1	3%	0.033	34%	0.336	C	S	.	.	H	α-helix	trans	-59.1	-52.4	173.2	0	0	0	0	0	111.1	T599 I600 S606 S607 L617 M620	T599-A603 WeakPolarHBondContact O-CB 3.4Å; T599-A603 PolarHBondContact O-N 3.4Å; I600-A603 WeakPolarHBondContact O-CB 3.25Å; I600-A603 PolarHBondContact O-N 3.01Å; A603-S606 PolarHBondContact O-N 3.35Å; A603-S606 PolarHBondContact O-OG 3.46Å; A603-S607 PolarHBondContact O-N 3.48Å; A603-L617 HydrophobicContact CB-CD2 3.71Å; A603-L617 HydrophobicContact CB-CG 4.32Å; A603-M620 HydrophobicContact CB-CE 4.17Å; A603-M620 HydrophobicContact CB-SD 4.43Å
604	I	92.4	Very high	91.3	Very high	10 Å²	10	65.7 Å²	65.7	5%	0.051	33%	0.329	C	S	.	.	H	α-helix	trans	-58.5	-51.2	176.9	-68.6	170.9	0	0	0	111.2	I600 Y601 S606 S607 L617 M633 I634 F647 F648	I600-I604 HydrophobicContact CG2-CD1 3.82Å; I600-I604 HydrophobicContact CG2-CG1 4.35Å; I600-I604 WeakPolarHBondContact O-CG1 3.47Å; I600-I604 PolarHBondContact O-N 3.45Å; Y601-I604 PolarHBondContact O-N 2.69Å; I604-S606 PolarHBondContact O-N 3.15Å; I604-S607 PolarHBondContact O-N 3.19Å; I604-S607 PolarHBondContact O-OG 2.99Å; I604-L617 HydrophobicContact CG1-CD1 4.42Å; I604-M633 HydrophobicContact CD1-SD 4.18Å; I604-I634 HydrophobicContact CD1-CG1 4.14Å; I604-F647 HydrophobicContact CG2-CE1 4.07Å; I604-F648 HydrophobicContact CG2-CE1 4.04Å; I604-F648 HydrophobicContact CG2-CZ 4.29Å
605	Q	89.9	Confident	91.4	Very high	119 Å²	119	67.3 Å²	67.3	56%	0.556	33%	0.331	S	S	*	.	H	α-helix	trans	-71.4	-16.8	-175.4	-166.6	57.4	84.6	0	0	113.4	Y601	Y601-Q605 VanDerWaalsContact O-CB 3.25Å; Y601-Q605 WeakPolarHBondContact O-CB 3.45Å; Y601-Q605 PolarHBondContact O-N 3.17Å
606	S	92.6	Very high	91.5	Very high	72 Å²	72	67.9 Å²	67.9	50%	0.503	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.8	-10.3	176.3	77	0	0	0	0	114.9	L602 A603 I604 K616	L602-S606 WeakPolarHBondContact O-CB 3.43Å; L602-S606 PolarHBondContact O-N 3.39Å; L602-S606 PolarHBondContact O-OG 2.91Å; L602-S606 VanDerWaalsContact O-OG 3.13Å; A603-S606 PolarHBondContact O-N 3.35Å; A603-S606 PolarHBondContact O-OG 3.46Å; I604-S606 PolarHBondContact O-N 3.15Å; S606-K616 PolarHBondContact O-NZ 3.11Å; S606-K616 PolarHBondContact OG-NZ 3.2Å
607	S	91.8	Very high	91.6	Very high	17 Å²	17	67.2 Å²	67.2	12%	0.119	32%	0.322	C	S	.	.			trans	-97.9	147.9	179.9	56.4	0	0	0	0	111.6	A603 I604 E612 C613	A603-S607 PolarHBondContact O-N 3.48Å; I604-S607 PolarHBondContact O-N 3.19Å; I604-S607 PolarHBondContact O-OG 2.99Å; S607-E612 VanDerWaalsContact CA-OE2 3.31Å; S607-E612 WeakPolarHBondContact CA-OE2 3.38Å; S607-C613 WeakPolarHBondContact OG-CB 3.27Å; S607-C613 PolarHBondContact OG-SG 3.32Å; S607-C613 VanDerWaalsContact OG-SG 3.37Å
608	L	88.4	Confident	91.5	Very high	145 Å²	145	65.8 Å²	65.8	76%	0.759	32%	0.321	S	S	*	.	S	Bend	trans	-94.6	-41.3	173.9	-173.3	64.9	0	0	0	111.7	E612	L608-E612 PolarHBondContact N-OE2 2.93Å
609	D	92.5	Very high	91.4	Very high	104 Å²	104	64.8 Å²	64.8	56%	0.556	32%	0.322	S	S	*	.	S	Bend	trans	-113.5	149.2	-177	-84.8	-50.3	0	0	0	112.4	E611 E612 C613	D609-E611 VanDerWaalsContact C-N 3.34Å; D609-E611 PolarHBondContact O-N 3.31Å; D609-E612 HydrophobicContact CB-CB 4.44Å; D609-E612 WeakPolarHBondContact O-CB 3.41Å; D609-E612 PolarHBondContact O-N 3.24Å; D609-E612 VanDerWaalsContact O-N 3.13Å; D609-C613 PolarHBondContact O-N 2.79Å
610	F	91.3	Very high	91.1	Very high	48 Å²	48	65.9 Å²	65.9	21%	0.211	32%	0.323	C	S	.	.	H	α-helix	trans	-66.3	-30.8	-175.1	73.1	-83.4	0	0	0	113.6	C613 A614 F647 L650 L651 R654	F610-C613 PolarHBondContact O-N 3.05Å; F610-A614 WeakPolarHBondContact O-CB 3.38Å; F610-A614 PolarHBondContact O-N 3.44Å; F610-F647 HydrophobicContact CB-CD2 4.1Å; F610-F647 HydrophobicContact CB-CE2 4.17Å; F610-L650 HydrophobicContact CB-CB 4.26Å; F610-L650 HydrophobicContact CD1-CB 3.83Å; F610-L650 HydrophobicContact CD1-CD1 3.97Å; F610-L650 HydrophobicContact CD1-CG 4.49Å; F610-L650 HydrophobicContact CD2-CB 3.74Å; F610-L650 HydrophobicContact CE1-CB 4.11Å; F610-L650 HydrophobicContact CE1-CD1 3.95Å; F610-L650 HydrophobicContact CE1-CG 4.47Å; F610-L650 HydrophobicContact CE2-CB 4.02Å; F610-L650 HydrophobicContact CG-CB 3.65Å; F610-L650 HydrophobicContact CZ-CB 4.2Å; F610-L651 HydrophobicContact CB-CB 4.08Å; F610-R654 HydrophobicContact CD2-CB 4.41Å; F610-R654 HydrophobicContact CE2-CB 4.49Å
611	E	91.3	Very high	90.5	Very high	81 Å²	81	72.5 Å²	72.5	38%	0.379	36%	0.359	S	S	.	.	H	α-helix	trans	-70.1	-37.2	172.8	-67.6	-72.2	161.7	0	0	111.6	D609 C613 H615 R654	D609-E611 VanDerWaalsContact C-N 3.34Å; D609-E611 PolarHBondContact O-N 3.31Å; E611-C613 VanDerWaalsContact C-N 3.33Å; E611-H615 VanDerWaalsContact O-CB 3.24Å; E611-H615 WeakPolarHBondContact O-CB 3.47Å; E611-H615 PolarHBondContact O-N 2.89Å; E611-R654 VanDerWaalsContact CD-NE 3.27Å; E611-R654 IonicContact OE1-CZ 3.45Å; E611-R654 IonicContact OE1-NE 2.75Å; E611-R654 PolarHBondContact OE1-NE 3.08Å; E611-R654 IonicContact OE1-NH2 3.97Å; E611-R654 IonicContact OE2-CZ 3.68Å; E611-R654 IonicContact OE2-NE 2.75Å; E611-R654 PolarHBondContact OE2-NE 3.32Å; E611-R654 IonicContact OE2-NH2 3.68Å; E611-R654 PolarHBondContact OE2-NH2 2.66Å
612	E	92.3	Very high	90	Very high	76 Å²	76	68.9 Å²	68.9	36%	0.355	35%	0.345	S	S	.	.	H	α-helix	trans	-63.9	-43	174.1	-167.9	-144.5	156.1	0	0	110.2	S607 L608 D609 K616	S607-E612 VanDerWaalsContact CA-OE2 3.31Å; S607-E612 WeakPolarHBondContact CA-OE2 3.38Å; L608-E612 PolarHBondContact N-OE2 2.93Å; D609-E612 HydrophobicContact CB-CB 4.44Å; D609-E612 WeakPolarHBondContact O-CB 3.41Å; D609-E612 PolarHBondContact O-N 3.24Å; D609-E612 VanDerWaalsContact O-N 3.13Å; E612-K616 WeakPolarHBondContact O-CB 3.37Å; E612-K616 WeakPolarHBondContact O-CG 3.38Å; E612-K616 PolarHBondContact O-N 3.08Å; E612-K616 WeakPolarHBondContact OE1-CE 3.41Å; E612-K616 IonicContact OE1-NZ 3.23Å; E612-K616 PolarHBondContact OE1-NZ 3.01Å
613	C	93.1	Very high	89.6	Confident	0 Å²	0	67.6 Å²	67.6	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-63.2	-50.4	175.7	-165.8	0	0	0	0	112.5	S607 D609 F610 E611 H615 K616 L617 F647 L651	S607-C613 WeakPolarHBondContact OG-CB 3.27Å; S607-C613 PolarHBondContact OG-SG 3.32Å; S607-C613 VanDerWaalsContact OG-SG 3.37Å; D609-C613 PolarHBondContact O-N 2.79Å; F610-C613 PolarHBondContact O-N 3.05Å; E611-C613 VanDerWaalsContact C-N 3.33Å; C613-H615 VanDerWaalsContact C-N 3.33Å; C613-H615 PolarHBondContact O-N 3.33Å; C613-K616 WeakPolarHBondContact O-CB 3.37Å; C613-K616 PolarHBondContact O-N 3.24Å; C613-L617 WeakPolarHBondContact O-CB 3.34Å; C613-L617 WeakPolarHBondContact O-CG 3.39Å; C613-L617 PolarHBondContact O-N 2.63Å; C613-F647 HydrophobicContact CB-CE2 4.36Å; C613-F647 HydrophobicContact CB-CZ 3.82Å; C613-L651 HydrophobicContact CB-CD1 3.74Å; C613-L651 WeakPolarHBondContact SG-CD1 3.43Å
614	A	91.2	Very high	89	Confident	2 Å²	2	72 Å²	72	2%	0.017	37%	0.366	C	S	.	.	H	α-helix	trans	-59.3	-45.1	177.6	0	0	0	0	0	110.9	F610 K616 L617 I618 R654 F655	F610-A614 WeakPolarHBondContact O-CB 3.38Å; F610-A614 PolarHBondContact O-N 3.44Å; A614-K616 PolarHBondContact O-N 3Å; A614-L617 PolarHBondContact O-N 3.35Å; A614-I618 WeakPolarHBondContact O-CB 3.25Å; A614-I618 VanDerWaalsContact O-CD1 3.29Å; A614-I618 WeakPolarHBondContact O-CD1 3.48Å; A614-I618 WeakPolarHBondContact O-CG1 3.38Å; A614-I618 PolarHBondContact O-N 3.06Å; A614-R654 HydrophobicContact CB-CG 4.31Å; A614-F655 HydrophobicContact CB-CE2 4.16Å; A614-F655 HydrophobicContact CB-CZ 4.27Å
615	H	90.4	Very high	88.5	Confident	123 Å²	123	76.5 Å²	76.5	57%	0.569	40%	0.398	S	S	*	.	H	α-helix	trans	-63.5	-39.9	176	178.5	-110.4	0	0	0	113	E611 C613 K619	E611-H615 VanDerWaalsContact O-CB 3.24Å; E611-H615 WeakPolarHBondContact O-CB 3.47Å; E611-H615 PolarHBondContact O-N 2.89Å; C613-H615 VanDerWaalsContact C-N 3.33Å; C613-H615 PolarHBondContact O-N 3.33Å; H615-K619 WeakPolarHBondContact O-CB 3.4Å; H615-K619 PolarHBondContact O-N 2.93Å
616	K	92.3	Very high	88.3	Confident	57 Å²	57	73.6 Å²	73.6	25%	0.248	38%	0.384	C	S	.	.	H	α-helix	trans	-59.2	-47.4	172.9	-84.6	169.3	164.4	172.9	0	112	S606 E612 C613 A614 K619 M620	S606-K616 PolarHBondContact O-NZ 3.11Å; S606-K616 PolarHBondContact OG-NZ 3.2Å; E612-K616 WeakPolarHBondContact O-CB 3.37Å; E612-K616 WeakPolarHBondContact O-CG 3.38Å; E612-K616 PolarHBondContact O-N 3.08Å; E612-K616 WeakPolarHBondContact OE1-CE 3.41Å; E612-K616 IonicContact OE1-NZ 3.23Å; E612-K616 PolarHBondContact OE1-NZ 3.01Å; C613-K616 WeakPolarHBondContact O-CB 3.37Å; C613-K616 PolarHBondContact O-N 3.24Å; A614-K616 PolarHBondContact O-N 3Å; K616-K619 PolarHBondContact O-N 3.11Å; K616-M620 WeakPolarHBondContact O-CG 3.31Å; K616-M620 PolarHBondContact O-N 3.16Å
617	L	90.4	Very high	88	Confident	2 Å²	2	70.7 Å²	70.7	1%	0.01	36%	0.364	C	S	.	.	H	α-helix	trans	-69.7	-39.8	-178.5	-71.5	169	0	0	0	112.4	I600 A603 I604 C613 A614 M620 F622 L630 F655	I600-L617 HydrophobicContact CB-CD2 4.4Å; I600-L617 HydrophobicContact CG1-CD2 4.38Å; I600-L617 HydrophobicContact CG2-CD2 3.89Å; A603-L617 HydrophobicContact CB-CD2 3.71Å; A603-L617 HydrophobicContact CB-CG 4.32Å; I604-L617 HydrophobicContact CG1-CD1 4.42Å; C613-L617 WeakPolarHBondContact O-CB 3.34Å; C613-L617 WeakPolarHBondContact O-CG 3.39Å; C613-L617 PolarHBondContact O-N 2.63Å; A614-L617 PolarHBondContact O-N 3.35Å; L617-M620 PolarHBondContact O-N 3.48Å; L617-F622 HydrophobicContact CB-CE2 4.47Å; L617-F622 HydrophobicContact CD2-CE2 4.03Å; L617-F622 HydrophobicContact CD2-CZ 4.36Å; L617-F622 WeakPolarHBondContact O-CE2 3.49Å; L617-L630 HydrophobicContact CD1-CD1 4.39Å; L617-L630 HydrophobicContact CD2-CD1 4.17Å; L617-F655 HydrophobicContact CB-CZ 3.86Å; L617-F655 HydrophobicContact CD1-CE2 3.97Å; L617-F655 HydrophobicContact CD1-CZ 3.91Å
618	I	88.7	Confident	87.9	Confident	73 Å²	73	73.5 Å²	73.5	37%	0.374	37%	0.374	S	S	.	.	H	α-helix	trans	-63.3	-44.3	173.9	-66.9	159.1	0	0	0	110.1	A614 M620 D621 F655 L658	A614-I618 WeakPolarHBondContact O-CB 3.25Å; A614-I618 VanDerWaalsContact O-CD1 3.29Å; A614-I618 WeakPolarHBondContact O-CD1 3.48Å; A614-I618 WeakPolarHBondContact O-CG1 3.38Å; A614-I618 PolarHBondContact O-N 3.06Å; I618-M620 PolarHBondContact O-N 2.99Å; I618-D621 PolarHBondContact O-N 3.07Å; I618-F655 HydrophobicContact CG1-CE1 4.13Å; I618-L658 HydrophobicContact CD1-CD1 3.7Å
619	K	90.1	Very high	87.9	Confident	157 Å²	157	69 Å²	69	68%	0.683	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-6.7	179.1	-176.8	170.8	177.4	-173.9	0	114.3	H615 K616	H615-K619 WeakPolarHBondContact O-CB 3.4Å; H615-K619 PolarHBondContact O-N 2.93Å; K616-K619 PolarHBondContact O-N 3.11Å
620	M	84.3	Confident	87.9	Confident	84 Å²	84	64.1 Å²	64.1	41%	0.414	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.4	-4	170.9	-68.4	173.5	177.9	0	0	113	T599 A603 K616 L617 I618 F622	T599-M620 HydrophobicContact CG2-CE 4.41Å; T599-M620 HydrophobicContact CG2-SD 4.02Å; A603-M620 HydrophobicContact CB-CE 4.17Å; A603-M620 HydrophobicContact CB-SD 4.43Å; K616-M620 WeakPolarHBondContact O-CG 3.31Å; K616-M620 PolarHBondContact O-N 3.16Å; L617-M620 PolarHBondContact O-N 3.48Å; I618-M620 PolarHBondContact O-N 2.99Å; M620-F622 HydrophobicContact CB-CD1 4.04Å; M620-F622 HydrophobicContact CB-CE1 3.46Å; M620-F622 VanDerWaalsContact CB-CE1 3.46Å; M620-F622 HydrophobicContact CB-CE2 3.97Å; M620-F622 HydrophobicContact CB-CZ 3.43Å; M620-F622 VanDerWaalsContact CB-CZ 3.43Å; M620-F622 HydrophobicContact CG-CE1 4.36Å; M620-F622 HydrophobicContact CG-CZ 4.13Å; M620-F622 PolarHBondContact O-N 2.92Å; M620-F622 HydrophobicContact SD-CE1 4.19Å; M620-F622 HydrophobicContact SD-CZ 3.65Å
621	D	80.1	Confident	87.9	Confident	139 Å²	139	61.8 Å²	61.8	74%	0.743	31%	0.313	S	S	*	.			trans	42.6	55.1	171.3	-70.3	-52.5	0	0	0	113.7	I618	I618-D621 PolarHBondContact O-N 3.07Å
622	F	83	Confident	87.9	Confident	35 Å²	35	59.8 Å²	59.8	15%	0.154	30%	0.304	C	S	.	.			trans	-67	143.8	-178.4	-54.9	-55.5	0	0	0	112.5	F596 I600 L617 M620 L630	F596-F622 HydrophobicContact CD2-CD1 4.19Å; F596-F622 HydrophobicContact CD2-CE1 4.23Å; F596-F622 HydrophobicContact CE2-CB 4.18Å; F596-F622 AromaticContact CE2-CD1 3.54Å; F596-F622 HydrophobicContact CE2-CD1 3.54Å; F596-F622 HydrophobicContact CE2-CD2 4.28Å; F596-F622 AromaticContact CE2-CE1 3.82Å; F596-F622 HydrophobicContact CE2-CE1 3.82Å; F596-F622 AromaticContact CE2-CG 3.76Å; F596-F622 HydrophobicContact CE2-CG 3.76Å; F596-F622 HydrophobicContact CE2-CZ 4.3Å; F596-F622 HydrophobicContact CZ-CG 4.41Å; I600-F622 HydrophobicContact CG1-CE2 4.43Å; I600-F622 HydrophobicContact CG1-CZ 4.22Å; L617-F622 HydrophobicContact CB-CE2 4.47Å; L617-F622 HydrophobicContact CD2-CE2 4.03Å; L617-F622 HydrophobicContact CD2-CZ 4.36Å; L617-F622 WeakPolarHBondContact O-CE2 3.49Å; M620-F622 HydrophobicContact CB-CD1 4.04Å; M620-F622 HydrophobicContact CB-CE1 3.46Å; M620-F622 VanDerWaalsContact CB-CE1 3.46Å; M620-F622 HydrophobicContact CB-CE2 3.97Å; M620-F622 HydrophobicContact CB-CZ 3.43Å; M620-F622 VanDerWaalsContact CB-CZ 3.43Å; M620-F622 HydrophobicContact CG-CE1 4.36Å; M620-F622 HydrophobicContact CG-CZ 4.13Å; M620-F622 PolarHBondContact O-N 2.92Å; M620-F622 HydrophobicContact SD-CE1 4.19Å; M620-F622 HydrophobicContact SD-CZ 3.65Å; F622-L630 HydrophobicContact CD2-CD2 4.07Å; F622-L630 HydrophobicContact CE2-CD1 4.48Å; F622-L630 HydrophobicContact CE2-CD2 4.35Å
623	P	84.1	Confident	88	Confident	72 Å²	72	57 Å²	57	47%	0.468	29%	0.292	S	S	.	.			trans	-57.9	142	174	-24	33.8	0	0	0	112.8	S625 Q626	P623-S625 PolarHBondContact O-N 2.96Å; P623-S625 VanDerWaalsContact O-N 3.08Å; P623-Q626 PolarHBondContact O-N 2.95Å
624	D	79.4	Confident	88	Confident	97 Å²	97	57 Å²	57	52%	0.519	29%	0.292	S	S	.	.	G	3₁₀ helix	trans	-60.2	-26.8	-175.1	-64.6	-44.9	0	0	0	113.2	Q626 T627 K659	D624-Q626 VanDerWaalsContact C-N 3.25Å; D624-Q626 PolarHBondContact O-N 3.1Å; D624-T627 WeakPolarHBondContact O-CB 3.45Å; D624-T627 VanDerWaalsContact O-CG2 3.31Å; D624-T627 WeakPolarHBondContact O-CG2 3.26Å; D624-T627 PolarHBondContact O-N 3.38Å; D624-T627 PolarHBondContact O-OG1 2.74Å; D624-K659 IonicContact OD1-NZ 3.53Å; D624-K659 PolarHBondContact OD1-NZ 3.26Å
625	S	81.3	Confident	88	Confident	103 Å²	103	57 Å²	57	72%	0.72	29%	0.291	S	S	*	.	G	3₁₀ helix	trans	-63	-26.3	173.3	54.8	0	0	0	0	114.2	P623	P623-S625 PolarHBondContact O-N 2.96Å; P623-S625 VanDerWaalsContact O-N 3.08Å
626	Q	85.3	Confident	88.1	Confident	58 Å²	58	55 Å²	55	27%	0.271	29%	0.285	S	S	.	.	G	3₁₀ helix	trans	-92.8	-0.1	-179.9	-63.7	-177.9	-24.1	0	0	112.9	F596 P623 D624 K628 E629 L630	F596-Q626 HydrophobicContact CE1-CB 3.96Å; F596-Q626 HydrophobicContact CE2-CB 4.03Å; F596-Q626 HydrophobicContact CZ-CB 3.56Å; F596-Q626 HydrophobicContact CZ-CG 4.47Å; P623-Q626 PolarHBondContact O-N 2.95Å; D624-Q626 VanDerWaalsContact C-N 3.25Å; D624-Q626 PolarHBondContact O-N 3.1Å; Q626-K628 PolarHBondContact O-N 3.35Å; Q626-E629 WeakPolarHBondContact O-CB 3.44Å; Q626-E629 PolarHBondContact O-N 2.68Å; Q626-E629 VanDerWaalsContact O-N 3.14Å; Q626-L630 PolarHBondContact O-N 3.08Å
627	T	86.7	Confident	88	Confident	12 Å²	12	52.9 Å²	52.9	7%	0.074	28%	0.277	C	S	.	.	H	α-helix	trans	-63.3	-39.3	179.7	57.5	0	0	0	0	112.9	D624 E629 L630 C631 Y662	D624-T627 WeakPolarHBondContact O-CB 3.45Å; D624-T627 VanDerWaalsContact O-CG2 3.31Å; D624-T627 WeakPolarHBondContact O-CG2 3.26Å; D624-T627 PolarHBondContact O-N 3.38Å; D624-T627 PolarHBondContact O-OG1 2.74Å; T627-E629 VanDerWaalsContact C-N 3.29Å; T627-E629 PolarHBondContact O-N 3.06Å; T627-L630 WeakPolarHBondContact O-CB 3.41Å; T627-L630 PolarHBondContact O-N 2.82Å; T627-C631 PolarHBondContact O-N 3.05Å; T627-Y662 HydrophobicContact CG2-CD1 4.45Å; T627-Y662 HydrophobicContact CG2-CE1 3.68Å
628	K	89.2	Confident	88.1	Confident	75 Å²	75	52.9 Å²	52.9	33%	0.326	28%	0.277	S	S	.	.	H	α-helix	trans	-61.7	-38	173.4	-174	179.4	179.1	-175.6	0	111.7	Q626 N632 I669 E672	Q626-K628 PolarHBondContact O-N 3.35Å; K628-N632 WeakPolarHBondContact O-CB 3.44Å; K628-N632 PolarHBondContact O-N 2.96Å; K628-N632 PolarHBondContact O-ND2 3.16Å; K628-I669 HydrophobicContact CG-CD1 4.44Å; K628-E672 VanDerWaalsContact CE-OE2 3.27Å; K628-E672 WeakPolarHBondContact CE-OE2 3.25Å; K628-E672 IonicContact NZ-OE1 3.86Å; K628-E672 PolarHBondContact NZ-OE1 3.38Å; K628-E672 IonicContact NZ-OE2 3.64Å; K628-E672 PolarHBondContact NZ-OE2 2.67Å
629	E	90	Very high	88.1	Confident	51 Å²	51	49.6 Å²	49.6	24%	0.238	26%	0.261	C	S	.	.	H	α-helix	trans	-69.7	-38.9	175.6	-70	-168.4	-163.6	0	0	112.3	L593 F596 Q626 T627 N632 M633	L593-E629 VanDerWaalsContact CD1-OE1 3.3Å; L593-E629 WeakPolarHBondContact CD1-OE1 3.47Å; L593-E629 WeakPolarHBondContact CG-OE2 3.38Å; F596-E629 HydrophobicContact CD1-CB 4.39Å; F596-E629 HydrophobicContact CE1-CB 3.76Å; Q626-E629 WeakPolarHBondContact O-CB 3.44Å; Q626-E629 PolarHBondContact O-N 2.68Å; Q626-E629 VanDerWaalsContact O-N 3.14Å; T627-E629 VanDerWaalsContact C-N 3.29Å; T627-E629 PolarHBondContact O-N 3.06Å; E629-N632 PolarHBondContact O-N 3.43Å; E629-M633 WeakPolarHBondContact O-CB 3.21Å; E629-M633 PolarHBondContact O-N 3.43Å
630	L	91.3	Very high	88.1	Confident	1 Å²	1	48.3 Å²	48.3	1%	0.005	26%	0.258	C	S	.	.	H	α-helix	trans	-58.3	-47.7	172.4	173.1	61	0	0	0	111.5	F596 I600 L617 F622 Q626 T627 N632 M633 I634 F655 Y662	F596-L630 HydrophobicContact CZ-CB 4.35Å; I600-L630 HydrophobicContact CB-CD1 4.41Å; I600-L630 HydrophobicContact CD1-CB 4.24Å; I600-L630 HydrophobicContact CD1-CD1 3.65Å; I600-L630 HydrophobicContact CG1-CD1 3.86Å; I600-L630 HydrophobicContact CG2-CD1 3.6Å; L617-L630 HydrophobicContact CD1-CD1 4.39Å; L617-L630 HydrophobicContact CD2-CD1 4.17Å; F622-L630 HydrophobicContact CD2-CD2 4.07Å; F622-L630 HydrophobicContact CE2-CD1 4.48Å; F622-L630 HydrophobicContact CE2-CD2 4.35Å; Q626-L630 PolarHBondContact O-N 3.08Å; T627-L630 WeakPolarHBondContact O-CB 3.41Å; T627-L630 PolarHBondContact O-N 2.82Å; L630-N632 PolarHBondContact O-N 3.47Å; L630-M633 PolarHBondContact O-N 3.23Å; L630-I634 HydrophobicContact CD1-CD1 3.95Å; L630-I634 HydrophobicContact CD1-CG1 4.33Å; L630-I634 HydrophobicContact CG-CD1 4.01Å; L630-I634 WeakPolarHBondContact O-CD1 3.29Å; L630-I634 VanDerWaalsContact O-CG1 3.3Å; L630-I634 WeakPolarHBondContact O-CG1 3.47Å; L630-I634 PolarHBondContact O-N 3.01Å; L630-F655 HydrophobicContact CD2-CE1 4.49Å; L630-Y662 HydrophobicContact CD2-CE1 4.03Å
631	C	91.9	Very high	88.4	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-61.8	-42.3	176.2	-71.5	0	0	0	0	112.5	T627 L635 F666 I669	T627-C631 PolarHBondContact O-N 3.05Å; C631-L635 PolarHBondContact O-N 2.95Å; C631-L635 VanDerWaalsContact O-N 3.13Å; C631-F666 HydrophobicContact CB-CD1 4.1Å; C631-F666 HydrophobicContact CB-CD2 4.36Å; C631-F666 HydrophobicContact CB-CE1 3.79Å; C631-F666 HydrophobicContact CB-CE2 4.09Å; C631-F666 HydrophobicContact CB-CG 4.37Å; C631-F666 HydrophobicContact CB-CZ 3.78Å; C631-F666 WeakPolarHBondContact O-CE1 3.16Å; C631-F666 WeakPolarHBondContact SG-CE2 3.36Å; C631-I669 HydrophobicContact CB-CD1 3.4Å; C631-I669 VanDerWaalsContact CB-CD1 3.4Å
632	N	91.9	Very high	88.8	Confident	38 Å²	38	52.2 Å²	52.2	20%	0.203	26%	0.26	C	S	.	.	H	α-helix	trans	-62.9	-42.5	174.4	-91.3	-50.8	0	0	0	111.9	K628 E629 L630 L635 D636 I669	K628-N632 WeakPolarHBondContact O-CB 3.44Å; K628-N632 PolarHBondContact O-N 2.96Å; K628-N632 PolarHBondContact O-ND2 3.16Å; E629-N632 PolarHBondContact O-N 3.43Å; L630-N632 PolarHBondContact O-N 3.47Å; N632-L635 WeakPolarHBondContact O-CB 3.43Å; N632-L635 PolarHBondContact O-N 3.44Å; N632-L635 VanDerWaalsContact O-N 3.11Å; N632-D636 PolarHBondContact O-N 3.3Å; N632-I669 HydrophobicContact CB-CD1 4.24Å; N632-I669 WeakPolarHBondContact OD1-CG1 3.37Å
633	M	92.9	Very high	89.1	Confident	19 Å²	19	54.7 Å²	54.7	9%	0.094	28%	0.278	C	S	.	.	H	α-helix	trans	-64.3	-42.5	-179.6	-162.7	-71.7	148.4	0	0	111.7	R597 I600 Y601 I604 E629 L630 L635 D636 C637	R597-M633 HydrophobicContact CB-CG 4.21Å; R597-M633 HydrophobicContact CG-CG 4.2Å; R597-M633 WeakPolarHBondContact O-CE 3.27Å; I600-M633 HydrophobicContact CB-CG 4.05Å; I600-M633 HydrophobicContact CB-SD 3.67Å; I600-M633 HydrophobicContact CD1-CB 4.16Å; I600-M633 HydrophobicContact CD1-CG 4.13Å; I600-M633 HydrophobicContact CG2-CB 4.39Å; I600-M633 HydrophobicContact CG2-CG 4.04Å; I600-M633 HydrophobicContact CG2-SD 3.32Å; I600-M633 WeakPolarHBondContact CG2-SD 3.22Å; Y601-M633 HydrophobicContact CD2-CE 4.01Å; Y601-M633 HydrophobicContact CG-CE 4.21Å; I604-M633 HydrophobicContact CD1-SD 4.18Å; E629-M633 WeakPolarHBondContact O-CB 3.21Å; E629-M633 PolarHBondContact O-N 3.43Å; L630-M633 PolarHBondContact O-N 3.23Å; M633-L635 VanDerWaalsContact C-N 3.28Å; M633-L635 PolarHBondContact O-N 2.65Å; M633-D636 PolarHBondContact O-N 3.44Å; M633-C637 WeakPolarHBondContact CE-SG 3.44Å; M633-C637 PolarHBondContact O-N 3.23Å; M633-C637 PolarHBondContact O-SG 2.82Å
634	I	92.8	Very high	89.5	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-57.6	-42.1	171.7	-71.2	160.5	0	0	0	110.9	I604 L630 C638 L651 A652 F655 F666	I604-I634 HydrophobicContact CD1-CG1 4.14Å; L630-I634 HydrophobicContact CD1-CD1 3.95Å; L630-I634 HydrophobicContact CD1-CG1 4.33Å; L630-I634 HydrophobicContact CG-CD1 4.01Å; L630-I634 WeakPolarHBondContact O-CD1 3.29Å; L630-I634 VanDerWaalsContact O-CG1 3.3Å; L630-I634 WeakPolarHBondContact O-CG1 3.47Å; L630-I634 PolarHBondContact O-N 3.01Å; I634-C638 PolarHBondContact O-N 3.03Å; I634-L651 HydrophobicContact CB-CD2 4.41Å; I634-L651 HydrophobicContact CD1-CD2 3.63Å; I634-L651 HydrophobicContact CG1-CD2 3.84Å; I634-L651 HydrophobicContact CG2-CD2 3.65Å; I634-A652 HydrophobicContact CG2-CB 4.43Å; I634-F655 HydrophobicContact CD1-CD2 4.18Å; I634-F655 HydrophobicContact CD1-CE2 4.2Å; I634-F666 HydrophobicContact CB-CZ 4.48Å; I634-F666 HydrophobicContact CD1-CZ 4.42Å; I634-F666 HydrophobicContact CG2-CZ 4.24Å
635	L	92.5	Very high	90	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-68.6	-44.7	178.6	-177.8	60.2	0	0	0	112.5	C631 N632 M633 C637 C638 A639 I669 Q673 V688 L691 F692	C631-L635 PolarHBondContact O-N 2.95Å; C631-L635 VanDerWaalsContact O-N 3.13Å; N632-L635 WeakPolarHBondContact O-CB 3.43Å; N632-L635 PolarHBondContact O-N 3.44Å; N632-L635 VanDerWaalsContact O-N 3.11Å; M633-L635 VanDerWaalsContact C-N 3.28Å; M633-L635 PolarHBondContact O-N 2.65Å; L635-C637 VanDerWaalsContact C-N 3.31Å; L635-C637 PolarHBondContact O-N 2.93Å; L635-C638 CarbonylContact O-C 3.58Å; L635-C638 WeakPolarHBondContact O-CB 3.45Å; L635-C638 PolarHBondContact O-N 2.94Å; L635-C638 VanDerWaalsContact O-N 3.14Å; L635-A639 WeakPolarHBondContact O-CB 3.48Å; L635-A639 PolarHBondContact O-N 3.11Å; L635-I669 HydrophobicContact CD2-CG2 3.36Å; L635-Q673 HydrophobicContact CD2-CG 3.7Å; L635-Q673 VanDerWaalsContact CD2-NE2 3.3Å; L635-V688 HydrophobicContact CD1-CG1 4.19Å; L635-V688 HydrophobicContact CD1-CG2 4.1Å; L635-L691 HydrophobicContact CD1-CD2 3.42Å; L635-L691 VanDerWaalsContact CD1-CD2 3.42Å; L635-F692 HydrophobicContact CD1-CE2 4.21Å; L635-F692 HydrophobicContact CD1-CZ 4.47Å; L635-F692 HydrophobicContact CD2-CE2 4.13Å; L635-F692 HydrophobicContact CD2-CZ 4.07Å
636	D	91.5	Very high	90.5	Very high	81 Å²	81	51.6 Å²	51.6	43%	0.433	24%	0.241	S	C	.	.	H	α-helix	trans	-60.9	-39	177.7	-86.7	-23.5	0	0	0	111.8	N632 M633 A639 Q640	N632-D636 PolarHBondContact O-N 3.3Å; M633-D636 PolarHBondContact O-N 3.44Å; D636-A639 PolarHBondContact O-N 2.85Å; D636-Q640 VanDerWaalsContact O-CB 3.29Å; D636-Q640 WeakPolarHBondContact O-CB 3.43Å; D636-Q640 PolarHBondContact O-N 3.05Å
637	C	91.3	Very high	90.8	Very high	14 Å²	14	50.6 Å²	50.6	10%	0.095	24%	0.236	C	C	.	.	H	α-helix	trans	-59.1	-49.1	171.8	-69.1	0	0	0	0	111.8	M633 L635 A639 Q640 Q641 F648	M633-C637 WeakPolarHBondContact CE-SG 3.44Å; M633-C637 PolarHBondContact O-N 3.23Å; M633-C637 PolarHBondContact O-SG 2.82Å; L635-C637 VanDerWaalsContact C-N 3.31Å; L635-C637 PolarHBondContact O-N 2.93Å; C637-A639 VanDerWaalsContact C-N 3.3Å; C637-A639 PolarHBondContact O-N 3.32Å; C637-Q640 PolarHBondContact O-N 2.9Å; C637-Q641 PolarHBondContact O-N 2.9Å; C637-F648 HydrophobicContact CB-CD1 4.42Å; C637-F648 HydrophobicContact CB-CE1 3.53Å; C637-F648 HydrophobicContact CB-CZ 3.99Å
638	C	91.6	Very high	91.1	Very high	1 Å²	1	50.6 Å²	50.6	1%	0.007	24%	0.235	C	C	.	.	H	α-helix	trans	-62.8	-36.9	177.4	-173.8	0	0	0	0	112	I634 L635 F648 N687	I634-C638 PolarHBondContact O-N 3.03Å; L635-C638 CarbonylContact O-C 3.58Å; L635-C638 WeakPolarHBondContact O-CB 3.45Å; L635-C638 PolarHBondContact O-N 2.94Å; L635-C638 VanDerWaalsContact O-N 3.14Å; C638-F648 HydrophobicContact CB-CB 3.86Å; C638-F648 HydrophobicContact CB-CD1 3.91Å; C638-F648 HydrophobicContact CB-CD2 4.16Å; C638-F648 HydrophobicContact CB-CG 3.7Å; C638-N687 VanDerWaalsContact O-CB 3.22Å; C638-N687 WeakPolarHBondContact O-CB 3.08Å; C638-N687 PolarHBondContact O-ND2 3.27Å
639	A	89.8	Confident	91.2	Very high	5 Å²	5	47 Å²	47	4%	0.041	22%	0.219	C	C	.	.	H	α-helix	trans	-69	-37.5	178.2	0	0	0	0	0	112.3	L635 D636 C637 K684 V688	L635-A639 WeakPolarHBondContact O-CB 3.48Å; L635-A639 PolarHBondContact O-N 3.11Å; D636-A639 PolarHBondContact O-N 2.85Å; C637-A639 VanDerWaalsContact C-N 3.3Å; C637-A639 PolarHBondContact O-N 3.32Å; A639-K684 HydrophobicContact CB-CB 4.44Å; A639-K684 WeakPolarHBondContact O-CG 3.3Å; A639-V688 HydrophobicContact CB-CG2 3.69Å
640	Q	90.4	Very high	91.4	Very high	130 Å²	130	47.1 Å²	47.1	61%	0.607	22%	0.221	S	C	*	.	H	α-helix	trans	-80.6	-18.9	-176	-169.7	60.1	33.6	0	0	113.8	D636 C637	D636-Q640 VanDerWaalsContact O-CB 3.29Å; D636-Q640 WeakPolarHBondContact O-CB 3.43Å; D636-Q640 PolarHBondContact O-N 3.05Å; C637-Q640 PolarHBondContact O-N 2.9Å
641	Q	89.4	Confident	91.5	Very high	74 Å²	74	47.1 Å²	47.1	35%	0.346	22%	0.221	S	C	.	.	S	Bend	trans	-66	144.7	-179.4	-169.8	63.7	-24.2	0	0	112.5	C637 T643 E645 N687	C637-Q641 PolarHBondContact O-N 2.9Å; Q641-T643 WeakPolarHBondContact CG-O 3.33Å; Q641-T643 PolarHBondContact O-N 2.68Å; Q641-T643 VanDerWaalsContact O-N 3.17Å; Q641-E645 PolarHBondContact NE2-OE1 3.45Å; Q641-N687 PolarHBondContact O-ND2 2.68Å
642	R	88.9	Confident	91.6	Very high	230 Å²	230	47.1 Å²	47.1	87%	0.868	22%	0.221	S	C	*	.	S	Bend	trans	-61	-29.7	-176.5	-178	174.5	176	167.9	0.8	113.7
643	T	89.8	Confident	91.5	Very high	87 Å²	87	45.5 Å²	45.5	53%	0.534	21%	0.214	S	C	.	.	S	Bend	trans	-145.9	137.8	179.7	43.7	0	0	0	0	109.3	Q641 E645	Q641-T643 WeakPolarHBondContact CG-O 3.33Å; Q641-T643 PolarHBondContact O-N 2.68Å; Q641-T643 VanDerWaalsContact O-N 3.17Å; T643-E645 PolarHBondContact O-N 3.14Å
644	Y	91.6	Very high	91.5	Very high	24 Å²	24	48.7 Å²	48.7	9%	0.094	22%	0.224	C	C	.	.			trans	-53.2	123.1	174	178.9	-104.3	0	0	0	112.5	N687 R690 L691 H694	Y644-N687 HydrophobicContact CD2-CB 4.5Å; Y644-N687 PolarHBondContact N-OD1 3.39Å; Y644-R690 HydrophobicContact CD1-CB 3.66Å; Y644-R690 HydrophobicContact CD1-CG 4.35Å; Y644-R690 HydrophobicContact CD2-CB 3.64Å; Y644-R690 HydrophobicContact CE1-CB 3.95Å; Y644-R690 HydrophobicContact CE2-CB 3.95Å; Y644-R690 HydrophobicContact CG-CB 3.48Å; Y644-R690 VanDerWaalsContact CG-CB 3.48Å; Y644-R690 HydrophobicContact CG-CG 4.29Å; Y644-L691 HydrophobicContact CE2-CB 3.98Å; Y644-L691 HydrophobicContact CE2-CD1 4.04Å; Y644-H694 WeakPolarHBondContact OH-CB 3.5Å
645	E	90.5	Very high	91.4	Very high	76 Å²	76	48.7 Å²	48.7	36%	0.355	23%	0.225	S	C	.	.			trans	-108.5	132.4	174.4	-76.1	167.2	-153.1	0	0	110	Q641 T643 F647 F648	Q641-E645 PolarHBondContact NE2-OE1 3.45Å; T643-E645 PolarHBondContact O-N 3.14Å; E645-F647 HydrophobicContact CB-CB 4.46Å; E645-F647 PolarHBondContact O-N 3.25Å; E645-F648 HydrophobicContact CB-CD2 4.32Å; E645-F648 PolarHBondContact O-N 2.93Å
646	K	90.4	Very high	91.3	Very high	107 Å²	107	49.1 Å²	49.1	47%	0.465	23%	0.228	S	C	.	.	H	α-helix	trans	-60.3	-22	-178.9	-163.7	-173.5	175.9	-171	0	113	F648 G649 L650 H694	K646-F648 VanDerWaalsContact C-N 3.29Å; K646-F648 PolarHBondContact O-N 2.9Å; K646-G649 PolarHBondContact O-N 2.97Å; K646-G649 VanDerWaalsContact O-N 3.13Å; K646-L650 HydrophobicContact CD-CD1 4.12Å; K646-L650 HydrophobicContact CG-CD1 4.05Å; K646-L650 HydrophobicContact CG-CG 4.2Å; K646-L650 PolarHBondContact O-N 3.41Å; K646-H694 WeakPolarHBondContact CE-NE2 3.49Å
647	F	92.9	Very high	91.2	Very high	37 Å²	37	51.1 Å²	51.1	16%	0.162	24%	0.238	C	C	.	.	H	α-helix	trans	-44.3	-51.5	172.8	173.9	-86.8	0	0	0	112.2	I604 F610 C613 E645 G649 L650 L651	I604-F647 HydrophobicContact CG2-CE1 4.07Å; F610-F647 HydrophobicContact CB-CD2 4.1Å; F610-F647 HydrophobicContact CB-CE2 4.17Å; C613-F647 HydrophobicContact CB-CE2 4.36Å; C613-F647 HydrophobicContact CB-CZ 3.82Å; E645-F647 HydrophobicContact CB-CB 4.46Å; E645-F647 PolarHBondContact O-N 3.25Å; F647-G649 PolarHBondContact O-N 3.01Å; F647-L650 PolarHBondContact O-N 3.45Å; F647-L651 HydrophobicContact CE1-CD1 3.65Å; F647-L651 HydrophobicContact CZ-CD1 3.86Å; F647-L651 VanDerWaalsContact O-CB 3.29Å; F647-L651 WeakPolarHBondContact O-CB 3.48Å; F647-L651 PolarHBondContact O-N 3.2Å
648	F	92.6	Very high	91	Very high	13 Å²	13	54.2 Å²	54.2	6%	0.057	25%	0.253	C	S	.	.	H	α-helix	trans	-66.6	-38.6	-177.3	-67.7	-82	0	0	0	112.5	I604 C637 C638 E645 K646 L650 L651 A652 L691	I604-F648 HydrophobicContact CG2-CE1 4.04Å; I604-F648 HydrophobicContact CG2-CZ 4.29Å; C637-F648 HydrophobicContact CB-CD1 4.42Å; C637-F648 HydrophobicContact CB-CE1 3.53Å; C637-F648 HydrophobicContact CB-CZ 3.99Å; C638-F648 HydrophobicContact CB-CB 3.86Å; C638-F648 HydrophobicContact CB-CD1 3.91Å; C638-F648 HydrophobicContact CB-CD2 4.16Å; C638-F648 HydrophobicContact CB-CG 3.7Å; E645-F648 HydrophobicContact CB-CD2 4.32Å; E645-F648 PolarHBondContact O-N 2.93Å; K646-F648 VanDerWaalsContact C-N 3.29Å; K646-F648 PolarHBondContact O-N 2.9Å; F648-L650 VanDerWaalsContact C-N 3.34Å; F648-L651 PolarHBondContact O-N 3.19Å; F648-A652 WeakPolarHBondContact O-CB 3.31Å; F648-A652 PolarHBondContact O-N 3.46Å; F648-L691 HydrophobicContact CB-CD1 3.64Å
649	G	91.7	Very high	90.8	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-68.7	-32	177.9	0	0	0	0	0	113.4	K646 F647 G653 L691 H694	K646-G649 PolarHBondContact O-N 2.97Å; K646-G649 VanDerWaalsContact O-N 3.13Å; F647-G649 PolarHBondContact O-N 3.01Å; G649-G653 PolarHBondContact O-N 2.97Å; G649-L691 VanDerWaalsContact CA-CD1 3.5Å; G649-L691 VanDerWaalsContact N-CD1 3.31Å; G649-H694 VanDerWaalsContact C-CE1 3.49Å; G649-H694 VanDerWaalsContact C-ND1 3.27Å; G649-H694 PolarHBondContact O-CE1 3.11Å; G649-H694 PolarHBondContact O-ND1 3.05Å; G649-H694 VanDerWaalsContact O-ND1 3.07Å
650	L	93.4	Very high	90.8	Very high	53 Å²	53	63.8 Å²	63.8	28%	0.277	29%	0.293	S	S	.	.	H	α-helix	trans	-74.8	-41.9	172.5	-69.4	165.3	0	0	0	111.4	F610 K646 F647 F648 R654	F610-L650 HydrophobicContact CB-CB 4.26Å; F610-L650 HydrophobicContact CD1-CB 3.83Å; F610-L650 HydrophobicContact CD1-CD1 3.97Å; F610-L650 HydrophobicContact CD1-CG 4.49Å; F610-L650 HydrophobicContact CD2-CB 3.74Å; F610-L650 HydrophobicContact CE1-CB 4.11Å; F610-L650 HydrophobicContact CE1-CD1 3.95Å; F610-L650 HydrophobicContact CE1-CG 4.47Å; F610-L650 HydrophobicContact CE2-CB 4.02Å; F610-L650 HydrophobicContact CG-CB 3.65Å; F610-L650 HydrophobicContact CZ-CB 4.2Å; K646-L650 HydrophobicContact CD-CD1 4.12Å; K646-L650 HydrophobicContact CG-CD1 4.05Å; K646-L650 HydrophobicContact CG-CG 4.2Å; K646-L650 PolarHBondContact O-N 3.41Å; F647-L650 PolarHBondContact O-N 3.45Å; F648-L650 VanDerWaalsContact C-N 3.34Å; L650-R654 VanDerWaalsContact O-CB 3.25Å; L650-R654 WeakPolarHBondContact O-CB 3.12Å; L650-R654 PolarHBondContact O-N 2.78Å
651	L	93.6	Very high	90.7	Very high	0 Å²	0	61.2 Å²	61.2	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-61.5	-53.7	176.8	-175.7	152	0	0	0	111.7	F610 C613 I634 F647 F648 G653 R654 F655	F610-L651 HydrophobicContact CB-CB 4.08Å; C613-L651 HydrophobicContact CB-CD1 3.74Å; C613-L651 WeakPolarHBondContact SG-CD1 3.43Å; I634-L651 HydrophobicContact CB-CD2 4.41Å; I634-L651 HydrophobicContact CD1-CD2 3.63Å; I634-L651 HydrophobicContact CG1-CD2 3.84Å; I634-L651 HydrophobicContact CG2-CD2 3.65Å; F647-L651 HydrophobicContact CE1-CD1 3.65Å; F647-L651 HydrophobicContact CZ-CD1 3.86Å; F647-L651 VanDerWaalsContact O-CB 3.29Å; F647-L651 WeakPolarHBondContact O-CB 3.48Å; F647-L651 PolarHBondContact O-N 3.2Å; F648-L651 PolarHBondContact O-N 3.19Å; L651-G653 PolarHBondContact O-N 3.45Å; L651-R654 WeakPolarHBondContact O-CB 3.02Å; L651-R654 PolarHBondContact O-N 3.23Å; L651-F655 HydrophobicContact CD2-CD2 3.75Å; L651-F655 HydrophobicContact CD2-CE2 3.74Å; L651-F655 HydrophobicContact CG-CD2 4.27Å; L651-F655 HydrophobicContact CG-CE2 4.09Å; L651-F655 VanDerWaalsContact O-CD2 3.3Å; L651-F655 WeakPolarHBondContact O-CD2 3.36Å; L651-F655 PolarHBondContact O-N 3.4Å
652	A	93.3	Very high	90.8	Very high	0 Å²	0	58.7 Å²	58.7	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-63.2	-42.5	179.7	0	0	0	0	0	111.5	I634 F648 R654 F655 C656 F666 L695	I634-A652 HydrophobicContact CG2-CB 4.43Å; F648-A652 WeakPolarHBondContact O-CB 3.31Å; F648-A652 PolarHBondContact O-N 3.46Å; A652-R654 VanDerWaalsContact C-N 3.28Å; A652-R654 PolarHBondContact O-N 3.1Å; A652-F655 PolarHBondContact O-N 2.94Å; A652-F655 VanDerWaalsContact O-N 3.14Å; A652-C656 PolarHBondContact O-N 3.24Å; A652-C656 PolarHBondContact O-SG 3.02Å; A652-C656 VanDerWaalsContact O-SG 3.36Å; A652-F666 HydrophobicContact CB-CE1 4.17Å; A652-F666 HydrophobicContact CB-CE2 3.95Å; A652-F666 HydrophobicContact CB-CZ 3.66Å; A652-L695 HydrophobicContact CB-CD1 4.26Å; A652-L695 HydrophobicContact CB-CD2 3.91Å
653	G	90.7	Very high	90.9	Very high	5 Å²	5	50.1 Å²	50.1	5%	0.052	24%	0.239	C	C	.	.	H	α-helix	trans	-61.6	-36.2	174.9	0	0	0	0	0	112.6	G649 L651 C656 L657 L695	G649-G653 PolarHBondContact O-N 2.97Å; L651-G653 PolarHBondContact O-N 3.45Å; G653-C656 PolarHBondContact O-N 3.43Å; G653-L657 WeakPolarHBondContact O-CB 3.17Å; G653-L657 VanDerWaalsContact O-CG 3.27Å; G653-L657 WeakPolarHBondContact O-CG 3.44Å; G653-L657 PolarHBondContact O-N 3.4Å; G653-L657 VanDerWaalsContact O-N 3.12Å; G653-L695 VanDerWaalsContact N-CD2 3.3Å
654	R	92.3	Very high	90.9	Very high	85 Å²	85	50.3 Å²	50.3	32%	0.321	23%	0.234	S	C	.	.	H	α-helix	trans	-64	-40.4	174.2	-170.8	57.3	158.4	115.6	8.4	112.1	F610 E611 A614 L650 L651 A652 L657 L658	F610-R654 HydrophobicContact CD2-CB 4.41Å; F610-R654 HydrophobicContact CE2-CB 4.49Å; E611-R654 VanDerWaalsContact CD-NE 3.27Å; E611-R654 IonicContact OE1-CZ 3.45Å; E611-R654 IonicContact OE1-NE 2.75Å; E611-R654 PolarHBondContact OE1-NE 3.08Å; E611-R654 IonicContact OE1-NH2 3.97Å; E611-R654 IonicContact OE2-CZ 3.68Å; E611-R654 IonicContact OE2-NE 2.75Å; E611-R654 PolarHBondContact OE2-NE 3.32Å; E611-R654 IonicContact OE2-NH2 3.68Å; E611-R654 PolarHBondContact OE2-NH2 2.66Å; A614-R654 HydrophobicContact CB-CG 4.31Å; L650-R654 VanDerWaalsContact O-CB 3.25Å; L650-R654 WeakPolarHBondContact O-CB 3.12Å; L650-R654 PolarHBondContact O-N 2.78Å; L651-R654 WeakPolarHBondContact O-CB 3.02Å; L651-R654 PolarHBondContact O-N 3.23Å; A652-R654 VanDerWaalsContact C-N 3.28Å; A652-R654 PolarHBondContact O-N 3.1Å; R654-L657 PolarHBondContact O-N 2.96Å; R654-L658 HydrophobicContact CG-CD1 4.1Å; R654-L658 WeakPolarHBondContact O-CB 3.34Å; R654-L658 WeakPolarHBondContact O-CD1 3.48Å; R654-L658 WeakPolarHBondContact O-CG 3.41Å; R654-L658 PolarHBondContact O-N 3.47Å
655	F	91.1	Very high	90.9	Very high	1 Å²	1	49.9 Å²	49.9	0%	0.004	23%	0.234	C	C	.	.	H	α-helix	trans	-65.9	-46.6	175.2	-84.1	-73.8	0	0	0	112.8	A614 L617 I618 L630 I634 L651 A652 L657 L658 K659 Y662 F666	A614-F655 HydrophobicContact CB-CE2 4.16Å; A614-F655 HydrophobicContact CB-CZ 4.27Å; L617-F655 HydrophobicContact CB-CZ 3.86Å; L617-F655 HydrophobicContact CD1-CE2 3.97Å; L617-F655 HydrophobicContact CD1-CZ 3.91Å; I618-F655 HydrophobicContact CG1-CE1 4.13Å; L630-F655 HydrophobicContact CD2-CE1 4.49Å; I634-F655 HydrophobicContact CD1-CD2 4.18Å; I634-F655 HydrophobicContact CD1-CE2 4.2Å; L651-F655 HydrophobicContact CD2-CD2 3.75Å; L651-F655 HydrophobicContact CD2-CE2 3.74Å; L651-F655 HydrophobicContact CG-CD2 4.27Å; L651-F655 HydrophobicContact CG-CE2 4.09Å; L651-F655 VanDerWaalsContact O-CD2 3.3Å; L651-F655 WeakPolarHBondContact O-CD2 3.36Å; L651-F655 PolarHBondContact O-N 3.4Å; A652-F655 PolarHBondContact O-N 2.94Å; A652-F655 VanDerWaalsContact O-N 3.14Å; F655-L657 PolarHBondContact O-N 2.98Å; F655-L658 PolarHBondContact O-N 3.48Å; F655-K659 PolarHBondContact O-N 2.99Å; F655-Y662 HydrophobicContact CB-CD2 4.18Å; F655-Y662 HydrophobicContact CB-CG 4.11Å; F655-Y662 HydrophobicContact CD1-CD1 4.39Å; F655-Y662 AromaticContact CD1-CD2 3.77Å; F655-Y662 HydrophobicContact CD1-CD2 3.77Å; F655-Y662 HydrophobicContact CD1-CE1 4.27Å; F655-Y662 AromaticContact CD1-CE2 3.66Å; F655-Y662 HydrophobicContact CD1-CE2 3.66Å; F655-Y662 HydrophobicContact CD1-CG 4.16Å; F655-Y662 AromaticContact CD1-CZ 3.92Å; F655-Y662 HydrophobicContact CE1-CE2 4.24Å; F655-Y662 HydrophobicContact CG-CD2 4.47Å; F655-Y662 WeakPolarHBondContact O-CD2 3.42Å; F655-F666 HydrophobicContact CB-CE2 4.38Å
656	C	90.8	Very high	91	Very high	9 Å²	9	46.2 Å²	46.2	6%	0.061	22%	0.217	C	C	.	.	H	α-helix	trans	-57.4	-36.9	175.5	-60	0	0	0	0	112.8	A652 G653 L658 M663 F666 S700	A652-C656 PolarHBondContact O-N 3.24Å; A652-C656 PolarHBondContact O-SG 3.02Å; A652-C656 VanDerWaalsContact O-SG 3.36Å; G653-C656 PolarHBondContact O-N 3.43Å; C656-L658 VanDerWaalsContact C-N 3.29Å; C656-L658 PolarHBondContact O-N 3.11Å; C656-M663 HydrophobicContact CB-CB 4.12Å; C656-M663 HydrophobicContact CB-CG 4.37Å; C656-F666 VanDerWaalsContact SG-CD2 3.51Å; C656-S700 WeakPolarHBondContact CB-O 3.48Å; C656-S700 PolarHBondContact SG-O 3.34Å
657	L	88.4	Confident	91	Very high	123 Å²	123	43.5 Å²	43.5	64%	0.644	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.9	-1.6	178.1	-66.5	172.4	0	0	0	114	G653 R654 F655	G653-L657 WeakPolarHBondContact O-CB 3.17Å; G653-L657 VanDerWaalsContact O-CG 3.27Å; G653-L657 WeakPolarHBondContact O-CG 3.44Å; G653-L657 PolarHBondContact O-N 3.4Å; G653-L657 VanDerWaalsContact O-N 3.12Å; R654-L657 PolarHBondContact O-N 2.96Å; F655-L657 PolarHBondContact O-N 2.98Å
658	L	87.9	Confident	90.9	Very high	78 Å²	78	43.5 Å²	43.5	41%	0.408	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.4	-46.3	179.4	-81.7	168.5	0	0	0	113.3	I618 R654 F655 C656	I618-L658 HydrophobicContact CD1-CD1 3.7Å; R654-L658 HydrophobicContact CG-CD1 4.1Å; R654-L658 WeakPolarHBondContact O-CB 3.34Å; R654-L658 WeakPolarHBondContact O-CD1 3.48Å; R654-L658 WeakPolarHBondContact O-CG 3.41Å; R654-L658 PolarHBondContact O-N 3.47Å; F655-L658 PolarHBondContact O-N 3.48Å; C656-L658 VanDerWaalsContact C-N 3.29Å; C656-L658 PolarHBondContact O-N 3.11Å
659	K	87.5	Confident	90.8	Very high	74 Å²	74	42.9 Å²	42.9	32%	0.322	21%	0.21	S	C	.	.			trans	-134.2	144.3	171.4	-64	-164.1	178.7	-173.5	0	110.8	D624 F655 E661 Y662	D624-K659 IonicContact OD1-NZ 3.53Å; D624-K659 PolarHBondContact OD1-NZ 3.26Å; F655-K659 PolarHBondContact O-N 2.99Å; K659-E661 VanDerWaalsContact C-N 3.29Å; K659-E661 HydrophobicContact CB-CB 4.49Å; K659-E661 WeakPolarHBondContact CD-OE2 3.28Å; K659-E661 WeakPolarHBondContact CE-OE2 3.22Å; K659-E661 IonicContact NZ-OE1 2.68Å; K659-E661 IonicContact NZ-OE2 3.39Å; K659-E661 PolarHBondContact NZ-OE2 2.8Å; K659-E661 PolarHBondContact O-N 3.46Å; K659-Y662 HydrophobicContact CB-CD2 3.64Å; K659-Y662 HydrophobicContact CB-CE2 3.97Å; K659-Y662 HydrophobicContact CD-CD2 4.44Å; K659-Y662 HydrophobicContact CD-CE2 3.98Å; K659-Y662 HydrophobicContact CG-CD2 4.11Å; K659-Y662 HydrophobicContact CG-CE2 3.9Å; K659-Y662 PolarHBondContact O-N 3.49Å
660	K	88.9	Confident	90.8	Very high	134 Å²	134	43 Å²	43	58%	0.583	21%	0.211	S	C	*	.	H	α-helix	trans	-61.9	-34.6	174.4	-170.7	167.4	-179.4	-79.8	0	112.6	Y662 M663 E664	K660-Y662 VanDerWaalsContact C-N 3.28Å; K660-Y662 PolarHBondContact O-N 3.3Å; K660-M663 HydrophobicContact CG-CE 4.39Å; K660-M663 WeakPolarHBondContact O-CB 3.07Å; K660-M663 PolarHBondContact O-N 2.9Å; K660-M663 VanDerWaalsContact O-N 3.09Å; K660-E664 HydrophobicContact CG-CG 4.49Å; K660-E664 IonicContact NZ-OE1 2.6Å; K660-E664 PolarHBondContact NZ-OE1 3.39Å; K660-E664 PolarHBondContact O-N 3.38Å
661	E	90.1	Very high	90.6	Very high	76 Å²	76	42.2 Å²	42.2	36%	0.355	21%	0.21	S	C	.	.	H	α-helix	trans	-54.8	-39.3	175.2	-64.8	136.1	-124.9	0	0	113.2	K659 S665	K659-E661 VanDerWaalsContact C-N 3.29Å; K659-E661 HydrophobicContact CB-CB 4.49Å; K659-E661 WeakPolarHBondContact CD-OE2 3.28Å; K659-E661 WeakPolarHBondContact CE-OE2 3.22Å; K659-E661 IonicContact NZ-OE1 2.68Å; K659-E661 IonicContact NZ-OE2 3.39Å; K659-E661 PolarHBondContact NZ-OE2 2.8Å; K659-E661 PolarHBondContact O-N 3.46Å; E661-S665 VanDerWaalsContact O-CB 3.31Å; E661-S665 WeakPolarHBondContact O-CB 3.42Å; E661-S665 PolarHBondContact O-N 2.93Å; E661-S665 PolarHBondContact O-OG 3.35Å
662	Y	90.4	Very high	90.5	Very high	21 Å²	21	46.3 Å²	46.3	8%	0.082	23%	0.229	C	C	.	.	H	α-helix	trans	-72.1	-36.1	177.5	-64.6	-55.2	0	0	0	112.1	T627 L630 F655 K659 K660 S665 F666	T627-Y662 HydrophobicContact CG2-CD1 4.45Å; T627-Y662 HydrophobicContact CG2-CE1 3.68Å; L630-Y662 HydrophobicContact CD2-CE1 4.03Å; F655-Y662 HydrophobicContact CB-CD2 4.18Å; F655-Y662 HydrophobicContact CB-CG 4.11Å; F655-Y662 HydrophobicContact CD1-CD1 4.39Å; F655-Y662 AromaticContact CD1-CD2 3.77Å; F655-Y662 HydrophobicContact CD1-CD2 3.77Å; F655-Y662 HydrophobicContact CD1-CE1 4.27Å; F655-Y662 AromaticContact CD1-CE2 3.66Å; F655-Y662 HydrophobicContact CD1-CE2 3.66Å; F655-Y662 HydrophobicContact CD1-CG 4.16Å; F655-Y662 AromaticContact CD1-CZ 3.92Å; F655-Y662 HydrophobicContact CE1-CE2 4.24Å; F655-Y662 HydrophobicContact CG-CD2 4.47Å; F655-Y662 WeakPolarHBondContact O-CD2 3.42Å; K659-Y662 HydrophobicContact CB-CD2 3.64Å; K659-Y662 HydrophobicContact CB-CE2 3.97Å; K659-Y662 HydrophobicContact CD-CD2 4.44Å; K659-Y662 HydrophobicContact CD-CE2 3.98Å; K659-Y662 HydrophobicContact CG-CD2 4.11Å; K659-Y662 HydrophobicContact CG-CE2 3.9Å; K659-Y662 PolarHBondContact O-N 3.49Å; K660-Y662 VanDerWaalsContact C-N 3.28Å; K660-Y662 PolarHBondContact O-N 3.3Å; Y662-S665 PolarHBondContact O-N 2.94Å; Y662-F666 WeakPolarHBondContact O-CD2 3.37Å; Y662-F666 PolarHBondContact O-N 3.37Å
663	M	90.4	Very high	90.3	Very high	49 Å²	49	47.7 Å²	47.7	24%	0.241	24%	0.235	C	C	.	.	H	α-helix	trans	-62.9	-51.6	175.2	-171.1	-174.2	78	0	0	110.4	C656 K660 S665 F666 E667	C656-M663 HydrophobicContact CB-CB 4.12Å; C656-M663 HydrophobicContact CB-CG 4.37Å; K660-M663 HydrophobicContact CG-CE 4.39Å; K660-M663 WeakPolarHBondContact O-CB 3.07Å; K660-M663 PolarHBondContact O-N 2.9Å; K660-M663 VanDerWaalsContact O-N 3.09Å; M663-S665 VanDerWaalsContact C-N 3.29Å; M663-S665 PolarHBondContact O-N 3.46Å; M663-F666 PolarHBondContact O-N 2.99Å; M663-F666 VanDerWaalsContact O-N 3.09Å; M663-E667 WeakPolarHBondContact CE-OE1 3.45Å; M663-E667 WeakPolarHBondContact O-CG 3.38Å; M663-E667 PolarHBondContact O-N 2.91Å
664	E	91.1	Very high	90.2	Very high	92 Å²	92	48.4 Å²	48.4	43%	0.43	24%	0.236	S	C	.	.	H	α-helix	trans	-59.9	-38	176.3	-69	173.6	175.4	0	0	112.2	K660 E667 A668	K660-E664 HydrophobicContact CG-CG 4.49Å; K660-E664 IonicContact NZ-OE1 2.6Å; K660-E664 PolarHBondContact NZ-OE1 3.39Å; K660-E664 PolarHBondContact O-N 3.38Å; E664-E667 PolarHBondContact O-N 3.06Å; E664-A668 PolarHBondContact O-N 3.01Å
665	S	91.4	Very high	90.1	Very high	14 Å²	14	49.8 Å²	49.8	10%	0.098	25%	0.25	C	S	.	.	H	α-helix	trans	-62	-46.7	172.7	-64.7	0	0	0	0	111.9	E661 Y662 M663 E667 A668 I669	E661-S665 VanDerWaalsContact O-CB 3.31Å; E661-S665 WeakPolarHBondContact O-CB 3.42Å; E661-S665 PolarHBondContact O-N 2.93Å; E661-S665 PolarHBondContact O-OG 3.35Å; Y662-S665 PolarHBondContact O-N 2.94Å; M663-S665 VanDerWaalsContact C-N 3.29Å; M663-S665 PolarHBondContact O-N 3.46Å; S665-E667 VanDerWaalsContact C-N 3.33Å; S665-E667 PolarHBondContact O-N 3.31Å; S665-A668 PolarHBondContact O-N 2.94Å; S665-I669 WeakPolarHBondContact O-CB 3.39Å; S665-I669 VanDerWaalsContact O-CD1 3.29Å; S665-I669 WeakPolarHBondContact O-CD1 3.41Å; S665-I669 WeakPolarHBondContact O-CG1 3.07Å; S665-I669 PolarHBondContact O-N 2.58Å
666	F	91.9	Very high	90	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-69.1	-27.2	177.1	-80	-62.3	0	0	0	113.4	C631 I634 A652 F655 C656 Y662 M663 F670 V701	C631-F666 HydrophobicContact CB-CD1 4.1Å; C631-F666 HydrophobicContact CB-CD2 4.36Å; C631-F666 HydrophobicContact CB-CE1 3.79Å; C631-F666 HydrophobicContact CB-CE2 4.09Å; C631-F666 HydrophobicContact CB-CG 4.37Å; C631-F666 HydrophobicContact CB-CZ 3.78Å; C631-F666 WeakPolarHBondContact O-CE1 3.16Å; C631-F666 WeakPolarHBondContact SG-CE2 3.36Å; I634-F666 HydrophobicContact CB-CZ 4.48Å; I634-F666 HydrophobicContact CD1-CZ 4.42Å; I634-F666 HydrophobicContact CG2-CZ 4.24Å; A652-F666 HydrophobicContact CB-CE1 4.17Å; A652-F666 HydrophobicContact CB-CE2 3.95Å; A652-F666 HydrophobicContact CB-CZ 3.66Å; F655-F666 HydrophobicContact CB-CE2 4.38Å; C656-F666 VanDerWaalsContact SG-CD2 3.51Å; Y662-F666 WeakPolarHBondContact O-CD2 3.37Å; Y662-F666 PolarHBondContact O-N 3.37Å; M663-F666 PolarHBondContact O-N 2.99Å; M663-F666 VanDerWaalsContact O-N 3.09Å; F666-F670 PolarHBondContact O-N 3.23Å; F666-F670 VanDerWaalsContact O-N 3.08Å; F666-V701 HydrophobicContact CB-CG2 4.28Å
667	E	90.6	Very high	89.9	Confident	50 Å²	50	51.6 Å²	51.6	23%	0.234	26%	0.261	C	S	.	.	H	α-helix	trans	-66	-50.9	170	-70.3	176.2	-129	0	0	111.5	M663 E664 S665 I669 F670 S671 V701 P702 V705	M663-E667 WeakPolarHBondContact CE-OE1 3.45Å; M663-E667 WeakPolarHBondContact O-CG 3.38Å; M663-E667 PolarHBondContact O-N 2.91Å; E664-E667 PolarHBondContact O-N 3.06Å; S665-E667 VanDerWaalsContact C-N 3.33Å; S665-E667 PolarHBondContact O-N 3.31Å; E667-I669 VanDerWaalsContact C-N 3.3Å; E667-I669 PolarHBondContact O-N 3.46Å; E667-F670 WeakPolarHBondContact O-CB 3.27Å; E667-F670 PolarHBondContact O-N 3.02Å; E667-F670 VanDerWaalsContact O-N 3.1Å; E667-S671 PolarHBondContact O-N 3.03Å; E667-V701 HydrophobicContact CG-CG1 3.92Å; E667-P702 HydrophobicContact CG-CG 4.06Å; E667-P702 VanDerWaalsContact OE1-CD 3.24Å; E667-P702 WeakPolarHBondContact OE1-CD 3.26Å; E667-P702 VanDerWaalsContact OE1-CG 3.23Å; E667-P702 WeakPolarHBondContact OE1-CG 3.47Å; E667-P702 WeakPolarHBondContact OE2-CG 3.32Å; E667-V705 HydrophobicContact CB-CG1 3.9Å; E667-V705 HydrophobicContact CG-CG1 3.64Å
668	A	90.8	Very high	89.7	Confident	36 Å²	36	50.5 Å²	50.5	30%	0.298	25%	0.252	S	S	.	.	H	α-helix	trans	-63.1	-35.8	177.4	0	0	0	0	0	112.5	E664 S665 F670 S671 E672	E664-A668 PolarHBondContact O-N 3.01Å; S665-A668 PolarHBondContact O-N 2.94Å; A668-F670 VanDerWaalsContact C-N 3.32Å; A668-S671 PolarHBondContact O-N 3.07Å; A668-S671 PolarHBondContact O-OG 3.42Å; A668-E672 WeakPolarHBondContact O-CB 3.43Å; A668-E672 WeakPolarHBondContact O-CG 3.1Å; A668-E672 PolarHBondContact O-N 3.14Å; A668-E672 VanDerWaalsContact O-N 3.11Å
669	I	90.6	Very high	89.7	Confident	0 Å²	0	56 Å²	56	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-69.8	-29.7	175.6	-68.4	164.5	0	0	0	111.2	K628 C631 N632 L635 S665 E667 Q673	K628-I669 HydrophobicContact CG-CD1 4.44Å; C631-I669 HydrophobicContact CB-CD1 3.4Å; C631-I669 VanDerWaalsContact CB-CD1 3.4Å; N632-I669 HydrophobicContact CB-CD1 4.24Å; N632-I669 WeakPolarHBondContact OD1-CG1 3.37Å; L635-I669 HydrophobicContact CD2-CG2 3.36Å; S665-I669 WeakPolarHBondContact O-CB 3.39Å; S665-I669 VanDerWaalsContact O-CD1 3.29Å; S665-I669 WeakPolarHBondContact O-CD1 3.41Å; S665-I669 WeakPolarHBondContact O-CG1 3.07Å; S665-I669 PolarHBondContact O-N 2.58Å; E667-I669 VanDerWaalsContact C-N 3.3Å; E667-I669 PolarHBondContact O-N 3.46Å; I669-Q673 HydrophobicContact CG2-CG 3.91Å; I669-Q673 WeakPolarHBondContact O-CB 3.2Å; I669-Q673 WeakPolarHBondContact O-CG 3.37Å; I669-Q673 PolarHBondContact O-N 2.97Å
670	F	91.9	Very high	89.6	Confident	3 Å²	3	54.1 Å²	54.1	1%	0.013	26%	0.261	C	S	.	.	H	α-helix	trans	-63.3	-44.6	175	-174.6	-96.6	0	0	0	112.1	F666 E667 A668 Y674 F692 V705 L706 I709 F723	F666-F670 PolarHBondContact O-N 3.23Å; F666-F670 VanDerWaalsContact O-N 3.08Å; E667-F670 WeakPolarHBondContact O-CB 3.27Å; E667-F670 PolarHBondContact O-N 3.02Å; E667-F670 VanDerWaalsContact O-N 3.1Å; A668-F670 VanDerWaalsContact C-N 3.32Å; F670-Y674 VanDerWaalsContact O-CB 3.28Å; F670-Y674 WeakPolarHBondContact O-CB 3.39Å; F670-Y674 PolarHBondContact O-N 3.09Å; F670-F692 HydrophobicContact CB-CE1 4.03Å; F670-F692 HydrophobicContact CB-CZ 4.13Å; F670-F692 HydrophobicContact CD2-CB 4.03Å; F670-F692 AromaticContact CD2-CD1 3.56Å; F670-F692 HydrophobicContact CD2-CD1 3.56Å; F670-F692 AromaticContact CD2-CD2 3.61Å; F670-F692 HydrophobicContact CD2-CD2 3.61Å; F670-F692 AromaticContact CD2-CE1 3.79Å; F670-F692 HydrophobicContact CD2-CE1 3.79Å; F670-F692 AromaticContact CD2-CE2 3.83Å; F670-F692 HydrophobicContact CD2-CE2 3.83Å; F670-F692 AromaticContact CD2-CG 3.46Å; F670-F692 HydrophobicContact CD2-CG 3.46Å; F670-F692 VanDerWaalsContact CD2-CG 3.46Å; F670-F692 AromaticContact CD2-CZ 3.91Å; F670-F692 HydrophobicContact CD2-CZ 3.91Å; F670-F692 HydrophobicContact CE2-CB 3.83Å; F670-F692 HydrophobicContact CE2-CD1 4.25Å; F670-F692 AromaticContact CE2-CD2 3.94Å; F670-F692 HydrophobicContact CE2-CD2 3.94Å; F670-F692 AromaticContact CE2-CG 3.77Å; F670-F692 HydrophobicContact CE2-CG 3.77Å; F670-F692 HydrophobicContact CG-CD1 4.49Å; F670-F692 HydrophobicContact CG-CE1 4.42Å; F670-V705 HydrophobicContact CB-CB 4.36Å; F670-V705 HydrophobicContact CD1-CB 3.64Å; F670-V705 HydrophobicContact CD1-CG2 3.89Å; F670-V705 WeakPolarHBondContact CD1-O 3.4Å; F670-V705 HydrophobicContact CE1-CB 4.18Å; F670-V705 HydrophobicContact CE1-CG2 4.07Å; F670-V705 WeakPolarHBondContact CE1-O 3.36Å; F670-V705 HydrophobicContact CG-CB 4.09Å; F670-V705 HydrophobicContact CG-CG2 4.17Å; F670-L706 HydrophobicContact CE1-CD2 4.48Å; F670-L706 HydrophobicContact CZ-CD2 4.18Å; F670-I709 HydrophobicContact CE1-CD1 4.3Å; F670-I709 HydrophobicContact CE1-CG1 4.45Å; F670-I709 HydrophobicContact CZ-CD1 4.11Å; F670-F723 HydrophobicContact CE2-CE1 4.26Å; F670-F723 HydrophobicContact CE2-CZ 4.1Å; F670-F723 HydrophobicContact CZ-CE1 4.25Å
671	S	89.6	Confident	89.5	Confident	37 Å²	37	52.9 Å²	52.9	26%	0.259	26%	0.257	S	S	.	.	H	α-helix	trans	-70.4	-47.8	178.7	53.8	0	0	0	0	112	E667 A668 Q673 Y674 D675	E667-S671 PolarHBondContact O-N 3.03Å; A668-S671 PolarHBondContact O-N 3.07Å; A668-S671 PolarHBondContact O-OG 3.42Å; S671-Q673 VanDerWaalsContact C-N 3.25Å; S671-Q673 PolarHBondContact O-N 3.38Å; S671-Y674 PolarHBondContact O-N 3.18Å; S671-D675 PolarHBondContact O-N 3.38Å
672	E	90.8	Very high	89.3	Confident	86 Å²	86	52.9 Å²	52.9	40%	0.402	26%	0.263	S	S	.	.	H	α-helix	trans	-55.7	-40.1	176.1	-73.8	174.5	178.3	0	0	112.2	K628 A668 T676	K628-E672 VanDerWaalsContact CE-OE2 3.27Å; K628-E672 WeakPolarHBondContact CE-OE2 3.25Å; K628-E672 IonicContact NZ-OE1 3.86Å; K628-E672 PolarHBondContact NZ-OE1 3.38Å; K628-E672 IonicContact NZ-OE2 3.64Å; K628-E672 PolarHBondContact NZ-OE2 2.67Å; A668-E672 WeakPolarHBondContact O-CB 3.43Å; A668-E672 WeakPolarHBondContact O-CG 3.1Å; A668-E672 PolarHBondContact O-N 3.14Å; A668-E672 VanDerWaalsContact O-N 3.11Å; E672-T676 WeakPolarHBondContact O-CG2 3.32Å; E672-T676 PolarHBondContact O-N 3.01Å; E672-T676 PolarHBondContact O-OG1 3.42Å
673	Q	89.3	Confident	89.2	Confident	29 Å²	29	55.9 Å²	55.9	14%	0.136	28%	0.28	C	S	.	.	H	α-helix	trans	-76.6	-34.6	176.9	-66	-81.2	62.1	0	0	112.3	L635 I669 S671 T676 I677	L635-Q673 HydrophobicContact CD2-CG 3.7Å; L635-Q673 VanDerWaalsContact CD2-NE2 3.3Å; I669-Q673 HydrophobicContact CG2-CG 3.91Å; I669-Q673 WeakPolarHBondContact O-CB 3.2Å; I669-Q673 WeakPolarHBondContact O-CG 3.37Å; I669-Q673 PolarHBondContact O-N 2.97Å; S671-Q673 VanDerWaalsContact C-N 3.25Å; S671-Q673 PolarHBondContact O-N 3.38Å; Q673-T676 WeakPolarHBondContact CA-OG1 3.47Å; Q673-T676 CarbonylContact O-C 3.6Å; Q673-T676 PolarHBondContact O-N 3.01Å; Q673-T676 PolarHBondContact O-OG1 2.92Å; Q673-T676 PolarHBondContact OE1-OG1 3Å; Q673-I677 WeakPolarHBondContact O-CG1 3.45Å; Q673-I677 PolarHBondContact O-N 3.15Å
674	Y	89.3	Confident	89.2	Confident	19 Å²	19	56.4 Å²	56.4	8%	0.075	28%	0.281	C	S	.	.	H	α-helix	trans	-63.2	-42.4	177.7	-176.6	-94.2	0	0	0	112.1	F670 S671 T676 I677 C708 I709 F723 V724	F670-Y674 VanDerWaalsContact O-CB 3.28Å; F670-Y674 WeakPolarHBondContact O-CB 3.39Å; F670-Y674 PolarHBondContact O-N 3.09Å; S671-Y674 PolarHBondContact O-N 3.18Å; Y674-T676 VanDerWaalsContact C-N 3.33Å; Y674-T676 PolarHBondContact O-N 3.22Å; Y674-I677 HydrophobicContact CD2-CD1 3.43Å; Y674-I677 VanDerWaalsContact CD2-CD1 3.43Å; Y674-I677 HydrophobicContact CE2-CD1 3.88Å; Y674-I677 HydrophobicContact CG-CD1 4.08Å; Y674-I677 WeakPolarHBondContact O-CB 3.47Å; Y674-I677 PolarHBondContact O-N 3.17Å; Y674-C708 HydrophobicContact CD1-CB 4.46Å; Y674-I709 HydrophobicContact CD2-CD1 4.5Å; Y674-I709 HydrophobicContact CD2-CG1 4.11Å; Y674-I709 HydrophobicContact CE2-CB 4.39Å; Y674-I709 HydrophobicContact CE2-CD1 4.26Å; Y674-I709 HydrophobicContact CE2-CG1 3.82Å; Y674-I709 HydrophobicContact CE2-CG2 4.13Å; Y674-F723 HydrophobicContact CD2-CD1 4.18Å; Y674-F723 HydrophobicContact CD2-CE1 4.15Å; Y674-F723 HydrophobicContact CE2-CD1 4.3Å; Y674-V724 HydrophobicContact CE2-CG2 4.21Å
675	D	89.2	Confident	89.2	Confident	114 Å²	114	52.1 Å²	52.1	61%	0.61	26%	0.261	S	S	*	.	H	α-helix	trans	-67.5	-35.4	176.9	-70.7	-20	0	0	0	111.9	S671 H678	S671-D675 PolarHBondContact O-N 3.38Å; D675-H678 PolarHBondContact O-CE1 2.89Å; D675-H678 PolarHBondContact O-ND1 2.94Å
676	T	88.6	Confident	89.1	Confident	45 Å²	45	56.6 Å²	56.6	28%	0.276	28%	0.276	S	S	.	.	H	α-helix	trans	-88.4	-1	-179.3	58.9	0	0	0	0	115	E672 Q673 Y674 H678 R679	E672-T676 WeakPolarHBondContact O-CG2 3.32Å; E672-T676 PolarHBondContact O-N 3.01Å; E672-T676 PolarHBondContact O-OG1 3.42Å; Q673-T676 WeakPolarHBondContact CA-OG1 3.47Å; Q673-T676 CarbonylContact O-C 3.6Å; Q673-T676 PolarHBondContact O-N 3.01Å; Q673-T676 PolarHBondContact O-OG1 2.92Å; Q673-T676 PolarHBondContact OE1-OG1 3Å; Y674-T676 VanDerWaalsContact C-N 3.33Å; Y674-T676 PolarHBondContact O-N 3.22Å; T676-H678 PolarHBondContact O-N 3.09Å; T676-R679 WeakPolarHBondContact O-CB 3.42Å; T676-R679 PolarHBondContact O-N 3.01Å
677	I	88.4	Confident	89.1	Confident	3 Å²	3	56.7 Å²	56.7	2%	0.015	28%	0.276	C	S	.	.	G	3₁₀ helix	trans	-42.6	-36.8	175.5	-90.2	168.1	0	0	0	113.5	Q673 Y674 R679 L680 L685 S719 F723	Q673-I677 WeakPolarHBondContact O-CG1 3.45Å; Q673-I677 PolarHBondContact O-N 3.15Å; Y674-I677 HydrophobicContact CD2-CD1 3.43Å; Y674-I677 VanDerWaalsContact CD2-CD1 3.43Å; Y674-I677 HydrophobicContact CE2-CD1 3.88Å; Y674-I677 HydrophobicContact CG-CD1 4.08Å; Y674-I677 WeakPolarHBondContact O-CB 3.47Å; Y674-I677 PolarHBondContact O-N 3.17Å; I677-R679 PolarHBondContact O-N 3.02Å; I677-R679 VanDerWaalsContact O-N 3.11Å; I677-L680 PolarHBondContact O-N 3.29Å; I677-L685 HydrophobicContact CB-CD2 4.14Å; I677-L685 HydrophobicContact CG1-CD2 3.79Å; I677-L685 HydrophobicContact CG2-CD2 3.9Å; I677-S719 VanDerWaalsContact CG2-C 3.44Å; I677-S719 VanDerWaalsContact CG2-CB 3.45Å; I677-F723 HydrophobicContact CD1-CB 3.72Å; I677-F723 HydrophobicContact CD1-CD1 3.53Å; I677-F723 HydrophobicContact CD1-CD2 3.85Å; I677-F723 HydrophobicContact CD1-CE1 4.05Å; I677-F723 HydrophobicContact CD1-CE2 4.33Å; I677-F723 HydrophobicContact CD1-CG 3.41Å; I677-F723 VanDerWaalsContact CD1-CG 3.41Å; I677-F723 HydrophobicContact CD1-CZ 4.43Å; I677-F723 HydrophobicContact CG1-CB 4.48Å; I677-F723 HydrophobicContact CG1-CD2 4.3Å; I677-F723 HydrophobicContact CG1-CG 4.28Å
678	H	85.8	Confident	89.2	Confident	100 Å²	100	54.4 Å²	54.4	46%	0.463	27%	0.266	S	S	.	.	G	3₁₀ helix	trans	-60.9	-19.4	-178.3	65.9	-90.4	0	0	0	113.9	D675 T676	D675-H678 PolarHBondContact O-CE1 2.89Å; D675-H678 PolarHBondContact O-ND1 2.94Å; T676-H678 PolarHBondContact O-N 3.09Å
679	R	87.4	Confident	89.3	Confident	193 Å²	193	52.7 Å²	52.7	73%	0.728	25%	0.252	S	S	*	.	G	3₁₀ helix	trans	-92.5	-14	177.6	-52.3	-176.6	-178.7	179.6	-2.8	113.5	T676 I677	T676-R679 WeakPolarHBondContact O-CB 3.42Å; T676-R679 PolarHBondContact O-N 3.01Å; I677-R679 PolarHBondContact O-N 3.02Å; I677-R679 VanDerWaalsContact O-N 3.11Å
680	L	84.1	Confident	89.4	Confident	36 Å²	36	56.2 Å²	56.2	19%	0.188	27%	0.265	C	S	.	.	S	Bend	trans	-89.9	137.2	-173	-66.8	176.3	0	0	0	111.9	I677 K684 L685	I677-L680 PolarHBondContact O-N 3.29Å; L680-K684 HydrophobicContact CB-CB 4.47Å; L680-K684 HydrophobicContact CD2-CD 4.24Å; L680-L685 HydrophobicContact CB-CD2 3.68Å; L680-L685 HydrophobicContact CB-CG 3.81Å; L680-L685 HydrophobicContact CD1-CD2 4.03Å; L680-L685 HydrophobicContact CG-CD2 4.49Å; L680-L685 WeakPolarHBondContact O-CD1 3.46Å
681	E	87.6	Confident	89.4	Confident	107 Å²	107	56 Å²	56	50%	0.5	26%	0.264	S	S	.	.			trans	-70.2	153.3	177.4	-159.5	-134.2	106.4	0	0	111.7	N683 K684 L685	E681-N683 PolarHBondContact O-N 2.87Å; E681-N683 VanDerWaalsContact O-N 3.1Å; E681-N683 WeakPolarHBondContact OE1-CB 3.29Å; E681-N683 PolarHBondContact OE1-N 2.97Å; E681-N683 PolarHBondContact OE1-ND2 3.14Å; E681-K684 HydrophobicContact CB-CG 4.36Å; E681-K684 WeakPolarHBondContact O-CB 3.44Å; E681-K684 PolarHBondContact O-N 3.14Å; E681-L685 PolarHBondContact O-N 3.11Å
682	T	86.4	Confident	89.6	Confident	76 Å²	76	54.4 Å²	54.4	47%	0.466	25%	0.253	S	S	.	.	H	α-helix	trans	-58.1	-29.8	-173.1	66.6	0	0	0	0	114.6	R686	T682-R686 PolarHBondContact O-N 3.28Å
683	N	88.5	Confident	89.7	Confident	84 Å²	84	50.3 Å²	50.3	45%	0.449	23%	0.233	S	C	.	.	H	α-helix	trans	-72.5	-42.8	174.2	-68.5	-58.4	0	0	0	111.9	E681 R686 N687	E681-N683 PolarHBondContact O-N 2.87Å; E681-N683 VanDerWaalsContact O-N 3.1Å; E681-N683 WeakPolarHBondContact OE1-CB 3.29Å; E681-N683 PolarHBondContact OE1-N 2.97Å; E681-N683 PolarHBondContact OE1-ND2 3.14Å; N683-R686 WeakPolarHBondContact O-CB 3.42Å; N683-R686 PolarHBondContact O-N 3.21Å; N683-N687 PolarHBondContact O-N 3.07Å
684	K	89.9	Confident	89.8	Confident	61 Å²	61	49 Å²	49	27%	0.265	23%	0.227	S	C	.	.	H	α-helix	trans	-61.2	-48.3	174.8	-58.8	-159.9	167.9	-163.6	0	111.2	A639 L680 E681 R686 N687 V688	A639-K684 HydrophobicContact CB-CB 4.44Å; A639-K684 WeakPolarHBondContact O-CG 3.3Å; L680-K684 HydrophobicContact CB-CB 4.47Å; L680-K684 HydrophobicContact CD2-CD 4.24Å; E681-K684 HydrophobicContact CB-CG 4.36Å; E681-K684 WeakPolarHBondContact O-CB 3.44Å; E681-K684 PolarHBondContact O-N 3.14Å; K684-R686 VanDerWaalsContact C-N 3.25Å; K684-R686 PolarHBondContact O-N 3.42Å; K684-N687 PolarHBondContact O-N 3Å; K684-N687 VanDerWaalsContact O-N 3.09Å; K684-V688 WeakPolarHBondContact O-CG2 3.48Å; K684-V688 PolarHBondContact O-N 2.67Å
685	L	90.1	Very high	89.9	Confident	1 Å²	1	48.1 Å²	48.1	1%	0.005	22%	0.224	C	C	.	.	H	α-helix	trans	-55.3	-39.5	175.9	-71.6	175.5	0	0	0	112.4	I677 L680 E681 A689 F723	I677-L685 HydrophobicContact CB-CD2 4.14Å; I677-L685 HydrophobicContact CG1-CD2 3.79Å; I677-L685 HydrophobicContact CG2-CD2 3.9Å; L680-L685 HydrophobicContact CB-CD2 3.68Å; L680-L685 HydrophobicContact CB-CG 3.81Å; L680-L685 HydrophobicContact CD1-CD2 4.03Å; L680-L685 HydrophobicContact CG-CD2 4.49Å; L680-L685 WeakPolarHBondContact O-CD1 3.46Å; E681-L685 PolarHBondContact O-N 3.11Å; L685-A689 WeakPolarHBondContact O-CB 3.41Å; L685-A689 PolarHBondContact O-N 2.89Å; L685-F723 HydrophobicContact CD2-CD2 4.26Å
686	R	90.4	Very high	90	Very high	108 Å²	108	42.8 Å²	42.8	41%	0.408	20%	0.195	S	C	.	.	H	α-helix	trans	-63.3	-43.3	176.6	-176.7	-175.5	-56.2	-74.1	-2	112.2	T682 N683 K684 R690 I726	T682-R686 PolarHBondContact O-N 3.28Å; N683-R686 WeakPolarHBondContact O-CB 3.42Å; N683-R686 PolarHBondContact O-N 3.21Å; K684-R686 VanDerWaalsContact C-N 3.25Å; K684-R686 PolarHBondContact O-N 3.42Å; R686-R690 WeakPolarHBondContact O-CB 3.44Å; R686-R690 WeakPolarHBondContact O-CG 3.5Å; R686-R690 PolarHBondContact O-N 3.18Å; R686-I726 HydrophobicContact CB-CD1 4.01Å; R686-I726 HydrophobicContact CG-CD1 4.23Å; R686-I726 HydrophobicContact CG-CG2 4.35Å
687	N	92.6	Very high	90.1	Very high	3 Å²	3	45.1 Å²	45.1	2%	0.016	20%	0.2	C	C	.	.	H	α-helix	trans	-73.1	-43.8	-178.9	-66.1	-5.6	0	0	0	112	C638 Q641 Y644 N683 K684 A689 R690 L691	C638-N687 VanDerWaalsContact O-CB 3.22Å; C638-N687 WeakPolarHBondContact O-CB 3.08Å; C638-N687 PolarHBondContact O-ND2 3.27Å; Q641-N687 PolarHBondContact O-ND2 2.68Å; Y644-N687 HydrophobicContact CD2-CB 4.5Å; Y644-N687 PolarHBondContact N-OD1 3.39Å; N683-N687 PolarHBondContact O-N 3.07Å; K684-N687 PolarHBondContact O-N 3Å; K684-N687 VanDerWaalsContact O-N 3.09Å; N687-A689 PolarHBondContact O-N 2.86Å; N687-R690 WeakPolarHBondContact O-CB 3.45Å; N687-R690 PolarHBondContact O-N 2.95Å; N687-R690 VanDerWaalsContact O-N 3.15Å; N687-L691 PolarHBondContact O-N 3.07Å
688	V	92	Very high	90.2	Very high	2 Å²	2	47.6 Å²	47.6	1%	0.012	22%	0.215	C	C	.	.	H	α-helix	trans	-61.4	-44.9	177.7	175.5	0	0	0	0	110.7	L635 A639 K684 R690 L691 F692 F723	L635-V688 HydrophobicContact CD1-CG1 4.19Å; L635-V688 HydrophobicContact CD1-CG2 4.1Å; A639-V688 HydrophobicContact CB-CG2 3.69Å; K684-V688 WeakPolarHBondContact O-CG2 3.48Å; K684-V688 PolarHBondContact O-N 2.67Å; V688-R690 VanDerWaalsContact C-N 3.28Å; V688-R690 PolarHBondContact O-N 3.48Å; V688-L691 PolarHBondContact O-N 3.07Å; V688-F692 HydrophobicContact CG1-CD2 3.8Å; V688-F692 HydrophobicContact CG1-CE2 3.68Å; V688-F692 VanDerWaalsContact O-CD2 3.31Å; V688-F692 WeakPolarHBondContact O-CD2 3.45Å; V688-F692 PolarHBondContact O-N 3.39Å; V688-F692 VanDerWaalsContact O-N 3.13Å; V688-F723 HydrophobicContact CB-CE2 4.42Å; V688-F723 HydrophobicContact CG1-CE2 3.95Å
689	A	92.3	Very high	90.2	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-60.6	-36.3	175	0	0	0	0	0	112.7	L685 N687 A693 F723 I726 L727	L685-A689 WeakPolarHBondContact O-CB 3.41Å; L685-A689 PolarHBondContact O-N 2.89Å; N687-A689 PolarHBondContact O-N 2.86Å; A689-A693 VanDerWaalsContact O-CB 3.25Å; A689-A693 WeakPolarHBondContact O-CB 3.36Å; A689-A693 PolarHBondContact O-N 3.41Å; A689-F723 HydrophobicContact CB-CD2 3.72Å; A689-F723 HydrophobicContact CB-CE2 3.68Å; A689-F723 HydrophobicContact CB-CG 4.43Å; A689-F723 HydrophobicContact CB-CZ 4.37Å; A689-I726 HydrophobicContact CB-CB 3.96Å; A689-I726 HydrophobicContact CB-CG2 3.76Å; A689-L727 HydrophobicContact CB-CB 4.38Å; A689-L727 WeakPolarHBondContact O-CD1 3.15Å
690	R	92.3	Very high	90.2	Very high	73 Å²	73	37.7 Å²	37.7	28%	0.275	18%	0.18	S	C	.	.	H	α-helix	trans	-72.8	-35.2	177.3	-76.7	178.3	155.3	-166.4	-19.6	113.5	Y644 R686 N687 V688 H694 I726 E730	Y644-R690 HydrophobicContact CD1-CB 3.66Å; Y644-R690 HydrophobicContact CD1-CG 4.35Å; Y644-R690 HydrophobicContact CD2-CB 3.64Å; Y644-R690 HydrophobicContact CE1-CB 3.95Å; Y644-R690 HydrophobicContact CE2-CB 3.95Å; Y644-R690 HydrophobicContact CG-CB 3.48Å; Y644-R690 VanDerWaalsContact CG-CB 3.48Å; Y644-R690 HydrophobicContact CG-CG 4.29Å; R686-R690 WeakPolarHBondContact O-CB 3.44Å; R686-R690 WeakPolarHBondContact O-CG 3.5Å; R686-R690 PolarHBondContact O-N 3.18Å; N687-R690 WeakPolarHBondContact O-CB 3.45Å; N687-R690 PolarHBondContact O-N 2.95Å; N687-R690 VanDerWaalsContact O-N 3.15Å; V688-R690 VanDerWaalsContact C-N 3.28Å; V688-R690 PolarHBondContact O-N 3.48Å; R690-H694 PolarHBondContact O-N 2.96Å; R690-I726 HydrophobicContact CG-CG2 4.31Å; R690-E730 HydrophobicContact CG-CB 4.42Å; R690-E730 HydrophobicContact CG-CG 3.96Å; R690-E730 IonicContact CZ-OE1 2.7Å; R690-E730 IonicContact CZ-OE2 3.3Å; R690-E730 VanDerWaalsContact NE-CD 3.33Å; R690-E730 IonicContact NE-OE1 3.33Å; R690-E730 PolarHBondContact NE-OE1 3.13Å; R690-E730 IonicContact NE-OE2 3.14Å; R690-E730 PolarHBondContact NE-OE2 3.33Å; R690-E730 IonicContact NH2-OE1 3.46Å; R690-E730 IonicContact NH2-OE2 3.66Å; R690-E730 PolarHBondContact NH2-OE2 3.04Å
691	L	93.1	Very high	90.4	Very high	0 Å²	0	36 Å²	36	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-62.2	-52.8	174	-170.5	79.1	0	0	0	110.5	L635 Y644 F648 G649 N687 V688 A693 H694 L695	L635-L691 HydrophobicContact CD1-CD2 3.42Å; L635-L691 VanDerWaalsContact CD1-CD2 3.42Å; Y644-L691 HydrophobicContact CE2-CB 3.98Å; Y644-L691 HydrophobicContact CE2-CD1 4.04Å; F648-L691 HydrophobicContact CB-CD1 3.64Å; G649-L691 VanDerWaalsContact CA-CD1 3.5Å; G649-L691 VanDerWaalsContact N-CD1 3.31Å; N687-L691 PolarHBondContact O-N 3.07Å; V688-L691 PolarHBondContact O-N 3.07Å; L691-A693 VanDerWaalsContact C-N 3.35Å; L691-A693 PolarHBondContact O-N 3.38Å; L691-H694 WeakPolarHBondContact O-CA 3.28Å; L691-H694 WeakPolarHBondContact O-CB 3.38Å; L691-H694 PolarHBondContact O-N 2.87Å; L691-L695 HydrophobicContact CG-CD1 4.31Å; L691-L695 WeakPolarHBondContact O-CG 3.49Å; L691-L695 PolarHBondContact O-N 2.94Å
692	F	92.7	Very high	90.4	Very high	3 Å²	3	33.1 Å²	33.1	1%	0.013	16%	0.162	C	C	.	.	H	α-helix	trans	-68.6	-32.1	-180	-70.2	-64.5	0	0	0	112.7	L635 F670 V688 H694 L695 L696 L727	L635-F692 HydrophobicContact CD1-CE2 4.21Å; L635-F692 HydrophobicContact CD1-CZ 4.47Å; L635-F692 HydrophobicContact CD2-CE2 4.13Å; L635-F692 HydrophobicContact CD2-CZ 4.07Å; F670-F692 HydrophobicContact CB-CE1 4.03Å; F670-F692 HydrophobicContact CB-CZ 4.13Å; F670-F692 HydrophobicContact CD2-CB 4.03Å; F670-F692 AromaticContact CD2-CD1 3.56Å; F670-F692 HydrophobicContact CD2-CD1 3.56Å; F670-F692 AromaticContact CD2-CD2 3.61Å; F670-F692 HydrophobicContact CD2-CD2 3.61Å; F670-F692 AromaticContact CD2-CE1 3.79Å; F670-F692 HydrophobicContact CD2-CE1 3.79Å; F670-F692 AromaticContact CD2-CE2 3.83Å; F670-F692 HydrophobicContact CD2-CE2 3.83Å; F670-F692 AromaticContact CD2-CG 3.46Å; F670-F692 HydrophobicContact CD2-CG 3.46Å; F670-F692 VanDerWaalsContact CD2-CG 3.46Å; F670-F692 AromaticContact CD2-CZ 3.91Å; F670-F692 HydrophobicContact CD2-CZ 3.91Å; F670-F692 HydrophobicContact CE2-CB 3.83Å; F670-F692 HydrophobicContact CE2-CD1 4.25Å; F670-F692 AromaticContact CE2-CD2 3.94Å; F670-F692 HydrophobicContact CE2-CD2 3.94Å; F670-F692 AromaticContact CE2-CG 3.77Å; F670-F692 HydrophobicContact CE2-CG 3.77Å; F670-F692 HydrophobicContact CG-CD1 4.49Å; F670-F692 HydrophobicContact CG-CE1 4.42Å; V688-F692 HydrophobicContact CG1-CD2 3.8Å; V688-F692 HydrophobicContact CG1-CE2 3.68Å; V688-F692 VanDerWaalsContact O-CD2 3.31Å; V688-F692 WeakPolarHBondContact O-CD2 3.45Å; V688-F692 PolarHBondContact O-N 3.39Å; V688-F692 VanDerWaalsContact O-N 3.13Å; F692-H694 VanDerWaalsContact C-N 3.29Å; F692-H694 PolarHBondContact O-N 3.29Å; F692-L695 HydrophobicContact CD1-CD1 3.86Å; F692-L695 HydrophobicContact CE1-CD1 4.18Å; F692-L695 PolarHBondContact O-N 3.32Å; F692-L696 WeakPolarHBondContact O-CB 3.43Å; F692-L696 WeakPolarHBondContact O-CG 3.48Å; F692-L696 PolarHBondContact O-N 3.46Å; F692-L727 HydrophobicContact CB-CD1 4.15Å
693	A	92.8	Very high	90.5	Very high	0 Å²	0	30 Å²	30	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-59.7	-38.9	168.1	0	0	0	0	0	112.3	A689 L691 Y697 L727 E730 L731	A689-A693 VanDerWaalsContact O-CB 3.25Å; A689-A693 WeakPolarHBondContact O-CB 3.36Å; A689-A693 PolarHBondContact O-N 3.41Å; L691-A693 VanDerWaalsContact C-N 3.35Å; L691-A693 PolarHBondContact O-N 3.38Å; A693-Y697 WeakPolarHBondContact O-CB 3.45Å; A693-Y697 PolarHBondContact O-N 3.06Å; A693-L727 HydrophobicContact CB-CD1 4.1Å; A693-E730 HydrophobicContact CB-CB 3.84Å; A693-E730 HydrophobicContact CB-CG 4.08Å; A693-L731 HydrophobicContact CB-CD2 4.36Å; A693-L731 HydrophobicContact CB-CG 3.98Å; A693-L731 VanDerWaalsContact O-CD2 3.26Å; A693-L731 WeakPolarHBondContact O-CD2 3.18Å
694	H	92.3	Very high	90.3	Very high	2 Å²	2	27.6 Å²	27.6	1%	0.009	13%	0.131	C	C	.	.	H	α-helix	trans	-68.8	-43.9	175.7	-172.2	-82.8	0	0	0	111.9	Y644 K646 G649 R690 L691 F692 Y697 T698	Y644-H694 WeakPolarHBondContact OH-CB 3.5Å; K646-H694 WeakPolarHBondContact CE-NE2 3.49Å; G649-H694 VanDerWaalsContact C-CE1 3.49Å; G649-H694 VanDerWaalsContact C-ND1 3.27Å; G649-H694 PolarHBondContact O-CE1 3.11Å; G649-H694 PolarHBondContact O-ND1 3.05Å; G649-H694 VanDerWaalsContact O-ND1 3.07Å; R690-H694 PolarHBondContact O-N 2.96Å; L691-H694 WeakPolarHBondContact O-CA 3.28Å; L691-H694 WeakPolarHBondContact O-CB 3.38Å; L691-H694 PolarHBondContact O-N 2.87Å; F692-H694 VanDerWaalsContact C-N 3.29Å; F692-H694 PolarHBondContact O-N 3.29Å; H694-Y697 PolarHBondContact O-N 3.46Å; H694-T698 PolarHBondContact O-N 2.99Å; H694-T698 PolarHBondContact O-OG1 2.91Å
695	L	91.9	Very high	90.1	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-63.7	-41.8	179.4	-69.4	171.7	0	0	0	113.1	A652 G653 L691 F692 T698 D699 S700 V701	A652-L695 HydrophobicContact CB-CD1 4.26Å; A652-L695 HydrophobicContact CB-CD2 3.91Å; G653-L695 VanDerWaalsContact N-CD2 3.3Å; L691-L695 HydrophobicContact CG-CD1 4.31Å; L691-L695 WeakPolarHBondContact O-CG 3.49Å; L691-L695 PolarHBondContact O-N 2.94Å; F692-L695 HydrophobicContact CD1-CD1 3.86Å; F692-L695 HydrophobicContact CE1-CD1 4.18Å; F692-L695 PolarHBondContact O-N 3.32Å; L695-T698 PolarHBondContact O-OG1 2.87Å; L695-D699 PolarHBondContact O-N 2.92Å; L695-S700 PolarHBondContact O-N 3.24Å; L695-V701 HydrophobicContact CB-CB 4.36Å; L695-V701 HydrophobicContact CB-CG2 3.99Å; L695-V701 HydrophobicContact CD1-CG2 4.2Å; L695-V701 HydrophobicContact CG-CG2 4.49Å
696	L	91.1	Very high	89.9	Confident	2 Å²	2	25.2 Å²	25.2	1%	0.01	12%	0.122	C	C	.	.	H	α-helix	trans	-69.6	-36	174	-71.5	169.1	0	0	0	111.9	F692 D699 W703 V705 L706 L731	F692-L696 WeakPolarHBondContact O-CB 3.43Å; F692-L696 WeakPolarHBondContact O-CG 3.48Å; F692-L696 PolarHBondContact O-N 3.46Å; L696-D699 PolarHBondContact O-N 3.5Å; L696-W703 HydrophobicContact CB-CZ2 4.28Å; L696-W703 HydrophobicContact CD2-CD2 4.28Å; L696-W703 HydrophobicContact CD2-CG 4.11Å; L696-W703 PolarHBondContact O-NE1 3.32Å; L696-V705 HydrophobicContact CD2-CG2 4.13Å; L696-L706 HydrophobicContact CD1-CD1 4.46Å; L696-L706 HydrophobicContact CD1-CD2 4.1Å; L696-L706 HydrophobicContact CD1-CG 4.45Å; L696-L731 HydrophobicContact CB-CD2 4.05Å; L696-L731 HydrophobicContact CD1-CD1 4.43Å
697	Y	91.1	Very high	89.6	Confident	94 Å²	94	24.9 Å²	24.9	37%	0.369	13%	0.125	S	C	.	.	H	α-helix	trans	-65.4	-38.5	174.3	165.7	-114.4	0	0	0	112.9	A693 H694 D699 Y734 M735	A693-Y697 WeakPolarHBondContact O-CB 3.45Å; A693-Y697 PolarHBondContact O-N 3.06Å; H694-Y697 PolarHBondContact O-N 3.46Å; Y697-D699 PolarHBondContact O-N 2.97Å; Y697-Y734 HydrophobicContact CD1-CD1 4.1Å; Y697-Y734 HydrophobicContact CD1-CD2 4.45Å; Y697-Y734 AromaticContact CD1-CG 3.9Å; Y697-Y734 HydrophobicContact CD1-CG 3.9Å; Y697-Y734 HydrophobicContact CD2-CG 4.45Å; Y697-Y734 HydrophobicContact CE1-CD1 4.11Å; Y697-Y734 HydrophobicContact CE1-CG 4.27Å; Y697-Y734 HydrophobicContact CG-CD2 4.43Å; Y697-Y734 AromaticContact CG-CG 4Å; Y697-Y734 HydrophobicContact CG-CG 4Å; Y697-M735 HydrophobicContact CD2-CG 3.67Å; Y697-M735 HydrophobicContact CE2-CG 4.24Å
698	T	89.3	Confident	89.2	Confident	54 Å²	54	27.3 Å²	27.3	33%	0.331	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.2	11.4	177.5	56.2	0	0	0	0	113.4	H694 L695 S700	H694-T698 PolarHBondContact O-N 2.99Å; H694-T698 PolarHBondContact O-OG1 2.91Å; L695-T698 PolarHBondContact O-OG1 2.87Å; T698-S700 WeakPolarHBondContact CB-OG 3.46Å; T698-S700 PolarHBondContact O-N 3.13Å; T698-S700 PolarHBondContact O-OG 3.21Å; T698-S700 PolarHBondContact OG1-OG 3.37Å
699	D	86.9	Confident	88.9	Confident	80 Å²	80	27.2 Å²	27.2	43%	0.428	14%	0.141	S	C	.	.	T	Hydrogen-bonded Turn	trans	45.5	33.8	-174.6	-69.4	-44.2	0	0	0	112.6	L695 L696 Y697 W703 R743	L695-D699 PolarHBondContact O-N 2.92Å; L696-D699 PolarHBondContact O-N 3.5Å; Y697-D699 PolarHBondContact O-N 2.97Å; D699-W703 PolarHBondContact OD1-NE1 3.03Å; D699-R743 IonicContact OD1-CZ 2.77Å; D699-R743 IonicContact OD1-NH1 3.8Å; D699-R743 PolarHBondContact OD1-NH1 3.41Å; D699-R743 IonicContact OD1-NH2 3.22Å; D699-R743 IonicContact OD2-CZ 3.89Å; D699-R743 IonicContact OD2-NH1 3.3Å; D699-R743 PolarHBondContact OD2-NH1 3.41Å; D699-R743 IonicContact OD2-NH2 3.97Å; D699-R743 PolarHBondContact OD2-NH2 3.41Å
700	S	87.8	Confident	88.4	Confident	5 Å²	5	35.3 Å²	35.3	4%	0.035	17%	0.172	C	C	.	.			trans	-95.6	-9.2	-175.5	-49.6	0	0	0	0	113.1	C656 L695 T698	C656-S700 WeakPolarHBondContact CB-O 3.48Å; C656-S700 PolarHBondContact SG-O 3.34Å; L695-S700 PolarHBondContact O-N 3.24Å; T698-S700 WeakPolarHBondContact CB-OG 3.46Å; T698-S700 PolarHBondContact O-N 3.13Å; T698-S700 PolarHBondContact O-OG 3.21Å; T698-S700 PolarHBondContact OG1-OG 3.37Å
701	V	87.6	Confident	87.8	Confident	2 Å²	2	32 Å²	32	1%	0.012	16%	0.159	C	C	.	.	S	Bend	trans	-133.6	134.9	168.5	171.2	0	0	0	0	105.7	F666 E667 L695 V705	F666-V701 HydrophobicContact CB-CG2 4.28Å; E667-V701 HydrophobicContact CG-CG1 3.92Å; L695-V701 HydrophobicContact CB-CB 4.36Å; L695-V701 HydrophobicContact CB-CG2 3.99Å; L695-V701 HydrophobicContact CD1-CG2 4.2Å; L695-V701 HydrophobicContact CG-CG2 4.49Å; V701-V705 HydrophobicContact CG1-CG1 3.73Å; V701-V705 HydrophobicContact CG1-CG2 4.18Å
702	P	87.8	Confident	87.2	Confident	45 Å²	45	32.7 Å²	32.7	29%	0.292	17%	0.165	S	C	.	.			trans	-66.5	148.5	-178.5	28.5	-36	0	0	0	111.7	E667 S704 V705	E667-P702 HydrophobicContact CG-CG 4.06Å; E667-P702 VanDerWaalsContact OE1-CD 3.24Å; E667-P702 WeakPolarHBondContact OE1-CD 3.26Å; E667-P702 VanDerWaalsContact OE1-CG 3.23Å; E667-P702 WeakPolarHBondContact OE1-CG 3.47Å; E667-P702 WeakPolarHBondContact OE2-CG 3.32Å; P702-S704 WeakPolarHBondContact CB-OG 3.24Å; P702-S704 WeakPolarHBondContact CG-OG 3.23Å; P702-S704 PolarHBondContact O-N 2.81Å; P702-S704 VanDerWaalsContact O-N 3.1Å; P702-V705 PolarHBondContact O-N 2.97Å
703	W	87.3	Confident	86.4	Confident	11 Å²	11	37.9 Å²	37.9	4%	0.042	19%	0.189	C	C	.	.	G	3₁₀ helix	trans	-70.8	-4.8	-177.6	-71.7	62.6	0	0	0	113.6	L696 D699 V705 L706 L731 M735 L740 L744 L749 F753	L696-W703 HydrophobicContact CB-CZ2 4.28Å; L696-W703 HydrophobicContact CD2-CD2 4.28Å; L696-W703 HydrophobicContact CD2-CG 4.11Å; L696-W703 PolarHBondContact O-NE1 3.32Å; D699-W703 PolarHBondContact OD1-NE1 3.03Å; W703-V705 PolarHBondContact O-N 3.1Å; W703-L706 HydrophobicContact CE3-CD1 3.76Å; W703-L706 HydrophobicContact CZ3-CD1 4.29Å; W703-L706 WeakPolarHBondContact O-CB 3.39Å; W703-L706 PolarHBondContact O-N 3.29Å; W703-L731 HydrophobicContact CH2-CD1 4.43Å; W703-L731 HydrophobicContact CH2-CD2 4.32Å; W703-M735 HydrophobicContact CH2-CE 4.32Å; W703-M735 HydrophobicContact CH2-SD 3.9Å; W703-M735 HydrophobicContact CZ2-CE 3.94Å; W703-M735 HydrophobicContact CZ2-SD 4.03Å; W703-L740 HydrophobicContact CH2-CD1 3.87Å; W703-L740 HydrophobicContact CZ3-CD1 4.13Å; W703-L744 HydrophobicContact CE3-CD2 4.44Å; W703-L744 HydrophobicContact CZ3-CD2 4.1Å; W703-L749 HydrophobicContact CB-CD1 4.46Å; W703-F753 HydrophobicContact CB-CE1 4.32Å; W703-F753 HydrophobicContact CB-CZ 4.16Å; W703-F753 HydrophobicContact CE3-CE1 4.37Å; W703-F753 HydrophobicContact CE3-CZ 4.02Å
704	S	85.3	Confident	85.5	Confident	34 Å²	34	46.7 Å²	46.7	24%	0.238	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	-58.7	-30.1	172.1	43.3	0	0	0	0	113.5	P702 L706 E707	P702-S704 WeakPolarHBondContact CB-OG 3.24Å; P702-S704 WeakPolarHBondContact CG-OG 3.23Å; P702-S704 PolarHBondContact O-N 2.81Å; P702-S704 VanDerWaalsContact O-N 3.1Å; S704-L706 PolarHBondContact O-N 3.14Å; S704-E707 VanDerWaalsContact O-CB 3.3Å; S704-E707 WeakPolarHBondContact O-CB 3.39Å; S704-E707 PolarHBondContact O-N 3.44Å
705	V	85.7	Confident	84.7	Confident	12 Å²	12	51 Å²	51	7%	0.073	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-58.2	-19	178.6	-57.1	0	0	0	0	113.7	E667 F670 L696 V701 P702 W703 E707	E667-V705 HydrophobicContact CB-CG1 3.9Å; E667-V705 HydrophobicContact CG-CG1 3.64Å; F670-V705 HydrophobicContact CB-CB 4.36Å; F670-V705 HydrophobicContact CD1-CB 3.64Å; F670-V705 HydrophobicContact CD1-CG2 3.89Å; F670-V705 WeakPolarHBondContact CD1-O 3.4Å; F670-V705 HydrophobicContact CE1-CB 4.18Å; F670-V705 HydrophobicContact CE1-CG2 4.07Å; F670-V705 WeakPolarHBondContact CE1-O 3.36Å; F670-V705 HydrophobicContact CG-CB 4.09Å; F670-V705 HydrophobicContact CG-CG2 4.17Å; L696-V705 HydrophobicContact CD2-CG2 4.13Å; V701-V705 HydrophobicContact CG1-CG1 3.73Å; V701-V705 HydrophobicContact CG1-CG2 4.18Å; P702-V705 PolarHBondContact O-N 2.97Å; W703-V705 PolarHBondContact O-N 3.1Å; V705-E707 PolarHBondContact O-N 3.09Å
706	L	84.9	Confident	84.3	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	26%	0.257	C	S	.	.	G	3₁₀ helix	trans	-74	-10.9	177.2	-62.2	176.8	0	0	0	113.6	F670 L696 W703 S704 C708 I709 L727 F753 L756	F670-L706 HydrophobicContact CE1-CD2 4.48Å; F670-L706 HydrophobicContact CZ-CD2 4.18Å; L696-L706 HydrophobicContact CD1-CD1 4.46Å; L696-L706 HydrophobicContact CD1-CD2 4.1Å; L696-L706 HydrophobicContact CD1-CG 4.45Å; W703-L706 HydrophobicContact CE3-CD1 3.76Å; W703-L706 HydrophobicContact CZ3-CD1 4.29Å; W703-L706 WeakPolarHBondContact O-CB 3.39Å; W703-L706 PolarHBondContact O-N 3.29Å; S704-L706 PolarHBondContact O-N 3.14Å; L706-C708 PolarHBondContact O-N 3.3Å; L706-I709 HydrophobicContact CD2-CD1 3.62Å; L706-I709 WeakPolarHBondContact O-CB 3.4Å; L706-I709 PolarHBondContact O-N 2.94Å; L706-L727 HydrophobicContact CD2-CD2 4.11Å; L706-F753 HydrophobicContact CB-CD1 4.33Å; L706-F753 HydrophobicContact CB-CE1 4.26Å; L706-F753 HydrophobicContact CD1-CD1 4.45Å; L706-F753 HydrophobicContact CD1-CE1 3.87Å; L706-L756 HydrophobicContact CB-CD1 3.9Å; L706-L756 HydrophobicContact CD1-CD1 4.27Å
707	E	85.5	Confident	84.1	Confident	100 Å²	100	53.7 Å²	53.7	47%	0.467	27%	0.273	S	S	.	.	G	3₁₀ helix	trans	-59.1	-32.5	176.6	-169.2	-172.3	147.3	0	0	112.6	S704 V705 I709 F752	S704-E707 VanDerWaalsContact O-CB 3.3Å; S704-E707 WeakPolarHBondContact O-CB 3.39Å; S704-E707 PolarHBondContact O-N 3.44Å; V705-E707 PolarHBondContact O-N 3.09Å; E707-I709 PolarHBondContact O-N 3.39Å; E707-F752 WeakPolarHBondContact CA-O 3.38Å; E707-F752 HydrophobicContact CB-CB 4.42Å; E707-F752 HydrophobicContact CB-CD1 4.33Å; E707-F752 PolarHBondContact N-O 3.26Å; E707-F752 WeakPolarHBondContact OE2-CD1 3.2Å
708	C	83.1	Confident	83.9	Confident	55 Å²	55	53.3 Å²	53.3	37%	0.372	28%	0.284	S	S	.	.	G	3₁₀ helix	trans	-62.4	-21.9	175.5	-57.9	0	0	0	0	113	Y674 L706 R710	Y674-C708 HydrophobicContact CD1-CB 4.46Å; L706-C708 PolarHBondContact O-N 3.3Å; C708-R710 PolarHBondContact O-N 3.09Å; C708-R710 VanDerWaalsContact O-N 3.15Å
709	I	85.3	Confident	83.8	Confident	0 Å²	0	52 Å²	52	0%	0	28%	0.277	C	S	.	.			trans	-85.7	91.3	-173.9	-49.7	-174.5	0	0	0	110.8	F670 Y674 L706 E707 M711 V724 L727 G755 L756	F670-I709 HydrophobicContact CE1-CD1 4.3Å; F670-I709 HydrophobicContact CE1-CG1 4.45Å; F670-I709 HydrophobicContact CZ-CD1 4.11Å; Y674-I709 HydrophobicContact CD2-CD1 4.5Å; Y674-I709 HydrophobicContact CD2-CG1 4.11Å; Y674-I709 HydrophobicContact CE2-CB 4.39Å; Y674-I709 HydrophobicContact CE2-CD1 4.26Å; Y674-I709 HydrophobicContact CE2-CG1 3.82Å; Y674-I709 HydrophobicContact CE2-CG2 4.13Å; L706-I709 HydrophobicContact CD2-CD1 3.62Å; L706-I709 WeakPolarHBondContact O-CB 3.4Å; L706-I709 PolarHBondContact O-N 2.94Å; E707-I709 PolarHBondContact O-N 3.39Å; I709-M711 HydrophobicContact CG2-SD 4.07Å; I709-V724 HydrophobicContact CD1-CG2 4.32Å; I709-V724 HydrophobicContact CG2-CG2 3.69Å; I709-L727 HydrophobicContact CD1-CD2 4.25Å; I709-G755 CarbonylContact O-C 3.57Å; I709-L756 HydrophobicContact CB-CD2 3.97Å; I709-L756 HydrophobicContact CB-CG 4.22Å; I709-L756 HydrophobicContact CG2-CD2 3.57Å; I709-L756 HydrophobicContact CG2-CG 4.33Å; I709-L756 PolarHBondContact O-N 2.94Å
710	R	82.6	Confident	83.9	Confident	169 Å²	169	48.6 Å²	48.6	64%	0.638	26%	0.26	S	S	*	.			trans	-94.7	108.1	176.4	-64.6	-178	-179.3	174.8	0.7	112.4	C708 S712 T715 T716	C708-R710 PolarHBondContact O-N 3.09Å; C708-R710 VanDerWaalsContact O-N 3.15Å; R710-S712 PolarHBondContact O-N 3.08Å; R710-S712 VanDerWaalsContact O-N 3.15Å; R710-T715 PolarHBondContact O-OG1 3.5Å; R710-T716 PolarHBondContact O-OG1 3.1Å
711	M	79.3	Confident	83.9	Confident	3 Å²	3	52.3 Å²	52.3	2%	0.015	27%	0.273	C	S	.	.			trans	-84.5	76.1	-178.3	-65	-58.1	-42.6	0	0	112.5	I709 T716 V724 G755 L756 F767 F771	I709-M711 HydrophobicContact CG2-SD 4.07Å; M711-T716 HydrophobicContact CE-CG2 4.08Å; M711-T716 HydrophobicContact SD-CG2 4.37Å; M711-V724 HydrophobicContact SD-CG1 4.3Å; M711-G755 PolarHBondContact N-O 3.25Å; M711-L756 HydrophobicContact CG-CD2 4.13Å; M711-F767 HydrophobicContact CE-CE1 3.9Å; M711-F771 HydrophobicContact CE-CD1 3.37Å; M711-F771 HydrophobicContact CE-CE1 3.39Å; M711-F771 HydrophobicContact CE-CG 3.96Å; M711-F771 HydrophobicContact CE-CZ 4.02Å; M711-F771 HydrophobicContact SD-CD1 4.33Å; M711-F771 HydrophobicContact SD-CE1 3.97Å
712	S	80.4	Confident	84	Confident	16 Å²	16	55.6 Å²	55.6	11%	0.112	29%	0.29	C	S	.	.			trans	-116	157.7	170.3	91.1	0	0	0	0	113	R710 E714 T715 T716	R710-S712 PolarHBondContact O-N 3.08Å; R710-S712 VanDerWaalsContact O-N 3.15Å; S712-E714 VanDerWaalsContact C-N 3.25Å; S712-E714 PolarHBondContact O-N 3Å; S712-T715 WeakPolarHBondContact OG-CB 3.36Å; S712-T715 WeakPolarHBondContact OG-CG2 3.31Å; S712-T715 PolarHBondContact OG-N 2.87Å; S712-T715 PolarHBondContact OG-OG1 3.18Å; S712-T716 PolarHBondContact N-OG1 3.02Å; S712-T716 VanDerWaalsContact N-OG1 3.12Å; S712-T716 VanDerWaalsContact O-CB 3.26Å; S712-T716 WeakPolarHBondContact O-CB 3.47Å; S712-T716 PolarHBondContact O-N 3.44Å; S712-T716 PolarHBondContact O-OG1 3.32Å
713	E	76.9	Confident	84.2	Confident	112 Å²	112	53.7 Å²	53.7	52%	0.523	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-29.5	-178.2	-160.5	151.5	-122.8	0	0	112.3	R721 F767	E713-R721 PolarHBondContact O-NH2 3.4Å; E713-R721 VanDerWaalsContact O-NH2 3.13Å; E713-F767 HydrophobicContact CB-CD2 4.02Å; E713-F767 HydrophobicContact CB-CE2 4.25Å; E713-F767 HydrophobicContact CB-CG 4.33Å; E713-F767 HydrophobicContact CG-CD2 3.91Å; E713-F767 HydrophobicContact CG-CE2 4.02Å; E713-F767 WeakPolarHBondContact OE1-CD2 3.21Å
714	E	73.1	Confident	84.4	Confident	184 Å²	184	53.1 Å²	53.1	86%	0.86	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.8	-40.3	-177.3	-65.6	169.9	-171.5	0	0	113	S712	S712-E714 VanDerWaalsContact C-N 3.25Å; S712-E714 PolarHBondContact O-N 3Å
715	T	77	Confident	84.7	Confident	92 Å²	92	55.2 Å²	55.2	56%	0.564	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.2	-21.6	-175.8	63.9	0	0	0	0	114.4	R710 S712 T717	R710-T715 PolarHBondContact O-OG1 3.5Å; S712-T715 WeakPolarHBondContact OG-CB 3.36Å; S712-T715 WeakPolarHBondContact OG-CG2 3.31Å; S712-T715 PolarHBondContact OG-N 2.87Å; S712-T715 PolarHBondContact OG-OG1 3.18Å; T715-T717 PolarHBondContact O-N 2.8Å
716	T	82.6	Confident	84.9	Confident	3 Å²	3	55.2 Å²	55.2	2%	0.018	28%	0.279	C	S	.	.			trans	-89.2	106.8	-172	-39.2	0	0	0	0	111.3	R710 M711 S712 R721	R710-T716 PolarHBondContact O-OG1 3.1Å; M711-T716 HydrophobicContact CE-CG2 4.08Å; M711-T716 HydrophobicContact SD-CG2 4.37Å; S712-T716 PolarHBondContact N-OG1 3.02Å; S712-T716 VanDerWaalsContact N-OG1 3.12Å; S712-T716 VanDerWaalsContact O-CB 3.26Å; S712-T716 WeakPolarHBondContact O-CB 3.47Å; S712-T716 PolarHBondContact O-N 3.44Å; S712-T716 PolarHBondContact O-OG1 3.32Å; T716-R721 HydrophobicContact CG2-CG 3.7Å; T716-R721 VanDerWaalsContact O-CZ 3.23Å; T716-R721 PolarHBondContact O-NE 3.27Å; T716-R721 PolarHBondContact O-NH2 3.44Å
717	T	86.7	Confident	85.3	Confident	57 Å²	57	55.2 Å²	55.2	35%	0.35	28%	0.279	S	S	.	.			trans	-62.9	161.6	175.7	79.3	0	0	0	0	112.5	T715 S719 S720 R721	T715-T717 PolarHBondContact O-N 2.8Å; T717-S719 VanDerWaalsContact C-N 3.31Å; T717-S719 PolarHBondContact O-N 2.95Å; T717-S719 PolarHBondContact OG1-N 2.85Å; T717-S720 PolarHBondContact O-N 3.35Å; T717-S720 WeakPolarHBondContact OG1-CB 3.48Å; T717-S720 PolarHBondContact OG1-N 3.44Å; T717-S720 PolarHBondContact OG1-OG 2.79Å; T717-R721 VanDerWaalsContact O-CG 3.31Å; T717-R721 WeakPolarHBondContact O-CG 3.47Å; T717-R721 PolarHBondContact O-N 2.98Å
718	S	86.4	Confident	85.5	Confident	86 Å²	86	50.5 Å²	50.5	60%	0.601	26%	0.257	S	S	*	.	H	α-helix	trans	-59.2	-40.7	173.1	49.5	0	0	0	0	112.4	R721 I722	S718-R721 WeakPolarHBondContact O-CB 3.46Å; S718-R721 PolarHBondContact O-N 2.99Å; S718-I722 WeakPolarHBondContact O-CG1 3.3Å; S718-I722 PolarHBondContact O-N 2.89Å
719	S	87.8	Confident	85.9	Confident	25 Å²	25	51.7 Å²	51.7	18%	0.175	26%	0.257	C	S	.	.	H	α-helix	trans	-63.3	-41.9	174.8	-59.6	0	0	0	0	112	I677 T717 R721 I722 F723	I677-S719 VanDerWaalsContact CG2-C 3.44Å; I677-S719 VanDerWaalsContact CG2-CB 3.45Å; T717-S719 VanDerWaalsContact C-N 3.31Å; T717-S719 PolarHBondContact O-N 2.95Å; T717-S719 PolarHBondContact OG1-N 2.85Å; S719-R721 PolarHBondContact O-N 3.41Å; S719-I722 PolarHBondContact O-N 2.78Å; S719-F723 WeakPolarHBondContact O-CB 3.35Å; S719-F723 PolarHBondContact O-N 3.13Å
720	S	88.8	Confident	86.3	Confident	9 Å²	9	53.1 Å²	53.1	6%	0.063	26%	0.263	C	S	.	.	H	α-helix	trans	-63.2	-41.4	174.9	-49.9	0	0	0	0	111.4	T717 I722 F723 V724	T717-S720 PolarHBondContact O-N 3.35Å; T717-S720 WeakPolarHBondContact OG1-CB 3.48Å; T717-S720 PolarHBondContact OG1-N 3.44Å; T717-S720 PolarHBondContact OG1-OG 2.79Å; S720-I722 VanDerWaalsContact C-N 3.32Å; S720-I722 PolarHBondContact O-N 3.39Å; S720-F723 PolarHBondContact O-N 3.35Å; S720-V724 WeakPolarHBondContact O-CG2 3.27Å; S720-V724 PolarHBondContact O-N 3.15Å
721	R	88.8	Confident	86.6	Confident	84 Å²	84	45 Å²	45	32%	0.317	23%	0.233	S	C	.	.	H	α-helix	trans	-60.3	-39	173.3	-66.8	170.4	-150.3	-154.5	-1.5	111.9	E713 T716 T717 S718 S719 K725 F771	E713-R721 PolarHBondContact O-NH2 3.4Å; E713-R721 VanDerWaalsContact O-NH2 3.13Å; T716-R721 HydrophobicContact CG2-CG 3.7Å; T716-R721 VanDerWaalsContact O-CZ 3.23Å; T716-R721 PolarHBondContact O-NE 3.27Å; T716-R721 PolarHBondContact O-NH2 3.44Å; T717-R721 VanDerWaalsContact O-CG 3.31Å; T717-R721 WeakPolarHBondContact O-CG 3.47Å; T717-R721 PolarHBondContact O-N 2.98Å; S718-R721 WeakPolarHBondContact O-CB 3.46Å; S718-R721 PolarHBondContact O-N 2.99Å; S719-R721 PolarHBondContact O-N 3.41Å; R721-K725 VanDerWaalsContact O-CB 3.22Å; R721-K725 WeakPolarHBondContact O-CB 3.38Å; R721-K725 PolarHBondContact O-N 2.98Å; R721-K725 VanDerWaalsContact O-N 3.13Å; R721-F771 HydrophobicContact CB-CE2 3.81Å; R721-F771 HydrophobicContact CB-CZ 4.28Å; R721-F771 HydrophobicContact CG-CE2 4.17Å; R721-F771 WeakPolarHBondContact O-CZ 3.32Å
722	I	89.8	Confident	87.1	Confident	71 Å²	71	46.1 Å²	46.1	36%	0.364	24%	0.241	S	C	.	.	H	α-helix	trans	-70.1	-42.7	176.5	-68.3	165.3	0	0	0	111.3	S718 S719 S720 K725 I726	S718-I722 WeakPolarHBondContact O-CG1 3.3Å; S718-I722 PolarHBondContact O-N 2.89Å; S719-I722 PolarHBondContact O-N 2.78Å; S720-I722 VanDerWaalsContact C-N 3.32Å; S720-I722 PolarHBondContact O-N 3.39Å; I722-K725 WeakPolarHBondContact O-CB 3.42Å; I722-K725 PolarHBondContact O-N 3Å; I722-I726 HydrophobicContact CG2-CD1 3.93Å; I722-I726 WeakPolarHBondContact O-CG1 3.26Å; I722-I726 PolarHBondContact O-N 3.15Å
723	F	91.3	Very high	87.6	Confident	4 Å²	4	49.1 Å²	49.1	2%	0.018	27%	0.266	C	S	.	.	H	α-helix	trans	-59.6	-55	177.2	179.3	-96.3	0	0	0	111.9	F670 Y674 I677 L685 V688 A689 S719 S720 K725 I726 L727	F670-F723 HydrophobicContact CE2-CE1 4.26Å; F670-F723 HydrophobicContact CE2-CZ 4.1Å; F670-F723 HydrophobicContact CZ-CE1 4.25Å; Y674-F723 HydrophobicContact CD2-CD1 4.18Å; Y674-F723 HydrophobicContact CD2-CE1 4.15Å; Y674-F723 HydrophobicContact CE2-CD1 4.3Å; I677-F723 HydrophobicContact CD1-CB 3.72Å; I677-F723 HydrophobicContact CD1-CD1 3.53Å; I677-F723 HydrophobicContact CD1-CD2 3.85Å; I677-F723 HydrophobicContact CD1-CE1 4.05Å; I677-F723 HydrophobicContact CD1-CE2 4.33Å; I677-F723 HydrophobicContact CD1-CG 3.41Å; I677-F723 VanDerWaalsContact CD1-CG 3.41Å; I677-F723 HydrophobicContact CD1-CZ 4.43Å; I677-F723 HydrophobicContact CG1-CB 4.48Å; I677-F723 HydrophobicContact CG1-CD2 4.3Å; I677-F723 HydrophobicContact CG1-CG 4.28Å; L685-F723 HydrophobicContact CD2-CD2 4.26Å; V688-F723 HydrophobicContact CB-CE2 4.42Å; V688-F723 HydrophobicContact CG1-CE2 3.95Å; A689-F723 HydrophobicContact CB-CD2 3.72Å; A689-F723 HydrophobicContact CB-CE2 3.68Å; A689-F723 HydrophobicContact CB-CG 4.43Å; A689-F723 HydrophobicContact CB-CZ 4.37Å; S719-F723 WeakPolarHBondContact O-CB 3.35Å; S719-F723 PolarHBondContact O-N 3.13Å; S720-F723 PolarHBondContact O-N 3.35Å; F723-K725 VanDerWaalsContact C-N 3.28Å; F723-K725 PolarHBondContact O-N 3.2Å; F723-I726 PolarHBondContact O-N 2.82Å; F723-I726 VanDerWaalsContact O-N 3.07Å; F723-L727 HydrophobicContact CE1-CD2 4.25Å; F723-L727 WeakPolarHBondContact O-CB 3.44Å; F723-L727 PolarHBondContact O-N 3.22Å
724	V	90.4	Very high	88	Confident	0 Å²	0	47 Å²	47	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-61.9	-36.9	-179.7	179.3	0	0	0	0	111	Y674 I709 M711 S720 I726 F728 F771	Y674-V724 HydrophobicContact CE2-CG2 4.21Å; I709-V724 HydrophobicContact CD1-CG2 4.32Å; I709-V724 HydrophobicContact CG2-CG2 3.69Å; M711-V724 HydrophobicContact SD-CG1 4.3Å; S720-V724 WeakPolarHBondContact O-CG2 3.27Å; S720-V724 PolarHBondContact O-N 3.15Å; V724-I726 PolarHBondContact O-N 3.12Å; V724-F728 HydrophobicContact CG1-CD2 3.64Å; V724-F728 HydrophobicContact CG1-CE2 3.85Å; V724-F728 WeakPolarHBondContact O-CD2 3.3Å; V724-F728 PolarHBondContact O-N 2.93Å; V724-F771 HydrophobicContact CB-CE1 4.16Å; V724-F771 HydrophobicContact CB-CZ 4.08Å; V724-F771 HydrophobicContact CG1-CE1 3.74Å; V724-F771 HydrophobicContact CG1-CZ 4.16Å
725	K	91.3	Very high	88.6	Confident	78 Å²	78	39.4 Å²	39.4	34%	0.339	22%	0.219	S	C	.	.	H	α-helix	trans	-57.5	-48	171.8	168	163.7	-177.6	165.9	0	112.5	R721 I722 F723 Q729 I775	R721-K725 VanDerWaalsContact O-CB 3.22Å; R721-K725 WeakPolarHBondContact O-CB 3.38Å; R721-K725 PolarHBondContact O-N 2.98Å; R721-K725 VanDerWaalsContact O-N 3.13Å; I722-K725 WeakPolarHBondContact O-CB 3.42Å; I722-K725 PolarHBondContact O-N 3Å; F723-K725 VanDerWaalsContact C-N 3.28Å; F723-K725 PolarHBondContact O-N 3.2Å; K725-Q729 WeakPolarHBondContact O-CB 3.42Å; K725-Q729 VanDerWaalsContact O-CG 3.22Å; K725-Q729 WeakPolarHBondContact O-CG 3.4Å; K725-Q729 PolarHBondContact O-N 2.62Å; K725-Q729 VanDerWaalsContact O-N 3.09Å; K725-I775 HydrophobicContact CB-CD1 4.05Å; K725-I775 HydrophobicContact CB-CG1 3.94Å; K725-I775 HydrophobicContact CD-CG1 4.16Å; K725-I775 HydrophobicContact CG-CG1 3.93Å; K725-I775 HydrophobicContact CG-CG2 4.26Å
726	I	91.9	Very high	89.2	Confident	12 Å²	12	36.3 Å²	36.3	6%	0.062	21%	0.205	C	C	.	.	H	α-helix	trans	-70.5	-43.6	-178.7	-64.7	168.1	0	0	0	110.6	R686 A689 R690 I722 F723 V724 F728 Q729 E730	R686-I726 HydrophobicContact CB-CD1 4.01Å; R686-I726 HydrophobicContact CG-CD1 4.23Å; R686-I726 HydrophobicContact CG-CG2 4.35Å; A689-I726 HydrophobicContact CB-CB 3.96Å; A689-I726 HydrophobicContact CB-CG2 3.76Å; R690-I726 HydrophobicContact CG-CG2 4.31Å; I722-I726 HydrophobicContact CG2-CD1 3.93Å; I722-I726 WeakPolarHBondContact O-CG1 3.26Å; I722-I726 PolarHBondContact O-N 3.15Å; F723-I726 PolarHBondContact O-N 2.82Å; F723-I726 VanDerWaalsContact O-N 3.07Å; V724-I726 PolarHBondContact O-N 3.12Å; I726-F728 PolarHBondContact O-N 3.21Å; I726-Q729 PolarHBondContact O-N 3.34Å; I726-E730 WeakPolarHBondContact O-CB 3.43Å; I726-E730 PolarHBondContact O-N 3.19Å
727	L	92.4	Very high	89.2	Confident	0 Å²	0	39 Å²	39	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-53.1	-53.7	177.6	-177	73.5	0	0	0	111.4	A689 F692 A693 L706 I709 F723 E730 L731	A689-L727 HydrophobicContact CB-CB 4.38Å; A689-L727 WeakPolarHBondContact O-CD1 3.15Å; F692-L727 HydrophobicContact CB-CD1 4.15Å; A693-L727 HydrophobicContact CB-CD1 4.1Å; L706-L727 HydrophobicContact CD2-CD2 4.11Å; I709-L727 HydrophobicContact CD1-CD2 4.25Å; F723-L727 HydrophobicContact CE1-CD2 4.25Å; F723-L727 WeakPolarHBondContact O-CB 3.44Å; F723-L727 PolarHBondContact O-N 3.22Å; L727-E730 PolarHBondContact O-N 3.25Å; L727-L731 HydrophobicContact CG-CD1 4.27Å; L727-L731 WeakPolarHBondContact O-CB 3.43Å; L727-L731 WeakPolarHBondContact O-CG 3.15Å; L727-L731 PolarHBondContact O-N 3.44Å
728	F	90.4	Very high	89.1	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-74.5	-29.2	-178.8	-81.9	-79.8	0	0	0	113.9	V724 I726 L731 C732 L740 L744 L756 F772 L777	V724-F728 HydrophobicContact CG1-CD2 3.64Å; V724-F728 HydrophobicContact CG1-CE2 3.85Å; V724-F728 WeakPolarHBondContact O-CD2 3.3Å; V724-F728 PolarHBondContact O-N 2.93Å; I726-F728 PolarHBondContact O-N 3.21Å; F728-L731 HydrophobicContact CD1-CD1 4.44Å; F728-C732 WeakPolarHBondContact O-CB 3.25Å; F728-C732 PolarHBondContact O-N 3.32Å; F728-L740 HydrophobicContact CD1-CD2 4.41Å; F728-L744 HydrophobicContact CE1-CD1 4.16Å; F728-L744 HydrophobicContact CE1-CD2 4.47Å; F728-L756 HydrophobicContact CE2-CD1 4.36Å; F728-L756 HydrophobicContact CE2-CD2 3.91Å; F728-L756 HydrophobicContact CZ-CD1 3.92Å; F728-L756 HydrophobicContact CZ-CD2 4.21Å; F728-F772 HydrophobicContact CD2-CE1 4.03Å; F728-F772 HydrophobicContact CE2-CE1 4.34Å; F728-F772 HydrophobicContact CE2-CZ 4.43Å; F728-F772 HydrophobicContact CG-CE1 4.13Å; F728-L777 HydrophobicContact CB-CD1 3.67Å; F728-L777 WeakPolarHBondContact O-CD1 3.37Å
729	Q	91.3	Very high	89.1	Confident	81 Å²	81	42.8 Å²	42.8	38%	0.379	23%	0.229	S	C	.	.	H	α-helix	trans	-65.7	-42.5	171.8	-77.7	-179	-23.5	0	0	111.6	K725 I726 C732 A733 I775	K725-Q729 WeakPolarHBondContact O-CB 3.42Å; K725-Q729 VanDerWaalsContact O-CG 3.22Å; K725-Q729 WeakPolarHBondContact O-CG 3.4Å; K725-Q729 PolarHBondContact O-N 2.62Å; K725-Q729 VanDerWaalsContact O-N 3.09Å; I726-Q729 PolarHBondContact O-N 3.34Å; Q729-C732 PolarHBondContact O-N 3.28Å; Q729-A733 PolarHBondContact O-N 3.5Å; Q729-I775 HydrophobicContact CG-CG2 3.54Å; Q729-I775 PolarHBondContact NE2-O 2.88Å
730	E	92.5	Very high	89	Confident	29 Å²	29	41.6 Å²	41.6	14%	0.136	22%	0.221	C	C	.	.	H	α-helix	trans	-72.4	-41.1	178.9	-160.4	87.9	-177.3	0	0	111.6	R690 A693 I726 L727 C732 A733 Y734	R690-E730 HydrophobicContact CG-CB 4.42Å; R690-E730 HydrophobicContact CG-CG 3.96Å; R690-E730 IonicContact CZ-OE1 2.7Å; R690-E730 IonicContact CZ-OE2 3.3Å; R690-E730 VanDerWaalsContact NE-CD 3.33Å; R690-E730 IonicContact NE-OE1 3.33Å; R690-E730 PolarHBondContact NE-OE1 3.13Å; R690-E730 IonicContact NE-OE2 3.14Å; R690-E730 PolarHBondContact NE-OE2 3.33Å; R690-E730 IonicContact NH2-OE1 3.46Å; R690-E730 IonicContact NH2-OE2 3.66Å; R690-E730 PolarHBondContact NH2-OE2 3.04Å; A693-E730 HydrophobicContact CB-CB 3.84Å; A693-E730 HydrophobicContact CB-CG 4.08Å; I726-E730 WeakPolarHBondContact O-CB 3.43Å; I726-E730 PolarHBondContact O-N 3.19Å; L727-E730 PolarHBondContact O-N 3.25Å; E730-C732 VanDerWaalsContact C-N 3.32Å; E730-C732 PolarHBondContact O-N 2.97Å; E730-A733 WeakPolarHBondContact O-CA 3.38Å; E730-A733 WeakPolarHBondContact O-CB 3.4Å; E730-A733 PolarHBondContact O-N 2.95Å; E730-Y734 HydrophobicContact CG-CD2 4.11Å; E730-Y734 HydrophobicContact CG-CE2 3.55Å; E730-Y734 VanDerWaalsContact O-CD2 3.26Å; E730-Y734 WeakPolarHBondContact O-CD2 3.38Å; E730-Y734 PolarHBondContact O-N 2.98Å
731	L	90.5	Very high	88.8	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-57.8	-42.7	170.8	-80.3	170.5	0	0	0	112.1	A693 L696 W703 L727 F728 A733 Y734 M735	A693-L731 HydrophobicContact CB-CD2 4.36Å; A693-L731 HydrophobicContact CB-CG 3.98Å; A693-L731 VanDerWaalsContact O-CD2 3.26Å; A693-L731 WeakPolarHBondContact O-CD2 3.18Å; L696-L731 HydrophobicContact CB-CD2 4.05Å; L696-L731 HydrophobicContact CD1-CD1 4.43Å; W703-L731 HydrophobicContact CH2-CD1 4.43Å; W703-L731 HydrophobicContact CH2-CD2 4.32Å; L727-L731 HydrophobicContact CG-CD1 4.27Å; L727-L731 WeakPolarHBondContact O-CB 3.43Å; L727-L731 WeakPolarHBondContact O-CG 3.15Å; L727-L731 PolarHBondContact O-N 3.44Å; F728-L731 HydrophobicContact CD1-CD1 4.44Å; L731-A733 VanDerWaalsContact C-N 3.26Å; L731-A733 PolarHBondContact O-N 3.27Å; L731-Y734 PolarHBondContact O-N 2.81Å; L731-M735 WeakPolarHBondContact O-CB 3.5Å; L731-M735 PolarHBondContact O-N 2.96Å
732	C	89.3	Confident	88.7	Confident	26 Å²	26	44.9 Å²	44.9	18%	0.176	24%	0.24	C	C	.	.	H	α-helix	trans	-66.3	-28.2	175.5	-172	0	0	0	0	112.5	F728 Q729 E730 G736 L740 L777	F728-C732 WeakPolarHBondContact O-CB 3.25Å; F728-C732 PolarHBondContact O-N 3.32Å; Q729-C732 PolarHBondContact O-N 3.28Å; E730-C732 VanDerWaalsContact C-N 3.32Å; E730-C732 PolarHBondContact O-N 2.97Å; C732-G736 WeakPolarHBondContact O-CA 3.36Å; C732-G736 PolarHBondContact O-N 3.06Å; C732-L740 HydrophobicContact CB-CD2 4.09Å; C732-L777 HydrophobicContact CB-CD1 4.45Å; C732-L777 HydrophobicContact CB-CD2 3.68Å; C732-L777 WeakPolarHBondContact SG-CD2 3.36Å
733	A	89.4	Confident	88.3	Confident	78 Å²	78	45.1 Å²	45.1	65%	0.645	24%	0.236	S	C	*	.	H	α-helix	trans	-72.1	-39.5	174.2	0	0	0	0	0	112.4	Q729 E730 L731	Q729-A733 PolarHBondContact O-N 3.5Å; E730-A733 WeakPolarHBondContact O-CA 3.38Å; E730-A733 WeakPolarHBondContact O-CB 3.4Å; E730-A733 PolarHBondContact O-N 2.95Å; L731-A733 VanDerWaalsContact C-N 3.26Å; L731-A733 PolarHBondContact O-N 3.27Å
734	Y	87.3	Confident	87.9	Confident	67 Å²	67	45.4 Å²	45.4	26%	0.263	24%	0.238	S	C	.	.	H	α-helix	trans	-76.7	-42.8	177.7	-69.9	-62.5	0	0	0	113.9	Y697 E730 L731	Y697-Y734 HydrophobicContact CD1-CD1 4.1Å; Y697-Y734 HydrophobicContact CD1-CD2 4.45Å; Y697-Y734 AromaticContact CD1-CG 3.9Å; Y697-Y734 HydrophobicContact CD1-CG 3.9Å; Y697-Y734 HydrophobicContact CD2-CG 4.45Å; Y697-Y734 HydrophobicContact CE1-CD1 4.11Å; Y697-Y734 HydrophobicContact CE1-CG 4.27Å; Y697-Y734 HydrophobicContact CG-CD2 4.43Å; Y697-Y734 AromaticContact CG-CG 4Å; Y697-Y734 HydrophobicContact CG-CG 4Å; E730-Y734 HydrophobicContact CG-CD2 4.11Å; E730-Y734 HydrophobicContact CG-CE2 3.55Å; E730-Y734 VanDerWaalsContact O-CD2 3.26Å; E730-Y734 WeakPolarHBondContact O-CD2 3.38Å; E730-Y734 PolarHBondContact O-N 2.98Å; L731-Y734 PolarHBondContact O-N 2.81Å
735	M	84.9	Confident	87.4	Confident	25 Å²	25	49 Å²	49	12%	0.123	25%	0.254	C	S	.	.	H	α-helix	trans	-91.3	-30.7	-175	-62.4	-176.6	109.7	0	0	113.5	Y697 W703 L731 K739 L740 R743	Y697-M735 HydrophobicContact CD2-CG 3.67Å; Y697-M735 HydrophobicContact CE2-CG 4.24Å; W703-M735 HydrophobicContact CH2-CE 4.32Å; W703-M735 HydrophobicContact CH2-SD 3.9Å; W703-M735 HydrophobicContact CZ2-CE 3.94Å; W703-M735 HydrophobicContact CZ2-SD 4.03Å; L731-M735 WeakPolarHBondContact O-CB 3.5Å; L731-M735 PolarHBondContact O-N 2.96Å; M735-K739 HydrophobicContact CB-CB 4.31Å; M735-K739 WeakPolarHBondContact O-CD 3.46Å; M735-L740 HydrophobicContact CB-CB 4.42Å; M735-L740 HydrophobicContact SD-CB 4.47Å; M735-L740 HydrophobicContact SD-CD1 4.02Å; M735-R743 HydrophobicContact CE-CG 4.13Å
736	G	88.6	Confident	86.9	Confident	27 Å²	27	48.4 Å²	48.4	28%	0.278	25%	0.254	S	S	.	.			trans	75.3	142.5	-160.6	0	0	0	0	0	112.3	C732 K739 L740	C732-G736 WeakPolarHBondContact O-CA 3.36Å; C732-G736 PolarHBondContact O-N 3.06Å; G736-K739 PolarHBondContact O-N 2.68Å; G736-L740 PolarHBondContact O-N 3.32Å
737	L	83.9	Confident	86	Confident	60 Å²	60	52.8 Å²	52.8	31%	0.314	28%	0.283	S	S	.	.	H	α-helix	trans	-46.3	-43.7	-179.6	-172	65.4	0	0	0	115.3	N741 L777 L780	L737-N741 VanDerWaalsContact O-CB 3.25Å; L737-N741 WeakPolarHBondContact O-CB 3.08Å; L737-N741 PolarHBondContact O-N 3.14Å; L737-L777 HydrophobicContact CD1-CD2 4.14Å; L737-L780 HydrophobicContact CD1-CD2 3.78Å; L737-L780 HydrophobicContact CD1-CG 3.93Å
738	P	84.4	Confident	85.3	Confident	92 Å²	92	58.4 Å²	58.4	60%	0.597	32%	0.318	S	S	*	.	H	α-helix	trans	-68.9	-35.8	-177.4	25.8	-34.6	0	0	0	113.9	Q742	P738-Q742 WeakPolarHBondContact O-CG 3.29Å; P738-Q742 PolarHBondContact O-N 2.94Å; P738-Q742 VanDerWaalsContact O-N 3.09Å
739	K	85.8	Confident	84.6	Confident	130 Å²	130	60.2 Å²	60.2	57%	0.565	33%	0.327	S	S	*	.	H	α-helix	trans	-73.8	-38.2	177.9	-64.9	-171.1	-173.4	173.6	0	111.6	M735 G736 N741 Q742 R743	M735-K739 HydrophobicContact CB-CB 4.31Å; M735-K739 WeakPolarHBondContact O-CD 3.46Å; G736-K739 PolarHBondContact O-N 2.68Å; K739-N741 VanDerWaalsContact C-N 3.34Å; K739-Q742 WeakPolarHBondContact O-CB 3.24Å; K739-Q742 PolarHBondContact O-N 2.84Å; K739-R743 PolarHBondContact O-N 3.43Å
740	L	86.3	Confident	83.8	Confident	0 Å²	0	59.5 Å²	59.5	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-61.7	-43.3	173.3	-178.4	60.6	0	0	0	111	W703 F728 C732 M735 G736 Q742 R743 L744 L780	W703-L740 HydrophobicContact CH2-CD1 3.87Å; W703-L740 HydrophobicContact CZ3-CD1 4.13Å; F728-L740 HydrophobicContact CD1-CD2 4.41Å; C732-L740 HydrophobicContact CB-CD2 4.09Å; M735-L740 HydrophobicContact CB-CB 4.42Å; M735-L740 HydrophobicContact SD-CB 4.47Å; M735-L740 HydrophobicContact SD-CD1 4.02Å; G736-L740 PolarHBondContact O-N 3.32Å; L740-Q742 VanDerWaalsContact C-N 3.29Å; L740-Q742 PolarHBondContact O-N 2.81Å; L740-R743 PolarHBondContact O-N 3.03Å; L740-L744 HydrophobicContact CD1-CD1 3.88Å; L740-L744 HydrophobicContact CD1-CG 4.15Å; L740-L744 HydrophobicContact CG-CD1 3.84Å; L740-L744 HydrophobicContact CG-CG 4.49Å; L740-L744 WeakPolarHBondContact O-CB 3.45Å; L740-L744 VanDerWaalsContact O-CG 3.28Å; L740-L744 WeakPolarHBondContact O-CG 3.33Å; L740-L744 PolarHBondContact O-N 3.4Å; L740-L780 HydrophobicContact CD2-CD1 4.14Å; L740-L780 HydrophobicContact CG-CD2 4.4Å
741	N	84.5	Confident	83.1	Confident	32 Å²	32	61.9 Å²	61.9	17%	0.171	34%	0.341	C	S	.	.	H	α-helix	trans	-66.2	-28.2	176.1	-158.2	-12.9	0	0	0	112.9	L737 K739 K745 G779 L780	L737-N741 VanDerWaalsContact O-CB 3.25Å; L737-N741 WeakPolarHBondContact O-CB 3.08Å; L737-N741 PolarHBondContact O-N 3.14Å; K739-N741 VanDerWaalsContact C-N 3.34Å; N741-K745 WeakPolarHBondContact O-CB 3.4Å; N741-K745 WeakPolarHBondContact O-CD 3.18Å; N741-K745 WeakPolarHBondContact O-CG 3.49Å; N741-K745 VanDerWaalsContact OD1-CE 3.31Å; N741-K745 WeakPolarHBondContact OD1-CE 3.39Å; N741-K745 PolarHBondContact OD1-NZ 3.28Å; N741-G779 PolarHBondContact ND2-O 3.38Å; N741-L780 HydrophobicContact CB-CD2 3.79Å
742	Q	85.6	Confident	82.3	Confident	130 Å²	130	64.8 Å²	64.8	61%	0.607	35%	0.353	S	S	*	.	H	α-helix	trans	-69.4	-56.2	170.5	-74.8	168	-20.5	0	0	111	P738 K739 L740 L744 K745 D746	P738-Q742 WeakPolarHBondContact O-CG 3.29Å; P738-Q742 PolarHBondContact O-N 2.94Å; P738-Q742 VanDerWaalsContact O-N 3.09Å; K739-Q742 WeakPolarHBondContact O-CB 3.24Å; K739-Q742 PolarHBondContact O-N 2.84Å; L740-Q742 VanDerWaalsContact C-N 3.29Å; L740-Q742 PolarHBondContact O-N 2.81Å; Q742-L744 VanDerWaalsContact C-N 3.31Å; Q742-L744 PolarHBondContact O-N 2.96Å; Q742-K745 WeakPolarHBondContact O-CA 3.42Å; Q742-K745 PolarHBondContact O-N 3.28Å; Q742-D746 PolarHBondContact O-N 3.49Å
743	R	82	Confident	81.8	Confident	76 Å²	76	63.7 Å²	63.7	29%	0.287	35%	0.346	S	S	.	.	H	α-helix	trans	-59	-38.2	-179.6	-75.4	-64.8	-163.4	86.5	3.8	113.6	D699 M735 K739 L740 K745 D746	D699-R743 IonicContact OD1-CZ 2.77Å; D699-R743 IonicContact OD1-NH1 3.8Å; D699-R743 PolarHBondContact OD1-NH1 3.41Å; D699-R743 IonicContact OD1-NH2 3.22Å; D699-R743 IonicContact OD2-CZ 3.89Å; D699-R743 IonicContact OD2-NH1 3.3Å; D699-R743 PolarHBondContact OD2-NH1 3.41Å; D699-R743 IonicContact OD2-NH2 3.97Å; D699-R743 PolarHBondContact OD2-NH2 3.41Å; M735-R743 HydrophobicContact CE-CG 4.13Å; K739-R743 PolarHBondContact O-N 3.43Å; L740-R743 PolarHBondContact O-N 3.03Å; R743-K745 PolarHBondContact O-N 2.99Å; R743-D746 WeakPolarHBondContact CA-OD2 3.29Å; R743-D746 VanDerWaalsContact CD-OD2 3.32Å; R743-D746 WeakPolarHBondContact CD-OD2 3.15Å; R743-D746 PolarHBondContact O-N 2.82Å
744	L	82.3	Confident	81.1	Confident	10 Å²	10	65.9 Å²	65.9	5%	0.052	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-11	176.4	-69.1	171.8	0	0	0	114	W703 F728 L740 Q742 F753 F757 L780	W703-L744 HydrophobicContact CE3-CD2 4.44Å; W703-L744 HydrophobicContact CZ3-CD2 4.1Å; F728-L744 HydrophobicContact CE1-CD1 4.16Å; F728-L744 HydrophobicContact CE1-CD2 4.47Å; L740-L744 HydrophobicContact CD1-CD1 3.88Å; L740-L744 HydrophobicContact CD1-CG 4.15Å; L740-L744 HydrophobicContact CG-CD1 3.84Å; L740-L744 HydrophobicContact CG-CG 4.49Å; L740-L744 WeakPolarHBondContact O-CB 3.45Å; L740-L744 VanDerWaalsContact O-CG 3.28Å; L740-L744 WeakPolarHBondContact O-CG 3.33Å; L740-L744 PolarHBondContact O-N 3.4Å; Q742-L744 VanDerWaalsContact C-N 3.31Å; Q742-L744 PolarHBondContact O-N 2.96Å; L744-F753 HydrophobicContact CD2-CD2 4.05Å; L744-F753 HydrophobicContact CD2-CE1 4.35Å; L744-F753 HydrophobicContact CD2-CE2 3.81Å; L744-F753 HydrophobicContact CD2-CG 4.43Å; L744-F753 HydrophobicContact CD2-CZ 3.97Å; L744-F757 HydrophobicContact CB-CE2 4.39Å; L744-F757 HydrophobicContact CD1-CE2 4.39Å; L744-F757 HydrophobicContact CD1-CZ 4.24Å; L744-F757 HydrophobicContact CD2-CE2 4.4Å; L744-L780 HydrophobicContact CD1-CD1 3.9Å; L744-L780 HydrophobicContact CD1-CD2 4.04Å; L744-L780 HydrophobicContact CD1-CG 4.49Å
745	K	80.6	Confident	80.6	Confident	77 Å²	77	63.6 Å²	63.6	34%	0.335	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.6	-6.2	176.7	-78.8	175.6	172.6	151.7	0	113.9	N741 Q742 R743 P747 Q750	N741-K745 WeakPolarHBondContact O-CB 3.4Å; N741-K745 WeakPolarHBondContact O-CD 3.18Å; N741-K745 WeakPolarHBondContact O-CG 3.49Å; N741-K745 VanDerWaalsContact OD1-CE 3.31Å; N741-K745 WeakPolarHBondContact OD1-CE 3.39Å; N741-K745 PolarHBondContact OD1-NZ 3.28Å; Q742-K745 WeakPolarHBondContact O-CA 3.42Å; Q742-K745 PolarHBondContact O-N 3.28Å; R743-K745 PolarHBondContact O-N 2.99Å; K745-P747 VanDerWaalsContact O-CD 3.3Å; K745-P747 WeakPolarHBondContact O-CD 3.22Å; K745-P747 VanDerWaalsContact O-N 3.17Å; K745-Q750 PolarHBondContact O-NE2 3.27Å
746	D	82.1	Confident	80.3	Confident	64 Å²	64	62.4 Å²	62.4	34%	0.342	33%	0.333	S	S	.	.			trans	-59.3	116.8	179.2	-74.2	-31.7	0	0	0	110.2	Q742 R743 T748 L749	Q742-D746 PolarHBondContact O-N 3.49Å; R743-D746 WeakPolarHBondContact CA-OD2 3.29Å; R743-D746 VanDerWaalsContact CD-OD2 3.32Å; R743-D746 WeakPolarHBondContact CD-OD2 3.15Å; R743-D746 PolarHBondContact O-N 2.82Å; D746-T748 PolarHBondContact O-N 3.45Å; D746-L749 HydrophobicContact CB-CD1 4.41Å; D746-L749 PolarHBondContact O-N 2.8Å
747	P	73	Confident	80	Confident	104 Å²	104	62.2 Å²	62.2	68%	0.675	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-22.5	-168.1	-29.7	36.9	0	0	0	115.9	K745 L749	K745-P747 VanDerWaalsContact O-CD 3.3Å; K745-P747 WeakPolarHBondContact O-CD 3.22Å; K745-P747 VanDerWaalsContact O-N 3.17Å; P747-L749 VanDerWaalsContact C-N 3.3Å
748	T	77.4	Confident	79.8	Confident	118 Å²	118	59.7 Å²	59.7	72%	0.724	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.1	-11.8	176.9	52	0	0	0	0	114.1	D746	D746-T748 PolarHBondContact O-N 3.45Å
749	L	75	Confident	79.4	Confident	38 Å²	38	60 Å²	60	20%	0.199	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.9	-12.2	-179.2	-60.7	178.7	0	0	0	113.2	W703 D746 P747 T751 F752 F753	W703-L749 HydrophobicContact CB-CD1 4.46Å; D746-L749 HydrophobicContact CB-CD1 4.41Å; D746-L749 PolarHBondContact O-N 2.8Å; P747-L749 VanDerWaalsContact C-N 3.3Å; L749-T751 PolarHBondContact O-N 2.9Å; L749-F752 HydrophobicContact CD2-CD2 4.34Å; L749-F752 PolarHBondContact O-N 3.21Å; L749-F752 VanDerWaalsContact O-N 3.12Å; L749-F753 HydrophobicContact CB-CD2 4.35Å; L749-F753 HydrophobicContact CB-CE2 3.54Å; L749-F753 HydrophobicContact CB-CZ 3.77Å; L749-F753 HydrophobicContact CD1-CZ 4.33Å; L749-F753 WeakPolarHBondContact O-CD2 3.43Å
750	Q	73.7	Confident	78.8	Confident	67 Å²	67	60.6 Å²	60.6	31%	0.313	31%	0.311	S	S	.	.	G	3₁₀ helix	trans	-59.5	-32.1	-173.1	-68	-176.7	12.6	0	0	113.6	K745 F752 F753 E754	K745-Q750 PolarHBondContact O-NE2 3.27Å; Q750-F752 PolarHBondContact O-N 2.98Å; Q750-F753 CarbonylContact O-C 3.59Å; Q750-F753 WeakPolarHBondContact O-CA 3.5Å; Q750-F753 PolarHBondContact O-N 3.02Å; Q750-E754 PolarHBondContact O-N 2.65Å
751	T	77.8	Confident	78.4	Confident	79 Å²	79	64 Å²	64	49%	0.485	33%	0.329	S	S	.	.	G	3₁₀ helix	trans	-59.8	-43	176.5	49.4	0	0	0	0	112.2	L749 F753 E754	L749-T751 PolarHBondContact O-N 2.9Å; T751-F753 PolarHBondContact O-N 2.91Å; T751-E754 WeakPolarHBondContact O-CG 3.38Å; T751-E754 PolarHBondContact O-N 2.81Å
752	F	74.6	Confident	78.2	Confident	60 Å²	60	65.4 Å²	65.4	26%	0.263	34%	0.34	S	S	.	.	G	3₁₀ helix	trans	-70.9	-10.3	176.6	-51.6	-67.5	0	0	0	112.9	E707 L749 Q750	E707-F752 WeakPolarHBondContact CA-O 3.38Å; E707-F752 HydrophobicContact CB-CB 4.42Å; E707-F752 HydrophobicContact CB-CD1 4.33Å; E707-F752 PolarHBondContact N-O 3.26Å; E707-F752 WeakPolarHBondContact OE2-CD1 3.2Å; L749-F752 HydrophobicContact CD2-CD2 4.34Å; L749-F752 PolarHBondContact O-N 3.21Å; L749-F752 VanDerWaalsContact O-N 3.12Å; Q750-F752 PolarHBondContact O-N 2.98Å
753	F	78.2	Confident	78	Confident	4 Å²	4	67.5 Å²	67.5	2%	0.018	34%	0.342	C	S	.	.	G	3₁₀ helix	trans	-106	3.7	178.8	-51.6	-30.8	0	0	0	113.3	W703 L706 L744 L749 Q750 T751 G755 L756 F757	W703-F753 HydrophobicContact CB-CE1 4.32Å; W703-F753 HydrophobicContact CB-CZ 4.16Å; W703-F753 HydrophobicContact CE3-CE1 4.37Å; W703-F753 HydrophobicContact CE3-CZ 4.02Å; L706-F753 HydrophobicContact CB-CD1 4.33Å; L706-F753 HydrophobicContact CB-CE1 4.26Å; L706-F753 HydrophobicContact CD1-CD1 4.45Å; L706-F753 HydrophobicContact CD1-CE1 3.87Å; L744-F753 HydrophobicContact CD2-CD2 4.05Å; L744-F753 HydrophobicContact CD2-CE1 4.35Å; L744-F753 HydrophobicContact CD2-CE2 3.81Å; L744-F753 HydrophobicContact CD2-CG 4.43Å; L744-F753 HydrophobicContact CD2-CZ 3.97Å; L749-F753 HydrophobicContact CB-CD2 4.35Å; L749-F753 HydrophobicContact CB-CE2 3.54Å; L749-F753 HydrophobicContact CB-CZ 3.77Å; L749-F753 HydrophobicContact CD1-CZ 4.33Å; L749-F753 WeakPolarHBondContact O-CD2 3.43Å; Q750-F753 CarbonylContact O-C 3.59Å; Q750-F753 WeakPolarHBondContact O-CA 3.5Å; Q750-F753 PolarHBondContact O-N 3.02Å; T751-F753 PolarHBondContact O-N 2.91Å; F753-G755 VanDerWaalsContact C-N 3.27Å; F753-G755 PolarHBondContact O-N 3.26Å; F753-L756 HydrophobicContact CD1-CD1 4.17Å; F753-L756 PolarHBondContact O-N 3.39Å; F753-F757 HydrophobicContact CB-CD2 4.1Å; F753-F757 PolarHBondContact O-N 3.32Å
754	E	76.1	Confident	78	Confident	123 Å²	123	65.8 Å²	65.8	58%	0.575	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-38.7	176.3	-71.1	175.5	-164.8	0	0	111.8	Q750 T751 L756 F757 P758	Q750-E754 PolarHBondContact O-N 2.65Å; T751-E754 WeakPolarHBondContact O-CG 3.38Å; T751-E754 PolarHBondContact O-N 2.81Å; E754-L756 PolarHBondContact O-N 3.25Å; E754-F757 CarbonylContact O-C 3.46Å; E754-P758 WeakPolarHBondContact O-CA 3.3Å
755	G	75.8	Confident	78.1	Confident	19 Å²	19	65.4 Å²	65.4	20%	0.196	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-34.3	173.3	0	0	0	0	0	114.2	I709 M711 F753	I709-G755 CarbonylContact O-C 3.57Å; M711-G755 PolarHBondContact N-O 3.25Å; F753-G755 VanDerWaalsContact C-N 3.27Å; F753-G755 PolarHBondContact O-N 3.26Å
756	L	79.8	Confident	78.3	Confident	0 Å²	0	68.7 Å²	68.7	0%	0	35%	0.347	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-34.3	179.2	-80.8	168.5	0	0	0	112.9	L706 I709 M711 F728 F753 E754 P758 F772	L706-L756 HydrophobicContact CB-CD1 3.9Å; L706-L756 HydrophobicContact CD1-CD1 4.27Å; I709-L756 HydrophobicContact CB-CD2 3.97Å; I709-L756 HydrophobicContact CB-CG 4.22Å; I709-L756 HydrophobicContact CG2-CD2 3.57Å; I709-L756 HydrophobicContact CG2-CG 4.33Å; I709-L756 PolarHBondContact O-N 2.94Å; M711-L756 HydrophobicContact CG-CD2 4.13Å; F728-L756 HydrophobicContact CE2-CD1 4.36Å; F728-L756 HydrophobicContact CE2-CD2 3.91Å; F728-L756 HydrophobicContact CZ-CD1 3.92Å; F728-L756 HydrophobicContact CZ-CD2 4.21Å; F753-L756 HydrophobicContact CD1-CD1 4.17Å; F753-L756 PolarHBondContact O-N 3.39Å; E754-L756 PolarHBondContact O-N 3.25Å; L756-P758 WeakPolarHBondContact O-CD 3.36Å; L756-F772 HydrophobicContact CD2-CZ 4.44Å
757	F	80.5	Confident	78.4	Confident	23 Å²	23	66.7 Å²	66.7	10%	0.101	34%	0.336	C	S	.	.	S	Bend	trans	-124.4	62.2	-176.3	-61.9	-51.6	0	0	0	111.8	L744 F753 E754 R759 F772 L780 L784	L744-F757 HydrophobicContact CB-CE2 4.39Å; L744-F757 HydrophobicContact CD1-CE2 4.39Å; L744-F757 HydrophobicContact CD1-CZ 4.24Å; L744-F757 HydrophobicContact CD2-CE2 4.4Å; F753-F757 HydrophobicContact CB-CD2 4.1Å; F753-F757 PolarHBondContact O-N 3.32Å; E754-F757 CarbonylContact O-C 3.46Å; F757-R759 PolarHBondContact O-N 3.49Å; F757-F772 HydrophobicContact CD1-CE2 4.06Å; F757-F772 HydrophobicContact CE1-CD2 4.02Å; F757-F772 AromaticContact CE1-CE2 3.58Å; F757-F772 HydrophobicContact CE1-CE2 3.58Å; F757-F772 HydrophobicContact CE1-CZ 4.11Å; F757-F772 HydrophobicContact CZ-CE2 4.48Å; F757-L780 HydrophobicContact CZ-CB 4.42Å; F757-L784 HydrophobicContact CB-CD1 4.01Å; F757-L784 HydrophobicContact CB-CD2 4.2Å; F757-L784 HydrophobicContact CB-CG 4.35Å; F757-L784 HydrophobicContact CD1-CD1 3.81Å; F757-L784 HydrophobicContact CG-CD1 4.34Å
758	P	80.7	Confident	79	Confident	8 Å²	8	61.7 Å²	61.7	5%	0.052	30%	0.303	C	S	.	.			trans	-62.2	125.8	-172.1	24.4	-35.1	0	0	0	112.4	E754 L756 N764 T765 A768	E754-P758 WeakPolarHBondContact O-CA 3.3Å; L756-P758 WeakPolarHBondContact O-CD 3.36Å; P758-N764 HydrophobicContact CB-CB 3.97Å; P758-N764 HydrophobicContact CG-CB 3.76Å; P758-T765 PolarHBondContact O-OG1 2.81Å; P758-A768 HydrophobicContact CG-CB 4.34Å
759	R	75.5	Confident	79.5	Confident	98 Å²	98	56.9 Å²	56.9	37%	0.37	27%	0.273	S	S	.	.			trans	-100.2	-17.4	-178.1	-59.7	-171.6	-170.2	-133.6	-3.2	113.1	F757 E783 L784 H787	F757-R759 PolarHBondContact O-N 3.49Å; R759-E783 IonicContact CZ-OE1 3.22Å; R759-E783 IonicContact NH1-OE1 2.83Å; R759-E783 PolarHBondContact NH1-OE1 3.06Å; R759-E783 IonicContact NH2-OE1 3.59Å; R759-E783 PolarHBondContact NH2-OE1 3.21Å; R759-E783 IonicContact NH2-OE2 2.69Å; R759-L784 HydrophobicContact CG-CD2 4.21Å; R759-H787 PolarHBondContact O-CE1 3.34Å; R759-H787 VanDerWaalsContact O-CE1 3.31Å
760	D	74.1	Confident	80.2	Confident	143 Å²	143	60.1 Å²	60.1	77%	0.765	29%	0.29	S	S	*	.	S	Bend	trans	-78.2	-43.3	-163.5	-31.1	-82.1	0	0	0	113.1
761	N	77.8	Confident	80.8	Confident	70 Å²	70	57.8 Å²	57.8	37%	0.374	28%	0.279	S	S	.	.			trans	-117.7	119.9	-176.6	-172.5	-31.1	0	0	0	110.2	R763 N764 T765	N761-R763 PolarHBondContact O-N 2.9Å; N761-R763 WeakPolarHBondContact OD1-CB 3.31Å; N761-R763 PolarHBondContact OD1-N 3.42Å; N761-N764 HydrophobicContact CB-CB 4.45Å; N761-N764 PolarHBondContact O-N 3.41Å; N761-T765 PolarHBondContact O-N 2.73Å; N761-T765 PolarHBondContact O-OG1 2.72Å
762	P	80.3	Confident	81.3	Confident	63 Å²	63	54 Å²	54	41%	0.409	26%	0.256	S	S	.	.	H	α-helix	trans	-63.2	-14.4	-178.3	25.8	-35	0	0	0	114	R766	P762-R766 WeakPolarHBondContact O-CB 3.04Å; P762-R766 VanDerWaalsContact O-CD 3.27Å; P762-R766 WeakPolarHBondContact O-CD 3.48Å; P762-R766 WeakPolarHBondContact O-CG 3.36Å; P762-R766 PolarHBondContact O-N 2.88Å
763	R	81.4	Confident	82	Confident	173 Å²	173	53.9 Å²	53.9	65%	0.653	26%	0.26	S	S	*	.	H	α-helix	trans	-69.3	-53.4	166.8	-66.4	-172.5	176.9	-169.7	-0.9	111.1	N761 T765 R766 F767	N761-R763 PolarHBondContact O-N 2.9Å; N761-R763 WeakPolarHBondContact OD1-CB 3.31Å; N761-R763 PolarHBondContact OD1-N 3.42Å; R763-T765 VanDerWaalsContact C-N 3.32Å; R763-T765 PolarHBondContact O-N 3.37Å; R763-R766 WeakPolarHBondContact O-CB 3.5Å; R763-R766 PolarHBondContact O-N 3.23Å; R763-R766 VanDerWaalsContact O-N 3.11Å; R763-F767 PolarHBondContact O-N 2.98Å
764	N	82.4	Confident	82.4	Confident	40 Å²	40	57.3 Å²	57.3	21%	0.214	29%	0.285	C	S	.	.	H	α-helix	trans	-62.2	-39	178.8	-66.6	-9.4	0	0	0	111.5	P758 N761 R766 F767 A768	P758-N764 HydrophobicContact CB-CB 3.97Å; P758-N764 HydrophobicContact CG-CB 3.76Å; N761-N764 HydrophobicContact CB-CB 4.45Å; N761-N764 PolarHBondContact O-N 3.41Å; N764-R766 PolarHBondContact O-N 3.17Å; N764-F767 WeakPolarHBondContact O-CB 3.36Å; N764-F767 PolarHBondContact O-N 3.21Å; N764-A768 WeakPolarHBondContact O-CB 3.37Å; N764-A768 PolarHBondContact O-N 3.46Å
765	T	83.1	Confident	82.9	Confident	3 Å²	3	51.9 Å²	51.9	2%	0.018	26%	0.26	C	S	.	.	H	α-helix	trans	-61.1	-42.1	173.5	-46.5	0	0	0	0	112.1	P758 N761 R763 I769 L784	P758-T765 PolarHBondContact O-OG1 2.81Å; N761-T765 PolarHBondContact O-N 2.73Å; N761-T765 PolarHBondContact O-OG1 2.72Å; R763-T765 VanDerWaalsContact C-N 3.32Å; R763-T765 PolarHBondContact O-N 3.37Å; T765-I769 HydrophobicContact CG2-CD1 4.11Å; T765-I769 WeakPolarHBondContact O-CD1 3.18Å; T765-I769 VanDerWaalsContact O-CG1 3.22Å; T765-I769 WeakPolarHBondContact O-CG1 3.5Å; T765-I769 PolarHBondContact O-N 3.26Å; T765-L784 HydrophobicContact CG2-CB 4.02Å; T765-L784 HydrophobicContact CG2-CD2 4.2Å; T765-L784 HydrophobicContact CG2-CG 4.48Å
766	R	84.9	Confident	83.3	Confident	146 Å²	146	54 Å²	54	55%	0.551	28%	0.281	S	S	*	.	H	α-helix	trans	-65.1	-42.8	174.3	-74.2	166.6	-170.3	-168	2.7	111.8	P762 R763 N764 I769 N770 L788	P762-R766 WeakPolarHBondContact O-CB 3.04Å; P762-R766 VanDerWaalsContact O-CD 3.27Å; P762-R766 WeakPolarHBondContact O-CD 3.48Å; P762-R766 WeakPolarHBondContact O-CG 3.36Å; P762-R766 PolarHBondContact O-N 2.88Å; R763-R766 WeakPolarHBondContact O-CB 3.5Å; R763-R766 PolarHBondContact O-N 3.23Å; R763-R766 VanDerWaalsContact O-N 3.11Å; N764-R766 PolarHBondContact O-N 3.17Å; R766-I769 PolarHBondContact O-N 3.47Å; R766-N770 WeakPolarHBondContact O-CB 3.33Å; R766-N770 VanDerWaalsContact O-CG 3.24Å; R766-N770 PolarHBondContact O-N 3.23Å; R766-L788 HydrophobicContact CG-CD1 3.65Å
767	F	85.5	Confident	83.5	Confident	21 Å²	21	54.5 Å²	54.5	9%	0.092	28%	0.284	C	S	.	.	H	α-helix	trans	-59.2	-49.1	177.4	-178.3	-101.3	0	0	0	111.1	M711 E713 R763 N764 I769 N770 F771	M711-F767 HydrophobicContact CE-CE1 3.9Å; E713-F767 HydrophobicContact CB-CD2 4.02Å; E713-F767 HydrophobicContact CB-CE2 4.25Å; E713-F767 HydrophobicContact CB-CG 4.33Å; E713-F767 HydrophobicContact CG-CD2 3.91Å; E713-F767 HydrophobicContact CG-CE2 4.02Å; E713-F767 WeakPolarHBondContact OE1-CD2 3.21Å; R763-F767 PolarHBondContact O-N 2.98Å; N764-F767 WeakPolarHBondContact O-CB 3.36Å; N764-F767 PolarHBondContact O-N 3.21Å; F767-I769 PolarHBondContact O-N 3.24Å; F767-N770 PolarHBondContact O-N 3.14Å; F767-F771 VanDerWaalsContact O-CB 3.23Å; F767-F771 WeakPolarHBondContact O-CB 3.41Å; F767-F771 PolarHBondContact O-N 3.07Å
768	A	85.6	Confident	83.4	Confident	0 Å²	0	54 Å²	54	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-60.9	-44.1	175.6	0	0	0	0	0	112.6	P758 N764 F771 F772 L784	P758-A768 HydrophobicContact CG-CB 4.34Å; N764-A768 WeakPolarHBondContact O-CB 3.37Å; N764-A768 PolarHBondContact O-N 3.46Å; A768-F771 PolarHBondContact O-N 3.03Å; A768-F772 VanDerWaalsContact O-CD2 3.29Å; A768-F772 WeakPolarHBondContact O-CD2 3.45Å; A768-F772 PolarHBondContact O-N 3.33Å; A768-L784 HydrophobicContact CB-CD1 4.23Å
769	I	86.5	Confident	83.3	Confident	16 Å²	16	54.7 Å²	54.7	8%	0.082	29%	0.294	C	S	.	.	H	α-helix	trans	-59.2	-49.8	175.4	-68.7	162.7	0	0	0	110.9	T765 R766 F767 F771 T773 L784 R785 L788	T765-I769 HydrophobicContact CG2-CD1 4.11Å; T765-I769 WeakPolarHBondContact O-CD1 3.18Å; T765-I769 VanDerWaalsContact O-CG1 3.22Å; T765-I769 WeakPolarHBondContact O-CG1 3.5Å; T765-I769 PolarHBondContact O-N 3.26Å; R766-I769 PolarHBondContact O-N 3.47Å; F767-I769 PolarHBondContact O-N 3.24Å; I769-F771 VanDerWaalsContact C-N 3.32Å; I769-F771 PolarHBondContact O-N 2.87Å; I769-T773 WeakPolarHBondContact O-CG2 3.35Å; I769-T773 PolarHBondContact O-N 3.13Å; I769-T773 PolarHBondContact O-OG1 2.92Å; I769-T773 VanDerWaalsContact O-OG1 3.07Å; I769-L784 HydrophobicContact CD1-CB 4.08Å; I769-L784 HydrophobicContact CG1-CB 3.98Å; I769-R785 HydrophobicContact CD1-CG 3.95Å; I769-R785 HydrophobicContact CG1-CG 4.25Å; I769-R785 HydrophobicContact CG2-CG 4.19Å; I769-L788 HydrophobicContact CD1-CD1 3.74Å
770	N	89.7	Confident	83.6	Confident	106 Å²	106	50.5 Å²	50.5	57%	0.567	28%	0.278	S	S	*	.	H	α-helix	trans	-65.7	-35	-179.3	-70.7	-11.5	0	0	0	112.3	R766 F767 T773 S774	R766-N770 WeakPolarHBondContact O-CB 3.33Å; R766-N770 VanDerWaalsContact O-CG 3.24Å; R766-N770 PolarHBondContact O-N 3.23Å; F767-N770 PolarHBondContact O-N 3.14Å; N770-T773 WeakPolarHBondContact CA-OG1 3.31Å; N770-T773 PolarHBondContact O-OG1 3.36Å; N770-S774 WeakPolarHBondContact O-CB 3.47Å; N770-S774 PolarHBondContact O-N 3.36Å
771	F	87.8	Confident	84	Confident	18 Å²	18	43.7 Å²	43.7	8%	0.079	24%	0.242	C	C	.	.	H	α-helix	trans	-66	-55.9	176.9	-179.7	-118.4	0	0	0	111	M711 R721 V724 F767 A768 I769 T773 S774 I775	M711-F771 HydrophobicContact CE-CD1 3.37Å; M711-F771 HydrophobicContact CE-CE1 3.39Å; M711-F771 HydrophobicContact CE-CG 3.96Å; M711-F771 HydrophobicContact CE-CZ 4.02Å; M711-F771 HydrophobicContact SD-CD1 4.33Å; M711-F771 HydrophobicContact SD-CE1 3.97Å; R721-F771 HydrophobicContact CB-CE2 3.81Å; R721-F771 HydrophobicContact CB-CZ 4.28Å; R721-F771 HydrophobicContact CG-CE2 4.17Å; R721-F771 WeakPolarHBondContact O-CZ 3.32Å; V724-F771 HydrophobicContact CB-CE1 4.16Å; V724-F771 HydrophobicContact CB-CZ 4.08Å; V724-F771 HydrophobicContact CG1-CE1 3.74Å; V724-F771 HydrophobicContact CG1-CZ 4.16Å; F767-F771 VanDerWaalsContact O-CB 3.23Å; F767-F771 WeakPolarHBondContact O-CB 3.41Å; F767-F771 PolarHBondContact O-N 3.07Å; A768-F771 PolarHBondContact O-N 3.03Å; I769-F771 VanDerWaalsContact C-N 3.32Å; I769-F771 PolarHBondContact O-N 2.87Å; F771-T773 VanDerWaalsContact C-N 3.33Å; F771-T773 PolarHBondContact O-N 3.17Å; F771-S774 PolarHBondContact O-N 3.26Å; F771-S774 VanDerWaalsContact O-N 3.07Å; F771-S774 PolarHBondContact O-OG 3.15Å; F771-I775 HydrophobicContact CD1-CD1 3.78Å; F771-I775 HydrophobicContact CD2-CD1 4.17Å; F771-I775 HydrophobicContact CE1-CD1 3.52Å; F771-I775 HydrophobicContact CE2-CD1 3.9Å; F771-I775 HydrophobicContact CE2-CG1 4.49Å; F771-I775 HydrophobicContact CG-CD1 4.12Å; F771-I775 HydrophobicContact CZ-CD1 3.59Å; F771-I775 WeakPolarHBondContact O-CG1 3.23Å; F771-I775 PolarHBondContact O-N 3.5Å; F771-I775 VanDerWaalsContact O-N 3.08Å
772	F	87.9	Confident	84.2	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-67.2	-28.1	-179.7	-73.6	-66.4	0	0	0	113.7	F728 L756 F757 A768 I775 G776 L777 T781	F728-F772 HydrophobicContact CD2-CE1 4.03Å; F728-F772 HydrophobicContact CE2-CE1 4.34Å; F728-F772 HydrophobicContact CE2-CZ 4.43Å; F728-F772 HydrophobicContact CG-CE1 4.13Å; L756-F772 HydrophobicContact CD2-CZ 4.44Å; F757-F772 HydrophobicContact CD1-CE2 4.06Å; F757-F772 HydrophobicContact CE1-CD2 4.02Å; F757-F772 AromaticContact CE1-CE2 3.58Å; F757-F772 HydrophobicContact CE1-CE2 3.58Å; F757-F772 HydrophobicContact CE1-CZ 4.11Å; F757-F772 HydrophobicContact CZ-CE2 4.48Å; A768-F772 VanDerWaalsContact O-CD2 3.29Å; A768-F772 WeakPolarHBondContact O-CD2 3.45Å; A768-F772 PolarHBondContact O-N 3.33Å; F772-I775 HydrophobicContact CD1-CD1 4.01Å; F772-I775 HydrophobicContact CE1-CD1 4.44Å; F772-I775 PolarHBondContact O-N 2.99Å; F772-G776 PolarHBondContact O-N 3.09Å; F772-L777 CarbonylContact O-C 3.52Å; F772-L777 PolarHBondContact O-N 3.18Å; F772-T781 HydrophobicContact CB-CG2 3.53Å; F772-T781 HydrophobicContact CD2-CG2 3.97Å; F772-T781 HydrophobicContact CG-CG2 4.11Å
773	T	88.1	Confident	84.2	Confident	57 Å²	57	43.5 Å²	43.5	35%	0.35	24%	0.236	S	C	.	.	H	α-helix	trans	-67.7	-41	168.5	54.9	0	0	0	0	112.1	I769 N770 F771 I775 G776 R785	I769-T773 WeakPolarHBondContact O-CG2 3.35Å; I769-T773 PolarHBondContact O-N 3.13Å; I769-T773 PolarHBondContact O-OG1 2.92Å; I769-T773 VanDerWaalsContact O-OG1 3.07Å; N770-T773 WeakPolarHBondContact CA-OG1 3.31Å; N770-T773 PolarHBondContact O-OG1 3.36Å; F771-T773 VanDerWaalsContact C-N 3.33Å; F771-T773 PolarHBondContact O-N 3.17Å; T773-I775 PolarHBondContact O-N 2.95Å; T773-G776 PolarHBondContact O-N 3.27Å; T773-R785 VanDerWaalsContact CG2-NH2 3.25Å
774	S	86.9	Confident	84.2	Confident	77 Å²	77	35.5 Å²	35.5	54%	0.538	21%	0.206	S	C	.	.	H	α-helix	trans	-65.6	-20.1	175.4	81	0	0	0	0	114.2	N770 F771	N770-S774 WeakPolarHBondContact O-CB 3.47Å; N770-S774 PolarHBondContact O-N 3.36Å; F771-S774 PolarHBondContact O-N 3.26Å; F771-S774 VanDerWaalsContact O-N 3.07Å; F771-S774 PolarHBondContact O-OG 3.15Å
775	I	87.2	Confident	84.2	Confident	9 Å²	9	37.6 Å²	37.6	5%	0.046	21%	0.211	C	C	.	.	H	α-helix	trans	-81.7	-21.5	172.6	-64.2	166.3	0	0	0	111.5	K725 Q729 F771 F772 T773 L777	K725-I775 HydrophobicContact CB-CD1 4.05Å; K725-I775 HydrophobicContact CB-CG1 3.94Å; K725-I775 HydrophobicContact CD-CG1 4.16Å; K725-I775 HydrophobicContact CG-CG1 3.93Å; K725-I775 HydrophobicContact CG-CG2 4.26Å; Q729-I775 HydrophobicContact CG-CG2 3.54Å; Q729-I775 PolarHBondContact NE2-O 2.88Å; F771-I775 HydrophobicContact CD1-CD1 3.78Å; F771-I775 HydrophobicContact CD2-CD1 4.17Å; F771-I775 HydrophobicContact CE1-CD1 3.52Å; F771-I775 HydrophobicContact CE2-CD1 3.9Å; F771-I775 HydrophobicContact CE2-CG1 4.49Å; F771-I775 HydrophobicContact CG-CD1 4.12Å; F771-I775 HydrophobicContact CZ-CD1 3.59Å; F771-I775 WeakPolarHBondContact O-CG1 3.23Å; F771-I775 PolarHBondContact O-N 3.5Å; F771-I775 VanDerWaalsContact O-N 3.08Å; F772-I775 HydrophobicContact CD1-CD1 4.01Å; F772-I775 HydrophobicContact CE1-CD1 4.44Å; F772-I775 PolarHBondContact O-N 2.99Å; T773-I775 PolarHBondContact O-N 2.95Å; I775-L777 HydrophobicContact CG2-CD1 3.67Å; I775-L777 HydrophobicContact CG2-CG 3.91Å
776	G	83	Confident	84.1	Confident	62 Å²	62	43 Å²	43	64%	0.639	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	95.6	5.8	-173.2	0	0	0	0	0	114.5	F772 T773	F772-G776 PolarHBondContact O-N 3.09Å; T773-G776 PolarHBondContact O-N 3.27Å
777	L	84.3	Confident	83.7	Confident	11 Å²	11	38.2 Å²	38.2	6%	0.058	22%	0.22	C	C	.	.			trans	-107.2	31.9	-172.8	-59.7	175	0	0	0	112.7	F728 C732 L737 F772 I775 G779 L780	F728-L777 HydrophobicContact CB-CD1 3.67Å; F728-L777 WeakPolarHBondContact O-CD1 3.37Å; C732-L777 HydrophobicContact CB-CD1 4.45Å; C732-L777 HydrophobicContact CB-CD2 3.68Å; C732-L777 WeakPolarHBondContact SG-CD2 3.36Å; L737-L777 HydrophobicContact CD1-CD2 4.14Å; F772-L777 CarbonylContact O-C 3.52Å; F772-L777 PolarHBondContact O-N 3.18Å; I775-L777 HydrophobicContact CG2-CD1 3.67Å; I775-L777 HydrophobicContact CG2-CG 3.91Å; L777-G779 PolarHBondContact O-N 3.26Å; L777-L780 HydrophobicContact CB-CD1 4.16Å; L777-L780 HydrophobicContact CB-CG 4.45Å; L777-L780 PolarHBondContact O-N 3.46Å
778	G	78.2	Confident	83.3	Confident	13 Å²	13	39.5 Å²	39.5	13%	0.134	23%	0.227	C	C	.	.	G	3₁₀ helix	trans	-55.7	-27.1	-172.5	0	0	0	0	0	115.3	L780 T781	G778-L780 PolarHBondContact O-N 3.27Å; G778-T781 PolarHBondContact O-N 3.12Å; G778-T781 PolarHBondContact O-OG1 2.99Å
779	G	79.5	Confident	82.8	Confident	22 Å²	22	46.2 Å²	46.2	23%	0.227	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-68.7	-7.8	177.6	0	0	0	0	0	115.5	N741 L777 T781 D782	N741-G779 PolarHBondContact ND2-O 3.38Å; L777-G779 PolarHBondContact O-N 3.26Å; G779-T781 VanDerWaalsContact C-N 3.32Å; G779-D782 WeakPolarHBondContact CA-OD2 3.39Å
780	L	81.3	Confident	82	Confident	10 Å²	10	48.5 Å²	48.5	5%	0.052	27%	0.269	C	S	.	.	G	3₁₀ helix	trans	-77.9	-20.7	167.1	-58.3	-176.8	0	0	0	111.9	L737 L740 N741 L744 F757 L777 G778	L737-L780 HydrophobicContact CD1-CD2 3.78Å; L737-L780 HydrophobicContact CD1-CG 3.93Å; L740-L780 HydrophobicContact CD2-CD1 4.14Å; L740-L780 HydrophobicContact CG-CD2 4.4Å; N741-L780 HydrophobicContact CB-CD2 3.79Å; L744-L780 HydrophobicContact CD1-CD1 3.9Å; L744-L780 HydrophobicContact CD1-CD2 4.04Å; L744-L780 HydrophobicContact CD1-CG 4.49Å; F757-L780 HydrophobicContact CZ-CB 4.42Å; L777-L780 HydrophobicContact CB-CD1 4.16Å; L777-L780 HydrophobicContact CB-CG 4.45Å; L777-L780 PolarHBondContact O-N 3.46Å; G778-L780 PolarHBondContact O-N 3.27Å
781	T	83.3	Confident	80.6	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	25%	0.25	C	S	.	.	S	Bend	trans	-99.1	5	-169.8	69.5	0	0	0	0	114.8	F772 G778 G779 E783 L784 R785	F772-T781 HydrophobicContact CB-CG2 3.53Å; F772-T781 HydrophobicContact CD2-CG2 3.97Å; F772-T781 HydrophobicContact CG-CG2 4.11Å; G778-T781 PolarHBondContact O-N 3.12Å; G778-T781 PolarHBondContact O-OG1 2.99Å; G779-T781 VanDerWaalsContact C-N 3.32Å; T781-E783 VanDerWaalsContact C-N 3.31Å; T781-E783 PolarHBondContact O-N 3.33Å; T781-L784 PolarHBondContact O-N 3.43Å; T781-L784 VanDerWaalsContact O-N 3.1Å; T781-R785 WeakPolarHBondContact O-CD 3.23Å; T781-R785 VanDerWaalsContact O-CG 3.31Å; T781-R785 WeakPolarHBondContact O-CG 3.41Å; T781-R785 PolarHBondContact O-N 3.5Å; T781-R785 PolarHBondContact OG1-NE 3.03Å
782	D	81.6	Confident	79.3	Confident	66 Å²	66	47.7 Å²	47.7	35%	0.353	27%	0.273	S	S	.	.	H	α-helix	trans	-63.7	-34.2	-174.5	-67.2	-40.1	0	0	0	113.2	G779 R785 E786	G779-D782 WeakPolarHBondContact CA-OD2 3.39Å; D782-R785 WeakPolarHBondContact O-CB 3.5Å; D782-R785 PolarHBondContact O-N 3.44Å; D782-R785 WeakPolarHBondContact OD1-CD 3.38Å; D782-R785 IonicContact OD1-CZ 3.58Å; D782-R785 IonicContact OD1-NE 4Å; D782-R785 IonicContact OD1-NH1 2.73Å; D782-R785 PolarHBondContact OD1-NH1 3.07Å; D782-E786 WeakPolarHBondContact O-CG 3.41Å; D782-E786 PolarHBondContact O-N 2.89Å
783	E	80.9	Confident	77.8	Confident	64 Å²	64	53.8 Å²	53.8	30%	0.299	30%	0.299	S	S	.	.	H	α-helix	trans	-67.7	-40.2	172.3	-168.3	-179.4	154.6	0	0	112.1	R759 T781 R785 E786 H787	R759-E783 IonicContact CZ-OE1 3.22Å; R759-E783 IonicContact NH1-OE1 2.83Å; R759-E783 PolarHBondContact NH1-OE1 3.06Å; R759-E783 IonicContact NH2-OE1 3.59Å; R759-E783 PolarHBondContact NH2-OE1 3.21Å; R759-E783 IonicContact NH2-OE2 2.69Å; T781-E783 VanDerWaalsContact C-N 3.31Å; T781-E783 PolarHBondContact O-N 3.33Å; E783-R785 VanDerWaalsContact C-N 3.3Å; E783-R785 PolarHBondContact O-N 3.13Å; E783-E786 PolarHBondContact O-N 3.29Å; E783-H787 WeakPolarHBondContact O-CB 3.45Å; E783-H787 PolarHBondContact O-N 3.44Å
784	L	80.7	Confident	76.3	Confident	5 Å²	5	55.6 Å²	55.6	3%	0.026	31%	0.305	C	S	.	.	H	α-helix	trans	-65.5	-33.5	173.4	-68.6	-174.7	0	0	0	112.3	F757 R759 T765 A768 I769 T781 H787 L788	F757-L784 HydrophobicContact CB-CD1 4.01Å; F757-L784 HydrophobicContact CB-CD2 4.2Å; F757-L784 HydrophobicContact CB-CG 4.35Å; F757-L784 HydrophobicContact CD1-CD1 3.81Å; F757-L784 HydrophobicContact CG-CD1 4.34Å; R759-L784 HydrophobicContact CG-CD2 4.21Å; T765-L784 HydrophobicContact CG2-CB 4.02Å; T765-L784 HydrophobicContact CG2-CD2 4.2Å; T765-L784 HydrophobicContact CG2-CG 4.48Å; A768-L784 HydrophobicContact CB-CD1 4.23Å; I769-L784 HydrophobicContact CD1-CB 4.08Å; I769-L784 HydrophobicContact CG1-CB 3.98Å; T781-L784 PolarHBondContact O-N 3.43Å; T781-L784 VanDerWaalsContact O-N 3.1Å; L784-H787 PolarHBondContact O-N 3.4Å; L784-L788 VanDerWaalsContact O-CB 3.29Å; L784-L788 WeakPolarHBondContact O-CB 3.46Å; L784-L788 PolarHBondContact O-N 2.96Å
785	R	81.8	Confident	74.7	Confident	84 Å²	84	55.8 Å²	55.8	32%	0.317	30%	0.299	S	S	.	.	H	α-helix	trans	-68	-36.2	173.8	-68.9	156.6	165.6	-166.4	-5.9	111.4	I769 T773 T781 D782 E783 K789	I769-R785 HydrophobicContact CD1-CG 3.95Å; I769-R785 HydrophobicContact CG1-CG 4.25Å; I769-R785 HydrophobicContact CG2-CG 4.19Å; T773-R785 VanDerWaalsContact CG2-NH2 3.25Å; T781-R785 WeakPolarHBondContact O-CD 3.23Å; T781-R785 VanDerWaalsContact O-CG 3.31Å; T781-R785 WeakPolarHBondContact O-CG 3.41Å; T781-R785 PolarHBondContact O-N 3.5Å; T781-R785 PolarHBondContact OG1-NE 3.03Å; D782-R785 WeakPolarHBondContact O-CB 3.5Å; D782-R785 PolarHBondContact O-N 3.44Å; D782-R785 WeakPolarHBondContact OD1-CD 3.38Å; D782-R785 IonicContact OD1-CZ 3.58Å; D782-R785 IonicContact OD1-NE 4Å; D782-R785 IonicContact OD1-NH1 2.73Å; D782-R785 PolarHBondContact OD1-NH1 3.07Å; E783-R785 VanDerWaalsContact C-N 3.3Å; E783-R785 PolarHBondContact O-N 3.13Å; R785-K789 WeakPolarHBondContact O-CD 3.33Å; R785-K789 WeakPolarHBondContact O-CG 3.2Å; R785-K789 PolarHBondContact O-N 2.84Å
786	E	80.6	Confident	73.2	Confident	116 Å²	116	61.2 Å²	61.2	54%	0.542	33%	0.326	S	S	.	.	H	α-helix	trans	-72.3	-40.2	172.6	-72.6	-178.1	-177.3	0	0	112.2	D782 E783 L788 K789 N790	D782-E786 WeakPolarHBondContact O-CG 3.41Å; D782-E786 PolarHBondContact O-N 2.89Å; E783-E786 PolarHBondContact O-N 3.29Å; E786-L788 VanDerWaalsContact C-N 3.34Å; E786-L788 PolarHBondContact O-N 3.1Å; E786-K789 PolarHBondContact O-N 3.33Å; E786-N790 WeakPolarHBondContact O-CB 3.49Å; E786-N790 PolarHBondContact O-N 2.85Å; E786-N790 PolarHBondContact O-ND2 3.03Å
787	H	76.7	Confident	71.9	Confident	46 Å²	46	61.7 Å²	61.7	21%	0.213	32%	0.317	C	S	.	.	H	α-helix	trans	-58.3	-45.7	171.4	-163.1	-107.5	0	0	0	110.9	R759 E783 L784 K789 N790 A791	R759-H787 PolarHBondContact O-CE1 3.34Å; R759-H787 VanDerWaalsContact O-CE1 3.31Å; E783-H787 WeakPolarHBondContact O-CB 3.45Å; E783-H787 PolarHBondContact O-N 3.44Å; L784-H787 PolarHBondContact O-N 3.4Å; H787-K789 PolarHBondContact O-N 3.33Å; H787-N790 CarbonylContact O-C 3.4Å; H787-N790 PolarHBondContact O-N 3.35Å; H787-N790 VanDerWaalsContact O-N 3.14Å; H787-A791 WeakPolarHBondContact O-CB 3.14Å; H787-A791 PolarHBondContact O-N 3.02Å
788	L	77.1	Confident	70.4	Confident	48 Å²	48	66.9 Å²	66.9	25%	0.251	34%	0.341	S	S	.	.	H	α-helix	trans	-65.1	-37.9	176.1	-161.4	170.1	0	0	0	112.2	R766 I769 L784 E786 N790 P792	R766-L788 HydrophobicContact CG-CD1 3.65Å; I769-L788 HydrophobicContact CD1-CD1 3.74Å; L784-L788 VanDerWaalsContact O-CB 3.29Å; L784-L788 WeakPolarHBondContact O-CB 3.46Å; L784-L788 PolarHBondContact O-N 2.96Å; E786-L788 VanDerWaalsContact C-N 3.34Å; E786-L788 PolarHBondContact O-N 3.1Å; L788-N790 VanDerWaalsContact C-N 3.29Å; L788-N790 PolarHBondContact O-N 3.32Å; L788-P792 WeakPolarHBondContact O-CD 3.23Å
789	K	76.9	Confident	69.1	Low	140 Å²	140	70.2 Å²	70.2	61%	0.609	36%	0.355	S	S	*	.	H	α-helix	trans	-66.9	-27.9	172.7	-72.8	164.2	-172.5	171.1	0	113.2	R785 E786 H787	R785-K789 WeakPolarHBondContact O-CD 3.33Å; R785-K789 WeakPolarHBondContact O-CG 3.2Å; R785-K789 PolarHBondContact O-N 2.84Å; E786-K789 PolarHBondContact O-N 3.33Å; H787-K789 PolarHBondContact O-N 3.33Å
790	N	68.3	Low	67.8	Low	65 Å²	65	74.6 Å²	74.6	35%	0.348	37%	0.37	S	S	.	.	H	α-helix	trans	-95.1	-20.6	179.7	-71.2	-28.4	0	0	0	113.1	E786 H787 L788 K793 M794	E786-N790 WeakPolarHBondContact O-CB 3.49Å; E786-N790 PolarHBondContact O-N 2.85Å; E786-N790 PolarHBondContact O-ND2 3.03Å; H787-N790 CarbonylContact O-C 3.4Å; H787-N790 PolarHBondContact O-N 3.35Å; H787-N790 VanDerWaalsContact O-N 3.14Å; L788-N790 VanDerWaalsContact C-N 3.29Å; L788-N790 PolarHBondContact O-N 3.32Å; N790-K793 CarbonylContact O-C 2.97Å; N790-K793 WeakPolarHBondContact O-CA 3.27Å; N790-K793 VanDerWaalsContact O-CB 3.3Å; N790-K793 WeakPolarHBondContact O-CB 3.48Å; N790-K793 PolarHBondContact O-N 3.45Å; N790-K793 PolarHBondContact OD1-NZ 2.87Å; N790-M794 PolarHBondContact O-N 3.49Å
791	A	61	Low	66.2	Low	21 Å²	21	80.6 Å²	80.6	17%	0.174	40%	0.397	C	S	.	.	H	α-helix	trans	-55.3	-41.7	179	0	0	0	0	0	113.3	H787 K793 M794 I795	H787-A791 WeakPolarHBondContact O-CB 3.14Å; H787-A791 PolarHBondContact O-N 3.02Å; A791-K793 PolarHBondContact O-N 2.8Å; A791-M794 PolarHBondContact O-N 2.85Å; A791-I795 WeakPolarHBondContact O-CB 3.21Å; A791-I795 WeakPolarHBondContact O-CD1 3.46Å; A791-I795 WeakPolarHBondContact O-CG1 3.44Å; A791-I795 PolarHBondContact O-N 3.21Å
792	P	59.4	Low	64.8	Low	86 Å²	86	84.8 Å²	84.8	56%	0.558	42%	0.423	S	S	*	.	H	α-helix	trans	-59.4	-29.8	171.7	-25.8	34.8	0	0	0	114.1	L788 M796	L788-P792 WeakPolarHBondContact O-CD 3.23Å; P792-M796 VanDerWaalsContact O-CB 3.3Å; P792-M796 WeakPolarHBondContact O-CB 3.47Å; P792-M796 PolarHBondContact O-N 2.76Å; P792-M796 VanDerWaalsContact O-N 3.15Å
793	K	57.4	Low	63	Low	127 Å²	127	89.9 Å²	89.9	55%	0.552	45%	0.445	S	S	*	.	H	α-helix	trans	-81.1	-39.6	177.3	-50.9	174.3	-168.3	158.3	0	111.3	N790 A791 M796 T797	N790-K793 CarbonylContact O-C 2.97Å; N790-K793 WeakPolarHBondContact O-CA 3.27Å; N790-K793 VanDerWaalsContact O-CB 3.3Å; N790-K793 WeakPolarHBondContact O-CB 3.48Å; N790-K793 PolarHBondContact O-N 3.45Å; N790-K793 PolarHBondContact OD1-NZ 2.87Å; A791-K793 PolarHBondContact O-N 2.8Å; K793-M796 WeakPolarHBondContact O-CB 3.33Å; K793-M796 PolarHBondContact O-N 2.82Å; K793-T797 PolarHBondContact O-N 3.41Å; K793-T797 PolarHBondContact O-OG1 2.71Å
794	M	55.3	Low	61.3	Low	96 Å²	96	91.5 Å²	91.5	47%	0.473	46%	0.463	S	S	.	.	H	α-helix	trans	-67.1	-40.3	175.7	-70.4	172	63.6	0	0	111.5	N790 A791 M796 T797 Q798	N790-M794 PolarHBondContact O-N 3.49Å; A791-M794 PolarHBondContact O-N 2.85Å; M794-M796 VanDerWaalsContact C-N 3.29Å; M794-M796 PolarHBondContact O-N 3.4Å; M794-T797 WeakPolarHBondContact CA-OG1 3.42Å; M794-T797 PolarHBondContact O-N 2.93Å; M794-T797 PolarHBondContact O-OG1 3.03Å; M794-Q798 WeakPolarHBondContact O-CB 3.21Å; M794-Q798 PolarHBondContact O-N 3.2Å
795	I	55.3	Low	59.5	Low	81 Å²	81	95.1 Å²	95.1	42%	0.415	49%	0.489	S	S	.	.	H	α-helix	trans	-64.3	-36.6	170.7	-66.5	163.6	0	0	0	110.2	A791 N799	A791-I795 WeakPolarHBondContact O-CB 3.21Å; A791-I795 WeakPolarHBondContact O-CD1 3.46Å; A791-I795 WeakPolarHBondContact O-CG1 3.44Å; A791-I795 PolarHBondContact O-N 3.21Å; I795-N799 WeakPolarHBondContact O-CB 3.28Å; I795-N799 PolarHBondContact O-N 3.12Å; I795-N799 PolarHBondContact O-OD1 3.19Å
796	M	54.4	Low	57.1	Low	122 Å²	122	98.4 Å²	98.4	60%	0.601	51%	0.513	S	S	*	.	H	α-helix	trans	-66.8	-41.3	174.7	-177.9	176.6	171.4	0	0	112.7	P792 K793 M794 Q800	P792-M796 VanDerWaalsContact O-CB 3.3Å; P792-M796 WeakPolarHBondContact O-CB 3.47Å; P792-M796 PolarHBondContact O-N 2.76Å; P792-M796 VanDerWaalsContact O-N 3.15Å; K793-M796 WeakPolarHBondContact O-CB 3.33Å; K793-M796 PolarHBondContact O-N 2.82Å; M794-M796 VanDerWaalsContact C-N 3.29Å; M794-M796 PolarHBondContact O-N 3.4Å; M796-Q800 WeakPolarHBondContact O-CG 3.46Å; M796-Q800 PolarHBondContact O-N 2.86Å
797	T	55.9	Low	55	Low	73 Å²	73	97.9 Å²	97.9	45%	0.448	52%	0.522	S	S	.	.	H	α-helix	trans	-70.9	-41.6	174.9	50.7	0	0	0	0	112.1	K793 M794 N799 Q800 E801	K793-T797 PolarHBondContact O-N 3.41Å; K793-T797 PolarHBondContact O-OG1 2.71Å; M794-T797 WeakPolarHBondContact CA-OG1 3.42Å; M794-T797 PolarHBondContact O-N 2.93Å; M794-T797 PolarHBondContact O-OG1 3.03Å; T797-N799 VanDerWaalsContact C-N 3.31Å; T797-N799 PolarHBondContact O-N 3.47Å; T797-Q800 WeakPolarHBondContact O-CB 3.38Å; T797-Q800 PolarHBondContact O-N 3.5Å; T797-Q800 VanDerWaalsContact O-N 3.08Å; T797-E801 WeakPolarHBondContact O-CG 3.35Å; T797-E801 PolarHBondContact O-N 3.05Å
798	Q	51.9	Low	53	Low	120 Å²	120	101 Å²	101	56%	0.561	55%	0.549	S	S	*	.	H	α-helix	trans	-64.5	-36.8	176.9	-168.8	171.9	20.7	0	0	111.2	M794 E801 V802	M794-Q798 WeakPolarHBondContact O-CB 3.21Å; M794-Q798 PolarHBondContact O-N 3.2Å; Q798-E801 PolarHBondContact O-N 3.28Å; Q798-V802 PolarHBondContact O-N 2.88Å
799	N	52.1	Low	50.8	Low	82 Å²	82	104.6 Å²	104.6	44%	0.439	58%	0.578	S	S	.	*	H	α-helix	trans	-65.7	-37.3	170.8	-75.5	4.4	0	0	0	112.2	I795 T797 E801 V802 E803	I795-N799 WeakPolarHBondContact O-CB 3.28Å; I795-N799 PolarHBondContact O-N 3.12Å; I795-N799 PolarHBondContact O-OD1 3.19Å; T797-N799 VanDerWaalsContact C-N 3.31Å; T797-N799 PolarHBondContact O-N 3.47Å; N799-E801 VanDerWaalsContact C-N 3.31Å; N799-E801 PolarHBondContact O-N 3.31Å; N799-V802 PolarHBondContact O-N 3.45Å; N799-E803 VanDerWaalsContact O-CB 3.3Å; N799-E803 WeakPolarHBondContact O-CB 3.47Å; N799-E803 WeakPolarHBondContact O-CG 3.49Å; N799-E803 PolarHBondContact O-N 2.8Å
800	Q	51.1	Low	48.8	Very low	115 Å²	115	103.1 Å²	103.1	54%	0.537	59%	0.585	S	S	.	*	H	α-helix	trans	-66.3	-32.3	172.6	-74.3	-175.4	-51.4	0	0	112.9	M796 T797 S804	M796-Q800 WeakPolarHBondContact O-CG 3.46Å; M796-Q800 PolarHBondContact O-N 2.86Å; T797-Q800 WeakPolarHBondContact O-CB 3.38Å; T797-Q800 PolarHBondContact O-N 3.5Å; T797-Q800 VanDerWaalsContact O-N 3.08Å; Q800-S804 PolarHBondContact O-N 3.33Å; Q800-S804 PolarHBondContact O-OG 2.76Å
801	E	49	Very low	47.2	Very low	135 Å²	135	105.4 Å²	105.4	63%	0.631	61%	0.606	S	S	*	*	H	α-helix	trans	-72.6	-33.2	175.6	-71.2	173.8	162.1	0	0	112.4	T797 Q798 N799 S804 S805	T797-E801 WeakPolarHBondContact O-CG 3.35Å; T797-E801 PolarHBondContact O-N 3.05Å; Q798-E801 PolarHBondContact O-N 3.28Å; N799-E801 VanDerWaalsContact C-N 3.31Å; N799-E801 PolarHBondContact O-N 3.31Å; E801-S804 PolarHBondContact O-OG 2.88Å; E801-S805 PolarHBondContact O-OG 3.26Å
802	V	53.6	Low	45.9	Very low	89 Å²	89	109 Å²	109	54%	0.539	63%	0.63	S	S	.	*	H	α-helix	trans	-84.5	-31.2	171.9	-60.8	0	0	0	0	114.1	Q798 N799 S804 S805	Q798-V802 PolarHBondContact O-N 2.88Å; N799-V802 PolarHBondContact O-N 3.45Å; V802-S804 PolarHBondContact O-N 3.11Å; V802-S804 VanDerWaalsContact O-N 3.14Å; V802-S805 PolarHBondContact O-N 3.39Å; V802-S805 VanDerWaalsContact O-N 3.11Å
803	E	44	Very low	44.7	Very low	173 Å²	173	110.1 Å²	110.1	81%	0.808	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.4	-10	173.2	-78.1	-169.6	150.9	0	0	113.2	N799	N799-E803 VanDerWaalsContact O-CB 3.3Å; N799-E803 WeakPolarHBondContact O-CB 3.47Å; N799-E803 WeakPolarHBondContact O-CG 3.49Å; N799-E803 PolarHBondContact O-N 2.8Å
804	S	45.8	Very low	43.4	Very low	97 Å²	97	108.7 Å²	108.7	68%	0.678	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.1	8.3	173.3	47.3	0	0	0	0	114.5	Q800 E801 V802	Q800-S804 PolarHBondContact O-N 3.33Å; Q800-S804 PolarHBondContact O-OG 2.76Å; E801-S804 PolarHBondContact O-OG 2.88Å; V802-S804 PolarHBondContact O-N 3.11Å; V802-S804 VanDerWaalsContact O-N 3.14Å
805	S	42.1	Very low	42.4	Very low	81 Å²	81	109.3 Å²	109.3	57%	0.566	66%	0.66	S	S	*	*	S	Bend	trans	-141.3	72.3	178	46.8	0	0	0	0	115.4	E801 V802	E801-S805 PolarHBondContact O-OG 3.26Å; V802-S805 PolarHBondContact O-N 3.39Å; V802-S805 VanDerWaalsContact O-N 3.11Å
806	D	31.9	Very low	41.4	Very low	154 Å²	154	109.9 Å²	109.9	82%	0.824	67%	0.671	S	S	*	*			trans	65.5	157.1	163.2	-84.9	-30.1	0	0	0	118.9
807	S	35.5	Very low	40.6	Very low	104 Å²	104	108.8 Å²	108.8	73%	0.727	68%	0.675	S	S	*	*			cis	-167.1	165.1	-35.2	-111.9	0	0	0	0	109.8
808	S	35.6	Very low	39.3	Very low	112 Å²	112	113.1 Å²	113.1	78%	0.783	69%	0.691	S	S	*	*			trans	-68.5	130.3	-168.7	59.3	0	0	0	0	117.2
809	S	31.3	Very low	38.2	Very low	124 Å²	124	112.6 Å²	112.6	87%	0.867	70%	0.7	S	S	*	*				169.2	169.5	123.6	49.9	0	0	0	0	112.3
810	S	33.2	Very low	37.1	Very low	109 Å²	109	113.4 Å²	113.4	76%	0.762	71%	0.712	S	S	*	*			trans	-156.8	177.3	-160.9	61	0	0	0	0	115.8
811	S	35	Very low	36.2	Very low	112 Å²	112	112.9 Å²	112.9	78%	0.783	72%	0.721	S	S	*	*			trans	83.6	148.5	163.1	78.5	0	0	0	0	119.1
812	S	34.2	Very low	35.5	Very low	97 Å²	97	111.4 Å²	111.4	68%	0.678	73%	0.726	S	S	*	*			cis	-176.6	160.3	-21	52.2	0	0	0	0	113.7
813	S	34.1	Very low	34.3	Very low	110 Å²	110	114 Å²	114	77%	0.769	74%	0.736	S	S	*	*			trans	64.5	157.3	152	51.5	0	0	0	0	119.1
814	S	31.2	Very low	33.6	Very low	97 Å²	97	111 Å²	111	68%	0.678	74%	0.735	S	S	*	*			cis	-153	146	15.6	0.2	0	0	0	0	109.1
815	S	33.3	Very low	32.9	Very low	108 Å²	108	111.3 Å²	111.3	76%	0.755	74%	0.737	S	S	*	*				63.4	147.2	75.4	101.5	0	0	0	0	114.3
816	S	34.7	Very low	32.4	Very low	93 Å²	93	112 Å²	112	65%	0.65	74%	0.742	S	S	*	*			cis	179.6	156.3	2.3	28.8	0	0	0	0	109.7
817	S	36.8	Very low	32.2	Very low	100 Å²	100	110.7 Å²	110.7	70%	0.699	74%	0.735	S	S	*	*			cis	165.5	126.2	-21.5	52.4	0	0	0	0	110.6
818	E	28.6	Very low	31.9	Very low	164 Å²	164	110.2 Å²	110.2	77%	0.766	73%	0.731	S	S	*	*			trans	-112.8	143.9	-169.7	-28.8	-55.8	114.2	0	0	116
819	S	29.8	Very low	31.5	Very low	109 Å²	109	112.1 Å²	112.1	76%	0.762	73%	0.733	S	S	*	*			trans	6.7	154.3	151.2	54.5	0	0	0	0	123.4
820	S	29.2	Very low	31.3	Very low	99 Å²	99	111 Å²	111	69%	0.692	73%	0.725	S	S	*	*			cis	-178.5	164.8	-12.3	53.2	0	0	0	0	111.1
821	S	32.7	Very low	30.9	Very low	103 Å²	103	112.5 Å²	112.5	72%	0.72	72%	0.724	S	S	*	*			trans	63	148.1	165	44.5	0	0	0	0	117.9
822	S	32.7	Very low	30.6	Very low	105 Å²	105	112.3 Å²	112.3	73%	0.734	72%	0.723	S	S	*	*			cis	-178.5	162	-8.7	47.5	0	0	0	0	109.6
823	D	28.8	Very low	30.3	Very low	142 Å²	142	113.5 Å²	113.5	76%	0.759	73%	0.731	S	S	*	*			cis	-174.8	177.6	-27.5	-103.7	-62.4	0	0	0	108.6
824	S	30.4	Very low	30	Very low	111 Å²	111	112.9 Å²	112.9	78%	0.776	73%	0.727	S	S	*	*			trans	76.9	138.7	168.7	-40	0	0	0	0	116.3
825	S	30.6	Very low	29.9	Very low	104 Å²	104	113 Å²	113	73%	0.727	73%	0.728	S	S	*	*			cis	-134.9	150.1	-2.4	-59.8	0	0	0	0	108.8
826	S	31.3	Very low	29.7	Very low	95 Å²	95	113.3 Å²	113.3	66%	0.664	73%	0.73	S	S	*	*				63.8	141	57.4	123.7	0	0	0	0	112.4
827	D	28.1	Very low	29.5	Very low	127 Å²	127	114.1 Å²	114.1	68%	0.679	74%	0.736	S	S	*	*			cis	-148.9	154.2	5	-104.5	-53.6	0	0	0	108.9
828	S	28.8	Very low	29.2	Very low	93 Å²	93	113.7 Å²	113.7	65%	0.65	73%	0.733	S	S	*	*				66.4	159.7	85.5	-47.8	0	0	0	0	116.8
829	D	27.6	Very low	29.2	Very low	152 Å²	152	111 Å²	111	81%	0.813	73%	0.733	S	S	*	*			trans	83	96	162	-54.3	-23.6	0	0	0	123.1
830	S	25.9	Very low	29.2	Very low	100 Å²	100	110.6 Å²	110.6	70%	0.699	73%	0.729	S	S	*	*				34.4	128.7	118	-88.2	0	0	0	0	125
831	D	26.3	Very low	29.2	Very low	141 Å²	141	113 Å²	113	75%	0.754	74%	0.735	S	S	*	*				57.4	125.2	127.6	-59.3	-63.9	0	0	0	122.7
832	S	28.5	Very low	29	Very low	109 Å²	109	112.4 Å²	112.4	76%	0.762	73%	0.73	S	S	*	*				172.3	143.5	93.4	48.1	0	0	0	0	116.2
833	S	27.7	Very low	28.8	Very low	121 Å²	121	114.6 Å²	114.6	85%	0.846	73%	0.734	S	S	*	*			trans	68.6	151.9	168.8	81.9	0	0	0	0	117.4
834	S	28.1	Very low	29	Very low	98 Å²	98	114 Å²	114	69%	0.685	74%	0.735	S	S	*	*			cis	-147	162.4	10.1	58.8	0	0	0	0	114
835	S	28.2	Very low	28.8	Very low	99 Å²	99	114.4 Å²	114.4	69%	0.692	73%	0.728	S	S	*	*			trans	49.8	102.7	158.8	47.4	0	0	0	0	119.1
836	S	28.3	Very low	28.6	Very low	115 Å²	115	113.2 Å²	113.2	80%	0.804	72%	0.72	S	S	*	*				103.7	136	67.5	63.1	0	0	0	0	111.5
837	S	30.7	Very low	28.5	Very low	109 Å²	109	116.5 Å²	116.5	76%	0.762	72%	0.723	S	S	*	*			cis	-153.2	-165.4	-1.6	64.8	0	0	0	0	108.5
838	S	31.1	Very low	28.5	Very low	92 Å²	92	120.4 Å²	120.4	64%	0.643	73%	0.728	S	S	*	*			cis	-169.1	171	2.7	24	0	0	0	0	108.4
839	S	29.7	Very low	28.4	Very low	108 Å²	108	122.7 Å²	122.7	76%	0.755	73%	0.726	S	S	*	*			trans	62.3	129.5	155.6	48.1	0	0	0	0	118.5
840	S	28.9	Very low	28.4	Very low	99 Å²	99	122.9 Å²	122.9	69%	0.692	72%	0.72	S	S	*	*			cis	-156.4	155.8	4.9	-65.9	0	0	0	0	111.9
841	N	28.7	Very low	28.6	Very low	151 Å²	151	126.7 Å²	126.7	81%	0.807	72%	0.723	S	S	*	*			trans	32.8	144.5	138.1	-57.3	3.3	0	0	0	121.5
842	S	28.7	Very low	28.5	Very low	90 Å²	90	128.5 Å²	128.5	63%	0.629	73%	0.725	S	S	*	*			cis	179.1	138.3	-5.3	47.5	0	0	0	0	111.4
843	D	28.7	Very low	28.4	Very low	151 Å²	151	133.5 Å²	133.5	81%	0.807	73%	0.727	S	S	*	*			trans	59.8	163.8	145.5	-64	-59.6	0	0	0	120.8
844	V	31.8	Very low	28.4	Very low	128 Å²	128	137.4 Å²	137.4	78%	0.776	73%	0.728	S	S	*	*			cis	-152.1	163.9	5.5	-130.4	0	0	0	0	113.8
845	D	27	Very low	28.2	Very low	120 Å²	120	136.3 Å²	136.3	64%	0.642	73%	0.733	S	S	*	*			trans	46.1	98.1	146.3	-106.6	-109.5	0	0	0	126.1	K847	D845-K847 IonicContact OD1-NZ 3.01Å; D845-K847 PolarHBondContact OD1-NZ 3.24Å
846	S	27.5	Very low	28	Very low	80 Å²	80	142.8 Å²	142.8	56%	0.559	74%	0.742	S	S	*	*				72.5	153.1	99	109.8	0	0	0	0	127.4
847	K	27.5	Very low	28	Very low	164 Å²	164	142.4 Å²	142.4	71%	0.713	74%	0.735	S	S	*	*			trans	65.8	93.5	145.7	-67.8	169.2	-154.9	111.8	0	122.7	D845	D845-K847 IonicContact OD1-NZ 3.01Å; D845-K847 PolarHBondContact OD1-NZ 3.24Å
848	R	28.3	Very low	27.7	Very low	208 Å²	208	145.3 Å²	145.3	79%	0.785	74%	0.737	S	S	*	*				56	126.3	107.8	-85.2	-179.2	160.1	-178.7	0.4	121.6
849	K	28.2	Very low	27.4	Very low	141 Å²	141	145.9 Å²	145.9	61%	0.613	73%	0.729	S	S	*	*				105.9	126.7	119.6	-84.6	173.5	178.8	171.8	0	122.1
850	K	27.3	Very low	27.3	Very low	157 Å²	157	148 Å²	148	68%	0.683	73%	0.725	S	S	*	*				90.1	117	128.5	-80.9	177.2	175.2	179.2	0	122.1
851	K	28.9	Very low	27.2	Very low	179 Å²	179	150.4 Å²	150.4	78%	0.778	72%	0.722	S	S	*	*			trans	70.5	166.9	135.4	-61.2	-172.3	175.1	-169.8	0	115.3
852	K	25.3	Very low	27.2	Very low	180 Å²	180	152.1 Å²	152.1	78%	0.783	72%	0.723	S	S	*	*			cis	-160.7	141	18.9	-150.6	173.3	-176.9	-176.4	0	112.4
853	R	26.5	Very low	27	Very low	214 Å²	214	157.5 Å²	157.5	81%	0.808	74%	0.735	S	S	*	*			trans	39.6	132.6	147.1	-80.4	-175.8	163.3	-175.7	-3.7	123.6
854	K	27.3	Very low	26.9	Very low	202 Å²	202	153.4 Å²	153.4	88%	0.878	73%	0.728	S	S	*	*			trans	67.9	123.9	133.6	-79.3	-162.9	169.1	-166.7	0	122.2
855	G	23.6	Very low	26.6	Very low	76 Å²	76	156.8 Å²	156.8	78%	0.784	73%	0.732	S	S	*	*			trans	149.1	171.2	146.4	0	0	0	0	0	112.9
856	R	25	Very low	26.7	Very low	234 Å²	234	157.4 Å²	157.4	88%	0.883	74%	0.736	S	S	*	*			cis	-175	111.2	-43.5	177.2	-173.5	175.9	-155.1	-2.7	109.3
857	V	26.5	Very low	26.7	Very low	107 Å²	107	162.5 Å²	162.5	65%	0.648	75%	0.748	S	S	*	*			trans	70.8	141.4	149.7	177.7	0	0	0	0	120.5
858	E	25	Very low	26.7	Very low	171 Å²	171	163.3 Å²	163.3	80%	0.799	75%	0.751	S	S	*	*			trans	65.1	162.8	158.9	-78.4	165.1	-165.8	0	0	121.2
859	E	25	Very low	26.7	Very low	104 Å²	104	161.9 Å²	161.9	49%	0.486	75%	0.751	S	S	.	*			cis	-149.6	144.9	-7.4	-132.8	-142	-173.3	0	0	114.9	K861	E859-K861 IonicContact OE2-NZ 2.76Å; E859-K861 PolarHBondContact OE2-NZ 3.21Å
860	K	26.9	Very low	26.6	Very low	152 Å²	152	161.9 Å²	161.9	66%	0.661	75%	0.751	S	S	*	*			trans	29.6	158.3	142.6	-69.1	-177.6	-163.7	138.7	0	126.5
861	K	26.8	Very low	26.6	Very low	149 Å²	149	160.3 Å²	160.3	65%	0.648	75%	0.746	S	S	*	*			trans	80.5	144.2	157	-62.4	126.9	-175.6	163.5	0	114.7	E859	E859-K861 IonicContact OE2-NZ 2.76Å; E859-K861 PolarHBondContact OE2-NZ 3.21Å
862	K	28.8	Very low	26.6	Very low	187 Å²	187	159.7 Å²	159.7	81%	0.813	74%	0.743	S	S	*	*			cis	-156.8	174.9	-5.5	-98.5	157.5	-178.5	171.1	0	104.8
863	K	25.8	Very low	26.7	Very low	204 Å²	204	156.8 Å²	156.8	89%	0.887	74%	0.74	S	S	*	*			cis	-164.6	162.9	9.1	-143.3	-174.4	-177.1	-176.5	0	105.2
864	G	24.9	Very low	26.8	Very low	64 Å²	64	151.6 Å²	151.6	66%	0.66	73%	0.729	S	S	*	*			cis	153.2	140.9	-15.3	0	0	0	0	0	112.1
865	K	26.8	Very low	26.9	Very low	200 Å²	200	149.3 Å²	149.3	87%	0.87	72%	0.718	S	S	*	*			trans	74.1	151.7	171.9	-74	-166.5	173.1	-175	0	118.6
866	D	28.6	Very low	27.1	Very low	133 Å²	133	155 Å²	155	71%	0.711	72%	0.716	S	S	*	*			cis	-172.5	172.6	-28.6	-141.1	-46.7	0	0	0	111.3
867	K	27.7	Very low	27.2	Very low	186 Å²	186	153.7 Å²	153.7	81%	0.809	71%	0.711	S	S	*	*			trans	76.3	143.2	174.5	-55.7	172.9	-176.9	175.2	0	115.7
868	K	27.5	Very low	27.5	Very low	181 Å²	181	158.9 Å²	158.9	79%	0.787	73%	0.725	S	S	*	*			cis	-179.3	129.8	-20.4	-113.6	177.8	-179.8	-176.7	0	103.1
869	K	28.3	Very low	27.6	Very low	178 Å²	178	154.7 Å²	154.7	77%	0.774	73%	0.728	S	S	*	*				56.1	138.8	107.5	-78.6	-172	172.3	-176.2	0	115.5
870	K	27.2	Very low	27.7	Very low	142 Å²	142	153.8 Å²	153.8	62%	0.617	75%	0.746	S	S	*	*			cis	-167.8	150	31.7	-142.7	174.1	178.9	-92.7	0	111.9
871	E	27.3	Very low	28.2	Very low	123 Å²	123	158.7 Å²	158.7	58%	0.575	76%	0.761	S	S	*	*			trans	48.4	150	140.8	-80.1	160.6	-129.8	0	0	121.1
872	K	27.1	Very low	28.8	Very low	166 Å²	166	157.1 Å²	157.1	72%	0.722	77%	0.769	S	S	*	*			cis	-161.7	143.4	26.2	-123.4	157	-178	-170.7	0	108.3
873	V	28.7	Very low	29.3	Very low	120 Å²	120	154.7 Å²	154.7	73%	0.727	76%	0.764	S	S	*	*				67.5	130.5	97.7	165	0	0	0	0	113.6
874	D	27.8	Very low	29.9	Very low	105 Å²	105	151.4 Å²	151.4	56%	0.561	76%	0.757	S	S	*	*			cis	-158.2	178.8	14.2	-136.8	-26.4	0	0	0	115
875	K	29.2	Very low	30.8	Very low	153 Å²	153	155.2 Å²	155.2	67%	0.665	76%	0.762	S	S	*	*			trans	17.4	150.7	145.4	-72.2	151.5	-157.4	153.2	0	122
876	R	27.8	Very low	31.6	Very low	195 Å²	195	150.5 Å²	150.5	74%	0.736	75%	0.746	S	S	*	*			cis	-174.9	152.4	-12.3	-118.8	-176.6	178.9	177.8	-1.9	110.9
877	R	28.7	Very low	32.2	Very low	208 Å²	208	149 Å²	149	79%	0.785	74%	0.738	S	S	*	*			trans	66.8	111.1	146.6	-73.6	-178	170.2	-173.7	-5.4	122.6
878	K	31.7	Very low	33	Very low	215 Å²	215	143.5 Å²	143.5	94%	0.935	73%	0.728	S	S	*	*				54.9	125.8	123.2	-81.1	-163.2	169.9	-166.2	0	121.9
879	G	26.4	Very low	33.9	Very low	84 Å²	84	139.8 Å²	139.8	87%	0.866	71%	0.713	S	S	*	*			trans	125.4	129.2	164	0	0	0	0	0	110.3
880	G	29.1	Very low	34.9	Very low	84 Å²	84	137.3 Å²	137.3	87%	0.866	70%	0.702	S	S	*	*			cis	-138.6	-166.2	-9.1	0	0	0	0	0	110.9
881	R	36	Very low	36.1	Very low	255 Å²	255	136.2 Å²	136.2	96%	0.962	70%	0.699	S	S	*	*			trans	-95.7	164.2	174.4	-95.6	-179.5	167.8	174	-6.9	111
882	S	40.8	Very low	37.5	Very low	116 Å²	116	133.2 Å²	133.2	81%	0.811	70%	0.696	S	S	*	*			trans	86.3	80	164	-160.9	0	0	0	0	117.6
883	D	37.5	Very low	39.1	Very low	136 Å²	136	130.9 Å²	130.9	73%	0.727	69%	0.686	S	S	*	*			trans	-169.3	109.4	144	-110.1	-36.2	0	0	0	107.5
884	N	40.1	Very low	40.6	Very low	136 Å²	136	130 Å²	130	73%	0.727	67%	0.672	S	S	*	*			trans	-157.9	-22.2	176.8	-148.8	51.5	0	0	0	115.6
885	D	43.5	Very low	42.2	Very low	143 Å²	143	128.4 Å²	128.4	77%	0.765	66%	0.663	S	S	*	*	H	α-helix	trans	-77.9	-25.3	-178.6	-55.5	-69.4	0	0	0	113.2	D887	D885-D887 PolarHBondContact O-N 3.02Å
886	N	42.1	Very low	43.7	Very low	101 Å²	101	129.5 Å²	129.5	54%	0.54	66%	0.664	S	S	.	*	H	α-helix	trans	-66.9	-26.8	-177.2	-85.1	-54	0	0	0	115	K890	N886-K890 WeakPolarHBondContact O-CG 3.31Å; N886-K890 PolarHBondContact O-N 3.03Å
887	D	42.6	Very low	45.1	Very low	101 Å²	101	128.9 Å²	128.9	54%	0.54	66%	0.661	S	S	.	*	H	α-helix	trans	-90.1	-26.4	-176.1	-75.2	-26.1	0	0	0	113.1	D885 E889 K890 Q891	D885-D887 PolarHBondContact O-N 3.02Å; D887-E889 VanDerWaalsContact C-N 3.34Å; D887-E889 PolarHBondContact O-N 3.23Å; D887-K890 PolarHBondContact O-N 2.81Å; D887-K890 IonicContact OD1-NZ 2.66Å; D887-K890 PolarHBondContact OD1-NZ 3.3Å; D887-Q891 PolarHBondContact O-N 3.35Å
888	A	44.9	Very low	46.4	Very low	72 Å²	72	123.3 Å²	123.3	60%	0.595	64%	0.644	S	S	*	*	H	α-helix	trans	-61.8	-42.9	170.6	0	0	0	0	0	111.4	Q891 A892	A888-Q891 PolarHBondContact O-N 3.31Å; A888-A892 PolarHBondContact O-N 2.88Å
889	E	46.2	Very low	47.5	Very low	102 Å²	102	121.6 Å²	121.6	48%	0.477	63%	0.632	S	S	.	*	H	α-helix	trans	-70.2	-35.8	179.9	-139.4	-127.6	145.7	0	0	112.5	D887 A892 K893	D887-E889 VanDerWaalsContact C-N 3.34Å; D887-E889 PolarHBondContact O-N 3.23Å; E889-A892 PolarHBondContact O-N 3.26Å; E889-K893 WeakPolarHBondContact O-CB 3.46Å; E889-K893 PolarHBondContact O-N 2.81Å; E889-K893 WeakPolarHBondContact OE1-CE 3.36Å; E889-K893 IonicContact OE1-NZ 2.78Å; E889-K893 PolarHBondContact OE1-NZ 3.34Å; E889-K893 IonicContact OE2-NZ 2.76Å; E889-K893 PolarHBondContact OE2-NZ 3.35Å
890	K	49.3	Very low	48.9	Very low	126 Å²	126	122.1 Å²	122.1	55%	0.548	61%	0.611	S	S	.	*	H	α-helix	trans	-63.4	-41.9	171.3	-75	176.4	-156.6	151.1	0	112.1	N886 D887 K893 K894	N886-K890 WeakPolarHBondContact O-CG 3.31Å; N886-K890 PolarHBondContact O-N 3.03Å; D887-K890 PolarHBondContact O-N 2.81Å; D887-K890 IonicContact OD1-NZ 2.66Å; D887-K890 PolarHBondContact OD1-NZ 3.3Å; K890-K893 PolarHBondContact O-N 3.08Å; K890-K894 WeakPolarHBondContact O-CB 3.25Å; K890-K894 PolarHBondContact O-N 2.97Å
891	Q	51.9	Low	50	Low	119 Å²	119	126.7 Å²	126.7	56%	0.556	60%	0.603	S	S	*	*	H	α-helix	trans	-62	-48.5	177.5	-153.9	78.8	-16.3	0	0	110.2	D887 A888 K893 K894 D895	D887-Q891 PolarHBondContact O-N 3.35Å; A888-Q891 PolarHBondContact O-N 3.31Å; Q891-K893 PolarHBondContact O-N 3.07Å; Q891-K894 WeakPolarHBondContact O-CB 3.38Å; Q891-K894 PolarHBondContact O-N 3.09Å; Q891-D895 PolarHBondContact O-N 3.36Å
892	A	56.3	Low	50.9	Low	61 Å²	61	119.3 Å²	119.3	50%	0.504	58%	0.582	S	S	.	*	H	α-helix	trans	-60.5	-41.3	176.4	0	0	0	0	0	113.2	A888 E889 K894 D895 R896	A888-A892 PolarHBondContact O-N 2.88Å; E889-A892 PolarHBondContact O-N 3.26Å; A892-K894 VanDerWaalsContact C-N 3.3Å; A892-K894 PolarHBondContact O-N 3.48Å; A892-D895 PolarHBondContact O-N 3.15Å; A892-R896 WeakPolarHBondContact O-CB 3.45Å; A892-R896 PolarHBondContact O-N 3.2Å
893	K	60	Low	51.4	Low	117 Å²	117	119.2 Å²	119.2	51%	0.509	57%	0.572	S	S	.	*	H	α-helix	trans	-67	-26.7	174.1	-82.1	167.3	169.4	159.2	0	113.1	E889 K890 Q891 R897	E889-K893 WeakPolarHBondContact O-CB 3.46Å; E889-K893 PolarHBondContact O-N 2.81Å; E889-K893 WeakPolarHBondContact OE1-CE 3.36Å; E889-K893 IonicContact OE1-NZ 2.78Å; E889-K893 PolarHBondContact OE1-NZ 3.34Å; E889-K893 IonicContact OE2-NZ 2.76Å; E889-K893 PolarHBondContact OE2-NZ 3.35Å; K890-K893 PolarHBondContact O-N 3.08Å; Q891-K893 PolarHBondContact O-N 3.07Å; K893-R897 WeakPolarHBondContact O-CG 3.27Å; K893-R897 PolarHBondContact O-N 3Å
894	K	60.5	Low	51.7	Low	102 Å²	102	117.4 Å²	117.4	44%	0.443	56%	0.559	S	S	.	*	H	α-helix	trans	-73	-52.3	172.4	-172.8	-175.3	173.6	-75.6	0	111	K890 Q891 A892 R896 R897 E898	K890-K894 WeakPolarHBondContact O-CB 3.25Å; K890-K894 PolarHBondContact O-N 2.97Å; Q891-K894 WeakPolarHBondContact O-CB 3.38Å; Q891-K894 PolarHBondContact O-N 3.09Å; A892-K894 VanDerWaalsContact C-N 3.3Å; A892-K894 PolarHBondContact O-N 3.48Å; K894-R896 VanDerWaalsContact C-N 3.29Å; K894-R896 PolarHBondContact O-N 2.7Å; K894-R897 WeakPolarHBondContact O-CB 3.2Å; K894-R897 PolarHBondContact O-N 3.28Å; K894-E898 IonicContact NZ-OE1 3.79Å; K894-E898 PolarHBondContact NZ-OE1 3.31Å; K894-E898 IonicContact NZ-OE2 3.54Å; K894-E898 PolarHBondContact NZ-OE2 2.99Å; K894-E898 PolarHBondContact O-N 3.13Å
895	D	61.6	Low	51.8	Low	70 Å²	70	116.3 Å²	116.3	37%	0.374	55%	0.55	S	S	.	.	H	α-helix	trans	-63	-36.3	-176.7	-66.5	4.4	0	0	0	111.7	Q891 A892 E898 R899	Q891-D895 PolarHBondContact O-N 3.36Å; A892-D895 PolarHBondContact O-N 3.15Å; D895-E898 PolarHBondContact O-N 2.6Å; D895-R899 WeakPolarHBondContact O-CG 3.45Å; D895-R899 PolarHBondContact O-N 2.92Å
896	R	60.3	Low	51.8	Low	177 Å²	177	119.2 Å²	119.2	67%	0.668	55%	0.55	S	S	*	.	H	α-helix	trans	-62.6	-41.6	172.6	-172.5	173.3	179.5	160.9	5.6	112.2	A892 K894 R899 E900	A892-R896 WeakPolarHBondContact O-CB 3.45Å; A892-R896 PolarHBondContact O-N 3.2Å; K894-R896 VanDerWaalsContact C-N 3.29Å; K894-R896 PolarHBondContact O-N 2.7Å; R896-R899 PolarHBondContact O-N 2.97Å; R896-E900 IonicContact NE-OE1 2.65Å; R896-E900 PolarHBondContact NE-OE1 3.23Å; R896-E900 WeakPolarHBondContact O-CG 3.37Å; R896-E900 PolarHBondContact O-N 3.5Å
897	R	57.8	Low	52.1	Low	181 Å²	181	119.8 Å²	119.8	68%	0.683	56%	0.557	S	S	*	*	H	α-helix	trans	-71.1	-29.5	177	-79.4	177.2	165.1	-178.4	-3.1	113.8	K893 K894 R901	K893-R897 WeakPolarHBondContact O-CG 3.27Å; K893-R897 PolarHBondContact O-N 3Å; K894-R897 WeakPolarHBondContact O-CB 3.2Å; K894-R897 PolarHBondContact O-N 3.28Å; R897-R901 WeakPolarHBondContact O-CG 3.26Å; R897-R901 PolarHBondContact O-N 2.79Å
898	E	55	Low	52.2	Low	92 Å²	92	123.4 Å²	123.4	43%	0.43	56%	0.563	S	S	.	*	H	α-helix	trans	-69.3	-43.6	170.1	-87.1	167.4	170.6	0	0	110.6	K894 D895 E900 R901 D902	K894-E898 IonicContact NZ-OE1 3.79Å; K894-E898 PolarHBondContact NZ-OE1 3.31Å; K894-E898 IonicContact NZ-OE2 3.54Å; K894-E898 PolarHBondContact NZ-OE2 2.99Å; K894-E898 PolarHBondContact O-N 3.13Å; D895-E898 PolarHBondContact O-N 2.6Å; E898-E900 PolarHBondContact O-N 3.13Å; E898-R901 PolarHBondContact O-N 2.96Å; E898-D902 PolarHBondContact O-N 2.86Å
899	R	56	Low	52.2	Low	179 Å²	179	129.2 Å²	129.2	68%	0.675	57%	0.569	S	S	*	*	H	α-helix	trans	-63.1	-38.8	174.4	-68.7	176.4	-172.8	-166.8	3.3	113.7	D895 R896 R901 D902 L903	D895-R899 WeakPolarHBondContact O-CG 3.45Å; D895-R899 PolarHBondContact O-N 2.92Å; R896-R899 PolarHBondContact O-N 2.97Å; R899-R901 VanDerWaalsContact C-N 3.32Å; R899-D902 PolarHBondContact O-N 2.97Å; R899-L903 WeakPolarHBondContact O-CG 3.38Å; R899-L903 PolarHBondContact O-N 2.87Å
900	E	55.6	Low	52.2	Low	94 Å²	94	129.3 Å²	129.3	44%	0.439	57%	0.573	S	S	.	*	H	α-helix	trans	-64.6	-36.2	174.5	-76.2	165.3	-179.4	0	0	111.7	R896 E898 L903 E904	R896-E900 IonicContact NE-OE1 2.65Å; R896-E900 PolarHBondContact NE-OE1 3.23Å; R896-E900 WeakPolarHBondContact O-CG 3.37Å; R896-E900 PolarHBondContact O-N 3.5Å; E898-E900 PolarHBondContact O-N 3.13Å; E900-L903 PolarHBondContact O-N 3.35Å; E900-E904 PolarHBondContact O-N 2.74Å
901	R	52.8	Low	51.7	Low	181 Å²	181	128.9 Å²	128.9	68%	0.683	58%	0.584	S	S	*	*	H	α-helix	trans	-69.9	-41.8	173.4	-76.3	174.5	174.4	-173.8	-2	113.1	R897 E898 R899 L903 E904 E905	R897-R901 WeakPolarHBondContact O-CG 3.26Å; R897-R901 PolarHBondContact O-N 2.79Å; E898-R901 PolarHBondContact O-N 2.96Å; R899-R901 VanDerWaalsContact C-N 3.32Å; R901-L903 PolarHBondContact O-N 3.38Å; R901-E904 PolarHBondContact O-N 3.29Å; R901-E905 WeakPolarHBondContact O-CB 3.5Å; R901-E905 PolarHBondContact O-N 2.8Å
902	D	53.2	Low	51.2	Low	100 Å²	100	133.3 Å²	133.3	54%	0.535	60%	0.595	S	S	.	*	H	α-helix	trans	-61.3	-34.3	174.7	-77	-13.4	0	0	0	111.7	E898 R899 R906	E898-D902 PolarHBondContact O-N 2.86Å; R899-D902 PolarHBondContact O-N 2.97Å; D902-R906 WeakPolarHBondContact O-CB 3.17Å; D902-R906 VanDerWaalsContact O-CG 3.25Å; D902-R906 WeakPolarHBondContact O-CG 3.25Å; D902-R906 PolarHBondContact O-N 3.06Å
903	L	52.1	Low	50.4	Low	113 Å²	113	131.8 Å²	131.8	59%	0.592	59%	0.585	S	S	*	*	H	α-helix	trans	-69.4	-47.5	172.7	-76.7	164.9	0	0	0	111.9	R899 E900 R901 E905 R906 V907	R899-L903 WeakPolarHBondContact O-CG 3.38Å; R899-L903 PolarHBondContact O-N 2.87Å; E900-L903 PolarHBondContact O-N 3.35Å; R901-L903 PolarHBondContact O-N 3.38Å; L903-E905 VanDerWaalsContact C-N 3.35Å; L903-E905 PolarHBondContact O-N 3.31Å; L903-R906 PolarHBondContact O-N 3.45Å; L903-V907 WeakPolarHBondContact O-CG2 3.43Å; L903-V907 PolarHBondContact O-N 3.13Å
904	E	45	Very low	49.5	Very low	99 Å²	99	135 Å²	135	46%	0.463	60%	0.595	S	S	.	*	H	α-helix	trans	-59.5	-42.6	174.2	-76.4	-151.7	140.9	0	0	112.7	E900 R901 V907 R908	E900-E904 PolarHBondContact O-N 2.74Å; R901-E904 PolarHBondContact O-N 3.29Å; E904-V907 PolarHBondContact O-N 3.01Å; E904-R908 VanDerWaalsContact O-CG 3.32Å; E904-R908 WeakPolarHBondContact O-CG 3.41Å; E904-R908 PolarHBondContact O-N 2.89Å; E904-R908 IonicContact OE1-NH2 2.68Å; E904-R908 PolarHBondContact OE1-NH2 3.25Å; E904-R908 VanDerWaalsContact OE1-NH2 3.11Å; E904-R908 IonicContact OE2-CZ 2.63Å; E904-R908 IonicContact OE2-NH1 3.38Å; E904-R908 PolarHBondContact OE2-NH1 3.01Å; E904-R908 IonicContact OE2-NH2 2.94Å; E904-R908 PolarHBondContact OE2-NH2 3.21Å
905	E	42	Very low	48.6	Very low	112 Å²	112	139.9 Å²	139.9	52%	0.523	61%	0.61	S	S	.	*	H	α-helix	trans	-70.4	-34.7	-178.8	-168	171.4	169.2	0	0	111.6	R901 L903 R908 R909	R901-E905 WeakPolarHBondContact O-CB 3.5Å; R901-E905 PolarHBondContact O-N 2.8Å; L903-E905 VanDerWaalsContact C-N 3.35Å; L903-E905 PolarHBondContact O-N 3.31Å; E905-R908 PolarHBondContact O-N 3.42Å; E905-R909 WeakPolarHBondContact O-CB 3.4Å; E905-R909 IonicContact OE1-NH1 3.39Å
906	R	42.9	Very low	47.5	Very low	204 Å²	204	146.2 Å²	146.2	77%	0.77	63%	0.629	S	S	*	*	H	α-helix	trans	-61.6	-47	168.7	-79.6	174	176	-119.6	1.3	112	D902 L903 R908 R909	D902-R906 WeakPolarHBondContact O-CB 3.17Å; D902-R906 VanDerWaalsContact O-CG 3.25Å; D902-R906 WeakPolarHBondContact O-CG 3.25Å; D902-R906 PolarHBondContact O-N 3.06Å; L903-R906 PolarHBondContact O-N 3.45Å; R906-R908 PolarHBondContact O-N 3.07Å; R906-R909 PolarHBondContact O-N 2.76Å; R906-R909 VanDerWaalsContact O-N 3.13Å
907	V	48.2	Very low	46.8	Very low	114 Å²	114	143.5 Å²	143.5	69%	0.691	62%	0.624	S	S	*	*	H	α-helix	trans	-62.2	-31.1	178.9	169.8	0	0	0	0	112	L903 E904 R909	L903-V907 WeakPolarHBondContact O-CG2 3.43Å; L903-V907 PolarHBondContact O-N 3.13Å; E904-V907 PolarHBondContact O-N 3.01Å; V907-R909 VanDerWaalsContact C-N 3.31Å; V907-R909 PolarHBondContact O-N 2.99Å
908	R	44.6	Very low	46.3	Very low	176 Å²	176	139.6 Å²	139.6	66%	0.664	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.7	-2.3	177.8	-71.2	172.4	-175.6	138.1	11.8	114.7	E904 E905 R906	E904-R908 VanDerWaalsContact O-CG 3.32Å; E904-R908 WeakPolarHBondContact O-CG 3.41Å; E904-R908 PolarHBondContact O-N 2.89Å; E904-R908 IonicContact OE1-NH2 2.68Å; E904-R908 PolarHBondContact OE1-NH2 3.25Å; E904-R908 VanDerWaalsContact OE1-NH2 3.11Å; E904-R908 IonicContact OE2-CZ 2.63Å; E904-R908 IonicContact OE2-NH1 3.38Å; E904-R908 PolarHBondContact OE2-NH1 3.01Å; E904-R908 IonicContact OE2-NH2 2.94Å; E904-R908 PolarHBondContact OE2-NH2 3.21Å; E905-R908 PolarHBondContact O-N 3.42Å; R906-R908 PolarHBondContact O-N 3.07Å
909	R	44.7	Very low	45.8	Very low	194 Å²	194	141.8 Å²	141.8	73%	0.732	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.8	8.9	-165.2	-140.8	172.4	-173.3	162.6	3.7	118.2	E905 R906 V907	E905-R909 WeakPolarHBondContact O-CB 3.4Å; E905-R909 IonicContact OE1-NH1 3.39Å; R906-R909 PolarHBondContact O-N 2.76Å; R906-R909 VanDerWaalsContact O-N 3.13Å; V907-R909 VanDerWaalsContact C-N 3.31Å; V907-R909 PolarHBondContact O-N 2.99Å
910	D	45.8	Very low	45.5	Very low	104 Å²	104	135.8 Å²	135.8	56%	0.556	61%	0.606	S	S	*	*			trans	-144.8	101.5	162.6	-164	-10.3	0	0	0	114.8	R912 G913	D910-R912 VanDerWaalsContact C-N 3.32Å; D910-R912 WeakPolarHBondContact OD1-CA 3.45Å; D910-R912 WeakPolarHBondContact OD1-CB 3.22Å; D910-R912 PolarHBondContact OD1-N 3.49Å; D910-G913 PolarHBondContact OD1-N 2.79Å
911	P	39	Very low	45.2	Very low	118 Å²	118	136.2 Å²	136.2	77%	0.766	61%	0.608	S	S	*	*	S	Bend	trans	-88.5	15.8	172.5	36.5	-35	0	0	0	114.1
912	R	41.3	Very low	45.1	Very low	211 Å²	211	133.3 Å²	133.3	80%	0.796	60%	0.602	S	S	*	*	S	Bend	trans	-118.5	-15.5	-178.6	-64.5	-174.7	174	-172.5	-1.2	114.7	D910	D910-R912 VanDerWaalsContact C-N 3.32Å; D910-R912 WeakPolarHBondContact OD1-CA 3.45Å; D910-R912 WeakPolarHBondContact OD1-CB 3.22Å; D910-R912 PolarHBondContact OD1-N 3.49Å
913	G	39.9	Very low	45.1	Very low	29 Å²	29	133 Å²	133	30%	0.299	60%	0.597	S	S	.	*	S	Bend	trans	-63.9	-67.7	172.9	0	0	0	0	0	113	D910 R915 R916	D910-G913 PolarHBondContact OD1-N 2.79Å; G913-R915 VanDerWaalsContact C-N 3.26Å; G913-R915 PolarHBondContact O-N 3.02Å; G913-R916 WeakPolarHBondContact O-CB 3.34Å; G913-R916 PolarHBondContact O-N 2.93Å
914	R	40.3	Very low	45.3	Very low	186 Å²	186	133.8 Å²	133.8	70%	0.702	60%	0.598	S	S	*	*	H	α-helix	trans	-52.3	-37.7	-171.5	-66.4	-173	176.6	-158.8	-4.1	114.9	R916 E917 D918	R914-R916 PolarHBondContact O-N 3.01Å; R914-E917 PolarHBondContact O-N 3.37Å; R914-D918 VanDerWaalsContact O-CG 3.22Å; R914-D918 PolarHBondContact O-N 2.96Å; R914-D918 VanDerWaalsContact O-OD2 3.13Å
915	R	41.8	Very low	45.8	Very low	203 Å²	203	136.7 Å²	136.7	77%	0.766	61%	0.605	S	S	*	*	H	α-helix	trans	-64	-1.1	175.5	-102.3	-173	176.4	-163.7	-1.4	115.8	G913	G913-R915 VanDerWaalsContact C-N 3.26Å; G913-R915 PolarHBondContact O-N 3.02Å
916	R	40.3	Very low	46.6	Very low	204 Å²	204	136.3 Å²	136.3	77%	0.77	60%	0.603	S	S	*	*	H	α-helix	trans	-99.7	-39.8	166.3	-104.5	178.7	166.5	-175.7	-7.1	112.3	G913 R914 R919 S920	G913-R916 WeakPolarHBondContact O-CB 3.34Å; G913-R916 PolarHBondContact O-N 2.93Å; R914-R916 PolarHBondContact O-N 3.01Å; R916-R919 PolarHBondContact O-N 3.33Å; R916-S920 PolarHBondContact O-N 3.27Å; R916-S920 PolarHBondContact O-OG 3.45Å
917	E	44.4	Very low	47.3	Very low	120 Å²	120	133.3 Å²	133.3	56%	0.561	60%	0.598	S	S	*	*	H	α-helix	trans	-70.1	-49.2	179.7	-68.3	160.5	146.2	0	0	110.7	R914 R919 S920 E921	R914-E917 PolarHBondContact O-N 3.37Å; E917-R919 PolarHBondContact O-N 3.39Å; E917-S920 WeakPolarHBondContact CA-OG 3.33Å; E917-S920 PolarHBondContact O-N 3.06Å; E917-S920 PolarHBondContact O-OG 3.42Å; E917-E921 PolarHBondContact O-N 3.02Å
918	D	47.6	Very low	47.8	Very low	98 Å²	98	135 Å²	135	52%	0.524	60%	0.598	S	S	.	*	H	α-helix	trans	-50.9	-33.6	171	-58	-36.8	0	0	0	111.3	R914 E922	R914-D918 VanDerWaalsContact O-CG 3.22Å; R914-D918 PolarHBondContact O-N 2.96Å; R914-D918 VanDerWaalsContact O-OD2 3.13Å; D918-E922 WeakPolarHBondContact O-CG 3.38Å; D918-E922 PolarHBondContact O-N 2.96Å; D918-E922 VanDerWaalsContact O-N 3.09Å
919	R	44.6	Very low	48.6	Very low	139 Å²	139	132.9 Å²	132.9	53%	0.525	60%	0.596	S	S	.	*	H	α-helix	trans	-89.7	-28.4	-172.9	-162.5	169.3	-173.9	-73.6	-18.1	113.4	R916 E917 E923	R916-R919 PolarHBondContact O-N 3.33Å; E917-R919 PolarHBondContact O-N 3.39Å; R919-E923 IonicContact CZ-OE1 3.66Å; R919-E923 IonicContact NH1-OE1 3.68Å; R919-E923 PolarHBondContact NH1-OE1 3.31Å; R919-E923 IonicContact NH1-OE2 2.96Å; R919-E923 IonicContact NH2-OE1 2.81Å; R919-E923 PolarHBondContact NH2-OE1 2.93Å; R919-E923 VanDerWaalsContact O-CB 3.32Å; R919-E923 WeakPolarHBondContact O-CB 3.22Å; R919-E923 VanDerWaalsContact O-CG 3.26Å; R919-E923 WeakPolarHBondContact O-CG 3.45Å; R919-E923 PolarHBondContact O-N 3.46Å
920	S	49.2	Very low	49.2	Very low	53 Å²	53	127.8 Å²	127.8	37%	0.371	58%	0.58	S	S	.	*	H	α-helix	trans	-70.5	-38.6	166.2	41	0	0	0	0	111	R916 E917 E923 E924	R916-S920 PolarHBondContact O-N 3.27Å; R916-S920 PolarHBondContact O-OG 3.45Å; E917-S920 WeakPolarHBondContact CA-OG 3.33Å; E917-S920 PolarHBondContact O-N 3.06Å; E917-S920 PolarHBondContact O-OG 3.42Å; S920-E923 PolarHBondContact O-N 2.94Å; S920-E924 WeakPolarHBondContact O-CB 3.43Å; S920-E924 WeakPolarHBondContact O-CG 3.28Å; S920-E924 PolarHBondContact O-N 3.45Å
921	E	49.2	Very low	49.7	Very low	103 Å²	103	127.3 Å²	127.3	48%	0.481	58%	0.575	S	S	.	*	H	α-helix	trans	-66.4	-37.1	173.9	-71.3	-170.6	-147.3	0	0	112.5	E917 R925	E917-E921 PolarHBondContact O-N 3.02Å; E921-R925 WeakPolarHBondContact O-CB 3.29Å; E921-R925 WeakPolarHBondContact O-CD 3.41Å; E921-R925 WeakPolarHBondContact O-CG 3.38Å; E921-R925 PolarHBondContact O-N 3.5Å; E921-R925 VanDerWaalsContact O-N 3.09Å; E921-R925 IonicContact OE2-NH2 2.77Å
922	E	51.4	Low	50.8	Low	119 Å²	119	123.4 Å²	123.4	56%	0.556	56%	0.555	S	S	*	*	H	α-helix	trans	-66.2	-36.9	170.2	-82.3	-171.5	151	0	0	113	D918 Q926	D918-E922 WeakPolarHBondContact O-CG 3.38Å; D918-E922 PolarHBondContact O-N 2.96Å; D918-E922 VanDerWaalsContact O-N 3.09Å; E922-Q926 WeakPolarHBondContact O-CB 3.36Å; E922-Q926 VanDerWaalsContact O-CG 3.27Å; E922-Q926 WeakPolarHBondContact O-CG 3.5Å; E922-Q926 PolarHBondContact O-N 2.95Å; E922-Q926 PolarHBondContact O-NE2 2.95Å
923	E	53.4	Low	51.7	Low	93 Å²	93	119.3 Å²	119.3	44%	0.435	55%	0.545	S	S	.	.	H	α-helix	trans	-73.7	-41.7	179.3	-76.5	172.9	177.5	0	0	111.2	R919 S920 Q926 E927	R919-E923 IonicContact CZ-OE1 3.66Å; R919-E923 IonicContact NH1-OE1 3.68Å; R919-E923 PolarHBondContact NH1-OE1 3.31Å; R919-E923 IonicContact NH1-OE2 2.96Å; R919-E923 IonicContact NH2-OE1 2.81Å; R919-E923 PolarHBondContact NH2-OE1 2.93Å; R919-E923 VanDerWaalsContact O-CB 3.32Å; R919-E923 WeakPolarHBondContact O-CB 3.22Å; R919-E923 VanDerWaalsContact O-CG 3.26Å; R919-E923 WeakPolarHBondContact O-CG 3.45Å; R919-E923 PolarHBondContact O-N 3.46Å; S920-E923 PolarHBondContact O-N 2.94Å; E923-Q926 PolarHBondContact O-N 3.09Å; E923-E927 PolarHBondContact O-N 3.4Å
924	E	55.2	Low	52.3	Low	130 Å²	130	125.2 Å²	125.2	61%	0.607	56%	0.559	S	S	*	*	H	α-helix	trans	-64	-45.6	174.5	-74.7	179.9	162.8	0	0	112.2	S920 Q926 E927 E928	S920-E924 WeakPolarHBondContact O-CB 3.43Å; S920-E924 WeakPolarHBondContact O-CG 3.28Å; S920-E924 PolarHBondContact O-N 3.45Å; E924-Q926 VanDerWaalsContact C-N 3.26Å; E924-Q926 PolarHBondContact O-N 3.28Å; E924-E927 PolarHBondContact O-N 3.37Å; E924-E928 PolarHBondContact O-N 3.03Å
925	R	55.7	Low	53	Low	160 Å²	160	123.6 Å²	123.6	60%	0.604	55%	0.553	S	S	*	*	H	α-helix	trans	-60.8	-35.2	174.5	-70.5	169.1	-168.1	-112.8	5.7	112.2	E921 E928 E929	E921-R925 WeakPolarHBondContact O-CB 3.29Å; E921-R925 WeakPolarHBondContact O-CD 3.41Å; E921-R925 WeakPolarHBondContact O-CG 3.38Å; E921-R925 PolarHBondContact O-N 3.5Å; E921-R925 VanDerWaalsContact O-N 3.09Å; E921-R925 IonicContact OE2-NH2 2.77Å; R925-E928 PolarHBondContact O-N 3.38Å; R925-E929 PolarHBondContact O-N 3.28Å
926	Q	59.3	Low	53.8	Low	104 Å²	104	121.1 Å²	121.1	49%	0.486	55%	0.548	S	S	.	.	H	α-helix	trans	-73.9	-24.9	174.5	-79.1	170.9	69.6	0	0	113.4	E922 E923 E924 Q930	E922-Q926 WeakPolarHBondContact O-CB 3.36Å; E922-Q926 VanDerWaalsContact O-CG 3.27Å; E922-Q926 WeakPolarHBondContact O-CG 3.5Å; E922-Q926 PolarHBondContact O-N 2.95Å; E922-Q926 PolarHBondContact O-NE2 2.95Å; E923-Q926 PolarHBondContact O-N 3.09Å; E924-Q926 VanDerWaalsContact C-N 3.26Å; E924-Q926 PolarHBondContact O-N 3.28Å; Q926-Q930 WeakPolarHBondContact O-CB 3.39Å; Q926-Q930 VanDerWaalsContact O-CG 3.23Å; Q926-Q930 WeakPolarHBondContact O-CG 3.4Å; Q926-Q930 PolarHBondContact O-N 3.05Å; Q926-Q930 PolarHBondContact O-NE2 3.34Å
927	E	57.2	Low	54.4	Low	141 Å²	141	113.5 Å²	113.5	66%	0.659	53%	0.528	S	S	*	.	H	α-helix	trans	-76.4	-40.1	169.2	-69.3	-156.6	145.2	0	0	111.5	E923 E924 Q930 E931	E923-E927 PolarHBondContact O-N 3.4Å; E924-E927 PolarHBondContact O-N 3.37Å; E927-Q930 CarbonylContact O-C 3.56Å; E927-Q930 PolarHBondContact O-N 2.7Å; E927-E931 PolarHBondContact O-N 2.93Å
928	E	59	Low	54.8	Low	150 Å²	150	111.8 Å²	111.8	70%	0.701	52%	0.522	S	S	*	.	H	α-helix	trans	-62.3	-44.8	172.4	-71.9	-161.8	135.9	0	0	112.6	E924 R925 Q930 E931 G932	E924-E928 PolarHBondContact O-N 3.03Å; R925-E928 PolarHBondContact O-N 3.38Å; E928-Q930 VanDerWaalsContact C-N 3.31Å; E928-Q930 PolarHBondContact O-N 3.08Å; E928-E931 PolarHBondContact O-N 3.32Å; E928-G932 PolarHBondContact O-N 3.3Å
929	E	60.7	Low	54.8	Low	131 Å²	131	116.8 Å²	116.8	61%	0.612	53%	0.534	S	S	*	.	H	α-helix	trans	-62.8	-37.9	174.1	-78.1	-162.1	153.6	0	0	111.9	R925 G932 Q933	R925-E929 PolarHBondContact O-N 3.28Å; E929-G932 PolarHBondContact O-N 2.84Å; E929-Q933 WeakPolarHBondContact O-CB 3.29Å; E929-Q933 VanDerWaalsContact O-CG 3.27Å; E929-Q933 WeakPolarHBondContact O-CG 3.35Å; E929-Q933 PolarHBondContact O-N 2.75Å
930	Q	57.7	Low	54.9	Low	88 Å²	88	117.3 Å²	117.3	41%	0.411	54%	0.543	S	S	.	.	H	α-helix	trans	-69.5	-36.6	174.8	-81.6	177.6	79.1	0	0	112.8	Q926 E927 E928 Q933 R934	Q926-Q930 WeakPolarHBondContact O-CB 3.39Å; Q926-Q930 VanDerWaalsContact O-CG 3.23Å; Q926-Q930 WeakPolarHBondContact O-CG 3.4Å; Q926-Q930 PolarHBondContact O-N 3.05Å; Q926-Q930 PolarHBondContact O-NE2 3.34Å; E927-Q930 CarbonylContact O-C 3.56Å; E927-Q930 PolarHBondContact O-N 2.7Å; E928-Q930 VanDerWaalsContact C-N 3.31Å; E928-Q930 PolarHBondContact O-N 3.08Å; Q930-Q933 PolarHBondContact O-N 3.2Å; Q930-R934 WeakPolarHBondContact O-CB 3.13Å; Q930-R934 WeakPolarHBondContact O-CG 3.22Å; Q930-R934 PolarHBondContact O-N 3.07Å
931	E	57.3	Low	54.5	Low	94 Å²	94	123.3 Å²	123.3	44%	0.439	56%	0.557	S	S	.	*	H	α-helix	trans	-64.1	-44.7	170.4	-102.8	-122.6	82	0	0	110.9	E927 E928 Q933 R934 R935	E927-E931 PolarHBondContact O-N 2.93Å; E928-E931 PolarHBondContact O-N 3.32Å; E931-Q933 VanDerWaalsContact C-N 3.32Å; E931-Q933 PolarHBondContact O-N 3.01Å; E931-R934 PolarHBondContact O-N 3.35Å; E931-R935 WeakPolarHBondContact O-CB 3.3Å; E931-R935 VanDerWaalsContact O-CG 3.23Å; E931-R935 WeakPolarHBondContact O-CG 3.35Å; E931-R935 PolarHBondContact O-N 3.37Å; E931-R935 IonicContact OE1-CZ 2.8Å; E931-R935 VanDerWaalsContact OE1-CZ 3.24Å; E931-R935 IonicContact OE1-NE 2.71Å; E931-R935 PolarHBondContact OE1-NE 3Å; E931-R935 IonicContact OE1-NH2 2.76Å; E931-R935 PolarHBondContact OE1-NH2 3.32Å; E931-R935 IonicContact OE2-CZ 3.04Å; E931-R935 IonicContact OE2-NE 2.98Å; E931-R935 IonicContact OE2-NH2 3.04Å; E931-R935 PolarHBondContact OE2-NH2 3.05Å
932	G	61.4	Low	54.2	Low	35 Å²	35	124.4 Å²	124.4	36%	0.361	57%	0.566	S	S	.	*	H	α-helix	trans	-59	-41.2	174.3	0	0	0	0	0	112.8	E928 E929 K936	E928-G932 PolarHBondContact O-N 3.3Å; E929-G932 PolarHBondContact O-N 2.84Å; G932-K936 WeakPolarHBondContact O-CG 3.42Å; G932-K936 PolarHBondContact O-N 3.45Å
933	Q	59.8	Low	53.8	Low	125 Å²	125	125.4 Å²	125.4	58%	0.584	58%	0.575	S	S	*	*	H	α-helix	trans	-69.6	-39	174.5	-72.7	177.7	38.3	0	0	112.5	E929 Q930 E931 K936 A937	E929-Q933 WeakPolarHBondContact O-CB 3.29Å; E929-Q933 VanDerWaalsContact O-CG 3.27Å; E929-Q933 WeakPolarHBondContact O-CG 3.35Å; E929-Q933 PolarHBondContact O-N 2.75Å; Q930-Q933 PolarHBondContact O-N 3.2Å; E931-Q933 VanDerWaalsContact C-N 3.32Å; E931-Q933 PolarHBondContact O-N 3.01Å; Q933-K936 PolarHBondContact O-N 2.91Å; Q933-A937 WeakPolarHBondContact O-CB 3.44Å; Q933-A937 PolarHBondContact O-N 2.99Å
934	R	53.9	Low	53.1	Low	153 Å²	153	123.5 Å²	123.5	58%	0.577	58%	0.581	S	S	*	*	H	α-helix	trans	-65	-45.8	173.9	-73.4	170.5	-164.8	-168.5	10.8	111.6	Q930 E931 K936 A937 D938	Q930-R934 WeakPolarHBondContact O-CB 3.13Å; Q930-R934 WeakPolarHBondContact O-CG 3.22Å; Q930-R934 PolarHBondContact O-N 3.07Å; E931-R934 PolarHBondContact O-N 3.35Å; R934-K936 VanDerWaalsContact C-N 3.27Å; R934-K936 PolarHBondContact O-N 3.04Å; R934-A937 CarbonylContact O-C 3.55Å; R934-A937 PolarHBondContact O-N 2.87Å; R934-D938 PolarHBondContact O-N 2.75Å
935	R	54.5	Low	52.2	Low	152 Å²	152	121.3 Å²	121.3	57%	0.574	58%	0.579	S	S	*	*	H	α-helix	trans	-62.4	-31.4	175.4	-67.8	171.8	-172.6	-164.2	6.6	112.2	E931 R939	E931-R935 WeakPolarHBondContact O-CB 3.3Å; E931-R935 VanDerWaalsContact O-CG 3.23Å; E931-R935 WeakPolarHBondContact O-CG 3.35Å; E931-R935 PolarHBondContact O-N 3.37Å; E931-R935 IonicContact OE1-CZ 2.8Å; E931-R935 VanDerWaalsContact OE1-CZ 3.24Å; E931-R935 IonicContact OE1-NE 2.71Å; E931-R935 PolarHBondContact OE1-NE 3Å; E931-R935 IonicContact OE1-NH2 2.76Å; E931-R935 PolarHBondContact OE1-NH2 3.32Å; E931-R935 IonicContact OE2-CZ 3.04Å; E931-R935 IonicContact OE2-NE 2.98Å; E931-R935 IonicContact OE2-NH2 3.04Å; E931-R935 PolarHBondContact OE2-NH2 3.05Å; R935-R939 VanDerWaalsContact O-CG 3.31Å; R935-R939 WeakPolarHBondContact O-CG 3.26Å; R935-R939 PolarHBondContact O-N 3.46Å
936	K	58.7	Low	51.5	Low	152 Å²	152	122.3 Å²	122.3	66%	0.661	59%	0.591	S	S	*	*	H	α-helix	trans	-71.7	-42.2	167.9	-79.3	-179.3	176.4	177.6	0	112.6	G932 Q933 R934 R939 Q940	G932-K936 WeakPolarHBondContact O-CG 3.42Å; G932-K936 PolarHBondContact O-N 3.45Å; Q933-K936 PolarHBondContact O-N 2.91Å; R934-K936 VanDerWaalsContact C-N 3.27Å; R934-K936 PolarHBondContact O-N 3.04Å; K936-R939 PolarHBondContact O-N 3.35Å; K936-Q940 WeakPolarHBondContact O-CG 3.46Å; K936-Q940 PolarHBondContact O-N 2.91Å
937	A	53	Low	50.6	Low	43 Å²	43	128.5 Å²	128.5	36%	0.355	61%	0.61	S	S	.	*	H	α-helix	trans	-66.9	-37.1	-179.9	0	0	0	0	0	113.2	Q933 R934 Q940 R941	Q933-A937 WeakPolarHBondContact O-CB 3.44Å; Q933-A937 PolarHBondContact O-N 2.99Å; R934-A937 CarbonylContact O-C 3.55Å; R934-A937 PolarHBondContact O-N 2.87Å; A937-Q940 CarbonylContact O-C 3.49Å; A937-Q940 PolarHBondContact O-N 3.46Å; A937-R941 WeakPolarHBondContact O-CG 3.3Å; A937-R941 PolarHBondContact O-N 3.45Å; A937-R941 VanDerWaalsContact O-N 3.08Å
938	D	51.5	Low	49.5	Very low	84 Å²	84	128.8 Å²	128.8	45%	0.449	62%	0.616	S	S	.	*	H	α-helix	trans	-74.6	-36	176.1	-71.2	-35.4	0	0	0	111.6	R934 Q940 R941 D942	R934-D938 PolarHBondContact O-N 2.75Å; D938-Q940 PolarHBondContact O-N 2.77Å; D938-R941 WeakPolarHBondContact O-CA 3.47Å; D938-R941 WeakPolarHBondContact O-CB 3.44Å; D938-R941 PolarHBondContact O-N 3.46Å; D938-R941 WeakPolarHBondContact OD1-CD 3.47Å; D938-R941 IonicContact OD1-NH1 3.64Å; D938-R941 PolarHBondContact OD1-NH1 2.85Å; D938-D942 PolarHBondContact O-N 3.47Å; D938-D942 VanDerWaalsContact O-N 3.16Å
939	R	47.8	Very low	48.3	Very low	204 Å²	204	133.6 Å²	133.6	77%	0.77	63%	0.628	S	S	*	*	H	α-helix	trans	-59.2	-33.4	167.1	-76.8	178.4	178.6	-173.6	0.2	112.9	R935 K936 R941	R935-R939 VanDerWaalsContact O-CG 3.31Å; R935-R939 WeakPolarHBondContact O-CG 3.26Å; R935-R939 PolarHBondContact O-N 3.46Å; K936-R939 PolarHBondContact O-N 3.35Å; R939-R941 VanDerWaalsContact C-N 3.33Å
940	Q	47.3	Very low	47.1	Very low	150 Å²	150	130.6 Å²	130.6	70%	0.701	63%	0.632	S	S	*	*	H	α-helix	trans	-79.3	-10.5	172.8	-73.4	-179.6	-20.7	0	0	114	K936 A937 D938 G944	K936-Q940 WeakPolarHBondContact O-CG 3.46Å; K936-Q940 PolarHBondContact O-N 2.91Å; A937-Q940 CarbonylContact O-C 3.49Å; A937-Q940 PolarHBondContact O-N 3.46Å; D938-Q940 PolarHBondContact O-N 2.77Å; Q940-G944 PolarHBondContact O-N 2.72Å
941	R	41.5	Very low	45.9	Very low	179 Å²	179	137.5 Å²	137.5	68%	0.675	65%	0.654	S	S	*	*	H	α-helix	trans	-89.2	-34.6	175.2	-81	169.7	159.3	-173.1	-5.8	113.2	A937 D938 R939 G944 S945	A937-R941 WeakPolarHBondContact O-CG 3.3Å; A937-R941 PolarHBondContact O-N 3.45Å; A937-R941 VanDerWaalsContact O-N 3.08Å; D938-R941 WeakPolarHBondContact O-CA 3.47Å; D938-R941 WeakPolarHBondContact O-CB 3.44Å; D938-R941 PolarHBondContact O-N 3.46Å; D938-R941 WeakPolarHBondContact OD1-CD 3.47Å; D938-R941 IonicContact OD1-NH1 3.64Å; D938-R941 PolarHBondContact OD1-NH1 2.85Å; R939-R941 VanDerWaalsContact C-N 3.33Å; R941-G944 PolarHBondContact O-N 2.85Å; R941-S945 PolarHBondContact O-N 2.94Å
942	D	42.6	Very low	44.7	Very low	126 Å²	126	142.4 Å²	142.4	67%	0.674	68%	0.677	S	S	*	*	H	α-helix	trans	-64.7	-46.9	172.1	-77.7	-28.7	0	0	0	110.9	D938 G944 S945	D938-D942 PolarHBondContact O-N 3.47Å; D938-D942 VanDerWaalsContact O-N 3.16Å; D942-G944 PolarHBondContact O-N 2.87Å; D942-S945 VanDerWaalsContact O-CB 3.28Å; D942-S945 WeakPolarHBondContact O-CB 3.03Å; D942-S945 PolarHBondContact O-N 3.35Å; D942-S945 PolarHBondContact O-OG 3.23Å
943	D	43.3	Very low	43.3	Very low	140 Å²	140	144.2 Å²	144.2	75%	0.749	70%	0.696	S	S	*	*	H	α-helix	trans	-62.6	-28.4	174.6	-170.6	50.7	0	0	0	112.8	S945	D943-S945 VanDerWaalsContact C-N 3.26Å; D943-S945 PolarHBondContact O-N 3.14Å
944	G	37.9	Very low	41.9	Very low	53 Å²	53	144.2 Å²	144.2	55%	0.546	70%	0.7	S	S	.	*	G	3₁₀ helix	trans	-72.8	-10.4	173.1	0	0	0	0	0	115.1	Q940 R941 D942	Q940-G944 PolarHBondContact O-N 2.72Å; R941-G944 PolarHBondContact O-N 2.85Å; D942-G944 PolarHBondContact O-N 2.87Å
945	S	35.7	Very low	40.8	Very low	83 Å²	83	147.5 Å²	147.5	58%	0.58	71%	0.712	S	S	*	*	G	3₁₀ helix	trans	-84.2	-19.5	-168.6	74.4	0	0	0	0	115.2	R941 D942 D943	R941-S945 PolarHBondContact O-N 2.94Å; D942-S945 VanDerWaalsContact O-CB 3.28Å; D942-S945 WeakPolarHBondContact O-CB 3.03Å; D942-S945 PolarHBondContact O-N 3.35Å; D942-S945 PolarHBondContact O-OG 3.23Å; D943-S945 VanDerWaalsContact C-N 3.26Å; D943-S945 PolarHBondContact O-N 3.14Å
946	E	40.7	Very low	39.7	Very low	181 Å²	181	143.8 Å²	143.8	85%	0.846	72%	0.721	S	S	*	*	G	3₁₀ helix	trans	-87.6	-6.9	-174.1	-67.4	-151.1	131.6	0	0	115.4
947	R	41.3	Very low	38.5	Very low	235 Å²	235	147.7 Å²	147.7	89%	0.887	73%	0.732	S	S	*	*	S	Bend	trans	-111.2	-2.4	-163.6	-76.5	-169.3	175.1	-175.5	2.2	119.1
948	D	33.2	Very low	37.5	Very low	146 Å²	146	151.8 Å²	151.8	78%	0.781	75%	0.748	S	S	*	*			trans	-141.6	71.3	175	-158.6	6.6	0	0	0	115.7
949	R	34.9	Very low	37	Very low	252 Å²	252	159 Å²	159	95%	0.951	77%	0.769	S	S	*	*			trans	-134.7	58.5	155	-71.8	-164.1	176.5	114.3	3.5	110.4
950	G	35.2	Very low	36.6	Very low	68 Å²	68	157.3 Å²	157.3	70%	0.701	78%	0.775	S	S	*	*			trans	-112.5	5	-166.9	0	0	0	0	0	117.6
951	R	33	Very low	36	Very low	233 Å²	233	153.7 Å²	153.7	88%	0.879	78%	0.777	S	S	*	*			trans	-151.5	143	179.6	-112.7	176	-175.9	-172	0	114.6
952	E	30.7	Very low	36.2	Very low	197 Å²	197	148.4 Å²	148.4	92%	0.921	78%	0.779	S	S	*	*			trans	62.7	133.6	177.7	-55.5	-174.1	-175	0	0	115.8
953	G	32.7	Very low	36.5	Very low	73 Å²	73	152.7 Å²	152.7	75%	0.753	79%	0.786	S	S	*	*			cis	165.1	122.8	-10.3	0	0	0	0	0	114.4
954	D	31.4	Very low	36.6	Very low	125 Å²	125	149.1 Å²	149.1	67%	0.668	78%	0.782	S	S	*	*			trans	84.4	148.7	159.4	-151.9	6.7	0	0	0	120.2
955	R	30.8	Very low	37.1	Very low	221 Å²	221	156.4 Å²	156.4	83%	0.834	79%	0.793	S	S	*	*			trans	46.6	99.2	169.4	-72.6	157.7	-123.1	-172.9	4.6	118.3
956	G	31.2	Very low	37.7	Very low	74 Å²	74	158.7 Å²	158.7	76%	0.763	80%	0.795	S	S	*	*			cis	123.4	129.5	27.8	0	0	0	0	0	111.9
957	R	32.2	Very low	38.2	Very low	235 Å²	235	159.7 Å²	159.7	89%	0.887	79%	0.791	S	S	*	*			trans	69.2	146.8	171.8	-73.8	-173.7	178.8	171.9	0.9	117.7
958	D	33.5	Very low	38.7	Very low	128 Å²	128	154.3 Å²	154.3	68%	0.684	78%	0.776	S	S	*	*			cis	-149.8	158.8	7.6	-114.7	-30.7	0	0	0	112.7
959	R	39.7	Very low	39.9	Very low	236 Å²	236	155.7 Å²	155.7	89%	0.891	77%	0.771	S	S	*	*			trans	75.9	147.7	166.7	-67.6	-179.9	177.2	-178.9	-2.3	121.2
960	D	40	Very low	41.2	Very low	169 Å²	169	149.7 Å²	149.7	90%	0.904	75%	0.754	S	S	*	*			trans	62.3	143.6	174.5	-96.1	-57.9	0	0	0	120.7
961	G	34.3	Very low	42.4	Very low	73 Å²	73	151.5 Å²	151.5	75%	0.753	74%	0.744	S	S	*	*			trans	154.7	10.4	-171.6	0	0	0	0	0	116.9	R963	G961-R963 PolarHBondContact O-N 3.16Å
962	G	46	Very low	44	Very low	69 Å²	69	147 Å²	147	71%	0.711	73%	0.731	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.4	90.7	177.8	0	0	0	0	0	113
963	R	48.4	Very low	45.5	Very low	215 Å²	215	145.3 Å²	145.3	81%	0.811	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-175.8	-14.9	161	-106.2	155.7	-167.1	-162.8	2	115.5	G961 R965	G961-R963 PolarHBondContact O-N 3.16Å; R963-R965 VanDerWaalsContact C-N 3.34Å; R963-R965 PolarHBondContact O-N 2.95Å
964	G	46.4	Very low	47.1	Very low	66 Å²	66	147.6 Å²	147.6	68%	0.68	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.5	-16.2	-178.4	0	0	0	0	0	116
965	R	47.2	Very low	48.9	Very low	206 Å²	206	148.3 Å²	148.3	78%	0.777	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.9	-12.3	-171.1	-87.5	-175.3	171.5	173.8	-1.7	116.1	R963 Y969	R963-R965 VanDerWaalsContact C-N 3.34Å; R963-R965 PolarHBondContact O-N 2.95Å; R965-Y969 WeakPolarHBondContact O-CD2 3.49Å
966	E	49.8	Very low	50.7	Low	130 Å²	130	144.4 Å²	144.4	61%	0.607	70%	0.696	S	S	*	*	S	Bend	trans	-79.2	-45.3	-175.6	-70.6	167.9	131.9	0	0	111.3	E968 Y969 E970	E966-E968 VanDerWaalsContact C-N 3.33Å; E966-E968 PolarHBondContact O-N 3.22Å; E966-Y969 WeakPolarHBondContact O-CA 3.26Å; E966-Y969 WeakPolarHBondContact O-CB 3.37Å; E966-Y969 PolarHBondContact O-N 2.95Å; E966-E970 PolarHBondContact O-N 3.01Å
967	R	49.4	Very low	52.5	Low	203 Å²	203	147.4 Å²	147.4	77%	0.766	68%	0.684	S	S	*	*	H	α-helix	trans	-57.1	-40.4	178.2	-70.3	-177.8	172.2	-179.6	-4.6	113.8	Y969 E970 E971	R967-Y969 PolarHBondContact O-N 3.2Å; R967-E970 PolarHBondContact O-N 2.83Å; R967-E971 PolarHBondContact O-N 3.04Å
968	E	52.7	Low	54.3	Low	121 Å²	121	139.9 Å²	139.9	57%	0.565	66%	0.661	S	S	*	*	H	α-helix	trans	-69.7	-19	179.1	-159.2	-175.3	-163.1	0	0	113	E966	E966-E968 VanDerWaalsContact C-N 3.33Å; E966-E968 PolarHBondContact O-N 3.22Å
969	Y	58.1	Low	56.5	Low	175 Å²	175	135 Å²	135	69%	0.686	64%	0.642	S	S	*	*	H	α-helix	trans	-89.4	-35.3	170.7	-92.4	-97.8	0	0	0	112.4	R965 E966 R967 R973	R965-Y969 WeakPolarHBondContact O-CD2 3.49Å; E966-Y969 WeakPolarHBondContact O-CA 3.26Å; E966-Y969 WeakPolarHBondContact O-CB 3.37Å; E966-Y969 PolarHBondContact O-N 2.95Å; R967-Y969 PolarHBondContact O-N 3.2Å; Y969-R973 WeakPolarHBondContact O-CB 3.44Å; Y969-R973 PolarHBondContact O-N 3.05Å
970	E	62.3	Low	58	Low	126 Å²	126	129.6 Å²	129.6	59%	0.589	63%	0.626	S	S	*	*	H	α-helix	trans	-66.7	-46.6	176.4	-70	-175.4	127.3	0	0	112	E966 R967 K972 R973 E974	E966-E970 PolarHBondContact O-N 3.01Å; R967-E970 PolarHBondContact O-N 2.83Å; E970-K972 VanDerWaalsContact C-N 3.26Å; E970-K972 PolarHBondContact O-N 3.04Å; E970-R973 WeakPolarHBondContact O-CA 3.28Å; E970-R973 WeakPolarHBondContact O-CB 3.22Å; E970-R973 PolarHBondContact O-N 3.46Å; E970-E974 PolarHBondContact O-N 2.89Å
971	E	60.8	Low	59.5	Low	107 Å²	107	128.7 Å²	128.7	50%	0.5	61%	0.61	S	S	.	*	H	α-helix	trans	-55.6	-38.9	176.4	-94.3	-155.6	84.1	0	0	113.2	R967 K975	R967-E971 PolarHBondContact O-N 3.04Å; E971-K975 WeakPolarHBondContact O-CB 3.47Å; E971-K975 WeakPolarHBondContact O-CD 3.44Å; E971-K975 WeakPolarHBondContact O-CG 3.49Å; E971-K975 PolarHBondContact O-N 2.68Å; E971-K975 VanDerWaalsContact O-N 3.16Å; E971-K975 IonicContact OE1-NZ 2.92Å; E971-K975 PolarHBondContact OE1-NZ 3.16Å
972	K	65.9	Low	61.3	Low	137 Å²	137	129.6 Å²	129.6	60%	0.596	60%	0.598	S	S	*	*	H	α-helix	trans	-67.1	-39.3	175.7	-82	177.8	175.8	165.2	0	111.6	E970 K975 E976	E970-K972 VanDerWaalsContact C-N 3.26Å; E970-K972 PolarHBondContact O-N 3.04Å; K972-K975 PolarHBondContact O-N 3.4Å; K972-E976 WeakPolarHBondContact O-CG 3.32Å; K972-E976 PolarHBondContact O-N 2.92Å
973	R	63.8	Low	62.6	Low	163 Å²	163	135 Å²	135	62%	0.615	60%	0.597	S	S	*	*	H	α-helix	trans	-72.4	-28.5	-178	-156.2	177.4	-168.8	-164.1	3.6	112.9	Y969 E970 R977	Y969-R973 WeakPolarHBondContact O-CB 3.44Å; Y969-R973 PolarHBondContact O-N 3.05Å; E970-R973 WeakPolarHBondContact O-CA 3.28Å; E970-R973 WeakPolarHBondContact O-CB 3.22Å; E970-R973 PolarHBondContact O-N 3.46Å; R973-R977 WeakPolarHBondContact O-CD 3.44Å; R973-R977 VanDerWaalsContact O-CG 3.26Å; R973-R977 WeakPolarHBondContact O-CG 3.35Å; R973-R977 PolarHBondContact O-N 2.97Å
974	E	65.6	Low	63.8	Low	121 Å²	121	131.3 Å²	131.3	57%	0.565	59%	0.589	S	S	*	*	H	α-helix	trans	-72.2	-45.8	169.3	-66.2	-166.6	132.8	0	0	111.3	E970 E976 R977 D978	E970-E974 PolarHBondContact O-N 2.89Å; E974-E976 VanDerWaalsContact C-N 3.26Å; E974-E976 PolarHBondContact O-N 3.01Å; E974-R977 WeakPolarHBondContact O-CB 3.37Å; E974-R977 PolarHBondContact O-N 3.4Å; E974-D978 PolarHBondContact O-N 3.32Å
975	K	68.8	Low	65	Low	139 Å²	139	136.6 Å²	136.6	60%	0.604	59%	0.588	S	S	*	*	H	α-helix	trans	-60.8	-32.1	176.1	-73.5	162.9	-178.3	159.9	0	113.2	E971 K972 G979	E971-K975 WeakPolarHBondContact O-CB 3.47Å; E971-K975 WeakPolarHBondContact O-CD 3.44Å; E971-K975 WeakPolarHBondContact O-CG 3.49Å; E971-K975 PolarHBondContact O-N 2.68Å; E971-K975 VanDerWaalsContact O-N 3.16Å; E971-K975 IonicContact OE1-NZ 2.92Å; E971-K975 PolarHBondContact OE1-NZ 3.16Å; K972-K975 PolarHBondContact O-N 3.4Å; K975-G979 PolarHBondContact O-N 3.3Å
976	E	68.7	Low	66.3	Low	139 Å²	139	132.1 Å²	132.1	65%	0.65	58%	0.58	S	S	*	*	H	α-helix	trans	-70.7	-40.5	170.2	-74.8	-179.7	156	0	0	112.8	K972 E974 G979 E980	K972-E976 WeakPolarHBondContact O-CG 3.32Å; K972-E976 PolarHBondContact O-N 2.92Å; E974-E976 VanDerWaalsContact C-N 3.26Å; E974-E976 PolarHBondContact O-N 3.01Å; E976-G979 CarbonylContact O-C 3.59Å; E976-G979 PolarHBondContact O-N 2.97Å; E976-E980 PolarHBondContact O-N 2.95Å; E976-E980 VanDerWaalsContact O-N 3.09Å
977	R	69.8	Low	67.6	Low	138 Å²	138	132.5 Å²	132.5	52%	0.521	58%	0.579	S	S	.	*	H	α-helix	trans	-66.3	-41.8	179.5	-80.6	169.8	164.6	-174.3	-6.2	113.6	R973 E974 G979 E980 R981	R973-R977 WeakPolarHBondContact O-CD 3.44Å; R973-R977 VanDerWaalsContact O-CG 3.26Å; R973-R977 WeakPolarHBondContact O-CG 3.35Å; R973-R977 PolarHBondContact O-N 2.97Å; E974-R977 WeakPolarHBondContact O-CB 3.37Å; E974-R977 PolarHBondContact O-N 3.4Å; R977-G979 VanDerWaalsContact C-N 3.29Å; R977-E980 PolarHBondContact O-N 3.4Å; R977-E980 VanDerWaalsContact O-N 3.13Å; R977-R981 WeakPolarHBondContact O-CG 3.5Å; R977-R981 PolarHBondContact O-N 3.39Å
978	D	69.9	Low	68.9	Low	76 Å²	76	128 Å²	128	41%	0.406	57%	0.567	S	S	.	*	H	α-helix	trans	-68.2	-34.7	175.4	-70	-30.9	0	0	0	111.1	E974 E980 R981 D982	E974-D978 PolarHBondContact O-N 3.32Å; D978-E980 PolarHBondContact O-N 3.26Å; D978-R981 PolarHBondContact O-N 3.44Å; D978-R981 VanDerWaalsContact OD1-CD 3.28Å; D978-R981 WeakPolarHBondContact OD1-CD 3.36Å; D978-R981 IonicContact OD1-CZ 2.75Å; D978-R981 IonicContact OD1-NE 3.89Å; D978-R981 IonicContact OD1-NH1 3.49Å; D978-R981 PolarHBondContact OD1-NH1 2.7Å; D978-D982 PolarHBondContact O-N 3.08Å
979	G	79	Confident	69.9	Low	27 Å²	27	126.8 Å²	126.8	28%	0.278	56%	0.564	S	S	.	*	H	α-helix	trans	-62.6	-21.6	169	0	0	0	0	0	115	K975 E976 R977 R983	K975-G979 PolarHBondContact O-N 3.3Å; E976-G979 CarbonylContact O-C 3.59Å; E976-G979 PolarHBondContact O-N 2.97Å; R977-G979 VanDerWaalsContact C-N 3.29Å; G979-R983 WeakPolarHBondContact O-CD 3.3Å; G979-R983 VanDerWaalsContact O-CG 3.25Å; G979-R983 WeakPolarHBondContact O-CG 3.31Å; G979-R983 PolarHBondContact O-NE 3.04Å
980	E	71.9	Confident	70.7	Confident	121 Å²	121	127.1 Å²	127.1	57%	0.565	56%	0.564	S	S	*	*	H	α-helix	trans	-84.7	-42.7	169.1	-70.1	-168.2	129	0	0	112.1	E976 R977 D978 D982 R983 E984	E976-E980 PolarHBondContact O-N 2.95Å; E976-E980 VanDerWaalsContact O-N 3.09Å; R977-E980 PolarHBondContact O-N 3.4Å; R977-E980 VanDerWaalsContact O-N 3.13Å; D978-E980 PolarHBondContact O-N 3.26Å; E980-D982 VanDerWaalsContact C-N 3.31Å; E980-D982 PolarHBondContact O-N 2.95Å; E980-R983 WeakPolarHBondContact O-CA 3.44Å; E980-R983 WeakPolarHBondContact O-CB 3.42Å; E980-R983 PolarHBondContact O-N 3.04Å; E980-E984 PolarHBondContact O-N 3.07Å
981	R	70.8	Confident	71.4	Confident	151 Å²	151	124.3 Å²	124.3	57%	0.57	55%	0.554	S	S	*	*	H	α-helix	trans	-57	-41.6	176.1	-72.4	164.7	168.7	172.6	-5.4	112.6	R977 D978 R983 E984 R985	R977-R981 WeakPolarHBondContact O-CG 3.5Å; R977-R981 PolarHBondContact O-N 3.39Å; D978-R981 PolarHBondContact O-N 3.44Å; D978-R981 VanDerWaalsContact OD1-CD 3.28Å; D978-R981 WeakPolarHBondContact OD1-CD 3.36Å; D978-R981 IonicContact OD1-CZ 2.75Å; D978-R981 IonicContact OD1-NE 3.89Å; D978-R981 IonicContact OD1-NH1 3.49Å; D978-R981 PolarHBondContact OD1-NH1 2.7Å; R981-R983 VanDerWaalsContact C-N 3.29Å; R981-R983 PolarHBondContact O-N 2.89Å; R981-E984 PolarHBondContact O-N 3.28Å; R981-R985 PolarHBondContact O-N 2.94Å
982	D	72.7	Confident	72	Confident	92 Å²	92	126.2 Å²	126.2	49%	0.492	56%	0.556	S	S	.	*	H	α-helix	trans	-69.1	-27.2	176.3	-81	-16.8	0	0	0	112.9	D978 E980 N986	D978-D982 PolarHBondContact O-N 3.08Å; E980-D982 VanDerWaalsContact C-N 3.31Å; E980-D982 PolarHBondContact O-N 2.95Å; D982-N986 WeakPolarHBondContact O-CB 3.48Å; D982-N986 PolarHBondContact O-N 3.3Å; D982-N986 PolarHBondContact O-ND2 3.02Å
983	R	73.2	Confident	72.4	Confident	182 Å²	182	124.5 Å²	124.5	69%	0.687	55%	0.553	S	S	*	*	H	α-helix	trans	-73	-38.9	171.8	-69.1	167.8	-175.2	157.4	3.8	111.4	G979 E980 R981 N986 K987	G979-R983 WeakPolarHBondContact O-CD 3.3Å; G979-R983 VanDerWaalsContact O-CG 3.25Å; G979-R983 WeakPolarHBondContact O-CG 3.31Å; G979-R983 PolarHBondContact O-NE 3.04Å; E980-R983 WeakPolarHBondContact O-CA 3.44Å; E980-R983 WeakPolarHBondContact O-CB 3.42Å; E980-R983 PolarHBondContact O-N 3.04Å; R981-R983 VanDerWaalsContact C-N 3.29Å; R981-R983 PolarHBondContact O-N 2.89Å; R983-N986 PolarHBondContact O-N 3.38Å; R983-K987 WeakPolarHBondContact O-CB 3.46Å; R983-K987 PolarHBondContact O-N 2.78Å
984	E	73.1	Confident	72.8	Confident	137 Å²	137	123.9 Å²	123.9	64%	0.64	55%	0.551	S	S	*	*	H	α-helix	trans	-66.3	-44.9	173.9	-68.2	-163.4	124.3	0	0	112	E980 R981 N986 K987 E988	E980-E984 PolarHBondContact O-N 3.07Å; R981-E984 PolarHBondContact O-N 3.28Å; E984-N986 VanDerWaalsContact C-N 3.34Å; E984-N986 PolarHBondContact O-N 3.26Å; E984-K987 WeakPolarHBondContact O-CA 3.47Å; E984-K987 WeakPolarHBondContact O-CB 3.31Å; E984-K987 PolarHBondContact O-N 2.96Å; E984-E988 PolarHBondContact O-N 3.21Å
985	R	70.8	Confident	73.2	Confident	177 Å²	177	122.8 Å²	122.8	67%	0.668	55%	0.546	S	S	*	.	H	α-helix	trans	-58.5	-42.5	173.6	-76.5	-178.7	166.8	-162.8	-4.5	112.7	R981 K987 N989	R981-R985 PolarHBondContact O-N 2.94Å; R985-K987 VanDerWaalsContact C-N 3.33Å; R985-N989 WeakPolarHBondContact O-CB 3.42Å; R985-N989 PolarHBondContact O-N 3.18Å
986	N	75.4	Confident	73.3	Confident	112 Å²	112	124.7 Å²	124.7	60%	0.599	55%	0.549	S	S	*	.	H	α-helix	trans	-67.3	-32.3	174.9	-85.3	-69	0	0	0	112.9	D982 R983 E984 R990	D982-N986 WeakPolarHBondContact O-CB 3.48Å; D982-N986 PolarHBondContact O-N 3.3Å; D982-N986 PolarHBondContact O-ND2 3.02Å; R983-N986 PolarHBondContact O-N 3.38Å; E984-N986 VanDerWaalsContact C-N 3.34Å; E984-N986 PolarHBondContact O-N 3.26Å; N986-R990 WeakPolarHBondContact O-CB 3.19Å; N986-R990 PolarHBondContact O-N 3.34Å; N986-R990 VanDerWaalsContact O-N 3.14Å
987	K	77.3	Confident	73.6	Confident	139 Å²	139	122.9 Å²	122.9	60%	0.604	54%	0.541	S	S	*	.	H	α-helix	trans	-68.5	-49.6	174.3	-172.4	-175.6	174.3	-165.9	0	111.2	R983 E984 R985 N989 R990 D991	R983-K987 WeakPolarHBondContact O-CB 3.46Å; R983-K987 PolarHBondContact O-N 2.78Å; E984-K987 WeakPolarHBondContact O-CA 3.47Å; E984-K987 WeakPolarHBondContact O-CB 3.31Å; E984-K987 PolarHBondContact O-N 2.96Å; R985-K987 VanDerWaalsContact C-N 3.33Å; K987-N989 PolarHBondContact O-N 3.1Å; K987-R990 WeakPolarHBondContact O-CB 3.39Å; K987-R990 PolarHBondContact O-N 2.97Å; K987-R990 VanDerWaalsContact O-N 3.07Å; K987-D991 PolarHBondContact O-N 2.89Å
988	E	75.4	Confident	73.6	Confident	108 Å²	108	122.3 Å²	122.3	51%	0.505	54%	0.544	S	S	.	.	H	α-helix	trans	-56.4	-47.6	174.6	-85.5	-159.7	-147.3	0	0	112.3	E984 R990 D991 R992	E984-E988 PolarHBondContact O-N 3.21Å; E988-R990 PolarHBondContact O-N 3.31Å; E988-D991 PolarHBondContact O-N 3.43Å; E988-R992 WeakPolarHBondContact O-CB 3.49Å; E988-R992 VanDerWaalsContact O-CG 3.25Å; E988-R992 WeakPolarHBondContact O-CG 3.45Å; E988-R992 PolarHBondContact O-N 2.79Å; E988-R992 IonicContact OE2-CZ 3.32Å; E988-R992 IonicContact OE2-NE 2.67Å; E988-R992 PolarHBondContact OE2-NE 3.21Å; E988-R992 IonicContact OE2-NH2 2.79Å; E988-R992 PolarHBondContact OE2-NH2 2.72Å
989	N	74.3	Confident	73.7	Confident	96 Å²	96	127.1 Å²	127.1	51%	0.513	56%	0.556	S	S	.	*	H	α-helix	trans	-61.6	-32.1	177.5	-85.8	-22.4	0	0	0	112.7	R985 K987 N993	R985-N989 WeakPolarHBondContact O-CB 3.42Å; R985-N989 PolarHBondContact O-N 3.18Å; K987-N989 PolarHBondContact O-N 3.1Å; N989-N993 WeakPolarHBondContact O-CB 3.5Å; N989-N993 PolarHBondContact O-N 3.21Å; N989-N993 VanDerWaalsContact O-N 3.08Å
990	R	75.1	Confident	73.1	Confident	181 Å²	181	136 Å²	136	68%	0.683	58%	0.581	S	S	*	*	H	α-helix	trans	-71.4	-40.5	175.9	-164.6	176.3	-166.5	175	4.9	112.3	N986 K987 E988 N993 R994	N986-R990 WeakPolarHBondContact O-CB 3.19Å; N986-R990 PolarHBondContact O-N 3.34Å; N986-R990 VanDerWaalsContact O-N 3.14Å; K987-R990 WeakPolarHBondContact O-CB 3.39Å; K987-R990 PolarHBondContact O-N 2.97Å; K987-R990 VanDerWaalsContact O-N 3.07Å; E988-R990 PolarHBondContact O-N 3.31Å; R990-N993 PolarHBondContact O-N 3.03Å; R990-R994 PolarHBondContact O-N 3.37Å
991	D	76.6	Confident	72.6	Confident	68 Å²	68	139.3 Å²	139.3	36%	0.364	59%	0.589	S	S	.	*	H	α-helix	trans	-77.4	-34.8	179.8	-67.3	-34.3	0	0	0	111.8	K987 E988 N993 R994 E995	K987-D991 PolarHBondContact O-N 2.89Å; E988-D991 PolarHBondContact O-N 3.43Å; D991-N993 VanDerWaalsContact C-N 3.32Å; D991-N993 PolarHBondContact O-N 2.9Å; D991-R994 WeakPolarHBondContact O-CB 3.17Å; D991-R994 PolarHBondContact O-N 2.97Å; D991-R994 VanDerWaalsContact O-N 3.16Å; D991-R994 IonicContact OD1-NH1 3.69Å; D991-E995 PolarHBondContact O-N 2.97Å
992	R	74.1	Confident	71.8	Confident	147 Å²	147	144.8 Å²	144.8	56%	0.555	61%	0.61	S	S	*	*	H	α-helix	trans	-61.5	-36.3	167.2	-68.4	175.3	-167.1	-152.1	7.1	112.4	E988 R996	E988-R992 WeakPolarHBondContact O-CB 3.49Å; E988-R992 VanDerWaalsContact O-CG 3.25Å; E988-R992 WeakPolarHBondContact O-CG 3.45Å; E988-R992 PolarHBondContact O-N 2.79Å; E988-R992 IonicContact OE2-CZ 3.32Å; E988-R992 IonicContact OE2-NE 2.67Å; E988-R992 PolarHBondContact OE2-NE 3.21Å; E988-R992 IonicContact OE2-NH2 2.79Å; E988-R992 PolarHBondContact OE2-NH2 2.72Å; R992-R996 PolarHBondContact O-N 3Å
993	N	75.1	Confident	71.7	Confident	100 Å²	100	147.4 Å²	147.4	54%	0.535	62%	0.615	S	S	.	*	H	α-helix	trans	-69.8	-34.8	173.1	-97.3	-19.6	0	0	0	112.5	N989 R990 D991 R996 E997	N989-N993 WeakPolarHBondContact O-CB 3.5Å; N989-N993 PolarHBondContact O-N 3.21Å; N989-N993 VanDerWaalsContact O-N 3.08Å; R990-N993 PolarHBondContact O-N 3.03Å; D991-N993 VanDerWaalsContact C-N 3.32Å; D991-N993 PolarHBondContact O-N 2.9Å; N993-R996 CarbonylContact O-C 3.55Å; N993-R996 PolarHBondContact O-N 3.28Å; N993-E997 PolarHBondContact O-N 3.34Å
994	R	71.9	Confident	71.6	Confident	151 Å²	151	145.6 Å²	145.6	57%	0.57	61%	0.612	S	S	*	*	H	α-helix	trans	-63.2	-45.2	171.1	-80.5	172.5	155	174.8	-11.6	112.1	R990 D991 R996 E997 E998	R990-R994 PolarHBondContact O-N 3.37Å; D991-R994 WeakPolarHBondContact O-CB 3.17Å; D991-R994 PolarHBondContact O-N 2.97Å; D991-R994 VanDerWaalsContact O-N 3.16Å; D991-R994 IonicContact OD1-NH1 3.69Å; R994-R996 VanDerWaalsContact C-N 3.27Å; R994-R996 PolarHBondContact O-N 3.3Å; R994-E997 PolarHBondContact O-N 3.26Å; R994-E997 VanDerWaalsContact O-N 3.1Å; R994-E998 PolarHBondContact O-N 3.4Å
995	E	73.2	Confident	71.6	Confident	98 Å²	98	146.1 Å²	146.1	46%	0.458	61%	0.61	S	S	.	*	H	α-helix	trans	-56.5	-41.6	171.2	-97.1	-149.3	92.1	0	0	112.1	D991 E998 R999	D991-E995 PolarHBondContact O-N 2.97Å; E995-E998 PolarHBondContact O-N 2.97Å; E995-R999 VanDerWaalsContact O-CB 3.31Å; E995-R999 WeakPolarHBondContact O-CB 3.47Å; E995-R999 VanDerWaalsContact O-CG 3.24Å; E995-R999 WeakPolarHBondContact O-CG 3.25Å; E995-R999 PolarHBondContact O-N 3.24Å; E995-R999 IonicContact OE1-CZ 3.18Å; E995-R999 IonicContact OE1-NE 3.11Å; E995-R999 PolarHBondContact OE1-NE 3.02Å; E995-R999 VanDerWaalsContact OE1-NE 3.14Å; E995-R999 IonicContact OE1-NH2 2.7Å; E995-R999 PolarHBondContact OE1-NH2 3.32Å; E995-R999 IonicContact OE2-NH2 2.81Å
996	R	72.1	Confident	71.6	Confident	179 Å²	179	144.2 Å²	144.2	68%	0.675	61%	0.607	S	S	*	*	H	α-helix	trans	-67.1	-30.8	175.4	-84.8	-175.5	163.2	-169.4	-3.7	113.8	R992 N993 R994 R1000	R992-R996 PolarHBondContact O-N 3Å; N993-R996 CarbonylContact O-C 3.55Å; N993-R996 PolarHBondContact O-N 3.28Å; R994-R996 VanDerWaalsContact C-N 3.27Å; R994-R996 PolarHBondContact O-N 3.3Å; R996-R1000 WeakPolarHBondContact O-CB 3.43Å; R996-R1000 WeakPolarHBondContact O-CD 3.44Å; R996-R1000 VanDerWaalsContact O-CG 3.24Å; R996-R1000 WeakPolarHBondContact O-CG 3.45Å; R996-R1000 PolarHBondContact O-N 3.18Å
997	E	73.3	Confident	71.4	Confident	101 Å²	101	146.3 Å²	146.3	47%	0.472	61%	0.607	S	S	.	*	H	α-helix	trans	-73.4	-41.7	171.1	-79.1	-156.9	92.2	0	0	112.1	N993 R994 R1000 R1001	N993-E997 PolarHBondContact O-N 3.34Å; R994-E997 PolarHBondContact O-N 3.26Å; R994-E997 VanDerWaalsContact O-N 3.1Å; E997-R1000 CarbonylContact O-C 3.04Å; E997-R1000 WeakPolarHBondContact O-CA 3.35Å; E997-R1000 WeakPolarHBondContact O-CB 3.37Å; E997-R1000 PolarHBondContact O-N 3.09Å; E997-R1001 WeakPolarHBondContact O-CG 3.48Å; E997-R1001 PolarHBondContact O-N 2.83Å; E997-R1001 VanDerWaalsContact O-N 3.13Å; E997-R1001 IonicContact OE1-CZ 2.79Å; E997-R1001 IonicContact OE1-NH2 2.82Å; E997-R1001 PolarHBondContact OE1-NH2 3.41Å
998	E	71.1	Confident	71	Confident	125 Å²	125	146.7 Å²	146.7	58%	0.584	61%	0.607	S	S	*	*	H	α-helix	trans	-67.4	-38.5	177.7	-70.2	-168.6	171.7	0	0	112	R994 E995 R1000 R1001 R1002	R994-E998 PolarHBondContact O-N 3.4Å; E995-E998 PolarHBondContact O-N 2.97Å; E998-R1000 PolarHBondContact O-N 3.19Å; E998-R1001 PolarHBondContact O-N 2.73Å; E998-R1001 VanDerWaalsContact O-N 3.11Å; E998-R1002 PolarHBondContact O-N 3.29Å
999	R	70.6	Confident	70.7	Confident	177 Å²	177	149.5 Å²	149.5	67%	0.668	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.8	2.9	169.5	-64.6	178.4	-168.3	-147	10.3	114.1	E995	E995-R999 VanDerWaalsContact O-CB 3.31Å; E995-R999 WeakPolarHBondContact O-CB 3.47Å; E995-R999 VanDerWaalsContact O-CG 3.24Å; E995-R999 WeakPolarHBondContact O-CG 3.25Å; E995-R999 PolarHBondContact O-N 3.24Å; E995-R999 IonicContact OE1-CZ 3.18Å; E995-R999 IonicContact OE1-NE 3.11Å; E995-R999 PolarHBondContact OE1-NE 3.02Å; E995-R999 VanDerWaalsContact OE1-NE 3.14Å; E995-R999 IonicContact OE1-NH2 2.7Å; E995-R999 PolarHBondContact OE1-NH2 3.32Å; E995-R999 IonicContact OE2-NH2 2.81Å
1000	R	68.3	Low	70.4	Confident	213 Å²	213	153.6 Å²	153.6	80%	0.804	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.2	-1.5	169.1	-78.3	174.9	168.9	-172.2	-4.1	113	R996 E997 E998	R996-R1000 WeakPolarHBondContact O-CB 3.43Å; R996-R1000 WeakPolarHBondContact O-CD 3.44Å; R996-R1000 VanDerWaalsContact O-CG 3.24Å; R996-R1000 WeakPolarHBondContact O-CG 3.45Å; R996-R1000 PolarHBondContact O-N 3.18Å; E997-R1000 CarbonylContact O-C 3.04Å; E997-R1000 WeakPolarHBondContact O-CA 3.35Å; E997-R1000 WeakPolarHBondContact O-CB 3.37Å; E997-R1000 PolarHBondContact O-N 3.09Å; E998-R1000 PolarHBondContact O-N 3.19Å
1001	R	60.5	Low	70	Confident	192 Å²	192	151.3 Å²	151.3	73%	0.725	62%	0.617	S	S	*	*			trans	-115	2.8	174.9	-65.3	179	-167.3	-169.7	8.5	112.3	E997 E998	E997-R1001 WeakPolarHBondContact O-CG 3.48Å; E997-R1001 PolarHBondContact O-N 2.83Å; E997-R1001 VanDerWaalsContact O-N 3.13Å; E997-R1001 IonicContact OE1-CZ 2.79Å; E997-R1001 IonicContact OE1-NH2 2.82Å; E997-R1001 PolarHBondContact OE1-NH2 3.41Å; E998-R1001 PolarHBondContact O-N 2.73Å; E998-R1001 VanDerWaalsContact O-N 3.11Å
1002	R	53.3	Low	69.4	Low	265 Å²	265	158.9 Å²	158.9	100%	1	64%	0.64	S	S	*	*			trans	-112.9	0	161.4	-62.1	-176.7	-173.8	-171.8	4.6	107.8	E998	E998-R1002 PolarHBondContact O-N 3.29Å

Retrieved 1,002 of 1,002 residues in 200.5 ms (Link to these results)

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