A0A5K4FAR5_SCHMA Loading...

Formin-related

AlphaFold DB , UniProt , Accession A0A5K4FAR5, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,114 aa.

						>A0A5K4FAR5_SCHMA|A0A5K4FAR5
MNWFSTEEYHSTNQNNNHPYILCNQSNTQRNISEDDSLNIEPNVNNTNNRASSTKCSCLSSLVGNHYQSTNLLEKTSRQQLSEKSIRVPVIPSSPKKKVDCINNNVQNCINCKDDSINYLENVQFSHKYGDEIDLLYKKIRKNLKQNSLLEYYFLLILQHLLKSLILLKNNSMNQKYEPLHTTYIYNTYSIIVIWKTLIQNCHLLICSIKTNHQNNLNYFKTLNTVQKYKSKSLLNLSNFINYNIYPWNITFIYQSFFQCFRSSLPILKTKQAIAMNINPNNNMIRSTSSSDFESICSDNDLLDNHVESEHSTTIFNQNICLSKELDTESNDTQIKSKITLELSNLKSSNKNTFENLEELSLSTNNELTHSSMSNGGCSALYSQLPKISIPDPPPFTPLPPPPPFPENFHSTSKISFTSLPGNTSFENQKSHHQEINNQIASSTTNISESNIHKLKPFRWTKVYTSKYNNVWNNNNSTCSKTSDHNETVRRKPISLINLSKLNVLFAQKQKLSMKNPEMKISPNTESFCLPMSTDKQTVEREIYHDSPHQKFPGDKNVQESNLIVPPTSDPKLLCAINSYPIRGRSLSSSRTMEFIQKHEPNLLESQRCLNINIFLRQFRHIHINLLDLIDRCDGSSIGSERLKDLIKLLPTDQEIKCLKAFQGNVNYMDPAERFFYDLVRIPKYYHKIDSMLLKEEFQPTINWIKSSLDNVMKTSQEILTSPLICELLQTVLEIGNYMNEGNNLGSASGFKLSSLLKLSEVRSNDSKFTLLHFLVQEFKTNNPQMLKITDTLPYLKEASDVSLDLIIKEINRFKSRLQNMTRNFDPETFGEQSKICEFIEQSNKELNDVQTQMEKLQELEVKCAQYFCECPTQFRIAECLQTFSLFFEKMKSTEQEIKEFEQMDKERLEKLNNKDTLNQTNTKYNHKNSKIVEDKPKSSHDDHNTMMNLISNNISNPRIVHNRSRSRSNANKLNFSNPSNSFSKCTIENKNLNKNKNYTDELNMVSKSTNISHSTSVFEHSSTNTNGKNNNIRIRSRQSVGQHRMNTKFQIIDNEFERERGPWSQIQNQSINSSKNGINQQLDESKANQSSDEETVYHLNERIKRLALKFNKS
					

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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	24	Very low	26.9	Very low	246 Å²	246	173 Å²	173	100%	1.212	85%	0.849	S	S	*	*				0	164	0	-81.5	-179.5	169.5	0	0	109.6
2	N	27.6	Very low	27.2	Very low	154 Å²	154	168.2 Å²	168.2	82%	0.824	84%	0.837	S	S	*	*			trans	-40.9	168.8	161	-67.5	6.1	0	0	0	114.4
3	W	23.7	Very low	27.4	Very low	213 Å²	213	165.3 Å²	165.3	81%	0.807	83%	0.826	S	S	*	*			cis	173.8	169.7	-30.7	-139.4	38.6	0	0	0	105.2
4	F	27.3	Very low	27.8	Very low	152 Å²	152	163.9 Å²	163.9	67%	0.667	82%	0.816	S	S	*	*			trans	61.7	142.9	171	-73.4	-62.5	0	0	0	120.5
5	S	28.4	Very low	28	Very low	124 Å²	124	161.3 Å²	161.3	87%	0.867	81%	0.806	S	S	*	*				-154.2	127.3	114.2	-90.3	0	0	0	0	108.9
6	T	27.5	Very low	28.2	Very low	114 Å²	114	159.3 Å²	159.3	70%	0.699	80%	0.799	S	S	*	*			trans	-143.8	115.6	170.1	46.1	0	0	0	0	107.7
7	E	27.3	Very low	28.4	Very low	201 Å²	201	159.2 Å²	159.2	94%	0.939	80%	0.801	S	S	*	*			trans	-160	136.4	166.4	-118.1	159.3	-142.5	0	0	110.2
8	E	25.3	Very low	28.4	Very low	180 Å²	180	158.1 Å²	158.1	84%	0.841	79%	0.792	S	S	*	*			trans	-103.7	144.5	169.2	-59.5	176.6	117	0	0	108.2
9	Y	28.5	Very low	28.7	Very low	240 Å²	240	155.6 Å²	155.6	94%	0.941	79%	0.789	S	S	*	*			trans	-165.8	165.1	140.7	-104.2	-65.8	0	0	0	110.8
10	H	28	Very low	28.7	Very low	175 Å²	175	157.3 Å²	157.3	81%	0.81	79%	0.786	S	S	*	*			trans	-105	164.1	-160.5	-92.5	-84.3	0	0	0	115.6
11	S	28.5	Very low	28.8	Very low	104 Å²	104	156.5 Å²	156.5	73%	0.727	78%	0.783	S	S	*	*			trans	80.9	147	149.3	80	0	0	0	0	118.8
12	T	30.8	Very low	28.9	Very low	115 Å²	115	153.5 Å²	153.5	71%	0.706	77%	0.771	S	S	*	*			cis	-167	152.9	-18.9	20.3	0	0	0	0	110.4
13	N	29.5	Very low	28.9	Very low	131 Å²	131	152 Å²	152	70%	0.701	77%	0.771	S	S	*	*			trans	68.4	150.5	151.8	-69.5	-10.5	0	0	0	118.8
14	Q	32.5	Very low	29.2	Very low	146 Å²	146	148.1 Å²	148.1	68%	0.682	77%	0.766	S	S	*	*			cis	-160.3	167.9	-1.7	-127.1	169.4	3.2	0	0	113.3
15	N	30.5	Very low	29.4	Very low	124 Å²	124	149.3 Å²	149.3	66%	0.663	77%	0.774	S	S	*	*			trans	69.1	140.5	158.9	-59.9	-7.8	0	0	0	118
16	N	32.4	Very low	29.4	Very low	130 Å²	130	148.4 Å²	148.4	70%	0.695	77%	0.768	S	S	*	*			cis	-150.5	147.7	-11	-89.6	-25.9	0	0	0	106.2
17	N	31	Very low	29.4	Very low	157 Å²	157	149.9 Å²	149.9	84%	0.84	77%	0.772	S	S	*	*				-144.8	152.3	51	-75.2	-50	0	0	0	113.4
18	H	29	Very low	29.6	Very low	139 Å²	139	145.9 Å²	145.9	64%	0.644	76%	0.761	S	S	*	*			trans	-89.8	-171.2	168.5	-113.2	-114.7	0	0	0	110.4	Y20	H18-Y20 AromaticContact CE1-CD2 3.52Å; H18-Y20 AromaticContact CE1-CE2 3.38Å; H18-Y20 WeakPolarHBondContact CE1-CE2 3.44Å; H18-Y20 AromaticContact CE1-CZ 3.82Å; H18-Y20 AromaticContact ND1-CD2 3.2Å; H18-Y20 WeakPolarHBondContact ND1-CD2 3.42Å; H18-Y20 AromaticContact ND1-CE2 3.49Å; H18-Y20 WeakPolarHBondContact ND1-CE2 3.44Å; H18-Y20 AromaticContact ND1-CG 3.83Å
19	P	34.3	Very low	29.8	Very low	111 Å²	111	143.6 Å²	143.6	72%	0.721	75%	0.75	S	S	*	*			cis	-137.1	139.2	8.2	17.6	9.7	0	0	0	119.2
20	Y	28	Very low	29.9	Very low	189 Å²	189	141.4 Å²	141.4	74%	0.741	74%	0.74	S	S	*	*				58.7	155.2	122.1	-93.3	-53.7	0	0	0	125.9	H18	H18-Y20 AromaticContact CE1-CD2 3.52Å; H18-Y20 AromaticContact CE1-CE2 3.38Å; H18-Y20 WeakPolarHBondContact CE1-CE2 3.44Å; H18-Y20 AromaticContact CE1-CZ 3.82Å; H18-Y20 AromaticContact ND1-CD2 3.2Å; H18-Y20 WeakPolarHBondContact ND1-CD2 3.42Å; H18-Y20 AromaticContact ND1-CE2 3.49Å; H18-Y20 WeakPolarHBondContact ND1-CE2 3.44Å; H18-Y20 AromaticContact ND1-CG 3.83Å
21	I	30.4	Very low	29.9	Very low	141 Å²	141	139.7 Å²	139.7	72%	0.723	74%	0.737	S	S	*	*			trans	88.8	105.2	146.8	-74.2	156.5	0	0	0	119.3
22	L	26.2	Very low	30.1	Very low	183 Å²	183	141.6 Å²	141.6	96%	0.958	74%	0.738	S	S	*	*			trans	-73.4	112	140.2	-80.5	159.9	0	0	0	109.2
23	C	27.5	Very low	30	Very low	122 Å²	122	140.1 Å²	140.1	82%	0.824	73%	0.732	S	S	*	*			trans	-178.4	171.3	130.8	-149.1	0	0	0	0	110.9
24	N	31	Very low	30.1	Very low	132 Å²	132	141.8 Å²	141.8	71%	0.706	74%	0.735	S	S	*	*			trans	-98.8	143.3	-162.7	-90.8	-31.4	0	0	0	116.3
25	Q	30.1	Very low	30	Very low	177 Å²	177	141.9 Å²	141.9	83%	0.827	74%	0.741	S	S	*	*			trans	57.9	121.7	134.6	-60.6	173.1	1.6	0	0	121.9
26	S	28.3	Very low	30	Very low	106 Å²	106	143.1 Å²	143.1	74%	0.741	75%	0.748	S	S	*	*			trans	-154.6	153.9	140.2	55.3	0	0	0	0	106.5
27	N	29	Very low	29.8	Very low	145 Å²	145	141.4 Å²	141.4	78%	0.775	75%	0.746	S	S	*	*			cis	-150.1	167.3	37.5	-90.4	-68.7	0	0	0	109
28	T	30.4	Very low	29.8	Very low	116 Å²	116	140.7 Å²	140.7	71%	0.712	74%	0.741	S	S	*	*	S	Bend	cis	-140.1	161.2	14.4	43.8	0	0	0	0	109.4
29	Q	30.9	Very low	29.6	Very low	132 Å²	132	140.9 Å²	140.9	62%	0.617	75%	0.747	S	S	*	*			cis	-160.8	144.5	16.3	-134.3	172.8	56.2	0	0	112.1
30	R	29.8	Very low	29.4	Very low	195 Å²	195	143.1 Å²	143.1	74%	0.736	75%	0.751	S	S	*	*			trans	67.1	135.4	144.9	-82.1	163.8	-174.3	161.4	-6.8	122.8
31	N	28.9	Very low	29.5	Very low	138 Å²	138	142.7 Å²	142.7	74%	0.738	76%	0.756	S	S	*	*			trans	73.5	147	149.6	-58.7	5.7	0	0	0	118.2
32	I	31.8	Very low	29.9	Very low	144 Å²	144	141.3 Å²	141.3	74%	0.738	76%	0.756	S	S	*	*			cis	-169.5	144.3	-34.3	-112.4	158.2	0	0	0	106.1
33	S	29.4	Very low	30	Very low	84 Å²	84	140 Å²	140	59%	0.587	75%	0.75	S	S	*	*			trans	40.1	123.7	159.9	-76.1	0	0	0	0	123.8
34	E	30.8	Very low	30.3	Very low	166 Å²	166	139 Å²	139	78%	0.776	74%	0.74	S	S	*	*				77.2	140.8	122	-65.7	157.8	152.5	0	0	122.9
35	D	30.8	Very low	30.3	Very low	148 Å²	148	139.5 Å²	139.5	79%	0.791	74%	0.742	S	S	*	*			trans	66.6	112.3	148.3	-62.7	3.8	0	0	0	124.5
36	D	29.8	Very low	30.3	Very low	151 Å²	151	137 Å²	137	81%	0.807	74%	0.735	S	S	*	*				62.7	141.2	126.8	-95.6	5.4	0	0	0	125.6
37	S	28.8	Very low	30.6	Very low	94 Å²	94	137.4 Å²	137.4	66%	0.657	73%	0.733	S	S	*	*			trans	80	117.6	144.2	-71.3	0	0	0	0	123.4
38	L	30.2	Very low	30.7	Very low	142 Å²	142	136.9 Å²	136.9	74%	0.743	73%	0.73	S	S	*	*			trans	67	110.3	131.1	-63	169.5	0	0	0	122.3
39	N	25.8	Very low	30.8	Very low	142 Å²	142	138.3 Å²	138.3	76%	0.759	73%	0.733	S	S	*	*				56.2	163.6	127	-66.1	-18.3	0	0	0	123.1
40	I	29.5	Very low	30.6	Very low	159 Å²	159	143.8 Å²	143.8	82%	0.815	75%	0.748	S	S	*	*			trans	91	105.1	159.4	-51.6	-171.8	0	0	0	117.3
41	E	30.4	Very low	30.4	Very low	180 Å²	180	138.7 Å²	138.7	84%	0.841	75%	0.748	S	S	*	*			trans	-63.3	147.5	151.6	-73.8	-170	155.9	0	0	110.3
42	P	38.7	Very low	30.4	Very low	111 Å²	111	137.4 Å²	137.4	72%	0.721	75%	0.75	S	S	*	*				-158.3	147.8	61.2	40.9	-19	0	0	0	120.3
43	N	28.5	Very low	30.1	Very low	155 Å²	155	135.3 Å²	135.3	83%	0.829	75%	0.748	S	S	*	*				50	156.6	120.7	-154.8	7.5	0	0	0	123.1
44	V	33.2	Very low	30.1	Very low	101 Å²	101	137 Å²	137	61%	0.612	76%	0.755	S	S	*	*			trans	99.8	108.5	154.1	-170.7	0	0	0	0	119.7
45	N	31.3	Very low	30	Very low	143 Å²	143	137.9 Å²	137.9	77%	0.765	76%	0.756	S	S	*	*			trans	70.8	152.1	148.2	-73.2	-17.6	0	0	0	121.9
46	N	30.8	Very low	29.7	Very low	126 Å²	126	136.1 Å²	136.1	67%	0.674	75%	0.754	S	S	*	*			cis	-172.5	147	-28.1	-161.1	-19.6	0	0	0	109
47	T	33.5	Very low	29.6	Very low	114 Å²	114	133.9 Å²	133.9	70%	0.699	75%	0.751	S	S	*	*				178.5	134.3	126.8	23	0	0	0	0	112.6
48	N	31.4	Very low	29.3	Very low	133 Å²	133	135 Å²	135	71%	0.711	76%	0.757	S	S	*	*			trans	59.1	123.3	152.3	-53	-23.3	0	0	0	117.9
49	N	31.5	Very low	29.2	Very low	146 Å²	146	136.3 Å²	136.3	78%	0.781	76%	0.764	S	S	*	*			cis	-151.6	139.2	22.7	-109.7	-41.6	0	0	0	114
50	R	28	Very low	29.2	Very low	247 Å²	247	133.7 Å²	133.7	93%	0.932	76%	0.757	S	S	*	*			trans	54	128.8	158.5	-90.9	-179.4	168.2	150.9	-1	121
51	A	26.1	Very low	29.2	Very low	88 Å²	88	131.1 Å²	131.1	73%	0.727	75%	0.753	S	S	*	*			trans	-136.5	158.5	162.2	0	0	0	0	0	111.2
52	S	27.2	Very low	29.3	Very low	112 Å²	112	129.3 Å²	129.3	78%	0.783	75%	0.748	S	S	*	*			trans	48.4	126.8	156.1	64.5	0	0	0	0	119.6
53	S	25.7	Very low	29	Very low	100 Å²	100	130.1 Å²	130.1	70%	0.699	75%	0.751	S	S	*	*				170.5	169.9	68.1	53.2	0	0	0	0	113.7
54	T	29.3	Very low	29.1	Very low	120 Å²	120	125.1 Å²	125.1	74%	0.736	74%	0.736	S	S	*	*			trans	80.3	131.2	158.6	65.6	0	0	0	0	123.3
55	K	29.8	Very low	29.1	Very low	184 Å²	184	126.5 Å²	126.5	80%	0.8	74%	0.74	S	S	*	*			trans	78.9	125	139.1	-77.3	171.9	179.9	177.8	0	123.4
56	C	25	Very low	29	Very low	110 Å²	110	126.7 Å²	126.7	74%	0.743	74%	0.736	S	S	*	*			trans	72	146	136.8	-65.4	0	0	0	0	122.6
57	S	27	Very low	29	Very low	105 Å²	105	131.5 Å²	131.5	73%	0.734	75%	0.746	S	S	*	*			trans	56.5	120.9	159.2	38.5	0	0	0	0	117.9
58	C	23.5	Very low	28.9	Very low	117 Å²	117	134.3 Å²	134.3	79%	0.791	75%	0.751	S	S	*	*				70.4	134.5	50.6	-60.8	0	0	0	0	115.1
59	L	26.7	Very low	28.8	Very low	169 Å²	169	133.5 Å²	133.5	89%	0.885	76%	0.756	S	S	*	*			trans	74.5	149.5	170.2	-56.5	171.7	0	0	0	116.8
60	S	26.8	Very low	29	Very low	87 Å²	87	131.8 Å²	131.8	61%	0.608	75%	0.751	S	S	*	*			cis	-177.7	174.8	-24.2	55.9	0	0	0	0	111
61	S	29.1	Very low	29.3	Very low	105 Å²	105	126.9 Å²	126.9	73%	0.734	74%	0.744	S	S	*	*			trans	75.5	159.9	149.5	-63.6	0	0	0	0	117.7
62	L	31.7	Very low	29.5	Very low	143 Å²	143	129.7 Å²	129.7	75%	0.749	75%	0.746	S	S	*	*			cis	-148.7	-178.2	-5.6	-116.9	163.8	0	0	0	105.5
63	V	34	Very low	29.7	Very low	128 Å²	128	131.2 Å²	131.2	78%	0.776	74%	0.744	S	S	*	*			cis	-141.8	155.4	17.8	178.7	0	0	0	0	107
64	G	30.3	Very low	30	Very low	50 Å²	50	133.1 Å²	133.1	52%	0.515	74%	0.742	S	S	.	*			cis	-164.3	167.1	0.9	0	0	0	0	0	110.4
65	N	32.2	Very low	30.2	Very low	130 Å²	130	134.9 Å²	134.9	70%	0.695	74%	0.739	S	S	*	*				80	132	91.2	-71.9	6.8	0	0	0	113.5
66	H	30.2	Very low	30.2	Very low	147 Å²	147	132 Å²	132	68%	0.681	74%	0.738	S	S	*	*			cis	-154.8	144.5	6.6	-113.4	-65.9	0	0	0	111
67	Y	30.1	Very low	30.5	Very low	226 Å²	226	131.8 Å²	131.8	89%	0.886	74%	0.737	S	S	*	*				166.6	159.8	123.6	-104.1	-83.1	0	0	0	112.4
68	Q	30.7	Very low	30.6	Very low	173 Å²	173	137.3 Å²	137.3	81%	0.808	74%	0.742	S	S	*	*			trans	-136.9	153.3	-170.2	-61.9	175.3	-61.1	0	0	113.6
69	S	31.1	Very low	31	Very low	116 Å²	116	137.8 Å²	137.8	81%	0.811	73%	0.732	S	S	*	*			trans	-175.1	175.6	146	-77.5	0	0	0	0	110.5
70	T	35.7	Very low	31.1	Very low	111 Å²	111	137 Å²	137	68%	0.681	72%	0.724	S	S	*	*				-160.9	139.7	-87	39.1	0	0	0	0	112.4
71	N	33.1	Very low	31.1	Very low	144 Å²	144	139 Å²	139	77%	0.77	73%	0.728	S	S	*	*			trans	67.3	158.4	151.5	-62.1	-15.8	0	0	0	118.6
72	L	31.3	Very low	31	Very low	147 Å²	147	139.5 Å²	139.5	77%	0.77	73%	0.731	S	S	*	*			cis	-147	-167.8	-0.2	-149.3	76	0	0	0	112.2
73	L	31	Very low	30.7	Very low	144 Å²	144	141.1 Å²	141.1	75%	0.754	74%	0.735	S	S	*	*			trans	-85.5	-179.6	-173.1	-69.6	76.1	0	0	0	113.2
74	E	31.7	Very low	30.5	Very low	139 Å²	139	145.1 Å²	145.1	65%	0.65	74%	0.742	S	S	*	*			cis	-167.6	152	49.2	-79.5	-158.3	136.4	0	0	118.2
75	K	32.8	Very low	30.2	Very low	157 Å²	157	147 Å²	147	68%	0.683	75%	0.747	S	S	*	*			trans	65.3	171.9	140.6	-69.3	169.2	-171	152.1	0	122.2
76	T	30.7	Very low	30	Very low	125 Å²	125	147.8 Å²	147.8	77%	0.767	75%	0.75	S	S	*	*				-171	168.5	-81.8	31.7	0	0	0	0	113
77	S	31.4	Very low	29.8	Very low	105 Å²	105	151.9 Å²	151.9	73%	0.734	76%	0.759	S	S	*	*			trans	90.2	128.2	169	-60.3	0	0	0	0	116.8
78	R	29.7	Very low	29.4	Very low	220 Å²	220	147.4 Å²	147.4	83%	0.83	76%	0.755	S	S	*	*				77.7	141.3	58.1	-71.4	177	174.6	-132.5	10.6	112.8
79	Q	30.7	Very low	29.6	Very low	127 Å²	127	144.3 Å²	144.3	59%	0.593	75%	0.75	S	S	*	*			cis	-160.5	162.5	7.1	-129.8	168.1	-80.2	0	0	111.8
80	Q	28.4	Very low	29.4	Very low	152 Å²	152	144.4 Å²	144.4	71%	0.71	75%	0.745	S	S	*	*			trans	24.4	155.7	140.9	-77.6	171	-35	0	0	122.5
81	L	26.6	Very low	28.9	Very low	131 Å²	131	146.8 Å²	146.8	69%	0.686	75%	0.752	S	S	*	*			cis	-158.7	160.9	16	-116.3	153.4	0	0	0	108.9
82	S	28	Very low	28.9	Very low	115 Å²	115	145.4 Å²	145.4	80%	0.804	75%	0.751	S	S	*	*				170	167.1	90.2	48.4	0	0	0	0	111.9
83	E	24.8	Very low	28.6	Very low	177 Å²	177	144 Å²	144	83%	0.827	75%	0.753	S	S	*	*			trans	-118.7	155.2	-167.7	-55.3	169.5	111.9	0	0	114.8
84	K	29.4	Very low	28.4	Very low	211 Å²	211	142.1 Å²	142.1	92%	0.917	75%	0.752	S	S	*	*			trans	179.9	155.3	148	-102.5	159.5	-176.6	176.9	0	110.6
85	S	25.6	Very low	28.2	Very low	89 Å²	89	141.3 Å²	141.3	62%	0.622	76%	0.759	S	S	*	*			cis	-176.3	133.3	-35.4	-176.9	0	0	0	0	109
86	I	27	Very low	27.8	Very low	148 Å²	148	143.4 Å²	143.4	76%	0.759	77%	0.768	S	S	*	*			trans	57.2	118.9	160	-62.7	162.5	0	0	0	116.2
87	R	25.6	Very low	27.6	Very low	233 Å²	233	147 Å²	147	88%	0.879	77%	0.773	S	S	*	*				-168.6	162.5	70.4	-154.5	175.4	-103.7	-159.7	-4.1	112.5
88	V	21.8	Very low	27.3	Very low	131 Å²	131	151.8 Å²	151.8	79%	0.794	78%	0.781	S	S	*	*			trans	-150.1	163.9	-174.8	170.4	0	0	0	0	106.7
89	P	34.6	Very low	26.9	Very low	109 Å²	109	147.8 Å²	147.8	71%	0.708	78%	0.781	S	S	*	*			cis	-125.6	-168	-7.9	22.3	2.6	0	0	0	114.8
90	V	26.9	Very low	26.5	Very low	117 Å²	117	149.3 Å²	149.3	71%	0.709	79%	0.793	S	S	*	*				140.7	111	126.5	173	0	0	0	0	116.9
91	I	26.5	Very low	26.3	Very low	162 Å²	162	148 Å²	148	83%	0.831	80%	0.799	S	S	*	*			trans	73	147.4	149.5	-75.3	172	0	0	0	121.2
92	P	32	Very low	26.3	Very low	114 Å²	114	149.7 Å²	149.7	74%	0.74	81%	0.807	S	S	*	*			trans	-127.2	158.1	-157.7	41	-24.1	0	0	0	117.4
93	S	26.5	Very low	26	Very low	118 Å²	118	151.3 Å²	151.3	83%	0.825	81%	0.807	S	S	*	*			trans	-172.8	155.5	160	52.6	0	0	0	0	109.4
94	S	25.9	Very low	26	Very low	104 Å²	104	150.2 Å²	150.2	73%	0.727	81%	0.807	S	S	*	*			cis	-163.8	151.2	-18.1	52.4	0	0	0	0	109.9
95	P	28.4	Very low	25.8	Very low	123 Å²	123	147.2 Å²	147.2	80%	0.799	80%	0.801	S	S	*	*			trans	-91.3	121.3	169.8	33.1	-29.8	0	0	0	111.5
96	K	23.8	Very low	25.8	Very low	200 Å²	200	150 Å²	150	87%	0.87	81%	0.814	S	S	*	*			trans	-172.5	164	161.7	-111.7	158.9	-173	-179	0	113.3
97	K	25.5	Very low	25.7	Very low	200 Å²	200	150.3 Å²	150.3	87%	0.87	81%	0.812	S	S	*	*			trans	71.4	127.4	-173.6	-52.4	179.3	-178.8	-179.3	0	113
98	K	25.5	Very low	25.6	Very low	207 Å²	207	146.2 Å²	146.2	90%	0.9	81%	0.807	S	S	*	*			cis	-116.2	115.7	5.2	-66.8	179.4	179.6	178.7	0	112.4
99	V	22.3	Very low	25.8	Very low	136 Å²	136	145.4 Å²	145.4	82%	0.824	81%	0.806	S	S	*	*			trans	-129.8	116.6	142.7	171.6	0	0	0	0	104.2
100	D	22.2	Very low	25.4	Very low	158 Å²	158	147.7 Å²	147.7	85%	0.845	81%	0.811	S	S	*	*			trans	-179.1	163.1	162.1	-92.4	-35.7	0	0	0	108.1
101	C	24.4	Very low	25.3	Very low	125 Å²	125	149 Å²	149	85%	0.845	81%	0.814	S	S	*	*			trans	79.7	51.5	-173.8	-60.2	0	0	0	0	117.6
102	I	24.8	Very low	25.3	Very low	167 Å²	167	145.9 Å²	145.9	86%	0.856	81%	0.806	S	S	*	*			trans	-122	73	144.4	-53.6	-178.9	0	0	0	108.8
103	N	23.7	Very low	25	Very low	148 Å²	148	149.1 Å²	149.1	79%	0.791	81%	0.808	S	S	*	*	S	Bend	trans	-179.3	99.3	153	-100.5	-21.1	0	0	0	110
104	N	23.6	Very low	25.1	Very low	155 Å²	155	149 Å²	149	83%	0.829	80%	0.798	S	S	*	*			trans	175.8	163.9	138.1	-89.9	-29.2	0	0	0	109.7
105	N	26.1	Very low	25.1	Very low	148 Å²	148	149.9 Å²	149.9	79%	0.791	80%	0.795	S	S	*	*			trans	65.1	60.1	176.8	-57.8	-7.4	0	0	0	116.4	Q107	N105-Q107 PolarHBondContact O-N 3.22Å
106	V	25.2	Very low	25.1	Very low	148 Å²	148	149 Å²	149	90%	0.897	79%	0.791	S	S	*	*			trans	-88.7	57.3	144.3	-170.6	0	0	0	0	109.1
107	Q	24.8	Very low	25.5	Very low	154 Å²	154	143.9 Å²	143.9	72%	0.72	77%	0.773	S	S	*	*	S	Bend	trans	-150.6	153	158.3	-91.4	-51	-19.9	0	0	109.5	N105	N105-Q107 PolarHBondContact O-N 3.22Å
108	N	24.3	Very low	25.7	Very low	146 Å²	146	139.4 Å²	139.4	78%	0.781	76%	0.758	S	S	*	*			trans	61.6	85.9	-175.1	-57	-24.3	0	0	0	115.1
109	C	25.8	Very low	25.8	Very low	115 Å²	115	139.4 Å²	139.4	78%	0.777	75%	0.754	S	S	*	*			trans	-163.8	71.4	137.9	-112.2	0	0	0	0	111.5
110	I	24.5	Very low	26.2	Very low	157 Å²	157	137.4 Å²	137.4	81%	0.805	74%	0.738	S	S	*	*			trans	-73.1	132.4	149.5	-64	174.5	0	0	0	105.5
111	N	24.9	Very low	26.6	Very low	143 Å²	143	138 Å²	138	77%	0.765	74%	0.736	S	S	*	*			trans	77.4	91.8	-168.4	-48.2	-39.8	0	0	0	114.9
112	C	27.4	Very low	27	Very low	98 Å²	98	139.1 Å²	139.1	66%	0.662	73%	0.733	S	S	*	*			trans	-153.5	129.5	130.9	-121.3	0	0	0	0	110.1
113	K	26.1	Very low	27.3	Very low	182 Å²	182	134.6 Å²	134.6	79%	0.791	71%	0.714	S	S	*	*			trans	-93.7	162	152.7	-67	173.4	-176.6	166.6	0	106.5
114	D	27.4	Very low	27.7	Very low	116 Å²	116	137 Å²	137	62%	0.62	72%	0.72	S	S	*	*	S	Bend	trans	97.1	-22.6	164.6	-48.4	-23.7	0	0	0	118.1	S116 I117	D114-S116 PolarHBondContact O-N 2.79Å; D114-I117 PolarHBondContact O-N 3.04Å
115	D	26.5	Very low	28.2	Very low	121 Å²	121	135.1 Å²	135.1	65%	0.647	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.8	-13.7	178.7	-70.6	-54.3	0	0	0	115.4	I117	D115-I117 PolarHBondContact O-N 3.21Å
116	S	29.6	Very low	28.7	Very low	105 Å²	105	131.5 Å²	131.5	73%	0.734	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.8	-0.5	177.6	57.2	0	0	0	0	114.7	D114	D114-S116 PolarHBondContact O-N 2.79Å
117	I	31.3	Very low	29	Very low	93 Å²	93	133.2 Å²	133.2	48%	0.477	69%	0.689	S	S	.	*	S	Bend	trans	-96.9	-41.7	-176.6	-63.8	177.7	0	0	0	112.3	D114 D115 Y119	D114-I117 PolarHBondContact O-N 3.04Å; D115-I117 PolarHBondContact O-N 3.21Å; I117-Y119 VanDerWaalsContact C-N 3.29Å; I117-Y119 PolarHBondContact O-N 3.13Å
118	N	28.6	Very low	29.5	Very low	105 Å²	105	133.6 Å²	133.6	56%	0.561	69%	0.688	S	S	*	*	G	3₁₀ helix	trans	-76.2	-9.7	-168.7	-68.7	-3.9	0	0	0	114.8	L120	N118-L120 PolarHBondContact O-N 3.01Å
119	Y	29.6	Very low	30.2	Very low	208 Å²	208	133.4 Å²	133.4	82%	0.816	68%	0.677	S	S	*	*	G	3₁₀ helix	trans	-74.3	-2.7	179.2	-132.2	-85.7	0	0	0	114.2	I117	I117-Y119 VanDerWaalsContact C-N 3.29Å; I117-Y119 PolarHBondContact O-N 3.13Å
120	L	30.1	Very low	30.8	Very low	94 Å²	94	128.4 Å²	128.4	49%	0.492	65%	0.645	S	S	.	*	G	3₁₀ helix	trans	-98.7	-17.6	-178.7	-77.8	168.5	0	0	0	114.8	N118 N122	N118-L120 PolarHBondContact O-N 3.01Å; L120-N122 VanDerWaalsContact C-N 3.25Å; L120-N122 PolarHBondContact O-N 3.3Å
121	E	30.9	Very low	31.8	Very low	169 Å²	169	125.8 Å²	125.8	79%	0.79	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.3	-15.6	-177.9	-62.1	-165.8	137.2	0	0	113.4
122	N	31.5	Very low	32.7	Very low	149 Å²	149	125 Å²	125	80%	0.797	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.7	12.1	-178	-70.1	-61.8	0	0	0	114.6	L120	L120-N122 VanDerWaalsContact C-N 3.25Å; L120-N122 PolarHBondContact O-N 3.3Å
123	V	32.4	Very low	33.5	Very low	73 Å²	73	124.5 Å²	124.5	44%	0.442	62%	0.615	S	S	.	*			trans	-95.9	103.4	176.7	-177.6	0	0	0	0	109.9	F125	V123-F125 HydrophobicContact CB-CE2 4.2Å; V123-F125 HydrophobicContact CB-CZ 4.1Å; V123-F125 HydrophobicContact CG1-CD1 4.3Å; V123-F125 HydrophobicContact CG1-CE1 3.92Å; V123-F125 HydrophobicContact CG1-CE2 4.26Å; V123-F125 HydrophobicContact CG1-CZ 3.9Å; V123-F125 WeakPolarHBondContact O-CD2 3.49Å; V123-F125 VanDerWaalsContact O-CE2 3.3Å; V123-F125 WeakPolarHBondContact O-CE2 3.17Å; V123-F125 PolarHBondContact O-N 3.29Å
124	Q	31.4	Very low	34.6	Very low	197 Å²	197	118.4 Å²	118.4	92%	0.921	59%	0.59	S	S	*	*			trans	-70.4	111.3	170.8	-73.9	-172.6	-50.1	0	0	110.6
125	F	35	Very low	35.9	Very low	117 Å²	117	117 Å²	117	51%	0.513	58%	0.583	S	S	.	*			trans	-83.3	143.1	178.8	-63.7	-82.4	0	0	0	112.3	V123 H127	V123-F125 HydrophobicContact CB-CE2 4.2Å; V123-F125 HydrophobicContact CB-CZ 4.1Å; V123-F125 HydrophobicContact CG1-CD1 4.3Å; V123-F125 HydrophobicContact CG1-CE1 3.92Å; V123-F125 HydrophobicContact CG1-CE2 4.26Å; V123-F125 HydrophobicContact CG1-CZ 3.9Å; V123-F125 WeakPolarHBondContact O-CD2 3.49Å; V123-F125 VanDerWaalsContact O-CE2 3.3Å; V123-F125 WeakPolarHBondContact O-CE2 3.17Å; V123-F125 PolarHBondContact O-N 3.29Å; F125-H127 PolarHBondContact O-N 3.45Å
126	S	34.9	Very low	36.9	Very low	72 Å²	72	116.2 Å²	116.2	50%	0.503	58%	0.578	S	S	.	*			trans	-65.9	128.4	175.4	62.7	0	0	0	0	111.7	K128 K169	S126-K128 VanDerWaalsContact C-N 3.25Å; S126-K128 PolarHBondContact O-N 3.31Å; S126-K169 PolarHBondContact OG-NZ 3.4Å
127	H	32.6	Very low	37.9	Very low	183 Å²	183	114.6 Å²	114.6	85%	0.847	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.2	26.7	-154.7	-126.8	-57.2	0	0	0	119.6	F125	F125-H127 PolarHBondContact O-N 3.45Å
128	K	35.9	Very low	39.1	Very low	163 Å²	163	116 Å²	116	71%	0.709	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-141.3	-18.1	179.5	-158.7	168.8	-176.9	179.4	0	116.8	S126	S126-K128 VanDerWaalsContact C-N 3.25Å; S126-K128 PolarHBondContact O-N 3.31Å
129	Y	37.2	Very low	40.3	Very low	141 Å²	141	116.7 Å²	116.7	55%	0.553	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-132	-4.7	179.7	-67.1	-73.7	0	0	0	114.2	I133	Y129-I133 WeakPolarHBondContact O-CG1 3.46Å; Y129-I133 PolarHBondContact O-N 3.14Å
130	G	39.3	Very low	41.1	Very low	10 Å²	10	108.7 Å²	108.7	10%	0.103	53%	0.528	C	S	.	.	H	α-helix	trans	-63.5	-46.3	170.4	0	0	0	0	0	111.1	E132 I133 D134	G130-E132 PolarHBondContact O-N 3.31Å; G130-I133 PolarHBondContact O-N 3.4Å; G130-D134 WeakPolarHBondContact O-CB 3.22Å; G130-D134 PolarHBondContact O-N 3.09Å
131	D	44.7	Very low	42.1	Very low	103 Å²	103	110.1 Å²	110.1	55%	0.551	53%	0.527	S	S	*	.	H	α-helix	trans	-63.5	-37	-175.4	-50.8	-73.2	0	0	0	113.1	L135	D131-L135 WeakPolarHBondContact O-CB 3.3Å; D131-L135 PolarHBondContact O-N 2.91Å
132	E	44.5	Very low	43.3	Very low	127 Å²	127	109.9 Å²	109.9	59%	0.593	52%	0.523	S	S	*	.	H	α-helix	trans	-68.4	-43.4	176.2	-65.8	-166	137.4	0	0	112.2	G130 L135 L136	G130-E132 PolarHBondContact O-N 3.31Å; E132-L135 PolarHBondContact O-N 3Å; E132-L136 WeakPolarHBondContact O-CB 3.42Å; E132-L136 PolarHBondContact O-N 3.47Å
133	I	44.9	Very low	43.9	Very low	87 Å²	87	109.5 Å²	109.5	45%	0.446	52%	0.521	S	S	.	.	H	α-helix	trans	-65.8	-45.4	178.6	-73.6	173.9	0	0	0	110.5	Y129 G130 L136 Y137 L162	Y129-I133 WeakPolarHBondContact O-CG1 3.46Å; Y129-I133 PolarHBondContact O-N 3.14Å; G130-I133 PolarHBondContact O-N 3.4Å; I133-L136 WeakPolarHBondContact O-CB 3.43Å; I133-L136 PolarHBondContact O-N 2.98Å; I133-Y137 WeakPolarHBondContact O-CB 3.41Å; I133-Y137 PolarHBondContact O-N 3.1Å; I133-L162 HydrophobicContact CG2-CD2 3.55Å
134	D	49.6	Very low	44.6	Very low	53 Å²	53	108 Å²	108	28%	0.283	51%	0.51	S	S	.	.	H	α-helix	trans	-71.4	-34.7	179.2	-175.6	37.9	0	0	0	111.6	G130 L136 Y137 K138	G130-D134 WeakPolarHBondContact O-CB 3.22Å; G130-D134 PolarHBondContact O-N 3.09Å; D134-L136 VanDerWaalsContact C-N 3.34Å; D134-L136 PolarHBondContact O-N 3.46Å; D134-Y137 PolarHBondContact O-N 3.49Å; D134-K138 VanDerWaalsContact O-CB 3.23Å; D134-K138 WeakPolarHBondContact O-CB 3.34Å; D134-K138 WeakPolarHBondContact O-CD 3.33Å; D134-K138 WeakPolarHBondContact O-CG 3.26Å; D134-K138 PolarHBondContact O-N 3.42Å; D134-K138 VanDerWaalsContact OD1-CE 3.26Å; D134-K138 WeakPolarHBondContact OD1-CE 3.16Å; D134-K138 IonicContact OD1-NZ 3.64Å; D134-K138 WeakPolarHBondContact OD2-CE 3.3Å; D134-K138 IonicContact OD2-NZ 3.93Å; D134-K138 PolarHBondContact OD2-NZ 3.17Å
135	L	54.7	Low	45.3	Very low	87 Å²	87	106.8 Å²	106.8	46%	0.455	50%	0.502	S	S	.	.	H	α-helix	trans	-63.5	-38	168.3	-178.8	63.5	0	0	0	112	D131 E132 K139	D131-L135 WeakPolarHBondContact O-CB 3.3Å; D131-L135 PolarHBondContact O-N 2.91Å; E132-L135 PolarHBondContact O-N 3Å; L135-K139 HydrophobicContact CD1-CD 4.39Å; L135-K139 HydrophobicContact CD1-CG 4.43Å; L135-K139 HydrophobicContact CG-CD 4.14Å; L135-K139 VanDerWaalsContact O-CB 3.28Å; L135-K139 WeakPolarHBondContact O-CB 3.49Å; L135-K139 WeakPolarHBondContact O-CG 3.27Å; L135-K139 PolarHBondContact O-N 3.28Å
136	L	47.3	Very low	46	Very low	105 Å²	105	108.5 Å²	108.5	55%	0.55	51%	0.512	S	S	.	.	H	α-helix	trans	-66.1	-46.3	175.2	-159.1	82	0	0	0	110.8	E132 I133 D134 K139 I140	E132-L136 WeakPolarHBondContact O-CB 3.42Å; E132-L136 PolarHBondContact O-N 3.47Å; I133-L136 WeakPolarHBondContact O-CB 3.43Å; I133-L136 PolarHBondContact O-N 2.98Å; D134-L136 VanDerWaalsContact C-N 3.34Å; D134-L136 PolarHBondContact O-N 3.46Å; L136-K139 PolarHBondContact O-N 3.33Å; L136-I140 HydrophobicContact CD2-CD1 4.39Å; L136-I140 HydrophobicContact CG-CD1 4.16Å; L136-I140 WeakPolarHBondContact O-CB 3.46Å; L136-I140 VanDerWaalsContact O-CG1 3.29Å; L136-I140 WeakPolarHBondContact O-CG1 3.26Å; L136-I140 PolarHBondContact O-N 3.47Å
137	Y	49.6	Very low	46.7	Very low	70 Å²	70	109 Å²	109	28%	0.275	51%	0.509	S	S	.	.	H	α-helix	trans	-58.5	-49.1	174.8	178.1	-113.8	0	0	0	111.7	I133 D134 K139 I140 R141 L155 L158	I133-Y137 WeakPolarHBondContact O-CB 3.41Å; I133-Y137 PolarHBondContact O-N 3.1Å; D134-Y137 PolarHBondContact O-N 3.49Å; Y137-K139 PolarHBondContact O-N 3.32Å; Y137-I140 PolarHBondContact O-N 3.36Å; Y137-R141 WeakPolarHBondContact O-CB 3.23Å; Y137-R141 PolarHBondContact O-N 3.37Å; Y137-L155 HydrophobicContact CD2-CD2 4.47Å; Y137-L155 HydrophobicContact CE2-CD2 3.71Å; Y137-L158 HydrophobicContact CD2-CD2 4.01Å
138	K	56.9	Low	47.7	Very low	122 Å²	122	105 Å²	105	53%	0.53	50%	0.501	S	S	.	.	H	α-helix	trans	-61.8	-39.8	176	-73.8	165.7	175.4	170.8	0	112.2	D134 K142	D134-K138 VanDerWaalsContact O-CB 3.23Å; D134-K138 WeakPolarHBondContact O-CB 3.34Å; D134-K138 WeakPolarHBondContact O-CD 3.33Å; D134-K138 WeakPolarHBondContact O-CG 3.26Å; D134-K138 PolarHBondContact O-N 3.42Å; D134-K138 VanDerWaalsContact OD1-CE 3.26Å; D134-K138 WeakPolarHBondContact OD1-CE 3.16Å; D134-K138 IonicContact OD1-NZ 3.64Å; D134-K138 WeakPolarHBondContact OD2-CE 3.3Å; D134-K138 IonicContact OD2-NZ 3.93Å; D134-K138 PolarHBondContact OD2-NZ 3.17Å; K138-K142 VanDerWaalsContact O-CB 3.29Å; K138-K142 WeakPolarHBondContact O-CB 3.44Å; K138-K142 PolarHBondContact O-N 2.95Å
139	K	52.5	Low	48.3	Very low	120 Å²	120	101 Å²	101	52%	0.522	49%	0.487	S	S	.	.	H	α-helix	trans	-64.6	-44.6	173.9	-79.7	169.9	178.4	170.8	0	112.4	L135 L136 Y137 K142 N143	L135-K139 HydrophobicContact CD1-CD 4.39Å; L135-K139 HydrophobicContact CD1-CG 4.43Å; L135-K139 HydrophobicContact CG-CD 4.14Å; L135-K139 VanDerWaalsContact O-CB 3.28Å; L135-K139 WeakPolarHBondContact O-CB 3.49Å; L135-K139 WeakPolarHBondContact O-CG 3.27Å; L135-K139 PolarHBondContact O-N 3.28Å; L136-K139 PolarHBondContact O-N 3.33Å; Y137-K139 PolarHBondContact O-N 3.32Å; K139-K142 PolarHBondContact O-N 3.47Å; K139-N143 PolarHBondContact O-N 3.24Å
140	I	47.6	Very low	48.8	Very low	41 Å²	41	96.9 Å²	96.9	21%	0.21	47%	0.474	C	S	.	.	H	α-helix	trans	-63.3	-51.5	178	-71.7	166.1	0	0	0	110.3	L136 Y137 K142 N143 L144 F154 L158	L136-I140 HydrophobicContact CD2-CD1 4.39Å; L136-I140 HydrophobicContact CG-CD1 4.16Å; L136-I140 WeakPolarHBondContact O-CB 3.46Å; L136-I140 VanDerWaalsContact O-CG1 3.29Å; L136-I140 WeakPolarHBondContact O-CG1 3.26Å; L136-I140 PolarHBondContact O-N 3.47Å; Y137-I140 PolarHBondContact O-N 3.36Å; I140-K142 VanDerWaalsContact C-N 3.29Å; I140-K142 PolarHBondContact O-N 2.88Å; I140-N143 PolarHBondContact O-N 2.97Å; I140-L144 HydrophobicContact CG2-CD1 3.74Å; I140-L144 PolarHBondContact O-N 3.3Å; I140-F154 HydrophobicContact CG2-CD1 4.14Å; I140-F154 HydrophobicContact CG2-CE1 3.83Å; I140-L158 HydrophobicContact CD1-CD1 4.37Å; I140-L158 HydrophobicContact CD1-CD2 3.95Å; I140-L158 HydrophobicContact CG2-CD2 4.25Å
141	R	51.4	Low	49.3	Very low	123 Å²	123	98.2 Å²	98.2	46%	0.464	48%	0.478	S	S	.	.	H	α-helix	trans	-59.5	-36	178.3	-168.7	177.5	-178.7	-169	1.5	112.5	Y137 N143 L144	Y137-R141 WeakPolarHBondContact O-CB 3.23Å; Y137-R141 PolarHBondContact O-N 3.37Å; R141-N143 VanDerWaalsContact C-N 3.25Å; R141-N143 PolarHBondContact O-N 3.43Å; R141-L144 PolarHBondContact O-N 3.37Å
142	K	54.6	Low	49.7	Very low	164 Å²	164	100 Å²	100	71%	0.713	48%	0.478	S	S	*	.	H	α-helix	trans	-65.4	-26.6	177	-165.4	172.1	-176.3	179.7	0	113.2	K138 K139 I140	K138-K142 VanDerWaalsContact O-CB 3.29Å; K138-K142 WeakPolarHBondContact O-CB 3.44Å; K138-K142 PolarHBondContact O-N 2.95Å; K139-K142 PolarHBondContact O-N 3.47Å; I140-K142 VanDerWaalsContact C-N 3.29Å; I140-K142 PolarHBondContact O-N 2.88Å
143	N	44.9	Very low	50	Low	141 Å²	141	96.2 Å²	96.2	75%	0.754	46%	0.458	S	S	*	.	H	α-helix	trans	-93.1	-12.7	-177.9	-70.6	-16.4	0	0	0	114.6	K139 I140 R141	K139-N143 PolarHBondContact O-N 3.24Å; I140-N143 PolarHBondContact O-N 2.97Å; R141-N143 VanDerWaalsContact C-N 3.25Å; R141-N143 PolarHBondContact O-N 3.43Å
144	L	48.1	Very low	50.5	Low	42 Å²	42	96.2 Å²	96.2	22%	0.22	46%	0.455	C	S	.	.			trans	-88.5	-2.9	-173.4	-76.5	167.8	0	0	0	115.2	I140 R141 Q146 N147 E151 F154	I140-L144 HydrophobicContact CG2-CD1 3.74Å; I140-L144 PolarHBondContact O-N 3.3Å; R141-L144 PolarHBondContact O-N 3.37Å; L144-Q146 PolarHBondContact O-N 3.45Å; L144-N147 PolarHBondContact O-N 3.18Å; L144-E151 HydrophobicContact CB-CB 4.08Å; L144-E151 HydrophobicContact CB-CG 3.77Å; L144-E151 HydrophobicContact CD1-CG 4.12Å; L144-F154 HydrophobicContact CD1-CD1 4.01Å
145	K	46.2	Very low	50.8	Low	171 Å²	171	95.5 Å²	95.5	74%	0.743	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.5	10.5	-169.7	-79.3	-162.8	167.9	-159.8	0	119.2
146	Q	48.8	Very low	50.8	Low	154 Å²	154	94 Å²	94	72%	0.72	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-127.8	4.8	-176.6	-69.5	-170.8	-22.1	0	0	115.4	L144 N218	L144-Q146 PolarHBondContact O-N 3.45Å; Q146-N218 PolarHBondContact OE1-ND2 3.39Å
147	N	48.7	Very low	51.3	Low	83 Å²	83	91.1 Å²	91.1	44%	0.444	43%	0.428	S	S	.	.			trans	-154.5	91.9	168.3	-151.8	-30.4	0	0	0	113.6	L144 L149 L150 E151	L144-N147 PolarHBondContact O-N 3.18Å; N147-L149 VanDerWaalsContact C-N 3.33Å; N147-L149 PolarHBondContact O-N 3Å; N147-L150 HydrophobicContact CB-CB 4.4Å; N147-L150 PolarHBondContact O-N 3.33Å; N147-L150 VanDerWaalsContact O-N 3.11Å; N147-E151 PolarHBondContact O-N 3.05Å
148	S	53.8	Low	51.6	Low	97 Å²	97	89.1 Å²	89.1	68%	0.678	42%	0.422	S	S	*	.	H	α-helix	trans	-59.2	-33.5	-167.8	56.2	0	0	0	0	115.3	Y152	S148-Y152 WeakPolarHBondContact O-CB 3.41Å; S148-Y152 PolarHBondContact O-N 3.37Å
149	L	48.6	Very low	51.6	Low	81 Å²	81	86.8 Å²	86.8	42%	0.424	41%	0.413	S	S	.	.	H	α-helix	trans	-73.3	-35.5	179.1	-165.1	73.2	0	0	0	112	N147 Y153	N147-L149 VanDerWaalsContact C-N 3.33Å; N147-L149 PolarHBondContact O-N 3Å; L149-Y153 HydrophobicContact CD1-CE2 4.36Å; L149-Y153 HydrophobicContact CG-CD2 4.47Å; L149-Y153 HydrophobicContact CG-CE2 4.11Å; L149-Y153 WeakPolarHBondContact O-CD2 3.46Å; L149-Y153 PolarHBondContact O-N 3.32Å
150	L	48.7	Very low	51.6	Low	54 Å²	54	83.8 Å²	83.8	28%	0.283	40%	0.401	S	S	.	.	H	α-helix	trans	-78	-36.7	177.6	-166.4	66.9	0	0	0	111.1	N147 Y152 Y153 F154 T222	N147-L150 HydrophobicContact CB-CB 4.4Å; N147-L150 PolarHBondContact O-N 3.33Å; N147-L150 VanDerWaalsContact O-N 3.11Å; L150-Y152 VanDerWaalsContact C-N 3.35Å; L150-Y153 PolarHBondContact O-N 3.11Å; L150-F154 WeakPolarHBondContact O-CB 3.3Å; L150-F154 PolarHBondContact O-N 3.3Å; L150-T222 HydrophobicContact CD2-CG2 3.92Å
151	E	50	Low	51.7	Low	37 Å²	37	83.7 Å²	83.7	17%	0.173	40%	0.401	C	S	.	.	H	α-helix	trans	-56.2	-47.4	169.7	179	167.4	-159.6	0	0	111.2	L144 N147 Y153 F154 L155	L144-E151 HydrophobicContact CB-CB 4.08Å; L144-E151 HydrophobicContact CB-CG 3.77Å; L144-E151 HydrophobicContact CD1-CG 4.12Å; N147-E151 PolarHBondContact O-N 3.05Å; E151-Y153 PolarHBondContact O-N 3.38Å; E151-F154 PolarHBondContact O-N 2.89Å; E151-L155 HydrophobicContact CG-CD1 3.69Å; E151-L155 HydrophobicContact CG-CG 4.29Å; E151-L155 WeakPolarHBondContact O-CB 3.36Å; E151-L155 VanDerWaalsContact O-CG 3.23Å; E151-L155 WeakPolarHBondContact O-CG 3.39Å; E151-L155 PolarHBondContact O-N 3.1Å
152	Y	51.9	Low	51.9	Low	140 Å²	140	80 Å²	80	55%	0.549	39%	0.389	S	S	.	.	H	α-helix	trans	-55.8	-51.9	176.7	177.4	-102.7	0	0	0	113.1	S148 L150 L155 L156	S148-Y152 WeakPolarHBondContact O-CB 3.41Å; S148-Y152 PolarHBondContact O-N 3.37Å; L150-Y152 VanDerWaalsContact C-N 3.35Å; Y152-L155 PolarHBondContact O-N 3.37Å; Y152-L156 HydrophobicContact CD1-CD1 4.07Å; Y152-L156 HydrophobicContact CE1-CD1 3.48Å; Y152-L156 VanDerWaalsContact CE1-CD1 3.48Å; Y152-L156 HydrophobicContact CE2-CD1 4.15Å; Y152-L156 PolarHBondContact O-N 2.98Å
153	Y	51.5	Low	51.8	Low	48 Å²	48	77.1 Å²	77.1	19%	0.188	38%	0.377	C	S	.	.	H	α-helix	trans	-67.7	-36.6	179.3	-72.7	-62.1	0	0	0	112.8	L149 L150 E151 L156 I157 L268	L149-Y153 HydrophobicContact CD1-CE2 4.36Å; L149-Y153 HydrophobicContact CG-CD2 4.47Å; L149-Y153 HydrophobicContact CG-CE2 4.11Å; L149-Y153 WeakPolarHBondContact O-CD2 3.46Å; L149-Y153 PolarHBondContact O-N 3.32Å; L150-Y153 PolarHBondContact O-N 3.11Å; E151-Y153 PolarHBondContact O-N 3.38Å; Y153-L156 WeakPolarHBondContact O-CB 3.49Å; Y153-L156 PolarHBondContact O-N 3.14Å; Y153-I157 WeakPolarHBondContact O-CD1 3.36Å; Y153-I157 WeakPolarHBondContact O-CG1 3.44Å; Y153-I157 PolarHBondContact O-N 2.85Å; Y153-L268 HydrophobicContact CE2-CD2 4.21Å
154	F	54.4	Low	52.1	Low	88 Å²	88	71.5 Å²	71.5	39%	0.386	35%	0.349	S	S	.	.	H	α-helix	trans	-67.4	-40.4	177.4	-164	-90.2	0	0	0	111.9	I140 L144 L150 E151 I157 L158	I140-F154 HydrophobicContact CG2-CD1 4.14Å; I140-F154 HydrophobicContact CG2-CE1 3.83Å; L144-F154 HydrophobicContact CD1-CD1 4.01Å; L150-F154 WeakPolarHBondContact O-CB 3.3Å; L150-F154 PolarHBondContact O-N 3.3Å; E151-F154 PolarHBondContact O-N 2.89Å; F154-I157 PolarHBondContact O-N 2.97Å; F154-L158 VanDerWaalsContact O-CB 3.31Å; F154-L158 WeakPolarHBondContact O-CB 3.3Å; F154-L158 PolarHBondContact O-N 2.78Å
155	L	56.8	Low	52.1	Low	38 Å²	38	73.9 Å²	73.9	20%	0.199	36%	0.362	C	S	.	.	H	α-helix	trans	-64.4	-39.2	173.5	-70.9	169.7	0	0	0	111.8	Y137 E151 Y152 L158 Q159	Y137-L155 HydrophobicContact CD2-CD2 4.47Å; Y137-L155 HydrophobicContact CE2-CD2 3.71Å; E151-L155 HydrophobicContact CG-CD1 3.69Å; E151-L155 HydrophobicContact CG-CG 4.29Å; E151-L155 WeakPolarHBondContact O-CB 3.36Å; E151-L155 VanDerWaalsContact O-CG 3.23Å; E151-L155 WeakPolarHBondContact O-CG 3.39Å; E151-L155 PolarHBondContact O-N 3.1Å; Y152-L155 PolarHBondContact O-N 3.37Å; L155-L158 PolarHBondContact O-N 2.78Å; L155-Q159 VanDerWaalsContact O-CB 3.31Å; L155-Q159 WeakPolarHBondContact O-CB 3.39Å; L155-Q159 PolarHBondContact O-N 3.39Å
156	L	55.2	Low	52.4	Low	55 Å²	55	69.8 Å²	69.8	29%	0.288	35%	0.347	S	S	.	.	H	α-helix	trans	-60.8	-48.1	173.6	-108.6	158.2	0	0	0	112.1	Y152 Y153 Q159 H160	Y152-L156 HydrophobicContact CD1-CD1 4.07Å; Y152-L156 HydrophobicContact CE1-CD1 3.48Å; Y152-L156 VanDerWaalsContact CE1-CD1 3.48Å; Y152-L156 HydrophobicContact CE2-CD1 4.15Å; Y152-L156 PolarHBondContact O-N 2.98Å; Y153-L156 WeakPolarHBondContact O-CB 3.49Å; Y153-L156 PolarHBondContact O-N 3.14Å; L156-Q159 PolarHBondContact O-N 2.67Å; L156-H160 PolarHBondContact O-CD2 2.96Å; L156-H160 PolarHBondContact O-N 2.97Å
157	I	56.5	Low	52.3	Low	45 Å²	45	67.3 Å²	67.3	23%	0.231	34%	0.338	C	S	.	.	H	α-helix	trans	-60.4	-48.1	176	-67.5	160.7	0	0	0	109.9	Y153 F154 Q159 H160 L161 L198	Y153-I157 WeakPolarHBondContact O-CD1 3.36Å; Y153-I157 WeakPolarHBondContact O-CG1 3.44Å; Y153-I157 PolarHBondContact O-N 2.85Å; F154-I157 PolarHBondContact O-N 2.97Å; I157-Q159 VanDerWaalsContact C-N 3.31Å; I157-Q159 PolarHBondContact O-N 3.07Å; I157-H160 PolarHBondContact O-N 3.17Å; I157-H160 VanDerWaalsContact O-N 3.16Å; I157-L161 HydrophobicContact CG2-CD1 4.14Å; I157-L161 HydrophobicContact CG2-CG 4.38Å; I157-L161 WeakPolarHBondContact O-CG 3.45Å; I157-L161 PolarHBondContact O-N 3.5Å; I157-L198 HydrophobicContact CG2-CD2 4.43Å
158	L	57.3	Low	52.1	Low	28 Å²	28	68.9 Å²	68.9	15%	0.147	35%	0.346	C	S	.	.	H	α-helix	trans	-61	-38.3	178.7	-168.6	68.1	0	0	0	112.3	Y137 I140 F154 L155 L161 L162	Y137-L158 HydrophobicContact CD2-CD2 4.01Å; I140-L158 HydrophobicContact CD1-CD1 4.37Å; I140-L158 HydrophobicContact CD1-CD2 3.95Å; I140-L158 HydrophobicContact CG2-CD2 4.25Å; F154-L158 VanDerWaalsContact O-CB 3.31Å; F154-L158 WeakPolarHBondContact O-CB 3.3Å; F154-L158 PolarHBondContact O-N 2.78Å; L155-L158 PolarHBondContact O-N 2.78Å; L158-L161 PolarHBondContact O-N 2.97Å; L158-L162 HydrophobicContact CG-CD1 4.29Å; L158-L162 WeakPolarHBondContact O-CB 3.25Å; L158-L162 WeakPolarHBondContact O-CG 3.48Å; L158-L162 PolarHBondContact O-N 2.95Å
159	Q	56	Low	51.6	Low	73 Å²	73	69.2 Å²	69.2	34%	0.341	34%	0.335	S	S	.	.	H	α-helix	trans	-65.2	-40.5	175.2	-167.3	-167	51.9	0	0	111.8	L155 L156 I157 K163	L155-Q159 VanDerWaalsContact O-CB 3.31Å; L155-Q159 WeakPolarHBondContact O-CB 3.39Å; L155-Q159 PolarHBondContact O-N 3.39Å; L156-Q159 PolarHBondContact O-N 2.67Å; I157-Q159 VanDerWaalsContact C-N 3.31Å; I157-Q159 PolarHBondContact O-N 3.07Å; Q159-K163 WeakPolarHBondContact O-CB 3.38Å; Q159-K163 WeakPolarHBondContact O-CG 3.42Å; Q159-K163 PolarHBondContact O-N 2.85Å
160	H	51.9	Low	51.2	Low	57 Å²	57	70.1 Å²	70.1	26%	0.264	34%	0.34	S	S	.	.	H	α-helix	trans	-66.9	-41.8	174.2	-86.1	-83.8	0	0	0	112.1	L156 I157 L162 K163 S164	L156-H160 PolarHBondContact O-CD2 2.96Å; L156-H160 PolarHBondContact O-N 2.97Å; I157-H160 PolarHBondContact O-N 3.17Å; I157-H160 VanDerWaalsContact O-N 3.16Å; H160-L162 PolarHBondContact O-N 2.57Å; H160-K163 PolarHBondContact O-N 2.94Å; H160-S164 PolarHBondContact O-N 3.07Å; H160-S164 PolarHBondContact O-OG 2.9Å
161	L	50.8	Low	50.6	Low	39 Å²	39	73.6 Å²	73.6	20%	0.204	36%	0.359	C	S	.	.	H	α-helix	trans	-60.7	-44.9	175.2	-67.2	179	0	0	0	111.6	I157 L158 S164 L165 W195	I157-L161 HydrophobicContact CG2-CD1 4.14Å; I157-L161 HydrophobicContact CG2-CG 4.38Å; I157-L161 WeakPolarHBondContact O-CG 3.45Å; I157-L161 PolarHBondContact O-N 3.5Å; L158-L161 PolarHBondContact O-N 2.97Å; L161-S164 WeakPolarHBondContact CA-OG 3.39Å; L161-S164 PolarHBondContact O-N 2.63Å; L161-S164 PolarHBondContact O-OG 3.02Å; L161-L165 WeakPolarHBondContact O-CG 3.16Å; L161-L165 PolarHBondContact O-N 2.7Å; L161-W195 HydrophobicContact CD1-CH2 4.33Å; L161-W195 HydrophobicContact CD1-CZ3 4.39Å; L161-W195 HydrophobicContact CD2-CH2 3.62Å; L161-W195 HydrophobicContact CD2-CZ2 3.85Å; L161-W195 HydrophobicContact CD2-CZ3 4.02Å; L161-W195 HydrophobicContact CG-CH2 4.45Å
162	L	54.8	Low	50	Low	44 Å²	44	76.1 Å²	76.1	23%	0.23	38%	0.381	C	S	.	.	H	α-helix	trans	-62.7	-43	174.9	-78.3	164.7	0	0	0	112.4	I133 L158 H160 S164 L165 I166	I133-L162 HydrophobicContact CG2-CD2 3.55Å; L158-L162 HydrophobicContact CG-CD1 4.29Å; L158-L162 WeakPolarHBondContact O-CB 3.25Å; L158-L162 WeakPolarHBondContact O-CG 3.48Å; L158-L162 PolarHBondContact O-N 2.95Å; H160-L162 PolarHBondContact O-N 2.57Å; L162-S164 VanDerWaalsContact C-N 3.34Å; L162-S164 PolarHBondContact O-N 2.81Å; L162-L165 PolarHBondContact O-N 2.76Å; L162-I166 VanDerWaalsContact O-CG1 3.29Å; L162-I166 WeakPolarHBondContact O-CG1 3.45Å; L162-I166 PolarHBondContact O-N 3.05Å
163	K	53.5	Low	49.1	Very low	104 Å²	104	76.8 Å²	76.8	45%	0.452	39%	0.391	S	S	.	.	H	α-helix	trans	-58.6	-43.1	173.7	-78	171.8	177.1	172.1	0	112	Q159 H160 I166 L167	Q159-K163 WeakPolarHBondContact O-CB 3.38Å; Q159-K163 WeakPolarHBondContact O-CG 3.42Å; Q159-K163 PolarHBondContact O-N 2.85Å; H160-K163 PolarHBondContact O-N 2.94Å; K163-I166 PolarHBondContact O-N 3.39Å; K163-L167 WeakPolarHBondContact O-CG 3.4Å; K163-L167 PolarHBondContact O-N 2.81Å
164	S	51.1	Low	48.2	Very low	24 Å²	24	80.5 Å²	80.5	17%	0.168	41%	0.414	C	S	.	.	H	α-helix	trans	-66	-37.8	176.1	46.7	0	0	0	0	113.4	H160 L161 L162 L167 L168	H160-S164 PolarHBondContact O-N 3.07Å; H160-S164 PolarHBondContact O-OG 2.9Å; L161-S164 WeakPolarHBondContact CA-OG 3.39Å; L161-S164 PolarHBondContact O-N 2.63Å; L161-S164 PolarHBondContact O-OG 3.02Å; L162-S164 VanDerWaalsContact C-N 3.34Å; L162-S164 PolarHBondContact O-N 2.81Å; S164-L167 PolarHBondContact O-N 3.09Å; S164-L168 WeakPolarHBondContact O-CG 3.29Å; S164-L168 PolarHBondContact O-N 2.9Å
165	L	48.6	Very low	47.1	Very low	92 Å²	92	85.7 Å²	85.7	48%	0.482	44%	0.44	S	S	.	.	H	α-helix	trans	-68.3	-36.3	175.9	-70.5	167.4	0	0	0	112.4	L161 L162 L168 K169	L161-L165 WeakPolarHBondContact O-CG 3.16Å; L161-L165 PolarHBondContact O-N 2.7Å; L162-L165 PolarHBondContact O-N 2.76Å; L165-L168 HydrophobicContact CD2-CD1 4.46Å; L165-L168 PolarHBondContact O-N 3Å; L165-K169 PolarHBondContact O-N 3.42Å; L165-K169 VanDerWaalsContact O-N 3.1Å
166	I	51.5	Low	45.8	Very low	85 Å²	85	92.7 Å²	92.7	44%	0.436	47%	0.468	S	S	.	.	H	α-helix	trans	-68.6	-40.1	174.8	-67.9	163.9	0	0	0	111.1	L162 K163 K169 N170	L162-I166 VanDerWaalsContact O-CG1 3.29Å; L162-I166 WeakPolarHBondContact O-CG1 3.45Å; L162-I166 PolarHBondContact O-N 3.05Å; K163-I166 PolarHBondContact O-N 3.39Å; I166-K169 PolarHBondContact O-N 2.95Å; I166-N170 PolarHBondContact O-N 3.44Å
167	L	47.4	Very low	44.7	Very low	101 Å²	101	99.9 Å²	99.9	53%	0.529	49%	0.493	S	S	.	.	H	α-helix	trans	-63.1	-40.1	174.6	-77.8	164.6	0	0	0	112.4	K163 S164 K169	K163-L167 WeakPolarHBondContact O-CG 3.4Å; K163-L167 PolarHBondContact O-N 2.81Å; S164-L167 PolarHBondContact O-N 3.09Å; L167-K169 VanDerWaalsContact C-N 3.35Å
168	L	43.8	Very low	43.4	Very low	117 Å²	117	106.5 Å²	106.5	61%	0.613	52%	0.523	S	S	*	.	H	α-helix	trans	-61.6	-40.9	173.1	-74.9	163.6	0	0	0	112	S164 L165	S164-L168 WeakPolarHBondContact O-CG 3.29Å; S164-L168 PolarHBondContact O-N 2.9Å; L165-L168 HydrophobicContact CD2-CD1 4.46Å; L165-L168 PolarHBondContact O-N 3Å
169	K	42.5	Very low	42.5	Very low	104 Å²	104	109.2 Å²	109.2	45%	0.452	54%	0.543	S	S	.	.	H	α-helix	trans	-72.6	-45.3	179.5	-173.6	-177.7	176.4	-173.1	0	113.4	S126 L165 I166 L167 N171 S172	S126-K169 PolarHBondContact OG-NZ 3.4Å; L165-K169 PolarHBondContact O-N 3.42Å; L165-K169 VanDerWaalsContact O-N 3.1Å; I166-K169 PolarHBondContact O-N 2.95Å; L167-K169 VanDerWaalsContact C-N 3.35Å; K169-N171 PolarHBondContact O-N 3.16Å; K169-S172 PolarHBondContact O-N 3.21Å; K169-S172 PolarHBondContact O-OG 3.29Å; K169-S172 VanDerWaalsContact O-OG 3.07Å
170	N	40.3	Very low	41.2	Very low	100 Å²	100	113.3 Å²	113.3	54%	0.535	57%	0.566	S	S	.	*	H	α-helix	trans	-67	-25.2	-170.7	-75.1	-0.2	0	0	0	113.1	I166	I166-N170 PolarHBondContact O-N 3.44Å
171	N	37.9	Very low	40.2	Very low	126 Å²	126	117.4 Å²	117.4	67%	0.674	59%	0.585	S	S	*	*	G	3₁₀ helix	trans	-79.9	-14.9	174.5	-70	-10.6	0	0	0	113.5	K169 M173	K169-N171 PolarHBondContact O-N 3.16Å; N171-M173 VanDerWaalsContact C-N 3.3Å; N171-M173 PolarHBondContact O-N 3.04Å
172	S	36.2	Very low	39.3	Very low	91 Å²	91	121.6 Å²	121.6	64%	0.636	61%	0.612	S	S	*	*	G	3₁₀ helix	trans	-82.7	-2.7	-179.4	85.9	0	0	0	0	114.4	K169	K169-S172 PolarHBondContact O-N 3.21Å; K169-S172 PolarHBondContact O-OG 3.29Å; K169-S172 VanDerWaalsContact O-OG 3.07Å
173	M	33.7	Very low	38.3	Very low	154 Å²	154	123.9 Å²	123.9	76%	0.759	63%	0.628	S	S	*	*	G	3₁₀ helix	trans	-98.2	-3.5	-179.1	-70.4	-66.5	-64.2	0	0	113.4	N171	N171-M173 VanDerWaalsContact C-N 3.3Å; N171-M173 PolarHBondContact O-N 3.04Å
174	N	31.8	Very low	37.3	Very low	125 Å²	125	122.7 Å²	122.7	67%	0.668	62%	0.621	S	S	*	*	S	Bend	trans	-119.3	132.3	-179	-77.9	-40.6	0	0	0	111.1
175	Q	32.7	Very low	36.6	Very low	198 Å²	198	127 Å²	127	93%	0.925	64%	0.642	S	S	*	*			trans	80	148.1	173.3	-54.5	176.4	-8.2	0	0	116.9
176	K	28.1	Very low	35.9	Very low	185 Å²	185	131.6 Å²	131.6	80%	0.804	65%	0.654	S	S	*	*			trans	-115.4	173.9	174.2	-67.9	-178.6	175.5	-177.5	0	108.6
177	Y	31.7	Very low	35.4	Very low	205 Å²	205	129.6 Å²	129.6	80%	0.804	64%	0.644	S	S	*	*			trans	95.7	170.8	173.5	-57.5	-69.2	0	0	0	116.6
178	E	30	Very low	35.1	Very low	184 Å²	184	127.6 Å²	127.6	86%	0.86	64%	0.636	S	S	*	*			trans	-106.4	172.3	-131	-93.2	-164.1	156.4	0	0	116.8
179	P	37.6	Very low	35	Very low	86 Å²	86	129.7 Å²	129.7	56%	0.558	64%	0.637	S	S	*	*			trans	-100.4	158.1	-155.3	38.1	-36.4	0	0	0	116.7
180	L	30.5	Very low	35.2	Very low	158 Å²	158	126.6 Å²	126.6	83%	0.827	63%	0.628	S	S	*	*			trans	-124.6	128.1	160.5	-85.8	164.6	0	0	0	109.5
181	H	29.9	Very low	35.6	Very low	143 Å²	143	125.2 Å²	125.2	66%	0.662	62%	0.62	S	S	*	*	S	Bend	trans	-96.9	-8.1	-152	-151.3	-76.3	0	0	0	116.3
182	T	31.7	Very low	36.1	Very low	127 Å²	127	122.9 Å²	122.9	78%	0.779	61%	0.607	S	S	*	*	S	Bend	trans	-88.7	-34.6	-174.7	34.7	0	0	0	0	114.5	Y184	T182-Y184 PolarHBondContact O-N 2.78Å; T182-Y184 VanDerWaalsContact O-N 3.16Å
183	T	34.8	Very low	36.9	Very low	93 Å²	93	121.5 Å²	121.5	57%	0.571	59%	0.594	S	S	*	*	H	α-helix	trans	-70.8	-8.8	179.7	-33	0	0	0	0	113.5	N187	T183-N187 PolarHBondContact O-ND2 3.22Å
184	Y	32.1	Very low	37.8	Very low	78 Å²	78	116.4 Å²	116.4	31%	0.306	57%	0.57	S	S	.	*	H	α-helix	trans	-71.6	-44	-173.2	-175	-120.9	0	0	0	113.3	T182 Y186 N244	T182-Y184 PolarHBondContact O-N 2.78Å; T182-Y184 VanDerWaalsContact O-N 3.16Å; Y184-Y186 PolarHBondContact O-N 3.14Å; Y184-N244 PolarHBondContact OH-O 3.15Å
185	I	35.1	Very low	38.7	Very low	116 Å²	116	115 Å²	115	60%	0.595	56%	0.555	S	S	*	*	H	α-helix	trans	-71.7	-34.6	-171.7	-59.8	174.8	0	0	0	112.2	N187 T188 Y189	I185-N187 VanDerWaalsContact C-N 3.34Å; I185-N187 PolarHBondContact O-N 2.89Å; I185-T188 PolarHBondContact O-OG1 2.88Å; I185-T188 VanDerWaalsContact O-OG1 3.05Å; I185-Y189 PolarHBondContact O-N 3.27Å
186	Y	35.1	Very low	39.6	Very low	188 Å²	188	112.5 Å²	112.5	74%	0.737	54%	0.541	S	S	*	.	H	α-helix	trans	-70.1	-30.9	-178	-130.6	-88.2	0	0	0	112.8	Y184 S190	Y184-Y186 PolarHBondContact O-N 3.14Å; Y186-S190 WeakPolarHBondContact O-CB 3.37Å; Y186-S190 PolarHBondContact O-N 3.12Å; Y186-S190 VanDerWaalsContact O-N 3.15Å; Y186-S190 PolarHBondContact O-OG 2.88Å
187	N	41.3	Very low	40.8	Very low	42 Å²	42	106.9 Å²	106.9	23%	0.225	52%	0.523	C	S	.	.	H	α-helix	trans	-75.5	-42.9	179.8	-78.4	-73.3	0	0	0	111.7	T183 I185 S190 I191 I250	T183-N187 PolarHBondContact O-ND2 3.22Å; I185-N187 VanDerWaalsContact C-N 3.34Å; I185-N187 PolarHBondContact O-N 2.89Å; N187-S190 PolarHBondContact O-N 2.87Å; N187-I191 WeakPolarHBondContact O-CG1 3.41Å; N187-I191 PolarHBondContact O-N 3.21Å; N187-I250 WeakPolarHBondContact O-CD1 3.47Å
188	T	39.5	Very low	41.8	Very low	60 Å²	60	98.4 Å²	98.4	37%	0.368	49%	0.491	S	S	.	.	H	α-helix	trans	-64.8	-43.4	176.7	50.2	0	0	0	0	111.8	I185 S190 I191 I192	I185-T188 PolarHBondContact O-OG1 2.88Å; I185-T188 VanDerWaalsContact O-OG1 3.05Å; T188-S190 VanDerWaalsContact C-N 3.32Å; T188-S190 PolarHBondContact O-N 2.92Å; T188-I191 PolarHBondContact O-N 2.93Å; T188-I192 WeakPolarHBondContact O-CG1 3.49Å; T188-I192 PolarHBondContact O-N 3.47Å
189	Y	43.4	Very low	42.9	Very low	161 Å²	161	91.7 Å²	91.7	63%	0.631	46%	0.461	S	S	*	.	H	α-helix	trans	-57.7	-44.5	173	-168.6	-92.4	0	0	0	111.9	I185 I191 I192 V193	I185-Y189 PolarHBondContact O-N 3.27Å; Y189-I191 PolarHBondContact O-N 3.26Å; Y189-I192 PolarHBondContact O-N 3.45Å; Y189-V193 HydrophobicContact CD1-CG2 3.85Å; Y189-V193 HydrophobicContact CE1-CG2 3.57Å; Y189-V193 WeakPolarHBondContact O-CG2 3.42Å; Y189-V193 PolarHBondContact O-N 2.9Å
190	S	45.4	Very low	43.6	Very low	38 Å²	38	92 Å²	92	27%	0.266	46%	0.455	S	S	.	.	H	α-helix	trans	-64.5	-37.9	180	-60.8	0	0	0	0	112.9	Y186 N187 T188 V193 I194 I250	Y186-S190 WeakPolarHBondContact O-CB 3.37Å; Y186-S190 PolarHBondContact O-N 3.12Å; Y186-S190 VanDerWaalsContact O-N 3.15Å; Y186-S190 PolarHBondContact O-OG 2.88Å; N187-S190 PolarHBondContact O-N 2.87Å; T188-S190 VanDerWaalsContact C-N 3.32Å; T188-S190 PolarHBondContact O-N 2.92Å; S190-V193 PolarHBondContact O-N 3Å; S190-I194 WeakPolarHBondContact O-CG1 3.37Å; S190-I194 PolarHBondContact O-N 3.31Å; S190-I194 VanDerWaalsContact O-N 3.11Å; S190-I250 VanDerWaalsContact CB-CD1 3.42Å
191	I	48.7	Very low	44.5	Very low	71 Å²	71	88.1 Å²	88.1	36%	0.364	43%	0.434	S	S	.	.	H	α-helix	trans	-63.7	-45.9	172	-68.6	168.9	0	0	0	110.3	N187 T188 Y189 V193 I194 W195 I250	N187-I191 WeakPolarHBondContact O-CG1 3.41Å; N187-I191 PolarHBondContact O-N 3.21Å; T188-I191 PolarHBondContact O-N 2.93Å; Y189-I191 PolarHBondContact O-N 3.26Å; I191-V193 VanDerWaalsContact C-N 3.34Å; I191-V193 PolarHBondContact O-N 2.87Å; I191-I194 PolarHBondContact O-N 3.39Å; I191-W195 PolarHBondContact O-N 3.11Å; I191-I250 HydrophobicContact CD1-CD1 4.49Å; I191-I250 HydrophobicContact CG1-CD1 3.78Å; I191-I250 HydrophobicContact CG1-CG1 4.09Å
192	I	49.1	Very low	45.5	Very low	77 Å²	77	82.5 Å²	82.5	40%	0.395	41%	0.411	S	S	.	.	H	α-helix	trans	-60.2	-42.9	178.4	-68.4	163.6	0	0	0	111.2	T188 Y189 I194 W195 K196	T188-I192 WeakPolarHBondContact O-CG1 3.49Å; T188-I192 PolarHBondContact O-N 3.47Å; Y189-I192 PolarHBondContact O-N 3.45Å; I192-I194 PolarHBondContact O-N 3.3Å; I192-W195 PolarHBondContact O-N 2.89Å; I192-K196 VanDerWaalsContact O-CB 3.22Å; I192-K196 WeakPolarHBondContact O-CB 3.39Å; I192-K196 PolarHBondContact O-N 2.99Å
193	V	52.3	Low	46.4	Very low	62 Å²	62	78.3 Å²	78.3	38%	0.376	38%	0.383	S	S	.	.	H	α-helix	trans	-61.3	-43.3	175.9	169.6	0	0	0	0	111.6	Y189 S190 I191 T197	Y189-V193 HydrophobicContact CD1-CG2 3.85Å; Y189-V193 HydrophobicContact CE1-CG2 3.57Å; Y189-V193 WeakPolarHBondContact O-CG2 3.42Å; Y189-V193 PolarHBondContact O-N 2.9Å; S190-V193 PolarHBondContact O-N 3Å; I191-V193 VanDerWaalsContact C-N 3.34Å; I191-V193 PolarHBondContact O-N 2.87Å; V193-T197 WeakPolarHBondContact O-CB 3.27Å; V193-T197 PolarHBondContact O-N 3.47Å; V193-T197 PolarHBondContact O-OG1 3.27Å
194	I	51.9	Low	47.2	Very low	47 Å²	47	78.8 Å²	78.8	24%	0.241	38%	0.381	C	S	.	.	H	α-helix	trans	-64.6	-47.9	177	-71.7	169.6	0	0	0	110.9	S190 I191 I192 K196 T197 L198 I250 Y254	S190-I194 WeakPolarHBondContact O-CG1 3.37Å; S190-I194 PolarHBondContact O-N 3.31Å; S190-I194 VanDerWaalsContact O-N 3.11Å; I191-I194 PolarHBondContact O-N 3.39Å; I192-I194 PolarHBondContact O-N 3.3Å; I194-K196 PolarHBondContact O-N 2.86Å; I194-T197 PolarHBondContact O-N 2.99Å; I194-L198 VanDerWaalsContact O-CB 3.31Å; I194-L198 WeakPolarHBondContact O-CB 3.22Å; I194-L198 PolarHBondContact O-N 2.89Å; I194-I250 HydrophobicContact CD1-CG2 3.22Å; I194-Y254 HydrophobicContact CD1-CD2 3.98Å; I194-Y254 HydrophobicContact CG1-CD2 4.18Å
195	W	52.7	Low	48.1	Very low	95 Å²	95	77.9 Å²	77.9	36%	0.36	38%	0.381	S	S	.	.	H	α-helix	trans	-61.3	-43.7	177.7	-86.8	80.9	0	0	0	112.3	L161 I191 I192 T197 L198 I199	L161-W195 HydrophobicContact CD1-CH2 4.33Å; L161-W195 HydrophobicContact CD1-CZ3 4.39Å; L161-W195 HydrophobicContact CD2-CH2 3.62Å; L161-W195 HydrophobicContact CD2-CZ2 3.85Å; L161-W195 HydrophobicContact CD2-CZ3 4.02Å; L161-W195 HydrophobicContact CG-CH2 4.45Å; I191-W195 PolarHBondContact O-N 3.11Å; I192-W195 PolarHBondContact O-N 2.89Å; W195-T197 VanDerWaalsContact C-N 3.33Å; W195-T197 PolarHBondContact O-N 3.28Å; W195-L198 PolarHBondContact O-N 3.43Å; W195-I199 WeakPolarHBondContact O-CB 3.3Å; W195-I199 WeakPolarHBondContact O-CG1 3.44Å; W195-I199 PolarHBondContact O-N 3.15Å
196	K	51.2	Low	48.9	Very low	147 Å²	147	73.4 Å²	73.4	64%	0.639	36%	0.358	S	S	*	.	H	α-helix	trans	-58.5	-45.2	174.7	-173.7	177.3	-178.6	-179.8	0	111.1	I192 I194 Q200	I192-K196 VanDerWaalsContact O-CB 3.22Å; I192-K196 WeakPolarHBondContact O-CB 3.39Å; I192-K196 PolarHBondContact O-N 2.99Å; I194-K196 PolarHBondContact O-N 2.86Å; K196-Q200 VanDerWaalsContact O-CB 3.3Å; K196-Q200 WeakPolarHBondContact O-CB 3.38Å; K196-Q200 PolarHBondContact O-N 3.27Å
197	T	52.2	Low	49.6	Very low	67 Å²	67	66.5 Å²	66.5	41%	0.411	34%	0.337	S	S	.	.	H	α-helix	trans	-66	-41.4	177.9	-56.1	0	0	0	0	112.1	V193 I194 W195 Q200 N201	V193-T197 WeakPolarHBondContact O-CB 3.27Å; V193-T197 PolarHBondContact O-N 3.47Å; V193-T197 PolarHBondContact O-OG1 3.27Å; I194-T197 PolarHBondContact O-N 2.99Å; W195-T197 VanDerWaalsContact C-N 3.33Å; W195-T197 PolarHBondContact O-N 3.28Å; T197-Q200 PolarHBondContact O-N 3.12Å; T197-N201 WeakPolarHBondContact O-CB 3.38Å; T197-N201 VanDerWaalsContact O-CG 3.28Å; T197-N201 PolarHBondContact O-N 3.21Å
198	L	53.5	Low	49.8	Very low	27 Å²	27	67.4 Å²	67.4	14%	0.141	35%	0.347	C	S	.	.	H	α-helix	trans	-66	-43.1	-179.9	-157.5	156.9	0	0	0	110.9	I157 I194 W195 N201 C202 F257	I157-L198 HydrophobicContact CG2-CD2 4.43Å; I194-L198 VanDerWaalsContact O-CB 3.31Å; I194-L198 WeakPolarHBondContact O-CB 3.22Å; I194-L198 PolarHBondContact O-N 2.89Å; W195-L198 PolarHBondContact O-N 3.43Å; L198-N201 PolarHBondContact O-N 3.16Å; L198-C202 WeakPolarHBondContact O-CB 3.5Å; L198-C202 PolarHBondContact O-N 3.07Å; L198-C202 PolarHBondContact O-SG 2.98Å; L198-F257 HydrophobicContact CD1-CD1 4.44Å; L198-F257 HydrophobicContact CD1-CD2 4.2Å; L198-F257 HydrophobicContact CD1-CE1 4Å; L198-F257 HydrophobicContact CD1-CE2 3.72Å; L198-F257 HydrophobicContact CD1-CZ 3.62Å; L198-F257 HydrophobicContact CD2-CZ 4.29Å; L198-F257 HydrophobicContact CG-CE1 4.14Å; L198-F257 HydrophobicContact CG-CE2 4.19Å; L198-F257 HydrophobicContact CG-CZ 3.67Å
199	I	53	Low	50.2	Low	43 Å²	43	67.8 Å²	67.8	22%	0.221	35%	0.346	C	S	.	.	H	α-helix	trans	-64.2	-42.3	172.4	-67.8	167.8	0	0	0	111.2	W195 C202 H203 K230	W195-I199 WeakPolarHBondContact O-CB 3.3Å; W195-I199 WeakPolarHBondContact O-CG1 3.44Å; W195-I199 PolarHBondContact O-N 3.15Å; I199-C202 PolarHBondContact O-N 2.7Å; I199-H203 WeakPolarHBondContact O-CB 3.46Å; I199-H203 PolarHBondContact O-N 3.01Å; I199-K230 HydrophobicContact CG2-CD 4.02Å; I199-K230 HydrophobicContact CG2-CG 4Å
200	Q	52.8	Low	50.1	Low	93 Å²	93	65 Å²	65	44%	0.435	34%	0.337	S	S	.	.	H	α-helix	trans	-63.5	-44	178.3	-162.6	79.2	-17.8	0	0	111.4	K196 T197 H203 L204	K196-Q200 VanDerWaalsContact O-CB 3.3Å; K196-Q200 WeakPolarHBondContact O-CB 3.38Å; K196-Q200 PolarHBondContact O-N 3.27Å; T197-Q200 PolarHBondContact O-N 3.12Å; Q200-H203 WeakPolarHBondContact O-CB 3.25Å; Q200-H203 PolarHBondContact O-N 3.34Å; Q200-L204 HydrophobicContact CG-CD1 4.43Å; Q200-L204 WeakPolarHBondContact O-CG 3.44Å; Q200-L204 PolarHBondContact O-N 3.25Å
201	N	49.7	Very low	50.1	Low	75 Å²	75	68 Å²	68	40%	0.401	35%	0.354	S	S	.	.	H	α-helix	trans	-67.7	-38.9	177.9	-72.1	-12.3	0	0	0	112.4	T197 L198 H203 L204 L205	T197-N201 WeakPolarHBondContact O-CB 3.38Å; T197-N201 VanDerWaalsContact O-CG 3.28Å; T197-N201 PolarHBondContact O-N 3.21Å; L198-N201 PolarHBondContact O-N 3.16Å; N201-H203 VanDerWaalsContact C-N 3.33Å; N201-L204 PolarHBondContact O-N 3.22Å; N201-L205 WeakPolarHBondContact O-CB 3.48Å; N201-L205 PolarHBondContact O-N 2.95Å
202	C	50.5	Low	49.9	Very low	25 Å²	25	68.9 Å²	68.9	17%	0.169	36%	0.359	C	S	.	.	H	α-helix	trans	-65	-38	172.5	-66.7	0	0	0	0	111.8	L198 I199 L205 I206	L198-C202 WeakPolarHBondContact O-CB 3.5Å; L198-C202 PolarHBondContact O-N 3.07Å; L198-C202 PolarHBondContact O-SG 2.98Å; I199-C202 PolarHBondContact O-N 2.7Å; C202-L205 PolarHBondContact O-N 3.41Å; C202-I206 WeakPolarHBondContact O-CD1 3.45Å; C202-I206 VanDerWaalsContact O-CG1 3.28Å; C202-I206 WeakPolarHBondContact O-CG1 3.44Å; C202-I206 PolarHBondContact O-N 2.99Å
203	H	50.3	Low	49.8	Very low	40 Å²	40	69.2 Å²	69.2	19%	0.185	36%	0.359	C	S	.	.	H	α-helix	trans	-66	-44.7	175.1	-170.1	79.6	0	0	0	111.7	I199 Q200 N201 L205 I206 C207	I199-H203 WeakPolarHBondContact O-CB 3.46Å; I199-H203 PolarHBondContact O-N 3.01Å; Q200-H203 WeakPolarHBondContact O-CB 3.25Å; Q200-H203 PolarHBondContact O-N 3.34Å; N201-H203 VanDerWaalsContact C-N 3.33Å; H203-L205 PolarHBondContact O-N 3.38Å; H203-I206 PolarHBondContact O-N 3.49Å; H203-C207 WeakPolarHBondContact O-CB 3.47Å; H203-C207 PolarHBondContact O-N 3.22Å; H203-C207 PolarHBondContact O-SG 2.87Å; H203-C207 VanDerWaalsContact O-SG 3.37Å
204	L	51.9	Low	49.5	Very low	102 Å²	102	73.6 Å²	73.6	53%	0.534	38%	0.375	S	S	.	.	H	α-helix	trans	-61.8	-40.6	174.2	-73.1	168.4	0	0	0	112	Q200 N201 C207 S208	Q200-L204 HydrophobicContact CG-CD1 4.43Å; Q200-L204 WeakPolarHBondContact O-CG 3.44Å; Q200-L204 PolarHBondContact O-N 3.25Å; N201-L204 PolarHBondContact O-N 3.22Å; L204-C207 PolarHBondContact O-N 2.89Å; L204-S208 WeakPolarHBondContact O-CB 3.44Å; L204-S208 PolarHBondContact O-N 2.95Å
205	L	50.3	Low	49.3	Very low	60 Å²	60	79.3 Å²	79.3	31%	0.314	41%	0.406	S	S	.	.	H	α-helix	trans	-61.5	-48.1	175.5	-174.4	68.3	0	0	0	111.3	N201 C202 H203 S208 I209 L268	N201-L205 WeakPolarHBondContact O-CB 3.48Å; N201-L205 PolarHBondContact O-N 2.95Å; C202-L205 PolarHBondContact O-N 3.41Å; H203-L205 PolarHBondContact O-N 3.38Å; L205-S208 PolarHBondContact O-N 3.11Å; L205-S208 PolarHBondContact O-OG 3.27Å; L205-I209 PolarHBondContact O-N 3.47Å; L205-L268 HydrophobicContact CD1-CD1 4.33Å
206	I	51.9	Low	49.3	Very low	21 Å²	21	77.2 Å²	77.2	11%	0.108	40%	0.402	C	S	.	.	H	α-helix	trans	-61.8	-46.7	176.4	-66	164.1	0	0	0	110.3	C202 H203 S208 I209 Y219 L223 V226	C202-I206 WeakPolarHBondContact O-CD1 3.45Å; C202-I206 VanDerWaalsContact O-CG1 3.28Å; C202-I206 WeakPolarHBondContact O-CG1 3.44Å; C202-I206 PolarHBondContact O-N 2.99Å; H203-I206 PolarHBondContact O-N 3.49Å; I206-S208 VanDerWaalsContact C-N 3.29Å; I206-S208 PolarHBondContact O-N 3.16Å; I206-I209 WeakPolarHBondContact O-CB 3.31Å; I206-I209 PolarHBondContact O-N 3.35Å; I206-I209 VanDerWaalsContact O-N 3.1Å; I206-Y219 HydrophobicContact CG2-CE2 4.02Å; I206-Y219 PolarHBondContact O-OH 3.4Å; I206-L223 HydrophobicContact CG2-CD1 3.77Å; I206-V226 HydrophobicContact CD1-CG1 4.11Å; I206-V226 HydrophobicContact CD1-CG2 4.07Å
207	C	49.3	Very low	49.2	Very low	43 Å²	43	75.9 Å²	75.9	29%	0.291	40%	0.402	S	S	.	.	H	α-helix	trans	-64.9	-28.1	177.6	-72.3	0	0	0	0	113.5	H203 L204 I209 K210	H203-C207 WeakPolarHBondContact O-CB 3.47Å; H203-C207 PolarHBondContact O-N 3.22Å; H203-C207 PolarHBondContact O-SG 2.87Å; H203-C207 VanDerWaalsContact O-SG 3.37Å; L204-C207 PolarHBondContact O-N 2.89Å; C207-I209 VanDerWaalsContact C-N 3.26Å; C207-I209 PolarHBondContact O-N 2.8Å; C207-K210 WeakPolarHBondContact O-CB 3.36Å; C207-K210 PolarHBondContact O-N 2.73Å; C207-K210 VanDerWaalsContact O-N 3.17Å
208	S	46.8	Very low	48.9	Very low	62 Å²	62	75.6 Å²	75.6	43%	0.434	40%	0.398	S	S	.	.	H	α-helix	trans	-69.8	-21.7	174.2	75.1	0	0	0	0	113.3	L204 L205 I206 K210 T211	L204-S208 WeakPolarHBondContact O-CB 3.44Å; L204-S208 PolarHBondContact O-N 2.95Å; L205-S208 PolarHBondContact O-N 3.11Å; L205-S208 PolarHBondContact O-OG 3.27Å; I206-S208 VanDerWaalsContact C-N 3.29Å; I206-S208 PolarHBondContact O-N 3.16Å; S208-K210 VanDerWaalsContact C-N 3.28Å; S208-T211 PolarHBondContact O-OG1 3.23Å
209	I	47.5	Very low	48.5	Very low	67 Å²	67	75.3 Å²	75.3	34%	0.344	40%	0.395	S	S	.	.	H	α-helix	trans	-77.5	-15.7	174	-63.7	164.4	0	0	0	111.3	L205 I206 C207 T211 N212 Y219	L205-I209 PolarHBondContact O-N 3.47Å; I206-I209 WeakPolarHBondContact O-CB 3.31Å; I206-I209 PolarHBondContact O-N 3.35Å; I206-I209 VanDerWaalsContact O-N 3.1Å; C207-I209 VanDerWaalsContact C-N 3.26Å; C207-I209 PolarHBondContact O-N 2.8Å; I209-T211 PolarHBondContact O-N 3.24Å; I209-T211 VanDerWaalsContact O-N 3.1Å; I209-N212 PolarHBondContact O-N 3.1Å; I209-N212 VanDerWaalsContact O-N 3.1Å; I209-Y219 HydrophobicContact CB-CE2 4.36Å; I209-Y219 HydrophobicContact CG2-CE2 4.28Å
210	K	41.7	Very low	48.2	Very low	102 Å²	102	77.2 Å²	77.2	44%	0.443	40%	0.401	S	S	.	.	G	3₁₀ helix	trans	-57.7	-26.8	-178.3	-160.3	175.6	-178.5	-173.2	0	113.4	C207 S208 N212 Y219	C207-K210 WeakPolarHBondContact O-CB 3.36Å; C207-K210 PolarHBondContact O-N 2.73Å; C207-K210 VanDerWaalsContact O-N 3.17Å; S208-K210 VanDerWaalsContact C-N 3.28Å; K210-N212 PolarHBondContact O-N 3.22Å; K210-Y219 HydrophobicContact CB-CE1 4.33Å; K210-Y219 WeakPolarHBondContact CB-OH 3.29Å; K210-Y219 HydrophobicContact CG-CE1 4.03Å
211	T	44.1	Very low	48.1	Very low	103 Å²	103	78.3 Å²	78.3	63%	0.632	41%	0.405	S	S	*	.	G	3₁₀ helix	trans	-65.6	-19.9	178.8	59	0	0	0	0	114	S208 I209	S208-T211 PolarHBondContact O-OG1 3.23Å; I209-T211 PolarHBondContact O-N 3.24Å; I209-T211 VanDerWaalsContact O-N 3.1Å
212	N	46.1	Very low	48	Very low	88 Å²	88	77.2 Å²	77.2	47%	0.471	40%	0.401	S	S	.	.	G	3₁₀ helix	trans	-107	-8.5	-173.3	-69.7	28.6	0	0	0	113.7	I209 K210	I209-N212 PolarHBondContact O-N 3.1Å; I209-N212 VanDerWaalsContact O-N 3.1Å; K210-N212 PolarHBondContact O-N 3.22Å
213	H	46.3	Very low	48	Very low	85 Å²	85	76.6 Å²	76.6	39%	0.394	40%	0.396	S	S	.	.			trans	-144.6	49.5	-168.9	-72.7	-33.2	0	0	0	114.1	N215 N216	H213-N215 PolarHBondContact O-N 3.29Å; H213-N215 VanDerWaalsContact O-N 3.16Å; H213-N216 HydrophobicContact CB-CB 4.05Å; H213-N216 PolarHBondContact O-N 3.46Å
214	Q	45.4	Very low	48.1	Very low	154 Å²	154	79 Å²	79	72%	0.72	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-30	177.2	-77.4	174.9	-61.2	0	0	114	F220	Q214-F220 WeakPolarHBondContact O-CE2 3.49Å
215	N	47.8	Very low	47.9	Very low	166 Å²	166	77.6 Å²	77.6	89%	0.888	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.8	13.6	-175.1	-65.3	-0.6	0	0	0	114.9	H213 L217	H213-N215 PolarHBondContact O-N 3.29Å; H213-N215 VanDerWaalsContact O-N 3.16Å; N215-L217 PolarHBondContact O-N 3.21Å
216	N	52.6	Low	47.7	Very low	52 Å²	52	76.5 Å²	76.5	28%	0.278	40%	0.401	S	S	.	.			trans	-94.3	101.8	-176.7	-167.2	-30.1	0	0	0	112.5	H213 N218 Y219 F220	H213-N216 HydrophobicContact CB-CB 4.05Å; H213-N216 PolarHBondContact O-N 3.46Å; N216-N218 PolarHBondContact O-N 3.04Å; N216-N218 VanDerWaalsContact O-N 3.16Å; N216-N218 WeakPolarHBondContact OD1-CB 3.4Å; N216-N218 PolarHBondContact OD1-N 2.99Å; N216-Y219 WeakPolarHBondContact O-CB 2.98Å; N216-Y219 PolarHBondContact O-N 3.48Å; N216-Y219 PolarHBondContact OD1-N 3.08Å; N216-F220 PolarHBondContact O-N 3.1Å
217	L	49.5	Very low	47.5	Very low	119 Å²	119	79.7 Å²	79.7	62%	0.623	42%	0.416	S	S	*	.	H	α-helix	trans	-55.6	-33.2	179.3	-173	68.1	0	0	0	113.4	N215 F220 K221	N215-L217 PolarHBondContact O-N 3.21Å; L217-F220 PolarHBondContact O-N 3.47Å; L217-K221 WeakPolarHBondContact O-CG 3.26Å; L217-K221 PolarHBondContact O-N 2.9Å
218	N	46.1	Very low	47.5	Very low	61 Å²	61	85.3 Å²	85.3	33%	0.326	44%	0.435	S	S	.	.	H	α-helix	trans	-73.1	-32.4	177.8	-77.3	-13.5	0	0	0	112.3	Q146 N216 K221 T222	Q146-N218 PolarHBondContact OE1-ND2 3.39Å; N216-N218 PolarHBondContact O-N 3.04Å; N216-N218 VanDerWaalsContact O-N 3.16Å; N216-N218 WeakPolarHBondContact OD1-CB 3.4Å; N216-N218 PolarHBondContact OD1-N 2.99Å; N218-K221 PolarHBondContact O-N 3.43Å; N218-T222 PolarHBondContact O-N 2.97Å; N218-T222 PolarHBondContact O-OG1 3.34Å
219	Y	45.9	Very low	47.1	Very low	21 Å²	21	90.2 Å²	90.2	8%	0.082	45%	0.445	C	S	.	.	H	α-helix	trans	-61.6	-45.2	172.3	171.3	-92.1	0	0	0	111.1	I206 I209 K210 N216 T222 L223	I206-Y219 HydrophobicContact CG2-CE2 4.02Å; I206-Y219 PolarHBondContact O-OH 3.4Å; I209-Y219 HydrophobicContact CB-CE2 4.36Å; I209-Y219 HydrophobicContact CG2-CE2 4.28Å; K210-Y219 HydrophobicContact CB-CE1 4.33Å; K210-Y219 WeakPolarHBondContact CB-OH 3.29Å; K210-Y219 HydrophobicContact CG-CE1 4.03Å; N216-Y219 WeakPolarHBondContact O-CB 2.98Å; N216-Y219 PolarHBondContact O-N 3.48Å; N216-Y219 PolarHBondContact OD1-N 3.08Å; Y219-T222 PolarHBondContact O-N 3.38Å; Y219-L223 HydrophobicContact CE1-CD2 4.46Å; Y219-L223 WeakPolarHBondContact O-CB 3.47Å; Y219-L223 PolarHBondContact O-N 3.07Å
220	F	46.7	Very low	46.8	Very low	82 Å²	82	89.8 Å²	89.8	36%	0.36	44%	0.441	S	S	.	.	H	α-helix	trans	-64.1	-41.9	175	-80.5	-84.9	0	0	0	113	Q214 N216 L217 T222 L223 N224	Q214-F220 WeakPolarHBondContact O-CE2 3.49Å; N216-F220 PolarHBondContact O-N 3.1Å; L217-F220 PolarHBondContact O-N 3.47Å; F220-T222 VanDerWaalsContact C-N 3.31Å; F220-T222 PolarHBondContact O-N 2.9Å; F220-L223 PolarHBondContact O-N 3.11Å; F220-N224 WeakPolarHBondContact O-CB 3.38Å; F220-N224 PolarHBondContact O-N 3.25Å; F220-N224 PolarHBondContact O-OD1 3.12Å
221	K	50.2	Low	46.8	Very low	117 Å²	117	88.5 Å²	88.5	51%	0.509	45%	0.445	S	S	.	.	H	α-helix	trans	-58.8	-42	172.9	-74.2	173.6	-179.9	173.7	0	111.9	L217 N218 T225	L217-K221 WeakPolarHBondContact O-CG 3.26Å; L217-K221 PolarHBondContact O-N 2.9Å; N218-K221 PolarHBondContact O-N 3.43Å; K221-T225 VanDerWaalsContact O-CB 3.29Å; K221-T225 WeakPolarHBondContact O-CB 3.48Å; K221-T225 PolarHBondContact O-N 2.93Å; K221-T225 PolarHBondContact O-OG1 3.37Å
222	T	46.9	Very low	46.6	Very low	51 Å²	51	90 Å²	90	31%	0.313	44%	0.443	S	S	.	.	H	α-helix	trans	-67.1	-43.6	176.1	-57	0	0	0	0	111.9	L150 N218 Y219 F220 T225 V226	L150-T222 HydrophobicContact CD2-CG2 3.92Å; N218-T222 PolarHBondContact O-N 2.97Å; N218-T222 PolarHBondContact O-OG1 3.34Å; Y219-T222 PolarHBondContact O-N 3.38Å; F220-T222 VanDerWaalsContact C-N 3.31Å; F220-T222 PolarHBondContact O-N 2.9Å; T222-T225 WeakPolarHBondContact O-CB 3.46Å; T222-T225 PolarHBondContact O-N 3.22Å; T222-V226 WeakPolarHBondContact O-CG2 3.29Å; T222-V226 PolarHBondContact O-N 3.24Å
223	L	51.4	Low	46.4	Very low	13 Å²	13	88.2 Å²	88.2	7%	0.068	44%	0.438	C	S	.	.	H	α-helix	trans	-59.6	-49.9	177.4	-173.5	71.3	0	0	0	111.5	I206 Y219 F220 T225 V226 Q227	I206-L223 HydrophobicContact CG2-CD1 3.77Å; Y219-L223 HydrophobicContact CE1-CD2 4.46Å; Y219-L223 WeakPolarHBondContact O-CB 3.47Å; Y219-L223 PolarHBondContact O-N 3.07Å; F220-L223 PolarHBondContact O-N 3.11Å; L223-T225 VanDerWaalsContact C-N 3.29Å; L223-T225 PolarHBondContact O-N 3.23Å; L223-V226 PolarHBondContact O-N 3.06Å; L223-Q227 PolarHBondContact O-N 3.25Å
224	N	51	Low	46	Very low	91 Å²	91	88.6 Å²	88.6	49%	0.487	44%	0.442	S	S	.	.	H	α-helix	trans	-63.6	-35.4	177.3	-70.1	6.5	0	0	0	111.5	F220 Q227 K228	F220-N224 WeakPolarHBondContact O-CB 3.38Å; F220-N224 PolarHBondContact O-N 3.25Å; F220-N224 PolarHBondContact O-OD1 3.12Å; N224-Q227 PolarHBondContact O-N 3.38Å; N224-K228 VanDerWaalsContact O-CB 3.26Å; N224-K228 WeakPolarHBondContact O-CB 3.29Å; N224-K228 PolarHBondContact O-N 2.91Å
225	T	49	Very low	45.8	Very low	72 Å²	72	86.5 Å²	86.5	44%	0.442	44%	0.435	S	S	.	.	H	α-helix	trans	-65.2	-44.9	174.3	-61	0	0	0	0	111.3	K221 T222 L223 K228 Y229	K221-T225 VanDerWaalsContact O-CB 3.29Å; K221-T225 WeakPolarHBondContact O-CB 3.48Å; K221-T225 PolarHBondContact O-N 2.93Å; K221-T225 PolarHBondContact O-OG1 3.37Å; T222-T225 WeakPolarHBondContact O-CB 3.46Å; T222-T225 PolarHBondContact O-N 3.22Å; L223-T225 VanDerWaalsContact C-N 3.29Å; L223-T225 PolarHBondContact O-N 3.23Å; T225-K228 PolarHBondContact O-N 3.41Å; T225-Y229 HydrophobicContact CG2-CD2 3.78Å; T225-Y229 HydrophobicContact CG2-CE2 3.75Å; T225-Y229 VanDerWaalsContact O-CD2 3.27Å; T225-Y229 WeakPolarHBondContact O-CD2 3.3Å; T225-Y229 PolarHBondContact O-N 2.96Å
226	V	45.7	Very low	45.3	Very low	36 Å²	36	83 Å²	83	22%	0.218	42%	0.417	C	S	.	.	H	α-helix	trans	-65.1	-38.4	176.4	170	0	0	0	0	111.6	I206 T222 L223 Y229 K230	I206-V226 HydrophobicContact CD1-CG1 4.11Å; I206-V226 HydrophobicContact CD1-CG2 4.07Å; T222-V226 WeakPolarHBondContact O-CG2 3.29Å; T222-V226 PolarHBondContact O-N 3.24Å; L223-V226 PolarHBondContact O-N 3.06Å; V226-Y229 PolarHBondContact O-N 3.11Å; V226-K230 WeakPolarHBondContact O-CB 3.49Å; V226-K230 PolarHBondContact O-N 2.97Å
227	Q	47.9	Very low	44.4	Very low	88 Å²	88	84.5 Å²	84.5	41%	0.411	42%	0.424	S	S	.	.	H	α-helix	trans	-64.6	-43	172.3	-74.6	174.9	-37	0	0	112.2	L223 N224 Y229 K230 S231	L223-Q227 PolarHBondContact O-N 3.25Å; N224-Q227 PolarHBondContact O-N 3.38Å; Q227-Y229 VanDerWaalsContact C-N 3.32Å; Q227-Y229 PolarHBondContact O-N 3.17Å; Q227-K230 WeakPolarHBondContact O-CB 3.34Å; Q227-K230 PolarHBondContact O-N 3.49Å; Q227-K230 VanDerWaalsContact O-N 3.14Å; Q227-S231 PolarHBondContact O-N 2.93Å; Q227-S231 VanDerWaalsContact O-N 3.08Å; Q227-S231 PolarHBondContact O-OG 3.27Å
228	K	48.5	Very low	43.7	Very low	161 Å²	161	82.4 Å²	82.4	70%	0.7	42%	0.419	S	S	*	.	H	α-helix	trans	-64.4	-33.2	176.6	-173.6	171.2	-176.6	171	0	112.9	N224 T225 S231 K232	N224-K228 VanDerWaalsContact O-CB 3.26Å; N224-K228 WeakPolarHBondContact O-CB 3.29Å; N224-K228 PolarHBondContact O-N 2.91Å; T225-K228 PolarHBondContact O-N 3.41Å; K228-S231 PolarHBondContact O-OG 2.89Å; K228-K232 PolarHBondContact O-N 3.17Å
229	Y	38.7	Very low	43.2	Very low	165 Å²	165	85.2 Å²	85.2	65%	0.647	43%	0.434	S	S	*	.	H	α-helix	trans	-77.6	-32.7	170.3	-80	-69.3	0	0	0	112.9	T225 V226 Q227 S231 K232 S233	T225-Y229 HydrophobicContact CG2-CD2 3.78Å; T225-Y229 HydrophobicContact CG2-CE2 3.75Å; T225-Y229 VanDerWaalsContact O-CD2 3.27Å; T225-Y229 WeakPolarHBondContact O-CD2 3.3Å; T225-Y229 PolarHBondContact O-N 2.96Å; V226-Y229 PolarHBondContact O-N 3.11Å; Q227-Y229 VanDerWaalsContact C-N 3.32Å; Q227-Y229 PolarHBondContact O-N 3.17Å; Y229-S231 PolarHBondContact O-N 3.16Å; Y229-K232 PolarHBondContact O-N 3.16Å; Y229-S233 VanDerWaalsContact O-CB 3.28Å; Y229-S233 WeakPolarHBondContact O-CB 3.2Å; Y229-S233 PolarHBondContact O-N 2.93Å; Y229-S233 PolarHBondContact O-OG 3.46Å
230	K	41.4	Very low	42.6	Very low	59 Å²	59	92.3 Å²	92.3	26%	0.257	47%	0.466	S	S	.	.	H	α-helix	trans	-59.4	-44.3	174.1	-179.1	175.9	-176.1	175.8	0	111.9	I199 V226 Q227 S233 L234	I199-K230 HydrophobicContact CG2-CD 4.02Å; I199-K230 HydrophobicContact CG2-CG 4Å; V226-K230 WeakPolarHBondContact O-CB 3.49Å; V226-K230 PolarHBondContact O-N 2.97Å; Q227-K230 WeakPolarHBondContact O-CB 3.34Å; Q227-K230 PolarHBondContact O-N 3.49Å; Q227-K230 VanDerWaalsContact O-N 3.14Å; K230-S233 PolarHBondContact O-OG 2.92Å; K230-L234 HydrophobicContact CG-CD1 4.38Å; K230-L234 WeakPolarHBondContact O-CD1 3.45Å; K230-L234 VanDerWaalsContact O-CG 3.26Å; K230-L234 WeakPolarHBondContact O-CG 3.35Å; K230-L234 PolarHBondContact O-N 3.26Å
231	S	41.4	Very low	42	Very low	75 Å²	75	94.1 Å²	94.1	52%	0.524	48%	0.478	S	S	.	.	H	α-helix	trans	-69.8	-44.4	176.6	54.8	0	0	0	0	112.2	Q227 K228 Y229 L234 L235	Q227-S231 PolarHBondContact O-N 2.93Å; Q227-S231 VanDerWaalsContact O-N 3.08Å; Q227-S231 PolarHBondContact O-OG 3.27Å; K228-S231 PolarHBondContact O-OG 2.89Å; Y229-S231 PolarHBondContact O-N 3.16Å; S231-L234 PolarHBondContact O-N 3.47Å; S231-L235 PolarHBondContact O-N 3.49Å
232	K	40.5	Very low	41	Very low	133 Å²	133	95.5 Å²	95.5	58%	0.578	49%	0.491	S	S	*	.	H	α-helix	trans	-73.9	-28.5	-177.3	-166.4	147.1	-173.2	161.3	0	114.2	K228 Y229 N236	K228-K232 PolarHBondContact O-N 3.17Å; Y229-K232 PolarHBondContact O-N 3.16Å; K232-N236 WeakPolarHBondContact O-CB 3.24Å; K232-N236 PolarHBondContact O-N 2.65Å; K232-N236 PolarHBondContact O-OD1 2.98Å
233	S	40.7	Very low	40	Very low	52 Å²	52	102.3 Å²	102.3	36%	0.364	51%	0.512	S	S	.	.	H	α-helix	trans	-72.9	-37.6	173.9	66.1	0	0	0	0	112.3	Y229 K230 N236 L237	Y229-S233 VanDerWaalsContact O-CB 3.28Å; Y229-S233 WeakPolarHBondContact O-CB 3.2Å; Y229-S233 PolarHBondContact O-N 2.93Å; Y229-S233 PolarHBondContact O-OG 3.46Å; K230-S233 PolarHBondContact O-OG 2.92Å; S233-N236 PolarHBondContact O-N 3.38Å; S233-L237 WeakPolarHBondContact O-CB 3.34Å; S233-L237 PolarHBondContact O-N 2.71Å
234	L	39.3	Very low	39	Very low	93 Å²	93	108.1 Å²	108.1	49%	0.487	54%	0.543	S	S	.	.	H	α-helix	trans	-62.8	-44	173.5	-72.3	169.8	0	0	0	111.7	K230 S231 L237 S238	K230-L234 HydrophobicContact CG-CD1 4.38Å; K230-L234 WeakPolarHBondContact O-CD1 3.45Å; K230-L234 VanDerWaalsContact O-CG 3.26Å; K230-L234 WeakPolarHBondContact O-CG 3.35Å; K230-L234 PolarHBondContact O-N 3.26Å; S231-L234 PolarHBondContact O-N 3.47Å; L234-L237 PolarHBondContact O-N 2.67Å; L234-S238 PolarHBondContact O-N 3.37Å; L234-S238 VanDerWaalsContact O-N 3.15Å
235	L	40.4	Very low	38	Very low	109 Å²	109	108.8 Å²	108.8	57%	0.571	55%	0.546	S	S	*	.	H	α-helix	trans	-63.9	-44.4	176.4	-170	68.2	0	0	0	112.1	S231 L237 S238 N239	S231-L235 PolarHBondContact O-N 3.49Å; L235-L237 VanDerWaalsContact C-N 3.33Å; L235-L237 PolarHBondContact O-N 3.18Å; L235-S238 WeakPolarHBondContact O-CB 3.5Å; L235-S238 PolarHBondContact O-N 3.15Å; L235-N239 PolarHBondContact O-N 3.15Å
236	N	37.2	Very low	37.4	Very low	94 Å²	94	113.2 Å²	113.2	50%	0.503	56%	0.556	S	S	.	*	H	α-helix	trans	-66.3	-33.1	177.1	-76.7	12.7	0	0	0	112.8	K232 S233 S238 N239 F240	K232-N236 WeakPolarHBondContact O-CB 3.24Å; K232-N236 PolarHBondContact O-N 2.65Å; K232-N236 PolarHBondContact O-OD1 2.98Å; S233-N236 PolarHBondContact O-N 3.38Å; N236-S238 VanDerWaalsContact C-N 3.34Å; N236-N239 PolarHBondContact O-N 2.91Å; N236-F240 PolarHBondContact O-N 3.21Å
237	L	35.1	Very low	36.9	Very low	82 Å²	82	114.9 Å²	114.9	43%	0.429	57%	0.567	S	S	.	*	H	α-helix	trans	-67.1	-36.3	176.5	-167.6	69.4	0	0	0	111.4	S233 L234 L235 N239 F240	S233-L237 WeakPolarHBondContact O-CB 3.34Å; S233-L237 PolarHBondContact O-N 2.71Å; L234-L237 PolarHBondContact O-N 2.67Å; L235-L237 VanDerWaalsContact C-N 3.33Å; L235-L237 PolarHBondContact O-N 3.18Å; L237-N239 VanDerWaalsContact C-N 3.27Å; L237-N239 PolarHBondContact O-N 2.95Å; L237-F240 PolarHBondContact O-N 3.17Å
238	S	34.9	Very low	36.2	Very low	75 Å²	75	121.6 Å²	121.6	52%	0.524	59%	0.589	S	S	.	*	H	α-helix	trans	-59.5	-37.5	172	-163.6	0	0	0	0	112.4	L234 L235 N236	L234-S238 PolarHBondContact O-N 3.37Å; L234-S238 VanDerWaalsContact O-N 3.15Å; L235-S238 WeakPolarHBondContact O-CB 3.5Å; L235-S238 PolarHBondContact O-N 3.15Å; N236-S238 VanDerWaalsContact C-N 3.34Å
239	N	34.4	Very low	35.8	Very low	120 Å²	120	118.6 Å²	118.6	64%	0.642	58%	0.581	S	S	*	*	H	α-helix	trans	-82.3	-12.6	-176.4	-66.5	-4.7	0	0	0	113.8	L235 N236 L237 I241	L235-N239 PolarHBondContact O-N 3.15Å; N236-N239 PolarHBondContact O-N 2.91Å; L237-N239 VanDerWaalsContact C-N 3.27Å; L237-N239 PolarHBondContact O-N 2.95Å; N239-I241 VanDerWaalsContact C-N 3.28Å; N239-I241 PolarHBondContact O-N 3.28Å
240	F	34.1	Very low	35.6	Very low	170 Å²	170	112.3 Å²	112.3	75%	0.746	56%	0.558	S	S	*	*	G	3₁₀ helix	trans	-82.9	-4.2	179	-149.5	-93.4	0	0	0	113.2	N236 L237 N242	N236-F240 PolarHBondContact O-N 3.21Å; L237-F240 PolarHBondContact O-N 3.17Å; F240-N242 VanDerWaalsContact C-N 3.32Å; F240-N242 PolarHBondContact O-N 3.5Å
241	I	33	Very low	35.5	Very low	121 Å²	121	113.4 Å²	113.4	62%	0.621	57%	0.569	S	S	*	*	G	3₁₀ helix	trans	-73.6	-18.2	-170	-68.6	174.4	0	0	0	113.5	N239 Y243	N239-I241 VanDerWaalsContact C-N 3.28Å; N239-I241 PolarHBondContact O-N 3.28Å; I241-Y243 PolarHBondContact O-N 2.96Å
242	N	29.3	Very low	35.4	Very low	146 Å²	146	117 Å²	117	78%	0.781	58%	0.576	S	S	*	*	G	3₁₀ helix	trans	-79.8	-6.1	-170.1	-94.4	7.7	0	0	0	116.9	F240	F240-N242 VanDerWaalsContact C-N 3.32Å; F240-N242 PolarHBondContact O-N 3.5Å
243	Y	26.7	Very low	35.1	Very low	194 Å²	194	114.7 Å²	114.7	76%	0.761	57%	0.569	S	S	*	*	S	Bend	trans	-146.7	127	-179.7	-91.1	-78.6	0	0	0	115.9	I241	I241-Y243 PolarHBondContact O-N 2.96Å
244	N	29.7	Very low	35	Very low	135 Å²	135	117.9 Å²	117.9	72%	0.722	57%	0.574	S	S	*	*			trans	93.5	148.8	165.1	-55	-64.4	0	0	0	118.7	Y184	Y184-N244 PolarHBondContact OH-O 3.15Å
245	I	29.6	Very low	35.1	Very low	104 Å²	104	117.9 Å²	117.9	53%	0.533	57%	0.572	S	S	.	*			trans	-111.8	-178.7	-159.2	-64.3	164	0	0	0	110.1
246	Y	37.2	Very low	35	Very low	166 Å²	166	115.1 Å²	115.1	65%	0.651	56%	0.561	S	S	*	*			trans	103	148.1	161.4	-52	-69.5	0	0	0	118.1
247	P	35.3	Very low	35	Very low	71 Å²	71	113.1 Å²	113.1	46%	0.461	55%	0.548	S	S	.	.			trans	-90.9	171.1	179.4	8.7	14.2	0	0	0	111.6
248	W	34	Very low	35.3	Very low	228 Å²	228	114 Å²	114	86%	0.864	55%	0.548	S	S	*	.				-172.8	161.6	67	-87.6	94	0	0	0	113.9
249	N	38.4	Very low	35.6	Very low	99 Å²	99	116.5 Å²	116.5	53%	0.529	55%	0.552	S	S	.	*			trans	46.9	83	153.8	-157.9	-14.8	0	0	0	119	T251	N249-T251 PolarHBondContact OD1-N 2.7Å
250	I	35.6	Very low	35.7	Very low	33 Å²	33	113.6 Å²	113.6	17%	0.169	54%	0.54	C	S	.	.			trans	-73.2	-25.9	179.1	-67.3	166.4	0	0	0	113.6	N187 S190 I191 I194 F252 I253 Y254	N187-I250 WeakPolarHBondContact O-CD1 3.47Å; S190-I250 VanDerWaalsContact CB-CD1 3.42Å; I191-I250 HydrophobicContact CD1-CD1 4.49Å; I191-I250 HydrophobicContact CG1-CD1 3.78Å; I191-I250 HydrophobicContact CG1-CG1 4.09Å; I194-I250 HydrophobicContact CD1-CG2 3.22Å; I250-F252 VanDerWaalsContact C-N 3.34Å; I250-F252 PolarHBondContact O-N 3.44Å; I250-I253 PolarHBondContact O-N 3.41Å; I250-Y254 PolarHBondContact O-N 2.95Å; I250-Y254 VanDerWaalsContact O-N 3.08Å
251	T	38.2	Very low	35.8	Very low	81 Å²	81	108.8 Å²	108.8	50%	0.497	52%	0.519	S	S	.	.	H	α-helix	trans	-61.2	-37.3	-167.6	-50.1	0	0	0	0	113.4	N249 Y254 Q255	N249-T251 PolarHBondContact OD1-N 2.7Å; T251-Y254 PolarHBondContact O-N 3.31Å; T251-Q255 HydrophobicContact CG2-CG 4.49Å; T251-Q255 WeakPolarHBondContact O-CB 3.37Å; T251-Q255 WeakPolarHBondContact O-CG 3.11Å; T251-Q255 PolarHBondContact O-N 3.06Å
252	F	39.1	Very low	36.1	Very low	151 Å²	151	108.3 Å²	108.3	66%	0.662	51%	0.51	S	S	*	.	H	α-helix	trans	-69.1	-37	180	-174.3	-100.9	0	0	0	112.7	I250 S256	I250-F252 VanDerWaalsContact C-N 3.34Å; I250-F252 PolarHBondContact O-N 3.44Å; F252-S256 VanDerWaalsContact O-CB 3.29Å; F252-S256 WeakPolarHBondContact O-CB 3.48Å; F252-S256 PolarHBondContact O-N 3.26Å; F252-S256 PolarHBondContact O-OG 3.39Å
253	I	35.9	Very low	36.6	Very low	85 Å²	85	105 Å²	105	44%	0.436	50%	0.498	S	S	.	.	H	α-helix	trans	-69.3	-43.6	175.9	-61.3	177.7	0	0	0	109.6	I250 S256 F257	I250-I253 PolarHBondContact O-N 3.41Å; I253-S256 PolarHBondContact O-N 3.47Å; I253-F257 WeakPolarHBondContact O-CB 3.25Å; I253-F257 PolarHBondContact O-N 3.07Å
254	Y	38.1	Very low	37	Very low	119 Å²	119	97.3 Å²	97.3	47%	0.467	47%	0.472	S	S	.	.	H	α-helix	trans	-60	-49.4	175.9	-173.6	-90.2	0	0	0	111.8	I194 I250 T251 S256 F257 F258	I194-Y254 HydrophobicContact CD1-CD2 3.98Å; I194-Y254 HydrophobicContact CG1-CD2 4.18Å; I250-Y254 PolarHBondContact O-N 2.95Å; I250-Y254 VanDerWaalsContact O-N 3.08Å; T251-Y254 PolarHBondContact O-N 3.31Å; Y254-S256 PolarHBondContact O-N 3.31Å; Y254-F257 PolarHBondContact O-N 2.96Å; Y254-F258 HydrophobicContact CE1-CD2 4.14Å; Y254-F258 VanDerWaalsContact O-CB 3.27Å; Y254-F258 WeakPolarHBondContact O-CB 3.43Å; Y254-F258 PolarHBondContact O-N 3.21Å
255	Q	41.2	Very low	37.2	Very low	93 Å²	93	94.9 Å²	94.9	44%	0.435	46%	0.459	S	S	.	.	H	α-helix	trans	-63.2	-41.9	177.9	-75	177.2	-8	0	0	112.5	T251 F258 Q259	T251-Q255 HydrophobicContact CG2-CG 4.49Å; T251-Q255 WeakPolarHBondContact O-CB 3.37Å; T251-Q255 WeakPolarHBondContact O-CG 3.11Å; T251-Q255 PolarHBondContact O-N 3.06Å; Q255-F258 PolarHBondContact O-N 2.86Å; Q255-Q259 WeakPolarHBondContact O-CB 3.41Å; Q255-Q259 PolarHBondContact O-N 2.95Å
256	S	38.4	Very low	37.4	Very low	50 Å²	50	92.6 Å²	92.6	35%	0.35	45%	0.451	S	S	.	.	H	α-helix	trans	-62.2	-44.9	176.6	-60.9	0	0	0	0	111.9	F252 I253 Y254 Q259 C260	F252-S256 VanDerWaalsContact O-CB 3.29Å; F252-S256 WeakPolarHBondContact O-CB 3.48Å; F252-S256 PolarHBondContact O-N 3.26Å; F252-S256 PolarHBondContact O-OG 3.39Å; I253-S256 PolarHBondContact O-N 3.47Å; Y254-S256 PolarHBondContact O-N 3.31Å; S256-Q259 PolarHBondContact O-N 3.46Å; S256-C260 PolarHBondContact O-N 2.8Å; S256-C260 VanDerWaalsContact O-N 3.15Å; S256-C260 PolarHBondContact O-SG 3.38Å
257	F	37.2	Very low	37.3	Very low	53 Å²	53	89 Å²	89	23%	0.232	44%	0.442	C	S	.	.	H	α-helix	trans	-64.9	-45.9	176.2	-177.5	-98	0	0	0	111.7	L198 I253 Y254 Q259 C260 F261	L198-F257 HydrophobicContact CD1-CD1 4.44Å; L198-F257 HydrophobicContact CD1-CD2 4.2Å; L198-F257 HydrophobicContact CD1-CE1 4Å; L198-F257 HydrophobicContact CD1-CE2 3.72Å; L198-F257 HydrophobicContact CD1-CZ 3.62Å; L198-F257 HydrophobicContact CD2-CZ 4.29Å; L198-F257 HydrophobicContact CG-CE1 4.14Å; L198-F257 HydrophobicContact CG-CE2 4.19Å; L198-F257 HydrophobicContact CG-CZ 3.67Å; I253-F257 WeakPolarHBondContact O-CB 3.25Å; I253-F257 PolarHBondContact O-N 3.07Å; Y254-F257 PolarHBondContact O-N 2.96Å; F257-Q259 VanDerWaalsContact C-N 3.3Å; F257-Q259 PolarHBondContact O-N 2.97Å; F257-C260 PolarHBondContact O-N 3.12Å; F257-F261 HydrophobicContact CE1-CD2 4.22Å; F257-F261 AromaticContact CZ-CD2 3.89Å; F257-F261 HydrophobicContact CZ-CD2 3.89Å; F257-F261 HydrophobicContact CZ-CE2 4.36Å; F257-F261 WeakPolarHBondContact O-CB 3.48Å; F257-F261 PolarHBondContact O-N 2.9Å
258	F	41.4	Very low	37	Very low	99 Å²	99	88 Å²	88	43%	0.434	43%	0.432	S	S	.	.	H	α-helix	trans	-60.9	-38.9	178.6	-160.4	-87.9	0	0	0	111.7	Y254 Q255 F261 R262	Y254-F258 HydrophobicContact CE1-CD2 4.14Å; Y254-F258 VanDerWaalsContact O-CB 3.27Å; Y254-F258 WeakPolarHBondContact O-CB 3.43Å; Y254-F258 PolarHBondContact O-N 3.21Å; Q255-F258 PolarHBondContact O-N 2.86Å; F258-F261 PolarHBondContact O-N 3.13Å; F258-R262 WeakPolarHBondContact O-CB 3.43Å; F258-R262 PolarHBondContact O-N 2.98Å
259	Q	41.7	Very low	36.9	Very low	129 Å²	129	83.7 Å²	83.7	60%	0.603	42%	0.42	S	S	*	.	H	α-helix	trans	-68.1	-41.2	177.3	-167.9	68.4	-6.2	0	0	112.6	Q255 S256 F257 S263	Q255-Q259 WeakPolarHBondContact O-CB 3.41Å; Q255-Q259 PolarHBondContact O-N 2.95Å; S256-Q259 PolarHBondContact O-N 3.46Å; F257-Q259 VanDerWaalsContact C-N 3.3Å; F257-Q259 PolarHBondContact O-N 2.97Å; Q259-S263 WeakPolarHBondContact O-CB 3.43Å; Q259-S263 PolarHBondContact O-N 2.91Å; Q259-S263 VanDerWaalsContact O-N 3.13Å; Q259-S263 PolarHBondContact O-OG 3.48Å
260	C	35.8	Very low	36.8	Very low	58 Å²	58	81.4 Å²	81.4	39%	0.392	41%	0.41	S	S	.	.	H	α-helix	trans	-66.1	-34.7	172.9	-70.7	0	0	0	0	112.8	S256 F257 S263 S264	S256-C260 PolarHBondContact O-N 2.8Å; S256-C260 VanDerWaalsContact O-N 3.15Å; S256-C260 PolarHBondContact O-SG 3.38Å; F257-C260 PolarHBondContact O-N 3.12Å; C260-S263 PolarHBondContact O-OG 2.95Å; C260-S264 PolarHBondContact O-N 2.95Å; C260-S264 PolarHBondContact O-OG 3.09Å
261	F	35.6	Very low	36.7	Very low	70 Å²	70	85.2 Å²	85.2	31%	0.307	43%	0.425	S	S	.	.	H	α-helix	trans	-78	-40.7	178.8	-146.5	-93.1	0	0	0	112	F257 F258 S263 S264 L265	F257-F261 HydrophobicContact CE1-CD2 4.22Å; F257-F261 AromaticContact CZ-CD2 3.89Å; F257-F261 HydrophobicContact CZ-CD2 3.89Å; F257-F261 HydrophobicContact CZ-CE2 4.36Å; F257-F261 WeakPolarHBondContact O-CB 3.48Å; F257-F261 PolarHBondContact O-N 2.9Å; F258-F261 PolarHBondContact O-N 3.13Å; F261-S263 VanDerWaalsContact C-N 3.31Å; F261-S263 PolarHBondContact O-N 3.11Å; F261-S264 PolarHBondContact O-N 3.31Å; F261-S264 PolarHBondContact O-OG 2.76Å; F261-S264 VanDerWaalsContact O-OG 3.14Å; F261-L265 PolarHBondContact O-N 3.46Å; F261-L265 VanDerWaalsContact O-N 3.08Å
262	R	40.8	Very low	36.4	Very low	110 Å²	110	86 Å²	86	42%	0.415	42%	0.423	S	S	.	.	H	α-helix	trans	-64.5	-32.9	176.5	-172	174.3	-173.9	150.8	2.9	112.4	F258 P266	F258-R262 WeakPolarHBondContact O-CB 3.43Å; F258-R262 PolarHBondContact O-N 2.98Å; R262-P266 WeakPolarHBondContact O-CD 3.48Å
263	S	38.7	Very low	36	Very low	78 Å²	78	81.7 Å²	81.7	55%	0.545	42%	0.415	S	S	.	.	H	α-helix	trans	-78.2	-21.4	176.1	48.7	0	0	0	0	114.3	Q259 C260 F261	Q259-S263 WeakPolarHBondContact O-CB 3.43Å; Q259-S263 PolarHBondContact O-N 2.91Å; Q259-S263 VanDerWaalsContact O-N 3.13Å; Q259-S263 PolarHBondContact O-OG 3.48Å; C260-S263 PolarHBondContact O-OG 2.95Å; F261-S263 VanDerWaalsContact C-N 3.31Å; F261-S263 PolarHBondContact O-N 3.11Å
264	S	34.7	Very low	35.9	Very low	31 Å²	31	83.6 Å²	83.6	22%	0.217	43%	0.425	C	S	.	.	H	α-helix	trans	-93.4	-21.7	177	44.8	0	0	0	0	113.9	C260 F261 I267 L268	C260-S264 PolarHBondContact O-N 2.95Å; C260-S264 PolarHBondContact O-OG 3.09Å; F261-S264 PolarHBondContact O-N 3.31Å; F261-S264 PolarHBondContact O-OG 2.76Å; F261-S264 VanDerWaalsContact O-OG 3.14Å; S264-I267 WeakPolarHBondContact O-CB 3.23Å; S264-I267 PolarHBondContact O-N 3.44Å; S264-I267 VanDerWaalsContact O-N 3.17Å; S264-L268 PolarHBondContact O-N 3.03Å
265	L	33.7	Very low	35.5	Very low	84 Å²	84	81 Å²	81	44%	0.44	43%	0.428	S	S	.	.	H	α-helix	trans	-57.3	-38.6	178.1	-161	69.6	0	0	0	115.3	F261 I267 L268 K269	F261-L265 PolarHBondContact O-N 3.46Å; F261-L265 VanDerWaalsContact O-N 3.08Å; L265-I267 VanDerWaalsContact C-N 3.32Å; L265-I267 PolarHBondContact O-N 3.1Å; L265-L268 PolarHBondContact O-N 2.94Å; L265-K269 PolarHBondContact O-N 3.28Å
266	P	34.7	Very low	35	Very low	57 Å²	57	82.6 Å²	82.6	37%	0.37	44%	0.437	S	S	.	.	H	α-helix	trans	-67.4	-30.4	176.5	-20.8	34	0	0	0	113.4	R262 L268 K269 T270	R262-P266 WeakPolarHBondContact O-CD 3.48Å; P266-L268 VanDerWaalsContact C-N 3.29Å; P266-L268 PolarHBondContact O-N 3.1Å; P266-K269 PolarHBondContact O-N 3.14Å; P266-T270 WeakPolarHBondContact O-CG2 3.4Å; P266-T270 PolarHBondContact O-N 2.88Å; P266-T270 PolarHBondContact O-OG1 2.91Å
267	I	35	Very low	34.5	Very low	89 Å²	89	86.9 Å²	86.9	46%	0.456	46%	0.456	S	S	.	.	H	α-helix	trans	-69.2	-31.6	-179.5	-54.8	177	0	0	0	110.5	S264 L265 T270 K271	S264-I267 WeakPolarHBondContact O-CB 3.23Å; S264-I267 PolarHBondContact O-N 3.44Å; S264-I267 VanDerWaalsContact O-N 3.17Å; L265-I267 VanDerWaalsContact C-N 3.32Å; L265-I267 PolarHBondContact O-N 3.1Å; I267-T270 WeakPolarHBondContact CA-OG1 3.39Å; I267-T270 PolarHBondContact O-OG1 3.21Å; I267-K271 WeakPolarHBondContact O-CB 3.15Å; I267-K271 WeakPolarHBondContact O-CG 3.28Å; I267-K271 PolarHBondContact O-N 3.35Å
268	L	29.5	Very low	34.1	Very low	50 Å²	50	91.7 Å²	91.7	26%	0.262	48%	0.482	S	S	.	.	H	α-helix	trans	-73.8	-47.2	173.1	-71.8	167	0	0	0	111.9	Y153 L205 S264 L265 P266 T270 K271 Q272	Y153-L268 HydrophobicContact CE2-CD2 4.21Å; L205-L268 HydrophobicContact CD1-CD1 4.33Å; S264-L268 PolarHBondContact O-N 3.03Å; L265-L268 PolarHBondContact O-N 2.94Å; P266-L268 VanDerWaalsContact C-N 3.29Å; P266-L268 PolarHBondContact O-N 3.1Å; L268-T270 PolarHBondContact O-N 3.02Å; L268-K271 PolarHBondContact O-N 2.7Å; L268-Q272 WeakPolarHBondContact O-CB 3.41Å; L268-Q272 PolarHBondContact O-N 2.81Å
269	K	32.1	Very low	33.4	Very low	138 Å²	138	93.2 Å²	93.2	60%	0.6	50%	0.495	S	S	*	.	H	α-helix	trans	-60.3	-42	177.9	-75.2	-172.4	175.6	-178	0	112.8	L265 P266 Q272 A273	L265-K269 PolarHBondContact O-N 3.28Å; P266-K269 PolarHBondContact O-N 3.14Å; K269-Q272 PolarHBondContact O-N 3.22Å; K269-A273 PolarHBondContact O-N 3.36Å
270	T	36.6	Very low	32.7	Very low	52 Å²	52	92.5 Å²	92.5	32%	0.319	50%	0.502	S	S	.	.	H	α-helix	trans	-66.1	-42.9	177	45.6	0	0	0	0	112.2	P266 I267 L268 Q272 A273 I274 T873	P266-T270 WeakPolarHBondContact O-CG2 3.4Å; P266-T270 PolarHBondContact O-N 2.88Å; P266-T270 PolarHBondContact O-OG1 2.91Å; I267-T270 WeakPolarHBondContact CA-OG1 3.39Å; I267-T270 PolarHBondContact O-OG1 3.21Å; L268-T270 PolarHBondContact O-N 3.02Å; T270-Q272 PolarHBondContact O-N 2.91Å; T270-A273 PolarHBondContact O-N 2.95Å; T270-I274 VanDerWaalsContact O-CG1 3.31Å; T270-I274 WeakPolarHBondContact O-CG1 3.42Å; T270-I274 PolarHBondContact O-N 3.2Å; T270-T873 HydrophobicContact CG2-CG2 4.33Å
271	K	32.4	Very low	32.3	Very low	113 Å²	113	95.9 Å²	95.9	49%	0.491	52%	0.516	S	S	.	.	H	α-helix	trans	-65.5	-35.2	173.5	-77.3	-172.7	174.5	-174.3	0	113.4	I267 L268 I274 A275	I267-K271 WeakPolarHBondContact O-CB 3.15Å; I267-K271 WeakPolarHBondContact O-CG 3.28Å; I267-K271 PolarHBondContact O-N 3.35Å; L268-K271 PolarHBondContact O-N 2.7Å; K271-I274 PolarHBondContact O-N 3.1Å; K271-A275 WeakPolarHBondContact O-CB 3.43Å; K271-A275 PolarHBondContact O-N 3.25Å
272	Q	32.3	Very low	32	Very low	98 Å²	98	101 Å²	101	46%	0.458	55%	0.546	S	S	.	.	H	α-helix	trans	-65.1	-40.2	175.5	-161.3	170.2	23	0	0	111.3	L268 K269 T270 A275 M276	L268-Q272 WeakPolarHBondContact O-CB 3.41Å; L268-Q272 PolarHBondContact O-N 2.81Å; K269-Q272 PolarHBondContact O-N 3.22Å; T270-Q272 PolarHBondContact O-N 2.91Å; Q272-A275 PolarHBondContact O-N 3.41Å; Q272-M276 HydrophobicContact CG-CE 4.3Å; Q272-M276 HydrophobicContact CG-SD 4.38Å; Q272-M276 WeakPolarHBondContact O-CG 3.44Å; Q272-M276 PolarHBondContact O-N 3.31Å
273	A	31	Very low	31.4	Very low	59 Å²	59	102.3 Å²	102.3	49%	0.488	56%	0.562	S	S	.	*	H	α-helix	trans	-67.1	-35.1	173.3	0	0	0	0	0	113.5	K269 T270	K269-A273 PolarHBondContact O-N 3.36Å; T270-A273 PolarHBondContact O-N 2.95Å
274	I	33.5	Very low	30.6	Very low	125 Å²	125	106.3 Å²	106.3	64%	0.641	57%	0.574	S	S	*	*	H	α-helix	trans	-71.9	-39.2	176.1	-68.3	163.4	0	0	0	111.2	T270 K271 M276 N277	T270-I274 VanDerWaalsContact O-CG1 3.31Å; T270-I274 WeakPolarHBondContact O-CG1 3.42Å; T270-I274 PolarHBondContact O-N 3.2Å; K271-I274 PolarHBondContact O-N 3.1Å; I274-M276 VanDerWaalsContact C-N 3.29Å; I274-M276 PolarHBondContact O-N 3.5Å; I274-N277 PolarHBondContact O-N 2.72Å
275	A	30.3	Very low	30.3	Very low	64 Å²	64	113.2 Å²	113.2	53%	0.529	61%	0.607	S	S	.	*	H	α-helix	trans	-69.5	-23.4	178.5	0	0	0	0	0	113.8	K271 Q272	K271-A275 WeakPolarHBondContact O-CB 3.43Å; K271-A275 PolarHBondContact O-N 3.25Å; Q272-A275 PolarHBondContact O-N 3.41Å
276	M	29.9	Very low	29.9	Very low	128 Å²	128	119.7 Å²	119.7	63%	0.631	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92	11	-179.9	-71.7	177.6	167.1	0	0	113.9	Q272 I274	Q272-M276 HydrophobicContact CG-CE 4.3Å; Q272-M276 HydrophobicContact CG-SD 4.38Å; Q272-M276 WeakPolarHBondContact O-CG 3.44Å; Q272-M276 PolarHBondContact O-N 3.31Å; I274-M276 VanDerWaalsContact C-N 3.29Å; I274-M276 PolarHBondContact O-N 3.5Å
277	N	27.6	Very low	29.2	Very low	139 Å²	139	121.4 Å²	121.4	74%	0.743	64%	0.638	S	S	*	*			trans	-125	35.3	-171.6	-128.2	-21	0	0	0	113.7	I274	I274-N277 PolarHBondContact O-N 2.72Å
278	I	27.8	Very low	28.8	Very low	154 Å²	154	124.5 Å²	124.5	79%	0.79	66%	0.662	S	S	*	*	S	Bend	trans	-103.6	90.9	173	-58.1	-177.9	0	0	0	109.5
279	N	27.6	Very low	28.5	Very low	131 Å²	131	127.8 Å²	127.8	70%	0.701	69%	0.689	S	S	*	*			trans	21	104.8	161.6	-165.1	32.2	0	0	0	119.5	N281	N279-N281 PolarHBondContact O-N 2.74Å
280	P	27.4	Very low	28.1	Very low	114 Å²	114	126.4 Å²	126.4	74%	0.74	70%	0.697	S	S	*	*			trans	-85.3	100.7	165.1	33.5	-29.4	0	0	0	111.2
281	N	26.4	Very low	27.5	Very low	130 Å²	130	128.3 Å²	128.3	70%	0.695	71%	0.712	S	S	*	*			trans	-178.1	112.3	146.6	-98.4	-31.9	0	0	0	112	N279	N279-N281 PolarHBondContact O-N 2.74Å
282	N	29.5	Very low	27.1	Very low	176 Å²	176	129.3 Å²	129.3	94%	0.941	72%	0.722	S	S	*	*			trans	-150.8	128.3	144.6	-121.3	-6.3	0	0	0	106.8
283	N	27.6	Very low	26.7	Very low	138 Å²	138	135.1 Å²	135.1	74%	0.738	75%	0.747	S	S	*	*			trans	-114.5	144.1	-155.4	-132.8	-9.9	0	0	0	112.6
284	M	22.6	Very low	26.4	Very low	163 Å²	163	141.4 Å²	141.4	80%	0.803	77%	0.766	S	S	*	*			trans	54.9	115	166.3	-51.8	-170.8	95.9	0	0	119.3
285	I	28.7	Very low	26	Very low	176 Å²	176	140.1 Å²	140.1	90%	0.903	77%	0.768	S	S	*	*				-128.2	159.2	115	-68.5	-166.3	0	0	0	108.1
286	R	24.5	Very low	25.8	Very low	220 Å²	220	144.8 Å²	144.8	83%	0.83	78%	0.783	S	S	*	*			trans	-83.9	141.3	-160	-136.2	-175.2	-175.5	168.9	-2.2	114.5
287	S	21.4	Very low	25.6	Very low	92 Å²	92	143.7 Å²	143.7	64%	0.643	79%	0.786	S	S	*	*			trans	38.1	122.6	138	63.7	0	0	0	0	122.1
288	T	26.9	Very low	25.4	Very low	155 Å²	155	141.5 Å²	141.5	95%	0.951	78%	0.782	S	S	*	*				-147	162	121.2	35.2	0	0	0	0	109.8
289	S	22	Very low	25.3	Very low	118 Å²	118	142.1 Å²	142.1	83%	0.825	79%	0.787	S	S	*	*			trans	-116.2	139.1	179.1	53	0	0	0	0	111.2
290	S	24.6	Very low	25.2	Very low	110 Å²	110	143.3 Å²	143.3	77%	0.769	79%	0.793	S	S	*	*			trans	-159	153.4	150.7	-166.4	0	0	0	0	109.9
291	S	22.5	Very low	25.2	Very low	91 Å²	91	145.1 Å²	145.1	64%	0.636	80%	0.797	S	S	*	*			trans	-64.2	157.6	153	55.6	0	0	0	0	110.2
292	D	24.2	Very low	25.2	Very low	134 Å²	134	145.1 Å²	145.1	72%	0.717	80%	0.796	S	S	*	*				156.7	99.1	129.2	-78.2	2.2	0	0	0	109.7
293	F	24.5	Very low	25.1	Very low	220 Å²	220	143.3 Å²	143.3	97%	0.965	79%	0.785	S	S	*	*			trans	177.3	62.8	142.4	-102	-63.9	0	0	0	110.7
294	E	24.2	Very low	25.1	Very low	192 Å²	192	141.8 Å²	141.8	90%	0.897	78%	0.777	S	S	*	*			trans	-110.7	153.7	157	-80.3	-164.4	139.9	0	0	109.9
295	S	26.3	Very low	25.4	Very low	98 Å²	98	140 Å²	140	69%	0.685	77%	0.771	S	S	*	*			trans	56.5	106.6	165.8	-158.8	0	0	0	0	119.3
296	I	25.4	Very low	25.3	Very low	162 Å²	162	139.4 Å²	139.4	83%	0.831	76%	0.764	S	S	*	*	S	Bend		-125.8	113.9	127	-66.2	-177.3	0	0	0	106.6
297	C	25.7	Very low	25.4	Very low	105 Å²	105	134.5 Å²	134.5	71%	0.709	76%	0.758	S	S	*	*			trans	49.5	117.6	166	-57.4	0	0	0	0	117.6
298	S	24.1	Very low	25.6	Very low	92 Å²	92	138.2 Å²	138.2	64%	0.643	77%	0.766	S	S	*	*			cis	53	107.8	16	-61.4	0	0	0	0	115.8
299	D	25.6	Very low	25.5	Very low	167 Å²	167	135.2 Å²	135.2	89%	0.893	75%	0.751	S	S	*	*			trans	-127.4	137.8	131	-83.9	-41.2	0	0	0	106.6
300	N	25.9	Very low	25.6	Very low	156 Å²	156	137.4 Å²	137.4	83%	0.834	75%	0.748	S	S	*	*			trans	-152.5	120.1	-174.7	-123.6	5.8	0	0	0	107.1
301	D	26.9	Very low	25.8	Very low	153 Å²	153	139.3 Å²	139.3	82%	0.818	74%	0.744	S	S	*	*			trans	-158.7	141.2	175.4	-94.8	-17	0	0	0	107.2
302	L	26.2	Very low	25.8	Very low	130 Å²	130	139.3 Å²	139.3	68%	0.681	74%	0.744	S	S	*	*			cis	-163.4	140.2	-9.7	-165.4	87.9	0	0	0	109.4
303	L	27.1	Very low	25.9	Very low	137 Å²	137	138.7 Å²	138.7	72%	0.717	75%	0.746	S	S	*	*			trans	60.7	153.7	151.8	-101.7	67.4	0	0	0	120.1
304	D	26.8	Very low	25.8	Very low	107 Å²	107	134 Å²	134	57%	0.572	74%	0.735	S	S	*	*			cis	-161.4	171.3	-3.9	-152.2	-1.9	0	0	0	114.3
305	N	30.1	Very low	25.8	Very low	125 Å²	125	131.9 Å²	131.9	67%	0.668	73%	0.729	S	S	*	*			trans	71.5	118.9	165.3	-60.5	-67.3	0	0	0	118.2
306	H	25.9	Very low	25.7	Very low	163 Å²	163	136.1 Å²	136.1	76%	0.755	74%	0.735	S	S	*	*				69.5	134.2	59.9	-73	-80.5	0	0	0	112.9
307	V	27.4	Very low	25.6	Very low	118 Å²	118	135 Å²	135	72%	0.715	73%	0.731	S	S	*	*			cis	-148.5	154.7	37.4	166.8	0	0	0	0	112.9
308	E	24.7	Very low	25.6	Very low	170 Å²	170	138.7 Å²	138.7	79%	0.794	74%	0.738	S	S	*	*			trans	-0.4	161.5	153.1	-69	156.4	-158.5	0	0	122.7
309	S	24.7	Very low	25.5	Very low	91 Å²	91	141.9 Å²	141.9	64%	0.636	75%	0.747	S	S	*	*			cis	-168.9	165.1	-8.1	49.4	0	0	0	0	112.3
310	E	25.4	Very low	25.4	Very low	165 Å²	165	141.3 Å²	141.3	77%	0.771	74%	0.742	S	S	*	*			trans	62.2	147.9	156.5	-69.8	-178.5	175.5	0	0	119.8
311	H	28	Very low	25.2	Very low	149 Å²	149	138.7 Å²	138.7	69%	0.69	74%	0.735	S	S	*	*			cis	-150.6	143.4	10.5	-130.3	36.1	0	0	0	111.9
312	S	22.7	Very low	24.9	Very low	91 Å²	91	139 Å²	139	64%	0.636	74%	0.736	S	S	*	*			trans	64.1	122.7	143.5	-57.7	0	0	0	0	125.3
313	T	25.6	Very low	24.7	Very low	122 Å²	122	137.6 Å²	137.6	75%	0.748	74%	0.737	S	S	*	*			trans	77.4	93.7	135.6	45.4	0	0	0	0	124.3
314	T	23.7	Very low	24.7	Very low	121 Å²	121	138.7 Å²	138.7	74%	0.742	74%	0.736	S	S	*	*				70.6	139	121.6	43	0	0	0	0	125.4
315	I	24.4	Very low	24.5	Very low	148 Å²	148	140.7 Å²	140.7	76%	0.759	74%	0.742	S	S	*	*			trans	88.7	94.8	142.1	-72.4	162.9	0	0	0	119.3
316	F	23.7	Very low	24.2	Very low	187 Å²	187	142.7 Å²	142.7	82%	0.82	75%	0.752	S	S	*	*				65.9	129.5	122.1	-113.6	-97.2	0	0	0	122.8
317	N	22.3	Very low	24	Very low	138 Å²	138	142.2 Å²	142.2	74%	0.738	76%	0.755	S	S	*	*			trans	-50.1	146.8	165.8	-51.3	-69.1	0	0	0	114.5
318	Q	25.6	Very low	24.1	Very low	183 Å²	183	142.9 Å²	142.9	86%	0.855	76%	0.76	S	S	*	*				-167.3	146.9	112.6	-106.3	168.7	9.4	0	0	113.6
319	N	22.3	Very low	24.1	Very low	159 Å²	159	143.9 Å²	143.9	85%	0.85	76%	0.764	S	S	*	*			trans	-80.5	145.6	165.1	-69.2	-49.6	0	0	0	110
320	I	24.7	Very low	24.3	Very low	154 Å²	154	144.1 Å²	144.1	79%	0.79	77%	0.766	S	S	*	*			trans	-158.4	123.3	150.9	-110.7	154.3	0	0	0	112.4
321	C	20.9	Very low	24.4	Very low	101 Å²	101	143.2 Å²	143.2	68%	0.682	77%	0.766	S	S	*	*			trans	38.7	124.6	144.5	-63.4	0	0	0	0	124.8
322	L	20.9	Very low	24.4	Very low	159 Å²	159	141.6 Å²	141.6	83%	0.832	76%	0.763	S	S	*	*				92.9	141.9	117.5	-74.5	172.1	0	0	0	123
323	S	22.3	Very low	24.5	Very low	102 Å²	102	143.8 Å²	143.8	71%	0.713	77%	0.773	S	S	*	*			trans	90.8	96.9	148.5	-63.3	0	0	0	0	121.5
324	K	26.6	Very low	24.9	Very low	160 Å²	160	144.8 Å²	144.8	70%	0.696	77%	0.769	S	S	*	*				54.1	122.3	126.3	-84.1	178.9	159.3	-77.4	0	121.7
325	E	22.6	Very low	25.4	Very low	149 Å²	149	145 Å²	145	70%	0.696	76%	0.764	S	S	*	*				61.5	94.3	128.7	-67.1	155.7	-174.3	0	0	118.8
326	L	24.7	Very low	25.8	Very low	166 Å²	166	147 Å²	147	87%	0.869	77%	0.767	S	S	*	*			trans	-145	106.6	139.2	-111	170.4	0	0	0	108.9
327	D	21.5	Very low	26.2	Very low	154 Å²	154	141.8 Å²	141.8	82%	0.824	75%	0.754	S	S	*	*			trans	-79.2	123.2	168.4	-70	-54.1	0	0	0	109.2
328	T	28.6	Very low	26.9	Very low	132 Å²	132	142.7 Å²	142.7	81%	0.81	75%	0.751	S	S	*	*			trans	-158.1	146.2	147.8	-3.1	0	0	0	0	110.8
329	E	25	Very low	27.3	Very low	191 Å²	191	139.2 Å²	139.2	89%	0.893	74%	0.737	S	S	*	*			trans	-76.1	146.3	-169.9	-55	159.9	127.3	0	0	112.3
330	S	28.9	Very low	27.7	Very low	96 Å²	96	136.6 Å²	136.6	67%	0.671	73%	0.727	S	S	*	*				170.4	141.3	120.7	-166.3	0	0	0	0	111.1
331	N	27.1	Very low	28.2	Very low	145 Å²	145	134.3 Å²	134.3	78%	0.775	72%	0.716	S	S	*	*			trans	37.5	115.6	158.9	-57.1	-20.4	0	0	0	117.7
332	D	27.8	Very low	28.8	Very low	115 Å²	115	136.5 Å²	136.5	62%	0.615	72%	0.716	S	S	*	*				-151.5	119.7	86.7	-149.2	-18.2	0	0	0	115.5	Q334	D332-Q334 VanDerWaalsContact C-N 3.28Å; D332-Q334 PolarHBondContact O-N 3.37Å
333	T	26.1	Very low	29.3	Very low	138 Å²	138	135.3 Å²	135.3	85%	0.847	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.3	48.1	174.5	47.9	0	0	0	0	112.6
334	Q	33	Very low	29.7	Very low	142 Å²	142	133.4 Å²	133.4	66%	0.664	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.8	-14.6	175.1	-74.2	-163.3	2.9	0	0	116.1	D332 S337	D332-Q334 VanDerWaalsContact C-N 3.28Å; D332-Q334 PolarHBondContact O-N 3.37Å; Q334-S337 PolarHBondContact O-OG 2.99Å
335	I	34.8	Very low	29.9	Very low	125 Å²	125	131.4 Å²	131.4	64%	0.641	69%	0.694	S	S	*	*	S	Bend	trans	-87.7	-29.3	-177.4	-62.5	178.2	0	0	0	112.4	S337 K338	I335-S337 VanDerWaalsContact C-N 3.26Å; I335-S337 PolarHBondContact O-N 3.32Å; I335-K338 PolarHBondContact O-N 3.39Å
336	K	32	Very low	30.2	Very low	192 Å²	192	131.9 Å²	131.9	84%	0.835	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.7	-14.4	177.9	-85.8	-175.7	175.6	175.9	0	114.9	T340	K336-T340 PolarHBondContact O-OG1 3.43Å
337	S	33.6	Very low	30.3	Very low	76 Å²	76	133 Å²	133	53%	0.531	70%	0.698	S	S	.	*	T	Hydrogen-bonded Turn	trans	-86.4	-19.6	178.6	51.6	0	0	0	0	113.9	Q334 I335	Q334-S337 PolarHBondContact O-OG 2.99Å; I335-S337 VanDerWaalsContact C-N 3.26Å; I335-S337 PolarHBondContact O-N 3.32Å
338	K	35.5	Very low	30.6	Very low	158 Å²	158	130.6 Å²	130.6	69%	0.687	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.3	-44.4	-175.3	-142.1	170	-173.5	177.9	0	112.8	I335 T340 L341 E342	I335-K338 PolarHBondContact O-N 3.39Å; K338-T340 VanDerWaalsContact C-N 3.27Å; K338-T340 PolarHBondContact O-N 3.48Å; K338-L341 PolarHBondContact O-N 3.23Å; K338-L341 VanDerWaalsContact O-N 3.14Å; K338-E342 PolarHBondContact O-N 2.93Å
339	I	33.6	Very low	30.6	Very low	110 Å²	110	129.7 Å²	129.7	56%	0.564	69%	0.692	S	S	*	*	H	α-helix	trans	-64.4	-30.9	-179.6	-62.8	174	0	0	0	112	L341	I339-L341 VanDerWaalsContact C-N 3.33Å
340	T	31.5	Very low	30.9	Very low	103 Å²	103	128.2 Å²	128.2	63%	0.632	69%	0.69	S	S	*	*	H	α-helix	trans	-78.6	-14.5	178.6	-48	0	0	0	0	113.4	K336 K338	K336-T340 PolarHBondContact O-OG1 3.43Å; K338-T340 VanDerWaalsContact C-N 3.27Å; K338-T340 PolarHBondContact O-N 3.48Å
341	L	36.1	Very low	30.9	Very low	107 Å²	107	132.3 Å²	132.3	56%	0.56	70%	0.696	S	S	*	*	H	α-helix	trans	-95.5	-27.7	-176.6	-120.7	161	0	0	0	113.5	K338 I339 S344	K338-L341 PolarHBondContact O-N 3.23Å; K338-L341 VanDerWaalsContact O-N 3.14Å; I339-L341 VanDerWaalsContact C-N 3.33Å; L341-S344 PolarHBondContact O-OG 2.65Å
342	E	33.4	Very low	30.9	Very low	147 Å²	147	132.7 Å²	132.7	69%	0.687	70%	0.698	S	S	*	*	H	α-helix	trans	-73.8	-31.3	169.8	-67.5	-176.7	149.4	0	0	111.7	K338 S344	K338-E342 PolarHBondContact O-N 2.93Å; E342-S344 PolarHBondContact O-N 2.96Å
343	L	31.2	Very low	30.9	Very low	133 Å²	133	131.9 Å²	131.9	70%	0.696	70%	0.698	S	S	*	*	H	α-helix	trans	-77	-14	178.2	-83.3	165.8	0	0	0	114.8
344	S	30.2	Very low	30.9	Very low	63 Å²	63	133.7 Å²	133.7	44%	0.441	69%	0.694	S	S	.	*	H	α-helix	trans	-86.3	-32.3	175.2	57.5	0	0	0	0	113.5	L341 E342	L341-S344 PolarHBondContact O-OG 2.65Å; E342-S344 PolarHBondContact O-N 2.96Å
345	N	31.3	Very low	30.7	Very low	118 Å²	118	133.4 Å²	133.4	63%	0.631	69%	0.693	S	S	*	*	H	α-helix	trans	-87.6	-7.4	-166.7	-67.3	-0.3	0	0	0	114.3	K347	N345-K347 VanDerWaalsContact C-N 3.3Å; N345-K347 PolarHBondContact O-N 3.03Å
346	L	28.6	Very low	30.4	Very low	159 Å²	159	133 Å²	133	83%	0.832	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.3	22	175.3	-75.4	167.1	0	0	0	113.9
347	K	26.2	Very low	30	Very low	189 Å²	189	130.9 Å²	130.9	82%	0.822	69%	0.689	S	S	*	*	S	Bend	trans	-138.8	30.8	-172.5	-81.2	-168.1	174.2	178.5	0	116.9	N345	N345-K347 VanDerWaalsContact C-N 3.3Å; N345-K347 PolarHBondContact O-N 3.03Å
348	S	27.2	Very low	29.6	Very low	104 Å²	104	135.4 Å²	135.4	73%	0.727	70%	0.702	S	S	*	*	S	Bend	trans	-152.1	40.7	176.1	64.2	0	0	0	0	117.8
349	S	29.6	Very low	29.3	Very low	113 Å²	113	136.3 Å²	136.3	79%	0.79	71%	0.708	S	S	*	*	S	Bend	trans	-171.4	134.8	154.5	-82.3	0	0	0	0	108.9
350	N	30.4	Very low	28.8	Very low	159 Å²	159	138.8 Å²	138.8	85%	0.85	72%	0.722	S	S	*	*			cis	-119.9	157.3	-6.3	-88.3	-30	0	0	0	111.2
351	K	28.9	Very low	28.5	Very low	183 Å²	183	139 Å²	139	80%	0.796	73%	0.728	S	S	*	*			trans	-97.6	142.7	166.3	-81.7	-176.1	174.3	-179.1	0	110.6
352	N	28.5	Very low	28	Very low	152 Å²	152	141.4 Å²	141.4	81%	0.813	74%	0.74	S	S	*	*			trans	172.1	98.8	145.4	-85.9	-13.4	0	0	0	104.3
353	T	26.3	Very low	27.6	Very low	99 Å²	99	138.5 Å²	138.5	61%	0.607	74%	0.736	S	S	*	*			cis	62.3	145.1	46	67.9	0	0	0	0	114.9
354	F	26.9	Very low	27.3	Very low	176 Å²	176	137.1 Å²	137.1	77%	0.772	73%	0.733	S	S	*	*			trans	78.6	132.3	-167.3	-65.1	-91.9	0	0	0	115.7
355	E	28.5	Very low	27.2	Very low	136 Å²	136	140.4 Å²	140.4	64%	0.636	75%	0.746	S	S	*	*			cis	-167.1	157.3	-24.2	-133.4	177.9	-147.6	0	0	111.4
356	N	29.1	Very low	26.9	Very low	116 Å²	116	140.4 Å²	140.4	62%	0.62	75%	0.746	S	S	*	*			trans	62.4	148	159.9	-55.4	-33.1	0	0	0	117
357	L	23.3	Very low	26.8	Very low	148 Å²	148	139.5 Å²	139.5	78%	0.775	74%	0.737	S	S	*	*			cis	63.9	133.2	47.2	-56	173.5	0	0	0	111.4
358	E	25.7	Very low	26.9	Very low	171 Å²	171	137.1 Å²	137.1	80%	0.799	73%	0.733	S	S	*	*			cis	-157.9	-173.3	18.9	-150.1	168.6	174.8	0	0	113.3
359	E	28.2	Very low	26.9	Very low	177 Å²	177	136.7 Å²	136.7	83%	0.827	73%	0.726	S	S	*	*			trans	75.5	163.5	156.7	-68.5	-154	116.7	0	0	122.2
360	L	23.6	Very low	26.9	Very low	162 Å²	162	138.9 Å²	138.9	85%	0.848	72%	0.723	S	S	*	*			trans	-121.6	155.2	-175	-49.7	91	0	0	0	110.1
361	S	26.3	Very low	26.9	Very low	107 Å²	107	136.4 Å²	136.4	75%	0.748	72%	0.719	S	S	*	*				166.7	167.4	114.5	54.7	0	0	0	0	113.9
362	L	25.6	Very low	26.8	Very low	158 Å²	158	132.3 Å²	132.3	83%	0.827	71%	0.713	S	S	*	*			trans	8.4	146.8	143.8	-56.9	165.7	0	0	0	119.2
363	S	23.1	Very low	26.8	Very low	85 Å²	85	133.2 Å²	133.2	59%	0.594	71%	0.714	S	S	*	*			cis	-179.5	179	-15.6	54.9	0	0	0	0	108.1
364	T	26.8	Very low	27	Very low	105 Å²	105	132.3 Å²	132.3	64%	0.644	71%	0.712	S	S	*	*			trans	59.3	107.5	150.4	47	0	0	0	0	120.4
365	N	26.4	Very low	27.2	Very low	131 Å²	131	131.9 Å²	131.9	70%	0.701	72%	0.718	S	S	*	*				87.3	131.6	116.4	-66.3	7	0	0	0	121.7
366	N	26.8	Very low	27.3	Very low	119 Å²	119	129.5 Å²	129.5	64%	0.636	73%	0.73	S	S	*	*			trans	76.1	146.5	132.8	-68	29.5	0	0	0	118.6
367	E	26.5	Very low	27.2	Very low	140 Å²	140	127.3 Å²	127.3	65%	0.654	74%	0.735	S	S	*	*			cis	-169	161	-7.6	-121.4	176.3	144.5	0	0	112.3
368	L	26.9	Very low	27.4	Very low	139 Å²	139	126.5 Å²	126.5	73%	0.728	74%	0.74	S	S	*	*			trans	61.4	167.2	151	-59.3	164.1	0	0	0	116.2
369	T	27.5	Very low	27.5	Very low	94 Å²	94	123.4 Å²	123.4	58%	0.577	74%	0.738	S	S	*	*			cis	-149.6	163.9	-21.9	16.3	0	0	0	0	107.3
370	H	30.7	Very low	27.6	Very low	159 Å²	159	119.4 Å²	119.4	74%	0.736	74%	0.735	S	S	*	*				-172	149	63.8	-89.3	-82.9	0	0	0	113.5
371	S	28.7	Very low	27.6	Very low	108 Å²	108	118.9 Å²	118.9	76%	0.755	73%	0.732	S	S	*	*			trans	60.7	145.6	138.5	65.6	0	0	0	0	122.5
372	S	28	Very low	27.6	Very low	97 Å²	97	123.3 Å²	123.3	68%	0.678	73%	0.734	S	S	*	*			cis	-176.9	169.9	-14.9	50.8	0	0	0	0	111.9
373	M	29	Very low	27.7	Very low	170 Å²	170	120.5 Å²	120.5	84%	0.837	73%	0.727	S	S	*	*			trans	77.1	144.6	163.4	-57.4	-179.5	74.3	0	0	117.6
374	S	30.1	Very low	28	Very low	80 Å²	80	123.6 Å²	123.6	56%	0.559	73%	0.732	S	S	*	*			cis	-169.4	150.6	-17.3	51.3	0	0	0	0	112.6
375	N	31.5	Very low	27.9	Very low	167 Å²	167	125.3 Å²	125.3	89%	0.893	74%	0.737	S	S	*	*			trans	67.6	144.4	164.2	-49.8	-24.4	0	0	0	117
376	G	29.3	Very low	28.4	Very low	86 Å²	86	124.2 Å²	124.2	89%	0.887	74%	0.736	S	S	*	*			cis	163.3	155.8	-6.4	0	0	0	0	0	109.2
377	G	28.2	Very low	28.4	Very low	71 Å²	71	127.4 Å²	127.4	73%	0.732	75%	0.745	S	S	*	*			cis	175.8	171.3	-6.5	0	0	0	0	0	111.3
378	C	27.5	Very low	28.5	Very low	131 Å²	131	129.1 Å²	129.1	89%	0.885	76%	0.756	S	S	*	*			trans	66.1	160.8	165.3	-61.5	0	0	0	0	119.7
379	S	27.8	Very low	28.7	Very low	106 Å²	106	126.9 Å²	126.9	74%	0.741	75%	0.752	S	S	*	*			cis	-172	157	-29.6	-92	0	0	0	0	111.9
380	A	29.2	Very low	28.8	Very low	93 Å²	93	130 Å²	130	77%	0.769	76%	0.764	S	S	*	*			trans	61.7	152.4	162.8	0	0	0	0	0	119.3
381	L	24.1	Very low	29	Very low	150 Å²	150	127.8 Å²	127.8	79%	0.785	76%	0.764	S	S	*	*			cis	110.6	122.6	5.4	-74.2	171.9	0	0	0	116.8
382	Y	25.8	Very low	29.1	Very low	201 Å²	201	130 Å²	130	79%	0.788	77%	0.767	S	S	*	*			trans	64.5	156	168.9	-79	-109.3	0	0	0	117.1
383	S	28.2	Very low	29.6	Very low	98 Å²	98	131.1 Å²	131.1	69%	0.685	77%	0.772	S	S	*	*			cis	-148.5	134.2	-0.2	40.4	0	0	0	0	110
384	Q	29.2	Very low	30.1	Very low	150 Å²	150	128.6 Å²	128.6	70%	0.701	77%	0.769	S	S	*	*				52.2	107.1	90.7	-67	-163.7	11.8	0	0	115.9
385	L	24.9	Very low	30.6	Very low	142 Å²	142	130.8 Å²	130.8	74%	0.743	78%	0.781	S	S	*	*				104.5	166.8	93.3	-86.6	173.6	0	0	0	112
386	P	36.4	Very low	31	Very low	107 Å²	107	132.8 Å²	132.8	70%	0.695	78%	0.782	S	S	*	*			cis	-134.5	164.8	-9.8	37.4	-18.4	0	0	0	118.2
387	K	26.5	Very low	31.6	Very low	187 Å²	187	134.2 Å²	134.2	81%	0.813	77%	0.774	S	S	*	*			trans	14	141.8	145.1	-53.4	175.6	-178.4	176.9	0	123.7
388	I	30.1	Very low	32.2	Very low	175 Å²	175	136.9 Å²	136.9	90%	0.897	78%	0.778	S	S	*	*			trans	-157	171.4	130	-100.8	156.1	0	0	0	108.5
389	S	29.7	Very low	32.8	Very low	92 Å²	92	138.1 Å²	138.1	64%	0.643	78%	0.775	S	S	*	*			trans	-140.4	156.8	-150.8	-48.7	0	0	0	0	117.7
390	I	30.2	Very low	33.7	Very low	159 Å²	159	138.4 Å²	138.4	82%	0.815	77%	0.774	S	S	*	*			trans	72.9	154.3	151.1	-69.2	157.1	0	0	0	116.3
391	P	35.7	Very low	34.3	Very low	113 Å²	113	139.6 Å²	139.6	73%	0.734	77%	0.774	S	S	*	*			cis	-121.9	-178	-0.8	25.5	-2.1	0	0	0	116.5
392	D	30.1	Very low	35.3	Very low	156 Å²	156	138.2 Å²	138.2	83%	0.834	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-86.9	160.8	179.1	-45.5	-89.5	0	0	0	116.1
393	P	37.6	Very low	36.3	Very low	120 Å²	120	134 Å²	134	78%	0.779	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-97.3	162.3	160.4	35.1	-28.6	0	0	0	114
394	P	41.1	Very low	36.7	Very low	117 Å²	117	135.1 Å²	135.1	76%	0.76	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-85.7	170	-159.9	34.1	-37.9	0	0	0	116.6
395	P	39.8	Very low	36.9	Very low	125 Å²	125	138 Å²	138	81%	0.812	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-78.6	153.5	-167.2	31.3	-37.4	0	0	0	115.5
396	F	40.8	Very low	37.4	Very low	209 Å²	209	137 Å²	137	92%	0.917	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-67.5	133.5	176.8	-80.4	-93.6	0	0	0	113.3
397	T	40.5	Very low	37.1	Very low	117 Å²	117	140 Å²	140	72%	0.718	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-78.7	148	164.1	45.9	0	0	0	0	111.1
398	P	40.4	Very low	37.3	Very low	126 Å²	126	136.5 Å²	136.5	82%	0.818	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-74.1	133.3	175.6	30.1	-33.5	0	0	0	111
399	L	40.7	Very low	37.3	Very low	158 Å²	158	138.6 Å²	138.6	83%	0.827	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-69.5	141.8	173	-82.1	78.3	0	0	0	111
400	P	46.2	Very low	37.2	Very low	112 Å²	112	141.9 Å²	141.9	73%	0.727	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-70.1	154.8	167.6	31.4	-34.7	0	0	0	111.2
401	P	42.4	Very low	37	Very low	118 Å²	118	139.3 Å²	139.3	77%	0.766	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-69.1	150.3	177.6	29.7	-35.4	0	0	0	112.1
402	P	45.3	Very low	36.6	Very low	120 Å²	120	139.7 Å²	139.7	78%	0.779	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-69.6	145.8	179.7	28.8	-35	0	0	0	112.4
403	P	46.3	Very low	36.4	Very low	112 Å²	112	136.8 Å²	136.8	73%	0.727	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-72	159.2	175.5	31.2	-35.5	0	0	0	112.4
404	P	36.6	Very low	36.1	Very low	123 Å²	123	139.7 Å²	139.7	80%	0.799	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-74.7	146.1	-177.5	30.9	-35.7	0	0	0	113
405	F	34.6	Very low	35.5	Very low	210 Å²	210	140.9 Å²	140.9	92%	0.921	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-70.6	130	170.7	-81.6	-91.6	0	0	0	111.7
406	P	34.2	Very low	34.9	Very low	121 Å²	121	138.7 Å²	138.7	79%	0.786	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-87.8	151.3	161.7	35	-31.6	0	0	0	111.2
407	E	31.4	Very low	34.2	Very low	171 Å²	171	138.2 Å²	138.2	80%	0.799	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-93	154	179	-66.1	-168.9	151.6	0	0	114.2
408	N	30.6	Very low	33.5	Very low	113 Å²	113	138.8 Å²	138.8	60%	0.604	77%	0.768	S	S	*	*			trans	67.2	117.7	150.7	-60.4	-37.1	0	0	0	120.7
409	F	28.7	Very low	33	Very low	219 Å²	219	137.3 Å²	137.3	96%	0.961	76%	0.761	S	S	*	*			trans	-140.1	133.4	130.7	-104.2	-80.7	0	0	0	111
410	H	27.9	Very low	32.5	Very low	160 Å²	160	137.5 Å²	137.5	74%	0.741	76%	0.762	S	S	*	*			trans	-89.4	173.4	165.2	-56.3	-84	0	0	0	109.5
411	S	25.6	Very low	32.2	Very low	105 Å²	105	138 Å²	138	73%	0.734	77%	0.765	S	S	*	*			cis	-126.6	-136.6	7	-56	0	0	0	0	110.2
412	T	27.9	Very low	31.6	Very low	121 Å²	121	135.5 Å²	135.5	74%	0.742	76%	0.761	S	S	*	*			cis	-165.4	138.3	1	-4.8	0	0	0	0	103.7
413	S	26.7	Very low	31	Very low	95 Å²	95	137.1 Å²	137.1	66%	0.664	76%	0.763	S	S	*	*			cis	63	126.7	42.9	81.4	0	0	0	0	114.4
414	K	30	Very low	30.2	Very low	181 Å²	181	137.1 Å²	137.1	79%	0.787	76%	0.761	S	S	*	*			cis	-172	166.7	14.1	-129.6	175.1	177.5	-178.3	0	111.8
415	I	29.1	Very low	29.9	Very low	143 Å²	143	135.4 Å²	135.4	73%	0.733	75%	0.752	S	S	*	*			trans	73.8	139.6	148.8	-73.1	165.5	0	0	0	118.2
416	S	26.1	Very low	29.6	Very low	79 Å²	79	133.9 Å²	133.9	55%	0.552	75%	0.746	S	S	*	*			cis	-176.4	161.1	-17.3	60.5	0	0	0	0	113.9
417	F	26.2	Very low	29.5	Very low	198 Å²	198	135 Å²	135	87%	0.868	74%	0.74	S	S	*	*			trans	66.6	152.1	160.8	-69.4	-66.1	0	0	0	118.3
418	T	25.9	Very low	29.4	Very low	130 Å²	130	132 Å²	132	80%	0.798	73%	0.73	S	S	*	*			cis	-115.6	-157.8	-4.1	57.8	0	0	0	0	109.4
419	S	30.7	Very low	29.4	Very low	95 Å²	95	133.4 Å²	133.4	66%	0.664	73%	0.732	S	S	*	*			cis	-153.5	-159	-2.3	53.9	0	0	0	0	107.1
420	L	30.5	Very low	29.6	Very low	161 Å²	161	131.5 Å²	131.5	84%	0.843	72%	0.724	S	S	*	*			cis	-147.2	176	1.7	-109.9	162	0	0	0	105.9
421	P	39.5	Very low	29.7	Very low	122 Å²	122	128.3 Å²	128.3	79%	0.792	72%	0.72	S	S	*	*			trans	-127.1	-179.9	-150.8	45.6	-36.7	0	0	0	118.6
422	G	30.6	Very low	29.9	Very low	66 Å²	66	130.9 Å²	130.9	68%	0.68	72%	0.72	S	S	*	*			trans	-178.9	110	158.1	0	0	0	0	0	116.1
423	N	31.4	Very low	29.9	Very low	154 Å²	154	132.2 Å²	132.2	82%	0.824	72%	0.717	S	S	*	*			trans	30.9	148.4	134.7	-68.2	8.9	0	0	0	122.1
424	T	30.5	Very low	30.1	Very low	113 Å²	113	134.1 Å²	134.1	69%	0.693	72%	0.716	S	S	*	*			cis	-166.9	146.9	8.1	6.1	0	0	0	0	112.6
425	S	29.1	Very low	30	Very low	87 Å²	87	132.4 Å²	132.4	61%	0.608	71%	0.71	S	S	*	*			trans	49.9	151.6	150.7	59	0	0	0	0	120.2
426	F	29.9	Very low	30.1	Very low	178 Å²	178	132 Å²	132	78%	0.781	71%	0.708	S	S	*	*			cis	-157.3	163.9	33.1	-80.7	-79.1	0	0	0	109
427	E	30.3	Very low	30.1	Very low	144 Å²	144	134.6 Å²	134.6	67%	0.673	72%	0.716	S	S	*	*			cis	-166.2	178.9	-21.1	-146.8	-173.6	66	0	0	110.3
428	N	29.6	Very low	30.3	Very low	108 Å²	108	133 Å²	133	58%	0.578	72%	0.717	S	S	*	*			trans	24.6	147.3	146.5	-79.2	-19.7	0	0	0	123.8
429	Q	31.7	Very low	30.4	Very low	142 Å²	142	135.1 Å²	135.1	66%	0.664	72%	0.717	S	S	*	*			cis	-160.2	142.9	11.9	-132.9	168.6	84.7	0	0	114.8
430	K	32.7	Very low	30.4	Very low	179 Å²	179	138.3 Å²	138.3	78%	0.778	73%	0.725	S	S	*	*			trans	38.6	150.7	139.4	-70.2	178	-172.4	174.4	0	122.8
431	S	30.6	Very low	30.4	Very low	94 Å²	94	134.4 Å²	134.4	66%	0.657	72%	0.716	S	S	*	*			cis	-174.1	159.1	-7.9	48	0	0	0	0	113.1
432	H	28.3	Very low	29.7	Very low	159 Å²	159	133.8 Å²	133.8	74%	0.736	72%	0.715	S	S	*	*			trans	23.9	145	145.5	-62.6	-56.7	0	0	0	121.8
433	H	28.5	Very low	29.7	Very low	148 Å²	148	135.9 Å²	135.9	69%	0.685	72%	0.719	S	S	*	*			cis	-162.3	-160.1	3.6	-123.8	-34.9	0	0	0	110
434	Q	29.8	Very low	29.4	Very low	135 Å²	135	134.5 Å²	134.5	63%	0.631	72%	0.717	S	S	*	*			cis	-159.6	-179.8	8.6	-136.8	156.2	-47.1	0	0	113
435	E	28.8	Very low	29.3	Very low	145 Å²	145	135.4 Å²	135.4	68%	0.678	72%	0.722	S	S	*	*			trans	4.6	156.4	146.9	-72.2	164.1	-135.5	0	0	123.1
436	I	30.8	Very low	29.2	Very low	134 Å²	134	138.1 Å²	138.1	69%	0.687	73%	0.73	S	S	*	*			cis	-156.9	159.1	-9.1	-121.2	165.3	0	0	0	112.1
437	N	26.9	Very low	29.1	Very low	134 Å²	134	137.3 Å²	137.3	72%	0.717	73%	0.732	S	S	*	*			trans	-2.3	134.4	166.5	-53.7	-26.2	0	0	0	121.3
438	N	29.9	Very low	29	Very low	165 Å²	165	134.8 Å²	134.8	88%	0.882	73%	0.73	S	S	*	*				-156.6	158.4	104.9	-115.3	-27.3	0	0	0	113.8
439	Q	27.9	Very low	29	Very low	174 Å²	174	139.4 Å²	139.4	81%	0.813	75%	0.748	S	S	*	*			trans	-97.6	156.6	176.7	-61.5	175.8	-2.5	0	0	111.2
440	I	31.5	Very low	28.9	Very low	162 Å²	162	136.6 Å²	136.6	83%	0.831	74%	0.744	S	S	*	*			trans	153.9	141.2	132.2	-80.7	158.4	0	0	0	111.7
441	A	29.7	Very low	29	Very low	79 Å²	79	134.5 Å²	134.5	65%	0.653	74%	0.741	S	S	*	*			trans	59.9	104.1	160.6	0	0	0	0	0	120.6
442	S	26.1	Very low	29.8	Very low	109 Å²	109	137.1 Å²	137.1	76%	0.762	75%	0.747	S	S	*	*				40.8	132.7	119.6	68.7	0	0	0	0	120.4
443	S	29.2	Very low	31.1	Very low	111 Å²	111	135 Å²	135	78%	0.776	74%	0.737	S	S	*	*			cis	-152.6	136.7	21.8	-49.2	0	0	0	0	112.1
444	T	26.5	Very low	33.3	Very low	125 Å²	125	134.5 Å²	134.5	77%	0.767	73%	0.733	S	S	*	*			trans	-98.8	111.2	172.9	33.7	0	0	0	0	111.9	N446	T444-N446 PolarHBondContact O-N 3.5Å
445	T	28	Very low	36	Very low	131 Å²	131	129.1 Å²	129.1	80%	0.804	71%	0.708	S	S	*	*			trans	-80.9	59.5	169.5	51.5	0	0	0	0	111.8	I447	T445-I447 PolarHBondContact O-N 3.1Å
446	N	25.5	Very low	38.7	Very low	145 Å²	145	125 Å²	125	78%	0.775	69%	0.688	S	S	*	*			trans	-86.5	86.7	168.1	-80.2	-5.7	0	0	0	109.4	T444 S448	T444-N446 PolarHBondContact O-N 3.5Å; N446-S448 PolarHBondContact O-N 3.07Å
447	I	28.9	Very low	41.2	Very low	160 Å²	160	121.7 Å²	121.7	82%	0.821	68%	0.675	S	S	*	*			trans	-74.4	112.9	170	-61.6	177.2	0	0	0	107.9	T445	T445-I447 PolarHBondContact O-N 3.1Å
448	S	29	Very low	44.2	Very low	92 Å²	92	115.3 Å²	115.3	64%	0.643	64%	0.641	S	S	*	*			trans	-77.6	123.6	-178.6	56.8	0	0	0	0	112.4	N446 S450	N446-S448 PolarHBondContact O-N 3.07Å; S448-S450 VanDerWaalsContact C-N 3.33Å; S448-S450 PolarHBondContact O-N 3.14Å
449	E	29.4	Very low	47	Very low	205 Å²	205	117 Å²	117	96%	0.958	64%	0.635	S	S	*	*			trans	-70.7	76.8	175.2	-63.7	-176.6	115.6	0	0	112.4
450	S	28.9	Very low	50	Low	82 Å²	82	109 Å²	109	57%	0.573	60%	0.597	S	S	*	*			trans	-150.4	41.1	-176	61.6	0	0	0	0	116	S448	S448-S450 VanDerWaalsContact C-N 3.33Å; S448-S450 PolarHBondContact O-N 3.14Å
451	N	35	Very low	52.7	Low	135 Å²	135	104 Å²	104	72%	0.722	58%	0.575	S	S	*	*			trans	-155.6	55.8	170.1	-101.6	-44.2	0	0	0	114.9	H453	N451-H453 PolarHBondContact O-N 3.32Å
452	I	47	Very low	55.4	Low	150 Å²	150	102.2 Å²	102.2	77%	0.769	55%	0.552	S	S	*	*			trans	-70.5	114.3	168	-60.1	178.4	0	0	0	108.9	K454	I452-K454 PolarHBondContact O-N 3.35Å; I452-K454 VanDerWaalsContact O-N 3.11Å
453	H	55.3	Low	58.3	Low	114 Å²	114	97.9 Å²	97.9	53%	0.528	52%	0.521	S	S	.	.			trans	-66.3	110	179.2	-69.1	-53.2	0	0	0	111.3	N451 L455 A507	N451-H453 PolarHBondContact O-N 3.32Å; H453-L455 PolarHBondContact O-N 2.96Å; H453-L455 VanDerWaalsContact O-N 3.11Å; H453-A507 HydrophobicContact CB-CB 3.85Å
454	K	76	Confident	60.4	Low	137 Å²	137	100.4 Å²	100.4	60%	0.596	52%	0.515	S	S	*	.	P	Polyproline II helix	trans	-58.6	116.6	-178.2	-152	162.8	-167.6	165.8	0	111	I452 Q508	I452-K454 PolarHBondContact O-N 3.35Å; I452-K454 VanDerWaalsContact O-N 3.11Å; K454-Q508 VanDerWaalsContact O-CB 3.28Å; K454-Q508 WeakPolarHBondContact O-CB 3.36Å; K454-Q508 VanDerWaalsContact O-CG 3.23Å; K454-Q508 WeakPolarHBondContact O-CG 3.47Å; K454-Q508 PolarHBondContact O-N 2.97Å
455	L	85	Confident	62.3	Low	22 Å²	22	96 Å²	96	12%	0.115	49%	0.488	C	S	.	.	B	Isolated β-bridge	trans	-68.6	158	-179.3	-66.9	175.9	0	0	0	112	H453 L502 F506 Q508 Y738 M739	H453-L455 PolarHBondContact O-N 2.96Å; H453-L455 VanDerWaalsContact O-N 3.11Å; L455-L502 WeakPolarHBondContact CD2-O 3.48Å; L455-F506 HydrophobicContact CD2-CB 4.19Å; L455-Q508 PolarHBondContact O-NE2 3.5Å; L455-Y738 HydrophobicContact CD1-CD1 3.93Å; L455-Y738 HydrophobicContact CD1-CE1 4.05Å; L455-M739 HydrophobicContact CD1-CG 4.41Å
456	K	85.7	Confident	63.6	Low	59 Å²	59	95.2 Å²	95.2	26%	0.257	49%	0.488	S	S	.	.	P	Polyproline II helix	trans	-63.5	122.8	167.3	-68.4	176.6	-166.4	-171.7	0	109.1	F506 Q508 M739 R763 S764 N765	K456-F506 WeakPolarHBondContact CG-O 3.29Å; K456-F506 PolarHBondContact N-O 2.95Å; K456-Q508 HydrophobicContact CG-CG 4.12Å; K456-M739 WeakPolarHBondContact O-CE 3.49Å; K456-R763 WeakPolarHBondContact CD-O 3.26Å; K456-R763 PolarHBondContact NZ-O 3.47Å; K456-S764 PolarHBondContact NZ-O 3.21Å; K456-N765 VanDerWaalsContact CE-OD1 3.28Å; K456-N765 WeakPolarHBondContact CE-OD1 3.32Å; K456-N765 PolarHBondContact NZ-OD1 3.35Å
457	P	84	Confident	65	Low	64 Å²	64	96.1 Å²	96.1	42%	0.416	49%	0.485	S	S	.	.	P	Polyproline II helix	trans	-71.6	135.9	-173.5	28.6	-35.4	0	0	0	112.1
458	F	90.6	Very high	66.2	Low	1 Å²	1	98.9 Å²	98.9	0%	0.004	49%	0.487	C	S	.	.			trans	-92.3	108.2	177.4	173.7	-142.5	0	0	0	110.6	W460 M739 N740 K758 L759 V762 L771	F458-W460 HydrophobicContact CD1-CB 4.21Å; F458-W460 HydrophobicContact CD1-CD2 4.08Å; F458-W460 HydrophobicContact CD1-CE3 4.08Å; F458-W460 HydrophobicContact CD1-CG 4.16Å; F458-W460 HydrophobicContact CE1-CB 3.9Å; F458-W460 HydrophobicContact CE1-CD2 4.04Å; F458-W460 AromaticContact CE1-CE3 3.68Å; F458-W460 HydrophobicContact CE1-CE3 3.68Å; F458-W460 HydrophobicContact CE1-CG 4.18Å; F458-W460 HydrophobicContact CE1-CZ3 4.47Å; F458-W460 HydrophobicContact CE2-CB 4.48Å; F458-W460 HydrophobicContact CZ-CB 4.05Å; F458-W460 PolarHBondContact O-N 2.85Å; F458-M739 HydrophobicContact CB-CB 4.28Å; F458-N740 PolarHBondContact N-OD1 3.49Å; F458-N740 PolarHBondContact O-ND2 3.05Å; F458-N740 PolarHBondContact O-OD1 2.9Å; F458-K758 HydrophobicContact CE2-CB 3.88Å; F458-L759 HydrophobicContact CE1-CD1 4.4Å; F458-L759 HydrophobicContact CZ-CD1 3.71Å; F458-L759 HydrophobicContact CZ-CG 4.14Å; F458-V762 HydrophobicContact CD2-CG2 3.62Å; F458-V762 HydrophobicContact CE2-CG2 4.18Å; F458-L771 HydrophobicContact CD1-CD2 4.26Å; F458-L771 HydrophobicContact CD2-CD2 4.34Å; F458-L771 HydrophobicContact CE1-CD2 4.47Å; F458-L771 HydrophobicContact CG-CD2 4.18Å
459	R	87.3	Confident	68.3	Low	199 Å²	199	100.1 Å²	100.1	75%	0.751	49%	0.486	S	S	*	.			trans	-78.9	59.1	-177.1	-69.3	-168.7	174.5	-149.2	0.2	114	L745 K758	R459-L745 HydrophobicContact CG-CD1 4.47Å; R459-K758 WeakPolarHBondContact O-CD 3.33Å; R459-K758 PolarHBondContact O-NZ 3.01Å
460	W	90.9	Very high	71.1	Confident	6 Å²	6	91 Å²	91	2%	0.023	44%	0.444	C	S	.	.			trans	-73.9	167.3	165	65.7	-1.7	0	0	0	112.6	F458 V732 L733 G736 N737 N740 L745 A748 F751	F458-W460 HydrophobicContact CD1-CB 4.21Å; F458-W460 HydrophobicContact CD1-CD2 4.08Å; F458-W460 HydrophobicContact CD1-CE3 4.08Å; F458-W460 HydrophobicContact CD1-CG 4.16Å; F458-W460 HydrophobicContact CE1-CB 3.9Å; F458-W460 HydrophobicContact CE1-CD2 4.04Å; F458-W460 AromaticContact CE1-CE3 3.68Å; F458-W460 HydrophobicContact CE1-CE3 3.68Å; F458-W460 HydrophobicContact CE1-CG 4.18Å; F458-W460 HydrophobicContact CE1-CZ3 4.47Å; F458-W460 HydrophobicContact CE2-CB 4.48Å; F458-W460 HydrophobicContact CZ-CB 4.05Å; F458-W460 PolarHBondContact O-N 2.85Å; W460-V732 WeakPolarHBondContact CZ3-O 3.37Å; W460-L733 HydrophobicContact CH2-CD1 3.8Å; W460-L733 WeakPolarHBondContact CH2-O 3.45Å; W460-L733 HydrophobicContact CZ3-CD1 4.13Å; W460-G736 VanDerWaalsContact CH2-CA 3.43Å; W460-G736 WeakPolarHBondContact CZ2-O 3.33Å; W460-N737 WeakPolarHBondContact CZ2-OD1 3.44Å; W460-N740 PolarHBondContact NE1-ND2 3.03Å; W460-L745 PolarHBondContact NE1-O 2.8Å; W460-A748 HydrophobicContact CH2-CB 4.18Å; W460-A748 HydrophobicContact CZ2-CB 3.63Å; W460-F751 HydrophobicContact CD2-CB 4.19Å; W460-F751 HydrophobicContact CE3-CB 3.77Å; W460-F751 AromaticContact CE3-CD1 3.62Å; W460-F751 HydrophobicContact CE3-CD1 3.62Å; W460-F751 HydrophobicContact CE3-CE1 4.41Å; W460-F751 AromaticContact CE3-CG 3.8Å; W460-F751 HydrophobicContact CE3-CG 3.8Å; W460-F751 HydrophobicContact CH2-CD1 4.38Å; W460-F751 HydrophobicContact CZ3-CB 4.26Å; W460-F751 AromaticContact CZ3-CD1 3.41Å; W460-F751 HydrophobicContact CZ3-CD1 3.41Å; W460-F751 VanDerWaalsContact CZ3-CD1 3.41Å; W460-F751 HydrophobicContact CZ3-CE1 4.03Å; W460-F751 HydrophobicContact CZ3-CG 4.07Å
461	T	88.7	Confident	74	Confident	59 Å²	59	87.3 Å²	87.3	36%	0.362	42%	0.418	S	S	.	.			trans	-105.1	107.9	174.7	-50.7	0	0	0	0	109.6	F751 K752 S755	T461-F751 CarbonylContact O-C 3.56Å; T461-F751 VanDerWaalsContact O-CA 3.29Å; T461-F751 WeakPolarHBondContact O-CA 3.36Å; T461-K752 HydrophobicContact CG2-CD 3.83Å; T461-K752 HydrophobicContact CG2-CG 4.16Å; T461-K752 PolarHBondContact O-N 3.08Å; T461-S755 PolarHBondContact N-OG 3.46Å; T461-S755 VanDerWaalsContact N-OG 3.11Å
462	K	87	Confident	76.6	Confident	40 Å²	40	81.8 Å²	81.8	17%	0.174	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-54.9	148	175.9	-85.1	-171.9	156.9	177.3	0	112.9	Y464 N744 L745 G746 A748	K462-Y464 HydrophobicContact CD-CE1 4.37Å; K462-Y464 WeakPolarHBondContact CD-OH 3.41Å; K462-N744 WeakPolarHBondContact CE-O 3.4Å; K462-N744 PolarHBondContact NZ-O 3.35Å; K462-L745 VanDerWaalsContact CE-C 3.46Å; K462-L745 VanDerWaalsContact CE-O 3.31Å; K462-L745 WeakPolarHBondContact CE-O 3.44Å; K462-G746 WeakPolarHBondContact CE-O 3.38Å; K462-G746 PolarHBondContact NZ-O 2.84Å; K462-A748 HydrophobicContact CD-CB 4.26Å; K462-A748 HydrophobicContact CG-CB 3.79Å
463	V	85.5	Confident	77.8	Confident	19 Å²	19	77.4 Å²	77.4	12%	0.115	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	137	165.4	-178.3	0	0	0	0	108.6	G750 K752 C869	V463-G750 PolarHBondContact N-O 3.41Å; V463-G750 PolarHBondContact O-N 2.81Å; V463-K752 HydrophobicContact CG2-CG 3.82Å; V463-C869 HydrophobicContact CG1-CB 3.6Å
464	Y	74	Confident	77.7	Confident	163 Å²	163	76.2 Å²	76.2	64%	0.639	36%	0.362	S	S	*	.			trans	-105.2	123	176.6	-63.3	-73.5	0	0	0	109.2	K462	K462-Y464 HydrophobicContact CD-CE1 4.37Å; K462-Y464 WeakPolarHBondContact CD-OH 3.41Å
465	T	67.1	Low	75.9	Confident	34 Å²	34	77.3 Å²	77.3	21%	0.209	38%	0.375	C	S	.	.			trans	-91.4	120.5	-172.9	48.5	0	0	0	0	111.6	W472 N473 S749	T465-W472 HydrophobicContact CG2-CB 3.94Å; T465-W472 HydrophobicContact CG2-CG 4.23Å; T465-N473 PolarHBondContact OG1-OD1 3.46Å; T465-S749 WeakPolarHBondContact OG1-CB 3.49Å
466	S	53.9	Low	73.6	Confident	114 Å²	114	80 Å²	80	80%	0.797	39%	0.389	S	S	*	.			trans	-121.8	7.5	-177.2	59.3	0	0	0	0	114.5
467	K	55	Low	71.2	Confident	163 Å²	163	80.4 Å²	80.4	71%	0.709	40%	0.4	S	S	*	.	S	Bend	trans	-143.4	152	-177.8	-63.8	-170.9	178.5	-175.7	0	112.4	N470 N473	K467-N470 PolarHBondContact O-ND2 3.35Å; K467-N473 PolarHBondContact O-ND2 2.93Å
468	Y	55.5	Low	69	Low	219 Å²	219	83.3 Å²	83.3	86%	0.859	42%	0.416	S	S	*	.	S	Bend	trans	-67.9	160.9	177.3	-63.2	-83.2	0	0	0	112.6
469	N	72.9	Confident	66.4	Low	118 Å²	118	86.2 Å²	86.2	63%	0.631	44%	0.436	S	S	*	.	S	Bend	trans	55.3	74.5	178.5	-64.2	5.5	0	0	0	115.2	N476	N469-N476 PolarHBondContact OD1-ND2 2.96Å
470	N	88.1	Confident	63.6	Low	14 Å²	14	81.9 Å²	81.9	8%	0.075	44%	0.436	C	S	.	.	S	Bend	trans	-144	166.6	168	66.7	70.3	0	0	0	109.7	K467 W472 N473 Y867 C869	K467-N470 PolarHBondContact O-ND2 3.35Å; N470-W472 PolarHBondContact O-N 2.93Å; N470-W472 VanDerWaalsContact O-N 3.09Å; N470-W472 WeakPolarHBondContact OD1-CB 3.16Å; N470-W472 PolarHBondContact OD1-N 3.39Å; N470-N473 PolarHBondContact ND2-ND2 3.41Å; N470-N473 PolarHBondContact O-N 2.93Å; N470-N473 PolarHBondContact OD1-N 3.24Å; N470-N473 VanDerWaalsContact OD1-N 3.12Å; N470-Y867 WeakPolarHBondContact CB-O 3.23Å; N470-C869 VanDerWaalsContact CB-SG 3.51Å; N470-C869 VanDerWaalsContact CG-SG 3.54Å
471	V	90.2	Very high	60.6	Low	3 Å²	3	89.1 Å²	89.1	2%	0.018	47%	0.468	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-21.5	-173	72.6	0	0	0	0	114.9	C726 L729 Q730 Y867 F868	V471-C726 HydrophobicContact CG2-CB 4.44Å; V471-L729 HydrophobicContact CG1-CD1 4.4Å; V471-L729 HydrophobicContact CG2-CD1 3.79Å; V471-Q730 PolarHBondContact O-NE2 2.85Å; V471-Y867 HydrophobicContact CB-CD1 4.09Å; V471-Y867 HydrophobicContact CB-CE1 3.61Å; V471-Y867 HydrophobicContact CB-CE2 4.13Å; V471-Y867 HydrophobicContact CG2-CE1 3.78Å; V471-Y867 PolarHBondContact N-O 3.19Å; V471-F868 HydrophobicContact CG1-CD1 4.17Å
472	W	88.6	Confident	57.7	Low	19 Å²	19	92.4 Å²	92.4	7%	0.072	49%	0.488	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.4	-28.2	-176.9	-47.9	112.8	0	0	0	113	T465 N470 N474 L729 L733 S749 G750 F751 F868	T465-W472 HydrophobicContact CG2-CB 3.94Å; T465-W472 HydrophobicContact CG2-CG 4.23Å; N470-W472 PolarHBondContact O-N 2.93Å; N470-W472 VanDerWaalsContact O-N 3.09Å; N470-W472 WeakPolarHBondContact OD1-CB 3.16Å; N470-W472 PolarHBondContact OD1-N 3.39Å; W472-N474 VanDerWaalsContact C-N 3.31Å; W472-N474 PolarHBondContact O-N 3.29Å; W472-L729 HydrophobicContact CH2-CB 3.98Å; W472-L729 HydrophobicContact CH2-CD2 4.09Å; W472-L729 HydrophobicContact CH2-CG 4.49Å; W472-L729 HydrophobicContact CZ3-CB 3.95Å; W472-L733 HydrophobicContact CE3-CD1 4.46Å; W472-L733 HydrophobicContact CE3-CD2 4.12Å; W472-L733 HydrophobicContact CZ3-CB 4.34Å; W472-L733 HydrophobicContact CZ3-CD1 4.41Å; W472-S749 WeakPolarHBondContact CB-O 3.31Å; W472-G750 VanDerWaalsContact CD2-CA 3.44Å; W472-F751 AromaticContact CH2-CD1 3.6Å; W472-F751 HydrophobicContact CH2-CD1 3.6Å; W472-F751 HydrophobicContact CH2-CD2 4.09Å; W472-F751 AromaticContact CH2-CE1 3.42Å; W472-F751 HydrophobicContact CH2-CE1 3.42Å; W472-F751 VanDerWaalsContact CH2-CE1 3.42Å; W472-F751 AromaticContact CH2-CE2 3.93Å; W472-F751 HydrophobicContact CH2-CE2 3.93Å; W472-F751 AromaticContact CH2-CG 3.94Å; W472-F751 HydrophobicContact CH2-CG 3.94Å; W472-F751 AromaticContact CH2-CZ 3.59Å; W472-F751 HydrophobicContact CH2-CZ 3.59Å; W472-F751 HydrophobicContact CZ2-CD1 4.45Å; W472-F751 HydrophobicContact CZ2-CG 4.43Å; W472-F751 WeakPolarHBondContact CZ2-O 3.35Å; W472-F751 AromaticContact CZ3-CD1 3.87Å; W472-F751 HydrophobicContact CZ3-CD1 3.87Å; W472-F751 AromaticContact CZ3-CE1 3.6Å; W472-F751 HydrophobicContact CZ3-CE1 3.6Å; W472-F751 HydrophobicContact CZ3-CZ 4.14Å; W472-F868 PolarHBondContact NE1-O 3.16Å
473	N	72.2	Confident	55.1	Low	59 Å²	59	95.6 Å²	95.6	32%	0.316	52%	0.515	S	S	.	.			trans	-87.4	63.6	-176.3	-79.1	-6.9	0	0	0	111.6	T465 K467 N470 N475	T465-N473 PolarHBondContact OG1-OD1 3.46Å; K467-N473 PolarHBondContact O-ND2 2.93Å; N470-N473 PolarHBondContact ND2-ND2 3.41Å; N470-N473 PolarHBondContact O-N 2.93Å; N470-N473 PolarHBondContact OD1-N 3.24Å; N470-N473 VanDerWaalsContact OD1-N 3.12Å; N473-N475 PolarHBondContact O-N 3.45Å
474	N	53.6	Low	52.5	Low	89 Å²	89	101.2 Å²	101.2	48%	0.476	55%	0.545	S	S	.	.			trans	-83.2	77.3	-171.5	-159.7	8.8	0	0	0	114.2	W472 Q730	W472-N474 VanDerWaalsContact C-N 3.31Å; W472-N474 PolarHBondContact O-N 3.29Å; N474-Q730 PolarHBondContact ND2-NE2 3.1Å; N474-Q730 PolarHBondContact ND2-OE1 3.05Å
475	N	38.6	Very low	50.5	Low	160 Å²	160	101.2 Å²	101.2	86%	0.856	55%	0.55	S	S	*	*			trans	-111.4	-1.5	158.1	-100.4	-8.5	0	0	0	112.2	N473 S477	N473-N475 PolarHBondContact O-N 3.45Å; N475-S477 PolarHBondContact O-N 3.41Å
476	N	37.1	Very low	48.7	Very low	78 Å²	78	106.7 Å²	106.7	42%	0.417	58%	0.578	S	S	.	*			trans	-93.7	104.7	-172.1	-78.2	-0.1	0	0	0	111.8	N469 T478	N469-N476 PolarHBondContact OD1-ND2 2.96Å; N476-T478 PolarHBondContact O-N 2.86Å
477	S	34.3	Very low	47.6	Very low	68 Å²	68	109.9 Å²	109.9	48%	0.476	58%	0.581	S	S	.	*			trans	-67.3	32.7	179.6	62.4	0	0	0	0	116.2	N475 K481	N475-S477 PolarHBondContact O-N 3.41Å; S477-K481 PolarHBondContact OG-NZ 3.21Å
478	T	37.5	Very low	46.4	Very low	125 Å²	125	109.3 Å²	109.3	77%	0.767	59%	0.591	S	S	*	*	S	Bend	trans	-93.8	-1.7	-175.9	47.1	0	0	0	0	114.9	N476	N476-T478 PolarHBondContact O-N 2.86Å
479	C	37	Very low	45.3	Very low	62 Å²	62	103.6 Å²	103.6	42%	0.419	58%	0.578	S	S	.	*	S	Bend	trans	-112.2	13.6	176.5	-92.3	0	0	0	0	114.2	P723	C479-P723 HydrophobicContact CB-CB 4.19Å
480	S	28	Very low	43.1	Very low	108 Å²	108	110 Å²	110	76%	0.755	59%	0.594	S	S	*	*	S	Bend	trans	-152.8	46.6	-170.6	-47.1	0	0	0	0	113.8
481	K	27.4	Very low	40.1	Very low	158 Å²	158	119.3 Å²	119.3	69%	0.687	63%	0.628	S	S	*	*			trans	-139	79.6	-177.8	-77.2	-176	172.4	164.2	0	114.3	S477	S477-K481 PolarHBondContact OG-NZ 3.21Å
482	T	28.4	Very low	37.2	Very low	127 Å²	127	127.7 Å²	127.7	78%	0.779	66%	0.664	S	S	*	*	S	Bend	trans	-146	110.3	156.1	48.2	0	0	0	0	107.8
483	S	31.6	Very low	34.9	Very low	107 Å²	107	132.2 Å²	132.2	75%	0.748	70%	0.696	S	S	*	*	S	Bend	trans	54.9	137.7	177.4	51.1	0	0	0	0	118
484	D	31.9	Very low	33.8	Very low	137 Å²	137	135.9 Å²	135.9	73%	0.733	71%	0.714	S	S	*	*			cis	-155.8	163.2	-11.3	-98.3	-34.8	0	0	0	110.8
485	H	32.2	Very low	33.9	Very low	163 Å²	163	134.4 Å²	134.4	76%	0.755	71%	0.711	S	S	*	*			trans	45.8	119.7	163.6	-63.6	-55.9	0	0	0	122.2
486	N	28.2	Very low	35.4	Very low	150 Å²	150	130.2 Å²	130.2	80%	0.802	69%	0.688	S	S	*	*			trans	31.9	106.5	136.4	-58.3	-2.6	0	0	0	119.8
487	E	31.4	Very low	37.6	Very low	181 Å²	181	126.6 Å²	126.6	85%	0.846	67%	0.669	S	S	*	*				-166.2	147	106.3	-113.7	-168.1	155.2	0	0	113.5	V489	E487-V489 PolarHBondContact O-N 2.77Å
488	T	30.8	Very low	40.1	Very low	150 Å²	150	127 Å²	127	92%	0.92	67%	0.666	S	S	*	*			trans	-83.5	90.7	179.6	42.5	0	0	0	0	112.5
489	V	31.3	Very low	42.6	Very low	99 Å²	99	122.5 Å²	122.5	60%	0.6	64%	0.636	S	S	*	*			trans	-123.1	133.5	165.4	-179.7	0	0	0	0	109.9	E487 R491	E487-V489 PolarHBondContact O-N 2.77Å; V489-R491 HydrophobicContact CB-CG 4.41Å; V489-R491 HydrophobicContact CG1-CG 4.22Å; V489-R491 PolarHBondContact O-N 2.78Å
490	R	26.7	Very low	45.1	Very low	253 Å²	253	122.6 Å²	122.6	96%	0.955	64%	0.638	S	S	*	*			trans	-68.8	71.6	169.5	-69.2	-173.6	-178.5	-174.6	1.9	110.7	K492	R490-K492 PolarHBondContact O-N 3.01Å; R490-K492 VanDerWaalsContact O-N 3.13Å
491	R	26.4	Very low	48.1	Very low	209 Å²	209	120.7 Å²	120.7	79%	0.789	62%	0.616	S	S	*	*			trans	-66.1	111.4	171.2	-65.8	-173.7	-177.6	179.2	3.2	108.1	V489	V489-R491 HydrophobicContact CB-CG 4.41Å; V489-R491 HydrophobicContact CG1-CG 4.22Å; V489-R491 PolarHBondContact O-N 2.78Å
492	K	28.5	Very low	51.2	Low	180 Å²	180	113.1 Å²	113.1	78%	0.783	58%	0.583	S	S	*	*			trans	-54.1	150.6	157.3	-69.6	-179.1	177.1	179.9	0	107.8	R490 I494	R490-K492 PolarHBondContact O-N 3.01Å; R490-K492 VanDerWaalsContact O-N 3.13Å; K492-I494 PolarHBondContact O-N 2.83Å; K492-I494 VanDerWaalsContact O-N 3.09Å
493	P	39.7	Very low	54.2	Low	114 Å²	114	109.6 Å²	109.6	74%	0.74	56%	0.559	S	S	*	*			trans	-51.8	122.6	168	-22.5	33.1	0	0	0	108.8	S495	P493-S495 PolarHBondContact O-N 2.69Å; P493-S495 VanDerWaalsContact O-N 3.17Å
494	I	48.8	Very low	56.9	Low	135 Å²	135	110.2 Å²	110.2	69%	0.692	56%	0.559	S	S	*	*			trans	-77.1	102.4	171.8	-60.5	172.7	0	0	0	104.3	K492 L496	K492-I494 PolarHBondContact O-N 2.83Å; K492-I494 VanDerWaalsContact O-N 3.09Å; I494-L496 PolarHBondContact O-N 3.44Å
495	S	56.4	Low	59.7	Low	59 Å²	59	106.2 Å²	106.2	41%	0.413	54%	0.537	S	S	.	.			trans	-55.2	109.7	176.9	55.2	0	0	0	0	108.4	P493 I497 E734	P493-S495 PolarHBondContact O-N 2.69Å; P493-S495 VanDerWaalsContact O-N 3.17Å; S495-I497 PolarHBondContact O-N 3.32Å; S495-E734 VanDerWaalsContact CB-OE2 3.27Å; S495-E734 WeakPolarHBondContact CB-OE2 3.45Å
496	L	69.2	Low	62.6	Low	71 Å²	71	98.4 Å²	98.4	37%	0.372	50%	0.501	S	S	.	.	S	Bend	trans	-69.7	1.8	-173	-71.4	108.6	0	0	0	113.3	I494 E727 N782 N783	I494-L496 PolarHBondContact O-N 3.44Å; L496-E727 WeakPolarHBondContact CD2-OE1 3.34Å; L496-N782 WeakPolarHBondContact O-CB 3.5Å; L496-N782 PolarHBondContact O-ND2 3.42Å; L496-N783 HydrophobicContact CD2-CB 3.96Å
497	I	84.5	Confident	65.5	Low	3 Å²	3	92 Å²	92	2%	0.015	47%	0.468	C	S	.	.	S	Bend	trans	-125.8	135.2	-179.7	-71	-158.1	0	0	0	110.3	S495 L499 T731 I735 F774 L775 E778	S495-I497 PolarHBondContact O-N 3.32Å; I497-L499 VanDerWaalsContact C-N 3.3Å; I497-L499 HydrophobicContact CG2-CD2 3.96Å; I497-L499 HydrophobicContact CG2-CG 4.33Å; I497-L499 PolarHBondContact O-N 3.06Å; I497-T731 HydrophobicContact CD1-CG2 3.23Å; I497-T731 HydrophobicContact CG1-CG2 3.8Å; I497-I735 HydrophobicContact CD1-CD1 3.84Å; I497-I735 HydrophobicContact CD1-CG1 4.46Å; I497-I735 HydrophobicContact CG2-CG1 4.49Å; I497-F774 HydrophobicContact CG2-CE1 3.63Å; I497-F774 HydrophobicContact CG2-CZ 3.65Å; I497-L775 HydrophobicContact CD1-CD1 3.81Å; I497-E778 HydrophobicContact CB-CB 4.39Å; I497-E778 HydrophobicContact CD1-CB 3.63Å; I497-E778 HydrophobicContact CD1-CG 4.28Å; I497-E778 HydrophobicContact CG1-CB 3.73Å; I497-E778 HydrophobicContact CG1-CG 4.39Å; I497-E778 HydrophobicContact CG2-CB 4.24Å; I497-E778 HydrophobicContact CG2-CG 3.92Å
498	N	86.3	Confident	67.9	Low	77 Å²	77	87.6 Å²	87.6	41%	0.412	45%	0.448	S	S	.	.			trans	-81.4	81.3	173.5	-173.7	-16	0	0	0	109.9	S500 K501 E778	N498-S500 PolarHBondContact O-N 2.78Å; N498-S500 WeakPolarHBondContact OD1-CB 3.28Å; N498-S500 PolarHBondContact OD1-N 2.93Å; N498-S500 PolarHBondContact OD1-OG 2.93Å; N498-K501 HydrophobicContact CB-CD 4.02Å; N498-K501 HydrophobicContact CB-CG 4.38Å; N498-K501 WeakPolarHBondContact O-CB 3.37Å; N498-K501 WeakPolarHBondContact O-CG 3.45Å; N498-K501 PolarHBondContact O-N 3.48Å; N498-K501 VanDerWaalsContact O-N 3.16Å; N498-E778 PolarHBondContact N-OE2 3.06Å
499	L	90.5	Very high	69.6	Low	29 Å²	29	89 Å²	89	15%	0.152	44%	0.441	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.5	-28.1	-177.9	-65.8	170.3	0	0	0	113.5	I497 K501 L502 E734 I735 Y738	I497-L499 VanDerWaalsContact C-N 3.3Å; I497-L499 HydrophobicContact CG2-CD2 3.96Å; I497-L499 HydrophobicContact CG2-CG 4.33Å; I497-L499 PolarHBondContact O-N 3.06Å; L499-K501 PolarHBondContact O-N 3.01Å; L499-K501 VanDerWaalsContact O-N 3.11Å; L499-L502 HydrophobicContact CD2-CD1 3.93Å; L499-L502 WeakPolarHBondContact O-CB 3.49Å; L499-L502 WeakPolarHBondContact O-CG 3.18Å; L499-L502 PolarHBondContact O-N 3.45Å; L499-E734 HydrophobicContact CD1-CB 4.45Å; L499-I735 HydrophobicContact CD2-CB 4.48Å; L499-I735 HydrophobicContact CD2-CG1 3.88Å; L499-Y738 HydrophobicContact CB-CD1 4.14Å; L499-Y738 HydrophobicContact CB-CD2 4.04Å; L499-Y738 HydrophobicContact CB-CE1 4.29Å; L499-Y738 HydrophobicContact CB-CE2 4.21Å; L499-Y738 HydrophobicContact CB-CG 4Å; L499-Y738 HydrophobicContact CD1-CD2 4.08Å; L499-Y738 HydrophobicContact CD1-CG 4.27Å; L499-Y738 HydrophobicContact CD2-CG 4.46Å; L499-Y738 HydrophobicContact CG-CG 4.48Å; L499-Y738 WeakPolarHBondContact O-CE1 3.18Å
500	S	89.3	Confident	70.7	Confident	64 Å²	64	91 Å²	91	45%	0.448	44%	0.444	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-27.4	-179.7	76.2	0	0	0	0	113.6	N498 L502 N503	N498-S500 PolarHBondContact O-N 2.78Å; N498-S500 WeakPolarHBondContact OD1-CB 3.28Å; N498-S500 PolarHBondContact OD1-N 2.93Å; N498-S500 PolarHBondContact OD1-OG 2.93Å; S500-L502 PolarHBondContact O-N 3.26Å; S500-N503 WeakPolarHBondContact O-CB 3.41Å; S500-N503 PolarHBondContact O-N 3.4Å; S500-N503 VanDerWaalsContact O-N 3.1Å; S500-N503 PolarHBondContact O-ND2 3.48Å
501	K	91.5	Very high	71.3	Confident	68 Å²	68	88.8 Å²	88.8	30%	0.296	44%	0.441	S	S	.	.	H	α-helix	trans	-59.2	-27.4	174.5	-66.4	169.8	179.9	166.6	0	112.6	N498 L499 N503 V504 L505 F774 E778	N498-K501 HydrophobicContact CB-CD 4.02Å; N498-K501 HydrophobicContact CB-CG 4.38Å; N498-K501 WeakPolarHBondContact O-CB 3.37Å; N498-K501 WeakPolarHBondContact O-CG 3.45Å; N498-K501 PolarHBondContact O-N 3.48Å; N498-K501 VanDerWaalsContact O-N 3.16Å; L499-K501 PolarHBondContact O-N 3.01Å; L499-K501 VanDerWaalsContact O-N 3.11Å; K501-N503 PolarHBondContact O-N 2.9Å; K501-V504 PolarHBondContact O-N 3.46Å; K501-L505 PolarHBondContact O-N 2.86Å; K501-F774 HydrophobicContact CB-CE2 3.75Å; K501-F774 HydrophobicContact CB-CZ 4.34Å; K501-F774 HydrophobicContact CD-CE2 4.22Å; K501-E778 WeakPolarHBondContact CD-OE1 3.25Å; K501-E778 WeakPolarHBondContact CE-OE1 3.46Å; K501-E778 IonicContact NZ-OE1 2.57Å; K501-E778 PolarHBondContact NZ-OE1 3.33Å; K501-E778 IonicContact NZ-OE2 2.94Å; K501-E778 PolarHBondContact NZ-OE2 3.47Å
502	L	92.5	Very high	71.7	Confident	0 Å²	0	86.4 Å²	86.4	0%	0	44%	0.443	C	S	.	.	H	α-helix	trans	-61.6	-28.7	176.7	-67.3	167.1	0	0	0	112.4	L455 L499 S500 V504 L505 F506 I735 Y738 M739 L771 F774	L455-L502 WeakPolarHBondContact CD2-O 3.48Å; L499-L502 HydrophobicContact CD2-CD1 3.93Å; L499-L502 WeakPolarHBondContact O-CB 3.49Å; L499-L502 WeakPolarHBondContact O-CG 3.18Å; L499-L502 PolarHBondContact O-N 3.45Å; S500-L502 PolarHBondContact O-N 3.26Å; L502-V504 VanDerWaalsContact C-N 3.34Å; L502-V504 PolarHBondContact O-N 3.44Å; L502-L505 PolarHBondContact O-N 2.98Å; L502-F506 HydrophobicContact CB-CD2 4.5Å; L502-F506 HydrophobicContact CD2-CD2 3.54Å; L502-F506 HydrophobicContact CD2-CE2 3.69Å; L502-F506 WeakPolarHBondContact O-CA 3.41Å; L502-F506 WeakPolarHBondContact O-CB 3.27Å; L502-F506 PolarHBondContact O-N 3.5Å; L502-I735 HydrophobicContact CD1-CG2 4.4Å; L502-Y738 HydrophobicContact CB-CD1 4.2Å; L502-Y738 HydrophobicContact CB-CE1 4.2Å; L502-Y738 HydrophobicContact CD1-CD1 3.67Å; L502-Y738 HydrophobicContact CD1-CE1 4.39Å; L502-Y738 HydrophobicContact CD1-CG 4.43Å; L502-M739 HydrophobicContact CD1-CG 4.01Å; L502-M739 HydrophobicContact CD2-CG 4.44Å; L502-M739 HydrophobicContact CD2-SD 4.18Å; L502-L771 HydrophobicContact CD2-CD1 3.91Å; L502-F774 HydrophobicContact CD1-CE1 3.99Å; L502-F774 HydrophobicContact CD1-CZ 4.41Å; L502-F774 HydrophobicContact CD2-CD1 3.52Å; L502-F774 HydrophobicContact CD2-CD2 4.27Å; L502-F774 HydrophobicContact CD2-CE1 3.56Å; L502-F774 HydrophobicContact CD2-CE2 4.33Å; L502-F774 HydrophobicContact CD2-CG 3.88Å; L502-F774 HydrophobicContact CD2-CZ 3.98Å; L502-F774 HydrophobicContact CG-CD1 4.2Å; L502-F774 HydrophobicContact CG-CE1 3.69Å; L502-F774 HydrophobicContact CG-CE2 4.41Å; L502-F774 HydrophobicContact CG-CZ 3.81Å
503	N	90.7	Very high	71.9	Confident	52 Å²	52	82.6 Å²	82.6	28%	0.278	44%	0.439	S	S	.	.	H	α-helix	trans	-65.7	-35.8	178.2	-62.4	-41.9	0	0	0	112.6	S500 K501 A507 Y738	S500-N503 WeakPolarHBondContact O-CB 3.41Å; S500-N503 PolarHBondContact O-N 3.4Å; S500-N503 VanDerWaalsContact O-N 3.1Å; S500-N503 PolarHBondContact O-ND2 3.48Å; K501-N503 PolarHBondContact O-N 2.9Å; N503-A507 WeakPolarHBondContact O-CB 3.49Å; N503-Y738 PolarHBondContact ND2-OH 3.41Å
504	V	89.2	Confident	71.4	Confident	121 Å²	121	85.2 Å²	85.2	73%	0.733	44%	0.444	S	S	*	.	H	α-helix	trans	-74.4	-45.8	175.2	-175.8	0	0	0	0	110.3	K501 L502	K501-V504 PolarHBondContact O-N 3.46Å; L502-V504 VanDerWaalsContact C-N 3.34Å; L502-V504 PolarHBondContact O-N 3.44Å
505	L	90.5	Very high	70.6	Confident	52 Å²	52	87.8 Å²	87.8	27%	0.272	45%	0.45	S	S	.	.	H	α-helix	trans	-78.3	-33.6	-170.9	-65.3	173.1	0	0	0	113.8	K501 L502 S764 N765 F769 F774	K501-L505 PolarHBondContact O-N 2.86Å; L502-L505 PolarHBondContact O-N 2.98Å; L505-S764 CarbonylContact O-C 3.57Å; L505-S764 WeakPolarHBondContact O-CA 3.44Å; L505-S764 VanDerWaalsContact O-CB 3.29Å; L505-S764 WeakPolarHBondContact O-CB 3.45Å; L505-N765 PolarHBondContact O-N 3.15Å; L505-N765 PolarHBondContact O-ND2 2.88Å; L505-F769 HydrophobicContact CD1-CE1 3.95Å; L505-F774 HydrophobicContact CD1-CD2 3.91Å; L505-F774 HydrophobicContact CD1-CE2 4.49Å
506	F	92.7	Very high	69.4	Low	0 Å²	0	91.2 Å²	91.2	0%	0	46%	0.464	C	S	.	.	H	α-helix	trans	-125.8	8.6	-169	-62.4	-92.9	0	0	0	115.1	L455 K456 L502 Q508 M739 V762 S764 L771 F774	L455-F506 HydrophobicContact CD2-CB 4.19Å; K456-F506 WeakPolarHBondContact CG-O 3.29Å; K456-F506 PolarHBondContact N-O 2.95Å; L502-F506 HydrophobicContact CB-CD2 4.5Å; L502-F506 HydrophobicContact CD2-CD2 3.54Å; L502-F506 HydrophobicContact CD2-CE2 3.69Å; L502-F506 WeakPolarHBondContact O-CA 3.41Å; L502-F506 WeakPolarHBondContact O-CB 3.27Å; L502-F506 PolarHBondContact O-N 3.5Å; F506-Q508 PolarHBondContact O-N 3.4Å; F506-M739 HydrophobicContact CB-CE 4.02Å; F506-M739 HydrophobicContact CD1-CE 3.87Å; F506-M739 HydrophobicContact CG-CE 3.94Å; F506-V762 HydrophobicContact CD1-CG1 4.18Å; F506-V762 HydrophobicContact CE1-CG1 4.05Å; F506-S764 VanDerWaalsContact CE1-CA 3.49Å; F506-L771 HydrophobicContact CE1-CB 4.37Å; F506-L771 HydrophobicContact CE2-CD1 4.23Å; F506-L771 HydrophobicContact CZ-CB 4.25Å; F506-L771 HydrophobicContact CZ-CD1 4.07Å; F506-F774 HydrophobicContact CE2-CB 4.31Å
507	A	89	Confident	67.6	Low	14 Å²	14	93.9 Å²	93.9	12%	0.116	49%	0.485	C	S	.	.	B	Isolated β-bridge	trans	-58.7	137.1	171.2	0	0	0	0	0	112.4	H453 N503 K509 N765	H453-A507 HydrophobicContact CB-CB 3.85Å; N503-A507 WeakPolarHBondContact O-CB 3.49Å; A507-K509 PolarHBondContact O-N 3.03Å; A507-N765 PolarHBondContact O-ND2 3.44Å; A507-N765 PolarHBondContact O-OD1 2.91Å
508	Q	81.4	Confident	65	Low	90 Å²	90	102 Å²	102	42%	0.421	52%	0.523	S	S	.	.			trans	-72	123.8	172.3	-65.9	178.2	38.1	0	0	110.5	K454 L455 K456 F506 Q510	K454-Q508 VanDerWaalsContact O-CB 3.28Å; K454-Q508 WeakPolarHBondContact O-CB 3.36Å; K454-Q508 VanDerWaalsContact O-CG 3.23Å; K454-Q508 WeakPolarHBondContact O-CG 3.47Å; K454-Q508 PolarHBondContact O-N 2.97Å; L455-Q508 PolarHBondContact O-NE2 3.5Å; K456-Q508 HydrophobicContact CG-CG 4.12Å; F506-Q508 PolarHBondContact O-N 3.4Å; Q508-Q510 PolarHBondContact O-N 3.06Å
509	K	67.1	Low	62.2	Low	179 Å²	179	106.5 Å²	106.5	78%	0.778	54%	0.544	S	S	*	.			trans	-67	96.5	167.4	-67.7	-175.4	179.5	-179.4	0	109.3	A507 K511	A507-K509 PolarHBondContact O-N 3.03Å; K509-K511 PolarHBondContact O-N 2.86Å
510	Q	53.5	Low	59.2	Low	142 Å²	142	115 Å²	115	66%	0.664	58%	0.579	S	S	*	*			trans	-58.6	132.1	169.7	-67.8	-173.8	5.1	0	0	109.3	Q508 L512	Q508-Q510 PolarHBondContact O-N 3.06Å; Q510-L512 PolarHBondContact O-N 3.34Å
511	K	40.4	Very low	56.3	Low	206 Å²	206	119 Å²	119	90%	0.896	59%	0.594	S	S	*	*			trans	-70.2	99.4	164.1	-84.3	-172.1	173.9	-177.3	0	107.9	K509 S513	K509-K511 PolarHBondContact O-N 2.86Å; K511-S513 VanDerWaalsContact C-N 3.26Å; K511-S513 PolarHBondContact O-N 3.44Å
512	L	34.9	Very low	53.4	Low	159 Å²	159	120.9 Å²	120.9	83%	0.832	62%	0.616	S	S	*	*			trans	-60.8	93.8	159.9	-81	166.3	0	0	0	108.1	Q510 M514	Q510-L512 PolarHBondContact O-N 3.34Å; L512-M514 PolarHBondContact O-N 3.31Å
513	S	31.1	Very low	50.7	Low	99 Å²	99	125.9 Å²	125.9	69%	0.692	65%	0.648	S	S	*	*			trans	-72.1	96.6	168.7	-177.8	0	0	0	0	107.4	K511 K515	K511-S513 VanDerWaalsContact C-N 3.26Å; K511-S513 PolarHBondContact O-N 3.44Å; S513-K515 VanDerWaalsContact C-N 3.29Å; S513-K515 PolarHBondContact O-N 3.12Å
514	M	29.2	Very low	47.7	Very low	170 Å²	170	130.5 Å²	130.5	84%	0.837	67%	0.673	S	S	*	*			trans	-66.6	94.1	166.9	-64.4	-161.8	82.2	0	0	108.1	L512 N516	L512-M514 PolarHBondContact O-N 3.31Å; M514-N516 PolarHBondContact O-N 2.84Å
515	K	33	Very low	45	Very low	188 Å²	188	130.1 Å²	130.1	82%	0.817	67%	0.671	S	S	*	*			trans	-69.2	109.6	162.4	-78.9	-172	172.6	-175	0	107.8	S513 P517	S513-K515 VanDerWaalsContact C-N 3.29Å; S513-K515 PolarHBondContact O-N 3.12Å; K515-P517 WeakPolarHBondContact O-CD 3.47Å
516	N	30.9	Very low	42	Very low	132 Å²	132	136.2 Å²	136.2	71%	0.706	70%	0.698	S	S	*	*			trans	-61.1	127.9	159.3	-77.4	3	0	0	0	108.3	M514 E518	M514-N516 PolarHBondContact O-N 2.84Å; N516-E518 PolarHBondContact O-N 2.96Å
517	P	31.2	Very low	38.9	Very low	127 Å²	127	140.7 Å²	140.7	83%	0.825	73%	0.729	S	S	*	*			trans	-87	80.5	173.7	34.3	-32.1	0	0	0	109.9	K515	K515-P517 WeakPolarHBondContact O-CD 3.47Å
518	E	30.3	Very low	36.1	Very low	174 Å²	174	149.6 Å²	149.6	81%	0.813	77%	0.766	S	S	*	*			trans	-85.4	123.3	166.8	-74.3	-167.1	164.1	0	0	110.6	N516	N516-E518 PolarHBondContact O-N 2.96Å
519	M	26.8	Very low	33.5	Very low	171 Å²	171	151 Å²	151	84%	0.842	78%	0.784	S	S	*	*			trans	-67.6	136.4	175.2	-65.8	176.4	172.2	0	0	110.9
520	K	28.2	Very low	31.6	Very low	206 Å²	206	150.2 Å²	150.2	90%	0.896	79%	0.788	S	S	*	*			trans	-128.1	121.5	149.3	-74.9	-165	174.5	-175.3	0	109.8
521	I	29.3	Very low	30.7	Very low	149 Å²	149	149.5 Å²	149.5	76%	0.764	80%	0.796	S	S	*	*			trans	-89.6	143.6	176.9	-62.2	168.2	0	0	0	107.9
522	S	29.3	Very low	29.9	Very low	107 Å²	107	147.6 Å²	147.6	75%	0.748	79%	0.792	S	S	*	*			trans	-154.5	136.4	168.7	-64.6	0	0	0	0	110.5
523	P	35.8	Very low	29.5	Very low	105 Å²	105	144.5 Å²	144.5	68%	0.682	78%	0.783	S	S	*	*			trans	-113.2	138.8	134.5	-2.9	24.1	0	0	0	109.1
524	N	28.8	Very low	29.2	Very low	150 Å²	150	145.5 Å²	145.5	80%	0.802	79%	0.786	S	S	*	*				67.1	137.1	79.6	-59.4	0	0	0	0	112
525	T	31.6	Very low	29.1	Very low	113 Å²	113	142.7 Å²	142.7	69%	0.693	77%	0.774	S	S	*	*			cis	-144.5	159	39	44.9	0	0	0	0	115.4
526	E	28.8	Very low	28.8	Very low	179 Å²	179	141.1 Å²	141.1	84%	0.836	77%	0.767	S	S	*	*			trans	33.5	146.5	138.4	-65.3	155.9	-142.8	0	0	121.6
527	S	27.7	Very low	28.7	Very low	94 Å²	94	144.2 Å²	144.2	66%	0.657	78%	0.778	S	S	*	*			cis	-159.7	164.1	0.8	43.6	0	0	0	0	107.9
528	F	29.4	Very low	28.3	Very low	201 Å²	201	144.2 Å²	144.2	88%	0.882	78%	0.775	S	S	*	*				-173.6	-179.8	70.7	-127.4	-86.4	0	0	0	111.1
529	C	26.7	Very low	28.3	Very low	119 Å²	119	141.8 Å²	141.8	80%	0.804	77%	0.772	S	S	*	*			trans	-95.2	162.8	-170.7	-57.9	0	0	0	0	117.1
530	L	27.7	Very low	28.3	Very low	163 Å²	163	139.6 Å²	139.6	85%	0.853	76%	0.76	S	S	*	*			trans	-81.1	156.5	156.9	-72.5	172	0	0	0	110
531	P	33.9	Very low	28.3	Very low	128 Å²	128	138 Å²	138	83%	0.831	75%	0.748	S	S	*	*				-147.4	-151.6	69.2	41.1	-19	0	0	0	115.9
532	M	23.9	Very low	28.2	Very low	166 Å²	166	137.6 Å²	137.6	82%	0.818	74%	0.743	S	S	*	*			trans	-104	162.5	-156.3	-58.5	171	56.1	0	0	116.7
533	S	25.3	Very low	28.1	Very low	93 Å²	93	138.3 Å²	138.3	65%	0.65	74%	0.737	S	S	*	*			trans	70.5	143.1	146.9	-68.6	0	0	0	0	118.1
534	T	25.2	Very low	27.7	Very low	121 Å²	121	142.5 Å²	142.5	74%	0.742	74%	0.741	S	S	*	*			cis	-143.6	-148	2.8	7.7	0	0	0	0	109.5
535	D	26.8	Very low	27.7	Very low	111 Å²	111	142.8 Å²	142.8	59%	0.594	74%	0.737	S	S	*	*			cis	-154.7	-165.5	13.1	-150.1	-96.9	0	0	0	113.8
536	K	27.4	Very low	27.5	Very low	154 Å²	154	143.2 Å²	143.2	67%	0.67	74%	0.735	S	S	*	*			trans	-85.1	159.6	-160.8	-55.4	160.1	-161.6	83.8	0	114.8
537	Q	27.9	Very low	27.2	Very low	198 Å²	198	139.4 Å²	139.4	93%	0.925	73%	0.728	S	S	*	*				-154.6	175.5	117.7	-111	175.2	17.2	0	0	111.5
538	T	24	Very low	27.5	Very low	127 Å²	127	139.3 Å²	139.3	78%	0.779	73%	0.725	S	S	*	*			trans	-132.9	-157.8	-156.2	-26.4	0	0	0	0	111.4
539	V	29.1	Very low	27.6	Very low	123 Å²	123	137.6 Å²	137.6	75%	0.745	72%	0.72	S	S	*	*			trans	84.5	131.6	168.5	177.3	0	0	0	0	114.8
540	E	28.3	Very low	27.7	Very low	125 Å²	125	138.4 Å²	138.4	58%	0.584	71%	0.712	S	S	*	*			cis	-167.1	160	-10.9	-112.5	-175.7	-175.5	0	0	111.5
541	R	27.6	Very low	27.7	Very low	173 Å²	173	139 Å²	139	65%	0.653	71%	0.707	S	S	*	*			trans	56.5	167.3	142.8	-66.4	-171.3	164	110.1	10.5	120.6
542	E	26.3	Very low	27.1	Very low	139 Å²	139	142.7 Å²	142.7	65%	0.65	71%	0.711	S	S	*	*			cis	-169.1	-180	-26.8	-98.9	164.3	-160.3	0	0	105.1
543	I	28.8	Very low	27.8	Very low	123 Å²	123	140.6 Å²	140.6	63%	0.631	71%	0.71	S	S	*	*			cis	-159.3	134.3	5.3	-125.7	157.5	0	0	0	108.7
544	Y	26.3	Very low	27.9	Very low	192 Å²	192	139.9 Å²	139.9	75%	0.753	72%	0.717	S	S	*	*			trans	57.2	167.1	164.9	-66.7	-112.1	0	0	0	118.2
545	H	28.7	Very low	27.8	Very low	156 Å²	156	141.5 Å²	141.5	72%	0.722	72%	0.721	S	S	*	*			cis	-152.5	167.5	9.7	-111	-61.6	0	0	0	106.8
546	D	27.4	Very low	28	Very low	122 Å²	122	146 Å²	146	65%	0.652	74%	0.735	S	S	*	*			cis	-154.5	-115.3	-8	-164.3	-101	0	0	0	112
547	S	23.8	Very low	27.8	Very low	100 Å²	100	146 Å²	146	70%	0.699	74%	0.743	S	S	*	*			trans	-163.1	-164.5	-174.7	-80.3	0	0	0	0	108.8
548	P	33.1	Very low	27.8	Very low	92 Å²	92	142.4 Å²	142.4	60%	0.597	73%	0.734	S	S	*	*			cis	-142.2	-174.9	3.3	37.5	-14.2	0	0	0	117.9
549	H	30.6	Very low	27.9	Very low	164 Å²	164	143.9 Å²	143.9	76%	0.759	73%	0.732	S	S	*	*			trans	79.4	140.8	161.3	-55.3	-35.6	0	0	0	118.7
550	Q	30.5	Very low	27.7	Very low	137 Å²	137	145.6 Å²	145.6	64%	0.64	73%	0.732	S	S	*	*			cis	-150.3	138.8	-1.1	-129.4	-177.6	87.9	0	0	114.1
551	K	26.2	Very low	27.5	Very low	175 Å²	175	144.2 Å²	144.2	76%	0.761	74%	0.735	S	S	*	*			trans	65.2	90.2	152	-74.2	166.2	-176.2	157.7	0	122.2
552	F	22.3	Very low	27.5	Very low	205 Å²	205	142.2 Å²	142.2	90%	0.899	74%	0.738	S	S	*	*				-85.6	-173.8	122.6	-88.5	-75.7	0	0	0	109.6
553	P	37.5	Very low	27.4	Very low	123 Å²	123	142.4 Å²	142.4	80%	0.799	74%	0.742	S	S	*	*			cis	-127.8	-162.3	-37.2	34.5	-15.7	0	0	0	111.2
554	G	27.8	Very low	27.5	Very low	77 Å²	77	144.5 Å²	144.5	79%	0.794	75%	0.753	S	S	*	*			trans	169.6	82.4	159.9	0	0	0	0	0	117.9
555	D	23.6	Very low	27.9	Very low	155 Å²	155	141 Å²	141	83%	0.829	75%	0.751	S	S	*	*			trans	-74.4	144.8	168.1	-66.2	-71.4	0	0	0	113.2
556	K	30.2	Very low	28.4	Very low	207 Å²	207	139 Å²	139	90%	0.9	75%	0.753	S	S	*	*				-173.1	159	126.9	-101.1	152	-169.9	173.6	0	113.9
557	N	23.7	Very low	28.7	Very low	154 Å²	154	139 Å²	139	82%	0.824	76%	0.759	S	S	*	*			trans	-88.7	176.9	-176.2	-70.1	-55.1	0	0	0	113.4
558	V	28.2	Very low	29.1	Very low	121 Å²	121	141.4 Å²	141.4	73%	0.733	77%	0.77	S	S	*	*			trans	103.1	101.1	152.6	-173.4	0	0	0	0	117.8
559	Q	25.2	Very low	29	Very low	158 Å²	158	142.2 Å²	142.2	74%	0.738	78%	0.778	S	S	*	*			trans	58.4	141.8	137.5	-66.9	179.7	-91	0	0	124.2
560	E	25.2	Very low	29	Very low	160 Å²	160	140.9 Å²	140.9	75%	0.748	78%	0.776	S	S	*	*			trans	64.7	94	142.1	-71.4	-176.7	164.1	0	0	121.7
561	S	24.6	Very low	29.1	Very low	95 Å²	95	140.6 Å²	140.6	66%	0.664	79%	0.786	S	S	*	*				101.9	150.7	111.3	79.8	0	0	0	0	120.2
562	N	28	Very low	29.5	Very low	131 Å²	131	140.7 Å²	140.7	70%	0.701	79%	0.787	S	S	*	*			trans	74.4	107.5	154.8	-61.4	-31.7	0	0	0	120.4
563	L	24.7	Very low	29.9	Very low	143 Å²	143	139.2 Å²	139.2	75%	0.749	79%	0.787	S	S	*	*				57.7	102.9	125.5	-70.8	149.3	0	0	0	119.2
564	I	30.9	Very low	29.3	Very low	167 Å²	167	141.4 Å²	141.4	86%	0.856	79%	0.791	S	S	*	*				-133	120	113.4	-75.3	102.8	0	0	0	109
565	V	33.8	Very low	29.2	Very low	118 Å²	118	143.5 Å²	143.5	72%	0.715	79%	0.792	S	S	*	*			trans	-134.4	131.7	157.3	176	0	0	0	0	104.7
566	P	39.4	Very low	29.4	Very low	115 Å²	115	140.4 Å²	140.4	75%	0.747	79%	0.788	S	S	*	*			trans	-69.9	135.3	-165.5	26.2	-35	0	0	0	112.8
567	P	33.2	Very low	29.4	Very low	122 Å²	122	136.4 Å²	136.4	79%	0.792	78%	0.776	S	S	*	*			trans	-95.6	127.2	177.1	34.7	-31.1	0	0	0	112.6
568	T	32.5	Very low	29.8	Very low	151 Å²	151	135.8 Å²	135.8	93%	0.926	77%	0.772	S	S	*	*			trans	-139.3	153.8	150.8	45.4	0	0	0	0	109.4
569	S	30.8	Very low	29.7	Very low	109 Å²	109	135.6 Å²	135.6	76%	0.762	78%	0.776	S	S	*	*			trans	-128.2	124.6	-161	55.1	0	0	0	0	113.1
570	D	30	Very low	29.9	Very low	136 Å²	136	136.9 Å²	136.9	73%	0.727	78%	0.776	S	S	*	*			trans	-177.5	137.7	133	-115.3	-30.9	0	0	0	111.1
571	P	34	Very low	30.3	Very low	130 Å²	130	135.4 Å²	135.4	84%	0.844	78%	0.78	S	S	*	*			trans	-130.9	101.9	150.7	33.2	-18.3	0	0	0	111.1
572	K	33.3	Very low	30.6	Very low	178 Å²	178	137.7 Å²	137.7	77%	0.774	78%	0.783	S	S	*	*			trans	-118.9	161	165.2	-82.5	177.8	179.7	164.4	0	110.4
573	L	30.5	Very low	30.9	Very low	174 Å²	174	143.6 Å²	143.6	91%	0.911	80%	0.796	S	S	*	*			trans	70	89.2	174.3	-69.1	164.8	0	0	0	116.7
574	L	25.7	Very low	31	Very low	168 Å²	168	140 Å²	140	88%	0.88	79%	0.793	S	S	*	*			trans	-41.5	156.8	139.2	-86.9	152.9	0	0	0	113.7
575	C	25.2	Very low	31.2	Very low	121 Å²	121	143.9 Å²	143.9	82%	0.818	80%	0.797	S	S	*	*			trans	73.3	103	154.8	-166.3	0	0	0	0	118.8
576	A	29.4	Very low	31.3	Very low	90 Å²	90	143.2 Å²	143.2	74%	0.744	80%	0.798	S	S	*	*			trans	-156.7	105.1	136.1	0	0	0	0	0	112.9
577	I	29.2	Very low	30.7	Very low	124 Å²	124	146.3 Å²	146.3	64%	0.636	81%	0.807	S	S	*	*				46.7	110.2	129.7	-55.3	162	0	0	0	118.6
578	N	31.4	Very low	30.7	Very low	141 Å²	141	145.2 Å²	145.2	75%	0.754	80%	0.803	S	S	*	*				-167	114	107.4	-110.5	-44.3	0	0	0	113.6
579	S	26.4	Very low	30.7	Very low	117 Å²	117	143 Å²	143	82%	0.818	79%	0.793	S	S	*	*			trans	-163.8	110.2	160.6	-82.3	0	0	0	0	109.8
580	Y	29.6	Very low	30.6	Very low	184 Å²	184	143.4 Å²	143.4	72%	0.722	80%	0.796	S	S	*	*			trans	-139.8	149.8	176.6	-78.9	-60.4	0	0	0	106.2
581	P	34.4	Very low	30.9	Very low	129 Å²	129	147 Å²	147	84%	0.838	80%	0.799	S	S	*	*			cis	-137	171.5	50	39.2	-21.7	0	0	0	117.2
582	I	30.2	Very low	30.6	Very low	144 Å²	144	147 Å²	147	74%	0.738	80%	0.797	S	S	*	*			trans	-86.2	136.7	-177.8	-62.6	161.9	0	0	0	111.1
583	R	33.7	Very low	30.5	Very low	254 Å²	254	145.8 Å²	145.8	96%	0.958	80%	0.796	S	S	*	*			trans	-146.2	105.1	147.8	-110.7	-176.9	-179.4	-175.1	1.1	109.1
584	G	28.2	Very low	30.5	Very low	68 Å²	68	145.8 Å²	145.8	70%	0.701	79%	0.791	S	S	*	*			trans	-92.9	171.6	-174.3	0	0	0	0	0	114.5
585	R	34.1	Very low	30.9	Very low	249 Å²	249	147 Å²	147	94%	0.94	79%	0.79	S	S	*	*			trans	-153.9	138.2	159	-110	-178.7	-177.6	-164.7	-0.7	111
586	S	35.4	Very low	31.4	Very low	104 Å²	104	147.7 Å²	147.7	73%	0.727	78%	0.784	S	S	*	*			trans	55.8	93.6	158.2	-163.4	0	0	0	0	118.8
587	L	28.2	Very low	31.7	Very low	180 Å²	180	150.6 Å²	150.6	94%	0.942	78%	0.782	S	S	*	*			trans	-79.3	121.2	147.7	-83.3	162.1	0	0	0	109.3
588	S	32.3	Very low	32.3	Very low	99 Å²	99	151.3 Å²	151.3	69%	0.692	78%	0.781	S	S	*	*			trans	-164	157.7	156.2	59.2	0	0	0	0	111.3
589	S	33.2	Very low	32.7	Very low	105 Å²	105	152.1 Å²	152.1	73%	0.734	78%	0.78	S	S	*	*			trans	65.7	56.1	174.7	-131.7	0	0	0	0	116.7	R591	S589-R591 PolarHBondContact O-N 3.28Å
590	S	27.4	Very low	34	Very low	116 Å²	116	152.3 Å²	152.3	81%	0.811	77%	0.768	S	S	*	*			trans	-64.7	79	155.2	-62.7	0	0	0	0	110.5	T592	S590-T592 PolarHBondContact O-N 3.34Å
591	R	36.2	Very low	35.3	Very low	211 Å²	211	145.1 Å²	145.1	80%	0.796	74%	0.743	S	S	*	*			trans	-69.3	108.9	155.7	-82.3	-172.5	173.2	-175.9	-2.3	107.1	S589 M593	S589-R591 PolarHBondContact O-N 3.28Å; R591-M593 PolarHBondContact O-N 2.9Å
592	T	28.3	Very low	37	Very low	132 Å²	132	145.1 Å²	145.1	81%	0.81	74%	0.736	S	S	*	*			trans	-66.6	75.9	161.2	47.4	0	0	0	0	108.8	S590 E594	S590-T592 PolarHBondContact O-N 3.34Å; T592-E594 PolarHBondContact O-N 3Å
593	M	30.4	Very low	39.4	Very low	151 Å²	151	139.9 Å²	139.9	74%	0.744	71%	0.71	S	S	*	*			trans	-56.5	116.7	148.1	-84.7	-71.5	-171.1	0	0	105.8	R591 F595	R591-M593 PolarHBondContact O-N 2.9Å; M593-F595 VanDerWaalsContact C-N 3.27Å; M593-F595 PolarHBondContact O-N 3.48Å
594	E	31.3	Very low	42	Very low	174 Å²	174	128.1 Å²	128.1	81%	0.813	67%	0.666	S	S	*	*			trans	-61.9	99.3	163.8	-69.3	-179.9	124.4	0	0	106.9	T592 I596	T592-E594 PolarHBondContact O-N 3Å; E594-I596 PolarHBondContact O-N 3.28Å
595	F	33.5	Very low	44.9	Very low	193 Å²	193	131.7 Å²	131.7	85%	0.846	66%	0.664	S	S	*	*			trans	-64.2	81.5	154.4	-96.9	-89.9	0	0	0	106.5	M593 Q597	M593-F595 VanDerWaalsContact C-N 3.27Å; M593-F595 PolarHBondContact O-N 3.48Å; F595-Q597 PolarHBondContact O-N 3.47Å
596	I	35.7	Very low	47.5	Very low	136 Å²	136	124.4 Å²	124.4	70%	0.697	65%	0.652	S	S	*	*			trans	-49.2	105.2	148.2	-61.6	175.2	0	0	0	103.8	E594 K598	E594-I596 PolarHBondContact O-N 3.28Å; I596-K598 PolarHBondContact O-N 2.91Å
597	Q	35.9	Very low	50.2	Low	152 Å²	152	124.4 Å²	124.4	71%	0.71	64%	0.64	S	S	*	*			trans	-62.9	96.4	168.4	-78.7	-176.6	-22.2	0	0	105.6	F595 H599	F595-Q597 PolarHBondContact O-N 3.47Å; Q597-H599 PolarHBondContact O-N 2.87Å
598	K	41.5	Very low	53.3	Low	138 Å²	138	118 Å²	118	60%	0.6	60%	0.603	S	S	*	*			trans	-56.6	96.8	157.1	-77.4	-172.5	173.4	-173.5	0	105.2	I596 E600	I596-K598 PolarHBondContact O-N 2.91Å; K598-E600 HydrophobicContact CB-CG 4.41Å; K598-E600 PolarHBondContact O-N 3.47Å
599	H	40.2	Very low	56.2	Low	159 Å²	159	113.7 Å²	113.7	74%	0.736	57%	0.573	S	S	*	*			trans	-65.8	79.2	160	-89.2	-84.6	0	0	0	106.5	Q597 P601	Q597-H599 PolarHBondContact O-N 2.87Å; H599-P601 VanDerWaalsContact O-CD 3.28Å; H599-P601 WeakPolarHBondContact O-CD 3.36Å; H599-P601 VanDerWaalsContact O-N 3.16Å
600	E	53.3	Low	59.1	Low	121 Å²	121	113 Å²	113	57%	0.565	56%	0.561	S	S	*	*			trans	-56.9	113.4	160.9	-72.4	-179.9	163	0	0	105.8	K598 N602	K598-E600 HydrophobicContact CB-CG 4.41Å; K598-E600 PolarHBondContact O-N 3.47Å; E600-N602 VanDerWaalsContact C-N 3.31Å; E600-N602 PolarHBondContact O-N 3.4Å
601	P	57.3	Low	62.3	Low	32 Å²	32	110.6 Å²	110.6	21%	0.208	54%	0.539	C	S	.	.			trans	-80.5	87.3	-172.9	32.1	-30.6	0	0	0	107.3	H599 L603 F662 M669	H599-P601 VanDerWaalsContact O-CD 3.28Å; H599-P601 WeakPolarHBondContact O-CD 3.36Å; H599-P601 VanDerWaalsContact O-N 3.16Å; P601-L603 HydrophobicContact CB-CD1 4.22Å; P601-L603 HydrophobicContact CB-CG 4.35Å; P601-L603 HydrophobicContact CG-CD1 4.23Å; P601-L603 WeakPolarHBondContact O-CD1 3.4Å; P601-L603 VanDerWaalsContact O-CG 3.25Å; P601-L603 WeakPolarHBondContact O-CG 3Å; P601-L603 PolarHBondContact O-N 3.03Å; P601-F662 HydrophobicContact CB-CD2 4.37Å; P601-F662 HydrophobicContact CB-CE2 3.58Å; P601-F662 HydrophobicContact CB-CZ 4.21Å; P601-F662 HydrophobicContact CG-CE2 3.49Å; P601-F662 VanDerWaalsContact CG-CE2 3.49Å; P601-F662 HydrophobicContact CG-CZ 3.58Å; P601-M669 HydrophobicContact CG-CG 4.16Å
602	N	70.7	Confident	65.1	Low	129 Å²	129	100.6 Å²	100.6	69%	0.69	50%	0.501	S	S	*	.			trans	-58.9	87.2	173.2	-72.9	-51.4	0	0	0	109.7	E600	E600-N602 VanDerWaalsContact C-N 3.31Å; E600-N602 PolarHBondContact O-N 3.4Å
603	L	81.3	Confident	68.2	Low	35 Å²	35	95.7 Å²	95.7	18%	0.183	47%	0.47	C	S	.	.			trans	-90.2	-25.2	179.8	-72.6	151.9	0	0	0	110.3	P601 C658 L659 F662 M669 E673	P601-L603 HydrophobicContact CB-CD1 4.22Å; P601-L603 HydrophobicContact CB-CG 4.35Å; P601-L603 HydrophobicContact CG-CD1 4.23Å; P601-L603 WeakPolarHBondContact O-CD1 3.4Å; P601-L603 VanDerWaalsContact O-CG 3.25Å; P601-L603 WeakPolarHBondContact O-CG 3Å; P601-L603 PolarHBondContact O-N 3.03Å; L603-C658 HydrophobicContact CD2-CB 4.04Å; L603-L659 HydrophobicContact CB-CD2 4.4Å; L603-F662 HydrophobicContact CD1-CB 4.23Å; L603-F662 HydrophobicContact CD1-CD1 4.28Å; L603-F662 HydrophobicContact CD1-CD2 3.68Å; L603-F662 HydrophobicContact CD1-CE2 4.04Å; L603-F662 HydrophobicContact CD1-CG 3.79Å; L603-F662 HydrophobicContact CD1-CZ 4.47Å; L603-F662 HydrophobicContact CD2-CB 4.2Å; L603-F662 HydrophobicContact CD2-CD2 4.11Å; L603-F662 HydrophobicContact CD2-CG 4.41Å; L603-F662 HydrophobicContact CG-CD2 4.39Å; L603-M669 HydrophobicContact CD1-CE 3.58Å; L603-M669 HydrophobicContact CD1-SD 4.32Å; L603-E673 PolarHBondContact N-OE1 2.8Å
604	L	88	Confident	71.2	Confident	6 Å²	6	93.3 Å²	93.3	3%	0.031	46%	0.459	C	S	.	.	S	Bend	trans	-115.1	155.5	170	-56	-179.4	0	0	0	110	R608 I612 E655 E673 F676	L604-R608 HydrophobicContact CB-CB 4.34Å; L604-I612 HydrophobicContact CD1-CD1 3.8Å; L604-E655 HydrophobicContact CD2-CB 3.71Å; L604-E655 HydrophobicContact CD2-CG 3.54Å; L604-E673 HydrophobicContact CB-CG 4.12Å; L604-E673 HydrophobicContact CD1-CB 4.37Å; L604-E673 HydrophobicContact CD1-CG 3.87Å; L604-E673 HydrophobicContact CG-CG 3.91Å; L604-E673 PolarHBondContact N-OE1 3.25Å; L604-E673 VanDerWaalsContact N-OE1 3.14Å; L604-F676 HydrophobicContact CD1-CD2 3.77Å; L604-F676 HydrophobicContact CD1-CE2 4.42Å; L604-F676 HydrophobicContact CD1-CG 4.47Å; L604-F676 HydrophobicContact CD2-CD2 4.43Å
605	E	89.6	Confident	74.2	Confident	144 Å²	144	85.3 Å²	85.3	67%	0.673	42%	0.422	S	S	*	.			trans	-69.4	143.7	172.4	-176.1	175.7	-147.1	0	0	110.8	Q607 R608 C609	E605-Q607 PolarHBondContact O-N 3.19Å; E605-R608 HydrophobicContact CB-CG 4.21Å; E605-R608 WeakPolarHBondContact O-CA 3.09Å; E605-R608 VanDerWaalsContact O-CB 3.27Å; E605-R608 WeakPolarHBondContact O-CB 3.28Å; E605-R608 PolarHBondContact O-N 2.9Å; E605-C609 PolarHBondContact O-N 2.98Å
606	S	88.3	Confident	76.9	Confident	96 Å²	96	77.5 Å²	77.5	67%	0.671	39%	0.389	S	S	*	.	H	α-helix	trans	-51.9	-37.3	-177.2	-175.6	0	0	0	0	113.8	C609 L610	S606-C609 PolarHBondContact O-N 2.9Å; S606-L610 PolarHBondContact O-N 3.38Å
607	Q	91.9	Very high	79.5	Confident	104 Å²	104	78.9 Å²	78.9	49%	0.486	39%	0.385	S	S	.	.	H	α-helix	trans	-69	-31.5	175.6	-172.4	61.1	62.3	0	0	113.1	E605 N611	E605-Q607 PolarHBondContact O-N 3.19Å; Q607-N611 PolarHBondContact NE2-OD1 2.84Å; Q607-N611 PolarHBondContact O-N 2.83Å; Q607-N611 VanDerWaalsContact O-N 3.09Å; Q607-N611 PolarHBondContact O-OD1 3.12Å
608	R	93.8	Very high	82	Confident	44 Å²	44	75.1 Å²	75.1	17%	0.166	37%	0.367	C	S	.	.	H	α-helix	trans	-66.6	-49.7	172	-67.6	-79	-74.1	142.4	-9.8	109.8	L604 E605 L610 N611 I612 L649 L650 E655	L604-R608 HydrophobicContact CB-CB 4.34Å; E605-R608 HydrophobicContact CB-CG 4.21Å; E605-R608 WeakPolarHBondContact O-CA 3.09Å; E605-R608 VanDerWaalsContact O-CB 3.27Å; E605-R608 WeakPolarHBondContact O-CB 3.28Å; E605-R608 PolarHBondContact O-N 2.9Å; R608-L610 VanDerWaalsContact C-N 3.29Å; R608-L610 PolarHBondContact O-N 3.13Å; R608-N611 PolarHBondContact O-N 3.12Å; R608-I612 HydrophobicContact CB-CD1 4.42Å; R608-I612 VanDerWaalsContact O-CD1 3.27Å; R608-I612 WeakPolarHBondContact O-CD1 3.47Å; R608-I612 WeakPolarHBondContact O-CG1 3.42Å; R608-I612 PolarHBondContact O-N 2.83Å; R608-L649 PolarHBondContact NH1-O 2.97Å; R608-L649 PolarHBondContact NH2-O 3.2Å; R608-L649 VanDerWaalsContact NH2-O 3.15Å; R608-L650 PolarHBondContact NH2-O 3.27Å; R608-E655 IonicContact CZ-OE1 3.01Å; R608-E655 IonicContact CZ-OE2 2.81Å; R608-E655 IonicContact NE-OE1 2.74Å; R608-E655 PolarHBondContact NE-OE1 3.45Å; R608-E655 IonicContact NE-OE2 3.65Å; R608-E655 IonicContact NH2-OE1 2.93Å; R608-E655 PolarHBondContact NH2-OE1 2.8Å; R608-E655 IonicContact NH2-OE2 3.3Å; R608-E655 PolarHBondContact NH2-OE2 2.9Å
609	C	92.7	Very high	84	Confident	10 Å²	10	69 Å²	69	7%	0.068	34%	0.341	C	S	.	.	H	α-helix	trans	-54.8	-45.2	175.9	-60.7	0	0	0	0	111.7	E605 S606 I612 N613 A672	E605-C609 PolarHBondContact O-N 2.98Å; S606-C609 PolarHBondContact O-N 2.9Å; C609-I612 PolarHBondContact O-N 3.42Å; C609-N613 VanDerWaalsContact O-CB 3.27Å; C609-N613 WeakPolarHBondContact O-CB 3.02Å; C609-N613 PolarHBondContact O-N 3.27Å; C609-N613 PolarHBondContact O-ND2 3.5Å; C609-A672 HydrophobicContact CB-CB 4.18Å
610	L	93.7	Very high	85.7	Confident	89 Å²	89	69 Å²	69	47%	0.466	34%	0.335	S	S	.	.	H	α-helix	trans	-59.8	-49.3	176.9	179.4	57.1	0	0	0	112.3	S606 R608 I612 N613 I614	S606-L610 PolarHBondContact O-N 3.38Å; R608-L610 VanDerWaalsContact C-N 3.29Å; R608-L610 PolarHBondContact O-N 3.13Å; L610-I612 PolarHBondContact O-N 3.1Å; L610-N613 PolarHBondContact O-N 2.78Å; L610-I614 HydrophobicContact CD1-CD1 3.94Å; L610-I614 HydrophobicContact CD1-CG1 4.28Å; L610-I614 HydrophobicContact CG-CD1 3.99Å; L610-I614 VanDerWaalsContact O-CG1 3.27Å; L610-I614 WeakPolarHBondContact O-CG1 3.4Å; L610-I614 PolarHBondContact O-N 3.48Å
611	N	95.2	Very high	86.3	Confident	66 Å²	66	71.4 Å²	71.4	35%	0.353	35%	0.345	S	S	.	.	H	α-helix	trans	-61.6	-42.6	-179.7	-68.7	-3.1	0	0	0	112	Q607 R608 I614 F615 L649	Q607-N611 PolarHBondContact NE2-OD1 2.84Å; Q607-N611 PolarHBondContact O-N 2.83Å; Q607-N611 VanDerWaalsContact O-N 3.09Å; Q607-N611 PolarHBondContact O-OD1 3.12Å; R608-N611 PolarHBondContact O-N 3.12Å; N611-I614 PolarHBondContact O-N 3.03Å; N611-F615 PolarHBondContact O-N 2.92Å; N611-L649 HydrophobicContact CB-CD2 4.08Å
612	I	94.3	Very high	86.5	Confident	2 Å²	2	73.2 Å²	73.2	1%	0.01	35%	0.353	C	S	.	.	H	α-helix	trans	-68.2	-42.5	178.3	-60.8	156.2	0	0	0	110.5	L604 R608 C609 L610 I614 F615 L616 A672 F675 F676	L604-I612 HydrophobicContact CD1-CD1 3.8Å; R608-I612 HydrophobicContact CB-CD1 4.42Å; R608-I612 VanDerWaalsContact O-CD1 3.27Å; R608-I612 WeakPolarHBondContact O-CD1 3.47Å; R608-I612 WeakPolarHBondContact O-CG1 3.42Å; R608-I612 PolarHBondContact O-N 2.83Å; C609-I612 PolarHBondContact O-N 3.42Å; L610-I612 PolarHBondContact O-N 3.1Å; I612-I614 VanDerWaalsContact C-N 3.31Å; I612-I614 PolarHBondContact O-N 3.23Å; I612-F615 WeakPolarHBondContact O-CB 3.4Å; I612-F615 PolarHBondContact O-N 3.25Å; I612-F615 VanDerWaalsContact O-N 3.14Å; I612-L616 HydrophobicContact CG2-CD1 3.88Å; I612-L616 HydrophobicContact CG2-CG 4.21Å; I612-L616 WeakPolarHBondContact O-CG 3.44Å; I612-L616 PolarHBondContact O-N 2.68Å; I612-A672 HydrophobicContact CB-CB 3.58Å; I612-A672 HydrophobicContact CD1-CB 4.14Å; I612-A672 HydrophobicContact CG1-CB 4.49Å; I612-A672 HydrophobicContact CG2-CB 3.5Å; I612-A672 VanDerWaalsContact CG2-CB 3.5Å; I612-F675 HydrophobicContact CG2-CD1 4.29Å; I612-F676 HydrophobicContact CD1-CD2 3.8Å; I612-F676 HydrophobicContact CD1-CE1 4.24Å; I612-F676 HydrophobicContact CD1-CE2 3.25Å; I612-F676 HydrophobicContact CD1-CZ 3.49Å; I612-F676 VanDerWaalsContact CD1-CZ 3.49Å; I612-F676 HydrophobicContact CG1-CE1 4.31Å; I612-F676 HydrophobicContact CG1-CE2 3.98Å; I612-F676 HydrophobicContact CG1-CZ 3.67Å; I612-F676 HydrophobicContact CG2-CE1 4.12Å; I612-F676 HydrophobicContact CG2-CZ 4.33Å
613	N	93.1	Very high	86.1	Confident	29 Å²	29	76.6 Å²	76.6	16%	0.155	36%	0.364	C	S	.	.	H	α-helix	trans	-63.7	-34.2	176.5	-85.4	-54.7	0	0	0	113	C609 L610 R617 D670	C609-N613 VanDerWaalsContact O-CB 3.27Å; C609-N613 WeakPolarHBondContact O-CB 3.02Å; C609-N613 PolarHBondContact O-N 3.27Å; C609-N613 PolarHBondContact O-ND2 3.5Å; L610-N613 PolarHBondContact O-N 2.78Å; N613-R617 VanDerWaalsContact O-CB 3.31Å; N613-R617 WeakPolarHBondContact O-CB 3.35Å; N613-R617 PolarHBondContact O-N 3.23Å; N613-D670 PolarHBondContact ND2-OD1 3.4Å; N613-D670 PolarHBondContact ND2-OD2 3.43Å
614	I	94.2	Very high	85.6	Confident	100 Å²	100	76.7 Å²	76.7	51%	0.513	36%	0.364	S	S	.	.	H	α-helix	trans	-63.8	-43.2	172.2	-70.9	164.7	0	0	0	110.5	L610 N611 I612 R617	L610-I614 HydrophobicContact CD1-CD1 3.94Å; L610-I614 HydrophobicContact CD1-CG1 4.28Å; L610-I614 HydrophobicContact CG-CD1 3.99Å; L610-I614 VanDerWaalsContact O-CG1 3.27Å; L610-I614 WeakPolarHBondContact O-CG1 3.4Å; L610-I614 PolarHBondContact O-N 3.48Å; N611-I614 PolarHBondContact O-N 3.03Å; I612-I614 VanDerWaalsContact C-N 3.31Å; I612-I614 PolarHBondContact O-N 3.23Å; I614-R617 PolarHBondContact O-N 3.36Å
615	F	93.3	Very high	85.5	Confident	6 Å²	6	80.1 Å²	80.1	3%	0.026	38%	0.382	C	S	.	.	H	α-helix	trans	-64.7	-50.9	174.8	177	-96	0	0	0	112.2	N611 I612 R617 Q618 F619 L626 R642 D645 L646 L649	N611-F615 PolarHBondContact O-N 2.92Å; I612-F615 WeakPolarHBondContact O-CB 3.4Å; I612-F615 PolarHBondContact O-N 3.25Å; I612-F615 VanDerWaalsContact O-N 3.14Å; F615-R617 PolarHBondContact O-N 2.85Å; F615-Q618 VanDerWaalsContact O-CB 3.25Å; F615-Q618 WeakPolarHBondContact O-CB 3.36Å; F615-Q618 WeakPolarHBondContact O-CG 3.23Å; F615-Q618 PolarHBondContact O-N 3.42Å; F615-F619 HydrophobicContact CD1-CE2 4.1Å; F615-F619 HydrophobicContact CE1-CD2 4.43Å; F615-F619 AromaticContact CE1-CE2 3.52Å; F615-F619 HydrophobicContact CE1-CE2 3.52Å; F615-F619 HydrophobicContact CE1-CZ 4.14Å; F615-F619 HydrophobicContact CE2-CE2 4.02Å; F615-F619 HydrophobicContact CE2-CZ 4.4Å; F615-F619 AromaticContact CZ-CE2 3.47Å; F615-F619 HydrophobicContact CZ-CE2 3.47Å; F615-F619 VanDerWaalsContact CZ-CE2 3.47Å; F615-F619 AromaticContact CZ-CZ 3.76Å; F615-F619 HydrophobicContact CZ-CZ 3.76Å; F615-L626 HydrophobicContact CE1-CD2 4.07Å; F615-R642 HydrophobicContact CE2-CB 4.44Å; F615-R642 WeakPolarHBondContact CE2-O 3.28Å; F615-R642 WeakPolarHBondContact CZ-O 3.1Å; F615-D645 HydrophobicContact CD2-CB 4.05Å; F615-D645 HydrophobicContact CE2-CB 3.82Å; F615-L646 HydrophobicContact CE1-CB 4.19Å; F615-L646 HydrophobicContact CE1-CD1 3.91Å; F615-L646 HydrophobicContact CE2-CB 4.37Å; F615-L646 HydrophobicContact CZ-CB 3.7Å; F615-L646 HydrophobicContact CZ-CD1 4.32Å; F615-L646 HydrophobicContact CZ-CG 4.46Å; F615-L649 HydrophobicContact CB-CD1 3.47Å; F615-L649 VanDerWaalsContact CB-CD1 3.47Å; F615-L649 HydrophobicContact CD1-CD1 4.31Å; F615-L649 HydrophobicContact CD2-CD1 3.86Å; F615-L649 HydrophobicContact CG-CD1 3.62Å
616	L	91.2	Very high	85.5	Confident	30 Å²	30	73.7 Å²	73.7	16%	0.157	35%	0.353	C	S	.	.	H	α-helix	trans	-59.8	-30.7	178	-68.5	174.5	0	0	0	112.6	I612 Q618 F619 L626 F675	I612-L616 HydrophobicContact CG2-CD1 3.88Å; I612-L616 HydrophobicContact CG2-CG 4.21Å; I612-L616 WeakPolarHBondContact O-CG 3.44Å; I612-L616 PolarHBondContact O-N 2.68Å; L616-Q618 PolarHBondContact O-N 3.35Å; L616-F619 PolarHBondContact O-N 3.26Å; L616-L626 HydrophobicContact CD2-CD2 4.26Å; L616-F675 HydrophobicContact CD1-CB 3.77Å; L616-F675 HydrophobicContact CD1-CD1 4.1Å; L616-F675 HydrophobicContact CD1-CG 3.99Å; L616-F675 HydrophobicContact CD2-CB 4.46Å; L616-F675 HydrophobicContact CD2-CD1 3.81Å; L616-F675 HydrophobicContact CD2-CD2 4.02Å; L616-F675 HydrophobicContact CD2-CE1 4.01Å; L616-F675 HydrophobicContact CD2-CE2 4.21Å; L616-F675 HydrophobicContact CD2-CG 3.82Å; L616-F675 HydrophobicContact CD2-CZ 4.22Å; L616-F675 HydrophobicContact CG-CD1 4.34Å; L616-F675 HydrophobicContact CG-CG 4.48Å
617	R	90.4	Very high	85.7	Confident	165 Å²	165	70.6 Å²	70.6	62%	0.623	33%	0.329	S	S	*	.	H	α-helix	trans	-61	-29.4	174.5	-173.5	174.3	179.7	175.5	0.2	112.9	N613 I614 F615 F619 R620	N613-R617 VanDerWaalsContact O-CB 3.31Å; N613-R617 WeakPolarHBondContact O-CB 3.35Å; N613-R617 PolarHBondContact O-N 3.23Å; I614-R617 PolarHBondContact O-N 3.36Å; F615-R617 PolarHBondContact O-N 2.85Å; R617-F619 PolarHBondContact O-N 3.33Å; R617-R620 PolarHBondContact O-N 2.97Å
618	Q	87.8	Confident	85.5	Confident	72 Å²	72	69.2 Å²	69.2	34%	0.336	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-26.8	178.4	-57.5	-175.4	23	0	0	113	F615 L616	F615-Q618 VanDerWaalsContact O-CB 3.25Å; F615-Q618 WeakPolarHBondContact O-CB 3.36Å; F615-Q618 WeakPolarHBondContact O-CG 3.23Å; F615-Q618 PolarHBondContact O-N 3.42Å; L616-Q618 PolarHBondContact O-N 3.35Å
619	F	83.9	Confident	85.4	Confident	11 Å²	11	67.8 Å²	67.8	5%	0.048	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.1	-16.3	-176.8	-63.6	-90.5	0	0	0	113.3	F615 L616 R617 H621 I622 L626 I638 R642	F615-F619 HydrophobicContact CD1-CE2 4.1Å; F615-F619 HydrophobicContact CE1-CD2 4.43Å; F615-F619 AromaticContact CE1-CE2 3.52Å; F615-F619 HydrophobicContact CE1-CE2 3.52Å; F615-F619 HydrophobicContact CE1-CZ 4.14Å; F615-F619 HydrophobicContact CE2-CE2 4.02Å; F615-F619 HydrophobicContact CE2-CZ 4.4Å; F615-F619 AromaticContact CZ-CE2 3.47Å; F615-F619 HydrophobicContact CZ-CE2 3.47Å; F615-F619 VanDerWaalsContact CZ-CE2 3.47Å; F615-F619 AromaticContact CZ-CZ 3.76Å; F615-F619 HydrophobicContact CZ-CZ 3.76Å; L616-F619 PolarHBondContact O-N 3.26Å; R617-F619 PolarHBondContact O-N 3.33Å; F619-H621 PolarHBondContact O-N 3.3Å; F619-I622 CarbonylContact O-C 3.56Å; F619-I622 PolarHBondContact O-N 2.92Å; F619-L626 HydrophobicContact CE1-CD1 4.41Å; F619-L626 HydrophobicContact CE2-CD2 4.31Å; F619-L626 HydrophobicContact CZ-CD2 4.41Å; F619-I638 HydrophobicContact CE1-CG1 4.31Å; F619-I638 HydrophobicContact CE1-CG2 4Å; F619-I638 HydrophobicContact CZ-CG2 4.08Å; F619-R642 HydrophobicContact CZ-CB 4.21Å; F619-R642 HydrophobicContact CZ-CG 4.47Å
620	R	76.1	Confident	85.3	Confident	158 Å²	158	67.3 Å²	67.3	60%	0.596	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-16.8	-171.6	-66.4	-178	-170.5	178.3	2	115.8	R617	R617-R620 PolarHBondContact O-N 2.97Å
621	H	65.4	Low	85.1	Confident	171 Å²	171	66.4 Å²	66.4	79%	0.792	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.3	-4	177.1	-62.6	-68.9	0	0	0	113.6	F619	F619-H621 PolarHBondContact O-N 3.3Å
622	I	61.6	Low	84.7	Confident	70 Å²	70	70.9 Å²	70.9	36%	0.359	32%	0.324	S	S	.	.	S	Bend	trans	-124.1	126.6	179.3	-28.4	177.3	0	0	0	105.4	F619 I624	F619-I622 CarbonylContact O-C 3.56Å; F619-I622 PolarHBondContact O-N 2.92Å; I622-I624 HydrophobicContact CB-CD1 3.94Å; I622-I624 HydrophobicContact CB-CG1 4.18Å; I622-I624 HydrophobicContact CD1-CD1 4.28Å; I622-I624 HydrophobicContact CG2-CD1 3.57Å; I622-I624 HydrophobicContact CG2-CG1 3.84Å; I622-I624 PolarHBondContact O-N 3.1Å
623	H	61.7	Low	84.4	Confident	201 Å²	201	70.8 Å²	70.8	93%	0.931	32%	0.324	S	S	*	.			trans	-77.4	51.3	-176.7	-70.4	-86.1	0	0	0	112.3
624	I	70.9	Confident	84.1	Confident	37 Å²	37	72.4 Å²	72.4	19%	0.19	33%	0.333	C	S	.	.			trans	-92.7	119.2	179.8	-74.9	171.7	0	0	0	108.6	I622 L626 L629	I622-I624 HydrophobicContact CB-CD1 3.94Å; I622-I624 HydrophobicContact CB-CG1 4.18Å; I622-I624 HydrophobicContact CD1-CD1 4.28Å; I622-I624 HydrophobicContact CG2-CD1 3.57Å; I622-I624 HydrophobicContact CG2-CG1 3.84Å; I622-I624 PolarHBondContact O-N 3.1Å; I624-L626 PolarHBondContact O-N 2.86Å; I624-L629 HydrophobicContact CB-CD1 4.46Å; I624-L629 HydrophobicContact CD1-CD1 4.4Å; I624-L629 HydrophobicContact CG1-CD1 4.38Å; I624-L629 HydrophobicContact CG2-CD1 3.34Å; I624-L629 HydrophobicContact CG2-CG 4.06Å
625	N	85.8	Confident	83.7	Confident	77 Å²	77	67.7 Å²	67.7	41%	0.412	31%	0.308	S	S	.	.			trans	-78.4	102.5	157.5	-172.8	-3.5	0	0	0	108.6	L627 D628 L629	N625-L627 PolarHBondContact O-N 2.85Å; N625-L627 PolarHBondContact OD1-N 3.34Å; N625-D628 HydrophobicContact CB-CB 4.15Å; N625-D628 VanDerWaalsContact CB-OD2 3.28Å; N625-D628 WeakPolarHBondContact CB-OD2 3.29Å; N625-D628 VanDerWaalsContact CG-CG 3.45Å; N625-D628 PolarHBondContact ND2-OD1 3.49Å; N625-D628 PolarHBondContact ND2-OD2 2.93Å; N625-D628 PolarHBondContact O-N 3.21Å; N625-L629 PolarHBondContact O-N 2.94Å
626	L	90.2	Very high	83.3	Confident	10 Å²	10	71 Å²	71	5%	0.052	33%	0.333	C	S	.	.	H	α-helix	trans	-60.4	-31.2	-178.3	179	58.2	0	0	0	112.1	F615 L616 F619 I624 L629 I630 I638 F675	F615-L626 HydrophobicContact CE1-CD2 4.07Å; L616-L626 HydrophobicContact CD2-CD2 4.26Å; F619-L626 HydrophobicContact CE1-CD1 4.41Å; F619-L626 HydrophobicContact CE2-CD2 4.31Å; F619-L626 HydrophobicContact CZ-CD2 4.41Å; I624-L626 PolarHBondContact O-N 2.86Å; L626-L629 PolarHBondContact O-N 3.3Å; L626-I630 HydrophobicContact CD1-CD1 4.07Å; L626-I630 HydrophobicContact CD1-CG1 4.32Å; L626-I630 HydrophobicContact CG-CD1 3.92Å; L626-I630 WeakPolarHBondContact O-CD1 3.13Å; L626-I630 WeakPolarHBondContact O-CG1 3.33Å; L626-I630 PolarHBondContact O-N 3.43Å; L626-I638 HydrophobicContact CD1-CD1 3.51Å; L626-I638 HydrophobicContact CD1-CG1 4.08Å; L626-F675 HydrophobicContact CB-CE2 4.36Å; L626-F675 HydrophobicContact CD2-CE2 3.83Å; L626-F675 HydrophobicContact CD2-CZ 3.59Å; L626-F675 HydrophobicContact CG-CE2 4.07Å; L626-F675 HydrophobicContact CG-CZ 4.12Å
627	L	91.6	Very high	83.1	Confident	31 Å²	31	72 Å²	72	16%	0.162	34%	0.342	C	S	.	.	H	α-helix	trans	-68.1	-44.7	177.3	-65.8	168.1	0	0	0	111.2	N625 L629 I630 D631 F675 D678 L679 I682	N625-L627 PolarHBondContact O-N 2.85Å; N625-L627 PolarHBondContact OD1-N 3.34Å; L627-L629 VanDerWaalsContact C-N 3.29Å; L627-L629 PolarHBondContact O-N 2.92Å; L627-I630 PolarHBondContact O-N 3.23Å; L627-D631 PolarHBondContact O-N 2.9Å; L627-F675 HydrophobicContact CD1-CD2 4.38Å; L627-F675 HydrophobicContact CD2-CD2 3.84Å; L627-F675 HydrophobicContact CD2-CE2 3.6Å; L627-F675 HydrophobicContact CG-CD2 4.03Å; L627-F675 HydrophobicContact CG-CE2 3.92Å; L627-D678 HydrophobicContact CD1-CB 3.69Å; L627-D678 HydrophobicContact CD2-CB 4.49Å; L627-L679 HydrophobicContact CD2-CB 3.89Å; L627-L679 HydrophobicContact CD2-CD1 4.29Å; L627-I682 HydrophobicContact CB-CD1 4.2Å; L627-I682 HydrophobicContact CD2-CD1 3.91Å
628	D	89.5	Confident	83	Confident	74 Å²	74	64.5 Å²	64.5	40%	0.396	31%	0.314	S	S	.	.	H	α-helix	trans	-67	-29.3	178.3	-56.8	-14.4	0	0	0	112.4	N625 R632	N625-D628 HydrophobicContact CB-CB 4.15Å; N625-D628 VanDerWaalsContact CB-OD2 3.28Å; N625-D628 WeakPolarHBondContact CB-OD2 3.29Å; N625-D628 VanDerWaalsContact CG-CG 3.45Å; N625-D628 PolarHBondContact ND2-OD1 3.49Å; N625-D628 PolarHBondContact ND2-OD2 2.93Å; N625-D628 PolarHBondContact O-N 3.21Å; D628-R632 WeakPolarHBondContact O-CB 3.46Å; D628-R632 WeakPolarHBondContact O-CG 3.48Å; D628-R632 PolarHBondContact O-N 3.43Å; D628-R632 PolarHBondContact O-NE 3.16Å
629	L	90.2	Very high	83.2	Confident	14 Å²	14	62.1 Å²	62.1	7%	0.073	31%	0.309	C	S	.	.	H	α-helix	trans	-72.2	-41	172.6	-70.6	-172.2	0	0	0	111.9	I624 N625 L626 L627 R632 C633 D634 S637 I638 M692	I624-L629 HydrophobicContact CB-CD1 4.46Å; I624-L629 HydrophobicContact CD1-CD1 4.4Å; I624-L629 HydrophobicContact CG1-CD1 4.38Å; I624-L629 HydrophobicContact CG2-CD1 3.34Å; I624-L629 HydrophobicContact CG2-CG 4.06Å; N625-L629 PolarHBondContact O-N 2.94Å; L626-L629 PolarHBondContact O-N 3.3Å; L627-L629 VanDerWaalsContact C-N 3.29Å; L627-L629 PolarHBondContact O-N 2.92Å; L629-R632 CarbonylContact O-C 3.37Å; L629-C633 WeakPolarHBondContact O-CA 3.29Å; L629-C633 PolarHBondContact O-N 3.27Å; L629-D634 HydrophobicContact CD2-CB 4.19Å; L629-D634 PolarHBondContact O-N 3.22Å; L629-S637 WeakPolarHBondContact CD1-OG 3.48Å; L629-I638 HydrophobicContact CB-CD1 4.08Å; L629-I638 HydrophobicContact CD1-CD1 3.81Å; L629-I638 HydrophobicContact CD1-CG1 3.76Å; L629-M692 HydrophobicContact CB-CE 4.44Å
630	I	91.5	Very high	83.7	Confident	0 Å²	0	63.5 Å²	63.5	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-63.1	-46.2	175.9	-70.5	164.7	0	0	0	110.2	L626 L627 R632 C633 L646 F675 L679 I682 K688 I689 M692	L626-I630 HydrophobicContact CD1-CD1 4.07Å; L626-I630 HydrophobicContact CD1-CG1 4.32Å; L626-I630 HydrophobicContact CG-CD1 3.92Å; L626-I630 WeakPolarHBondContact O-CD1 3.13Å; L626-I630 WeakPolarHBondContact O-CG1 3.33Å; L626-I630 PolarHBondContact O-N 3.43Å; L627-I630 PolarHBondContact O-N 3.23Å; I630-R632 PolarHBondContact O-N 2.62Å; I630-C633 PolarHBondContact O-N 2.84Å; I630-C633 VanDerWaalsContact O-N 3.14Å; I630-L646 HydrophobicContact CD1-CD2 3.9Å; I630-F675 HydrophobicContact CD1-CZ 4.46Å; I630-L679 HydrophobicContact CD1-CD1 3.87Å; I630-L679 HydrophobicContact CG2-CD1 4.05Å; I630-I682 HydrophobicContact CB-CD1 4.47Å; I630-I682 HydrophobicContact CG2-CD1 4.21Å; I630-I682 HydrophobicContact CG2-CG2 4.48Å; I630-K688 HydrophobicContact CG2-CB 4.31Å; I630-K688 WeakPolarHBondContact O-CB 3.44Å; I630-K688 WeakPolarHBondContact O-CD 3.3Å; I630-I689 HydrophobicContact CD1-CD1 4.13Å; I630-I689 HydrophobicContact CD1-CG1 4.21Å; I630-I689 HydrophobicContact CG1-CD1 4.47Å; I630-I689 HydrophobicContact CG1-CG1 4.02Å; I630-I689 HydrophobicContact CG2-CD1 4.3Å; I630-I689 HydrophobicContact CG2-CG1 3.9Å; I630-M692 HydrophobicContact CG1-CE 4.03Å; I630-M692 HydrophobicContact CG1-SD 4.31Å
631	D	88.3	Confident	84.6	Confident	70 Å²	70	60.9 Å²	60.9	37%	0.374	31%	0.314	S	S	.	.	H	α-helix	trans	-65.1	-41.3	-178.6	-165.7	44.7	0	0	0	112.4	L627 C633 I682 K688	L627-D631 PolarHBondContact O-N 2.9Å; D631-C633 VanDerWaalsContact C-N 3.27Å; D631-C633 PolarHBondContact O-N 3.43Å; D631-I682 HydrophobicContact CB-CD1 4.31Å; D631-I682 HydrophobicContact CB-CG2 4.3Å; D631-I682 WeakPolarHBondContact OD1-CG2 3.36Å; D631-K688 PolarHBondContact O-NZ 2.87Å; D631-K688 IonicContact OD1-NZ 3.77Å; D631-K688 PolarHBondContact OD1-NZ 2.78Å
632	R	86.7	Confident	85.9	Confident	161 Å²	161	56.6 Å²	56.6	61%	0.608	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.4	0.8	174.3	-65.1	178	-67.7	-177.5	0.1	114.6	D628 L629 I630 D634	D628-R632 WeakPolarHBondContact O-CB 3.46Å; D628-R632 WeakPolarHBondContact O-CG 3.48Å; D628-R632 PolarHBondContact O-N 3.43Å; D628-R632 PolarHBondContact O-NE 3.16Å; L629-R632 CarbonylContact O-C 3.37Å; I630-R632 PolarHBondContact O-N 2.62Å; R632-D634 VanDerWaalsContact C-N 3.32Å; R632-D634 PolarHBondContact O-N 3.49Å
633	C	88.8	Confident	87.6	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	55.3	37.5	179.7	-55.2	0	0	0	0	115	L629 I630 D631 K688 M692 K695 Q833 I836	L629-C633 WeakPolarHBondContact O-CA 3.29Å; L629-C633 PolarHBondContact O-N 3.27Å; I630-C633 PolarHBondContact O-N 2.84Å; I630-C633 VanDerWaalsContact O-N 3.14Å; D631-C633 VanDerWaalsContact C-N 3.27Å; D631-C633 PolarHBondContact O-N 3.43Å; C633-K688 VanDerWaalsContact SG-CG 3.56Å; C633-M692 VanDerWaalsContact C-CG 3.5Å; C633-M692 HydrophobicContact CB-CG 4.43Å; C633-K695 PolarHBondContact O-NZ 3.31Å; C633-Q833 PolarHBondContact SG-NE2 3.03Å; C633-I836 HydrophobicContact CB-CD1 3.7Å
634	D	87	Confident	89.2	Confident	63 Å²	63	46.4 Å²	46.4	34%	0.337	24%	0.242	S	C	.	.			trans	-105.2	102.1	180	-173.3	3.6	0	0	0	111.9	L629 R632 S636 M692	L629-D634 HydrophobicContact CD2-CB 4.19Å; L629-D634 PolarHBondContact O-N 3.22Å; R632-D634 VanDerWaalsContact C-N 3.32Å; R632-D634 PolarHBondContact O-N 3.49Å; D634-S636 WeakPolarHBondContact OD1-CB 3.34Å; D634-S636 PolarHBondContact OD1-N 3.07Å; D634-S636 VanDerWaalsContact OD1-N 3.09Å; D634-S636 PolarHBondContact OD1-OG 3.44Å; D634-M692 VanDerWaalsContact O-CE 3.31Å; D634-M692 WeakPolarHBondContact O-CE 3.37Å
635	G	85.9	Confident	90.4	Very high	0 Å²	0	47 Å²	47	0%	0	25%	0.245	C	C	.	.			trans	-85.2	-11.4	179.4	0	0	0	0	0	115	S637 I638 G639	G635-S637 VanDerWaalsContact C-N 3.3Å; G635-S637 PolarHBondContact O-N 3.18Å; G635-I638 WeakPolarHBondContact O-CB 3.33Å; G635-I638 PolarHBondContact O-N 3.09Å; G635-G639 PolarHBondContact O-N 2.67Å
636	S	85.3	Confident	90.8	Very high	77 Å²	77	43.5 Å²	43.5	54%	0.538	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-32.1	-161	60.6	0	0	0	0	114.3	D634 E696	D634-S636 WeakPolarHBondContact OD1-CB 3.34Å; D634-S636 PolarHBondContact OD1-N 3.07Å; D634-S636 VanDerWaalsContact OD1-N 3.09Å; D634-S636 PolarHBondContact OD1-OG 3.44Å; S636-E696 WeakPolarHBondContact CA-OE1 3.32Å; S636-E696 PolarHBondContact N-OE1 3.38Å
637	S	85.7	Confident	91.1	Very high	51 Å²	51	45.1 Å²	45.1	36%	0.357	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.8	-0.3	177.9	56.6	0	0	0	0	113.9	L629 G635	L629-S637 WeakPolarHBondContact CD1-OG 3.48Å; G635-S637 VanDerWaalsContact C-N 3.3Å; G635-S637 PolarHBondContact O-N 3.18Å
638	I	90.1	Very high	91.3	Very high	7 Å²	7	50 Å²	50	4%	0.036	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.1	-46.7	176.8	-58.7	164.1	0	0	0	110.3	F619 L626 L629 G635 R642 L643 M692	F619-I638 HydrophobicContact CE1-CG1 4.31Å; F619-I638 HydrophobicContact CE1-CG2 4Å; F619-I638 HydrophobicContact CZ-CG2 4.08Å; L626-I638 HydrophobicContact CD1-CD1 3.51Å; L626-I638 HydrophobicContact CD1-CG1 4.08Å; L629-I638 HydrophobicContact CB-CD1 4.08Å; L629-I638 HydrophobicContact CD1-CD1 3.81Å; L629-I638 HydrophobicContact CD1-CG1 3.76Å; G635-I638 WeakPolarHBondContact O-CB 3.33Å; G635-I638 PolarHBondContact O-N 3.09Å; I638-R642 HydrophobicContact CG2-CB 3.78Å; I638-R642 WeakPolarHBondContact O-CD 3.28Å; I638-L643 HydrophobicContact CB-CD2 4.33Å; I638-L643 HydrophobicContact CB-CG 4.28Å; I638-L643 HydrophobicContact CD1-CD2 4.15Å; I638-L643 HydrophobicContact CG2-CD2 3.83Å; I638-L643 HydrophobicContact CG2-CG 3.73Å; I638-M692 HydrophobicContact CD1-CE 3.52Å
639	G	91.1	Very high	91.6	Very high	22 Å²	22	48 Å²	48	23%	0.227	24%	0.243	C	C	.	.			trans	79.6	153.6	-178	0	0	0	0	0	114.5	G635 E641 R642 L643	G635-G639 PolarHBondContact O-N 2.67Å; G639-E641 PolarHBondContact O-N 3.39Å; G639-R642 PolarHBondContact O-N 3.45Å; G639-L643 WeakPolarHBondContact O-CG 3.37Å; G639-L643 PolarHBondContact O-N 3.16Å; G639-L643 VanDerWaalsContact O-N 3.15Å
640	S	94.5	Very high	91.8	Very high	40 Å²	40	48.2 Å²	48.2	28%	0.28	25%	0.245	S	C	.	.	H	α-helix	trans	-58.1	-41	-169.4	57.1	0	0	0	0	115	L643 K644 L693	S640-L643 PolarHBondContact O-N 3.19Å; S640-K644 WeakPolarHBondContact O-CG 3.37Å; S640-K644 PolarHBondContact O-N 3.38Å; S640-L693 VanDerWaalsContact O-CD1 3.31Å; S640-L693 WeakPolarHBondContact O-CD1 3.39Å
641	E	94.6	Very high	92	Very high	103 Å²	103	48.7 Å²	48.7	48%	0.481	25%	0.248	S	C	.	.	H	α-helix	trans	-70.7	-38.5	-176.9	-161.9	56.7	-141.2	0	0	112.7	G639 L643 K644 D645 K648	G639-E641 PolarHBondContact O-N 3.39Å; E641-L643 VanDerWaalsContact C-N 3.31Å; E641-L643 PolarHBondContact O-N 3.45Å; E641-K644 WeakPolarHBondContact O-CB 3.46Å; E641-K644 PolarHBondContact O-N 2.94Å; E641-K644 VanDerWaalsContact OE2-CD 3.32Å; E641-K644 WeakPolarHBondContact OE2-CD 3.34Å; E641-K644 IonicContact OE2-NZ 3.23Å; E641-D645 PolarHBondContact O-N 3.21Å; E641-K648 IonicContact OE1-NZ 2.75Å
642	R	94	Very high	92.2	Very high	80 Å²	80	48.8 Å²	48.8	30%	0.302	25%	0.251	S	S	.	.	H	α-helix	trans	-67.7	-32.1	173.3	-70.1	-173.9	-179.5	148.1	-3.6	112.3	F615 F619 I638 G639 D645 L646	F615-R642 HydrophobicContact CE2-CB 4.44Å; F615-R642 WeakPolarHBondContact CE2-O 3.28Å; F615-R642 WeakPolarHBondContact CZ-O 3.1Å; F619-R642 HydrophobicContact CZ-CB 4.21Å; F619-R642 HydrophobicContact CZ-CG 4.47Å; I638-R642 HydrophobicContact CG2-CB 3.78Å; I638-R642 WeakPolarHBondContact O-CD 3.28Å; G639-R642 PolarHBondContact O-N 3.45Å; R642-D645 PolarHBondContact O-N 3.42Å; R642-L646 WeakPolarHBondContact O-CB 3.41Å; R642-L646 PolarHBondContact O-N 3.25Å
643	L	95.8	Very high	92.5	Very high	0 Å²	0	47 Å²	47	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-68	-36.6	172.5	-69.5	166.1	0	0	0	111.7	I638 G639 S640 E641 L646 I647 I689 M692 L693 E696	I638-L643 HydrophobicContact CB-CD2 4.33Å; I638-L643 HydrophobicContact CB-CG 4.28Å; I638-L643 HydrophobicContact CD1-CD2 4.15Å; I638-L643 HydrophobicContact CG2-CD2 3.83Å; I638-L643 HydrophobicContact CG2-CG 3.73Å; G639-L643 WeakPolarHBondContact O-CG 3.37Å; G639-L643 PolarHBondContact O-N 3.16Å; G639-L643 VanDerWaalsContact O-N 3.15Å; S640-L643 PolarHBondContact O-N 3.19Å; E641-L643 VanDerWaalsContact C-N 3.31Å; E641-L643 PolarHBondContact O-N 3.45Å; L643-L646 PolarHBondContact O-N 3.38Å; L643-I647 WeakPolarHBondContact O-CG1 3.49Å; L643-I647 PolarHBondContact O-N 3.15Å; L643-I689 HydrophobicContact CD2-CG2 4.28Å; L643-M692 HydrophobicContact CD1-CB 3.94Å; L643-M692 HydrophobicContact CD2-CB 4.11Å; L643-M692 HydrophobicContact CD2-CE 4.17Å; L643-L693 HydrophobicContact CB-CB 4.08Å; L643-L693 HydrophobicContact CB-CD1 4.03Å; L643-L693 HydrophobicContact CD1-CB 4.46Å; L643-E696 HydrophobicContact CD1-CG 3.76Å
644	K	96.1	Very high	92.6	Very high	58 Å²	58	54.2 Å²	54.2	25%	0.252	29%	0.287	S	S	.	.	H	α-helix	trans	-63.1	-46	170.8	-70.3	164.8	-172.5	170.1	0	111.7	S640 E641 L646 I647 K648 L693 E697	S640-K644 WeakPolarHBondContact O-CG 3.37Å; S640-K644 PolarHBondContact O-N 3.38Å; E641-K644 WeakPolarHBondContact O-CB 3.46Å; E641-K644 PolarHBondContact O-N 2.94Å; E641-K644 VanDerWaalsContact OE2-CD 3.32Å; E641-K644 WeakPolarHBondContact OE2-CD 3.34Å; E641-K644 IonicContact OE2-NZ 3.23Å; K644-L646 VanDerWaalsContact C-N 3.34Å; K644-I647 PolarHBondContact O-N 3.47Å; K644-K648 VanDerWaalsContact O-CG 3.28Å; K644-K648 WeakPolarHBondContact O-CG 3.3Å; K644-K648 PolarHBondContact O-N 2.89Å; K644-L693 HydrophobicContact CG-CD1 3.9Å; K644-L693 HydrophobicContact CG-CD2 3.83Å; K644-E697 WeakPolarHBondContact CE-OE1 3.41Å; K644-E697 IonicContact NZ-OE1 2.83Å; K644-E697 PolarHBondContact NZ-OE1 3.35Å
645	D	95.5	Very high	93	Very high	50 Å²	50	52.3 Å²	52.3	27%	0.267	28%	0.277	S	S	.	.	H	α-helix	trans	-62.9	-39.4	176.6	-81.5	-11.5	0	0	0	112.4	F615 E641 R642 I647 K648 L649	F615-D645 HydrophobicContact CD2-CB 4.05Å; F615-D645 HydrophobicContact CE2-CB 3.82Å; E641-D645 PolarHBondContact O-N 3.21Å; R642-D645 PolarHBondContact O-N 3.42Å; D645-I647 PolarHBondContact O-N 3.17Å; D645-K648 PolarHBondContact O-N 2.88Å; D645-K648 WeakPolarHBondContact OD1-CE 3.19Å; D645-K648 IonicContact OD1-NZ 2.91Å; D645-K648 PolarHBondContact OD1-NZ 3.26Å; D645-L649 WeakPolarHBondContact O-CB 3.24Å; D645-L649 VanDerWaalsContact O-CG 3.3Å; D645-L649 WeakPolarHBondContact O-CG 3.29Å; D645-L649 PolarHBondContact O-N 2.88Å; D645-L649 VanDerWaalsContact O-N 3.1Å
646	L	95.3	Very high	93.3	Very high	2 Å²	2	53.8 Å²	53.8	1%	0.01	28%	0.284	C	S	.	.	H	α-helix	trans	-58.3	-49	172	-178.4	54.9	0	0	0	111.2	F615 I630 R642 L643 K644 K648 L649 L650 F675 I689	F615-L646 HydrophobicContact CE1-CB 4.19Å; F615-L646 HydrophobicContact CE1-CD1 3.91Å; F615-L646 HydrophobicContact CE2-CB 4.37Å; F615-L646 HydrophobicContact CZ-CB 3.7Å; F615-L646 HydrophobicContact CZ-CD1 4.32Å; F615-L646 HydrophobicContact CZ-CG 4.46Å; I630-L646 HydrophobicContact CD1-CD2 3.9Å; R642-L646 WeakPolarHBondContact O-CB 3.41Å; R642-L646 PolarHBondContact O-N 3.25Å; L643-L646 PolarHBondContact O-N 3.38Å; K644-L646 VanDerWaalsContact C-N 3.34Å; L646-K648 VanDerWaalsContact C-N 3.33Å; L646-K648 PolarHBondContact O-N 2.95Å; L646-L649 PolarHBondContact O-N 3.11Å; L646-L650 HydrophobicContact CD1-CD2 4.03Å; L646-L650 HydrophobicContact CG-CD2 4.18Å; L646-L650 WeakPolarHBondContact O-CG 3.44Å; L646-L650 PolarHBondContact O-N 2.85Å; L646-L650 VanDerWaalsContact O-N 3.08Å; L646-F675 HydrophobicContact CD1-CE1 4.17Å; L646-F675 HydrophobicContact CD1-CZ 4.33Å; L646-I689 HydrophobicContact CD2-CD1 3.78Å; L646-I689 HydrophobicContact CD2-CG1 4.11Å; L646-I689 HydrophobicContact CD2-CG2 4.05Å; L646-I689 HydrophobicContact CG-CD1 4.17Å; L646-I689 HydrophobicContact CG-CG2 4.37Å
647	I	95.8	Very high	93.6	Very high	45 Å²	45	57 Å²	57	23%	0.231	29%	0.288	C	S	.	.	H	α-helix	trans	-59.1	-41.2	177.7	-69.7	173.1	0	0	0	111.7	L643 K644 D645 L649 I689 L693	L643-I647 WeakPolarHBondContact O-CG1 3.49Å; L643-I647 PolarHBondContact O-N 3.15Å; K644-I647 PolarHBondContact O-N 3.47Å; D645-I647 PolarHBondContact O-N 3.17Å; I647-L649 PolarHBondContact O-N 2.93Å; I647-I689 HydrophobicContact CD1-CG2 4.07Å; I647-I689 HydrophobicContact CG1-CG2 3.63Å; I647-L693 HydrophobicContact CD1-CB 4.42Å; I647-L693 HydrophobicContact CD1-CD2 3.65Å
648	K	95.5	Very high	93.9	Very high	134 Å²	134	57.5 Å²	57.5	58%	0.583	29%	0.291	S	S	*	.	H	α-helix	trans	-62.4	-27.3	174.8	-64.9	164.4	-149.6	164.1	0	112.6	E641 K644 D645 L646	E641-K648 IonicContact OE1-NZ 2.75Å; K644-K648 VanDerWaalsContact O-CG 3.28Å; K644-K648 WeakPolarHBondContact O-CG 3.3Å; K644-K648 PolarHBondContact O-N 2.89Å; D645-K648 PolarHBondContact O-N 2.88Å; D645-K648 WeakPolarHBondContact OD1-CE 3.19Å; D645-K648 IonicContact OD1-NZ 2.91Å; D645-K648 PolarHBondContact OD1-NZ 3.26Å; L646-K648 VanDerWaalsContact C-N 3.33Å; L646-K648 PolarHBondContact O-N 2.95Å
649	L	95.6	Very high	93.9	Very high	30 Å²	30	57.2 Å²	57.2	16%	0.157	29%	0.29	C	S	.	.	H	α-helix	trans	-95.8	-17.8	-174	-73.3	170.1	0	0	0	114.9	R608 N611 F615 D645 L646 I647 F676	R608-L649 PolarHBondContact NH1-O 2.97Å; R608-L649 PolarHBondContact NH2-O 3.2Å; R608-L649 VanDerWaalsContact NH2-O 3.15Å; N611-L649 HydrophobicContact CB-CD2 4.08Å; F615-L649 HydrophobicContact CB-CD1 3.47Å; F615-L649 VanDerWaalsContact CB-CD1 3.47Å; F615-L649 HydrophobicContact CD1-CD1 4.31Å; F615-L649 HydrophobicContact CD2-CD1 3.86Å; F615-L649 HydrophobicContact CG-CD1 3.62Å; D645-L649 WeakPolarHBondContact O-CB 3.24Å; D645-L649 VanDerWaalsContact O-CG 3.3Å; D645-L649 WeakPolarHBondContact O-CG 3.29Å; D645-L649 PolarHBondContact O-N 2.88Å; D645-L649 VanDerWaalsContact O-N 3.1Å; L646-L649 PolarHBondContact O-N 3.11Å; I647-L649 PolarHBondContact O-N 2.93Å; L649-F676 VanDerWaalsContact O-CZ 3.25Å; L649-F676 WeakPolarHBondContact O-CZ 3.37Å
650	L	95.5	Very high	93.9	Very high	20 Å²	20	63.1 Å²	63.1	11%	0.105	31%	0.309	C	S	.	.	P	Polyproline II helix	trans	-46.9	152.9	-171.6	-70.6	-178.1	0	0	0	114.7	R608 L646 L679 Y685 Y686 I689	R608-L650 PolarHBondContact NH2-O 3.27Å; L646-L650 HydrophobicContact CD1-CD2 4.03Å; L646-L650 HydrophobicContact CG-CD2 4.18Å; L646-L650 WeakPolarHBondContact O-CG 3.44Å; L646-L650 PolarHBondContact O-N 2.85Å; L646-L650 VanDerWaalsContact O-N 3.08Å; L650-L679 HydrophobicContact CD2-CD2 3.87Å; L650-Y685 HydrophobicContact CD1-CE2 4.29Å; L650-Y685 HydrophobicContact CD2-CD2 4.45Å; L650-Y685 HydrophobicContact CD2-CE2 4.16Å; L650-Y686 HydrophobicContact CD1-CD2 3.63Å; L650-Y686 HydrophobicContact CD1-CE2 4.22Å; L650-I689 HydrophobicContact CD1-CD1 4.43Å; L650-I689 HydrophobicContact CD2-CD1 3.91Å
651	P	94.1	Very high	93.7	Very high	9 Å²	9	64.6 Å²	64.6	6%	0.058	32%	0.323	C	S	.	.	P	Polyproline II helix	trans	-66.3	138.4	178.6	26.3	-32.6	0	0	0	111.6	E655 I656 L659 F676 V680	P651-E655 WeakPolarHBondContact CA-OE2 3.32Å; P651-E655 HydrophobicContact CB-CB 3.93Å; P651-I656 HydrophobicContact CB-CG1 4Å; P651-I656 HydrophobicContact CG-CG1 4.05Å; P651-I656 WeakPolarHBondContact O-CD1 3.5Å; P651-L659 HydrophobicContact CB-CD1 4.35Å; P651-F676 HydrophobicContact CB-CD2 3.69Å; P651-F676 HydrophobicContact CB-CE2 3.93Å; P651-F676 HydrophobicContact CB-CG 4.37Å; P651-F676 HydrophobicContact CG-CD2 3.98Å; P651-F676 HydrophobicContact CG-CE2 4.24Å; P651-F676 HydrophobicContact CG-CG 4.21Å; P651-V680 HydrophobicContact CB-CG2 4.47Å; P651-V680 HydrophobicContact CG-CG2 3.6Å
652	T	94	Very high	93.4	Very high	73 Å²	73	61 Å²	61	45%	0.448	31%	0.307	S	S	.	.	P	Polyproline II helix	trans	-74.4	164.8	175.4	60.2	0	0	0	0	112.1	Q654 E655 I656	T652-Q654 PolarHBondContact O-N 3.37Å; T652-E655 WeakPolarHBondContact CB-OE2 3.47Å; T652-E655 WeakPolarHBondContact CG2-OE2 3.48Å; T652-E655 PolarHBondContact N-OE2 3.47Å; T652-E655 PolarHBondContact O-N 3.12Å; T652-E655 WeakPolarHBondContact OG1-CG 3.32Å; T652-E655 PolarHBondContact OG1-N 3.5Å; T652-E655 PolarHBondContact OG1-OE2 3.01Å; T652-I656 WeakPolarHBondContact O-CB 3.28Å; T652-I656 VanDerWaalsContact O-CG1 3.27Å; T652-I656 WeakPolarHBondContact O-CG1 3.47Å; T652-I656 PolarHBondContact O-N 2.83Å
653	D	92.7	Very high	92.9	Very high	122 Å²	122	66.3 Å²	66.3	65%	0.652	34%	0.335	S	S	*	.	H	α-helix	trans	-56.1	-20.1	177.8	-69.3	-36.2	0	0	0	115.1	K657	D653-K657 WeakPolarHBondContact O-CD 3.35Å; D653-K657 VanDerWaalsContact O-CE 3.32Å; D653-K657 WeakPolarHBondContact O-CE 3.47Å; D653-K657 VanDerWaalsContact O-CG 3.25Å; D653-K657 WeakPolarHBondContact O-CG 3.32Å
654	Q	91.5	Very high	92.5	Very high	153 Å²	153	68.1 Å²	68.1	72%	0.715	35%	0.353	S	S	*	.	H	α-helix	trans	-83.8	-51	173.8	-66.5	-176.5	-6.3	0	0	110.6	T652 I656 K657 C658	T652-Q654 PolarHBondContact O-N 3.37Å; Q654-I656 VanDerWaalsContact C-N 3.32Å; Q654-I656 PolarHBondContact O-N 3.22Å; Q654-K657 WeakPolarHBondContact O-CB 3.42Å; Q654-K657 PolarHBondContact O-N 3.26Å; Q654-C658 PolarHBondContact O-N 3.02Å; Q654-C658 PolarHBondContact O-SG 3.29Å
655	E	93.4	Very high	91.9	Very high	23 Å²	23	69.1 Å²	69.1	11%	0.107	36%	0.361	C	S	.	.	H	α-helix	trans	-57.6	-43.1	176.4	-65.3	166.6	134.6	0	0	111.3	L604 R608 P651 T652 K657 C658 L659	L604-E655 HydrophobicContact CD2-CB 3.71Å; L604-E655 HydrophobicContact CD2-CG 3.54Å; R608-E655 IonicContact CZ-OE1 3.01Å; R608-E655 IonicContact CZ-OE2 2.81Å; R608-E655 IonicContact NE-OE1 2.74Å; R608-E655 PolarHBondContact NE-OE1 3.45Å; R608-E655 IonicContact NE-OE2 3.65Å; R608-E655 IonicContact NH2-OE1 2.93Å; R608-E655 PolarHBondContact NH2-OE1 2.8Å; R608-E655 IonicContact NH2-OE2 3.3Å; R608-E655 PolarHBondContact NH2-OE2 2.9Å; P651-E655 WeakPolarHBondContact CA-OE2 3.32Å; P651-E655 HydrophobicContact CB-CB 3.93Å; T652-E655 WeakPolarHBondContact CB-OE2 3.47Å; T652-E655 WeakPolarHBondContact CG2-OE2 3.48Å; T652-E655 PolarHBondContact N-OE2 3.47Å; T652-E655 PolarHBondContact O-N 3.12Å; T652-E655 WeakPolarHBondContact OG1-CG 3.32Å; T652-E655 PolarHBondContact OG1-N 3.5Å; T652-E655 PolarHBondContact OG1-OE2 3.01Å; E655-K657 VanDerWaalsContact C-N 3.29Å; E655-K657 PolarHBondContact O-N 3.19Å; E655-C658 PolarHBondContact O-N 3.06Å; E655-L659 WeakPolarHBondContact O-CB 3.42Å; E655-L659 WeakPolarHBondContact O-CD1 3.45Å; E655-L659 WeakPolarHBondContact O-CG 3.38Å; E655-L659 PolarHBondContact O-N 3.11Å
656	I	93.2	Very high	91.4	Very high	30 Å²	30	68 Å²	68	15%	0.154	36%	0.356	C	S	.	.	H	α-helix	trans	-55.6	-41.5	174.2	-68.6	167.2	0	0	0	111.6	P651 T652 Q654 K660 V680 Y685	P651-I656 HydrophobicContact CB-CG1 4Å; P651-I656 HydrophobicContact CG-CG1 4.05Å; P651-I656 WeakPolarHBondContact O-CD1 3.5Å; T652-I656 WeakPolarHBondContact O-CB 3.28Å; T652-I656 VanDerWaalsContact O-CG1 3.27Å; T652-I656 WeakPolarHBondContact O-CG1 3.47Å; T652-I656 PolarHBondContact O-N 2.83Å; Q654-I656 VanDerWaalsContact C-N 3.32Å; Q654-I656 PolarHBondContact O-N 3.22Å; I656-K660 HydrophobicContact CG2-CD 4.26Å; I656-K660 WeakPolarHBondContact O-CB 3.21Å; I656-K660 WeakPolarHBondContact O-CG 3.15Å; I656-K660 PolarHBondContact O-N 3.23Å; I656-V680 HydrophobicContact CG1-CG2 4.22Å; I656-V680 HydrophobicContact CG2-CG1 3.97Å; I656-Y685 VanDerWaalsContact CD1-OH 3.23Å; I656-Y685 WeakPolarHBondContact CD1-OH 3.5Å
657	K	92	Very high	90.8	Very high	146 Å²	146	74 Å²	74	64%	0.635	39%	0.388	S	S	*	.	H	α-helix	trans	-71.3	-43.6	-179.9	-72.6	167.4	-168.9	162	0	111.3	D653 Q654 E655 K660 A661	D653-K657 WeakPolarHBondContact O-CD 3.35Å; D653-K657 VanDerWaalsContact O-CE 3.32Å; D653-K657 WeakPolarHBondContact O-CE 3.47Å; D653-K657 VanDerWaalsContact O-CG 3.25Å; D653-K657 WeakPolarHBondContact O-CG 3.32Å; Q654-K657 WeakPolarHBondContact O-CB 3.42Å; Q654-K657 PolarHBondContact O-N 3.26Å; E655-K657 VanDerWaalsContact C-N 3.29Å; E655-K657 PolarHBondContact O-N 3.19Å; K657-K660 PolarHBondContact O-N 3.2Å; K657-A661 VanDerWaalsContact O-CB 3.23Å; K657-A661 WeakPolarHBondContact O-CB 3.29Å; K657-A661 PolarHBondContact O-N 2.94Å
658	C	91.3	Very high	90.3	Very high	60 Å²	60	77.6 Å²	77.6	41%	0.405	40%	0.4	S	S	.	.	H	α-helix	trans	-59.5	-48.1	175.3	-64.2	0	0	0	0	111.3	L603 Q654 E655 K660 A661 F662	L603-C658 HydrophobicContact CD2-CB 4.04Å; Q654-C658 PolarHBondContact O-N 3.02Å; Q654-C658 PolarHBondContact O-SG 3.29Å; E655-C658 PolarHBondContact O-N 3.06Å; C658-K660 PolarHBondContact O-N 2.83Å; C658-A661 PolarHBondContact O-N 2.93Å; C658-F662 PolarHBondContact O-N 2.95Å; C658-F662 VanDerWaalsContact O-N 3.12Å
659	L	91.3	Very high	89.9	Confident	2 Å²	2	72.1 Å²	72.1	1%	0.01	38%	0.376	C	S	.	.	H	α-helix	trans	-63.5	-41.1	179	-68.2	164.6	0	0	0	112.4	L603 P651 E655 F662 M669 F676 Y677 V680	L603-L659 HydrophobicContact CB-CD2 4.4Å; P651-L659 HydrophobicContact CB-CD1 4.35Å; E655-L659 WeakPolarHBondContact O-CB 3.42Å; E655-L659 WeakPolarHBondContact O-CD1 3.45Å; E655-L659 WeakPolarHBondContact O-CG 3.38Å; E655-L659 PolarHBondContact O-N 3.11Å; L659-F662 PolarHBondContact O-N 2.88Å; L659-M669 HydrophobicContact CD2-CE 4.11Å; L659-F676 HydrophobicContact CD1-CB 3.68Å; L659-Y677 WeakPolarHBondContact O-CD2 3.41Å; L659-Y677 WeakPolarHBondContact O-CE2 3.31Å; L659-V680 HydrophobicContact CD1-CG2 4.21Å
660	K	89.6	Confident	89.6	Confident	145 Å²	145	73.4 Å²	73.4	63%	0.63	38%	0.383	S	S	*	.	H	α-helix	trans	-72.4	-26.2	176.1	-73.1	-172	-179.3	-168.3	0	114.1	I656 K657 C658 V680	I656-K660 HydrophobicContact CG2-CD 4.26Å; I656-K660 WeakPolarHBondContact O-CB 3.21Å; I656-K660 WeakPolarHBondContact O-CG 3.15Å; I656-K660 PolarHBondContact O-N 3.23Å; K657-K660 PolarHBondContact O-N 3.2Å; C658-K660 PolarHBondContact O-N 2.83Å; K660-V680 HydrophobicContact CD-CG1 4.04Å; K660-V680 WeakPolarHBondContact CE-O 3.09Å; K660-V680 HydrophobicContact CG-CG1 3.61Å
661	A	90.2	Very high	89.3	Confident	71 Å²	71	76.3 Å²	76.3	59%	0.587	40%	0.403	S	S	*	.	H	α-helix	trans	-86.2	-7	176.9	0	0	0	0	0	113.3	K657 C658 Q663	K657-A661 VanDerWaalsContact O-CB 3.23Å; K657-A661 WeakPolarHBondContact O-CB 3.29Å; K657-A661 PolarHBondContact O-N 2.94Å; C658-A661 PolarHBondContact O-N 2.93Å; A661-Q663 PolarHBondContact O-N 2.6Å
662	F	89.3	Confident	89.2	Confident	29 Å²	29	75.9 Å²	75.9	13%	0.127	40%	0.4	C	S	.	.			trans	-72.2	121.4	-175.7	-179.9	-110.9	0	0	0	112.6	P601 L603 C658 L659 G664 V666 M669 Y677	P601-F662 HydrophobicContact CB-CD2 4.37Å; P601-F662 HydrophobicContact CB-CE2 3.58Å; P601-F662 HydrophobicContact CB-CZ 4.21Å; P601-F662 HydrophobicContact CG-CE2 3.49Å; P601-F662 VanDerWaalsContact CG-CE2 3.49Å; P601-F662 HydrophobicContact CG-CZ 3.58Å; L603-F662 HydrophobicContact CD1-CB 4.23Å; L603-F662 HydrophobicContact CD1-CD1 4.28Å; L603-F662 HydrophobicContact CD1-CD2 3.68Å; L603-F662 HydrophobicContact CD1-CE2 4.04Å; L603-F662 HydrophobicContact CD1-CG 3.79Å; L603-F662 HydrophobicContact CD1-CZ 4.47Å; L603-F662 HydrophobicContact CD2-CB 4.2Å; L603-F662 HydrophobicContact CD2-CD2 4.11Å; L603-F662 HydrophobicContact CD2-CG 4.41Å; L603-F662 HydrophobicContact CG-CD2 4.39Å; C658-F662 PolarHBondContact O-N 2.95Å; C658-F662 VanDerWaalsContact O-N 3.12Å; L659-F662 PolarHBondContact O-N 2.88Å; F662-G664 VanDerWaalsContact CE1-C 3.5Å; F662-G664 VanDerWaalsContact CE1-O 3.25Å; F662-G664 WeakPolarHBondContact CE1-O 3.42Å; F662-V666 HydrophobicContact CE1-CG2 4.35Å; F662-M669 HydrophobicContact CD1-SD 3.75Å; F662-M669 HydrophobicContact CE1-CG 4.08Å; F662-M669 HydrophobicContact CE1-SD 3.37Å; F662-M669 WeakPolarHBondContact CE1-SD 3.47Å; F662-M669 HydrophobicContact CZ-CG 4.23Å; F662-M669 HydrophobicContact CZ-SD 4.07Å; F662-Y677 HydrophobicContact CB-CE2 4.27Å; F662-Y677 HydrophobicContact CD1-CD2 4.21Å; F662-Y677 AromaticContact CD1-CE2 3.87Å; F662-Y677 HydrophobicContact CD1-CE2 3.87Å
663	Q	84	Confident	89.1	Confident	191 Å²	191	72.6 Å²	72.6	89%	0.893	38%	0.38	S	S	*	.			trans	-114.8	7	179	-62.7	179	-1	0	0	113.1	A661	A661-Q663 PolarHBondContact O-N 2.6Å
664	G	85.9	Confident	89.1	Confident	37 Å²	37	70.6 Å²	70.6	38%	0.381	36%	0.363	S	S	.	.	S	Bend	trans	-81.5	-177.4	179.6	0	0	0	0	0	113.3	F662 V666	F662-G664 VanDerWaalsContact CE1-C 3.5Å; F662-G664 VanDerWaalsContact CE1-O 3.25Å; F662-G664 WeakPolarHBondContact CE1-O 3.42Å; G664-V666 PolarHBondContact O-N 2.91Å
665	N	85.1	Confident	89.1	Confident	79 Å²	79	64.1 Å²	64.1	42%	0.422	33%	0.333	S	S	.	.			trans	-75.8	108.2	-180	-171.9	-18.3	0	0	0	111.3	N667 Y668	N665-N667 PolarHBondContact O-N 3.32Å; N665-N667 VanDerWaalsContact OD1-CB 3.31Å; N665-N667 WeakPolarHBondContact OD1-CB 3.28Å; N665-N667 PolarHBondContact OD1-N 3.49Å; N665-Y668 HydrophobicContact CB-CD2 3.85Å; N665-Y668 HydrophobicContact CB-CE2 4.11Å; N665-Y668 PolarHBondContact O-N 3.01Å
666	V	84.9	Confident	89.2	Confident	28 Å²	28	63.1 Å²	63.1	17%	0.17	33%	0.328	C	S	.	.	G	3₁₀ helix	trans	-63.1	-6.5	-179	-149.3	0	0	0	0	113.9	F662 G664 M669 R674 Y677	F662-V666 HydrophobicContact CE1-CG2 4.35Å; G664-V666 PolarHBondContact O-N 2.91Å; V666-M669 HydrophobicContact CB-SD 4.23Å; V666-M669 HydrophobicContact CG1-SD 3.5Å; V666-M669 VanDerWaalsContact CG1-SD 3.5Å; V666-R674 WeakPolarHBondContact O-CD 3.3Å; V666-R674 PolarHBondContact O-NH1 3.38Å; V666-Y677 HydrophobicContact CG1-CD1 3.53Å; V666-Y677 HydrophobicContact CG1-CE1 3.63Å; V666-Y677 HydrophobicContact CG1-CG 4.03Å; V666-Y677 HydrophobicContact CG2-CE1 4.03Å
667	N	81.8	Confident	89.2	Confident	126 Å²	126	63.9 Å²	63.9	67%	0.674	33%	0.329	S	S	*	.	G	3₁₀ helix	trans	-89.1	-2.7	174.8	-59.4	-14.6	0	0	0	113.3	N665	N665-N667 PolarHBondContact O-N 3.32Å; N665-N667 VanDerWaalsContact OD1-CB 3.31Å; N665-N667 WeakPolarHBondContact OD1-CB 3.28Å; N665-N667 PolarHBondContact OD1-N 3.49Å
668	Y	85.4	Confident	89.3	Confident	122 Å²	122	58.5 Å²	58.5	48%	0.478	31%	0.307	S	S	.	.	G	3₁₀ helix	trans	-113.8	17.4	175.3	-55.8	-39	0	0	0	113.3	N665	N665-Y668 HydrophobicContact CB-CD2 3.85Å; N665-Y668 HydrophobicContact CB-CE2 4.11Å; N665-Y668 PolarHBondContact O-N 3.01Å
669	M	87.1	Confident	89.5	Confident	19 Å²	19	55.6 Å²	55.6	9%	0.094	29%	0.288	C	S	.	.	S	Bend	trans	-90.6	150.6	174.6	-65.4	176.1	65.1	0	0	110.6	P601 L603 L659 F662 V666 E673 Y677	P601-M669 HydrophobicContact CG-CG 4.16Å; L603-M669 HydrophobicContact CD1-CE 3.58Å; L603-M669 HydrophobicContact CD1-SD 4.32Å; L659-M669 HydrophobicContact CD2-CE 4.11Å; F662-M669 HydrophobicContact CD1-SD 3.75Å; F662-M669 HydrophobicContact CE1-CG 4.08Å; F662-M669 HydrophobicContact CE1-SD 3.37Å; F662-M669 WeakPolarHBondContact CE1-SD 3.47Å; F662-M669 HydrophobicContact CZ-CG 4.23Å; F662-M669 HydrophobicContact CZ-SD 4.07Å; V666-M669 HydrophobicContact CB-SD 4.23Å; V666-M669 HydrophobicContact CG1-SD 3.5Å; V666-M669 VanDerWaalsContact CG1-SD 3.5Å; M669-E673 HydrophobicContact CB-CB 4.18Å; M669-E673 HydrophobicContact CE-CB 3.65Å; M669-Y677 HydrophobicContact CE-CD2 4.28Å; M669-Y677 HydrophobicContact CE-CG 4.28Å; M669-Y677 HydrophobicContact SD-CD2 4.45Å; M669-Y677 HydrophobicContact SD-CG 4.46Å
670	D	88.8	Confident	89.7	Confident	57 Å²	57	55.8 Å²	55.8	31%	0.305	29%	0.289	S	S	.	.			trans	-63.1	147.9	171.9	175.7	-81.4	0	0	0	110.5	N613 A672 E673 R674	N613-D670 PolarHBondContact ND2-OD1 3.4Å; N613-D670 PolarHBondContact ND2-OD2 3.43Å; D670-A672 PolarHBondContact O-N 3.23Å; D670-A672 WeakPolarHBondContact OD1-CB 3.19Å; D670-A672 PolarHBondContact OD1-N 2.86Å; D670-E673 HydrophobicContact CB-CG 4.11Å; D670-E673 PolarHBondContact N-OE2 3.33Å; D670-E673 WeakPolarHBondContact O-CB 3.48Å; D670-E673 PolarHBondContact O-N 3.46Å; D670-R674 WeakPolarHBondContact O-CB 3.41Å; D670-R674 PolarHBondContact O-N 3.34Å
671	P	89.6	Confident	89.8	Confident	80 Å²	80	56.8 Å²	56.8	52%	0.519	29%	0.289	S	S	.	.	H	α-helix	trans	-54.9	-27.5	-179.6	-28.1	36.5	0	0	0	115.4	F675	P671-F675 WeakPolarHBondContact O-CB 3.35Å; P671-F675 PolarHBondContact O-N 3.35Å
672	A	92.2	Very high	89.9	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-70.4	-47	171.7	0	0	0	0	0	112.6	C609 I612 D670 R674 F675 F676	C609-A672 HydrophobicContact CB-CB 4.18Å; I612-A672 HydrophobicContact CB-CB 3.58Å; I612-A672 HydrophobicContact CD1-CB 4.14Å; I612-A672 HydrophobicContact CG1-CB 4.49Å; I612-A672 HydrophobicContact CG2-CB 3.5Å; I612-A672 VanDerWaalsContact CG2-CB 3.5Å; D670-A672 PolarHBondContact O-N 3.23Å; D670-A672 WeakPolarHBondContact OD1-CB 3.19Å; D670-A672 PolarHBondContact OD1-N 2.86Å; A672-R674 VanDerWaalsContact C-N 3.31Å; A672-F675 PolarHBondContact O-N 3.37Å; A672-F676 PolarHBondContact O-N 2.87Å
673	E	92.3	Very high	89.9	Confident	4 Å²	4	56.1 Å²	56.1	2%	0.019	28%	0.281	C	S	.	.	H	α-helix	trans	-62.8	-41.6	176	-59.6	-177.5	126.9	0	0	110.6	L603 L604 M669 D670 F676 Y677	L603-E673 PolarHBondContact N-OE1 2.8Å; L604-E673 HydrophobicContact CB-CG 4.12Å; L604-E673 HydrophobicContact CD1-CB 4.37Å; L604-E673 HydrophobicContact CD1-CG 3.87Å; L604-E673 HydrophobicContact CG-CG 3.91Å; L604-E673 PolarHBondContact N-OE1 3.25Å; L604-E673 VanDerWaalsContact N-OE1 3.14Å; M669-E673 HydrophobicContact CB-CB 4.18Å; M669-E673 HydrophobicContact CE-CB 3.65Å; D670-E673 HydrophobicContact CB-CG 4.11Å; D670-E673 PolarHBondContact N-OE2 3.33Å; D670-E673 WeakPolarHBondContact O-CB 3.48Å; D670-E673 PolarHBondContact O-N 3.46Å; E673-F676 PolarHBondContact O-N 2.92Å; E673-Y677 WeakPolarHBondContact O-CB 3.15Å; E673-Y677 PolarHBondContact O-N 3.41Å
674	R	91.5	Very high	90.1	Very high	81 Å²	81	50.8 Å²	50.8	31%	0.306	25%	0.254	S	S	.	.	H	α-helix	trans	-60.8	-47.4	175.9	-178.8	68.2	-149.2	-138.4	5.8	111.7	V666 D670 A672 F676 Y677 D678	V666-R674 WeakPolarHBondContact O-CD 3.3Å; V666-R674 PolarHBondContact O-NH1 3.38Å; D670-R674 WeakPolarHBondContact O-CB 3.41Å; D670-R674 PolarHBondContact O-N 3.34Å; A672-R674 VanDerWaalsContact C-N 3.31Å; R674-F676 VanDerWaalsContact C-N 3.33Å; R674-F676 PolarHBondContact O-N 3.17Å; R674-Y677 PolarHBondContact O-N 3.1Å; R674-D678 IonicContact CZ-OD2 2.78Å; R674-D678 VanDerWaalsContact CZ-OD2 3.23Å; R674-D678 IonicContact NE-OD2 3.24Å; R674-D678 PolarHBondContact NE-OD2 3.49Å; R674-D678 IonicContact NH2-OD1 3.98Å; R674-D678 PolarHBondContact NH2-OD1 2.7Å; R674-D678 IonicContact NH2-OD2 3.4Å; R674-D678 PolarHBondContact NH2-OD2 2.96Å; R674-D678 PolarHBondContact O-N 3.1Å
675	F	93.1	Very high	90.5	Very high	17 Å²	17	50.3 Å²	50.3	8%	0.075	24%	0.241	C	C	.	.	H	α-helix	trans	-59.3	-43.3	175.4	173.4	-112.5	0	0	0	111.7	I612 L616 L626 L627 I630 L646 P671 A672 L679	I612-F675 HydrophobicContact CG2-CD1 4.29Å; L616-F675 HydrophobicContact CD1-CB 3.77Å; L616-F675 HydrophobicContact CD1-CD1 4.1Å; L616-F675 HydrophobicContact CD1-CG 3.99Å; L616-F675 HydrophobicContact CD2-CB 4.46Å; L616-F675 HydrophobicContact CD2-CD1 3.81Å; L616-F675 HydrophobicContact CD2-CD2 4.02Å; L616-F675 HydrophobicContact CD2-CE1 4.01Å; L616-F675 HydrophobicContact CD2-CE2 4.21Å; L616-F675 HydrophobicContact CD2-CG 3.82Å; L616-F675 HydrophobicContact CD2-CZ 4.22Å; L616-F675 HydrophobicContact CG-CD1 4.34Å; L616-F675 HydrophobicContact CG-CG 4.48Å; L626-F675 HydrophobicContact CB-CE2 4.36Å; L626-F675 HydrophobicContact CD2-CE2 3.83Å; L626-F675 HydrophobicContact CD2-CZ 3.59Å; L626-F675 HydrophobicContact CG-CE2 4.07Å; L626-F675 HydrophobicContact CG-CZ 4.12Å; L627-F675 HydrophobicContact CD1-CD2 4.38Å; L627-F675 HydrophobicContact CD2-CD2 3.84Å; L627-F675 HydrophobicContact CD2-CE2 3.6Å; L627-F675 HydrophobicContact CG-CD2 4.03Å; L627-F675 HydrophobicContact CG-CE2 3.92Å; I630-F675 HydrophobicContact CD1-CZ 4.46Å; L646-F675 HydrophobicContact CD1-CE1 4.17Å; L646-F675 HydrophobicContact CD1-CZ 4.33Å; P671-F675 WeakPolarHBondContact O-CB 3.35Å; P671-F675 PolarHBondContact O-N 3.35Å; A672-F675 PolarHBondContact O-N 3.37Å; F675-L679 HydrophobicContact CE1-CD2 4.1Å; F675-L679 HydrophobicContact CZ-CD2 4.18Å; F675-L679 WeakPolarHBondContact O-CB 3.41Å; F675-L679 PolarHBondContact O-N 3.04Å
676	F	94.7	Very high	90.9	Very high	1 Å²	1	51.8 Å²	51.8	0%	0.004	24%	0.242	C	C	.	.	H	α-helix	trans	-71.4	-34	176.9	-79.6	6.7	0	0	0	113.5	L604 I612 L649 P651 L659 A672 E673 R674 L679 V680	L604-F676 HydrophobicContact CD1-CD2 3.77Å; L604-F676 HydrophobicContact CD1-CE2 4.42Å; L604-F676 HydrophobicContact CD1-CG 4.47Å; L604-F676 HydrophobicContact CD2-CD2 4.43Å; I612-F676 HydrophobicContact CD1-CD2 3.8Å; I612-F676 HydrophobicContact CD1-CE1 4.24Å; I612-F676 HydrophobicContact CD1-CE2 3.25Å; I612-F676 HydrophobicContact CD1-CZ 3.49Å; I612-F676 VanDerWaalsContact CD1-CZ 3.49Å; I612-F676 HydrophobicContact CG1-CE1 4.31Å; I612-F676 HydrophobicContact CG1-CE2 3.98Å; I612-F676 HydrophobicContact CG1-CZ 3.67Å; I612-F676 HydrophobicContact CG2-CE1 4.12Å; I612-F676 HydrophobicContact CG2-CZ 4.33Å; L649-F676 VanDerWaalsContact O-CZ 3.25Å; L649-F676 WeakPolarHBondContact O-CZ 3.37Å; P651-F676 HydrophobicContact CB-CD2 3.69Å; P651-F676 HydrophobicContact CB-CE2 3.93Å; P651-F676 HydrophobicContact CB-CG 4.37Å; P651-F676 HydrophobicContact CG-CD2 3.98Å; P651-F676 HydrophobicContact CG-CE2 4.24Å; P651-F676 HydrophobicContact CG-CG 4.21Å; L659-F676 HydrophobicContact CD1-CB 3.68Å; A672-F676 PolarHBondContact O-N 2.87Å; E673-F676 PolarHBondContact O-N 2.92Å; R674-F676 VanDerWaalsContact C-N 3.33Å; R674-F676 PolarHBondContact O-N 3.17Å; F676-L679 HydrophobicContact CD1-CD2 4.13Å; F676-L679 HydrophobicContact CE1-CD2 4.36Å; F676-L679 PolarHBondContact O-N 3.44Å; F676-V680 WeakPolarHBondContact O-CB 3.35Å; F676-V680 WeakPolarHBondContact O-CG2 3.27Å; F676-V680 PolarHBondContact O-N 2.93Å
677	Y	93.7	Very high	91.2	Very high	46 Å²	46	52.7 Å²	52.7	18%	0.18	24%	0.244	C	C	.	.	H	α-helix	trans	-59.8	-49	173.8	-179.8	-92.2	0	0	0	111.3	L659 F662 V666 M669 E673 R674 R681	L659-Y677 WeakPolarHBondContact O-CD2 3.41Å; L659-Y677 WeakPolarHBondContact O-CE2 3.31Å; F662-Y677 HydrophobicContact CB-CE2 4.27Å; F662-Y677 HydrophobicContact CD1-CD2 4.21Å; F662-Y677 AromaticContact CD1-CE2 3.87Å; F662-Y677 HydrophobicContact CD1-CE2 3.87Å; V666-Y677 HydrophobicContact CG1-CD1 3.53Å; V666-Y677 HydrophobicContact CG1-CE1 3.63Å; V666-Y677 HydrophobicContact CG1-CG 4.03Å; V666-Y677 HydrophobicContact CG2-CE1 4.03Å; M669-Y677 HydrophobicContact CE-CD2 4.28Å; M669-Y677 HydrophobicContact CE-CG 4.28Å; M669-Y677 HydrophobicContact SD-CD2 4.45Å; M669-Y677 HydrophobicContact SD-CG 4.46Å; E673-Y677 WeakPolarHBondContact O-CB 3.15Å; E673-Y677 PolarHBondContact O-N 3.41Å; R674-Y677 PolarHBondContact O-N 3.1Å; Y677-R681 WeakPolarHBondContact O-CG 3.46Å
678	D	93.5	Very high	91.6	Very high	33 Å²	33	46.9 Å²	46.9	18%	0.176	21%	0.213	C	C	.	.	H	α-helix	trans	-72.1	-38.8	177.9	-71	-43.4	0	0	0	112	L627 R674 V680 R681 I682	L627-D678 HydrophobicContact CD1-CB 3.69Å; L627-D678 HydrophobicContact CD2-CB 4.49Å; R674-D678 IonicContact CZ-OD2 2.78Å; R674-D678 VanDerWaalsContact CZ-OD2 3.23Å; R674-D678 IonicContact NE-OD2 3.24Å; R674-D678 PolarHBondContact NE-OD2 3.49Å; R674-D678 IonicContact NH2-OD1 3.98Å; R674-D678 PolarHBondContact NH2-OD1 2.7Å; R674-D678 IonicContact NH2-OD2 3.4Å; R674-D678 PolarHBondContact NH2-OD2 2.96Å; R674-D678 PolarHBondContact O-N 3.1Å; D678-V680 PolarHBondContact O-N 3.35Å; D678-R681 WeakPolarHBondContact O-CB 3.18Å; D678-R681 PolarHBondContact O-N 3.16Å; D678-R681 IonicContact OD1-NH1 2.71Å; D678-I682 PolarHBondContact O-N 3.48Å
679	L	95.2	Very high	92	Very high	0 Å²	0	41 Å²	41	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-60.5	-42.5	175.7	178.5	62.7	0	0	0	112.8	L627 I630 L650 F675 F676 R681 I682 Y685 I689	L627-L679 HydrophobicContact CD2-CB 3.89Å; L627-L679 HydrophobicContact CD2-CD1 4.29Å; I630-L679 HydrophobicContact CD1-CD1 3.87Å; I630-L679 HydrophobicContact CG2-CD1 4.05Å; L650-L679 HydrophobicContact CD2-CD2 3.87Å; F675-L679 HydrophobicContact CE1-CD2 4.1Å; F675-L679 HydrophobicContact CZ-CD2 4.18Å; F675-L679 WeakPolarHBondContact O-CB 3.41Å; F675-L679 PolarHBondContact O-N 3.04Å; F676-L679 HydrophobicContact CD1-CD2 4.13Å; F676-L679 HydrophobicContact CE1-CD2 4.36Å; F676-L679 PolarHBondContact O-N 3.44Å; L679-R681 PolarHBondContact O-N 3.49Å; L679-I682 HydrophobicContact CD1-CD1 4.31Å; L679-I682 WeakPolarHBondContact O-CB 3.37Å; L679-I682 PolarHBondContact O-N 3.25Å; L679-Y685 HydrophobicContact CD1-CD2 3.96Å; L679-Y685 HydrophobicContact CD1-CG 4.06Å; L679-Y685 HydrophobicContact CD2-CD2 4.22Å; L679-Y685 HydrophobicContact CD2-CE2 4.46Å; L679-Y685 HydrophobicContact CG-CD2 3.86Å; L679-Y685 HydrophobicContact CG-CE2 4.38Å; L679-Y685 HydrophobicContact CG-CG 4.12Å; L679-Y685 WeakPolarHBondContact O-CD1 3.5Å; L679-I689 HydrophobicContact CD1-CD1 4.33Å
680	V	95	Very high	92.3	Very high	6 Å²	6	41 Å²	41	4%	0.036	19%	0.19	C	C	.	.	H	α-helix	trans	-71.5	-13.5	-178.9	168.6	0	0	0	0	112.4	P651 I656 L659 K660 F676 D678 Y685	P651-V680 HydrophobicContact CB-CG2 4.47Å; P651-V680 HydrophobicContact CG-CG2 3.6Å; I656-V680 HydrophobicContact CG1-CG2 4.22Å; I656-V680 HydrophobicContact CG2-CG1 3.97Å; L659-V680 HydrophobicContact CD1-CG2 4.21Å; K660-V680 HydrophobicContact CD-CG1 4.04Å; K660-V680 WeakPolarHBondContact CE-O 3.09Å; K660-V680 HydrophobicContact CG-CG1 3.61Å; F676-V680 WeakPolarHBondContact O-CB 3.35Å; F676-V680 WeakPolarHBondContact O-CG2 3.27Å; F676-V680 PolarHBondContact O-N 2.93Å; D678-V680 PolarHBondContact O-N 3.35Å; V680-Y685 HydrophobicContact CG2-CE1 4.19Å
681	R	92.6	Very high	92.5	Very high	165 Å²	165	38.5 Å²	38.5	62%	0.623	18%	0.177	S	C	*	.	H	α-helix	trans	-85.8	-18.7	169.4	-66.2	173.3	67.6	-100.7	-8	113.2	Y677 D678 L679 P683	Y677-R681 WeakPolarHBondContact O-CG 3.46Å; D678-R681 WeakPolarHBondContact O-CB 3.18Å; D678-R681 PolarHBondContact O-N 3.16Å; D678-R681 IonicContact OD1-NH1 2.71Å; L679-R681 PolarHBondContact O-N 3.49Å; R681-P683 WeakPolarHBondContact O-CD 3.39Å
682	I	91.3	Very high	92.6	Very high	19 Å²	19	34.7 Å²	34.7	10%	0.097	15%	0.152	C	C	.	.	S	Bend	trans	-68.4	121.4	173.2	-65.3	173.8	0	0	0	109.2	L627 I630 D631 D678 L679 K684 Y685 K688	L627-I682 HydrophobicContact CB-CD1 4.2Å; L627-I682 HydrophobicContact CD2-CD1 3.91Å; I630-I682 HydrophobicContact CB-CD1 4.47Å; I630-I682 HydrophobicContact CG2-CD1 4.21Å; I630-I682 HydrophobicContact CG2-CG2 4.48Å; D631-I682 HydrophobicContact CB-CD1 4.31Å; D631-I682 HydrophobicContact CB-CG2 4.3Å; D631-I682 WeakPolarHBondContact OD1-CG2 3.36Å; D678-I682 PolarHBondContact O-N 3.48Å; L679-I682 HydrophobicContact CD1-CD1 4.31Å; L679-I682 WeakPolarHBondContact O-CB 3.37Å; L679-I682 PolarHBondContact O-N 3.25Å; I682-K684 PolarHBondContact O-N 3.35Å; I682-Y685 PolarHBondContact O-N 3.46Å; I682-K688 HydrophobicContact CG2-CD 4.05Å
683	P	89.3	Confident	92.8	Very high	68 Å²	68	35.2 Å²	35.2	44%	0.442	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.4	133.4	178.3	-26.2	36.6	0	0	0	112.1	R681 Y685 K688 T829	R681-P683 WeakPolarHBondContact O-CD 3.39Å; P683-Y685 PolarHBondContact O-N 2.95Å; P683-K688 VanDerWaalsContact O-CE 3.3Å; P683-K688 WeakPolarHBondContact O-CE 3.29Å; P683-T829 HydrophobicContact CB-CG2 3.33Å; P683-T829 HydrophobicContact CG-CG2 4.48Å
684	K	89.7	Confident	92.9	Very high	78 Å²	78	35 Å²	35	34%	0.339	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.5	28.8	179.2	-69.1	-177.4	171.6	-178.7	0	114.9	I682 Y686 H687 K688 N824 D826 T829 F830	I682-K684 PolarHBondContact O-N 3.35Å; K684-Y686 PolarHBondContact O-N 3.29Å; K684-H687 HydrophobicContact CB-CB 4.4Å; K684-H687 WeakPolarHBondContact O-CA 3.38Å; K684-H687 WeakPolarHBondContact O-CB 3.37Å; K684-H687 PolarHBondContact O-N 3.15Å; K684-K688 PolarHBondContact O-N 3.02Å; K684-N824 PolarHBondContact NZ-O 2.98Å; K684-D826 WeakPolarHBondContact CE-OD2 3.49Å; K684-D826 IonicContact NZ-OD2 3.31Å; K684-D826 PolarHBondContact NZ-OD2 2.76Å; K684-T829 HydrophobicContact CB-CG2 4.37Å; K684-T829 HydrophobicContact CD-CG2 3.98Å; K684-T829 HydrophobicContact CG-CG2 4.07Å; K684-F830 HydrophobicContact CB-CE2 4.33Å; K684-F830 HydrophobicContact CB-CZ 4.32Å; K684-F830 HydrophobicContact CD-CD2 4.45Å; K684-F830 HydrophobicContact CD-CE2 3.56Å; K684-F830 HydrophobicContact CD-CZ 4.17Å
685	Y	92.9	Very high	93	Very high	27 Å²	27	33.4 Å²	33.4	11%	0.106	15%	0.149	C	C	.	.	H	α-helix	trans	-47.1	-40	-174.3	72.2	-91.9	0	0	0	114.8	L650 I656 L679 V680 I682 P683 H687 K688 I689	L650-Y685 HydrophobicContact CD1-CE2 4.29Å; L650-Y685 HydrophobicContact CD2-CD2 4.45Å; L650-Y685 HydrophobicContact CD2-CE2 4.16Å; I656-Y685 VanDerWaalsContact CD1-OH 3.23Å; I656-Y685 WeakPolarHBondContact CD1-OH 3.5Å; L679-Y685 HydrophobicContact CD1-CD2 3.96Å; L679-Y685 HydrophobicContact CD1-CG 4.06Å; L679-Y685 HydrophobicContact CD2-CD2 4.22Å; L679-Y685 HydrophobicContact CD2-CE2 4.46Å; L679-Y685 HydrophobicContact CG-CD2 3.86Å; L679-Y685 HydrophobicContact CG-CE2 4.38Å; L679-Y685 HydrophobicContact CG-CG 4.12Å; L679-Y685 WeakPolarHBondContact O-CD1 3.5Å; V680-Y685 HydrophobicContact CG2-CE1 4.19Å; I682-Y685 PolarHBondContact O-N 3.46Å; P683-Y685 PolarHBondContact O-N 2.95Å; Y685-H687 PolarHBondContact O-N 3.48Å; Y685-K688 PolarHBondContact O-N 3.41Å; Y685-I689 HydrophobicContact CD2-CD1 4.21Å; Y685-I689 VanDerWaalsContact O-CG1 3.29Å; Y685-I689 WeakPolarHBondContact O-CG1 3.37Å; Y685-I689 PolarHBondContact O-N 3.38Å
686	Y	93.7	Very high	93.1	Very high	110 Å²	110	35.1 Å²	35.1	43%	0.431	16%	0.157	S	C	.	.	H	α-helix	trans	-58.2	-46.5	175.7	178.5	-87.5	0	0	0	112.1	L650 K684 I689 D690	L650-Y686 HydrophobicContact CD1-CD2 3.63Å; L650-Y686 HydrophobicContact CD1-CE2 4.22Å; K684-Y686 PolarHBondContact O-N 3.29Å; Y686-I689 PolarHBondContact O-N 2.93Å; Y686-D690 PolarHBondContact O-N 2.91Å
687	H	91.1	Very high	93.1	Very high	48 Å²	48	36.4 Å²	36.4	22%	0.222	16%	0.164	C	C	.	.	H	α-helix	trans	-70.8	-32.8	177.7	-58	-68.1	0	0	0	112	K684 Y685 S691 N824 F830	K684-H687 HydrophobicContact CB-CB 4.4Å; K684-H687 WeakPolarHBondContact O-CA 3.38Å; K684-H687 WeakPolarHBondContact O-CB 3.37Å; K684-H687 PolarHBondContact O-N 3.15Å; Y685-H687 PolarHBondContact O-N 3.48Å; H687-S691 WeakPolarHBondContact O-CB 3.19Å; H687-S691 PolarHBondContact O-N 3.38Å; H687-S691 PolarHBondContact O-OG 3.48Å; H687-N824 HydrophobicContact CB-CB 4.49Å; H687-N824 VanDerWaalsContact CE1-CG 3.42Å; H687-F830 HydrophobicContact CB-CZ 4.21Å
688	K	91.7	Very high	93.3	Very high	3 Å²	3	34.2 Å²	34.2	1%	0.013	16%	0.155	C	C	.	.	H	α-helix	trans	-60.7	-46.7	171.2	-61.7	-162.4	174.1	-165.7	0	110.5	I630 D631 C633 I682 P683 K684 Y685 S691 M692 T829 F830	I630-K688 HydrophobicContact CG2-CB 4.31Å; I630-K688 WeakPolarHBondContact O-CB 3.44Å; I630-K688 WeakPolarHBondContact O-CD 3.3Å; D631-K688 PolarHBondContact O-NZ 2.87Å; D631-K688 IonicContact OD1-NZ 3.77Å; D631-K688 PolarHBondContact OD1-NZ 2.78Å; C633-K688 VanDerWaalsContact SG-CG 3.56Å; I682-K688 HydrophobicContact CG2-CD 4.05Å; P683-K688 VanDerWaalsContact O-CE 3.3Å; P683-K688 WeakPolarHBondContact O-CE 3.29Å; K684-K688 PolarHBondContact O-N 3.02Å; Y685-K688 PolarHBondContact O-N 3.41Å; K688-S691 WeakPolarHBondContact O-CB 3.18Å; K688-S691 PolarHBondContact O-N 2.71Å; K688-M692 WeakPolarHBondContact O-CG 3.45Å; K688-M692 PolarHBondContact O-N 2.82Å; K688-M692 VanDerWaalsContact O-SD 3.35Å; K688-T829 PolarHBondContact NZ-O 2.66Å; K688-F830 HydrophobicContact CG-CD1 4.15Å; K688-F830 HydrophobicContact CG-CE1 3.81Å
689	I	94	Very high	93.4	Very high	0 Å²	0	36 Å²	36	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-68.8	-44.9	178.9	-61.9	162.7	0	0	0	112.8	I630 L643 L646 I647 L650 L679 Y685 Y686 S691 M692 L693	I630-I689 HydrophobicContact CD1-CD1 4.13Å; I630-I689 HydrophobicContact CD1-CG1 4.21Å; I630-I689 HydrophobicContact CG1-CD1 4.47Å; I630-I689 HydrophobicContact CG1-CG1 4.02Å; I630-I689 HydrophobicContact CG2-CD1 4.3Å; I630-I689 HydrophobicContact CG2-CG1 3.9Å; L643-I689 HydrophobicContact CD2-CG2 4.28Å; L646-I689 HydrophobicContact CD2-CD1 3.78Å; L646-I689 HydrophobicContact CD2-CG1 4.11Å; L646-I689 HydrophobicContact CD2-CG2 4.05Å; L646-I689 HydrophobicContact CG-CD1 4.17Å; L646-I689 HydrophobicContact CG-CG2 4.37Å; I647-I689 HydrophobicContact CD1-CG2 4.07Å; I647-I689 HydrophobicContact CG1-CG2 3.63Å; L650-I689 HydrophobicContact CD1-CD1 4.43Å; L650-I689 HydrophobicContact CD2-CD1 3.91Å; L679-I689 HydrophobicContact CD1-CD1 4.33Å; Y685-I689 HydrophobicContact CD2-CD1 4.21Å; Y685-I689 VanDerWaalsContact O-CG1 3.29Å; Y685-I689 WeakPolarHBondContact O-CG1 3.37Å; Y685-I689 PolarHBondContact O-N 3.38Å; Y686-I689 PolarHBondContact O-N 2.93Å; I689-S691 PolarHBondContact O-N 2.88Å; I689-M692 PolarHBondContact O-N 2.88Å; I689-L693 PolarHBondContact O-N 3Å
690	D	93.2	Very high	93.4	Very high	17 Å²	17	40.3 Å²	40.3	9%	0.091	19%	0.19	C	C	.	.	H	α-helix	trans	-61.4	-35.5	174.1	-180	40	0	0	0	111.2	Y686 L693 L694 R817	Y686-D690 PolarHBondContact O-N 2.91Å; D690-L693 PolarHBondContact O-N 3.31Å; D690-L694 WeakPolarHBondContact O-CB 3.27Å; D690-L694 PolarHBondContact O-N 2.92Å; D690-R817 PolarHBondContact O-NH2 3.2Å; D690-R817 IonicContact OD1-CZ 2.82Å; D690-R817 IonicContact OD1-NE 2.66Å; D690-R817 PolarHBondContact OD1-NE 3.36Å; D690-R817 IonicContact OD1-NH2 3.93Å; D690-R817 PolarHBondContact OD1-NH2 2.64Å
691	S	91.9	Very high	93.5	Very high	5 Å²	5	41.3 Å²	41.3	4%	0.035	20%	0.196	C	C	.	.	H	α-helix	trans	-66.2	-43	174.7	-65.3	0	0	0	0	112.8	H687 K688 I689 L694 K695 M821	H687-S691 WeakPolarHBondContact O-CB 3.19Å; H687-S691 PolarHBondContact O-N 3.38Å; H687-S691 PolarHBondContact O-OG 3.48Å; K688-S691 WeakPolarHBondContact O-CB 3.18Å; K688-S691 PolarHBondContact O-N 2.71Å; I689-S691 PolarHBondContact O-N 2.88Å; S691-L694 PolarHBondContact O-N 3.06Å; S691-K695 WeakPolarHBondContact O-CG 3.35Å; S691-K695 PolarHBondContact O-N 3.3Å; S691-M821 VanDerWaalsContact CA-CE 3.47Å; S691-M821 VanDerWaalsContact CB-CE 3.46Å; S691-M821 WeakPolarHBondContact OG-CE 3.5Å
692	M	92.9	Very high	93.8	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-60.3	-47.7	172.5	-66	151.7	81.6	0	0	110.4	L629 I630 C633 D634 I638 L643 K688 I689 L694 K695 E696	L629-M692 HydrophobicContact CB-CE 4.44Å; I630-M692 HydrophobicContact CG1-CE 4.03Å; I630-M692 HydrophobicContact CG1-SD 4.31Å; C633-M692 VanDerWaalsContact C-CG 3.5Å; C633-M692 HydrophobicContact CB-CG 4.43Å; D634-M692 VanDerWaalsContact O-CE 3.31Å; D634-M692 WeakPolarHBondContact O-CE 3.37Å; I638-M692 HydrophobicContact CD1-CE 3.52Å; L643-M692 HydrophobicContact CD1-CB 3.94Å; L643-M692 HydrophobicContact CD2-CB 4.11Å; L643-M692 HydrophobicContact CD2-CE 4.17Å; K688-M692 WeakPolarHBondContact O-CG 3.45Å; K688-M692 PolarHBondContact O-N 2.82Å; K688-M692 VanDerWaalsContact O-SD 3.35Å; I689-M692 PolarHBondContact O-N 2.88Å; M692-L694 VanDerWaalsContact C-N 3.34Å; M692-L694 PolarHBondContact O-N 3.4Å; M692-K695 WeakPolarHBondContact O-CB 3.35Å; M692-K695 PolarHBondContact O-N 2.92Å; M692-E696 WeakPolarHBondContact O-CG 3.36Å; M692-E696 PolarHBondContact O-N 2.89Å; M692-E696 VanDerWaalsContact O-N 3.1Å
693	L	95.3	Very high	94.1	Very high	11 Å²	11	36 Å²	36	6%	0.058	18%	0.181	C	C	.	.	H	α-helix	trans	-61.9	-41.3	178.6	177.6	59.7	0	0	0	112.1	S640 L643 K644 I647 I689 D690 K695 E696 E697	S640-L693 VanDerWaalsContact O-CD1 3.31Å; S640-L693 WeakPolarHBondContact O-CD1 3.39Å; L643-L693 HydrophobicContact CB-CB 4.08Å; L643-L693 HydrophobicContact CB-CD1 4.03Å; L643-L693 HydrophobicContact CD1-CB 4.46Å; K644-L693 HydrophobicContact CG-CD1 3.9Å; K644-L693 HydrophobicContact CG-CD2 3.83Å; I647-L693 HydrophobicContact CD1-CB 4.42Å; I647-L693 HydrophobicContact CD1-CD2 3.65Å; I689-L693 PolarHBondContact O-N 3Å; D690-L693 PolarHBondContact O-N 3.31Å; L693-K695 VanDerWaalsContact C-N 3.32Å; L693-K695 PolarHBondContact O-N 2.99Å; L693-E696 PolarHBondContact O-N 3.11Å; L693-E697 HydrophobicContact CD1-CG 3.79Å; L693-E697 HydrophobicContact CG-CG 4.37Å; L693-E697 WeakPolarHBondContact O-CB 3.43Å; L693-E697 WeakPolarHBondContact O-CG 3.05Å; L693-E697 PolarHBondContact O-N 3.06Å
694	L	95.1	Very high	94.5	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-62.7	-39.1	178	-175.5	58.1	0	0	0	111.7	D690 S691 M692 F698 F814 R817 L818 M821 F839	D690-L694 WeakPolarHBondContact O-CB 3.27Å; D690-L694 PolarHBondContact O-N 2.92Å; S691-L694 PolarHBondContact O-N 3.06Å; M692-L694 VanDerWaalsContact C-N 3.34Å; M692-L694 PolarHBondContact O-N 3.4Å; L694-F698 VanDerWaalsContact O-CB 3.22Å; L694-F698 WeakPolarHBondContact O-CB 3.4Å; L694-F698 PolarHBondContact O-N 2.96Å; L694-F814 HydrophobicContact CD1-CD1 3.69Å; L694-F814 HydrophobicContact CD1-CE1 4.12Å; L694-R817 HydrophobicContact CD1-CB 3.82Å; L694-R817 HydrophobicContact CD2-CB 3.9Å; L694-R817 HydrophobicContact CG-CB 4.5Å; L694-L818 HydrophobicContact CD2-CD2 3.79Å; L694-L818 HydrophobicContact CD2-CG 4.06Å; L694-L818 HydrophobicContact CG-CD2 4.48Å; L694-M821 HydrophobicContact CB-CE 4.16Å; L694-M821 HydrophobicContact CD2-CB 4.33Å; L694-M821 HydrophobicContact CD2-CE 3.75Å; L694-M821 HydrophobicContact CD2-SD 4.05Å; L694-M821 HydrophobicContact CG-CE 4.31Å; L694-F839 HydrophobicContact CD2-CE1 4.36Å; L694-F839 HydrophobicContact CG-CE1 4.13Å; L694-F839 HydrophobicContact CG-CZ 4.27Å
695	K	93.4	Very high	94.9	Very high	48 Å²	48	34.1 Å²	34.1	21%	0.209	16%	0.163	C	C	.	.	H	α-helix	trans	-61	-50.2	174	-73.2	163.6	58.7	177.5	0	111.8	C633 S691 M692 L693 E697 F839	C633-K695 PolarHBondContact O-NZ 3.31Å; S691-K695 WeakPolarHBondContact O-CG 3.35Å; S691-K695 PolarHBondContact O-N 3.3Å; M692-K695 WeakPolarHBondContact O-CB 3.35Å; M692-K695 PolarHBondContact O-N 2.92Å; L693-K695 VanDerWaalsContact C-N 3.32Å; L693-K695 PolarHBondContact O-N 2.99Å; K695-E697 PolarHBondContact O-N 3.25Å; K695-F839 HydrophobicContact CB-CE2 4.21Å; K695-F839 HydrophobicContact CB-CZ 4.27Å; K695-F839 HydrophobicContact CG-CD1 3.77Å; K695-F839 HydrophobicContact CG-CD2 3.83Å; K695-F839 HydrophobicContact CG-CE1 3.78Å; K695-F839 HydrophobicContact CG-CE2 3.83Å; K695-F839 HydrophobicContact CG-CG 3.8Å; K695-F839 HydrophobicContact CG-CZ 3.81Å
696	E	94.3	Very high	95.1	Very high	52 Å²	52	35.5 Å²	35.5	24%	0.243	17%	0.169	C	C	.	.	H	α-helix	trans	-65.9	-33.1	-179.5	-61.1	-55	121.4	0	0	113.3	S636 L643 M692 L693 P700	S636-E696 WeakPolarHBondContact CA-OE1 3.32Å; S636-E696 PolarHBondContact N-OE1 3.38Å; L643-E696 HydrophobicContact CD1-CG 3.76Å; M692-E696 WeakPolarHBondContact O-CG 3.36Å; M692-E696 PolarHBondContact O-N 2.89Å; M692-E696 VanDerWaalsContact O-N 3.1Å; L693-E696 PolarHBondContact O-N 3.11Å; E696-P700 WeakPolarHBondContact O-CD 3.36Å
697	E	96	Very high	95.2	Very high	29 Å²	29	33.3 Å²	33.3	14%	0.136	17%	0.17	C	C	.	.	H	α-helix	trans	-84.7	-28.4	179.7	-70.8	-170.6	122.6	0	0	114.2	K644 L693 K695 T701 F814 R817	K644-E697 WeakPolarHBondContact CE-OE1 3.41Å; K644-E697 IonicContact NZ-OE1 2.83Å; K644-E697 PolarHBondContact NZ-OE1 3.35Å; L693-E697 HydrophobicContact CD1-CG 3.79Å; L693-E697 HydrophobicContact CG-CG 4.37Å; L693-E697 WeakPolarHBondContact O-CB 3.43Å; L693-E697 WeakPolarHBondContact O-CG 3.05Å; L693-E697 PolarHBondContact O-N 3.06Å; K695-E697 PolarHBondContact O-N 3.25Å; E697-T701 PolarHBondContact O-N 2.74Å; E697-T701 PolarHBondContact O-OG1 3.39Å; E697-T701 VanDerWaalsContact O-OG1 3.13Å; E697-F814 HydrophobicContact CB-CE1 4.27Å; E697-R817 IonicContact OE2-CZ 2.63Å; E697-R817 IonicContact OE2-NH1 3.69Å; E697-R817 PolarHBondContact OE2-NH1 2.89Å; E697-R817 IonicContact OE2-NH2 2.6Å
698	F	96.8	Very high	95.5	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-65.1	-54.1	-170	-175.9	-92.6	0	0	0	113	L694 T701 I702 F814 L818 F839 S843 E846 L847	L694-F698 VanDerWaalsContact O-CB 3.22Å; L694-F698 WeakPolarHBondContact O-CB 3.4Å; L694-F698 PolarHBondContact O-N 2.96Å; F698-T701 PolarHBondContact O-N 2.91Å; F698-I702 HydrophobicContact CD1-CB 4.37Å; F698-I702 HydrophobicContact CD1-CG2 4.02Å; F698-I702 HydrophobicContact CE1-CB 3.98Å; F698-I702 HydrophobicContact CE1-CG1 4.11Å; F698-I702 HydrophobicContact CE1-CG2 3.71Å; F698-I702 HydrophobicContact CE2-CD1 4.37Å; F698-I702 HydrophobicContact CE2-CG1 4.48Å; F698-I702 HydrophobicContact CZ-CB 4.04Å; F698-I702 HydrophobicContact CZ-CD1 4.09Å; F698-I702 HydrophobicContact CZ-CG1 3.84Å; F698-I702 HydrophobicContact CZ-CG2 4.28Å; F698-I702 WeakPolarHBondContact O-CB 3.38Å; F698-I702 WeakPolarHBondContact O-CG2 3.21Å; F698-I702 PolarHBondContact O-N 3.41Å; F698-F814 HydrophobicContact CB-CE1 4.31Å; F698-F814 HydrophobicContact CD2-CB 4.22Å; F698-F814 AromaticContact CD2-CD1 3.82Å; F698-F814 HydrophobicContact CD2-CD1 3.82Å; F698-F814 HydrophobicContact CD2-CD2 4.33Å; F698-F814 HydrophobicContact CD2-CE1 4.19Å; F698-F814 AromaticContact CD2-CG 3.89Å; F698-F814 HydrophobicContact CD2-CG 3.89Å; F698-F814 HydrophobicContact CE2-CB 4.2Å; F698-F814 HydrophobicContact CE2-CG 4.24Å; F698-L818 HydrophobicContact CE2-CD1 4.19Å; F698-F839 HydrophobicContact CB-CE2 4.06Å; F698-F839 HydrophobicContact CB-CZ 3.86Å; F698-F839 HydrophobicContact CD1-CE2 4.37Å; F698-F839 HydrophobicContact CG-CE2 4.35Å; F698-F839 HydrophobicContact CG-CZ 4.22Å; F698-S843 WeakPolarHBondContact CD1-OG 3.33Å; F698-S843 WeakPolarHBondContact CE1-OG 3.49Å; F698-S843 WeakPolarHBondContact CG-OG 3.47Å; F698-S843 VanDerWaalsContact CZ-CB 3.46Å; F698-S843 WeakPolarHBondContact CZ-O 3.2Å; F698-E846 HydrophobicContact CE1-CB 4.19Å; F698-E846 HydrophobicContact CZ-CB 4.08Å; F698-L847 HydrophobicContact CE2-CD1 4.22Å; F698-L847 HydrophobicContact CE2-CD2 4.21Å; F698-L847 HydrophobicContact CE2-CG 3.89Å; F698-L847 HydrophobicContact CZ-CG 4.17Å
699	Q	95.1	Very high	95.8	Very high	71 Å²	71	31.3 Å²	31.3	33%	0.332	16%	0.162	S	C	.	.	H	α-helix	trans	-65	-44	-171.9	-78.1	-63.1	-25.3	0	0	114.1	T701 N703 E846	Q699-T701 PolarHBondContact O-N 2.83Å; Q699-N703 WeakPolarHBondContact O-CB 3.4Å; Q699-N703 PolarHBondContact O-N 3.36Å; Q699-N703 PolarHBondContact O-ND2 3Å; Q699-N703 PolarHBondContact OE1-ND2 3.41Å; Q699-E846 PolarHBondContact NE2-OE1 3.45Å
700	P	96.2	Very high	95.9	Very high	89 Å²	89	35.4 Å²	35.4	58%	0.578	18%	0.184	S	C	*	.	H	α-helix	trans	-60.7	-45	174.9	-25	35.4	0	0	0	112.7	E696 W704	E696-P700 WeakPolarHBondContact O-CD 3.36Å; P700-W704 PolarHBondContact O-N 3.03Å; P700-W704 VanDerWaalsContact O-N 3.15Å
701	T	97.4	Very high	96.1	Very high	28 Å²	28	35.9 Å²	35.9	17%	0.172	19%	0.186	C	C	.	.	H	α-helix	trans	-75.7	-38.4	-176.3	-48.9	0	0	0	0	112.8	E697 F698 Q699 N703 W704 I705 E810 F814	E697-T701 PolarHBondContact O-N 2.74Å; E697-T701 PolarHBondContact O-OG1 3.39Å; E697-T701 VanDerWaalsContact O-OG1 3.13Å; F698-T701 PolarHBondContact O-N 2.91Å; Q699-T701 PolarHBondContact O-N 2.83Å; T701-N703 VanDerWaalsContact C-N 3.3Å; T701-N703 PolarHBondContact O-N 2.78Å; T701-W704 HydrophobicContact CG2-CE3 4.08Å; T701-W704 PolarHBondContact O-N 3.41Å; T701-I705 HydrophobicContact CG2-CD1 4.14Å; T701-I705 VanDerWaalsContact O-CG1 3.31Å; T701-I705 WeakPolarHBondContact O-CG1 3.46Å; T701-I705 PolarHBondContact O-N 3.28Å; T701-E810 HydrophobicContact CG2-CB 4.49Å; T701-F814 HydrophobicContact CG2-CE2 3.62Å; T701-F814 HydrophobicContact CG2-CZ 4.02Å
702	I	97.9	Very high	96.4	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-66.4	-35.2	179.3	-158.4	67.2	0	0	0	111.4	F698 I705 K706 E846 L847 V850	F698-I702 HydrophobicContact CD1-CB 4.37Å; F698-I702 HydrophobicContact CD1-CG2 4.02Å; F698-I702 HydrophobicContact CE1-CB 3.98Å; F698-I702 HydrophobicContact CE1-CG1 4.11Å; F698-I702 HydrophobicContact CE1-CG2 3.71Å; F698-I702 HydrophobicContact CE2-CD1 4.37Å; F698-I702 HydrophobicContact CE2-CG1 4.48Å; F698-I702 HydrophobicContact CZ-CB 4.04Å; F698-I702 HydrophobicContact CZ-CD1 4.09Å; F698-I702 HydrophobicContact CZ-CG1 3.84Å; F698-I702 HydrophobicContact CZ-CG2 4.28Å; F698-I702 WeakPolarHBondContact O-CB 3.38Å; F698-I702 WeakPolarHBondContact O-CG2 3.21Å; F698-I702 PolarHBondContact O-N 3.41Å; I702-I705 HydrophobicContact CD1-CD1 4.41Å; I702-I705 PolarHBondContact O-N 3.47Å; I702-K706 WeakPolarHBondContact O-CG 3.27Å; I702-K706 PolarHBondContact O-N 2.72Å; I702-E846 HydrophobicContact CG1-CB 4.21Å; I702-E846 WeakPolarHBondContact CG2-OE2 3.4Å; I702-L847 HydrophobicContact CD1-CD2 3.75Å; I702-L847 HydrophobicContact CD1-CG 4.46Å; I702-V850 HydrophobicContact CD1-CB 4.35Å; I702-V850 HydrophobicContact CD1-CG2 3.88Å; I702-V850 HydrophobicContact CG1-CG2 4.25Å
703	N	97.6	Very high	96.6	Very high	73 Å²	73	37.6 Å²	37.6	39%	0.39	19%	0.194	S	C	.	.	H	α-helix	trans	-74.4	-34.8	177.1	-66.8	-39.4	0	0	0	112	Q699 T701 K706 S707	Q699-N703 WeakPolarHBondContact O-CB 3.4Å; Q699-N703 PolarHBondContact O-N 3.36Å; Q699-N703 PolarHBondContact O-ND2 3Å; Q699-N703 PolarHBondContact OE1-ND2 3.41Å; T701-N703 VanDerWaalsContact C-N 3.3Å; T701-N703 PolarHBondContact O-N 2.78Å; N703-K706 PolarHBondContact O-N 3.19Å; N703-K706 PolarHBondContact OD1-NZ 3.38Å; N703-S707 WeakPolarHBondContact O-CB 3.32Å; N703-S707 PolarHBondContact O-N 3.45Å
704	W	97.5	Very high	96.6	Very high	106 Å²	106	41 Å²	41	40%	0.402	21%	0.208	S	C	.	.	H	α-helix	trans	-60.6	-42.5	166.4	168.3	72.4	0	0	0	112.3	P700 T701 S708 L806 I807	P700-W704 PolarHBondContact O-N 3.03Å; P700-W704 VanDerWaalsContact O-N 3.15Å; T701-W704 HydrophobicContact CG2-CE3 4.08Å; T701-W704 PolarHBondContact O-N 3.41Å; W704-S708 PolarHBondContact NE1-OG 3.27Å; W704-S708 VanDerWaalsContact O-CB 3.31Å; W704-S708 WeakPolarHBondContact O-CB 3.27Å; W704-S708 PolarHBondContact O-N 2.89Å; W704-S708 PolarHBondContact O-OG 3.3Å; W704-L806 HydrophobicContact CH2-CD2 3.86Å; W704-L806 HydrophobicContact CH2-CG 4.16Å; W704-L806 HydrophobicContact CZ2-CD2 4.42Å; W704-I807 HydrophobicContact CH2-CG1 3.8Å; W704-I807 HydrophobicContact CZ3-CG1 4.13Å
705	I	98.3	Very high	96.7	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-62.5	-49.8	176.5	-70	163.3	0	0	0	111	T701 I702 S707 S708 L709 I807 E810 I811 V850	T701-I705 HydrophobicContact CG2-CD1 4.14Å; T701-I705 VanDerWaalsContact O-CG1 3.31Å; T701-I705 WeakPolarHBondContact O-CG1 3.46Å; T701-I705 PolarHBondContact O-N 3.28Å; I702-I705 HydrophobicContact CD1-CD1 4.41Å; I702-I705 PolarHBondContact O-N 3.47Å; I705-S707 PolarHBondContact O-N 3.32Å; I705-S708 PolarHBondContact O-N 3.48Å; I705-L709 HydrophobicContact CG2-CD1 3.85Å; I705-L709 HydrophobicContact CG2-CG 4.28Å; I705-L709 WeakPolarHBondContact O-CG 3.41Å; I705-L709 PolarHBondContact O-N 2.86Å; I705-I807 HydrophobicContact CG1-CG1 4.4Å; I705-I807 HydrophobicContact CG1-CG2 4.39Å; I705-I807 HydrophobicContact CG2-CG2 3.64Å; I705-E810 HydrophobicContact CD1-CB 3.98Å; I705-I811 HydrophobicContact CD1-CG1 4.3Å; I705-V850 HydrophobicContact CG2-CG1 3.49Å; I705-V850 VanDerWaalsContact CG2-CG1 3.49Å; I705-V850 HydrophobicContact CG2-CG2 4.25Å
706	K	97.7	Very high	96.9	Very high	55 Å²	55	38.7 Å²	38.7	24%	0.239	20%	0.198	C	C	.	.	H	α-helix	trans	-56.6	-48.3	178.7	-71.6	170.8	-163.6	161	0	111.6	I702 N703 L709 D710 E846 V850	I702-K706 WeakPolarHBondContact O-CG 3.27Å; I702-K706 PolarHBondContact O-N 2.72Å; N703-K706 PolarHBondContact O-N 3.19Å; N703-K706 PolarHBondContact OD1-NZ 3.38Å; K706-L709 PolarHBondContact O-N 2.94Å; K706-D710 WeakPolarHBondContact O-CB 3.49Å; K706-D710 PolarHBondContact O-N 3.46Å; K706-E846 IonicContact NZ-OE2 3.84Å; K706-E846 PolarHBondContact NZ-OE2 3.23Å; K706-V850 HydrophobicContact CG-CG2 3.59Å
707	S	96.7	Very high	97	Very high	64 Å²	64	40.4 Å²	40.4	45%	0.448	21%	0.206	S	C	.	.	H	α-helix	trans	-61.8	-44.4	177.9	-179.2	0	0	0	0	111.9	N703 I705 L709 D710 N711	N703-S707 WeakPolarHBondContact O-CB 3.32Å; N703-S707 PolarHBondContact O-N 3.45Å; I705-S707 PolarHBondContact O-N 3.32Å; S707-L709 PolarHBondContact O-N 2.83Å; S707-D710 PolarHBondContact O-N 3.27Å; S707-N711 WeakPolarHBondContact O-CB 3.48Å; S707-N711 PolarHBondContact O-N 2.85Å
708	S	97.3	Very high	97	Very high	9 Å²	9	41.1 Å²	41.1	6%	0.063	21%	0.21	C	C	.	.	H	α-helix	trans	-63.2	-41.2	177.5	-59.1	0	0	0	0	112.5	W704 I705 V712	W704-S708 PolarHBondContact NE1-OG 3.27Å; W704-S708 VanDerWaalsContact O-CB 3.31Å; W704-S708 WeakPolarHBondContact O-CB 3.27Å; W704-S708 PolarHBondContact O-N 2.89Å; W704-S708 PolarHBondContact O-OG 3.3Å; I705-S708 PolarHBondContact O-N 3.48Å; S708-V712 VanDerWaalsContact O-CG2 3.27Å; S708-V712 WeakPolarHBondContact O-CG2 3.33Å; S708-V712 PolarHBondContact O-N 3.01Å; S708-V712 VanDerWaalsContact O-N 3.16Å
709	L	97.9	Very high	97	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-69.5	-40.6	176.4	-70.3	176.7	0	0	0	112.1	I705 K706 S707 V712 M713 L804 I807 V850 Q853 M854 L857	I705-L709 HydrophobicContact CG2-CD1 3.85Å; I705-L709 HydrophobicContact CG2-CG 4.28Å; I705-L709 WeakPolarHBondContact O-CG 3.41Å; I705-L709 PolarHBondContact O-N 2.86Å; K706-L709 PolarHBondContact O-N 2.94Å; S707-L709 PolarHBondContact O-N 2.83Å; L709-V712 PolarHBondContact O-N 2.93Å; L709-M713 WeakPolarHBondContact O-CB 3.4Å; L709-M713 VanDerWaalsContact O-CG 3.3Å; L709-M713 WeakPolarHBondContact O-CG 3.42Å; L709-M713 PolarHBondContact O-N 2.93Å; L709-L804 HydrophobicContact CD2-CD2 4.1Å; L709-I807 HydrophobicContact CD1-CG2 4.43Å; L709-I807 HydrophobicContact CD2-CD1 4.2Å; L709-I807 HydrophobicContact CD2-CG2 4.31Å; L709-I807 HydrophobicContact CG-CD1 4.34Å; L709-I807 HydrophobicContact CG-CG2 4.45Å; L709-V850 HydrophobicContact CD1-CG1 4Å; L709-Q853 HydrophobicContact CD1-CB 3.97Å; L709-M854 HydrophobicContact CD1-CG 4.15Å; L709-M854 HydrophobicContact CD2-CG 4.02Å; L709-M854 HydrophobicContact CD2-SD 4.13Å; L709-L857 HydrophobicContact CD2-CD2 3.83Å
710	D	96.5	Very high	96.9	Very high	86 Å²	86	38.9 Å²	38.9	46%	0.46	20%	0.2	S	C	.	.	H	α-helix	trans	-64.9	-46.1	178.4	-163.4	63.3	0	0	0	111.4	K706 S707 V712 M713 K714	K706-D710 WeakPolarHBondContact O-CB 3.49Å; K706-D710 PolarHBondContact O-N 3.46Å; S707-D710 PolarHBondContact O-N 3.27Å; D710-V712 PolarHBondContact O-N 2.97Å; D710-M713 PolarHBondContact O-N 3.26Å; D710-K714 WeakPolarHBondContact O-CB 3.4Å; D710-K714 PolarHBondContact O-N 2.99Å
711	N	95.7	Very high	96.8	Very high	28 Å²	28	38.7 Å²	38.7	15%	0.15	20%	0.197	C	C	.	.	H	α-helix	trans	-56.4	-49	173.8	-73.9	-10.5	0	0	0	111.8	S707 K714 T715 A799	S707-N711 WeakPolarHBondContact O-CB 3.48Å; S707-N711 PolarHBondContact O-N 2.85Å; N711-K714 PolarHBondContact O-N 2.87Å; N711-T715 WeakPolarHBondContact O-CB 3.38Å; N711-T715 PolarHBondContact O-N 3.17Å; N711-T715 PolarHBondContact O-OG1 3.49Å; N711-A799 HydrophobicContact CB-CB 4.32Å
712	V	98.2	Very high	96.7	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-63	-44.4	178.1	174.3	0	0	0	0	111.5	S708 L709 D710 S716 A799 V802 L857 I877 L881	S708-V712 VanDerWaalsContact O-CG2 3.27Å; S708-V712 WeakPolarHBondContact O-CG2 3.33Å; S708-V712 PolarHBondContact O-N 3.01Å; S708-V712 VanDerWaalsContact O-N 3.16Å; L709-V712 PolarHBondContact O-N 2.93Å; D710-V712 PolarHBondContact O-N 2.97Å; V712-S716 WeakPolarHBondContact O-CB 3.49Å; V712-S716 PolarHBondContact O-N 3.5Å; V712-S716 PolarHBondContact O-OG 3.45Å; V712-A799 HydrophobicContact CG2-CB 4.13Å; V712-V802 HydrophobicContact CG2-CB 3.72Å; V712-V802 HydrophobicContact CG2-CG1 3.91Å; V712-V802 HydrophobicContact CG2-CG2 3.91Å; V712-L857 HydrophobicContact CG1-CD1 3.76Å; V712-L857 HydrophobicContact CG1-CD2 3.94Å; V712-I877 HydrophobicContact CG1-CG2 4.24Å; V712-L881 HydrophobicContact CB-CD1 4.49Å; V712-L881 HydrophobicContact CG1-CD1 4.06Å; V712-L881 HydrophobicContact CG2-CD1 4.44Å
713	M	97.2	Very high	96.4	Very high	40 Å²	40	41 Å²	41	20%	0.197	21%	0.213	C	C	.	.	H	α-helix	trans	-64.1	-46.1	178	-76.4	180	58.8	0	0	111.9	L709 D710 S716 Q717 Q853 K856 L857 L860	L709-M713 WeakPolarHBondContact O-CB 3.4Å; L709-M713 VanDerWaalsContact O-CG 3.3Å; L709-M713 WeakPolarHBondContact O-CG 3.42Å; L709-M713 PolarHBondContact O-N 2.93Å; D710-M713 PolarHBondContact O-N 3.26Å; M713-S716 PolarHBondContact O-N 3.18Å; M713-Q717 WeakPolarHBondContact O-CB 3.46Å; M713-Q717 PolarHBondContact O-N 3.08Å; M713-Q853 HydrophobicContact SD-CB 4.42Å; M713-K856 HydrophobicContact CE-CB 3.78Å; M713-K856 HydrophobicContact CE-CD 4.4Å; M713-K856 HydrophobicContact SD-CB 4.41Å; M713-L857 HydrophobicContact CG-CB 3.98Å; M713-L857 HydrophobicContact CG-CD1 3.84Å; M713-L857 HydrophobicContact CG-CG 4.38Å; M713-L857 HydrophobicContact SD-CB 4.29Å; M713-L860 HydrophobicContact CB-CD2 4.39Å; M713-L860 WeakPolarHBondContact O-CD2 3.29Å
714	K	96.6	Very high	96.3	Very high	82 Å²	82	38.9 Å²	38.9	36%	0.357	20%	0.202	S	C	.	.	H	α-helix	trans	-64.2	-54.8	-178.7	179.7	176.1	173.3	-178.8	0	111.6	D710 N711 S716 Q717 E718 Y795	D710-K714 WeakPolarHBondContact O-CB 3.4Å; D710-K714 PolarHBondContact O-N 2.99Å; N711-K714 PolarHBondContact O-N 2.87Å; K714-S716 VanDerWaalsContact C-N 3.28Å; K714-S716 PolarHBondContact O-N 3.49Å; K714-Q717 CarbonylContact O-C 3.5Å; K714-Q717 WeakPolarHBondContact O-CA 3.45Å; K714-Q717 WeakPolarHBondContact O-CB 3.41Å; K714-Q717 PolarHBondContact O-N 3.49Å; K714-E718 WeakPolarHBondContact CE-OE1 3.38Å; K714-E718 HydrophobicContact CG-CG 4.4Å; K714-E718 WeakPolarHBondContact CG-OE1 3.39Å; K714-E718 WeakPolarHBondContact O-CG 3.32Å; K714-E718 PolarHBondContact O-N 3.43Å; K714-Y795 HydrophobicContact CD-CD2 4.4Å
715	T	97.4	Very high	96.2	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-61.4	-36.6	178	-64	0	0	0	0	112.2	N711 Q717 E718 I719 L796 A799 L881	N711-T715 WeakPolarHBondContact O-CB 3.38Å; N711-T715 PolarHBondContact O-N 3.17Å; N711-T715 PolarHBondContact O-OG1 3.49Å; T715-Q717 VanDerWaalsContact C-N 3.32Å; T715-Q717 PolarHBondContact O-N 3.4Å; T715-E718 WeakPolarHBondContact CA-OE2 3.48Å; T715-E718 PolarHBondContact O-N 3.46Å; T715-I719 HydrophobicContact CG2-CD1 3.99Å; T715-I719 WeakPolarHBondContact O-CB 3.31Å; T715-I719 WeakPolarHBondContact O-CG1 3.37Å; T715-I719 PolarHBondContact O-N 2.89Å; T715-L796 HydrophobicContact CG2-CB 4.02Å; T715-L796 HydrophobicContact CG2-CD1 3.62Å; T715-L796 HydrophobicContact CG2-CG 4.43Å; T715-A799 HydrophobicContact CG2-CB 4.34Å; T715-L881 HydrophobicContact CG2-CD1 4.47Å; T715-L881 HydrophobicContact CG2-CD2 3.86Å
716	S	97.7	Very high	96	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-63.2	-38.6	173.4	-62	0	0	0	0	112.4	V712 M713 K714 L720 I877	V712-S716 WeakPolarHBondContact O-CB 3.49Å; V712-S716 PolarHBondContact O-N 3.5Å; V712-S716 PolarHBondContact O-OG 3.45Å; M713-S716 PolarHBondContact O-N 3.18Å; K714-S716 VanDerWaalsContact C-N 3.28Å; K714-S716 PolarHBondContact O-N 3.49Å; S716-L720 WeakPolarHBondContact O-CG 3.22Å; S716-L720 PolarHBondContact O-N 3.2Å; S716-L720 VanDerWaalsContact O-N 3.13Å; S716-I877 WeakPolarHBondContact OG-CD1 3.45Å; S716-I877 WeakPolarHBondContact OG-CG1 3.39Å
717	Q	96.3	Very high	95.9	Very high	88 Å²	88	34 Å²	34	41%	0.411	19%	0.185	S	C	.	.	H	α-helix	trans	-72	-41.5	177.1	-173.2	55.9	77.2	0	0	111.9	M713 K714 T715 I719 L720 T721	M713-Q717 WeakPolarHBondContact O-CB 3.46Å; M713-Q717 PolarHBondContact O-N 3.08Å; K714-Q717 CarbonylContact O-C 3.5Å; K714-Q717 WeakPolarHBondContact O-CA 3.45Å; K714-Q717 WeakPolarHBondContact O-CB 3.41Å; K714-Q717 PolarHBondContact O-N 3.49Å; T715-Q717 VanDerWaalsContact C-N 3.32Å; T715-Q717 PolarHBondContact O-N 3.4Å; Q717-I719 VanDerWaalsContact C-N 3.34Å; Q717-I719 PolarHBondContact O-N 3.47Å; Q717-L720 WeakPolarHBondContact O-CB 3.42Å; Q717-L720 PolarHBondContact O-N 3.4Å; Q717-T721 PolarHBondContact O-N 3.14Å; Q717-T721 VanDerWaalsContact O-N 3.12Å; Q717-T721 PolarHBondContact O-OG1 3.39Å
718	E	95.8	Very high	95.9	Very high	45 Å²	45	30.9 Å²	30.9	21%	0.21	16%	0.164	C	C	.	.	H	α-helix	trans	-58.2	-44.5	173.2	-69.3	165.3	167.3	0	0	111	K714 T715 L720 T721 S722 L793	K714-E718 WeakPolarHBondContact CE-OE1 3.38Å; K714-E718 HydrophobicContact CG-CG 4.4Å; K714-E718 WeakPolarHBondContact CG-OE1 3.39Å; K714-E718 WeakPolarHBondContact O-CG 3.32Å; K714-E718 PolarHBondContact O-N 3.43Å; T715-E718 WeakPolarHBondContact CA-OE2 3.48Å; T715-E718 PolarHBondContact O-N 3.46Å; E718-L720 PolarHBondContact O-N 2.85Å; E718-T721 PolarHBondContact O-N 3.45Å; E718-S722 VanDerWaalsContact O-CB 3.24Å; E718-S722 WeakPolarHBondContact O-CB 3.3Å; E718-S722 PolarHBondContact O-N 2.86Å; E718-L793 HydrophobicContact CB-CD2 3.62Å
719	I	96.2	Very high	95.8	Very high	2 Å²	2	30.5 Å²	30.5	1%	0.01	16%	0.161	C	C	.	.	H	α-helix	trans	-64.2	-35.5	176.1	-77.6	174	0	0	0	112.8	T715 Q717 I725 L793 L796 F868 L881 F884	T715-I719 HydrophobicContact CG2-CD1 3.99Å; T715-I719 WeakPolarHBondContact O-CB 3.31Å; T715-I719 WeakPolarHBondContact O-CG1 3.37Å; T715-I719 PolarHBondContact O-N 2.89Å; Q717-I719 VanDerWaalsContact C-N 3.34Å; Q717-I719 PolarHBondContact O-N 3.47Å; I719-I725 HydrophobicContact CB-CD1 4.17Å; I719-I725 HydrophobicContact CG1-CD1 3.69Å; I719-I725 HydrophobicContact CG2-CD1 4.25Å; I719-L793 HydrophobicContact CG1-CD1 4.25Å; I719-L793 HydrophobicContact CG1-CD2 3.96Å; I719-L796 HydrophobicContact CD1-CD1 3.95Å; I719-F868 HydrophobicContact CG2-CE2 4.08Å; I719-F868 HydrophobicContact CG2-CZ 3.67Å; I719-L881 HydrophobicContact CD1-CD2 3.52Å; I719-F884 HydrophobicContact CD1-CB 4.33Å; I719-F884 HydrophobicContact CD1-CD2 3.95Å; I719-F884 HydrophobicContact CD1-CG 4.24Å; I719-F884 HydrophobicContact CG2-CD2 4.19Å; I719-F884 HydrophobicContact CG2-CE2 3.77Å; I719-F884 HydrophobicContact CG2-CZ 4.27Å
720	L	94.1	Very high	95.7	Very high	22 Å²	22	32.8 Å²	32.8	12%	0.115	17%	0.172	C	C	.	.	H	α-helix	trans	-69.1	-31.3	174.8	-81.9	-179.8	0	0	0	113.6	S716 Q717 E718 L860 K863 Y867 F868	S716-L720 WeakPolarHBondContact O-CG 3.22Å; S716-L720 PolarHBondContact O-N 3.2Å; S716-L720 VanDerWaalsContact O-N 3.13Å; Q717-L720 WeakPolarHBondContact O-CB 3.42Å; Q717-L720 PolarHBondContact O-N 3.4Å; E718-L720 PolarHBondContact O-N 2.85Å; L720-L860 HydrophobicContact CD1-CD1 3.67Å; L720-K863 HydrophobicContact CD1-CB 4.43Å; L720-Y867 HydrophobicContact CD2-CD1 3.45Å; L720-Y867 VanDerWaalsContact CD2-CD1 3.45Å; L720-Y867 HydrophobicContact CD2-CD2 4.37Å; L720-Y867 HydrophobicContact CD2-CE1 4.17Å; L720-Y867 HydrophobicContact CD2-CG 3.56Å; L720-F868 HydrophobicContact CD2-CE2 4.34Å
721	T	93.7	Very high	95.6	Very high	84 Å²	84	29 Å²	29	52%	0.515	15%	0.151	S	C	.	.	H	α-helix	trans	-105.4	-6.9	-174.5	51.3	0	0	0	0	114.4	Q717 E718 P723	Q717-T721 PolarHBondContact O-N 3.14Å; Q717-T721 VanDerWaalsContact O-N 3.12Å; Q717-T721 PolarHBondContact O-OG1 3.39Å; E718-T721 PolarHBondContact O-N 3.45Å; T721-P723 VanDerWaalsContact O-CD 3.29Å; T721-P723 WeakPolarHBondContact O-CD 3.49Å
722	S	94.9	Very high	95.6	Very high	12 Å²	12	27.7 Å²	27.7	8%	0.084	15%	0.145	C	C	.	.			trans	-68.2	115.5	-177.4	175.9	0	0	0	0	111.6	E718 L724 I725 C726	E718-S722 VanDerWaalsContact O-CB 3.24Å; E718-S722 WeakPolarHBondContact O-CB 3.3Å; E718-S722 PolarHBondContact O-N 2.86Å; S722-L724 PolarHBondContact O-N 2.88Å; S722-I725 PolarHBondContact O-N 3.29Å; S722-I725 PolarHBondContact OG-N 2.99Å; S722-C726 PolarHBondContact O-N 2.88Å
723	P	92.4	Very high	95.5	Very high	65 Å²	65	28.8 Å²	28.8	42%	0.422	15%	0.151	S	C	.	.	H	α-helix	trans	-63.8	-32.5	176.1	26.8	-33.8	0	0	0	111.2	C479 T721 I725 C726 E727	C479-P723 HydrophobicContact CB-CB 4.19Å; T721-P723 VanDerWaalsContact O-CD 3.29Å; T721-P723 WeakPolarHBondContact O-CD 3.49Å; P723-I725 PolarHBondContact O-N 3.24Å; P723-C726 WeakPolarHBondContact O-CB 3.35Å; P723-C726 PolarHBondContact O-N 3.27Å; P723-E727 WeakPolarHBondContact O-CB 3.49Å; P723-E727 PolarHBondContact O-N 3.19Å
724	L	94.6	Very high	95.4	Very high	29 Å²	29	29.9 Å²	29.9	15%	0.152	16%	0.155	C	C	.	.	H	α-helix	trans	-69.5	-31.6	179	-52.5	176.4	0	0	0	112.4	S722 L728 Q785 M786 I789 T792	S722-L724 PolarHBondContact O-N 2.88Å; L724-L728 WeakPolarHBondContact O-CB 3.49Å; L724-L728 PolarHBondContact O-N 3.49Å; L724-Q785 HydrophobicContact CD2-CG 4.1Å; L724-M786 HydrophobicContact CB-SD 4.23Å; L724-M786 HydrophobicContact CD2-SD 3.98Å; L724-M786 WeakPolarHBondContact O-CE 3.41Å; L724-I789 HydrophobicContact CB-CD1 4.02Å; L724-I789 HydrophobicContact CB-CG1 3.69Å; L724-I789 HydrophobicContact CD1-CG1 4.05Å; L724-I789 HydrophobicContact CG-CG1 4.5Å; L724-T792 HydrophobicContact CD1-CG2 4.23Å
725	I	95.9	Very high	95.3	Very high	0 Å²	0	26 Å²	26	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-70.7	-38.8	171.2	-77.8	175.4	0	0	0	111	I719 S722 P723 L728 L729 I789 L793 F884 F888	I719-I725 HydrophobicContact CB-CD1 4.17Å; I719-I725 HydrophobicContact CG1-CD1 3.69Å; I719-I725 HydrophobicContact CG2-CD1 4.25Å; S722-I725 PolarHBondContact O-N 3.29Å; S722-I725 PolarHBondContact OG-N 2.99Å; P723-I725 PolarHBondContact O-N 3.24Å; I725-L728 PolarHBondContact O-N 3.34Å; I725-L729 HydrophobicContact CG2-CD1 3.8Å; I725-L729 HydrophobicContact CG2-CG 4.42Å; I725-L729 WeakPolarHBondContact O-CB 3.48Å; I725-L729 VanDerWaalsContact O-CG 3.25Å; I725-L729 WeakPolarHBondContact O-CG 3.44Å; I725-L729 PolarHBondContact O-N 2.99Å; I725-I789 HydrophobicContact CG1-CG2 4.1Å; I725-L793 HydrophobicContact CD1-CD1 3.74Å; I725-F884 HydrophobicContact CD1-CD1 4.49Å; I725-F884 HydrophobicContact CD1-CE1 4.31Å; I725-F884 HydrophobicContact CG2-CE1 4.04Å; I725-F884 HydrophobicContact CG2-CZ 4.04Å; I725-F888 HydrophobicContact CD1-CZ 4.49Å; I725-F888 HydrophobicContact CG1-CZ 4.37Å
726	C	94.6	Very high	95.2	Very high	14 Å²	14	26 Å²	26	10%	0.095	14%	0.138	C	C	.	.	H	α-helix	trans	-60.9	-46.3	174.2	-165.8	0	0	0	0	111.2	V471 S722 P723 L729 Q730	V471-C726 HydrophobicContact CG2-CB 4.44Å; S722-C726 PolarHBondContact O-N 2.88Å; P723-C726 WeakPolarHBondContact O-CB 3.35Å; P723-C726 PolarHBondContact O-N 3.27Å; C726-L729 PolarHBondContact O-N 2.92Å; C726-Q730 WeakPolarHBondContact O-CB 3.4Å; C726-Q730 WeakPolarHBondContact O-CG 3.49Å; C726-Q730 PolarHBondContact O-N 3.41Å; C726-Q730 PolarHBondContact SG-NE2 3.41Å
727	E	94.2	Very high	95	Very high	43 Å²	43	27.8 Å²	27.8	20%	0.201	15%	0.148	C	C	.	.	H	α-helix	trans	-64.1	-41.3	175.8	-169.3	-176.1	163.4	0	0	112.3	L496 P723 L729 Q730 T731 N783 M786	L496-E727 WeakPolarHBondContact CD2-OE1 3.34Å; P723-E727 WeakPolarHBondContact O-CB 3.49Å; P723-E727 PolarHBondContact O-N 3.19Å; E727-L729 PolarHBondContact O-N 2.91Å; E727-Q730 PolarHBondContact O-N 2.7Å; E727-T731 VanDerWaalsContact O-CB 3.27Å; E727-T731 WeakPolarHBondContact O-CB 3.28Å; E727-T731 PolarHBondContact O-N 3.37Å; E727-T731 PolarHBondContact O-OG1 3.05Å; E727-N783 PolarHBondContact OE1-ND2 3.15Å; E727-N783 PolarHBondContact OE2-ND2 3.42Å; E727-M786 HydrophobicContact CB-CE 3.88Å; E727-M786 HydrophobicContact CB-SD 4.22Å; E727-M786 HydrophobicContact CG-CE 3.93Å; E727-M786 HydrophobicContact CG-SD 4.19Å
728	L	96.3	Very high	94.9	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-59.5	-46.9	176.1	168.7	65.7	0	0	0	111	L724 I725 T731 V732 L775 F779 M786 I789 F887 F888	L724-L728 WeakPolarHBondContact O-CB 3.49Å; L724-L728 PolarHBondContact O-N 3.49Å; I725-L728 PolarHBondContact O-N 3.34Å; L728-T731 PolarHBondContact O-N 2.87Å; L728-V732 HydrophobicContact CD1-CG2 4.37Å; L728-V732 WeakPolarHBondContact O-CG2 3.26Å; L728-V732 PolarHBondContact O-N 3.15Å; L728-L775 HydrophobicContact CD1-CD2 4.17Å; L728-F779 HydrophobicContact CD1-CE2 3.78Å; L728-F779 HydrophobicContact CD1-CZ 3.82Å; L728-M786 HydrophobicContact CB-CE 3.78Å; L728-M786 VanDerWaalsContact N-CE 3.34Å; L728-I789 HydrophobicContact CB-CD1 4.2Å; L728-I789 HydrophobicContact CD2-CD1 4.19Å; L728-F887 HydrophobicContact CD1-CE1 3.99Å; L728-F887 HydrophobicContact CD1-CZ 4.13Å; L728-F887 HydrophobicContact CD2-CD1 4.36Å; L728-F887 HydrophobicContact CD2-CE1 3.8Å; L728-F887 HydrophobicContact CG-CE1 4.44Å; L728-F888 HydrophobicContact CD2-CE1 3.8Å; L728-F888 HydrophobicContact CD2-CZ 4.06Å
729	L	96.7	Very high	94.8	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-67.2	-39.7	-179.8	-70	168.4	0	0	0	111.5	V471 W472 I725 C726 E727 V732 L733 F751 L753 L756 F868	V471-L729 HydrophobicContact CG1-CD1 4.4Å; V471-L729 HydrophobicContact CG2-CD1 3.79Å; W472-L729 HydrophobicContact CH2-CB 3.98Å; W472-L729 HydrophobicContact CH2-CD2 4.09Å; W472-L729 HydrophobicContact CH2-CG 4.49Å; W472-L729 HydrophobicContact CZ3-CB 3.95Å; I725-L729 HydrophobicContact CG2-CD1 3.8Å; I725-L729 HydrophobicContact CG2-CG 4.42Å; I725-L729 WeakPolarHBondContact O-CB 3.48Å; I725-L729 VanDerWaalsContact O-CG 3.25Å; I725-L729 WeakPolarHBondContact O-CG 3.44Å; I725-L729 PolarHBondContact O-N 2.99Å; C726-L729 PolarHBondContact O-N 2.92Å; E727-L729 PolarHBondContact O-N 2.91Å; L729-V732 PolarHBondContact O-N 3.43Å; L729-L733 WeakPolarHBondContact O-CB 3.37Å; L729-L733 PolarHBondContact O-N 2.86Å; L729-F751 HydrophobicContact CD2-CE2 3.97Å; L729-F751 HydrophobicContact CD2-CZ 3.77Å; L729-F751 WeakPolarHBondContact O-CE1 3.26Å; L729-L753 HydrophobicContact CD2-CD2 3.97Å; L729-L756 HydrophobicContact CD2-CD1 4.18Å; L729-L756 HydrophobicContact CD2-CD2 4.14Å; L729-L756 HydrophobicContact CD2-CG 4.48Å; L729-F868 HydrophobicContact CD1-CD1 4.18Å; L729-F868 HydrophobicContact CD1-CE1 3.81Å
730	Q	94.3	Very high	94.6	Very high	48 Å²	48	24.5 Å²	24.5	22%	0.224	13%	0.13	C	C	.	.	H	α-helix	trans	-68	-39.2	174.9	-72.4	169.1	22.1	0	0	111.9	V471 N474 C726 E727 V732 L733 E734	V471-Q730 PolarHBondContact O-NE2 2.85Å; N474-Q730 PolarHBondContact ND2-NE2 3.1Å; N474-Q730 PolarHBondContact ND2-OE1 3.05Å; C726-Q730 WeakPolarHBondContact O-CB 3.4Å; C726-Q730 WeakPolarHBondContact O-CG 3.49Å; C726-Q730 PolarHBondContact O-N 3.41Å; C726-Q730 PolarHBondContact SG-NE2 3.41Å; E727-Q730 PolarHBondContact O-N 2.7Å; Q730-V732 PolarHBondContact O-N 3.16Å; Q730-L733 WeakPolarHBondContact O-CA 3.44Å; Q730-L733 VanDerWaalsContact O-CB 3.3Å; Q730-L733 WeakPolarHBondContact O-CB 3.4Å; Q730-L733 PolarHBondContact O-N 3.04Å; Q730-L733 VanDerWaalsContact O-N 3.1Å; Q730-E734 PolarHBondContact O-N 3.42Å
731	T	95.5	Very high	94.4	Very high	6 Å²	6	29.8 Å²	29.8	4%	0.037	15%	0.154	C	C	.	.	H	α-helix	trans	-61.1	-44	174	-59.7	0	0	0	0	111.9	I497 E727 L728 L733 E734 I735 L775 F779	I497-T731 HydrophobicContact CD1-CG2 3.23Å; I497-T731 HydrophobicContact CG1-CG2 3.8Å; E727-T731 VanDerWaalsContact O-CB 3.27Å; E727-T731 WeakPolarHBondContact O-CB 3.28Å; E727-T731 PolarHBondContact O-N 3.37Å; E727-T731 PolarHBondContact O-OG1 3.05Å; L728-T731 PolarHBondContact O-N 2.87Å; T731-L733 VanDerWaalsContact C-N 3.3Å; T731-L733 PolarHBondContact O-N 3.47Å; T731-E734 PolarHBondContact O-N 3.27Å; T731-I735 HydrophobicContact CG2-CD1 4.45Å; T731-I735 WeakPolarHBondContact O-CG1 3.38Å; T731-I735 PolarHBondContact O-N 3.34Å; T731-I735 VanDerWaalsContact O-N 3.08Å; T731-L775 HydrophobicContact CG2-CD1 3.66Å; T731-F779 HydrophobicContact CG2-CE1 3.83Å; T731-F779 HydrophobicContact CG2-CZ 4.08Å
732	V	95.9	Very high	94	Very high	1 Å²	1	29.4 Å²	29.4	1%	0.006	17%	0.167	C	C	.	.	H	α-helix	trans	-67.9	-31	174.9	173.9	0	0	0	0	111.4	W460 L728 L729 Q730 G736 F751 L756 L759 L775	W460-V732 WeakPolarHBondContact CZ3-O 3.37Å; L728-V732 HydrophobicContact CD1-CG2 4.37Å; L728-V732 WeakPolarHBondContact O-CG2 3.26Å; L728-V732 PolarHBondContact O-N 3.15Å; L729-V732 PolarHBondContact O-N 3.43Å; Q730-V732 PolarHBondContact O-N 3.16Å; V732-G736 PolarHBondContact O-N 2.85Å; V732-F751 HydrophobicContact CB-CE1 3.95Å; V732-F751 HydrophobicContact CB-CZ 3.74Å; V732-F751 HydrophobicContact CG1-CE1 3.66Å; V732-F751 HydrophobicContact CG1-CE2 4.18Å; V732-F751 HydrophobicContact CG1-CZ 3.43Å; V732-F751 VanDerWaalsContact CG1-CZ 3.43Å; V732-L756 HydrophobicContact CG1-CD2 4.4Å; V732-L756 HydrophobicContact CG2-CD2 4.29Å; V732-L759 HydrophobicContact CG1-CD1 3.92Å; V732-L759 HydrophobicContact CG1-CD2 4.35Å; V732-L759 HydrophobicContact CG2-CD2 4.06Å; V732-L775 HydrophobicContact CG2-CD2 3.89Å
733	L	95.4	Very high	93.5	Very high	24 Å²	24	31.4 Å²	31.4	13%	0.126	18%	0.177	C	C	.	.	H	α-helix	trans	-65.6	-44.5	173.2	-169.7	72.8	0	0	0	111.7	W460 W472 L729 Q730 T731 G736 N737 A748 S749 F751	W460-L733 HydrophobicContact CH2-CD1 3.8Å; W460-L733 WeakPolarHBondContact CH2-O 3.45Å; W460-L733 HydrophobicContact CZ3-CD1 4.13Å; W472-L733 HydrophobicContact CE3-CD1 4.46Å; W472-L733 HydrophobicContact CE3-CD2 4.12Å; W472-L733 HydrophobicContact CZ3-CB 4.34Å; W472-L733 HydrophobicContact CZ3-CD1 4.41Å; L729-L733 WeakPolarHBondContact O-CB 3.37Å; L729-L733 PolarHBondContact O-N 2.86Å; Q730-L733 WeakPolarHBondContact O-CA 3.44Å; Q730-L733 VanDerWaalsContact O-CB 3.3Å; Q730-L733 WeakPolarHBondContact O-CB 3.4Å; Q730-L733 PolarHBondContact O-N 3.04Å; Q730-L733 VanDerWaalsContact O-N 3.1Å; T731-L733 VanDerWaalsContact C-N 3.3Å; T731-L733 PolarHBondContact O-N 3.47Å; L733-G736 PolarHBondContact O-N 2.92Å; L733-N737 VanDerWaalsContact O-CB 3.25Å; L733-N737 WeakPolarHBondContact O-CB 3.38Å; L733-N737 PolarHBondContact O-N 3.5Å; L733-N737 PolarHBondContact O-ND2 3.33Å; L733-A748 HydrophobicContact CD1-CB 4.28Å; L733-S749 WeakPolarHBondContact CD2-O 3.29Å; L733-F751 HydrophobicContact CB-CD1 4.47Å; L733-F751 HydrophobicContact CB-CE1 4.16Å; L733-F751 HydrophobicContact CD1-CD1 3.92Å; L733-F751 HydrophobicContact CD1-CE1 4.44Å
734	E	94.6	Very high	93.1	Very high	63 Å²	63	35.4 Å²	35.4	29%	0.294	20%	0.195	S	C	.	.	H	α-helix	trans	-60.4	-51.8	174.9	-72.2	-174.7	-178.1	0	0	111.5	S495 L499 Q730 T731 G736 N737 Y738	S495-E734 VanDerWaalsContact CB-OE2 3.27Å; S495-E734 WeakPolarHBondContact CB-OE2 3.45Å; L499-E734 HydrophobicContact CD1-CB 4.45Å; Q730-E734 PolarHBondContact O-N 3.42Å; T731-E734 PolarHBondContact O-N 3.27Å; E734-G736 PolarHBondContact O-N 2.91Å; E734-N737 PolarHBondContact O-N 3.26Å; E734-Y738 WeakPolarHBondContact O-CB 3.41Å; E734-Y738 PolarHBondContact O-N 2.77Å
735	I	95.2	Very high	92.8	Very high	1 Å²	1	36.4 Å²	36.4	1%	0.005	20%	0.2	C	C	.	.	H	α-helix	trans	-55.9	-50.6	176.5	-71.3	173.5	0	0	0	111.2	I497 L499 L502 T731 N737 Y738 M739 L771 F774 L775	I497-I735 HydrophobicContact CD1-CD1 3.84Å; I497-I735 HydrophobicContact CD1-CG1 4.46Å; I497-I735 HydrophobicContact CG2-CG1 4.49Å; L499-I735 HydrophobicContact CD2-CB 4.48Å; L499-I735 HydrophobicContact CD2-CG1 3.88Å; L502-I735 HydrophobicContact CD1-CG2 4.4Å; T731-I735 HydrophobicContact CG2-CD1 4.45Å; T731-I735 WeakPolarHBondContact O-CG1 3.38Å; T731-I735 PolarHBondContact O-N 3.34Å; T731-I735 VanDerWaalsContact O-N 3.08Å; I735-N737 VanDerWaalsContact C-N 3.33Å; I735-N737 PolarHBondContact O-N 2.9Å; I735-Y738 PolarHBondContact O-N 3.47Å; I735-M739 HydrophobicContact CG2-CG 4.43Å; I735-M739 HydrophobicContact CG2-SD 4.21Å; I735-M739 WeakPolarHBondContact O-CB 3.31Å; I735-M739 WeakPolarHBondContact O-CG 3.17Å; I735-M739 PolarHBondContact O-N 3.4Å; I735-L771 HydrophobicContact CG2-CD1 3.69Å; I735-L771 HydrophobicContact CG2-CD2 4.02Å; I735-L771 HydrophobicContact CG2-CG 4.12Å; I735-F774 HydrophobicContact CD1-CD1 4.02Å; I735-F774 HydrophobicContact CD1-CE1 4.04Å; I735-F774 HydrophobicContact CG1-CE1 4.18Å; I735-L775 HydrophobicContact CD1-CB 4.42Å; I735-L775 HydrophobicContact CD1-CD1 3.85Å
736	G	94.8	Very high	92.3	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-71.9	-27	-174.1	0	0	0	0	0	113.6	W460 V732 L733 E734 N740	W460-G736 VanDerWaalsContact CH2-CA 3.43Å; W460-G736 WeakPolarHBondContact CZ2-O 3.33Å; V732-G736 PolarHBondContact O-N 2.85Å; L733-G736 PolarHBondContact O-N 2.92Å; E734-G736 PolarHBondContact O-N 2.91Å; G736-N740 WeakPolarHBondContact O-CB 3.42Å; G736-N740 PolarHBondContact O-N 2.93Å; G736-N740 PolarHBondContact O-ND2 3.27Å
737	N	94.6	Very high	92.1	Very high	37 Å²	37	41.3 Å²	41.3	20%	0.198	24%	0.235	C	C	.	.	H	α-helix	trans	-71.2	-45.4	170	-81.9	-27.9	0	0	0	111.2	W460 L733 E734 I735 N740 E741 S747 A748	W460-N737 WeakPolarHBondContact CZ2-OD1 3.44Å; L733-N737 VanDerWaalsContact O-CB 3.25Å; L733-N737 WeakPolarHBondContact O-CB 3.38Å; L733-N737 PolarHBondContact O-N 3.5Å; L733-N737 PolarHBondContact O-ND2 3.33Å; E734-N737 PolarHBondContact O-N 3.26Å; I735-N737 VanDerWaalsContact C-N 3.33Å; I735-N737 PolarHBondContact O-N 2.9Å; N737-N740 CarbonylContact O-C 3.33Å; N737-N740 PolarHBondContact O-N 3.33Å; N737-E741 PolarHBondContact O-N 3.16Å; N737-E741 VanDerWaalsContact O-N 3.1Å; N737-S747 PolarHBondContact OD1-N 3.43Å; N737-S747 VanDerWaalsContact OD1-N 3.1Å; N737-A748 PolarHBondContact ND2-O 3.26Å; N737-A748 WeakPolarHBondContact OD1-CB 3.31Å; N737-A748 PolarHBondContact OD1-N 3.19Å
738	Y	94.3	Very high	92	Very high	63 Å²	63	39.6 Å²	39.6	25%	0.247	23%	0.228	C	C	.	.	H	α-helix	trans	-60.7	-48.3	176.7	-164.7	-97.3	0	0	0	111.9	L455 L499 L502 N503 E734 I735 N740 E741	L455-Y738 HydrophobicContact CD1-CD1 3.93Å; L455-Y738 HydrophobicContact CD1-CE1 4.05Å; L499-Y738 HydrophobicContact CB-CD1 4.14Å; L499-Y738 HydrophobicContact CB-CD2 4.04Å; L499-Y738 HydrophobicContact CB-CE1 4.29Å; L499-Y738 HydrophobicContact CB-CE2 4.21Å; L499-Y738 HydrophobicContact CB-CG 4Å; L499-Y738 HydrophobicContact CD1-CD2 4.08Å; L499-Y738 HydrophobicContact CD1-CG 4.27Å; L499-Y738 HydrophobicContact CD2-CG 4.46Å; L499-Y738 HydrophobicContact CG-CG 4.48Å; L499-Y738 WeakPolarHBondContact O-CE1 3.18Å; L502-Y738 HydrophobicContact CB-CD1 4.2Å; L502-Y738 HydrophobicContact CB-CE1 4.2Å; L502-Y738 HydrophobicContact CD1-CD1 3.67Å; L502-Y738 HydrophobicContact CD1-CE1 4.39Å; L502-Y738 HydrophobicContact CD1-CG 4.43Å; N503-Y738 PolarHBondContact ND2-OH 3.41Å; E734-Y738 WeakPolarHBondContact O-CB 3.41Å; E734-Y738 PolarHBondContact O-N 2.77Å; I735-Y738 PolarHBondContact O-N 3.47Å; Y738-N740 PolarHBondContact O-N 3.11Å; Y738-N740 VanDerWaalsContact O-N 3.14Å; Y738-E741 PolarHBondContact O-N 3.44Å
739	M	92.2	Very high	91.7	Very high	3 Å²	3	42 Å²	42	2%	0.015	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-15.9	178.1	-72.1	-164.9	67.3	0	0	114.8	L455 K456 F458 L502 F506 I735 V762 L771	L455-M739 HydrophobicContact CD1-CG 4.41Å; K456-M739 WeakPolarHBondContact O-CE 3.49Å; F458-M739 HydrophobicContact CB-CB 4.28Å; L502-M739 HydrophobicContact CD1-CG 4.01Å; L502-M739 HydrophobicContact CD2-CG 4.44Å; L502-M739 HydrophobicContact CD2-SD 4.18Å; F506-M739 HydrophobicContact CB-CE 4.02Å; F506-M739 HydrophobicContact CD1-CE 3.87Å; F506-M739 HydrophobicContact CG-CE 3.94Å; I735-M739 HydrophobicContact CG2-CG 4.43Å; I735-M739 HydrophobicContact CG2-SD 4.21Å; I735-M739 WeakPolarHBondContact O-CB 3.31Å; I735-M739 WeakPolarHBondContact O-CG 3.17Å; I735-M739 PolarHBondContact O-N 3.4Å; M739-V762 HydrophobicContact CE-CG1 3.99Å; M739-L771 HydrophobicContact CE-CD1 4.5Å; M739-L771 HydrophobicContact CE-CD2 4.44Å; M739-L771 HydrophobicContact SD-CD1 3.34Å; M739-L771 WeakPolarHBondContact SD-CD1 3.32Å; M739-L771 HydrophobicContact SD-CD2 3.48Å; M739-L771 WeakPolarHBondContact SD-CD2 3.37Å; M739-L771 HydrophobicContact SD-CG 4.02Å
740	N	92.6	Very high	91.5	Very high	0 Å²	0	42 Å²	42	0%	0	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-115.5	15.4	179.4	-69.6	-58.1	0	0	0	114	F458 W460 G736 N737 Y738 G742 N743 L745 G746	F458-N740 PolarHBondContact N-OD1 3.49Å; F458-N740 PolarHBondContact O-ND2 3.05Å; F458-N740 PolarHBondContact O-OD1 2.9Å; W460-N740 PolarHBondContact NE1-ND2 3.03Å; G736-N740 WeakPolarHBondContact O-CB 3.42Å; G736-N740 PolarHBondContact O-N 2.93Å; G736-N740 PolarHBondContact O-ND2 3.27Å; N737-N740 CarbonylContact O-C 3.33Å; N737-N740 PolarHBondContact O-N 3.33Å; Y738-N740 PolarHBondContact O-N 3.11Å; Y738-N740 VanDerWaalsContact O-N 3.14Å; N740-G742 PolarHBondContact O-N 3.04Å; N740-N743 VanDerWaalsContact CA-ND2 3.26Å; N740-N743 WeakPolarHBondContact CA-ND2 3.17Å; N740-N743 WeakPolarHBondContact CB-ND2 3.43Å; N740-N743 VanDerWaalsContact O-CG 3.28Å; N740-N743 PolarHBondContact O-N 3.45Å; N740-N743 VanDerWaalsContact O-N 3.1Å; N740-N743 PolarHBondContact O-ND2 2.97Å; N740-N743 PolarHBondContact OD1-ND2 3.27Å; N740-L745 HydrophobicContact CB-CB 4.01Å; N740-G746 VanDerWaalsContact CB-N 3.34Å; N740-G746 VanDerWaalsContact O-CA 3.28Å; N740-G746 WeakPolarHBondContact O-CA 3.34Å; N740-G746 PolarHBondContact O-N 2.8Å
741	E	90.3	Very high	91.5	Very high	132 Å²	132	39.7 Å²	39.7	62%	0.617	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.4	140.3	175.6	-173	167.4	-138	0	0	111.6	N737 Y738 N743	N737-E741 PolarHBondContact O-N 3.16Å; N737-E741 VanDerWaalsContact O-N 3.1Å; Y738-E741 PolarHBondContact O-N 3.44Å; E741-N743 PolarHBondContact O-N 3.15Å
742	G	84.3	Confident	91.5	Very high	77 Å²	77	42.4 Å²	42.4	79%	0.794	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	65.6	16.9	-176.3	0	0	0	0	0	115.3	N740	N740-G742 PolarHBondContact O-N 3.04Å
743	N	84.7	Confident	91.4	Very high	53 Å²	53	42.6 Å²	42.6	28%	0.283	25%	0.247	S	C	.	.	S	Bend	trans	-135.9	163	172.4	90.5	60.3	0	0	0	112.8	N740 E741 L745 G746	N740-N743 VanDerWaalsContact CA-ND2 3.26Å; N740-N743 WeakPolarHBondContact CA-ND2 3.17Å; N740-N743 WeakPolarHBondContact CB-ND2 3.43Å; N740-N743 VanDerWaalsContact O-CG 3.28Å; N740-N743 PolarHBondContact O-N 3.45Å; N740-N743 VanDerWaalsContact O-N 3.1Å; N740-N743 PolarHBondContact O-ND2 2.97Å; N740-N743 PolarHBondContact OD1-ND2 3.27Å; E741-N743 PolarHBondContact O-N 3.15Å; N743-L745 PolarHBondContact O-N 2.68Å; N743-L745 WeakPolarHBondContact OD1-CA 3.35Å; N743-L745 VanDerWaalsContact OD1-CB 3.28Å; N743-L745 WeakPolarHBondContact OD1-CB 3.13Å; N743-L745 PolarHBondContact OD1-N 3.49Å; N743-G746 PolarHBondContact O-N 3.37Å
744	N	84.2	Confident	91.2	Very high	149 Å²	149	44.5 Å²	44.5	80%	0.797	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-10.4	-172.1	-62.4	11.9	0	0	0	114.7	K462	K462-N744 WeakPolarHBondContact CE-O 3.4Å; K462-N744 PolarHBondContact NZ-O 3.35Å
745	L	87.4	Confident	91.2	Very high	51 Å²	51	41.5 Å²	41.5	27%	0.267	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.9	-9.9	174	-56.4	179.8	0	0	0	113.8	R459 W460 K462 N740 N743	R459-L745 HydrophobicContact CG-CD1 4.47Å; W460-L745 PolarHBondContact NE1-O 2.8Å; K462-L745 VanDerWaalsContact CE-C 3.46Å; K462-L745 VanDerWaalsContact CE-O 3.31Å; K462-L745 WeakPolarHBondContact CE-O 3.44Å; N740-L745 HydrophobicContact CB-CB 4.01Å; N743-L745 PolarHBondContact O-N 2.68Å; N743-L745 WeakPolarHBondContact OD1-CA 3.35Å; N743-L745 VanDerWaalsContact OD1-CB 3.28Å; N743-L745 WeakPolarHBondContact OD1-CB 3.13Å; N743-L745 PolarHBondContact OD1-N 3.49Å
746	G	87.1	Confident	91.3	Very high	4 Å²	4	41.5 Å²	41.5	4%	0.041	25%	0.248	C	C	.	.	S	Bend	trans	-81.8	167.5	172.5	0	0	0	0	0	112.5	K462 N740 N743 A748	K462-G746 WeakPolarHBondContact CE-O 3.38Å; K462-G746 PolarHBondContact NZ-O 2.84Å; N740-G746 VanDerWaalsContact CB-N 3.34Å; N740-G746 VanDerWaalsContact O-CA 3.28Å; N740-G746 WeakPolarHBondContact O-CA 3.34Å; N740-G746 PolarHBondContact O-N 2.8Å; N743-G746 PolarHBondContact O-N 3.37Å; G746-A748 VanDerWaalsContact C-N 3.28Å; G746-A748 PolarHBondContact O-N 3.14Å
747	S	89.9	Confident	91.3	Very high	112 Å²	112	43.2 Å²	43.2	78%	0.783	26%	0.257	S	S	*	.	S	Bend	trans	51.3	46.7	-174.8	-52.5	0	0	0	0	112.8	N737	N737-S747 PolarHBondContact OD1-N 3.43Å; N737-S747 VanDerWaalsContact OD1-N 3.1Å
748	A	91.8	Very high	91.4	Very high	7 Å²	7	43.9 Å²	43.9	6%	0.058	26%	0.258	C	S	.	.			trans	-78	139.2	169.9	0	0	0	0	0	111	W460 K462 L733 N737 G746	W460-A748 HydrophobicContact CH2-CB 4.18Å; W460-A748 HydrophobicContact CZ2-CB 3.63Å; K462-A748 HydrophobicContact CD-CB 4.26Å; K462-A748 HydrophobicContact CG-CB 3.79Å; L733-A748 HydrophobicContact CD1-CB 4.28Å; N737-A748 PolarHBondContact ND2-O 3.26Å; N737-A748 WeakPolarHBondContact OD1-CB 3.31Å; N737-A748 PolarHBondContact OD1-N 3.19Å; G746-A748 VanDerWaalsContact C-N 3.28Å; G746-A748 PolarHBondContact O-N 3.14Å
749	S	90.6	Very high	91.5	Very high	51 Å²	51	40.9 Å²	40.9	36%	0.357	25%	0.246	S	C	.	.	S	Bend	trans	-75.2	-36.1	168.2	-46	0	0	0	0	111.6	T465 W472 L733	T465-S749 WeakPolarHBondContact OG1-CB 3.49Å; W472-S749 WeakPolarHBondContact CB-O 3.31Å; L733-S749 WeakPolarHBondContact CD2-O 3.29Å
750	G	92.6	Very high	91.6	Very high	0 Å²	0	42 Å²	42	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.7	178.5	177.6	0	0	0	0	0	112.2	V463 W472	V463-G750 PolarHBondContact N-O 3.41Å; V463-G750 PolarHBondContact O-N 2.81Å; W472-G750 VanDerWaalsContact CD2-CA 3.44Å
751	F	94.1	Very high	91.7	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	154.2	176.4	61.1	-97.8	0	0	0	112.5	W460 T461 W472 L729 V732 L733 L756	W460-F751 HydrophobicContact CD2-CB 4.19Å; W460-F751 HydrophobicContact CE3-CB 3.77Å; W460-F751 AromaticContact CE3-CD1 3.62Å; W460-F751 HydrophobicContact CE3-CD1 3.62Å; W460-F751 HydrophobicContact CE3-CE1 4.41Å; W460-F751 AromaticContact CE3-CG 3.8Å; W460-F751 HydrophobicContact CE3-CG 3.8Å; W460-F751 HydrophobicContact CH2-CD1 4.38Å; W460-F751 HydrophobicContact CZ3-CB 4.26Å; W460-F751 AromaticContact CZ3-CD1 3.41Å; W460-F751 HydrophobicContact CZ3-CD1 3.41Å; W460-F751 VanDerWaalsContact CZ3-CD1 3.41Å; W460-F751 HydrophobicContact CZ3-CE1 4.03Å; W460-F751 HydrophobicContact CZ3-CG 4.07Å; T461-F751 CarbonylContact O-C 3.56Å; T461-F751 VanDerWaalsContact O-CA 3.29Å; T461-F751 WeakPolarHBondContact O-CA 3.36Å; W472-F751 AromaticContact CH2-CD1 3.6Å; W472-F751 HydrophobicContact CH2-CD1 3.6Å; W472-F751 HydrophobicContact CH2-CD2 4.09Å; W472-F751 AromaticContact CH2-CE1 3.42Å; W472-F751 HydrophobicContact CH2-CE1 3.42Å; W472-F751 VanDerWaalsContact CH2-CE1 3.42Å; W472-F751 AromaticContact CH2-CE2 3.93Å; W472-F751 HydrophobicContact CH2-CE2 3.93Å; W472-F751 AromaticContact CH2-CG 3.94Å; W472-F751 HydrophobicContact CH2-CG 3.94Å; W472-F751 AromaticContact CH2-CZ 3.59Å; W472-F751 HydrophobicContact CH2-CZ 3.59Å; W472-F751 HydrophobicContact CZ2-CD1 4.45Å; W472-F751 HydrophobicContact CZ2-CG 4.43Å; W472-F751 WeakPolarHBondContact CZ2-O 3.35Å; W472-F751 AromaticContact CZ3-CD1 3.87Å; W472-F751 HydrophobicContact CZ3-CD1 3.87Å; W472-F751 AromaticContact CZ3-CE1 3.6Å; W472-F751 HydrophobicContact CZ3-CE1 3.6Å; W472-F751 HydrophobicContact CZ3-CZ 4.14Å; L729-F751 HydrophobicContact CD2-CE2 3.97Å; L729-F751 HydrophobicContact CD2-CZ 3.77Å; L729-F751 WeakPolarHBondContact O-CE1 3.26Å; V732-F751 HydrophobicContact CB-CE1 3.95Å; V732-F751 HydrophobicContact CB-CZ 3.74Å; V732-F751 HydrophobicContact CG1-CE1 3.66Å; V732-F751 HydrophobicContact CG1-CE2 4.18Å; V732-F751 HydrophobicContact CG1-CZ 3.43Å; V732-F751 VanDerWaalsContact CG1-CZ 3.43Å; L733-F751 HydrophobicContact CB-CD1 4.47Å; L733-F751 HydrophobicContact CB-CE1 4.16Å; L733-F751 HydrophobicContact CD1-CD1 3.92Å; L733-F751 HydrophobicContact CD1-CE1 4.44Å; F751-L756 HydrophobicContact CE2-CD2 3.94Å; F751-L756 HydrophobicContact CE2-CG 4.12Å; F751-L756 HydrophobicContact CZ-CD2 4.14Å
752	K	94	Very high	91.9	Very high	62 Å²	62	42.6 Å²	42.6	27%	0.27	26%	0.259	S	S	.	.			trans	-68.1	137.8	173.9	-74.7	-169.4	168.6	-90.9	0	111.6	T461 V463 S754 S755 E870	T461-K752 HydrophobicContact CG2-CD 3.83Å; T461-K752 HydrophobicContact CG2-CG 4.16Å; T461-K752 PolarHBondContact O-N 3.08Å; V463-K752 HydrophobicContact CG2-CG 3.82Å; K752-S754 PolarHBondContact O-N 3.46Å; K752-S754 VanDerWaalsContact O-N 3.11Å; K752-S755 WeakPolarHBondContact O-CB 3.49Å; K752-S755 PolarHBondContact O-N 3.17Å; K752-S755 PolarHBondContact O-OG 3.21Å; K752-E870 VanDerWaalsContact CA-OE1 3.3Å; K752-E870 WeakPolarHBondContact CA-OE1 3.25Å; K752-E870 WeakPolarHBondContact CB-OE1 3.28Å; K752-E870 VanDerWaalsContact CG-OE1 3.29Å; K752-E870 WeakPolarHBondContact CG-OE1 3.49Å; K752-E870 IonicContact NZ-OE2 2.72Å; K752-E870 PolarHBondContact NZ-OE2 3.48Å
753	L	94.5	Very high	92.3	Very high	6 Å²	6	45.5 Å²	45.5	3%	0.031	25%	0.246	C	C	.	.	G	3₁₀ helix	trans	-55.1	-35.2	-173.7	-71.8	178.3	0	0	0	113.7	L729 S755 L756 F868 E870 C880 T883 F884	L729-L753 HydrophobicContact CD2-CD2 3.97Å; L753-S755 PolarHBondContact O-N 3.25Å; L753-L756 HydrophobicContact CD2-CD1 4.31Å; L753-L756 VanDerWaalsContact O-CB 3.3Å; L753-L756 WeakPolarHBondContact O-CB 3.27Å; L753-L756 WeakPolarHBondContact O-CG 3.33Å; L753-L756 PolarHBondContact O-N 2.91Å; L753-F868 HydrophobicContact CD1-CB 3.98Å; L753-F868 HydrophobicContact CD1-CD1 4.12Å; L753-F868 HydrophobicContact CD1-CD2 3.9Å; L753-F868 HydrophobicContact CD1-CE2 4.47Å; L753-F868 HydrophobicContact CD1-CG 3.73Å; L753-F868 HydrophobicContact CD2-CD1 3.88Å; L753-F868 HydrophobicContact CD2-CE1 4.35Å; L753-F868 HydrophobicContact CD2-CG 4.29Å; L753-F868 HydrophobicContact CG-CB 4.21Å; L753-F868 HydrophobicContact CG-CD1 4.33Å; L753-F868 HydrophobicContact CG-CG 4.23Å; L753-E870 PolarHBondContact N-OE1 3.25Å; L753-C880 VanDerWaalsContact CD1-SG 3.52Å; L753-T883 HydrophobicContact CB-CG2 4.45Å; L753-F884 HydrophobicContact CD1-CE2 4.13Å; L753-F884 HydrophobicContact CD2-CE2 4.36Å; L753-F884 HydrophobicContact CD2-CZ 3.98Å
754	S	92	Very high	92.7	Very high	63 Å²	63	43.2 Å²	43.2	44%	0.441	23%	0.234	S	C	.	.	G	3₁₀ helix	trans	-60.2	-10.4	174.9	57.3	0	0	0	0	114.6	K752 L756	K752-S754 PolarHBondContact O-N 3.46Å; K752-S754 VanDerWaalsContact O-N 3.11Å; S754-L756 VanDerWaalsContact C-N 3.34Å
755	S	95.2	Very high	93	Very high	1 Å²	1	39.1 Å²	39.1	1%	0.007	21%	0.212	C	C	.	.	G	3₁₀ helix	trans	-74.9	-20	171	-50.3	0	0	0	0	113.4	T461 K752 L753 L757 K758	T461-S755 PolarHBondContact N-OG 3.46Å; T461-S755 VanDerWaalsContact N-OG 3.11Å; K752-S755 WeakPolarHBondContact O-CB 3.49Å; K752-S755 PolarHBondContact O-N 3.17Å; K752-S755 PolarHBondContact O-OG 3.21Å; L753-S755 PolarHBondContact O-N 3.25Å; S755-L757 VanDerWaalsContact C-N 3.35Å; S755-L757 PolarHBondContact O-N 2.9Å; S755-K758 WeakPolarHBondContact O-CB 3.26Å; S755-K758 PolarHBondContact O-N 3.45Å
756	L	96.1	Very high	93.1	Very high	1 Å²	1	40.4 Å²	40.4	1%	0.005	22%	0.22	C	C	.	.	G	3₁₀ helix	trans	-58.7	-44.9	177.4	-73.3	173.9	0	0	0	112	L729 V732 F751 L753 S754 K758 L759 F884 F887	L729-L756 HydrophobicContact CD2-CD1 4.18Å; L729-L756 HydrophobicContact CD2-CD2 4.14Å; L729-L756 HydrophobicContact CD2-CG 4.48Å; V732-L756 HydrophobicContact CG1-CD2 4.4Å; V732-L756 HydrophobicContact CG2-CD2 4.29Å; F751-L756 HydrophobicContact CE2-CD2 3.94Å; F751-L756 HydrophobicContact CE2-CG 4.12Å; F751-L756 HydrophobicContact CZ-CD2 4.14Å; L753-L756 HydrophobicContact CD2-CD1 4.31Å; L753-L756 VanDerWaalsContact O-CB 3.3Å; L753-L756 WeakPolarHBondContact O-CB 3.27Å; L753-L756 WeakPolarHBondContact O-CG 3.33Å; L753-L756 PolarHBondContact O-N 2.91Å; S754-L756 VanDerWaalsContact C-N 3.34Å; L756-K758 PolarHBondContact O-N 3.05Å; L756-K758 VanDerWaalsContact O-N 3.16Å; L756-L759 WeakPolarHBondContact O-CD1 3.27Å; L756-L759 PolarHBondContact O-N 3.5Å; L756-F884 HydrophobicContact CD1-CD1 4.48Å; L756-F884 HydrophobicContact CD1-CE1 4.11Å; L756-F887 HydrophobicContact CB-CD2 3.73Å; L756-F887 HydrophobicContact CB-CE2 4.19Å; L756-F887 HydrophobicContact CB-CG 4.22Å; L756-F887 HydrophobicContact CD2-CE2 4.32Å
757	L	95.8	Very high	93.1	Very high	36 Å²	36	44.3 Å²	44.3	19%	0.188	25%	0.246	C	C	.	.	G	3₁₀ helix	trans	-63.1	-25.4	-178.5	-59.6	178.7	0	0	0	112.4	S755 L759 S760 T883 L886 F887 K890	S755-L757 VanDerWaalsContact C-N 3.35Å; S755-L757 PolarHBondContact O-N 2.9Å; L757-L759 VanDerWaalsContact C-N 3.31Å; L757-L759 PolarHBondContact O-N 3.42Å; L757-S760 PolarHBondContact O-N 3.18Å; L757-S760 PolarHBondContact O-OG 3.01Å; L757-T883 HydrophobicContact CD1-CG2 4.46Å; L757-T883 HydrophobicContact CG-CG2 4.4Å; L757-L886 HydrophobicContact CD2-CB 3.88Å; L757-F887 HydrophobicContact CD2-CB 4.01Å; L757-K890 HydrophobicContact CD2-CD 4.49Å
758	K	95.9	Very high	93	Very high	50 Å²	50	44.5 Å²	44.5	22%	0.217	23%	0.233	C	C	.	.	G	3₁₀ helix	trans	-72.5	-15.6	-180	-57	176.9	-177.4	169.6	0	114.1	F458 R459 S755 L756 S760 E761 V762	F458-K758 HydrophobicContact CE2-CB 3.88Å; R459-K758 WeakPolarHBondContact O-CD 3.33Å; R459-K758 PolarHBondContact O-NZ 3.01Å; S755-K758 WeakPolarHBondContact O-CB 3.26Å; S755-K758 PolarHBondContact O-N 3.45Å; L756-K758 PolarHBondContact O-N 3.05Å; L756-K758 VanDerWaalsContact O-N 3.16Å; K758-S760 PolarHBondContact O-N 3.11Å; K758-E761 WeakPolarHBondContact O-CB 3.15Å; K758-E761 PolarHBondContact O-N 3.29Å; K758-V762 PolarHBondContact O-N 3.3Å
759	L	96.7	Very high	93	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	24%	0.24	C	C	.	.	G	3₁₀ helix	trans	-60.8	-27.6	173.6	-79.1	87.2	0	0	0	111.6	F458 V732 L756 L757 E761 L771 L772 L775	F458-L759 HydrophobicContact CE1-CD1 4.4Å; F458-L759 HydrophobicContact CZ-CD1 3.71Å; F458-L759 HydrophobicContact CZ-CG 4.14Å; V732-L759 HydrophobicContact CG1-CD1 3.92Å; V732-L759 HydrophobicContact CG1-CD2 4.35Å; V732-L759 HydrophobicContact CG2-CD2 4.06Å; L756-L759 WeakPolarHBondContact O-CD1 3.27Å; L756-L759 PolarHBondContact O-N 3.5Å; L757-L759 VanDerWaalsContact C-N 3.31Å; L757-L759 PolarHBondContact O-N 3.42Å; L759-E761 VanDerWaalsContact C-N 3.28Å; L759-E761 PolarHBondContact O-N 2.92Å; L759-L771 HydrophobicContact CB-CB 4.49Å; L759-L771 HydrophobicContact CD2-CG 4.26Å; L759-L771 HydrophobicContact CG-CD2 4.21Å; L759-L771 HydrophobicContact CG-CG 4.3Å; L759-L771 PolarHBondContact O-N 3.35Å; L759-L772 HydrophobicContact CB-CB 4.04Å; L759-L772 PolarHBondContact O-N 3.42Å; L759-L775 HydrophobicContact CD2-CB 4.49Å; L759-L775 HydrophobicContact CD2-CD2 3.81Å
760	S	94.9	Very high	93.3	Very high	28 Å²	28	44.3 Å²	44.3	20%	0.196	23%	0.225	C	C	.	.	G	3₁₀ helix	trans	-73.1	-14	173.3	66.5	0	0	0	0	114.4	L757 K758 T770 K890	L757-S760 PolarHBondContact O-N 3.18Å; L757-S760 PolarHBondContact O-OG 3.01Å; K758-S760 PolarHBondContact O-N 3.11Å; S760-T770 WeakPolarHBondContact O-CG2 3.44Å; S760-K890 PolarHBondContact OG-NZ 3.4Å
761	E	94	Very high	93.5	Very high	121 Å²	121	44.3 Å²	44.3	57%	0.565	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.1	-34.8	-175.8	-62.3	166.8	-156.8	0	0	112.5	K758 L759 R763	K758-E761 WeakPolarHBondContact O-CB 3.15Å; K758-E761 PolarHBondContact O-N 3.29Å; L759-E761 VanDerWaalsContact C-N 3.28Å; L759-E761 PolarHBondContact O-N 2.92Å; E761-R763 PolarHBondContact O-N 3.41Å
762	V	93.3	Very high	93.7	Very high	23 Å²	23	44.4 Å²	44.4	14%	0.139	23%	0.226	C	C	.	.			trans	-72.7	107.1	-177.9	-177.8	0	0	0	0	110.1	F458 F506 M739 K758 T770 L771	F458-V762 HydrophobicContact CD2-CG2 3.62Å; F458-V762 HydrophobicContact CE2-CG2 4.18Å; F506-V762 HydrophobicContact CD1-CG1 4.18Å; F506-V762 HydrophobicContact CE1-CG1 4.05Å; M739-V762 HydrophobicContact CE-CG1 3.99Å; K758-V762 PolarHBondContact O-N 3.3Å; V762-T770 CarbonylContact O-C 3.45Å; V762-T770 VanDerWaalsContact O-CA 3.23Å; V762-T770 WeakPolarHBondContact O-CA 3.19Å; V762-L771 HydrophobicContact CB-CB 3.95Å; V762-L771 HydrophobicContact CB-CD2 4.44Å; V762-L771 HydrophobicContact CG1-CB 4.28Å; V762-L771 PolarHBondContact O-N 2.83Å
763	R	93.3	Very high	93.8	Very high	137 Å²	137	41.6 Å²	41.6	52%	0.517	21%	0.213	S	C	.	.	B	Isolated β-bridge	trans	-90.8	138.9	179.6	-76	174.5	168.3	85.1	1.3	113.5	K456 E761 S767 T770	K456-R763 WeakPolarHBondContact CD-O 3.26Å; K456-R763 PolarHBondContact NZ-O 3.47Å; E761-R763 PolarHBondContact O-N 3.41Å; R763-S767 WeakPolarHBondContact CD-O 3.31Å; R763-S767 PolarHBondContact NE-O 3.37Å; R763-T770 HydrophobicContact CG-CG2 4.19Å
764	S	93.1	Very high	93.9	Very high	5 Å²	5	41.4 Å²	41.4	4%	0.035	21%	0.212	C	C	.	.			trans	-68.4	-171.4	172.8	87.3	0	0	0	0	111.6	K456 L505 F506 D766 F769	K456-S764 PolarHBondContact NZ-O 3.21Å; L505-S764 CarbonylContact O-C 3.57Å; L505-S764 WeakPolarHBondContact O-CA 3.44Å; L505-S764 VanDerWaalsContact O-CB 3.29Å; L505-S764 WeakPolarHBondContact O-CB 3.45Å; F506-S764 VanDerWaalsContact CE1-CA 3.49Å; S764-D766 CarbonylContact C-O 3.58Å; S764-D766 PolarHBondContact OG-N 3.5Å; S764-D766 PolarHBondContact OG-O 3.3Å; S764-F769 VanDerWaalsContact CB-O 3.29Å; S764-F769 WeakPolarHBondContact CB-O 3.49Å; S764-F769 PolarHBondContact N-O 3.11Å; S764-F769 PolarHBondContact OG-O 3.06Å
765	N	91.1	Very high	94.2	Very high	63 Å²	63	38.4 Å²	38.4	34%	0.337	19%	0.191	S	C	.	.	S	Bend	trans	-71.8	-15.4	172.3	-72.4	-31.6	0	0	0	113.6	K456 L505 A507	K456-N765 VanDerWaalsContact CE-OD1 3.28Å; K456-N765 WeakPolarHBondContact CE-OD1 3.32Å; K456-N765 PolarHBondContact NZ-OD1 3.35Å; L505-N765 PolarHBondContact O-N 3.15Å; L505-N765 PolarHBondContact O-ND2 2.88Å; A507-N765 PolarHBondContact O-ND2 3.44Å; A507-N765 PolarHBondContact O-OD1 2.91Å
766	D	88.7	Confident	94.3	Very high	79 Å²	79	38.3 Å²	38.3	42%	0.422	19%	0.191	S	C	.	.	S	Bend	trans	-90.5	135.2	151.7	-169.4	-32.3	0	0	0	109.1	S764 K768 F769	S764-D766 CarbonylContact C-O 3.58Å; S764-D766 PolarHBondContact OG-N 3.5Å; S764-D766 PolarHBondContact OG-O 3.3Å; D766-K768 VanDerWaalsContact C-N 3.26Å; D766-K768 PolarHBondContact O-N 2.98Å; D766-K768 WeakPolarHBondContact OD1-CB 3.45Å; D766-K768 WeakPolarHBondContact OD1-CG 3.32Å; D766-K768 PolarHBondContact OD1-N 3.44Å; D766-F769 HydrophobicContact CB-CB 4.5Å
767	S	86.7	Confident	94.2	Very high	86 Å²	86	40.6 Å²	40.6	60%	0.601	20%	0.201	S	C	*	.	S	Bend	trans	-73	-14.6	179	56.7	0	0	0	0	114.3	R763	R763-S767 WeakPolarHBondContact CD-O 3.31Å; R763-S767 PolarHBondContact NE-O 3.37Å
768	K	87.9	Confident	94.2	Very high	116 Å²	116	39.1 Å²	39.1	50%	0.504	19%	0.194	S	C	.	.	S	Bend	trans	-78	-44.2	174.1	-62.1	168.4	-176	170	0	111.9	D766 F901	D766-K768 VanDerWaalsContact C-N 3.26Å; D766-K768 PolarHBondContact O-N 2.98Å; D766-K768 WeakPolarHBondContact OD1-CB 3.45Å; D766-K768 WeakPolarHBondContact OD1-CG 3.32Å; D766-K768 PolarHBondContact OD1-N 3.44Å; K768-F901 HydrophobicContact CB-CZ 4.16Å; K768-F901 HydrophobicContact CD-CE1 4.07Å; K768-F901 HydrophobicContact CD-CZ 4.24Å
769	F	93.4	Very high	94.2	Very high	45 Å²	45	36.8 Å²	36.8	20%	0.197	18%	0.184	C	C	.	.			trans	-86	127.2	-170.9	-164.5	-85.1	0	0	0	111.1	L505 S764 D766 H773 F774	L505-F769 HydrophobicContact CD1-CE1 3.95Å; S764-F769 VanDerWaalsContact CB-O 3.29Å; S764-F769 WeakPolarHBondContact CB-O 3.49Å; S764-F769 PolarHBondContact N-O 3.11Å; S764-F769 PolarHBondContact OG-O 3.06Å; D766-F769 HydrophobicContact CB-CB 4.5Å; F769-H773 HydrophobicContact CD1-CB 3.86Å; F769-H773 HydrophobicContact CD2-CB 3.61Å; F769-H773 AromaticContact CD2-CD2 3.88Å; F769-H773 HydrophobicContact CE1-CB 3.79Å; F769-H773 HydrophobicContact CE2-CB 3.55Å; F769-H773 HydrophobicContact CG-CB 3.77Å; F769-H773 HydrophobicContact CZ-CB 3.64Å; F769-F774 HydrophobicContact CE1-CB 3.94Å; F769-F774 HydrophobicContact CZ-CB 4.48Å
770	T	96.6	Very high	94	Very high	9 Å²	9	39.6 Å²	39.6	6%	0.055	20%	0.196	C	C	.	.	B	Isolated β-bridge	trans	-110.9	174.3	-176.2	66.8	0	0	0	0	112.5	S760 V762 R763 L772 H773 F774	S760-T770 WeakPolarHBondContact O-CG2 3.44Å; V762-T770 CarbonylContact O-C 3.45Å; V762-T770 VanDerWaalsContact O-CA 3.23Å; V762-T770 WeakPolarHBondContact O-CA 3.19Å; R763-T770 HydrophobicContact CG-CG2 4.19Å; T770-L772 PolarHBondContact O-N 3.35Å; T770-L772 PolarHBondContact OG1-N 3.4Å; T770-H773 PolarHBondContact N-ND1 2.99Å; T770-H773 WeakPolarHBondContact O-CB 3.28Å; T770-H773 PolarHBondContact O-N 2.92Å; T770-H773 VanDerWaalsContact O-N 3.1Å; T770-H773 PolarHBondContact OG1-N 3.28Å; T770-H773 PolarHBondContact OG1-ND1 2.79Å; T770-F774 PolarHBondContact O-N 3.05Å; T770-F774 VanDerWaalsContact O-N 3.07Å
771	L	96.9	Very high	93.9	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-65.9	-28.1	173.4	-170.8	58.4	0	0	0	112.2	F458 L502 F506 I735 M739 L759 V762 F774 L775	F458-L771 HydrophobicContact CD1-CD2 4.26Å; F458-L771 HydrophobicContact CD2-CD2 4.34Å; F458-L771 HydrophobicContact CE1-CD2 4.47Å; F458-L771 HydrophobicContact CG-CD2 4.18Å; L502-L771 HydrophobicContact CD2-CD1 3.91Å; F506-L771 HydrophobicContact CE1-CB 4.37Å; F506-L771 HydrophobicContact CE2-CD1 4.23Å; F506-L771 HydrophobicContact CZ-CB 4.25Å; F506-L771 HydrophobicContact CZ-CD1 4.07Å; I735-L771 HydrophobicContact CG2-CD1 3.69Å; I735-L771 HydrophobicContact CG2-CD2 4.02Å; I735-L771 HydrophobicContact CG2-CG 4.12Å; M739-L771 HydrophobicContact CE-CD1 4.5Å; M739-L771 HydrophobicContact CE-CD2 4.44Å; M739-L771 HydrophobicContact SD-CD1 3.34Å; M739-L771 WeakPolarHBondContact SD-CD1 3.32Å; M739-L771 HydrophobicContact SD-CD2 3.48Å; M739-L771 WeakPolarHBondContact SD-CD2 3.37Å; M739-L771 HydrophobicContact SD-CG 4.02Å; L759-L771 HydrophobicContact CB-CB 4.49Å; L759-L771 HydrophobicContact CD2-CG 4.26Å; L759-L771 HydrophobicContact CG-CD2 4.21Å; L759-L771 HydrophobicContact CG-CG 4.3Å; L759-L771 PolarHBondContact O-N 3.35Å; V762-L771 HydrophobicContact CB-CB 3.95Å; V762-L771 HydrophobicContact CB-CD2 4.44Å; V762-L771 HydrophobicContact CG1-CB 4.28Å; V762-L771 PolarHBondContact O-N 2.83Å; L771-F774 HydrophobicContact CD1-CB 4.33Å; L771-F774 HydrophobicContact CD1-CD1 4.19Å; L771-F774 WeakPolarHBondContact O-CB 3.41Å; L771-F774 PolarHBondContact O-N 2.55Å; L771-L775 PolarHBondContact O-N 3.44Å
772	L	97.5	Very high	93.8	Very high	2 Å²	2	39.6 Å²	39.6	1%	0.01	20%	0.201	C	C	.	.	H	α-helix	trans	-67.4	-38.2	169	-172.6	58.2	0	0	0	111.7	L759 T770 F774 L775 V776 F887 K890 T894	L759-L772 HydrophobicContact CB-CB 4.04Å; L759-L772 PolarHBondContact O-N 3.42Å; T770-L772 PolarHBondContact O-N 3.35Å; T770-L772 PolarHBondContact OG1-N 3.4Å; L772-F774 VanDerWaalsContact C-N 3.31Å; L772-F774 PolarHBondContact O-N 3.18Å; L772-L775 HydrophobicContact CD1-CD2 4.25Å; L772-L775 PolarHBondContact O-N 3.37Å; L772-V776 HydrophobicContact CD1-CG2 4.3Å; L772-V776 HydrophobicContact CG-CG2 4.47Å; L772-V776 WeakPolarHBondContact O-CG2 3.27Å; L772-V776 PolarHBondContact O-N 3Å; L772-F887 HydrophobicContact CD1-CE2 3.89Å; L772-F887 HydrophobicContact CD1-CZ 4Å; L772-K890 HydrophobicContact CD2-CB 3.8Å; L772-T894 HydrophobicContact CG-CG2 4.18Å
773	H	97	Very high	93.7	Very high	2 Å²	2	39.1 Å²	39.1	1%	0.009	20%	0.197	C	C	.	.	H	α-helix	trans	-61.4	-40.5	172.8	-75	65.2	0	0	0	111.5	F769 T770 Q777 T894 E897 I898 F901	F769-H773 HydrophobicContact CD1-CB 3.86Å; F769-H773 HydrophobicContact CD2-CB 3.61Å; F769-H773 AromaticContact CD2-CD2 3.88Å; F769-H773 HydrophobicContact CE1-CB 3.79Å; F769-H773 HydrophobicContact CE2-CB 3.55Å; F769-H773 HydrophobicContact CG-CB 3.77Å; F769-H773 HydrophobicContact CZ-CB 3.64Å; T770-H773 PolarHBondContact N-ND1 2.99Å; T770-H773 WeakPolarHBondContact O-CB 3.28Å; T770-H773 PolarHBondContact O-N 2.92Å; T770-H773 VanDerWaalsContact O-N 3.1Å; T770-H773 PolarHBondContact OG1-N 3.28Å; T770-H773 PolarHBondContact OG1-ND1 2.79Å; H773-Q777 WeakPolarHBondContact O-CB 3.14Å; H773-Q777 PolarHBondContact O-N 2.81Å; H773-T894 VanDerWaalsContact CA-CG2 3.46Å; H773-T894 HydrophobicContact CB-CG2 4.06Å; H773-E897 IonicContact CE1-OE2 3.4Å; H773-E897 PolarHBondContact CE1-OE2 3.43Å; H773-E897 IonicContact NE2-OE2 2.72Å; H773-I898 HydrophobicContact CB-CD1 4.35Å; H773-F901 AromaticContact NE2-CE2 3.79Å
774	F	96.6	Very high	93.7	Very high	2 Å²	2	36.2 Å²	36.2	1%	0.009	20%	0.196	C	C	.	.	H	α-helix	trans	-59.8	-51.4	174.2	178.4	-109	0	0	0	111.7	I497 K501 L502 L505 F506 I735 F769 T770 L771 L772 V776 Q777 E778	I497-F774 HydrophobicContact CG2-CE1 3.63Å; I497-F774 HydrophobicContact CG2-CZ 3.65Å; K501-F774 HydrophobicContact CB-CE2 3.75Å; K501-F774 HydrophobicContact CB-CZ 4.34Å; K501-F774 HydrophobicContact CD-CE2 4.22Å; L502-F774 HydrophobicContact CD1-CE1 3.99Å; L502-F774 HydrophobicContact CD1-CZ 4.41Å; L502-F774 HydrophobicContact CD2-CD1 3.52Å; L502-F774 HydrophobicContact CD2-CD2 4.27Å; L502-F774 HydrophobicContact CD2-CE1 3.56Å; L502-F774 HydrophobicContact CD2-CE2 4.33Å; L502-F774 HydrophobicContact CD2-CG 3.88Å; L502-F774 HydrophobicContact CD2-CZ 3.98Å; L502-F774 HydrophobicContact CG-CD1 4.2Å; L502-F774 HydrophobicContact CG-CE1 3.69Å; L502-F774 HydrophobicContact CG-CE2 4.41Å; L502-F774 HydrophobicContact CG-CZ 3.81Å; L505-F774 HydrophobicContact CD1-CD2 3.91Å; L505-F774 HydrophobicContact CD1-CE2 4.49Å; F506-F774 HydrophobicContact CE2-CB 4.31Å; I735-F774 HydrophobicContact CD1-CD1 4.02Å; I735-F774 HydrophobicContact CD1-CE1 4.04Å; I735-F774 HydrophobicContact CG1-CE1 4.18Å; F769-F774 HydrophobicContact CE1-CB 3.94Å; F769-F774 HydrophobicContact CZ-CB 4.48Å; T770-F774 PolarHBondContact O-N 3.05Å; T770-F774 VanDerWaalsContact O-N 3.07Å; L771-F774 HydrophobicContact CD1-CB 4.33Å; L771-F774 HydrophobicContact CD1-CD1 4.19Å; L771-F774 WeakPolarHBondContact O-CB 3.41Å; L771-F774 PolarHBondContact O-N 2.55Å; L772-F774 VanDerWaalsContact C-N 3.31Å; L772-F774 PolarHBondContact O-N 3.18Å; F774-V776 PolarHBondContact O-N 3.13Å; F774-Q777 PolarHBondContact O-N 3.17Å; F774-E778 HydrophobicContact CD2-CG 4.07Å; F774-E778 HydrophobicContact CE1-CG 4.12Å; F774-E778 HydrophobicContact CE2-CG 3.58Å; F774-E778 HydrophobicContact CZ-CG 3.62Å; F774-E778 WeakPolarHBondContact O-CG 3.46Å; F774-E778 PolarHBondContact O-N 3.27Å
775	L	96.9	Very high	93.6	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-56.5	-47.4	178.9	179.7	62.6	0	0	0	112	I497 L728 T731 V732 I735 L759 L771 L772 E778 F779 F887	I497-L775 HydrophobicContact CD1-CD1 3.81Å; L728-L775 HydrophobicContact CD1-CD2 4.17Å; T731-L775 HydrophobicContact CG2-CD1 3.66Å; V732-L775 HydrophobicContact CG2-CD2 3.89Å; I735-L775 HydrophobicContact CD1-CB 4.42Å; I735-L775 HydrophobicContact CD1-CD1 3.85Å; L759-L775 HydrophobicContact CD2-CB 4.49Å; L759-L775 HydrophobicContact CD2-CD2 3.81Å; L771-L775 PolarHBondContact O-N 3.44Å; L772-L775 HydrophobicContact CD1-CD2 4.25Å; L772-L775 PolarHBondContact O-N 3.37Å; L775-E778 PolarHBondContact O-N 3.14Å; L775-F779 HydrophobicContact CD1-CD2 4.12Å; L775-F779 HydrophobicContact CD1-CE1 4Å; L775-F779 HydrophobicContact CD1-CE2 3.54Å; L775-F779 HydrophobicContact CD1-CZ 3.48Å; L775-F779 VanDerWaalsContact CD1-CZ 3.48Å; L775-F779 HydrophobicContact CD2-CE2 4.09Å; L775-F779 HydrophobicContact CG-CD2 4.02Å; L775-F779 HydrophobicContact CG-CE2 3.61Å; L775-F779 HydrophobicContact CG-CZ 4.09Å; L775-F779 WeakPolarHBondContact O-CG 3.32Å; L775-F779 PolarHBondContact O-N 3.12Å; L775-F887 HydrophobicContact CD2-CZ 4.11Å
776	V	96.9	Very high	93.8	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-66.5	-39.7	-180	173	0	0	0	0	111.9	L772 F774 F779 K780 L787 M891 T894 E895 I898	L772-V776 HydrophobicContact CD1-CG2 4.3Å; L772-V776 HydrophobicContact CG-CG2 4.47Å; L772-V776 WeakPolarHBondContact O-CG2 3.27Å; L772-V776 PolarHBondContact O-N 3Å; F774-V776 PolarHBondContact O-N 3.13Å; V776-F779 PolarHBondContact O-N 3.48Å; V776-K780 VanDerWaalsContact O-CB 3.25Å; V776-K780 WeakPolarHBondContact O-CB 3.15Å; V776-K780 PolarHBondContact O-N 3.18Å; V776-L787 HydrophobicContact CG1-CD2 4.02Å; V776-M891 HydrophobicContact CG2-CG 3.6Å; V776-T894 HydrophobicContact CB-CG2 4.1Å; V776-T894 HydrophobicContact CG2-CG2 3.96Å; V776-E895 HydrophobicContact CG1-CB 3.85Å; V776-E895 HydrophobicContact CG1-CG 3.9Å; V776-I898 HydrophobicContact CB-CD1 3.9Å; V776-I898 HydrophobicContact CG1-CD1 3.69Å
777	Q	95.2	Very high	94	Very high	48 Å²	48	35.3 Å²	35.3	22%	0.224	19%	0.188	C	C	.	.	H	α-helix	trans	-66.4	-39.1	176.9	-166	68.6	14.3	0	0	112	H773 F774 K780 T781 I898 E902	H773-Q777 WeakPolarHBondContact O-CB 3.14Å; H773-Q777 PolarHBondContact O-N 2.81Å; F774-Q777 PolarHBondContact O-N 3.17Å; Q777-K780 PolarHBondContact O-N 3.32Å; Q777-T781 WeakPolarHBondContact O-CB 3.4Å; Q777-T781 PolarHBondContact O-N 3.31Å; Q777-T781 PolarHBondContact O-OG1 2.76Å; Q777-I898 HydrophobicContact CB-CD1 4.42Å; Q777-E902 PolarHBondContact NE2-OE1 2.98Å
778	E	95	Very high	94.3	Very high	6 Å²	6	37.4 Å²	37.4	3%	0.028	19%	0.186	C	C	.	.	H	α-helix	trans	-71.9	-38.3	177.8	-65.9	-64.7	114.2	0	0	111.9	I497 N498 K501 F774 L775 T781 N782	I497-E778 HydrophobicContact CB-CB 4.39Å; I497-E778 HydrophobicContact CD1-CB 3.63Å; I497-E778 HydrophobicContact CD1-CG 4.28Å; I497-E778 HydrophobicContact CG1-CB 3.73Å; I497-E778 HydrophobicContact CG1-CG 4.39Å; I497-E778 HydrophobicContact CG2-CB 4.24Å; I497-E778 HydrophobicContact CG2-CG 3.92Å; N498-E778 PolarHBondContact N-OE2 3.06Å; K501-E778 WeakPolarHBondContact CD-OE1 3.25Å; K501-E778 WeakPolarHBondContact CE-OE1 3.46Å; K501-E778 IonicContact NZ-OE1 2.57Å; K501-E778 PolarHBondContact NZ-OE1 3.33Å; K501-E778 IonicContact NZ-OE2 2.94Å; K501-E778 PolarHBondContact NZ-OE2 3.47Å; F774-E778 HydrophobicContact CD2-CG 4.07Å; F774-E778 HydrophobicContact CE1-CG 4.12Å; F774-E778 HydrophobicContact CE2-CG 3.58Å; F774-E778 HydrophobicContact CZ-CG 3.62Å; F774-E778 WeakPolarHBondContact O-CG 3.46Å; F774-E778 PolarHBondContact O-N 3.27Å; L775-E778 PolarHBondContact O-N 3.14Å; E778-T781 PolarHBondContact O-N 2.87Å; E778-N782 VanDerWaalsContact O-CB 3.3Å; E778-N782 WeakPolarHBondContact O-CB 3.26Å; E778-N782 PolarHBondContact O-N 2.93Å; E778-N782 PolarHBondContact OE2-ND2 3.35Å
779	F	95.7	Very high	94.6	Very high	1 Å²	1	31.9 Å²	31.9	0%	0.004	16%	0.162	C	C	.	.	H	α-helix	trans	-59.9	-48.3	168.3	-72.6	-28	0	0	0	111.5	L728 T731 L775 V776 T781 N783 P784 M786 L787	L728-F779 HydrophobicContact CD1-CE2 3.78Å; L728-F779 HydrophobicContact CD1-CZ 3.82Å; T731-F779 HydrophobicContact CG2-CE1 3.83Å; T731-F779 HydrophobicContact CG2-CZ 4.08Å; L775-F779 HydrophobicContact CD1-CD2 4.12Å; L775-F779 HydrophobicContact CD1-CE1 4Å; L775-F779 HydrophobicContact CD1-CE2 3.54Å; L775-F779 HydrophobicContact CD1-CZ 3.48Å; L775-F779 VanDerWaalsContact CD1-CZ 3.48Å; L775-F779 HydrophobicContact CD2-CE2 4.09Å; L775-F779 HydrophobicContact CG-CD2 4.02Å; L775-F779 HydrophobicContact CG-CE2 3.61Å; L775-F779 HydrophobicContact CG-CZ 4.09Å; L775-F779 WeakPolarHBondContact O-CG 3.32Å; L775-F779 PolarHBondContact O-N 3.12Å; V776-F779 PolarHBondContact O-N 3.48Å; F779-T781 PolarHBondContact O-N 2.89Å; F779-T781 VanDerWaalsContact O-N 3.15Å; F779-N783 CarbonylContact O-C 3.43Å; F779-N783 WeakPolarHBondContact O-CA 3.37Å; F779-N783 PolarHBondContact O-N 3.48Å; F779-N783 VanDerWaalsContact O-O 3.12Å; F779-P784 WeakPolarHBondContact O-CA 3.48Å; F779-P784 VanDerWaalsContact O-N 3.07Å; F779-M786 HydrophobicContact CB-CB 4.01Å; F779-M786 HydrophobicContact CD1-CB 3.5Å; F779-M786 HydrophobicContact CD1-CG 3.69Å; F779-M786 HydrophobicContact CD2-CB 3.72Å; F779-M786 HydrophobicContact CE1-CB 3.74Å; F779-M786 HydrophobicContact CE1-CE 3.68Å; F779-M786 HydrophobicContact CE1-CG 3.69Å; F779-M786 HydrophobicContact CE2-CB 3.95Å; F779-M786 HydrophobicContact CE2-CE 4.33Å; F779-M786 HydrophobicContact CG-CB 3.49Å; F779-M786 VanDerWaalsContact CG-CB 3.49Å; F779-M786 HydrophobicContact CG-CG 4.22Å; F779-M786 HydrophobicContact CZ-CB 3.96Å; F779-M786 HydrophobicContact CZ-CE 3.53Å; F779-M786 HydrophobicContact CZ-CG 4.21Å; F779-L787 HydrophobicContact CB-CD2 3.89Å; F779-L787 HydrophobicContact CB-CG 4.18Å; F779-L787 HydrophobicContact CD2-CD2 4.33Å
780	K	93.8	Very high	94.5	Very high	58 Å²	58	30.9 Å²	30.9	25%	0.252	16%	0.159	S	C	.	.	H	α-helix	trans	-56.7	-30.1	176.4	-174	179.6	174.5	-173	0	113.6	V776 Q777 L787 I898 E902	V776-K780 VanDerWaalsContact O-CB 3.25Å; V776-K780 WeakPolarHBondContact O-CB 3.15Å; V776-K780 PolarHBondContact O-N 3.18Å; Q777-K780 PolarHBondContact O-N 3.32Å; K780-L787 HydrophobicContact CB-CD1 4Å; K780-L787 HydrophobicContact CG-CD1 4.48Å; K780-I898 HydrophobicContact CD-CG2 4.35Å; K780-E902 IonicContact NZ-OE1 3.5Å; K780-E902 PolarHBondContact NZ-OE1 3.49Å; K780-E902 IonicContact NZ-OE2 3.58Å; K780-E902 PolarHBondContact NZ-OE2 2.96Å
781	T	92.5	Very high	94.3	Very high	84 Å²	84	35.5 Å²	35.5	52%	0.515	18%	0.183	S	C	.	.	H	α-helix	trans	-94	-42.5	-176.5	-50.3	0	0	0	0	112.9	Q777 E778 F779	Q777-T781 WeakPolarHBondContact O-CB 3.4Å; Q777-T781 PolarHBondContact O-N 3.31Å; Q777-T781 PolarHBondContact O-OG1 2.76Å; E778-T781 PolarHBondContact O-N 2.87Å; F779-T781 PolarHBondContact O-N 2.89Å; F779-T781 VanDerWaalsContact O-N 3.15Å
782	N	91.8	Very high	94.1	Very high	66 Å²	66	38.6 Å²	38.6	35%	0.353	20%	0.202	S	C	.	.	H	α-helix	trans	-111.7	-32.2	-165.7	-45.7	-21.7	0	0	0	112.9	L496 E778	L496-N782 WeakPolarHBondContact O-CB 3.5Å; L496-N782 PolarHBondContact O-ND2 3.42Å; E778-N782 VanDerWaalsContact O-CB 3.3Å; E778-N782 WeakPolarHBondContact O-CB 3.26Å; E778-N782 PolarHBondContact O-N 2.93Å; E778-N782 PolarHBondContact OE2-ND2 3.35Å
783	N	91.8	Very high	94	Very high	12 Å²	12	38.7 Å²	38.7	6%	0.064	20%	0.203	C	C	.	.			trans	-145.6	76.3	178.4	-168	7.8	0	0	0	113.2	L496 E727 F779 Q785 M786	L496-N783 HydrophobicContact CD2-CB 3.96Å; E727-N783 PolarHBondContact OE1-ND2 3.15Å; E727-N783 PolarHBondContact OE2-ND2 3.42Å; F779-N783 CarbonylContact O-C 3.43Å; F779-N783 WeakPolarHBondContact O-CA 3.37Å; F779-N783 PolarHBondContact O-N 3.48Å; F779-N783 VanDerWaalsContact O-O 3.12Å; N783-Q785 PolarHBondContact O-N 2.98Å; N783-Q785 VanDerWaalsContact O-N 3.12Å; N783-Q785 VanDerWaalsContact OD1-CG 3.26Å; N783-Q785 WeakPolarHBondContact OD1-CG 3.11Å; N783-Q785 PolarHBondContact OD1-NE2 2.94Å; N783-M786 HydrophobicContact CB-CG 4.08Å; N783-M786 VanDerWaalsContact ND2-CG 3.33Å; N783-M786 WeakPolarHBondContact ND2-CG 3.42Å; N783-M786 WeakPolarHBondContact O-CB 3.34Å; N783-M786 WeakPolarHBondContact O-CG 3.45Å; N783-M786 PolarHBondContact O-N 3.37Å; N783-M786 VanDerWaalsContact O-N 3.16Å
784	P	92	Very high	93.8	Very high	77 Å²	77	42.3 Å²	42.3	50%	0.5	23%	0.227	S	C	.	.	G	3₁₀ helix	trans	-64.7	-19.6	-169.8	-25.8	36.3	0	0	0	115.7	F779 M786 L787	F779-P784 WeakPolarHBondContact O-CA 3.48Å; F779-P784 VanDerWaalsContact O-N 3.07Å; P784-M786 PolarHBondContact O-N 3.48Å; P784-L787 PolarHBondContact O-N 2.94Å
785	Q	92.4	Very high	93.7	Very high	108 Å²	108	46.8 Å²	46.8	51%	0.505	24%	0.244	S	C	.	.	G	3₁₀ helix	trans	-66.7	-20.8	177.8	75.1	-153.3	-36.4	0	0	112.6	L724 N783 L787 K788	L724-Q785 HydrophobicContact CD2-CG 4.1Å; N783-Q785 PolarHBondContact O-N 2.98Å; N783-Q785 VanDerWaalsContact O-N 3.12Å; N783-Q785 VanDerWaalsContact OD1-CG 3.26Å; N783-Q785 WeakPolarHBondContact OD1-CG 3.11Å; N783-Q785 PolarHBondContact OD1-NE2 2.94Å; Q785-L787 PolarHBondContact O-N 3.19Å; Q785-K788 WeakPolarHBondContact O-CB 3.29Å; Q785-K788 PolarHBondContact O-N 3.23Å
786	M	94.4	Very high	93.7	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	25%	0.247	C	C	.	.	G	3₁₀ helix	trans	-67.2	-19.1	175.3	-62.7	-61.6	-76.5	0	0	113.6	L724 E727 L728 F779 N783 P784 K788 I789	L724-M786 HydrophobicContact CB-SD 4.23Å; L724-M786 HydrophobicContact CD2-SD 3.98Å; L724-M786 WeakPolarHBondContact O-CE 3.41Å; E727-M786 HydrophobicContact CB-CE 3.88Å; E727-M786 HydrophobicContact CB-SD 4.22Å; E727-M786 HydrophobicContact CG-CE 3.93Å; E727-M786 HydrophobicContact CG-SD 4.19Å; L728-M786 HydrophobicContact CB-CE 3.78Å; L728-M786 VanDerWaalsContact N-CE 3.34Å; F779-M786 HydrophobicContact CB-CB 4.01Å; F779-M786 HydrophobicContact CD1-CB 3.5Å; F779-M786 HydrophobicContact CD1-CG 3.69Å; F779-M786 HydrophobicContact CD2-CB 3.72Å; F779-M786 HydrophobicContact CE1-CB 3.74Å; F779-M786 HydrophobicContact CE1-CE 3.68Å; F779-M786 HydrophobicContact CE1-CG 3.69Å; F779-M786 HydrophobicContact CE2-CB 3.95Å; F779-M786 HydrophobicContact CE2-CE 4.33Å; F779-M786 HydrophobicContact CG-CB 3.49Å; F779-M786 VanDerWaalsContact CG-CB 3.49Å; F779-M786 HydrophobicContact CG-CG 4.22Å; F779-M786 HydrophobicContact CZ-CB 3.96Å; F779-M786 HydrophobicContact CZ-CE 3.53Å; F779-M786 HydrophobicContact CZ-CG 4.21Å; N783-M786 HydrophobicContact CB-CG 4.08Å; N783-M786 VanDerWaalsContact ND2-CG 3.33Å; N783-M786 WeakPolarHBondContact ND2-CG 3.42Å; N783-M786 WeakPolarHBondContact O-CB 3.34Å; N783-M786 WeakPolarHBondContact O-CG 3.45Å; N783-M786 PolarHBondContact O-N 3.37Å; N783-M786 VanDerWaalsContact O-N 3.16Å; P784-M786 PolarHBondContact O-N 3.48Å; M786-K788 VanDerWaalsContact C-N 3.3Å; M786-I789 HydrophobicContact CE-CD1 4.01Å; M786-I789 VanDerWaalsContact O-CD1 3.3Å; M786-I789 WeakPolarHBondContact O-CD1 3.43Å; M786-I789 VanDerWaalsContact O-CG1 3.29Å; M786-I789 WeakPolarHBondContact O-CG1 3.25Å; M786-I789 HydrophobicContact SD-CD1 4.3Å
787	L	93.5	Very high	93.6	Very high	20 Å²	20	51.5 Å²	51.5	11%	0.105	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-78.6	-17.4	172	-57.9	-180	0	0	0	112.2	V776 F779 K780 P784 Q785 E895	V776-L787 HydrophobicContact CG1-CD2 4.02Å; F779-L787 HydrophobicContact CB-CD2 3.89Å; F779-L787 HydrophobicContact CB-CG 4.18Å; F779-L787 HydrophobicContact CD2-CD2 4.33Å; K780-L787 HydrophobicContact CB-CD1 4Å; K780-L787 HydrophobicContact CG-CD1 4.48Å; P784-L787 PolarHBondContact O-N 2.94Å; Q785-L787 PolarHBondContact O-N 3.19Å; L787-E895 HydrophobicContact CD1-CG 4.27Å
788	K	92.4	Very high	93.6	Very high	130 Å²	130	54 Å²	54	57%	0.565	28%	0.277	S	S	*	.	G	3₁₀ helix	trans	-93.9	10.6	-178.9	-58.8	-170	177.3	-173.8	0	114.3	Q785 M786 T790 D791	Q785-K788 WeakPolarHBondContact O-CB 3.29Å; Q785-K788 PolarHBondContact O-N 3.23Å; M786-K788 VanDerWaalsContact C-N 3.3Å; K788-T790 PolarHBondContact O-N 3.18Å; K788-D791 WeakPolarHBondContact CB-OD2 3.39Å; K788-D791 VanDerWaalsContact O-CB 3.29Å; K788-D791 WeakPolarHBondContact O-CB 3.39Å; K788-D791 PolarHBondContact O-N 2.78Å
789	I	93.7	Very high	93.7	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	-55.7	-37.3	-178.4	-65.8	172.6	0	0	0	111.9	L724 I725 L728 M786 D791 T792 L793 F888	L724-I789 HydrophobicContact CB-CD1 4.02Å; L724-I789 HydrophobicContact CB-CG1 3.69Å; L724-I789 HydrophobicContact CD1-CG1 4.05Å; L724-I789 HydrophobicContact CG-CG1 4.5Å; I725-I789 HydrophobicContact CG1-CG2 4.1Å; L728-I789 HydrophobicContact CB-CD1 4.2Å; L728-I789 HydrophobicContact CD2-CD1 4.19Å; M786-I789 HydrophobicContact CE-CD1 4.01Å; M786-I789 VanDerWaalsContact O-CD1 3.3Å; M786-I789 WeakPolarHBondContact O-CD1 3.43Å; M786-I789 VanDerWaalsContact O-CG1 3.29Å; M786-I789 WeakPolarHBondContact O-CG1 3.25Å; M786-I789 HydrophobicContact SD-CD1 4.3Å; I789-D791 PolarHBondContact O-N 3.46Å; I789-T792 PolarHBondContact O-N 3.48Å; I789-T792 VanDerWaalsContact O-N 3.15Å; I789-T792 PolarHBondContact O-OG1 3.38Å; I789-L793 HydrophobicContact CG2-CD1 3.97Å; I789-F888 HydrophobicContact CB-CE1 4.04Å; I789-F888 HydrophobicContact CB-CZ 4.27Å; I789-F888 HydrophobicContact CD1-CE1 4.33Å; I789-F888 HydrophobicContact CG2-CE1 3.69Å; I789-F888 HydrophobicContact CG2-CE2 4.14Å; I789-F888 HydrophobicContact CG2-CZ 3.42Å; I789-F888 VanDerWaalsContact CG2-CZ 3.42Å
790	T	91.9	Very high	93.8	Very high	23 Å²	23	53.9 Å²	53.9	14%	0.141	28%	0.277	C	S	.	.	G	3₁₀ helix	trans	-60.5	-28.5	176.6	51.6	0	0	0	0	113.8	K788 T792 L793 F888 K892	K788-T790 PolarHBondContact O-N 3.18Å; T790-T792 PolarHBondContact O-N 3.33Å; T790-L793 CarbonylContact O-C 2.9Å; T790-L793 PolarHBondContact O-N 2.97Å; T790-F888 HydrophobicContact CG2-CB 3.63Å; T790-F888 HydrophobicContact CG2-CD1 4.49Å; T790-F888 HydrophobicContact CG2-CD2 4.41Å; T790-F888 HydrophobicContact CG2-CG 3.96Å; T790-K892 WeakPolarHBondContact OG1-CE 3.41Å; T790-K892 PolarHBondContact OG1-NZ 3.37Å
791	D	92.2	Very high	93.9	Very high	106 Å²	106	56 Å²	56	57%	0.567	29%	0.291	S	S	*	.	G	3₁₀ helix	trans	-77	-17.8	-174.1	-45.4	-6.8	0	0	0	109.6	K788 I789	K788-D791 WeakPolarHBondContact CB-OD2 3.39Å; K788-D791 VanDerWaalsContact O-CB 3.29Å; K788-D791 WeakPolarHBondContact O-CB 3.39Å; K788-D791 PolarHBondContact O-N 2.78Å; I789-D791 PolarHBondContact O-N 3.46Å
792	T	92.6	Very high	94.1	Very high	65 Å²	65	52.8 Å²	52.8	40%	0.399	27%	0.271	S	S	.	.	G	3₁₀ helix	trans	-88.9	-2.1	169.5	70	0	0	0	0	113.8	L724 I789 T790	L724-T792 HydrophobicContact CD1-CG2 4.23Å; I789-T792 PolarHBondContact O-N 3.48Å; I789-T792 VanDerWaalsContact O-N 3.15Å; I789-T792 PolarHBondContact O-OG1 3.38Å; T790-T792 PolarHBondContact O-N 3.33Å
793	L	95	Very high	94.3	Very high	5 Å²	5	52.4 Å²	52.4	3%	0.026	27%	0.274	C	S	.	.			trans	-135.2	55.6	-173.5	-62.9	171.1	0	0	0	111.5	E718 I719 I725 I789 T790 Y795 L796 F888	E718-L793 HydrophobicContact CB-CD2 3.62Å; I719-L793 HydrophobicContact CG1-CD1 4.25Å; I719-L793 HydrophobicContact CG1-CD2 3.96Å; I725-L793 HydrophobicContact CD1-CD1 3.74Å; I789-L793 HydrophobicContact CG2-CD1 3.97Å; T790-L793 CarbonylContact O-C 2.9Å; T790-L793 PolarHBondContact O-N 2.97Å; L793-Y795 VanDerWaalsContact C-N 3.31Å; L793-Y795 PolarHBondContact O-N 3.26Å; L793-L796 HydrophobicContact CB-CB 4.13Å; L793-L796 HydrophobicContact CB-CD2 4.42Å; L793-L796 HydrophobicContact CD1-CD2 4.29Å; L793-L796 VanDerWaalsContact O-CB 3.28Å; L793-L796 WeakPolarHBondContact O-CB 3.44Å; L793-L796 PolarHBondContact O-N 3.44Å; L793-L796 VanDerWaalsContact O-N 3.16Å; L793-F888 HydrophobicContact CD1-CE2 3.99Å
794	P	93	Very high	94.5	Very high	78 Å²	78	53.1 Å²	53.1	51%	0.506	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-34.5	-168.3	23.8	-34	0	0	0	113.9	L796	P794-L796 VanDerWaalsContact C-N 3.33Å; P794-L796 PolarHBondContact O-N 2.91Å
795	Y	94.8	Very high	94.6	Very high	96 Å²	96	55.5 Å²	55.5	38%	0.376	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.3	8.5	-177.8	-57.1	-74.8	0	0	0	114.1	K714 L793 K797 E798 A799	K714-Y795 HydrophobicContact CD-CD2 4.4Å; L793-Y795 VanDerWaalsContact C-N 3.31Å; L793-Y795 PolarHBondContact O-N 3.26Å; Y795-K797 VanDerWaalsContact C-N 3.29Å; Y795-K797 PolarHBondContact O-N 2.76Å; Y795-E798 VanDerWaalsContact C-OE2 3.26Å; Y795-E798 VanDerWaalsContact CA-OE2 3.32Å; Y795-E798 WeakPolarHBondContact CA-OE2 3.47Å; Y795-A799 WeakPolarHBondContact O-CB 3.29Å; Y795-A799 PolarHBondContact O-N 2.97Å
796	L	97	Very high	94.8	Very high	9 Å²	9	54.1 Å²	54.1	5%	0.047	28%	0.281	C	S	.	.	H	α-helix	trans	-62.8	-35.1	-173.8	175.8	59.5	0	0	0	112.9	T715 I719 L793 P794 S800 L881 F884 F888	T715-L796 HydrophobicContact CG2-CB 4.02Å; T715-L796 HydrophobicContact CG2-CD1 3.62Å; T715-L796 HydrophobicContact CG2-CG 4.43Å; I719-L796 HydrophobicContact CD1-CD1 3.95Å; L793-L796 HydrophobicContact CB-CB 4.13Å; L793-L796 HydrophobicContact CB-CD2 4.42Å; L793-L796 HydrophobicContact CD1-CD2 4.29Å; L793-L796 VanDerWaalsContact O-CB 3.28Å; L793-L796 WeakPolarHBondContact O-CB 3.44Å; L793-L796 PolarHBondContact O-N 3.44Å; L793-L796 VanDerWaalsContact O-N 3.16Å; P794-L796 VanDerWaalsContact C-N 3.33Å; P794-L796 PolarHBondContact O-N 2.91Å; L796-S800 WeakPolarHBondContact O-CB 3.34Å; L796-S800 PolarHBondContact O-N 3.49Å; L796-S800 PolarHBondContact O-OG 3.41Å; L796-L881 HydrophobicContact CD1-CB 4.25Å; L796-L881 HydrophobicContact CD1-CD2 4.25Å; L796-F884 HydrophobicContact CD1-CB 4.38Å; L796-F884 HydrophobicContact CD2-CB 4.26Å; L796-F888 HydrophobicContact CD2-CD2 3.61Å; L796-F888 HydrophobicContact CD2-CE2 3.94Å
797	K	95.3	Very high	94.9	Very high	90 Å²	90	54.1 Å²	54.1	39%	0.391	28%	0.281	S	S	.	.	H	α-helix	trans	-69.7	-54.1	-177.3	-177	54.9	178.4	176.4	0	110	Y795 A799 S800 D801 E889	Y795-K797 VanDerWaalsContact C-N 3.29Å; Y795-K797 PolarHBondContact O-N 2.76Å; K797-A799 VanDerWaalsContact C-N 3.33Å; K797-A799 PolarHBondContact O-N 3.13Å; K797-S800 PolarHBondContact O-N 2.91Å; K797-S800 PolarHBondContact O-OG 3.38Å; K797-D801 WeakPolarHBondContact CE-OD2 3.37Å; K797-D801 IonicContact NZ-OD1 3.97Å; K797-D801 IonicContact NZ-OD2 3.28Å; K797-D801 PolarHBondContact O-N 2.88Å; K797-D801 VanDerWaalsContact O-N 3.15Å; K797-E889 IonicContact NZ-OE1 2.66Å; K797-E889 PolarHBondContact NZ-OE1 3.44Å
798	E	95.3	Very high	95.1	Very high	99 Å²	99	56.1 Å²	56.1	46%	0.463	29%	0.292	S	S	.	.	H	α-helix	trans	-53.6	-49.5	176.9	-60.9	78.9	-179.8	0	0	110.6	Y795 S800 D801 V802	Y795-E798 VanDerWaalsContact C-OE2 3.26Å; Y795-E798 VanDerWaalsContact CA-OE2 3.32Å; Y795-E798 WeakPolarHBondContact CA-OE2 3.47Å; E798-S800 VanDerWaalsContact C-N 3.31Å; E798-S800 PolarHBondContact O-N 3.48Å; E798-D801 PolarHBondContact O-N 3.4Å; E798-V802 WeakPolarHBondContact O-CG2 3.43Å; E798-V802 PolarHBondContact O-N 2.7Å
799	A	97.2	Very high	95.3	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-66.4	-29.5	178.4	0	0	0	0	0	113.3	N711 V712 T715 Y795 K797 L881	N711-A799 HydrophobicContact CB-CB 4.32Å; V712-A799 HydrophobicContact CG2-CB 4.13Å; T715-A799 HydrophobicContact CG2-CB 4.34Å; Y795-A799 WeakPolarHBondContact O-CB 3.29Å; Y795-A799 PolarHBondContact O-N 2.97Å; K797-A799 VanDerWaalsContact C-N 3.33Å; K797-A799 PolarHBondContact O-N 3.13Å; A799-L881 HydrophobicContact CB-CD1 3.69Å
800	S	97	Very high	95.4	Very high	6 Å²	6	58.1 Å²	58.1	4%	0.042	30%	0.301	C	S	.	.	H	α-helix	trans	-75.1	-23.1	176.4	76	0	0	0	0	114.3	L796 K797 E798	L796-S800 WeakPolarHBondContact O-CB 3.34Å; L796-S800 PolarHBondContact O-N 3.49Å; L796-S800 PolarHBondContact O-OG 3.41Å; K797-S800 PolarHBondContact O-N 2.91Å; K797-S800 PolarHBondContact O-OG 3.38Å; E798-S800 VanDerWaalsContact C-N 3.31Å; E798-S800 PolarHBondContact O-N 3.48Å
801	D	96.2	Very high	95.7	Very high	101 Å²	101	57.5 Å²	57.5	54%	0.54	30%	0.297	S	S	.	.	S	Bend	trans	-93.4	-1.1	179.8	-66.6	-36.8	0	0	0	112.7	K797 E798 S803	K797-D801 WeakPolarHBondContact CE-OD2 3.37Å; K797-D801 IonicContact NZ-OD1 3.97Å; K797-D801 IonicContact NZ-OD2 3.28Å; K797-D801 PolarHBondContact O-N 2.88Å; K797-D801 VanDerWaalsContact O-N 3.15Å; E798-D801 PolarHBondContact O-N 3.4Å; D801-S803 PolarHBondContact O-N 3.18Å
802	V	96.6	Very high	95.9	Very high	18 Å²	18	56.7 Å²	56.7	11%	0.109	29%	0.292	C	S	.	.			trans	-73.1	118.7	177.3	171.6	0	0	0	0	112.5	V712 E798 L804 I807	V712-V802 HydrophobicContact CG2-CB 3.72Å; V712-V802 HydrophobicContact CG2-CG1 3.91Å; V712-V802 HydrophobicContact CG2-CG2 3.91Å; E798-V802 WeakPolarHBondContact O-CG2 3.43Å; E798-V802 PolarHBondContact O-N 2.7Å; V802-L804 HydrophobicContact CG1-CD2 4.01Å; V802-L804 PolarHBondContact O-N 3.08Å; V802-I807 HydrophobicContact CG1-CD1 3.61Å
803	S	96.1	Very high	96.1	Very high	57 Å²	57	57.2 Å²	57.2	40%	0.399	29%	0.287	S	S	.	.			trans	-83.4	104.6	167.5	-177.9	0	0	0	0	111.8	D801 D805 L806 I807	D801-S803 PolarHBondContact O-N 3.18Å; S803-D805 VanDerWaalsContact C-N 3.3Å; S803-D805 PolarHBondContact O-N 3.37Å; S803-L806 WeakPolarHBondContact O-CB 3.42Å; S803-L806 PolarHBondContact O-N 2.93Å; S803-L806 PolarHBondContact OG-N 2.89Å; S803-I807 PolarHBondContact O-N 3.28Å
804	L	95.5	Very high	96.2	Very high	27 Å²	27	57 Å²	57	14%	0.141	29%	0.286	C	S	.	.	H	α-helix	trans	-64.6	-32.7	175.2	-62.1	178.4	0	0	0	112.6	L709 V802 L806 I807 I808 L857 I877	L709-L804 HydrophobicContact CD2-CD2 4.1Å; V802-L804 HydrophobicContact CG1-CD2 4.01Å; V802-L804 PolarHBondContact O-N 3.08Å; L804-L806 VanDerWaalsContact C-N 3.34Å; L804-L806 PolarHBondContact O-N 3.47Å; L804-I807 HydrophobicContact CD2-CD1 4.44Å; L804-I807 PolarHBondContact O-N 3.15Å; L804-I808 VanDerWaalsContact O-CG1 3.27Å; L804-I808 WeakPolarHBondContact O-CG1 3.36Å; L804-I808 PolarHBondContact O-N 3.15Å; L804-L857 HydrophobicContact CD1-CD2 4.06Å; L804-L857 HydrophobicContact CD2-CD2 3.7Å; L804-I877 HydrophobicContact CD1-CG2 3.8Å
805	D	94.9	Very high	96.3	Very high	128 Å²	128	55.5 Å²	55.5	68%	0.684	27%	0.271	S	S	*	.	H	α-helix	trans	-65.5	-36.3	175	-69.5	-49.1	0	0	0	112.3	S803 I808 K809	S803-D805 VanDerWaalsContact C-N 3.3Å; S803-D805 PolarHBondContact O-N 3.37Å; D805-I808 PolarHBondContact O-N 3.4Å; D805-K809 WeakPolarHBondContact O-CB 3.33Å; D805-K809 PolarHBondContact O-N 3.37Å
806	L	96.4	Very high	96.4	Very high	78 Å²	78	54.1 Å²	54.1	41%	0.408	28%	0.275	S	S	.	.	H	α-helix	trans	-63.7	-46.1	172.3	-177.5	64.5	0	0	0	110.7	W704 S803 L804 I808 K809 E810	W704-L806 HydrophobicContact CH2-CD2 3.86Å; W704-L806 HydrophobicContact CH2-CG 4.16Å; W704-L806 HydrophobicContact CZ2-CD2 4.42Å; S803-L806 WeakPolarHBondContact O-CB 3.42Å; S803-L806 PolarHBondContact O-N 2.93Å; S803-L806 PolarHBondContact OG-N 2.89Å; L804-L806 VanDerWaalsContact C-N 3.34Å; L804-L806 PolarHBondContact O-N 3.47Å; L806-I808 PolarHBondContact O-N 2.91Å; L806-K809 WeakPolarHBondContact O-CB 3.5Å; L806-K809 PolarHBondContact O-N 2.92Å; L806-E810 HydrophobicContact CD1-CG 4.49Å; L806-E810 WeakPolarHBondContact O-CG 3.31Å; L806-E810 PolarHBondContact O-N 3.42Å
807	I	97.2	Very high	96.3	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-59	-46.9	176.2	-71.1	174.7	0	0	0	111.1	W704 I705 L709 V802 S803 L804 K809 E810 I811	W704-I807 HydrophobicContact CH2-CG1 3.8Å; W704-I807 HydrophobicContact CZ3-CG1 4.13Å; I705-I807 HydrophobicContact CG1-CG1 4.4Å; I705-I807 HydrophobicContact CG1-CG2 4.39Å; I705-I807 HydrophobicContact CG2-CG2 3.64Å; L709-I807 HydrophobicContact CD1-CG2 4.43Å; L709-I807 HydrophobicContact CD2-CD1 4.2Å; L709-I807 HydrophobicContact CD2-CG2 4.31Å; L709-I807 HydrophobicContact CG-CD1 4.34Å; L709-I807 HydrophobicContact CG-CG2 4.45Å; V802-I807 HydrophobicContact CG1-CD1 3.61Å; S803-I807 PolarHBondContact O-N 3.28Å; L804-I807 HydrophobicContact CD2-CD1 4.44Å; L804-I807 PolarHBondContact O-N 3.15Å; I807-K809 VanDerWaalsContact C-N 3.3Å; I807-K809 PolarHBondContact O-N 3Å; I807-E810 PolarHBondContact O-N 3.37Å; I807-I811 HydrophobicContact CG2-CD1 3.64Å; I807-I811 HydrophobicContact CG2-CG1 4.36Å; I807-I811 WeakPolarHBondContact O-CD1 3.36Å; I807-I811 VanDerWaalsContact O-CG1 3.26Å; I807-I811 WeakPolarHBondContact O-CG1 3.23Å; I807-I811 PolarHBondContact O-N 3.44Å
808	I	95.8	Very high	96.3	Very high	63 Å²	63	51.2 Å²	51.2	32%	0.323	26%	0.262	S	S	.	.	H	α-helix	trans	-59.2	-41.4	176.4	-69.2	163.6	0	0	0	111	L804 D805 L806 N812 M854	L804-I808 VanDerWaalsContact O-CG1 3.27Å; L804-I808 WeakPolarHBondContact O-CG1 3.36Å; L804-I808 PolarHBondContact O-N 3.15Å; D805-I808 PolarHBondContact O-N 3.4Å; L806-I808 PolarHBondContact O-N 2.91Å; I808-N812 PolarHBondContact O-N 3.36Å; I808-N812 VanDerWaalsContact O-N 3.15Å; I808-N812 PolarHBondContact O-ND2 3.16Å; I808-M854 HydrophobicContact CD1-CE 3.79Å; I808-M854 HydrophobicContact CG1-CE 3.86Å
809	K	97	Very high	96.2	Very high	145 Å²	145	50.2 Å²	50.2	63%	0.63	26%	0.257	S	S	*	.	H	α-helix	trans	-62.9	-45.3	176.7	-175.6	-176.2	177.3	-173.3	0	111.8	D805 L806 I807 N812 R813	D805-K809 WeakPolarHBondContact O-CB 3.33Å; D805-K809 PolarHBondContact O-N 3.37Å; L806-K809 WeakPolarHBondContact O-CB 3.5Å; L806-K809 PolarHBondContact O-N 2.92Å; I807-K809 VanDerWaalsContact C-N 3.3Å; I807-K809 PolarHBondContact O-N 3Å; K809-N812 PolarHBondContact O-N 3.39Å; K809-R813 PolarHBondContact O-N 3.28Å
810	E	97.3	Very high	95.9	Very high	27 Å²	27	53.2 Å²	53.2	13%	0.126	27%	0.273	C	S	.	.	H	α-helix	trans	-68.2	-41.1	-179.1	-66.5	-67.3	87.3	0	0	112.4	T701 I705 L806 I807 N812 R813 F814	T701-E810 HydrophobicContact CG2-CB 4.49Å; I705-E810 HydrophobicContact CD1-CB 3.98Å; L806-E810 HydrophobicContact CD1-CG 4.49Å; L806-E810 WeakPolarHBondContact O-CG 3.31Å; L806-E810 PolarHBondContact O-N 3.42Å; I807-E810 PolarHBondContact O-N 3.37Å; E810-N812 VanDerWaalsContact C-N 3.33Å; E810-N812 PolarHBondContact O-N 3.5Å; E810-R813 VanDerWaalsContact CD-CZ 3.46Å; E810-R813 WeakPolarHBondContact O-CB 3.43Å; E810-R813 PolarHBondContact O-N 3.38Å; E810-R813 IonicContact OE1-CZ 3.67Å; E810-R813 VanDerWaalsContact OE1-CZ 3.3Å; E810-R813 IonicContact OE1-NE 3.73Å; E810-R813 IonicContact OE1-NH1 2.6Å; E810-R813 PolarHBondContact OE1-NH1 3.4Å; E810-R813 IonicContact OE1-NH2 3.79Å; E810-R813 IonicContact OE2-CZ 3.71Å; E810-R813 IonicContact OE2-NH1 3.36Å; E810-R813 PolarHBondContact OE2-NH1 2.88Å; E810-R813 IonicContact OE2-NH2 3.44Å; E810-R813 PolarHBondContact OE2-NH2 3.32Å; E810-F814 VanDerWaalsContact O-CD2 3.29Å; E810-F814 WeakPolarHBondContact O-CD2 3.32Å; E810-F814 PolarHBondContact O-N 3.48Å
811	I	96.6	Very high	95.6	Very high	10 Å²	10	53.2 Å²	53.2	5%	0.051	27%	0.272	C	S	.	.	H	α-helix	trans	-56	-48.3	172.1	-68.2	163.3	0	0	0	110.2	I705 I807 R813 F814 K815 L847 V850 M854	I705-I811 HydrophobicContact CD1-CG1 4.3Å; I807-I811 HydrophobicContact CG2-CD1 3.64Å; I807-I811 HydrophobicContact CG2-CG1 4.36Å; I807-I811 WeakPolarHBondContact O-CD1 3.36Å; I807-I811 VanDerWaalsContact O-CG1 3.26Å; I807-I811 WeakPolarHBondContact O-CG1 3.23Å; I807-I811 PolarHBondContact O-N 3.44Å; I811-R813 PolarHBondContact O-N 3.02Å; I811-F814 PolarHBondContact O-N 3.46Å; I811-K815 VanDerWaalsContact O-CB 3.25Å; I811-K815 WeakPolarHBondContact O-CB 3.33Å; I811-K815 PolarHBondContact O-N 3.04Å; I811-L847 HydrophobicContact CG2-CD2 4.3Å; I811-V850 HydrophobicContact CD1-CG1 3.52Å; I811-V850 HydrophobicContact CG1-CG1 3.78Å; I811-M854 HydrophobicContact CD1-CG 4.45Å
812	N	96.4	Very high	95.3	Very high	89 Å²	89	51.9 Å²	51.9	48%	0.476	27%	0.268	S	S	.	.	H	α-helix	trans	-68.2	-32.6	179.1	-76.3	-66.9	0	0	0	112.9	I808 K809 E810 S816	I808-N812 PolarHBondContact O-N 3.36Å; I808-N812 VanDerWaalsContact O-N 3.15Å; I808-N812 PolarHBondContact O-ND2 3.16Å; K809-N812 PolarHBondContact O-N 3.39Å; E810-N812 VanDerWaalsContact C-N 3.33Å; E810-N812 PolarHBondContact O-N 3.5Å; N812-S816 WeakPolarHBondContact O-CB 3.4Å; N812-S816 PolarHBondContact O-N 2.95Å; N812-S816 PolarHBondContact O-OG 3.21Å
813	R	96.9	Very high	94.9	Very high	76 Å²	76	59.7 Å²	59.7	29%	0.287	30%	0.295	S	S	.	.	H	α-helix	trans	-62.7	-48.5	173	-171.1	-169.4	73.5	-160	0.3	111.5	K809 E810 I811 S816 R817	K809-R813 PolarHBondContact O-N 3.28Å; E810-R813 VanDerWaalsContact CD-CZ 3.46Å; E810-R813 WeakPolarHBondContact O-CB 3.43Å; E810-R813 PolarHBondContact O-N 3.38Å; E810-R813 IonicContact OE1-CZ 3.67Å; E810-R813 VanDerWaalsContact OE1-CZ 3.3Å; E810-R813 IonicContact OE1-NE 3.73Å; E810-R813 IonicContact OE1-NH1 2.6Å; E810-R813 PolarHBondContact OE1-NH1 3.4Å; E810-R813 IonicContact OE1-NH2 3.79Å; E810-R813 IonicContact OE2-CZ 3.71Å; E810-R813 IonicContact OE2-NH1 3.36Å; E810-R813 PolarHBondContact OE2-NH1 2.88Å; E810-R813 IonicContact OE2-NH2 3.44Å; E810-R813 PolarHBondContact OE2-NH2 3.32Å; I811-R813 PolarHBondContact O-N 3.02Å; R813-S816 PolarHBondContact O-OG 3.36Å; R813-R817 PolarHBondContact O-N 3.24Å
814	F	97.5	Very high	94.4	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-68.3	-41.7	177.7	-70.2	-56.2	0	0	0	112.2	L694 E697 F698 T701 E810 I811 S816 R817 L818 L847	L694-F814 HydrophobicContact CD1-CD1 3.69Å; L694-F814 HydrophobicContact CD1-CE1 4.12Å; E697-F814 HydrophobicContact CB-CE1 4.27Å; F698-F814 HydrophobicContact CB-CE1 4.31Å; F698-F814 HydrophobicContact CD2-CB 4.22Å; F698-F814 AromaticContact CD2-CD1 3.82Å; F698-F814 HydrophobicContact CD2-CD1 3.82Å; F698-F814 HydrophobicContact CD2-CD2 4.33Å; F698-F814 HydrophobicContact CD2-CE1 4.19Å; F698-F814 AromaticContact CD2-CG 3.89Å; F698-F814 HydrophobicContact CD2-CG 3.89Å; F698-F814 HydrophobicContact CE2-CB 4.2Å; F698-F814 HydrophobicContact CE2-CG 4.24Å; T701-F814 HydrophobicContact CG2-CE2 3.62Å; T701-F814 HydrophobicContact CG2-CZ 4.02Å; E810-F814 VanDerWaalsContact O-CD2 3.29Å; E810-F814 WeakPolarHBondContact O-CD2 3.32Å; E810-F814 PolarHBondContact O-N 3.48Å; I811-F814 PolarHBondContact O-N 3.46Å; F814-S816 VanDerWaalsContact C-N 3.3Å; F814-S816 PolarHBondContact O-N 2.94Å; F814-R817 PolarHBondContact O-N 3.43Å; F814-L818 WeakPolarHBondContact O-CB 3.41Å; F814-L818 WeakPolarHBondContact O-CG 3.47Å; F814-L818 PolarHBondContact O-N 3.18Å; F814-L847 HydrophobicContact CB-CD1 3.96Å; F814-L847 HydrophobicContact CB-CD2 4.03Å
815	K	95.8	Very high	93.8	Very high	47 Å²	47	59.5 Å²	59.5	20%	0.204	29%	0.288	C	S	.	.	H	α-helix	trans	-57.7	-41	176.9	-166.5	169.5	-166.7	167.3	0	112.4	I811 Q819 L847	I811-K815 VanDerWaalsContact O-CB 3.25Å; I811-K815 WeakPolarHBondContact O-CB 3.33Å; I811-K815 PolarHBondContact O-N 3.04Å; K815-Q819 WeakPolarHBondContact O-CB 3.45Å; K815-Q819 VanDerWaalsContact O-CG 3.24Å; K815-Q819 WeakPolarHBondContact O-CG 3.22Å; K815-Q819 PolarHBondContact O-N 2.83Å; K815-Q819 VanDerWaalsContact O-N 3.17Å; K815-L847 HydrophobicContact CB-CD1 4.31Å
816	S	95.3	Very high	93.1	Very high	66 Å²	66	55 Å²	55	46%	0.462	26%	0.264	S	S	.	.	H	α-helix	trans	-74	-40.5	176.3	51.4	0	0	0	0	113.2	N812 R813 F814 Q819 N820	N812-S816 WeakPolarHBondContact O-CB 3.4Å; N812-S816 PolarHBondContact O-N 2.95Å; N812-S816 PolarHBondContact O-OG 3.21Å; R813-S816 PolarHBondContact O-OG 3.36Å; F814-S816 VanDerWaalsContact C-N 3.3Å; F814-S816 PolarHBondContact O-N 2.94Å; S816-Q819 PolarHBondContact O-N 3.1Å; S816-N820 PolarHBondContact O-N 3.22Å
817	R	95.2	Very high	92.1	Very high	39 Å²	39	55.5 Å²	55.5	15%	0.147	27%	0.272	C	S	.	.	H	α-helix	trans	-66.7	-40.4	175.4	-74.8	-178	73.6	-162	3.7	113.1	D690 L694 E697 R813 F814 N820 M821	D690-R817 PolarHBondContact O-NH2 3.2Å; D690-R817 IonicContact OD1-CZ 2.82Å; D690-R817 IonicContact OD1-NE 2.66Å; D690-R817 PolarHBondContact OD1-NE 3.36Å; D690-R817 IonicContact OD1-NH2 3.93Å; D690-R817 PolarHBondContact OD1-NH2 2.64Å; L694-R817 HydrophobicContact CD1-CB 3.82Å; L694-R817 HydrophobicContact CD2-CB 3.9Å; L694-R817 HydrophobicContact CG-CB 4.5Å; E697-R817 IonicContact OE2-CZ 2.63Å; E697-R817 IonicContact OE2-NH1 3.69Å; E697-R817 PolarHBondContact OE2-NH1 2.89Å; E697-R817 IonicContact OE2-NH2 2.6Å; R813-R817 PolarHBondContact O-N 3.24Å; F814-R817 PolarHBondContact O-N 3.43Å; R817-N820 WeakPolarHBondContact O-CB 3.44Å; R817-N820 PolarHBondContact O-N 2.72Å; R817-N820 VanDerWaalsContact O-N 3.16Å; R817-M821 WeakPolarHBondContact O-CB 2.82Å; R817-M821 PolarHBondContact O-N 3.47Å
818	L	95.3	Very high	91.2	Very high	0 Å²	0	64.3 Å²	64.3	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-65.7	-39.9	174.2	-72	164.8	0	0	0	112	L694 F698 F814 N820 M821 T822 F839 L847	L694-L818 HydrophobicContact CD2-CD2 3.79Å; L694-L818 HydrophobicContact CD2-CG 4.06Å; L694-L818 HydrophobicContact CG-CD2 4.48Å; F698-L818 HydrophobicContact CE2-CD1 4.19Å; F814-L818 WeakPolarHBondContact O-CB 3.41Å; F814-L818 WeakPolarHBondContact O-CG 3.47Å; F814-L818 PolarHBondContact O-N 3.18Å; L818-N820 VanDerWaalsContact C-N 3.27Å; L818-N820 PolarHBondContact O-N 3.09Å; L818-M821 HydrophobicContact CD2-SD 4.19Å; L818-M821 PolarHBondContact O-N 3.32Å; L818-T822 WeakPolarHBondContact O-CB 3.35Å; L818-T822 PolarHBondContact O-N 2.85Å; L818-T822 PolarHBondContact O-OG1 2.71Å; L818-F839 HydrophobicContact CD2-CD1 4.44Å; L818-F839 HydrophobicContact CD2-CE1 3.81Å; L818-F839 HydrophobicContact CD2-CZ 4.47Å; L818-L847 HydrophobicContact CD1-CD1 3.47Å; L818-L847 VanDerWaalsContact CD1-CD1 3.47Å
819	Q	93.1	Very high	90.3	Very high	78 Å²	78	63.5 Å²	63.5	36%	0.364	31%	0.311	S	S	.	.	H	α-helix	trans	-62.5	-34.6	171.5	-77.1	179.7	18	0	0	112.4	K815 S816 R823	K815-Q819 WeakPolarHBondContact O-CB 3.45Å; K815-Q819 VanDerWaalsContact O-CG 3.24Å; K815-Q819 WeakPolarHBondContact O-CG 3.22Å; K815-Q819 PolarHBondContact O-N 2.83Å; K815-Q819 VanDerWaalsContact O-N 3.17Å; S816-Q819 PolarHBondContact O-N 3.1Å; Q819-R823 VanDerWaalsContact O-CG 3.24Å; Q819-R823 WeakPolarHBondContact O-CG 3.48Å; Q819-R823 PolarHBondContact O-N 3.36Å
820	N	91.1	Very high	89.2	Confident	62 Å²	62	57.1 Å²	57.1	33%	0.332	28%	0.284	S	S	.	.	H	α-helix	trans	-69.7	-44.2	174.1	-169.4	56.6	0	0	0	111.7	S816 R817 L818 R823 N824	S816-N820 PolarHBondContact O-N 3.22Å; R817-N820 WeakPolarHBondContact O-CB 3.44Å; R817-N820 PolarHBondContact O-N 2.72Å; R817-N820 VanDerWaalsContact O-N 3.16Å; L818-N820 VanDerWaalsContact C-N 3.27Å; L818-N820 PolarHBondContact O-N 3.09Å; N820-R823 PolarHBondContact O-N 3.07Å; N820-N824 PolarHBondContact O-N 3.46Å; N820-N824 VanDerWaalsContact O-N 3.12Å; N820-N824 PolarHBondContact O-ND2 2.81Å; N820-N824 PolarHBondContact OD1-ND2 2.79Å
821	M	91.2	Very high	87.5	Confident	6 Å²	6	57.8 Å²	57.8	3%	0.03	30%	0.297	C	S	.	.	H	α-helix	trans	-56.3	-53	173.9	179.4	-171.7	-100.3	0	0	110.6	S691 L694 R817 L818 R823 N824 F825 I836 F839 I840	S691-M821 VanDerWaalsContact CA-CE 3.47Å; S691-M821 VanDerWaalsContact CB-CE 3.46Å; S691-M821 WeakPolarHBondContact OG-CE 3.5Å; L694-M821 HydrophobicContact CB-CE 4.16Å; L694-M821 HydrophobicContact CD2-CB 4.33Å; L694-M821 HydrophobicContact CD2-CE 3.75Å; L694-M821 HydrophobicContact CD2-SD 4.05Å; L694-M821 HydrophobicContact CG-CE 4.31Å; R817-M821 WeakPolarHBondContact O-CB 2.82Å; R817-M821 PolarHBondContact O-N 3.47Å; L818-M821 HydrophobicContact CD2-SD 4.19Å; L818-M821 PolarHBondContact O-N 3.32Å; M821-R823 PolarHBondContact O-N 3.4Å; M821-N824 PolarHBondContact O-N 3.41Å; M821-N824 VanDerWaalsContact O-N 3.11Å; M821-F825 VanDerWaalsContact O-CB 3.3Å; M821-F825 WeakPolarHBondContact O-CB 3.39Å; M821-F825 PolarHBondContact O-N 2.93Å; M821-I836 HydrophobicContact SD-CG2 4.39Å; M821-F839 HydrophobicContact CE-CD1 3.95Å; M821-F839 HydrophobicContact CE-CE1 3.78Å; M821-F839 HydrophobicContact SD-CD1 3.88Å; M821-F839 HydrophobicContact SD-CE1 3.94Å; M821-I840 HydrophobicContact CG-CD1 3.89Å; M821-I840 HydrophobicContact CG-CG1 4.05Å; M821-I840 HydrophobicContact SD-CD1 3.87Å; M821-I840 HydrophobicContact SD-CG1 3.39Å; M821-I840 WeakPolarHBondContact SD-CG1 3.36Å
822	T	90.1	Very high	85.5	Confident	73 Å²	73	67.3 Å²	67.3	45%	0.448	34%	0.342	S	S	.	.	H	α-helix	trans	-59.1	-31	-179.9	-47.3	0	0	0	0	113.3	L818 I840	L818-T822 WeakPolarHBondContact O-CB 3.35Å; L818-T822 PolarHBondContact O-N 2.85Å; L818-T822 PolarHBondContact O-OG1 2.71Å; T822-I840 WeakPolarHBondContact OG1-CG2 3.48Å
823	R	88.2	Confident	83.8	Confident	182 Å²	182	64 Å²	64	69%	0.687	32%	0.324	S	S	*	.	H	α-helix	trans	-80.5	-29.7	177.4	-73.1	172.6	-163.7	155.3	10.1	114	Q819 N820 M821	Q819-R823 VanDerWaalsContact O-CG 3.24Å; Q819-R823 WeakPolarHBondContact O-CG 3.48Å; Q819-R823 PolarHBondContact O-N 3.36Å; N820-R823 PolarHBondContact O-N 3.07Å; M821-R823 PolarHBondContact O-N 3.4Å
824	N	84.8	Confident	82.2	Confident	40 Å²	40	64.2 Å²	64.2	21%	0.214	34%	0.336	C	S	.	.	H	α-helix	trans	-97.8	-16.2	-176	-65.9	-60.3	0	0	0	112.8	K684 H687 N820 M821	K684-N824 PolarHBondContact NZ-O 2.98Å; H687-N824 HydrophobicContact CB-CB 4.49Å; H687-N824 VanDerWaalsContact CE1-CG 3.42Å; N820-N824 PolarHBondContact O-N 3.46Å; N820-N824 VanDerWaalsContact O-N 3.12Å; N820-N824 PolarHBondContact O-ND2 2.81Å; N820-N824 PolarHBondContact OD1-ND2 2.79Å; M821-N824 PolarHBondContact O-N 3.41Å; M821-N824 VanDerWaalsContact O-N 3.11Å
825	F	83.4	Confident	81.4	Confident	40 Å²	40	71.9 Å²	71.9	18%	0.175	37%	0.37	C	S	.	.			trans	-63	135.4	169.6	-178.2	-95.2	0	0	0	111.2	M821 P827 F830 Q833 I836 C837	M821-F825 VanDerWaalsContact O-CB 3.3Å; M821-F825 WeakPolarHBondContact O-CB 3.39Å; M821-F825 PolarHBondContact O-N 2.93Å; F825-P827 HydrophobicContact CE1-CG 4.17Å; F825-F830 HydrophobicContact CD2-CG 4.45Å; F825-F830 HydrophobicContact CE2-CB 4.45Å; F825-Q833 HydrophobicContact CE2-CB 3.95Å; F825-Q833 HydrophobicContact CZ-CB 4.07Å; F825-I836 HydrophobicContact CD2-CB 4.41Å; F825-I836 HydrophobicContact CD2-CG2 3.74Å; F825-I836 HydrophobicContact CE2-CB 3.93Å; F825-I836 HydrophobicContact CE2-CG2 3.77Å; F825-C837 VanDerWaalsContact CZ-SG 3.54Å
826	D	80.5	Confident	80.8	Confident	35 Å²	35	69.8 Å²	69.8	19%	0.187	36%	0.361	C	S	.	.			trans	-142.3	145.4	160	69.6	91.2	0	0	0	108.5	K684 E828 T829 F830	K684-D826 WeakPolarHBondContact CE-OD2 3.49Å; K684-D826 IonicContact NZ-OD2 3.31Å; K684-D826 PolarHBondContact NZ-OD2 2.76Å; D826-E828 PolarHBondContact O-N 2.73Å; D826-E828 PolarHBondContact OD1-N 2.87Å; D826-T829 VanDerWaalsContact CG-OG1 3.24Å; D826-T829 WeakPolarHBondContact OD1-CB 3.33Å; D826-T829 PolarHBondContact OD1-N 3.32Å; D826-T829 PolarHBondContact OD1-OG1 2.65Å; D826-T829 VanDerWaalsContact OD2-CB 3.29Å; D826-T829 WeakPolarHBondContact OD2-CB 3.48Å; D826-T829 PolarHBondContact OD2-OG1 3.41Å; D826-T829 VanDerWaalsContact OD2-OG1 3.05Å; D826-F830 WeakPolarHBondContact O-CB 3.43Å; D826-F830 WeakPolarHBondContact O-CD2 3.41Å
827	P	76.3	Confident	80.4	Confident	87 Å²	87	68.9 Å²	68.9	57%	0.565	35%	0.354	S	S	*	.	H	α-helix	trans	-64.1	-36.9	-175.6	-24.3	35.1	0	0	0	113.9	F825 G831	F825-P827 HydrophobicContact CE1-CG 4.17Å; P827-G831 PolarHBondContact O-N 3.16Å
828	E	76.6	Confident	80.1	Confident	185 Å²	185	71.8 Å²	71.8	86%	0.864	37%	0.369	S	S	*	.	H	α-helix	trans	-67.8	-46.1	-171	-60.1	178.8	179.9	0	0	112.4	D826 F830	D826-E828 PolarHBondContact O-N 2.73Å; D826-E828 PolarHBondContact OD1-N 2.87Å; E828-F830 VanDerWaalsContact C-N 3.3Å; E828-F830 PolarHBondContact O-N 2.84Å
829	T	77.1	Confident	79.9	Confident	47 Å²	47	73.1 Å²	73.1	29%	0.288	38%	0.375	S	S	.	.	H	α-helix	trans	-75.6	-20.7	-176.8	-53.1	0	0	0	0	112.8	P683 K684 K688 D826	P683-T829 HydrophobicContact CB-CG2 3.33Å; P683-T829 HydrophobicContact CG-CG2 4.48Å; K684-T829 HydrophobicContact CB-CG2 4.37Å; K684-T829 HydrophobicContact CD-CG2 3.98Å; K684-T829 HydrophobicContact CG-CG2 4.07Å; K688-T829 PolarHBondContact NZ-O 2.66Å; D826-T829 VanDerWaalsContact CG-OG1 3.24Å; D826-T829 WeakPolarHBondContact OD1-CB 3.33Å; D826-T829 PolarHBondContact OD1-N 3.32Å; D826-T829 PolarHBondContact OD1-OG1 2.65Å; D826-T829 VanDerWaalsContact OD2-CB 3.29Å; D826-T829 WeakPolarHBondContact OD2-CB 3.48Å; D826-T829 PolarHBondContact OD2-OG1 3.41Å; D826-T829 VanDerWaalsContact OD2-OG1 3.05Å
830	F	74.2	Confident	79.9	Confident	11 Å²	11	70.1 Å²	70.1	5%	0.048	36%	0.361	C	S	.	.	H	α-helix	trans	-105.8	-23.2	-173.2	-78.4	-102.3	0	0	0	113.2	K684 H687 K688 F825 D826 E828 Q833	K684-F830 HydrophobicContact CB-CE2 4.33Å; K684-F830 HydrophobicContact CB-CZ 4.32Å; K684-F830 HydrophobicContact CD-CD2 4.45Å; K684-F830 HydrophobicContact CD-CE2 3.56Å; K684-F830 HydrophobicContact CD-CZ 4.17Å; H687-F830 HydrophobicContact CB-CZ 4.21Å; K688-F830 HydrophobicContact CG-CD1 4.15Å; K688-F830 HydrophobicContact CG-CE1 3.81Å; F825-F830 HydrophobicContact CD2-CG 4.45Å; F825-F830 HydrophobicContact CE2-CB 4.45Å; D826-F830 WeakPolarHBondContact O-CB 3.43Å; D826-F830 WeakPolarHBondContact O-CD2 3.41Å; E828-F830 VanDerWaalsContact C-N 3.3Å; E828-F830 PolarHBondContact O-N 2.84Å; F830-Q833 HydrophobicContact CB-CG 3.94Å; F830-Q833 VanDerWaalsContact O-CG 3.29Å; F830-Q833 WeakPolarHBondContact O-CG 3.41Å; F830-Q833 PolarHBondContact O-NE2 2.83Å
831	G	62.8	Low	79.9	Confident	40 Å²	40	73.9 Å²	73.9	41%	0.412	38%	0.377	S	S	.	.			trans	96.8	-158.6	175.3	0	0	0	0	0	114.4	P827 Q833	P827-G831 PolarHBondContact O-N 3.16Å; G831-Q833 VanDerWaalsContact C-N 3.3Å; G831-Q833 WeakPolarHBondContact O-CB 3.24Å; G831-Q833 WeakPolarHBondContact O-CG 3.24Å; G831-Q833 PolarHBondContact O-N 3.25Å
832	E	54.8	Low	80.2	Confident	210 Å²	210	77.7 Å²	77.7	98%	0.981	39%	0.394	S	S	*	.	S	Bend	trans	-67.3	83.1	177.6	-68.4	-171.5	137	0	0	111.6
833	Q	58.7	Low	80.5	Confident	21 Å²	21	74.2 Å²	74.2	10%	0.098	37%	0.373	C	S	.	.			trans	-114	41.5	-162.9	-70.7	-130.5	-15.2	0	0	115.5	C633 F825 F830 G831 K835 I836 C837	C633-Q833 PolarHBondContact SG-NE2 3.03Å; F825-Q833 HydrophobicContact CE2-CB 3.95Å; F825-Q833 HydrophobicContact CZ-CB 4.07Å; F830-Q833 HydrophobicContact CB-CG 3.94Å; F830-Q833 VanDerWaalsContact O-CG 3.29Å; F830-Q833 WeakPolarHBondContact O-CG 3.41Å; F830-Q833 PolarHBondContact O-NE2 2.83Å; G831-Q833 VanDerWaalsContact C-N 3.3Å; G831-Q833 WeakPolarHBondContact O-CB 3.24Å; G831-Q833 WeakPolarHBondContact O-CG 3.24Å; G831-Q833 PolarHBondContact O-N 3.25Å; Q833-K835 PolarHBondContact O-N 3.33Å; Q833-I836 PolarHBondContact O-N 3.01Å; Q833-C837 PolarHBondContact O-N 2.97Å
834	S	64.4	Low	80.9	Confident	79 Å²	79	67.9 Å²	67.9	55%	0.552	35%	0.353	S	S	*	.	H	α-helix	trans	-45.9	-45.8	164.5	-160.3	0	0	0	0	110.7	I836 C837 E838	S834-I836 VanDerWaalsContact C-N 3.31Å; S834-I836 PolarHBondContact O-N 2.91Å; S834-I836 VanDerWaalsContact O-N 3.14Å; S834-C837 PolarHBondContact O-N 3.24Å; S834-E838 VanDerWaalsContact C-CD 3.46Å; S834-E838 WeakPolarHBondContact CB-OE1 3.41Å; S834-E838 VanDerWaalsContact O-CB 3.32Å; S834-E838 WeakPolarHBondContact O-CB 3.4Å; S834-E838 VanDerWaalsContact O-CD 3.31Å; S834-E838 WeakPolarHBondContact O-CG 3.31Å; S834-E838 PolarHBondContact O-N 3.17Å; S834-E838 PolarHBondContact OG-OE1 3.02Å
835	K	80.5	Confident	81.4	Confident	162 Å²	162	71.7 Å²	71.7	70%	0.704	37%	0.368	S	S	*	.	H	α-helix	trans	-61.5	-20.5	-179.9	-63.7	-177.3	-179.6	178.4	0	116.8	Q833 F839	Q833-K835 PolarHBondContact O-N 3.33Å; K835-F839 WeakPolarHBondContact O-CB 3.44Å
836	I	84.2	Confident	82.1	Confident	3 Å²	3	70.2 Å²	70.2	2%	0.015	36%	0.361	C	S	.	.	H	α-helix	trans	-93.5	-37.5	173.4	-64.9	-151.7	0	0	0	110.9	C633 M821 F825 Q833 S834 F839 I840	C633-I836 HydrophobicContact CB-CD1 3.7Å; M821-I836 HydrophobicContact SD-CG2 4.39Å; F825-I836 HydrophobicContact CD2-CB 4.41Å; F825-I836 HydrophobicContact CD2-CG2 3.74Å; F825-I836 HydrophobicContact CE2-CB 3.93Å; F825-I836 HydrophobicContact CE2-CG2 3.77Å; Q833-I836 PolarHBondContact O-N 3.01Å; S834-I836 VanDerWaalsContact C-N 3.31Å; S834-I836 PolarHBondContact O-N 2.91Å; S834-I836 VanDerWaalsContact O-N 3.14Å; I836-F839 PolarHBondContact O-N 3.03Å; I836-I840 HydrophobicContact CG2-CD1 3.87Å; I836-I840 HydrophobicContact CG2-CG1 4.34Å; I836-I840 VanDerWaalsContact O-CG1 3.26Å; I836-I840 WeakPolarHBondContact O-CG1 3.44Å; I836-I840 PolarHBondContact O-N 2.97Å
837	C	86	Confident	82.9	Confident	46 Å²	46	68.8 Å²	68.8	31%	0.311	35%	0.354	S	S	.	.	H	α-helix	trans	-58.9	-50.5	169.6	-63.9	0	0	0	0	111.1	F825 Q833 S834 F839 I840 E841	F825-C837 VanDerWaalsContact CZ-SG 3.54Å; Q833-C837 PolarHBondContact O-N 2.97Å; S834-C837 PolarHBondContact O-N 3.24Å; C837-F839 VanDerWaalsContact C-N 3.31Å; C837-F839 PolarHBondContact O-N 3.42Å; C837-I840 PolarHBondContact O-N 3.43Å; C837-I840 VanDerWaalsContact O-N 3.12Å; C837-E841 WeakPolarHBondContact O-CB 3.36Å; C837-E841 WeakPolarHBondContact O-CG 3.4Å; C837-E841 PolarHBondContact O-N 3.43Å
838	E	88.6	Confident	83.9	Confident	100 Å²	100	68.9 Å²	68.9	47%	0.467	35%	0.349	S	S	.	.	H	α-helix	trans	-50.6	-48.3	173.1	-73.7	158	-146.6	0	0	111.9	S834 E841 Q842	S834-E838 VanDerWaalsContact C-CD 3.46Å; S834-E838 WeakPolarHBondContact CB-OE1 3.41Å; S834-E838 VanDerWaalsContact O-CB 3.32Å; S834-E838 WeakPolarHBondContact O-CB 3.4Å; S834-E838 VanDerWaalsContact O-CD 3.31Å; S834-E838 WeakPolarHBondContact O-CG 3.31Å; S834-E838 PolarHBondContact O-N 3.17Å; S834-E838 PolarHBondContact OG-OE1 3.02Å; E838-E841 PolarHBondContact O-N 2.78Å; E838-Q842 WeakPolarHBondContact O-CB 3.35Å; E838-Q842 PolarHBondContact O-N 3.34Å
839	F	91.7	Very high	84.9	Confident	28 Å²	28	64.1 Å²	64.1	12%	0.123	33%	0.33	C	S	.	.	H	α-helix	trans	-63.8	-45.7	177.9	174	-99.1	0	0	0	112	L694 K695 F698 L818 M821 K835 I836 C837 E841 S843	L694-F839 HydrophobicContact CD2-CE1 4.36Å; L694-F839 HydrophobicContact CG-CE1 4.13Å; L694-F839 HydrophobicContact CG-CZ 4.27Å; K695-F839 HydrophobicContact CB-CE2 4.21Å; K695-F839 HydrophobicContact CB-CZ 4.27Å; K695-F839 HydrophobicContact CG-CD1 3.77Å; K695-F839 HydrophobicContact CG-CD2 3.83Å; K695-F839 HydrophobicContact CG-CE1 3.78Å; K695-F839 HydrophobicContact CG-CE2 3.83Å; K695-F839 HydrophobicContact CG-CG 3.8Å; K695-F839 HydrophobicContact CG-CZ 3.81Å; F698-F839 HydrophobicContact CB-CE2 4.06Å; F698-F839 HydrophobicContact CB-CZ 3.86Å; F698-F839 HydrophobicContact CD1-CE2 4.37Å; F698-F839 HydrophobicContact CG-CE2 4.35Å; F698-F839 HydrophobicContact CG-CZ 4.22Å; L818-F839 HydrophobicContact CD2-CD1 4.44Å; L818-F839 HydrophobicContact CD2-CE1 3.81Å; L818-F839 HydrophobicContact CD2-CZ 4.47Å; M821-F839 HydrophobicContact CE-CD1 3.95Å; M821-F839 HydrophobicContact CE-CE1 3.78Å; M821-F839 HydrophobicContact SD-CD1 3.88Å; M821-F839 HydrophobicContact SD-CE1 3.94Å; K835-F839 WeakPolarHBondContact O-CB 3.44Å; I836-F839 PolarHBondContact O-N 3.03Å; C837-F839 VanDerWaalsContact C-N 3.31Å; C837-F839 PolarHBondContact O-N 3.42Å; F839-E841 PolarHBondContact O-N 3.16Å; F839-S843 VanDerWaalsContact CE2-OG 3.25Å; F839-S843 WeakPolarHBondContact CE2-OG 3.29Å; F839-S843 WeakPolarHBondContact CZ-OG 3.33Å; F839-S843 WeakPolarHBondContact O-CB 3.42Å; F839-S843 PolarHBondContact O-N 3.01Å; F839-S843 PolarHBondContact O-OG 2.76Å
840	I	92.1	Very high	85.8	Confident	15 Å²	15	61.9 Å²	61.9	8%	0.077	32%	0.316	C	S	.	.	H	α-helix	trans	-59.7	-47.5	177.5	-70.5	165.6	0	0	0	110.3	M821 T822 I836 C837 N844	M821-I840 HydrophobicContact CG-CD1 3.89Å; M821-I840 HydrophobicContact CG-CG1 4.05Å; M821-I840 HydrophobicContact SD-CD1 3.87Å; M821-I840 HydrophobicContact SD-CG1 3.39Å; M821-I840 WeakPolarHBondContact SD-CG1 3.36Å; T822-I840 WeakPolarHBondContact OG1-CG2 3.48Å; I836-I840 HydrophobicContact CG2-CD1 3.87Å; I836-I840 HydrophobicContact CG2-CG1 4.34Å; I836-I840 VanDerWaalsContact O-CG1 3.26Å; I836-I840 WeakPolarHBondContact O-CG1 3.44Å; I836-I840 PolarHBondContact O-N 2.97Å; C837-I840 PolarHBondContact O-N 3.43Å; C837-I840 VanDerWaalsContact O-N 3.12Å; I840-N844 WeakPolarHBondContact O-CB 3.31Å; I840-N844 PolarHBondContact O-N 3.31Å; I840-N844 PolarHBondContact O-ND2 3.29Å
841	E	92.7	Very high	86.9	Confident	141 Å²	141	64.4 Å²	64.4	66%	0.659	33%	0.328	S	S	*	.	H	α-helix	trans	-65.7	-50.4	-178.2	-71.6	176.4	-168.3	0	0	111.7	C837 E838 F839 N844 K845	C837-E841 WeakPolarHBondContact O-CB 3.36Å; C837-E841 WeakPolarHBondContact O-CG 3.4Å; C837-E841 PolarHBondContact O-N 3.43Å; E838-E841 PolarHBondContact O-N 2.78Å; F839-E841 PolarHBondContact O-N 3.16Å; E841-N844 PolarHBondContact O-N 3.28Å; E841-K845 WeakPolarHBondContact O-CB 3.5Å; E841-K845 PolarHBondContact O-N 3.5Å
842	Q	95.7	Very high	88.5	Confident	86 Å²	86	65.5 Å²	65.5	40%	0.402	33%	0.327	S	S	.	.	H	α-helix	trans	-63.6	-43.3	178.8	177.5	57.3	23.6	0	0	111.8	E838 N844 K845 E846	E838-Q842 WeakPolarHBondContact O-CB 3.35Å; E838-Q842 PolarHBondContact O-N 3.34Å; Q842-N844 PolarHBondContact O-N 3.24Å; Q842-K845 WeakPolarHBondContact O-CB 3.28Å; Q842-K845 PolarHBondContact O-N 3.01Å; Q842-E846 WeakPolarHBondContact CG-OE1 3.29Å; Q842-E846 PolarHBondContact NE2-OE1 3.4Å; Q842-E846 WeakPolarHBondContact O-CG 3.42Å; Q842-E846 PolarHBondContact O-N 2.92Å
843	S	96.9	Very high	90.5	Very high	1 Å²	1	57.7 Å²	57.7	1%	0.007	29%	0.29	C	S	.	.	H	α-helix	trans	-68	-34.2	176.7	-72.6	0	0	0	0	113.3	F698 F839 L847	F698-S843 WeakPolarHBondContact CD1-OG 3.33Å; F698-S843 WeakPolarHBondContact CE1-OG 3.49Å; F698-S843 WeakPolarHBondContact CG-OG 3.47Å; F698-S843 VanDerWaalsContact CZ-CB 3.46Å; F698-S843 WeakPolarHBondContact CZ-O 3.2Å; F839-S843 VanDerWaalsContact CE2-OG 3.25Å; F839-S843 WeakPolarHBondContact CE2-OG 3.29Å; F839-S843 WeakPolarHBondContact CZ-OG 3.33Å; F839-S843 WeakPolarHBondContact O-CB 3.42Å; F839-S843 PolarHBondContact O-N 3.01Å; F839-S843 PolarHBondContact O-OG 2.76Å; S843-L847 WeakPolarHBondContact O-CB 3.21Å; S843-L847 WeakPolarHBondContact O-CG 3.49Å; S843-L847 PolarHBondContact O-N 2.95Å
844	N	96	Very high	92.3	Very high	49 Å²	49	57.5 Å²	57.5	26%	0.262	29%	0.29	S	S	.	.	H	α-helix	trans	-67.8	-39	171.9	-83.4	-71.9	0	0	0	111.7	I840 E841 Q842 L847 N848	I840-N844 WeakPolarHBondContact O-CB 3.31Å; I840-N844 PolarHBondContact O-N 3.31Å; I840-N844 PolarHBondContact O-ND2 3.29Å; E841-N844 PolarHBondContact O-N 3.28Å; Q842-N844 PolarHBondContact O-N 3.24Å; N844-L847 PolarHBondContact O-N 2.83Å; N844-N848 VanDerWaalsContact O-CG 3.24Å; N844-N848 PolarHBondContact O-N 2.9Å; N844-N848 PolarHBondContact O-ND2 3.29Å; N844-N848 VanDerWaalsContact O-ND2 3.11Å
845	K	97.1	Very high	93.7	Very high	120 Å²	120	57.4 Å²	57.4	52%	0.522	28%	0.28	S	S	.	.	H	α-helix	trans	-59.1	-52.6	173.1	179.7	-176.5	173.2	-173	0	111.2	E841 Q842 L847 N848 D849	E841-K845 WeakPolarHBondContact O-CB 3.5Å; E841-K845 PolarHBondContact O-N 3.5Å; Q842-K845 WeakPolarHBondContact O-CB 3.28Å; Q842-K845 PolarHBondContact O-N 3.01Å; K845-L847 VanDerWaalsContact C-N 3.3Å; K845-L847 PolarHBondContact O-N 3.3Å; K845-N848 WeakPolarHBondContact O-CA 3.44Å; K845-N848 WeakPolarHBondContact O-CB 3.31Å; K845-N848 PolarHBondContact O-N 2.89Å; K845-D849 PolarHBondContact O-N 3.06Å
846	E	98.1	Very high	94.5	Very high	8 Å²	8	55.3 Å²	55.3	4%	0.037	27%	0.271	C	S	.	.	H	α-helix	trans	-63.1	-33.2	-179.8	-69.8	-175.9	-124.7	0	0	113.4	F698 Q699 I702 K706 Q842 V850	F698-E846 HydrophobicContact CE1-CB 4.19Å; F698-E846 HydrophobicContact CZ-CB 4.08Å; Q699-E846 PolarHBondContact NE2-OE1 3.45Å; I702-E846 HydrophobicContact CG1-CB 4.21Å; I702-E846 WeakPolarHBondContact CG2-OE2 3.4Å; K706-E846 IonicContact NZ-OE2 3.84Å; K706-E846 PolarHBondContact NZ-OE2 3.23Å; Q842-E846 WeakPolarHBondContact CG-OE1 3.29Å; Q842-E846 PolarHBondContact NE2-OE1 3.4Å; Q842-E846 WeakPolarHBondContact O-CG 3.42Å; Q842-E846 PolarHBondContact O-N 2.92Å; E846-V850 WeakPolarHBondContact O-CB 3.29Å; E846-V850 WeakPolarHBondContact O-CG2 3.21Å; E846-V850 PolarHBondContact O-N 3.45Å
847	L	97.3	Very high	95.1	Very high	6 Å²	6	55.3 Å²	55.3	3%	0.031	27%	0.271	C	S	.	.	H	α-helix	trans	-68.6	-35.3	171.5	-77.4	175.7	0	0	0	112.9	F698 I702 I811 F814 K815 L818 S843 N844 K845 Q851	F698-L847 HydrophobicContact CE2-CD1 4.22Å; F698-L847 HydrophobicContact CE2-CD2 4.21Å; F698-L847 HydrophobicContact CE2-CG 3.89Å; F698-L847 HydrophobicContact CZ-CG 4.17Å; I702-L847 HydrophobicContact CD1-CD2 3.75Å; I702-L847 HydrophobicContact CD1-CG 4.46Å; I811-L847 HydrophobicContact CG2-CD2 4.3Å; F814-L847 HydrophobicContact CB-CD1 3.96Å; F814-L847 HydrophobicContact CB-CD2 4.03Å; K815-L847 HydrophobicContact CB-CD1 4.31Å; L818-L847 HydrophobicContact CD1-CD1 3.47Å; L818-L847 VanDerWaalsContact CD1-CD1 3.47Å; S843-L847 WeakPolarHBondContact O-CB 3.21Å; S843-L847 WeakPolarHBondContact O-CG 3.49Å; S843-L847 PolarHBondContact O-N 2.95Å; N844-L847 PolarHBondContact O-N 2.83Å; K845-L847 VanDerWaalsContact C-N 3.3Å; K845-L847 PolarHBondContact O-N 3.3Å; L847-Q851 WeakPolarHBondContact O-CB 3.32Å; L847-Q851 PolarHBondContact O-N 2.98Å
848	N	96.4	Very high	95.5	Very high	89 Å²	89	56.7 Å²	56.7	48%	0.476	27%	0.273	S	S	.	.	H	α-helix	trans	-68.2	-44.4	174.8	-68.7	-33.7	0	0	0	110.6	N844 K845 V850 Q851 T852	N844-N848 VanDerWaalsContact O-CG 3.24Å; N844-N848 PolarHBondContact O-N 2.9Å; N844-N848 PolarHBondContact O-ND2 3.29Å; N844-N848 VanDerWaalsContact O-ND2 3.11Å; K845-N848 WeakPolarHBondContact O-CA 3.44Å; K845-N848 WeakPolarHBondContact O-CB 3.31Å; K845-N848 PolarHBondContact O-N 2.89Å; N848-V850 VanDerWaalsContact C-N 3.33Å; N848-V850 PolarHBondContact O-N 3.01Å; N848-Q851 PolarHBondContact O-N 2.92Å; N848-Q851 VanDerWaalsContact O-N 3.11Å; N848-T852 PolarHBondContact O-N 3.31Å; N848-T852 PolarHBondContact O-OG1 3.47Å
849	D	96.8	Very high	95.8	Very high	85 Å²	85	57.5 Å²	57.5	46%	0.455	28%	0.277	S	S	.	.	H	α-helix	trans	-55.8	-47.8	175.5	-64.7	-32	0	0	0	111.2	K845 T852 Q853	K845-D849 PolarHBondContact O-N 3.06Å; D849-T852 PolarHBondContact O-N 3.33Å; D849-Q853 PolarHBondContact O-N 3.43Å
850	V	97.6	Very high	96	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-65	-37.6	175.4	160.8	0	0	0	0	112.5	I702 I705 K706 L709 I811 E846 N848 T852 Q853 M854	I702-V850 HydrophobicContact CD1-CB 4.35Å; I702-V850 HydrophobicContact CD1-CG2 3.88Å; I702-V850 HydrophobicContact CG1-CG2 4.25Å; I705-V850 HydrophobicContact CG2-CG1 3.49Å; I705-V850 VanDerWaalsContact CG2-CG1 3.49Å; I705-V850 HydrophobicContact CG2-CG2 4.25Å; K706-V850 HydrophobicContact CG-CG2 3.59Å; L709-V850 HydrophobicContact CD1-CG1 4Å; I811-V850 HydrophobicContact CD1-CG1 3.52Å; I811-V850 HydrophobicContact CG1-CG1 3.78Å; E846-V850 WeakPolarHBondContact O-CB 3.29Å; E846-V850 WeakPolarHBondContact O-CG2 3.21Å; E846-V850 PolarHBondContact O-N 3.45Å; N848-V850 VanDerWaalsContact C-N 3.33Å; N848-V850 PolarHBondContact O-N 3.01Å; V850-T852 VanDerWaalsContact C-N 3.33Å; V850-Q853 WeakPolarHBondContact O-CB 3.42Å; V850-Q853 PolarHBondContact O-N 2.94Å; V850-M854 PolarHBondContact O-N 3.15Å
851	Q	96.2	Very high	96.2	Very high	64 Å²	64	57.3 Å²	57.3	30%	0.299	28%	0.276	S	S	.	.	H	α-helix	trans	-66.4	-37.9	175.6	-156.5	-170	-73.8	0	0	111.1	L847 N848 M854 E855	L847-Q851 WeakPolarHBondContact O-CB 3.32Å; L847-Q851 PolarHBondContact O-N 2.98Å; N848-Q851 PolarHBondContact O-N 2.92Å; N848-Q851 VanDerWaalsContact O-N 3.11Å; Q851-M854 WeakPolarHBondContact O-CB 3.41Å; Q851-M854 PolarHBondContact O-N 3.45Å; Q851-E855 PolarHBondContact NE2-OE1 3.32Å; Q851-E855 WeakPolarHBondContact O-CG 3.19Å; Q851-E855 PolarHBondContact O-N 3.36Å
852	T	96.6	Very high	96.3	Very high	63 Å²	63	53.5 Å²	53.5	39%	0.387	26%	0.263	S	S	.	.	H	α-helix	trans	-69.1	-33.6	173.4	-66.1	0	0	0	0	112.7	N848 D849 V850 E855 K856	N848-T852 PolarHBondContact O-N 3.31Å; N848-T852 PolarHBondContact O-OG1 3.47Å; D849-T852 PolarHBondContact O-N 3.33Å; V850-T852 VanDerWaalsContact C-N 3.33Å; T852-E855 PolarHBondContact O-N 2.84Å; T852-K856 WeakPolarHBondContact O-CG 3.12Å; T852-K856 PolarHBondContact O-N 3.22Å
853	Q	96.5	Very high	96.2	Very high	46 Å²	46	54.4 Å²	54.4	22%	0.215	27%	0.266	C	S	.	.	H	α-helix	trans	-60.3	-45.5	167.5	-74.2	178.9	-36.4	0	0	111.1	L709 M713 D849 V850 E855 K856 L857	L709-Q853 HydrophobicContact CD1-CB 3.97Å; M713-Q853 HydrophobicContact SD-CB 4.42Å; D849-Q853 PolarHBondContact O-N 3.43Å; V850-Q853 WeakPolarHBondContact O-CB 3.42Å; V850-Q853 PolarHBondContact O-N 2.94Å; Q853-E855 VanDerWaalsContact C-N 3.31Å; Q853-E855 PolarHBondContact O-N 3.34Å; Q853-K856 PolarHBondContact O-N 2.96Å; Q853-L857 WeakPolarHBondContact O-CB 3.3Å; Q853-L857 PolarHBondContact O-N 3.3Å
854	M	96	Very high	96.1	Very high	17 Å²	17	54.4 Å²	54.4	8%	0.084	27%	0.265	C	S	.	.	H	α-helix	trans	-61.9	-34.9	176	-106.8	-64.8	-63.9	0	0	113.4	L709 I808 I811 V850 Q851 L857 Q858	L709-M854 HydrophobicContact CD1-CG 4.15Å; L709-M854 HydrophobicContact CD2-CG 4.02Å; L709-M854 HydrophobicContact CD2-SD 4.13Å; I808-M854 HydrophobicContact CD1-CE 3.79Å; I808-M854 HydrophobicContact CG1-CE 3.86Å; I811-M854 HydrophobicContact CD1-CG 4.45Å; V850-M854 PolarHBondContact O-N 3.15Å; Q851-M854 WeakPolarHBondContact O-CB 3.41Å; Q851-M854 PolarHBondContact O-N 3.45Å; M854-L857 PolarHBondContact O-N 2.85Å; M854-L857 HydrophobicContact SD-CD2 4.29Å; M854-Q858 HydrophobicContact CE-CG 4.42Å; M854-Q858 VanDerWaalsContact CE-NE2 3.32Å; M854-Q858 WeakPolarHBondContact O-CG 3.39Å; M854-Q858 PolarHBondContact O-N 3.39Å
855	E	95.6	Very high	96.1	Very high	76 Å²	76	52.1 Å²	52.1	36%	0.355	25%	0.253	S	S	.	.	H	α-helix	trans	-69.5	-42.2	174.7	-73.6	167.3	174.5	0	0	111.7	Q851 T852 Q853 L857 Q858 E859	Q851-E855 PolarHBondContact NE2-OE1 3.32Å; Q851-E855 WeakPolarHBondContact O-CG 3.19Å; Q851-E855 PolarHBondContact O-N 3.36Å; T852-E855 PolarHBondContact O-N 2.84Å; Q853-E855 VanDerWaalsContact C-N 3.31Å; Q853-E855 PolarHBondContact O-N 3.34Å; E855-L857 VanDerWaalsContact C-N 3.33Å; E855-L857 PolarHBondContact O-N 3.5Å; E855-Q858 PolarHBondContact O-N 3.14Å; E855-E859 PolarHBondContact O-N 3.33Å; E855-E859 VanDerWaalsContact O-N 3.12Å
856	K	96.8	Very high	95.8	Very high	118 Å²	118	52 Å²	52	51%	0.513	25%	0.254	S	S	.	.	H	α-helix	trans	-61.3	-39.1	171.5	-70.1	169.6	-179.4	175.8	0	112.3	M713 T852 Q853 Q858 E859 L860	M713-K856 HydrophobicContact CE-CB 3.78Å; M713-K856 HydrophobicContact CE-CD 4.4Å; M713-K856 HydrophobicContact SD-CB 4.41Å; T852-K856 WeakPolarHBondContact O-CG 3.12Å; T852-K856 PolarHBondContact O-N 3.22Å; Q853-K856 PolarHBondContact O-N 2.96Å; K856-Q858 VanDerWaalsContact C-N 3.33Å; K856-Q858 PolarHBondContact O-N 2.84Å; K856-E859 PolarHBondContact O-N 2.94Å; K856-L860 PolarHBondContact O-N 2.97Å
857	L	96.5	Very high	95.6	Very high	3 Å²	3	53.8 Å²	53.8	2%	0.016	26%	0.261	C	S	.	.	H	α-helix	trans	-65.5	-35.2	175.6	-179.7	57.7	0	0	0	112	L709 V712 M713 L804 Q853 M854 E855 L860 E861 I877	L709-L857 HydrophobicContact CD2-CD2 3.83Å; V712-L857 HydrophobicContact CG1-CD1 3.76Å; V712-L857 HydrophobicContact CG1-CD2 3.94Å; M713-L857 HydrophobicContact CG-CB 3.98Å; M713-L857 HydrophobicContact CG-CD1 3.84Å; M713-L857 HydrophobicContact CG-CG 4.38Å; M713-L857 HydrophobicContact SD-CB 4.29Å; L804-L857 HydrophobicContact CD1-CD2 4.06Å; L804-L857 HydrophobicContact CD2-CD2 3.7Å; Q853-L857 WeakPolarHBondContact O-CB 3.3Å; Q853-L857 PolarHBondContact O-N 3.3Å; M854-L857 PolarHBondContact O-N 2.85Å; M854-L857 HydrophobicContact SD-CD2 4.29Å; E855-L857 VanDerWaalsContact C-N 3.33Å; E855-L857 PolarHBondContact O-N 3.5Å; L857-L860 HydrophobicContact CD1-CD2 4.5Å; L857-L860 WeakPolarHBondContact O-CB 3.46Å; L857-L860 PolarHBondContact O-N 3.38Å; L857-E861 PolarHBondContact O-N 2.66Å; L857-I877 HydrophobicContact CD1-CG2 4.07Å; L857-I877 HydrophobicContact CG-CG2 4.47Å
858	Q	94.8	Very high	95.5	Very high	75 Å²	75	53.6 Å²	53.6	35%	0.35	26%	0.26	S	S	.	.	H	α-helix	trans	-68.1	-35.9	173.6	-73.5	175.6	10.1	0	0	112.7	M854 E855 K856 L860 V862	M854-Q858 HydrophobicContact CE-CG 4.42Å; M854-Q858 VanDerWaalsContact CE-NE2 3.32Å; M854-Q858 WeakPolarHBondContact O-CG 3.39Å; M854-Q858 PolarHBondContact O-N 3.39Å; E855-Q858 PolarHBondContact O-N 3.14Å; K856-Q858 VanDerWaalsContact C-N 3.33Å; K856-Q858 PolarHBondContact O-N 2.84Å; Q858-L860 VanDerWaalsContact C-N 3.31Å; Q858-V862 WeakPolarHBondContact O-CG2 3.41Å; Q858-V862 PolarHBondContact O-N 3.34Å
859	E	95.2	Very high	95.3	Very high	118 Å²	118	51 Å²	51	55%	0.551	25%	0.249	S	C	*	.	H	α-helix	trans	-64	-38	169.5	-67.8	-172.7	-172.4	0	0	112.1	E855 K856 V862 K863	E855-E859 PolarHBondContact O-N 3.33Å; E855-E859 VanDerWaalsContact O-N 3.12Å; K856-E859 PolarHBondContact O-N 2.94Å; E859-V862 PolarHBondContact O-N 2.91Å; E859-K863 VanDerWaalsContact O-CG 3.32Å; E859-K863 WeakPolarHBondContact O-CG 3.38Å; E859-K863 PolarHBondContact O-N 2.89Å; E859-K863 IonicContact OE2-NZ 3.59Å; E859-K863 PolarHBondContact OE2-NZ 3.34Å
860	L	95.6	Very high	95.1	Very high	10 Å²	10	48.4 Å²	48.4	5%	0.052	23%	0.234	C	C	.	.	H	α-helix	trans	-68.5	-40.9	177.6	-166.6	60.5	0	0	0	111.7	M713 L720 K856 L857 Q858 V862 K863 C864	M713-L860 HydrophobicContact CB-CD2 4.39Å; M713-L860 WeakPolarHBondContact O-CD2 3.29Å; L720-L860 HydrophobicContact CD1-CD1 3.67Å; K856-L860 PolarHBondContact O-N 2.97Å; L857-L860 HydrophobicContact CD1-CD2 4.5Å; L857-L860 WeakPolarHBondContact O-CB 3.46Å; L857-L860 PolarHBondContact O-N 3.38Å; Q858-L860 VanDerWaalsContact C-N 3.31Å; L860-V862 VanDerWaalsContact C-N 3.27Å; L860-V862 PolarHBondContact O-N 3.25Å; L860-K863 HydrophobicContact CD1-CD 4.47Å; L860-K863 PolarHBondContact O-N 3.38Å; L860-K863 VanDerWaalsContact O-N 3.12Å; L860-C864 WeakPolarHBondContact O-CB 3.33Å; L860-C864 PolarHBondContact O-N 2.94Å; L860-C864 PolarHBondContact O-SG 3.46Å
861	E	96.1	Very high	94.7	Very high	28 Å²	28	50.5 Å²	50.5	13%	0.131	25%	0.248	C	C	.	.	H	α-helix	trans	-55.2	-42.8	171.5	-179.1	164.7	102.8	0	0	111.2	L857 A865 F875 R876 I877	L857-E861 PolarHBondContact O-N 2.66Å; E861-A865 WeakPolarHBondContact O-CB 3.49Å; E861-A865 PolarHBondContact O-N 2.88Å; E861-F875 HydrophobicContact CG-CD1 3.77Å; E861-F875 HydrophobicContact CG-CE1 4.05Å; E861-F875 WeakPolarHBondContact O-CD1 3.4Å; E861-F875 WeakPolarHBondContact O-CE1 3.21Å; E861-R876 IonicContact OE1-NH1 2.68Å; E861-R876 PolarHBondContact OE1-NH1 2.93Å; E861-R876 WeakPolarHBondContact OE2-CA 3.44Å; E861-I877 HydrophobicContact CB-CB 4.19Å; E861-I877 HydrophobicContact CB-CG2 4.49Å; E861-I877 HydrophobicContact CG-CB 4.25Å; E861-I877 PolarHBondContact OE2-N 2.93Å
862	V	94.5	Very high	94.4	Very high	62 Å²	62	50.6 Å²	50.6	38%	0.376	25%	0.254	S	S	.	.	H	α-helix	trans	-68.9	-38.1	176.1	173.1	0	0	0	0	112.6	Q858 E859 L860 Q866	Q858-V862 WeakPolarHBondContact O-CG2 3.41Å; Q858-V862 PolarHBondContact O-N 3.34Å; E859-V862 PolarHBondContact O-N 2.91Å; L860-V862 VanDerWaalsContact C-N 3.27Å; L860-V862 PolarHBondContact O-N 3.25Å; V862-Q866 VanDerWaalsContact CG1-NE2 3.34Å; V862-Q866 VanDerWaalsContact O-CG 3.32Å; V862-Q866 WeakPolarHBondContact O-CG 3.46Å; V862-Q866 PolarHBondContact O-N 3.11Å; V862-Q866 VanDerWaalsContact O-N 3.13Å
863	K	93.9	Very high	94.1	Very high	105 Å²	105	51.4 Å²	51.4	46%	0.457	26%	0.259	S	S	.	.	H	α-helix	trans	-64.4	-45.5	174.8	-71.7	161.4	-173.1	159.8	0	111.1	L720 E859 L860 Q866 Y867	L720-K863 HydrophobicContact CD1-CB 4.43Å; E859-K863 VanDerWaalsContact O-CG 3.32Å; E859-K863 WeakPolarHBondContact O-CG 3.38Å; E859-K863 PolarHBondContact O-N 2.89Å; E859-K863 IonicContact OE2-NZ 3.59Å; E859-K863 PolarHBondContact OE2-NZ 3.34Å; L860-K863 HydrophobicContact CD1-CD 4.47Å; L860-K863 PolarHBondContact O-N 3.38Å; L860-K863 VanDerWaalsContact O-N 3.12Å; K863-Q866 PolarHBondContact O-N 2.72Å; K863-Y867 WeakPolarHBondContact O-CB 3.2Å; K863-Y867 PolarHBondContact O-N 3.28Å
864	C	95.2	Very high	93.8	Very high	1 Å²	1	55.9 Å²	55.9	1%	0.007	28%	0.28	C	S	.	.	H	α-helix	trans	-61	-46.1	175.1	-67.3	0	0	0	0	112.3	L860 Q866 Y867 F868 F875 I877	L860-C864 WeakPolarHBondContact O-CB 3.33Å; L860-C864 PolarHBondContact O-N 2.94Å; L860-C864 PolarHBondContact O-SG 3.46Å; C864-Q866 VanDerWaalsContact C-N 3.3Å; C864-Q866 PolarHBondContact O-N 3.41Å; C864-Y867 PolarHBondContact O-N 2.69Å; C864-F868 HydrophobicContact CB-CD2 4.39Å; C864-F868 HydrophobicContact CB-CE2 4.46Å; C864-F868 VanDerWaalsContact O-CD2 3.24Å; C864-F868 WeakPolarHBondContact O-CD2 3.46Å; C864-F868 PolarHBondContact O-N 2.78Å; C864-F875 HydrophobicContact CB-CE1 3.58Å; C864-F875 HydrophobicContact CB-CZ 3.55Å; C864-I877 HydrophobicContact CB-CD1 3.86Å; C864-I877 VanDerWaalsContact SG-CD1 3.58Å
865	A	94.6	Very high	93.7	Very high	0 Å²	0	56 Å²	56	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-56.1	-44.4	175.6	0	0	0	0	0	112	E861 C869 E870 P872 F875	E861-A865 WeakPolarHBondContact O-CB 3.49Å; E861-A865 PolarHBondContact O-N 2.88Å; A865-C869 CarbonylContact O-C 3.59Å; A865-C869 WeakPolarHBondContact O-CA 3.21Å; A865-C869 PolarHBondContact O-N 3.12Å; A865-C869 VanDerWaalsContact O-N 3.12Å; A865-E870 PolarHBondContact O-N 3.1Å; A865-P872 HydrophobicContact CB-CB 3.96Å; A865-P872 HydrophobicContact CB-CG 3.9Å; A865-F875 HydrophobicContact CB-CB 3.77Å; A865-F875 HydrophobicContact CB-CD1 3.71Å; A865-F875 HydrophobicContact CB-CD2 4.43Å; A865-F875 HydrophobicContact CB-CE1 4.43Å; A865-F875 HydrophobicContact CB-CG 3.71Å
866	Q	92.3	Very high	93.7	Very high	118 Å²	118	58.5 Å²	58.5	55%	0.551	29%	0.286	S	S	*	.	H	α-helix	trans	-67	-46.3	177.6	-69.5	173.8	26.2	0	0	112.4	V862 K863 C864 F868 C869	V862-Q866 VanDerWaalsContact CG1-NE2 3.34Å; V862-Q866 VanDerWaalsContact O-CG 3.32Å; V862-Q866 WeakPolarHBondContact O-CG 3.46Å; V862-Q866 PolarHBondContact O-N 3.11Å; V862-Q866 VanDerWaalsContact O-N 3.13Å; K863-Q866 PolarHBondContact O-N 2.72Å; C864-Q866 VanDerWaalsContact C-N 3.3Å; C864-Q866 PolarHBondContact O-N 3.41Å; Q866-F868 PolarHBondContact O-N 2.78Å; Q866-C869 PolarHBondContact O-N 3.31Å; Q866-C869 VanDerWaalsContact O-N 3.12Å
867	Y	93.8	Very high	93.7	Very high	46 Å²	46	53 Å²	53	18%	0.18	26%	0.262	C	S	.	.	H	α-helix	trans	-63	-42.5	-177.3	-179.8	-103.1	0	0	0	112.9	N470 V471 L720 K863 C864 C869	N470-Y867 WeakPolarHBondContact CB-O 3.23Å; V471-Y867 HydrophobicContact CB-CD1 4.09Å; V471-Y867 HydrophobicContact CB-CE1 3.61Å; V471-Y867 HydrophobicContact CB-CE2 4.13Å; V471-Y867 HydrophobicContact CG2-CE1 3.78Å; V471-Y867 PolarHBondContact N-O 3.19Å; L720-Y867 HydrophobicContact CD2-CD1 3.45Å; L720-Y867 VanDerWaalsContact CD2-CD1 3.45Å; L720-Y867 HydrophobicContact CD2-CD2 4.37Å; L720-Y867 HydrophobicContact CD2-CE1 4.17Å; L720-Y867 HydrophobicContact CD2-CG 3.56Å; K863-Y867 WeakPolarHBondContact O-CB 3.2Å; K863-Y867 PolarHBondContact O-N 3.28Å; C864-Y867 PolarHBondContact O-N 2.69Å; Y867-C869 VanDerWaalsContact C-N 3.3Å
868	F	93.9	Very high	93.6	Very high	1 Å²	1	54 Å²	54	0%	0.004	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-2.9	176	-63	-62.1	0	0	0	113.7	V471 W472 I719 L720 L729 L753 C864 Q866 E870 F884	V471-F868 HydrophobicContact CG1-CD1 4.17Å; W472-F868 PolarHBondContact NE1-O 3.16Å; I719-F868 HydrophobicContact CG2-CE2 4.08Å; I719-F868 HydrophobicContact CG2-CZ 3.67Å; L720-F868 HydrophobicContact CD2-CE2 4.34Å; L729-F868 HydrophobicContact CD1-CD1 4.18Å; L729-F868 HydrophobicContact CD1-CE1 3.81Å; L753-F868 HydrophobicContact CD1-CB 3.98Å; L753-F868 HydrophobicContact CD1-CD1 4.12Å; L753-F868 HydrophobicContact CD1-CD2 3.9Å; L753-F868 HydrophobicContact CD1-CE2 4.47Å; L753-F868 HydrophobicContact CD1-CG 3.73Å; L753-F868 HydrophobicContact CD2-CD1 3.88Å; L753-F868 HydrophobicContact CD2-CE1 4.35Å; L753-F868 HydrophobicContact CD2-CG 4.29Å; L753-F868 HydrophobicContact CG-CB 4.21Å; L753-F868 HydrophobicContact CG-CD1 4.33Å; L753-F868 HydrophobicContact CG-CG 4.23Å; C864-F868 HydrophobicContact CB-CD2 4.39Å; C864-F868 HydrophobicContact CB-CE2 4.46Å; C864-F868 VanDerWaalsContact O-CD2 3.24Å; C864-F868 WeakPolarHBondContact O-CD2 3.46Å; C864-F868 PolarHBondContact O-N 2.78Å; Q866-F868 PolarHBondContact O-N 2.78Å; F868-E870 VanDerWaalsContact C-N 3.3Å; F868-E870 HydrophobicContact CB-CG 4.43Å; F868-E870 PolarHBondContact O-N 2.98Å; F868-F884 HydrophobicContact CE1-CZ 4.25Å; F868-F884 HydrophobicContact CZ-CE2 4.18Å; F868-F884 HydrophobicContact CZ-CZ 4.24Å
869	C	92.9	Very high	93.6	Very high	35 Å²	35	56 Å²	56	24%	0.236	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	58.8	35.5	-174.8	-62.1	0	0	0	0	114.2	V463 N470 A865 Q866 Y867	V463-C869 HydrophobicContact CG1-CB 3.6Å; N470-C869 VanDerWaalsContact CB-SG 3.51Å; N470-C869 VanDerWaalsContact CG-SG 3.54Å; A865-C869 CarbonylContact O-C 3.59Å; A865-C869 WeakPolarHBondContact O-CA 3.21Å; A865-C869 PolarHBondContact O-N 3.12Å; A865-C869 VanDerWaalsContact O-N 3.12Å; Q866-C869 PolarHBondContact O-N 3.31Å; Q866-C869 VanDerWaalsContact O-N 3.12Å; Y867-C869 VanDerWaalsContact C-N 3.3Å
870	E	92.5	Very high	93.7	Very high	31 Å²	31	50.7 Å²	50.7	15%	0.145	26%	0.256	C	S	.	.			trans	-88.6	166.1	169.7	-71.4	-68.3	179.1	0	0	111.6	K752 L753 A865 F868 P872 F875	K752-E870 VanDerWaalsContact CA-OE1 3.3Å; K752-E870 WeakPolarHBondContact CA-OE1 3.25Å; K752-E870 WeakPolarHBondContact CB-OE1 3.28Å; K752-E870 VanDerWaalsContact CG-OE1 3.29Å; K752-E870 WeakPolarHBondContact CG-OE1 3.49Å; K752-E870 IonicContact NZ-OE2 2.72Å; K752-E870 PolarHBondContact NZ-OE2 3.48Å; L753-E870 PolarHBondContact N-OE1 3.25Å; A865-E870 PolarHBondContact O-N 3.1Å; F868-E870 VanDerWaalsContact C-N 3.3Å; F868-E870 HydrophobicContact CB-CG 4.43Å; F868-E870 PolarHBondContact O-N 2.98Å; E870-P872 VanDerWaalsContact O-CD 3.27Å; E870-P872 WeakPolarHBondContact O-CD 3.32Å; E870-F875 HydrophobicContact CB-CB 4.18Å; E870-F875 HydrophobicContact CB-CD2 3.65Å; E870-F875 HydrophobicContact CB-CE2 4.49Å; E870-F875 HydrophobicContact CB-CG 4.26Å; E870-F875 HydrophobicContact CG-CD2 4.01Å
871	C	89.4	Confident	93.8	Very high	44 Å²	44	50.2 Å²	50.2	30%	0.297	25%	0.254	S	S	.	.			trans	-79.3	115.7	-176.1	-178.9	0	0	0	0	111.4	T873 Q874 F875	C871-T873 PolarHBondContact O-N 3Å; C871-Q874 HydrophobicContact CB-CB 4.2Å; C871-Q874 HydrophobicContact CB-CG 4.49Å; C871-Q874 PolarHBondContact O-N 2.91Å; C871-F875 WeakPolarHBondContact O-CB 3.38Å; C871-F875 PolarHBondContact O-N 3.42Å
872	P	89.7	Confident	93.8	Very high	66 Å²	66	53.3 Å²	53.3	43%	0.429	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-0.6	-172.7	-21.3	34.3	0	0	0	116.4	A865 E870	A865-P872 HydrophobicContact CB-CB 3.96Å; A865-P872 HydrophobicContact CB-CG 3.9Å; E870-P872 VanDerWaalsContact O-CD 3.27Å; E870-P872 WeakPolarHBondContact O-CD 3.32Å
873	T	90	Very high	93.9	Very high	80 Å²	80	51.6 Å²	51.6	49%	0.491	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.4	2.5	171.8	62	0	0	0	0	113.2	T270 C871	T270-T873 HydrophobicContact CG2-CG2 4.33Å; C871-T873 PolarHBondContact O-N 3Å
874	Q	91.2	Very high	94.1	Very high	140 Å²	140	46.6 Å²	46.6	65%	0.654	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-129.9	-29.4	179	-66.4	177.7	-38.7	0	0	112.2	C871	C871-Q874 HydrophobicContact CB-CB 4.2Å; C871-Q874 HydrophobicContact CB-CG 4.49Å; C871-Q874 PolarHBondContact O-N 2.91Å
875	F	94.2	Very high	94.2	Very high	18 Å²	18	46.9 Å²	46.9	8%	0.079	24%	0.238	C	C	.	.			trans	-60.5	135.7	175.1	178.4	-92	0	0	0	111	E861 C864 A865 E870 C871 I877 C880	E861-F875 HydrophobicContact CG-CD1 3.77Å; E861-F875 HydrophobicContact CG-CE1 4.05Å; E861-F875 WeakPolarHBondContact O-CD1 3.4Å; E861-F875 WeakPolarHBondContact O-CE1 3.21Å; C864-F875 HydrophobicContact CB-CE1 3.58Å; C864-F875 HydrophobicContact CB-CZ 3.55Å; A865-F875 HydrophobicContact CB-CB 3.77Å; A865-F875 HydrophobicContact CB-CD1 3.71Å; A865-F875 HydrophobicContact CB-CD2 4.43Å; A865-F875 HydrophobicContact CB-CE1 4.43Å; A865-F875 HydrophobicContact CB-CG 3.71Å; E870-F875 HydrophobicContact CB-CB 4.18Å; E870-F875 HydrophobicContact CB-CD2 3.65Å; E870-F875 HydrophobicContact CB-CE2 4.49Å; E870-F875 HydrophobicContact CB-CG 4.26Å; E870-F875 HydrophobicContact CG-CD2 4.01Å; C871-F875 WeakPolarHBondContact O-CB 3.38Å; C871-F875 PolarHBondContact O-N 3.42Å; F875-I877 HydrophobicContact CE1-CB 4.41Å; F875-I877 HydrophobicContact CE1-CD1 4.07Å; F875-I877 HydrophobicContact CZ-CD1 4.12Å; F875-C880 HydrophobicContact CE2-CB 3.7Å; F875-C880 HydrophobicContact CZ-CB 3.53Å
876	R	95.3	Very high	94.4	Very high	130 Å²	130	50.1 Å²	50.1	49%	0.491	26%	0.255	S	S	.	.			trans	-124.5	134.3	172.2	-67.1	-55.7	-171.8	-163.7	4.6	110.2	E861 E879 C880	E861-R876 IonicContact OE1-NH1 2.68Å; E861-R876 PolarHBondContact OE1-NH1 2.93Å; E861-R876 WeakPolarHBondContact OE2-CA 3.44Å; R876-E879 HydrophobicContact CB-CB 4.03Å; R876-E879 HydrophobicContact CB-CG 3.81Å; R876-E879 HydrophobicContact CG-CG 4.48Å; R876-E879 WeakPolarHBondContact CG-OE1 3.48Å; R876-E879 PolarHBondContact O-N 3.48Å; R876-C880 PolarHBondContact O-N 3.5Å
877	I	96.4	Very high	94.6	Very high	2 Å²	2	44.5 Å²	44.5	1%	0.01	23%	0.229	C	C	.	.	H	α-helix	trans	-67.4	-40.1	-177.5	-165.9	59.4	0	0	0	111.6	V712 S716 L804 L857 E861 C864 F875 E879 C880 L881	V712-I877 HydrophobicContact CG1-CG2 4.24Å; S716-I877 WeakPolarHBondContact OG-CD1 3.45Å; S716-I877 WeakPolarHBondContact OG-CG1 3.39Å; L804-I877 HydrophobicContact CD1-CG2 3.8Å; L857-I877 HydrophobicContact CD1-CG2 4.07Å; L857-I877 HydrophobicContact CG-CG2 4.47Å; E861-I877 HydrophobicContact CB-CB 4.19Å; E861-I877 HydrophobicContact CB-CG2 4.49Å; E861-I877 HydrophobicContact CG-CB 4.25Å; E861-I877 PolarHBondContact OE2-N 2.93Å; C864-I877 HydrophobicContact CB-CD1 3.86Å; C864-I877 VanDerWaalsContact SG-CD1 3.58Å; F875-I877 HydrophobicContact CE1-CB 4.41Å; F875-I877 HydrophobicContact CE1-CD1 4.07Å; F875-I877 HydrophobicContact CZ-CD1 4.12Å; I877-E879 PolarHBondContact O-N 2.88Å; I877-C880 HydrophobicContact CD1-CB 4.48Å; I877-C880 VanDerWaalsContact O-CB 3.27Å; I877-C880 WeakPolarHBondContact O-CB 3.43Å; I877-C880 PolarHBondContact O-N 2.88Å; I877-C880 VanDerWaalsContact O-N 3.15Å; I877-L881 WeakPolarHBondContact O-CG 3.32Å; I877-L881 PolarHBondContact O-N 3.23Å
878	A	93.7	Very high	94.8	Very high	24 Å²	24	42.6 Å²	42.6	20%	0.198	22%	0.221	C	C	.	.	H	α-helix	trans	-60.7	-44.1	175.1	0	0	0	0	0	112.7	C880 L881 Q882	A878-C880 VanDerWaalsContact C-N 3.28Å; A878-C880 PolarHBondContact O-N 3.25Å; A878-L881 PolarHBondContact O-N 2.81Å; A878-Q882 WeakPolarHBondContact O-CB 3.49Å; A878-Q882 PolarHBondContact O-N 3.49Å
879	E	95.3	Very high	94.9	Very high	117 Å²	117	46.5 Å²	46.5	55%	0.547	24%	0.24	S	C	.	.	H	α-helix	trans	-64	-33.1	175.5	-65.1	174.4	-151.2	0	0	112.2	R876 I877 T883	R876-E879 HydrophobicContact CB-CB 4.03Å; R876-E879 HydrophobicContact CB-CG 3.81Å; R876-E879 HydrophobicContact CG-CG 4.48Å; R876-E879 WeakPolarHBondContact CG-OE1 3.48Å; R876-E879 PolarHBondContact O-N 3.48Å; I877-E879 PolarHBondContact O-N 2.88Å; E879-T883 WeakPolarHBondContact O-CB 3.35Å; E879-T883 PolarHBondContact O-N 3.46Å; E879-T883 PolarHBondContact O-OG1 2.88Å
880	C	96.7	Very high	95.1	Very high	6 Å²	6	48.4 Å²	48.4	4%	0.041	24%	0.244	C	C	.	.	H	α-helix	trans	-65.5	-49.1	173.2	-171.7	0	0	0	0	111.3	L753 F875 R876 I877 A878 Q882 T883 F884	L753-C880 VanDerWaalsContact CD1-SG 3.52Å; F875-C880 HydrophobicContact CE2-CB 3.7Å; F875-C880 HydrophobicContact CZ-CB 3.53Å; R876-C880 PolarHBondContact O-N 3.5Å; I877-C880 HydrophobicContact CD1-CB 4.48Å; I877-C880 VanDerWaalsContact O-CB 3.27Å; I877-C880 WeakPolarHBondContact O-CB 3.43Å; I877-C880 PolarHBondContact O-N 2.88Å; I877-C880 VanDerWaalsContact O-N 3.15Å; A878-C880 VanDerWaalsContact C-N 3.28Å; A878-C880 PolarHBondContact O-N 3.25Å; C880-Q882 PolarHBondContact O-N 2.83Å; C880-T883 WeakPolarHBondContact O-CB 3.3Å; C880-T883 PolarHBondContact O-N 2.88Å; C880-F884 WeakPolarHBondContact O-CD2 3.28Å; C880-F884 PolarHBondContact O-N 2.89Å
881	L	97.5	Very high	95.3	Very high	1 Å²	1	47.1 Å²	47.1	1%	0.005	24%	0.238	C	C	.	.	H	α-helix	trans	-61	-43.6	176.6	-62.1	-171.1	0	0	0	111.4	V712 T715 I719 L796 A799 I877 A878 T883 F884 S885	V712-L881 HydrophobicContact CB-CD1 4.49Å; V712-L881 HydrophobicContact CG1-CD1 4.06Å; V712-L881 HydrophobicContact CG2-CD1 4.44Å; T715-L881 HydrophobicContact CG2-CD1 4.47Å; T715-L881 HydrophobicContact CG2-CD2 3.86Å; I719-L881 HydrophobicContact CD1-CD2 3.52Å; L796-L881 HydrophobicContact CD1-CB 4.25Å; L796-L881 HydrophobicContact CD1-CD2 4.25Å; A799-L881 HydrophobicContact CB-CD1 3.69Å; I877-L881 WeakPolarHBondContact O-CG 3.32Å; I877-L881 PolarHBondContact O-N 3.23Å; A878-L881 PolarHBondContact O-N 2.81Å; L881-T883 VanDerWaalsContact C-N 3.34Å; L881-T883 PolarHBondContact O-N 3.4Å; L881-F884 PolarHBondContact O-N 2.95Å; L881-S885 PolarHBondContact O-N 2.74Å
882	Q	97.3	Very high	95.6	Very high	93 Å²	93	49.6 Å²	49.6	44%	0.435	24%	0.244	S	C	.	.	H	α-helix	trans	-62.4	-38.2	174.9	-170.4	178.3	69.5	0	0	112.4	A878 C880 F884 S885 L886	A878-Q882 WeakPolarHBondContact O-CB 3.49Å; A878-Q882 PolarHBondContact O-N 3.49Å; C880-Q882 PolarHBondContact O-N 2.83Å; Q882-F884 PolarHBondContact O-N 3.28Å; Q882-S885 PolarHBondContact O-N 3.29Å; Q882-L886 HydrophobicContact CG-CD1 3.9Å; Q882-L886 HydrophobicContact CG-CG 4.28Å; Q882-L886 WeakPolarHBondContact O-CB 3.42Å; Q882-L886 VanDerWaalsContact O-CG 3.27Å; Q882-L886 WeakPolarHBondContact O-CG 3.29Å; Q882-L886 PolarHBondContact O-N 2.8Å
883	T	97.1	Very high	95.9	Very high	25 Å²	25	49.5 Å²	49.5	15%	0.153	24%	0.244	C	C	.	.	H	α-helix	trans	-62.4	-41.9	174.7	-60.9	0	0	0	0	111.6	L753 L757 E879 C880 L881 F887	L753-T883 HydrophobicContact CB-CG2 4.45Å; L757-T883 HydrophobicContact CD1-CG2 4.46Å; L757-T883 HydrophobicContact CG-CG2 4.4Å; E879-T883 WeakPolarHBondContact O-CB 3.35Å; E879-T883 PolarHBondContact O-N 3.46Å; E879-T883 PolarHBondContact O-OG1 2.88Å; C880-T883 WeakPolarHBondContact O-CB 3.3Å; C880-T883 PolarHBondContact O-N 2.88Å; L881-T883 VanDerWaalsContact C-N 3.34Å; L881-T883 PolarHBondContact O-N 3.4Å; T883-F887 VanDerWaalsContact O-CB 3.31Å; T883-F887 WeakPolarHBondContact O-CB 3.5Å; T883-F887 PolarHBondContact O-N 3.19Å; T883-F887 VanDerWaalsContact O-N 3.09Å
884	F	97.7	Very high	96.3	Very high	0 Å²	0	46 Å²	46	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-69.6	-44.7	175	-80.4	-71	0	0	0	112.4	I719 I725 L753 L756 L796 F868 C880 L881 Q882 L886 F887 F888	I719-F884 HydrophobicContact CD1-CB 4.33Å; I719-F884 HydrophobicContact CD1-CD2 3.95Å; I719-F884 HydrophobicContact CD1-CG 4.24Å; I719-F884 HydrophobicContact CG2-CD2 4.19Å; I719-F884 HydrophobicContact CG2-CE2 3.77Å; I719-F884 HydrophobicContact CG2-CZ 4.27Å; I725-F884 HydrophobicContact CD1-CD1 4.49Å; I725-F884 HydrophobicContact CD1-CE1 4.31Å; I725-F884 HydrophobicContact CG2-CE1 4.04Å; I725-F884 HydrophobicContact CG2-CZ 4.04Å; L753-F884 HydrophobicContact CD1-CE2 4.13Å; L753-F884 HydrophobicContact CD2-CE2 4.36Å; L753-F884 HydrophobicContact CD2-CZ 3.98Å; L756-F884 HydrophobicContact CD1-CD1 4.48Å; L756-F884 HydrophobicContact CD1-CE1 4.11Å; L796-F884 HydrophobicContact CD1-CB 4.38Å; L796-F884 HydrophobicContact CD2-CB 4.26Å; F868-F884 HydrophobicContact CE1-CZ 4.25Å; F868-F884 HydrophobicContact CZ-CE2 4.18Å; F868-F884 HydrophobicContact CZ-CZ 4.24Å; C880-F884 WeakPolarHBondContact O-CD2 3.28Å; C880-F884 PolarHBondContact O-N 2.89Å; L881-F884 PolarHBondContact O-N 2.95Å; Q882-F884 PolarHBondContact O-N 3.28Å; F884-L886 PolarHBondContact O-N 2.89Å; F884-F887 PolarHBondContact O-N 3.18Å; F884-F888 HydrophobicContact CB-CD2 4.38Å; F884-F888 HydrophobicContact CB-CE2 4.04Å; F884-F888 AromaticContact CD1-CE2 3.92Å; F884-F888 HydrophobicContact CD1-CE2 3.92Å; F884-F888 HydrophobicContact CD1-CZ 4.07Å; F884-F888 HydrophobicContact CG-CE2 4.41Å; F884-F888 WeakPolarHBondContact O-CD2 3.46Å; F884-F888 PolarHBondContact O-N 3.37Å
885	S	97.5	Very high	96.5	Very high	8 Å²	8	41.3 Å²	41.3	6%	0.056	20%	0.201	C	C	.	.	H	α-helix	trans	-57.1	-52.5	176.8	-168	0	0	0	0	111.2	L881 Q882 F887 F888 E889	L881-S885 PolarHBondContact O-N 2.74Å; Q882-S885 PolarHBondContact O-N 3.29Å; S885-F887 VanDerWaalsContact C-N 3.27Å; S885-F887 PolarHBondContact O-N 3.22Å; S885-F888 PolarHBondContact O-N 3.5Å; S885-E889 WeakPolarHBondContact O-CB 3.46Å; S885-E889 VanDerWaalsContact O-CG 3.29Å; S885-E889 WeakPolarHBondContact O-CG 3.01Å; S885-E889 PolarHBondContact O-N 3.04Å; S885-E889 PolarHBondContact OG-OE1 3.22Å; S885-E889 VanDerWaalsContact OG-OE1 3.1Å
886	L	97.2	Very high	96.6	Very high	67 Å²	67	44.5 Å²	44.5	35%	0.351	22%	0.216	S	C	.	.	H	α-helix	trans	-63.2	-30.4	178.2	-69.3	172.6	0	0	0	113	L757 Q882 F884 K890	L757-L886 HydrophobicContact CD2-CB 3.88Å; Q882-L886 HydrophobicContact CG-CD1 3.9Å; Q882-L886 HydrophobicContact CG-CG 4.28Å; Q882-L886 WeakPolarHBondContact O-CB 3.42Å; Q882-L886 VanDerWaalsContact O-CG 3.27Å; Q882-L886 WeakPolarHBondContact O-CG 3.29Å; Q882-L886 PolarHBondContact O-N 2.8Å; F884-L886 PolarHBondContact O-N 2.89Å; L886-K890 WeakPolarHBondContact O-CB 3.12Å; L886-K890 VanDerWaalsContact O-CG 3.28Å; L886-K890 WeakPolarHBondContact O-CG 3.29Å; L886-K890 PolarHBondContact O-N 3.27Å
887	F	97.7	Very high	96.6	Very high	1 Å²	1	41.5 Å²	41.5	0%	0.004	21%	0.208	C	C	.	.	H	α-helix	trans	-69.9	-46.4	174.1	177.7	-97.8	0	0	0	111.5	L728 L756 L757 L772 L775 T883 F884 S885 K890 M891	L728-F887 HydrophobicContact CD1-CE1 3.99Å; L728-F887 HydrophobicContact CD1-CZ 4.13Å; L728-F887 HydrophobicContact CD2-CD1 4.36Å; L728-F887 HydrophobicContact CD2-CE1 3.8Å; L728-F887 HydrophobicContact CG-CE1 4.44Å; L756-F887 HydrophobicContact CB-CD2 3.73Å; L756-F887 HydrophobicContact CB-CE2 4.19Å; L756-F887 HydrophobicContact CB-CG 4.22Å; L756-F887 HydrophobicContact CD2-CE2 4.32Å; L757-F887 HydrophobicContact CD2-CB 4.01Å; L772-F887 HydrophobicContact CD1-CE2 3.89Å; L772-F887 HydrophobicContact CD1-CZ 4Å; L775-F887 HydrophobicContact CD2-CZ 4.11Å; T883-F887 VanDerWaalsContact O-CB 3.31Å; T883-F887 WeakPolarHBondContact O-CB 3.5Å; T883-F887 PolarHBondContact O-N 3.19Å; T883-F887 VanDerWaalsContact O-N 3.09Å; F884-F887 PolarHBondContact O-N 3.18Å; S885-F887 VanDerWaalsContact C-N 3.27Å; S885-F887 PolarHBondContact O-N 3.22Å; F887-K890 PolarHBondContact O-N 3.21Å; F887-M891 HydrophobicContact CE1-SD 4.11Å; F887-M891 WeakPolarHBondContact O-CB 3.35Å; F887-M891 PolarHBondContact O-N 2.89Å
888	F	97.1	Very high	96.6	Very high	5 Å²	5	41.6 Å²	41.6	2%	0.022	21%	0.208	C	C	.	.	H	α-helix	trans	-72.7	-33.3	-179.8	-63.5	-52.2	0	0	0	113.2	I725 L728 I789 T790 L793 L796 F884 S885 M891 K892	I725-F888 HydrophobicContact CD1-CZ 4.49Å; I725-F888 HydrophobicContact CG1-CZ 4.37Å; L728-F888 HydrophobicContact CD2-CE1 3.8Å; L728-F888 HydrophobicContact CD2-CZ 4.06Å; I789-F888 HydrophobicContact CB-CE1 4.04Å; I789-F888 HydrophobicContact CB-CZ 4.27Å; I789-F888 HydrophobicContact CD1-CE1 4.33Å; I789-F888 HydrophobicContact CG2-CE1 3.69Å; I789-F888 HydrophobicContact CG2-CE2 4.14Å; I789-F888 HydrophobicContact CG2-CZ 3.42Å; I789-F888 VanDerWaalsContact CG2-CZ 3.42Å; T790-F888 HydrophobicContact CG2-CB 3.63Å; T790-F888 HydrophobicContact CG2-CD1 4.49Å; T790-F888 HydrophobicContact CG2-CD2 4.41Å; T790-F888 HydrophobicContact CG2-CG 3.96Å; L793-F888 HydrophobicContact CD1-CE2 3.99Å; L796-F888 HydrophobicContact CD2-CD2 3.61Å; L796-F888 HydrophobicContact CD2-CE2 3.94Å; F884-F888 HydrophobicContact CB-CD2 4.38Å; F884-F888 HydrophobicContact CB-CE2 4.04Å; F884-F888 AromaticContact CD1-CE2 3.92Å; F884-F888 HydrophobicContact CD1-CE2 3.92Å; F884-F888 HydrophobicContact CD1-CZ 4.07Å; F884-F888 HydrophobicContact CG-CE2 4.41Å; F884-F888 WeakPolarHBondContact O-CD2 3.46Å; F884-F888 PolarHBondContact O-N 3.37Å; S885-F888 PolarHBondContact O-N 3.5Å; F888-M891 HydrophobicContact CD1-CE 3.9Å; F888-M891 HydrophobicContact CD1-SD 4.26Å; F888-M891 HydrophobicContact CE1-CE 4.43Å; F888-M891 PolarHBondContact O-N 3.2Å; F888-K892 PolarHBondContact O-N 2.66Å
889	E	96.4	Very high	96.7	Very high	84 Å²	84	44.4 Å²	44.4	39%	0.393	22%	0.216	S	C	.	.	H	α-helix	trans	-56.4	-49.3	168	-74.9	170.1	-158	0	0	110.6	K797 S885 M891 K892 S893	K797-E889 IonicContact NZ-OE1 2.66Å; K797-E889 PolarHBondContact NZ-OE1 3.44Å; S885-E889 WeakPolarHBondContact O-CB 3.46Å; S885-E889 VanDerWaalsContact O-CG 3.29Å; S885-E889 WeakPolarHBondContact O-CG 3.01Å; S885-E889 PolarHBondContact O-N 3.04Å; S885-E889 PolarHBondContact OG-OE1 3.22Å; S885-E889 VanDerWaalsContact OG-OE1 3.1Å; E889-M891 PolarHBondContact O-N 2.89Å; E889-K892 PolarHBondContact O-N 2.68Å; E889-S893 PolarHBondContact O-N 3.44Å
890	K	96.8	Very high	96.6	Very high	75 Å²	75	43.5 Å²	43.5	33%	0.326	21%	0.212	S	C	.	.	H	α-helix	trans	-62.7	-39.8	174	-75.4	178.3	173.6	-167.4	0	112.7	L757 S760 L772 L886 F887 S893 T894	L757-K890 HydrophobicContact CD2-CD 4.49Å; S760-K890 PolarHBondContact OG-NZ 3.4Å; L772-K890 HydrophobicContact CD2-CB 3.8Å; L886-K890 WeakPolarHBondContact O-CB 3.12Å; L886-K890 VanDerWaalsContact O-CG 3.28Å; L886-K890 WeakPolarHBondContact O-CG 3.29Å; L886-K890 PolarHBondContact O-N 3.27Å; F887-K890 PolarHBondContact O-N 3.21Å; K890-S893 PolarHBondContact O-N 2.92Å; K890-T894 WeakPolarHBondContact O-CB 3.37Å; K890-T894 PolarHBondContact O-N 3.23Å; K890-T894 PolarHBondContact O-OG1 2.96Å
891	M	97	Very high	96.4	Very high	3 Å²	3	46.1 Å²	46.1	2%	0.015	22%	0.223	C	C	.	.	H	α-helix	trans	-61.8	-43.6	178.8	-164.2	177.4	78.5	0	0	111.3	V776 F887 F888 E889 T894 E895	V776-M891 HydrophobicContact CG2-CG 3.6Å; F887-M891 HydrophobicContact CE1-SD 4.11Å; F887-M891 WeakPolarHBondContact O-CB 3.35Å; F887-M891 PolarHBondContact O-N 2.89Å; F888-M891 HydrophobicContact CD1-CE 3.9Å; F888-M891 HydrophobicContact CD1-SD 4.26Å; F888-M891 HydrophobicContact CE1-CE 4.43Å; F888-M891 PolarHBondContact O-N 3.2Å; E889-M891 PolarHBondContact O-N 2.89Å; M891-T894 PolarHBondContact O-N 3.21Å; M891-E895 PolarHBondContact O-N 3.25Å
892	K	96	Very high	96.2	Very high	97 Å²	97	49 Å²	49	42%	0.422	24%	0.236	S	C	.	.	H	α-helix	trans	-66.6	-40.6	175.1	-74.7	-175.5	172.5	-179.3	0	112.9	T790 F888 E889 E895 Q896	T790-K892 WeakPolarHBondContact OG1-CE 3.41Å; T790-K892 PolarHBondContact OG1-NZ 3.37Å; F888-K892 PolarHBondContact O-N 2.66Å; E889-K892 PolarHBondContact O-N 2.68Å; K892-E895 PolarHBondContact O-N 3.02Å; K892-Q896 PolarHBondContact O-N 3.07Å; K892-Q896 VanDerWaalsContact O-N 3.1Å
893	S	96.7	Very high	96	Very high	63 Å²	63	50.3 Å²	50.3	44%	0.441	24%	0.242	S	C	.	.	H	α-helix	trans	-56.5	-51.6	171.2	-175.7	0	0	0	0	110.8	E889 K890 E895 Q896 E897	E889-S893 PolarHBondContact O-N 3.44Å; K890-S893 PolarHBondContact O-N 2.92Å; S893-E895 VanDerWaalsContact C-N 3.32Å; S893-E895 PolarHBondContact O-N 2.97Å; S893-Q896 WeakPolarHBondContact O-CA 3.45Å; S893-Q896 WeakPolarHBondContact O-CB 3.12Å; S893-Q896 PolarHBondContact O-N 3.04Å; S893-E897 WeakPolarHBondContact CB-OE1 3.14Å; S893-E897 WeakPolarHBondContact O-CG 3.26Å; S893-E897 PolarHBondContact O-N 3.05Å; S893-E897 PolarHBondContact OG-OE1 3.35Å
894	T	97	Very high	95.7	Very high	7 Å²	7	52.7 Å²	52.7	4%	0.043	25%	0.253	C	S	.	.	H	α-helix	trans	-63.4	-34.6	-179.7	-69.9	0	0	0	0	112.9	L772 H773 V776 K890 M891 Q896 E897 I898	L772-T894 HydrophobicContact CG-CG2 4.18Å; H773-T894 VanDerWaalsContact CA-CG2 3.46Å; H773-T894 HydrophobicContact CB-CG2 4.06Å; V776-T894 HydrophobicContact CB-CG2 4.1Å; V776-T894 HydrophobicContact CG2-CG2 3.96Å; K890-T894 WeakPolarHBondContact O-CB 3.37Å; K890-T894 PolarHBondContact O-N 3.23Å; K890-T894 PolarHBondContact O-OG1 2.96Å; M891-T894 PolarHBondContact O-N 3.21Å; T894-Q896 VanDerWaalsContact C-N 3.32Å; T894-Q896 PolarHBondContact O-N 2.83Å; T894-E897 WeakPolarHBondContact CA-OE1 3.31Å; T894-E897 PolarHBondContact N-OE1 3.45Å; T894-E897 PolarHBondContact O-N 2.63Å; T894-I898 HydrophobicContact CG2-CD1 4.04Å; T894-I898 WeakPolarHBondContact O-CB 3.37Å; T894-I898 WeakPolarHBondContact O-CD1 3.45Å; T894-I898 VanDerWaalsContact O-CG1 3.28Å; T894-I898 WeakPolarHBondContact O-CG1 3.39Å; T894-I898 PolarHBondContact O-N 3.02Å
895	E	96	Very high	95.4	Very high	41 Å²	41	56.8 Å²	56.8	19%	0.192	27%	0.274	C	S	.	.	H	α-helix	trans	-65	-35.9	172.8	-157.6	-151.8	146.4	0	0	112.2	V776 L787 M891 K892 S893 K899	V776-E895 HydrophobicContact CG1-CB 3.85Å; V776-E895 HydrophobicContact CG1-CG 3.9Å; L787-E895 HydrophobicContact CD1-CG 4.27Å; M891-E895 PolarHBondContact O-N 3.25Å; K892-E895 PolarHBondContact O-N 3.02Å; S893-E895 VanDerWaalsContact C-N 3.32Å; S893-E895 PolarHBondContact O-N 2.97Å; E895-K899 WeakPolarHBondContact O-CD 3.27Å; E895-K899 VanDerWaalsContact O-CG 3.29Å; E895-K899 WeakPolarHBondContact O-CG 3.3Å; E895-K899 PolarHBondContact O-N 3.02Å; E895-K899 VanDerWaalsContact O-N 3.14Å; E895-K899 WeakPolarHBondContact OE1-CE 3.27Å; E895-K899 IonicContact OE1-NZ 3.74Å; E895-K899 PolarHBondContact OE1-NZ 2.8Å; E895-K899 IonicContact OE2-NZ 2.67Å
896	Q	96	Very high	95.2	Very high	86 Å²	86	62.5 Å²	62.5	40%	0.402	30%	0.298	S	S	.	.	H	α-helix	trans	-72.4	-44.9	174.8	-179.3	57.5	25.4	0	0	112	K892 S893 T894 I898 K899 E900	K892-Q896 PolarHBondContact O-N 3.07Å; K892-Q896 VanDerWaalsContact O-N 3.1Å; S893-Q896 WeakPolarHBondContact O-CA 3.45Å; S893-Q896 WeakPolarHBondContact O-CB 3.12Å; S893-Q896 PolarHBondContact O-N 3.04Å; T894-Q896 VanDerWaalsContact C-N 3.32Å; T894-Q896 PolarHBondContact O-N 2.83Å; Q896-I898 VanDerWaalsContact C-N 3.26Å; Q896-I898 PolarHBondContact O-N 3.22Å; Q896-K899 WeakPolarHBondContact O-CB 3.35Å; Q896-K899 PolarHBondContact O-N 3.3Å; Q896-E900 PolarHBondContact NE2-OE1 3.01Å; Q896-E900 PolarHBondContact O-N 3.21Å
897	E	96.2	Very high	95	Very high	66 Å²	66	62.4 Å²	62.4	31%	0.308	30%	0.296	S	S	.	.	H	α-helix	trans	-53.8	-44.2	172.8	-68.7	161.9	-111.3	0	0	110.8	H773 S893 T894 E900 F901	H773-E897 IonicContact CE1-OE2 3.4Å; H773-E897 PolarHBondContact CE1-OE2 3.43Å; H773-E897 IonicContact NE2-OE2 2.72Å; S893-E897 WeakPolarHBondContact CB-OE1 3.14Å; S893-E897 WeakPolarHBondContact O-CG 3.26Å; S893-E897 PolarHBondContact O-N 3.05Å; S893-E897 PolarHBondContact OG-OE1 3.35Å; T894-E897 WeakPolarHBondContact CA-OE1 3.31Å; T894-E897 PolarHBondContact N-OE1 3.45Å; T894-E897 PolarHBondContact O-N 2.63Å; E897-E900 PolarHBondContact O-N 3.24Å; E897-F901 HydrophobicContact CB-CE2 4.18Å; E897-F901 WeakPolarHBondContact O-CD2 3.47Å; E897-F901 WeakPolarHBondContact O-CG 3.3Å; E897-F901 PolarHBondContact O-N 3.4Å
898	I	95.3	Very high	94.7	Very high	5 Å²	5	68.8 Å²	68.8	3%	0.026	32%	0.32	C	S	.	.	H	α-helix	trans	-60.1	-45.8	174	-79.3	166.7	0	0	0	112.6	H773 V776 Q777 K780 T894 Q896 E900 F901 E902	H773-I898 HydrophobicContact CB-CD1 4.35Å; V776-I898 HydrophobicContact CB-CD1 3.9Å; V776-I898 HydrophobicContact CG1-CD1 3.69Å; Q777-I898 HydrophobicContact CB-CD1 4.42Å; K780-I898 HydrophobicContact CD-CG2 4.35Å; T894-I898 HydrophobicContact CG2-CD1 4.04Å; T894-I898 WeakPolarHBondContact O-CB 3.37Å; T894-I898 WeakPolarHBondContact O-CD1 3.45Å; T894-I898 VanDerWaalsContact O-CG1 3.28Å; T894-I898 WeakPolarHBondContact O-CG1 3.39Å; T894-I898 PolarHBondContact O-N 3.02Å; Q896-I898 VanDerWaalsContact C-N 3.26Å; Q896-I898 PolarHBondContact O-N 3.22Å; I898-E900 VanDerWaalsContact C-N 3.29Å; I898-E900 PolarHBondContact O-N 3.23Å; I898-F901 PolarHBondContact O-N 3.07Å; I898-E902 WeakPolarHBondContact O-CG 3.45Å; I898-E902 PolarHBondContact O-N 2.6Å
899	K	95.3	Very high	94.4	Very high	83 Å²	83	73.5 Å²	73.5	36%	0.361	35%	0.345	S	S	.	.	H	α-helix	trans	-61.5	-39.4	177.7	-71.4	161.7	-170.2	164.8	0	111.4	E895 Q896 E902 Q903	E895-K899 WeakPolarHBondContact O-CD 3.27Å; E895-K899 VanDerWaalsContact O-CG 3.29Å; E895-K899 WeakPolarHBondContact O-CG 3.3Å; E895-K899 PolarHBondContact O-N 3.02Å; E895-K899 VanDerWaalsContact O-N 3.14Å; E895-K899 WeakPolarHBondContact OE1-CE 3.27Å; E895-K899 IonicContact OE1-NZ 3.74Å; E895-K899 PolarHBondContact OE1-NZ 2.8Å; E895-K899 IonicContact OE2-NZ 2.67Å; Q896-K899 WeakPolarHBondContact O-CB 3.35Å; Q896-K899 PolarHBondContact O-N 3.3Å; K899-E902 PolarHBondContact O-N 3.45Å; K899-Q903 WeakPolarHBondContact O-CB 3.16Å; K899-Q903 PolarHBondContact O-N 3.2Å
900	E	95	Very high	94.2	Very high	98 Å²	98	75 Å²	75	46%	0.458	35%	0.352	S	S	.	.	H	α-helix	trans	-69.5	-39.2	177.9	-71.2	175.1	-158.4	0	0	112.5	Q896 E897 I898 Q903 M904	Q896-E900 PolarHBondContact NE2-OE1 3.01Å; Q896-E900 PolarHBondContact O-N 3.21Å; E897-E900 PolarHBondContact O-N 3.24Å; I898-E900 VanDerWaalsContact C-N 3.29Å; I898-E900 PolarHBondContact O-N 3.23Å; E900-Q903 PolarHBondContact O-N 2.83Å; E900-M904 WeakPolarHBondContact O-CB 3.34Å; E900-M904 WeakPolarHBondContact O-CG 3.21Å; E900-M904 PolarHBondContact O-N 3.29Å
901	F	92	Very high	93.9	Very high	61 Å²	61	75.6 Å²	75.6	27%	0.268	35%	0.354	S	S	.	.	H	α-helix	trans	-62.7	-47.7	171.1	-65.8	-50.3	0	0	0	111.8	K768 H773 E897 I898 Q903 M904 D905	K768-F901 HydrophobicContact CB-CZ 4.16Å; K768-F901 HydrophobicContact CD-CE1 4.07Å; K768-F901 HydrophobicContact CD-CZ 4.24Å; H773-F901 AromaticContact NE2-CE2 3.79Å; E897-F901 HydrophobicContact CB-CE2 4.18Å; E897-F901 WeakPolarHBondContact O-CD2 3.47Å; E897-F901 WeakPolarHBondContact O-CG 3.3Å; E897-F901 PolarHBondContact O-N 3.4Å; I898-F901 PolarHBondContact O-N 3.07Å; F901-Q903 VanDerWaalsContact C-N 3.32Å; F901-Q903 PolarHBondContact O-N 3.14Å; F901-M904 HydrophobicContact CD1-CE 3.67Å; F901-M904 HydrophobicContact CE1-CE 4.09Å; F901-M904 PolarHBondContact O-N 3.5Å; F901-D905 PolarHBondContact O-N 3.38Å
902	E	92.1	Very high	93.6	Very high	60 Å²	60	79.8 Å²	79.8	28%	0.28	38%	0.376	S	S	.	.	H	α-helix	trans	-60.5	-38.3	176.7	-76.4	178.5	-171.3	0	0	112.9	Q777 K780 I898 K899 K906	Q777-E902 PolarHBondContact NE2-OE1 2.98Å; K780-E902 IonicContact NZ-OE1 3.5Å; K780-E902 PolarHBondContact NZ-OE1 3.49Å; K780-E902 IonicContact NZ-OE2 3.58Å; K780-E902 PolarHBondContact NZ-OE2 2.96Å; I898-E902 WeakPolarHBondContact O-CG 3.45Å; I898-E902 PolarHBondContact O-N 2.6Å; K899-E902 PolarHBondContact O-N 3.45Å; E902-K906 WeakPolarHBondContact O-CD 3.21Å; E902-K906 VanDerWaalsContact O-CG 3.26Å; E902-K906 WeakPolarHBondContact O-CG 3.16Å; E902-K906 PolarHBondContact O-N 3.29Å; E902-K906 VanDerWaalsContact O-N 3.15Å
903	Q	93.6	Very high	93.2	Very high	121 Å²	121	79.3 Å²	79.3	57%	0.565	38%	0.378	S	S	*	.	H	α-helix	trans	-67.3	-47	174.4	-179.4	175.8	-30	0	0	111.3	K899 E900 F901 D905 K906 E907	K899-Q903 WeakPolarHBondContact O-CB 3.16Å; K899-Q903 PolarHBondContact O-N 3.2Å; E900-Q903 PolarHBondContact O-N 2.83Å; F901-Q903 VanDerWaalsContact C-N 3.32Å; F901-Q903 PolarHBondContact O-N 3.14Å; Q903-D905 VanDerWaalsContact C-N 3.3Å; Q903-D905 PolarHBondContact O-N 3.18Å; Q903-K906 PolarHBondContact O-N 3.1Å; Q903-E907 WeakPolarHBondContact O-CB 3.25Å; Q903-E907 PolarHBondContact O-N 3.26Å
904	M	91.9	Very high	92.7	Very high	76 Å²	76	81.7 Å²	81.7	37%	0.374	39%	0.386	S	S	.	.	H	α-helix	trans	-60.6	-37.4	179.1	-81.5	-169.3	-77	0	0	112.9	E900 F901 E907 R908	E900-M904 WeakPolarHBondContact O-CB 3.34Å; E900-M904 WeakPolarHBondContact O-CG 3.21Å; E900-M904 PolarHBondContact O-N 3.29Å; F901-M904 HydrophobicContact CD1-CE 3.67Å; F901-M904 HydrophobicContact CE1-CE 4.09Å; F901-M904 PolarHBondContact O-N 3.5Å; M904-E907 WeakPolarHBondContact O-CB 3.42Å; M904-E907 PolarHBondContact O-N 3.08Å; M904-R908 VanDerWaalsContact O-CG 3.29Å; M904-R908 WeakPolarHBondContact O-CG 3.27Å; M904-R908 PolarHBondContact O-N 3Å
905	D	90	Very high	92.1	Very high	85 Å²	85	88 Å²	88	46%	0.455	41%	0.413	S	S	.	.	H	α-helix	trans	-77.1	-35.9	179.6	-77.8	-34.4	0	0	0	113	F901 Q903 E907 R908 L909	F901-D905 PolarHBondContact O-N 3.38Å; Q903-D905 VanDerWaalsContact C-N 3.3Å; Q903-D905 PolarHBondContact O-N 3.18Å; D905-E907 VanDerWaalsContact C-N 3.32Å; D905-E907 PolarHBondContact O-N 3.32Å; D905-R908 PolarHBondContact O-N 3.4Å; D905-R908 VanDerWaalsContact O-N 3.16Å; D905-R908 VanDerWaalsContact OD1-CD 3.27Å; D905-R908 WeakPolarHBondContact OD1-CD 3.37Å; D905-R908 IonicContact OD1-CZ 3.16Å; D905-R908 IonicContact OD1-NE 2.71Å; D905-R908 IonicContact OD1-NH1 2.76Å; D905-R908 PolarHBondContact OD1-NH1 3.36Å; D905-R908 IonicContact OD2-NH1 2.65Å; D905-L909 WeakPolarHBondContact O-CB 3.39Å; D905-L909 PolarHBondContact O-N 3.21Å
906	K	93.1	Very high	91.3	Very high	128 Å²	128	89.5 Å²	89.5	56%	0.557	42%	0.422	S	S	*	.	H	α-helix	trans	-57	-48.3	165.3	-72.4	165	-174.4	166.3	0	110.7	E902 Q903 R908 L909 E910	E902-K906 WeakPolarHBondContact O-CD 3.21Å; E902-K906 VanDerWaalsContact O-CG 3.26Å; E902-K906 WeakPolarHBondContact O-CG 3.16Å; E902-K906 PolarHBondContact O-N 3.29Å; E902-K906 VanDerWaalsContact O-N 3.15Å; Q903-K906 PolarHBondContact O-N 3.1Å; K906-R908 VanDerWaalsContact C-N 3.25Å; K906-R908 PolarHBondContact O-N 3.38Å; K906-L909 PolarHBondContact O-N 3.03Å; K906-E910 WeakPolarHBondContact O-CG 3.23Å; K906-E910 PolarHBondContact O-N 3.35Å
907	E	93	Very high	90.4	Very high	65 Å²	65	89.3 Å²	89.3	30%	0.304	43%	0.427	S	S	.	.	H	α-helix	trans	-60.3	-29.8	175.8	-99.4	-155.5	-118.4	0	0	113.6	Q903 M904 D905 K911 K1008	Q903-E907 WeakPolarHBondContact O-CB 3.25Å; Q903-E907 PolarHBondContact O-N 3.26Å; M904-E907 WeakPolarHBondContact O-CB 3.42Å; M904-E907 PolarHBondContact O-N 3.08Å; D905-E907 VanDerWaalsContact C-N 3.32Å; D905-E907 PolarHBondContact O-N 3.32Å; E907-K911 WeakPolarHBondContact O-CD 3.27Å; E907-K911 WeakPolarHBondContact O-CE 3.48Å; E907-K911 WeakPolarHBondContact O-CG 3.45Å; E907-K911 PolarHBondContact O-NZ 2.75Å; E907-K911 IonicContact OE2-NZ 2.7Å; E907-K911 PolarHBondContact OE2-NZ 3.31Å; E907-K1008 IonicContact OE2-NZ 2.65Å
908	R	92.2	Very high	89.3	Confident	136 Å²	136	91.1 Å²	91.1	51%	0.513	44%	0.439	S	S	.	.	H	α-helix	trans	-75.5	-44	174.5	-76.2	163.7	-174.8	153.1	7.5	111	M904 D905 K906 K911 L912	M904-R908 VanDerWaalsContact O-CG 3.29Å; M904-R908 WeakPolarHBondContact O-CG 3.27Å; M904-R908 PolarHBondContact O-N 3Å; D905-R908 PolarHBondContact O-N 3.4Å; D905-R908 VanDerWaalsContact O-N 3.16Å; D905-R908 VanDerWaalsContact OD1-CD 3.27Å; D905-R908 WeakPolarHBondContact OD1-CD 3.37Å; D905-R908 IonicContact OD1-CZ 3.16Å; D905-R908 IonicContact OD1-NE 2.71Å; D905-R908 IonicContact OD1-NH1 2.76Å; D905-R908 PolarHBondContact OD1-NH1 3.36Å; D905-R908 IonicContact OD2-NH1 2.65Å; K906-R908 VanDerWaalsContact C-N 3.25Å; K906-R908 PolarHBondContact O-N 3.38Å; R908-K911 PolarHBondContact O-N 2.79Å; R908-L912 PolarHBondContact O-N 3.02Å
909	L	91.5	Very high	88.1	Confident	104 Å²	104	95.1 Å²	95.1	55%	0.545	46%	0.46	S	S	.	.	H	α-helix	trans	-65.8	-41.6	-177.9	-160.5	69	0	0	0	111.7	D905 K906 K911 L912 N913	D905-L909 WeakPolarHBondContact O-CB 3.39Å; D905-L909 PolarHBondContact O-N 3.21Å; K906-L909 PolarHBondContact O-N 3.03Å; L909-K911 VanDerWaalsContact C-N 3.3Å; L909-K911 PolarHBondContact O-N 2.83Å; L909-L912 PolarHBondContact O-N 3.37Å; L909-L912 VanDerWaalsContact O-N 3.16Å; L909-N913 PolarHBondContact O-N 3.4Å; L909-N913 PolarHBondContact O-OD1 2.87Å
910	E	91.5	Very high	86.6	Confident	115 Å²	115	97.1 Å²	97.1	54%	0.537	47%	0.471	S	S	.	.	H	α-helix	trans	-57.5	-41.6	171.1	-72.8	176	-179.4	0	0	112.3	K906 L912 N914	K906-E910 WeakPolarHBondContact O-CG 3.23Å; K906-E910 PolarHBondContact O-N 3.35Å; E910-L912 VanDerWaalsContact C-N 3.31Å; E910-L912 PolarHBondContact O-N 3.42Å; E910-N914 VanDerWaalsContact O-CB 3.31Å; E910-N914 WeakPolarHBondContact O-CB 3.45Å; E910-N914 PolarHBondContact O-N 3.44Å; E910-N914 PolarHBondContact O-ND2 2.98Å; E910-N914 VanDerWaalsContact O-ND2 3.11Å
911	K	91.3	Very high	85.2	Confident	87 Å²	87	95.5 Å²	95.5	38%	0.378	47%	0.468	S	S	.	.	H	α-helix	trans	-72.9	-23.2	179	-69.4	169.3	-169	63	0	112.9	E907 R908 L909	E907-K911 WeakPolarHBondContact O-CD 3.27Å; E907-K911 WeakPolarHBondContact O-CE 3.48Å; E907-K911 WeakPolarHBondContact O-CG 3.45Å; E907-K911 PolarHBondContact O-NZ 2.75Å; E907-K911 IonicContact OE2-NZ 2.7Å; E907-K911 PolarHBondContact OE2-NZ 3.31Å; R908-K911 PolarHBondContact O-N 2.79Å; L909-K911 VanDerWaalsContact C-N 3.3Å; L909-K911 PolarHBondContact O-N 2.83Å
912	L	89.8	Confident	83.6	Confident	91 Å²	91	96.8 Å²	96.8	48%	0.476	48%	0.477	S	S	.	.	H	α-helix	trans	-77.2	-53.4	171.6	-172.2	63.4	0	0	0	110.2	R908 L909 E910 N914 K915 D916	R908-L912 PolarHBondContact O-N 3.02Å; L909-L912 PolarHBondContact O-N 3.37Å; L909-L912 VanDerWaalsContact O-N 3.16Å; E910-L912 VanDerWaalsContact C-N 3.31Å; E910-L912 PolarHBondContact O-N 3.42Å; L912-N914 VanDerWaalsContact C-N 3.29Å; L912-N914 PolarHBondContact O-N 3.44Å; L912-K915 WeakPolarHBondContact O-CA 3.48Å; L912-K915 WeakPolarHBondContact O-CB 3.2Å; L912-K915 PolarHBondContact O-N 3.18Å; L912-D916 PolarHBondContact O-N 2.87Å
913	N	88.4	Confident	82	Confident	87 Å²	87	97.9 Å²	97.9	47%	0.465	49%	0.488	S	S	.	.	H	α-helix	trans	-53.1	-45.5	177	-70.2	0.8	0	0	0	111.7	L909 K915 D916 T917	L909-N913 PolarHBondContact O-N 3.4Å; L909-N913 PolarHBondContact O-OD1 2.87Å; N913-K915 VanDerWaalsContact C-N 3.28Å; N913-K915 PolarHBondContact O-N 3.45Å; N913-D916 PolarHBondContact O-N 2.97Å; N913-D916 VanDerWaalsContact O-N 3.11Å; N913-T917 PolarHBondContact O-N 3.32Å; N913-T917 PolarHBondContact O-OG1 3.44Å
914	N	86.4	Confident	80.3	Confident	113 Å²	113	99.5 Å²	99.5	60%	0.604	49%	0.493	S	S	*	.	H	α-helix	trans	-62.1	-30.4	177.2	-74.1	-27.2	0	0	0	113.5	E910 L912 L918	E910-N914 VanDerWaalsContact O-CB 3.31Å; E910-N914 WeakPolarHBondContact O-CB 3.45Å; E910-N914 PolarHBondContact O-N 3.44Å; E910-N914 PolarHBondContact O-ND2 2.98Å; E910-N914 VanDerWaalsContact O-ND2 3.11Å; L912-N914 VanDerWaalsContact C-N 3.29Å; L912-N914 PolarHBondContact O-N 3.44Å; N914-L918 WeakPolarHBondContact O-CB 3.49Å; N914-L918 PolarHBondContact O-N 3.06Å
915	K	83.8	Confident	78.3	Confident	141 Å²	141	104.6 Å²	104.6	61%	0.613	51%	0.51	S	S	*	.	H	α-helix	trans	-73.1	-42.2	171.6	-78.8	-177	172.3	-171.9	0	111.6	L912 N913 L918 N919	L912-K915 WeakPolarHBondContact O-CA 3.48Å; L912-K915 WeakPolarHBondContact O-CB 3.2Å; L912-K915 PolarHBondContact O-N 3.18Å; N913-K915 VanDerWaalsContact C-N 3.28Å; N913-K915 PolarHBondContact O-N 3.45Å; K915-L918 WeakPolarHBondContact O-CB 3.33Å; K915-L918 PolarHBondContact O-N 2.9Å; K915-N919 WeakPolarHBondContact O-CB 3.27Å; K915-N919 VanDerWaalsContact O-CG 3.22Å; K915-N919 PolarHBondContact O-N 3.47Å; K915-N919 PolarHBondContact O-ND2 3.09Å
916	D	78.8	Confident	76.3	Confident	71 Å²	71	105.5 Å²	105.5	38%	0.38	52%	0.515	S	S	.	.	H	α-helix	trans	-70	-34.6	-178.5	-66.3	-33.9	0	0	0	112	L912 N913 N919 Q920	L912-D916 PolarHBondContact O-N 2.87Å; N913-D916 PolarHBondContact O-N 2.97Å; N913-D916 VanDerWaalsContact O-N 3.11Å; D916-N919 PolarHBondContact O-N 3.29Å; D916-Q920 WeakPolarHBondContact O-CB 3.37Å; D916-Q920 WeakPolarHBondContact O-CG 3.47Å; D916-Q920 PolarHBondContact O-N 3.45Å
917	T	77.2	Confident	74.4	Confident	83 Å²	83	106.5 Å²	106.5	51%	0.509	52%	0.521	S	S	.	.	H	α-helix	trans	-61.6	-44.6	168.9	-45.1	0	0	0	0	111.4	N913 N919 Q920 T921	N913-T917 PolarHBondContact O-N 3.32Å; N913-T917 PolarHBondContact O-OG1 3.44Å; T917-N919 VanDerWaalsContact C-N 3.35Å; T917-N919 PolarHBondContact O-N 3.28Å; T917-Q920 PolarHBondContact O-N 3.19Å; T917-T921 PolarHBondContact O-N 3.4Å; T917-T921 PolarHBondContact O-OG1 2.9Å
918	L	72.5	Confident	72.3	Confident	104 Å²	104	111.7 Å²	111.7	55%	0.545	54%	0.543	S	S	.	.	H	α-helix	trans	-63.3	-39.7	177.5	-170.7	67.4	0	0	0	112.1	N914 K915 T921 N922	N914-L918 WeakPolarHBondContact O-CB 3.49Å; N914-L918 PolarHBondContact O-N 3.06Å; K915-L918 WeakPolarHBondContact O-CB 3.33Å; K915-L918 PolarHBondContact O-N 2.9Å; L918-T921 WeakPolarHBondContact CA-OG1 3.44Å; L918-T921 PolarHBondContact O-N 3.01Å; L918-T921 PolarHBondContact O-OG1 3.01Å; L918-N922 PolarHBondContact O-N 3.15Å; L918-N922 VanDerWaalsContact O-N 3.15Å; L918-N922 PolarHBondContact O-ND2 2.78Å
919	N	70.2	Confident	70.2	Confident	88 Å²	88	112.1 Å²	112.1	47%	0.471	56%	0.555	S	S	.	*	H	α-helix	trans	-64.6	-43.3	174.1	-69.8	-27.7	0	0	0	111.7	K915 D916 T917 N922 T923	K915-N919 WeakPolarHBondContact O-CB 3.27Å; K915-N919 VanDerWaalsContact O-CG 3.22Å; K915-N919 PolarHBondContact O-N 3.47Å; K915-N919 PolarHBondContact O-ND2 3.09Å; D916-N919 PolarHBondContact O-N 3.29Å; T917-N919 VanDerWaalsContact C-N 3.35Å; T917-N919 PolarHBondContact O-N 3.28Å; N919-N922 PolarHBondContact O-N 2.8Å; N919-T923 PolarHBondContact O-N 2.78Å; N919-T923 PolarHBondContact O-OG1 3.39Å
920	Q	65.1	Low	67.9	Low	125 Å²	125	111.1 Å²	111.1	58%	0.584	56%	0.556	S	S	*	*	H	α-helix	trans	-68.4	-31	177.1	-73.4	-175.6	25.1	0	0	113.5	D916 T917 T923 K924	D916-Q920 WeakPolarHBondContact O-CB 3.37Å; D916-Q920 WeakPolarHBondContact O-CG 3.47Å; D916-Q920 PolarHBondContact O-N 3.45Å; T917-Q920 PolarHBondContact O-N 3.19Å; Q920-T923 PolarHBondContact O-OG1 3.29Å; Q920-K924 PolarHBondContact O-N 3.38Å; Q920-K924 VanDerWaalsContact O-N 3.14Å
921	T	63.9	Low	65.6	Low	65 Å²	65	114.8 Å²	114.8	40%	0.399	57%	0.571	S	S	.	*	H	α-helix	trans	-66.1	-40.6	170.1	43.7	0	0	0	0	111.5	T917 L918 K924 Y925	T917-T921 PolarHBondContact O-N 3.4Å; T917-T921 PolarHBondContact O-OG1 2.9Å; L918-T921 WeakPolarHBondContact CA-OG1 3.44Å; L918-T921 PolarHBondContact O-N 3.01Å; L918-T921 PolarHBondContact O-OG1 3.01Å; T921-K924 PolarHBondContact O-N 2.82Å; T921-Y925 WeakPolarHBondContact O-CD2 3.21Å; T921-Y925 PolarHBondContact O-N 2.98Å; T921-Y925 VanDerWaalsContact O-N 3.11Å
922	N	59.8	Low	63.3	Low	88 Å²	88	118 Å²	118	47%	0.471	59%	0.59	S	S	.	*	H	α-helix	trans	-66.9	-39.6	178	-70.6	-20	0	0	0	112.5	L918 N919 Y925 N926	L918-N922 PolarHBondContact O-N 3.15Å; L918-N922 VanDerWaalsContact O-N 3.15Å; L918-N922 PolarHBondContact O-ND2 2.78Å; N919-N922 PolarHBondContact O-N 2.8Å; N922-Y925 PolarHBondContact O-N 3.07Å; N922-N926 PolarHBondContact O-N 2.98Å; N922-N926 VanDerWaalsContact O-N 3.14Å
923	T	59.1	Low	61	Low	83 Å²	83	120.4 Å²	120.4	51%	0.509	61%	0.609	S	S	.	*	H	α-helix	trans	-68.6	-34.7	175.8	57	0	0	0	0	112.7	N919 Q920 N926 H927	N919-T923 PolarHBondContact O-N 2.78Å; N919-T923 PolarHBondContact O-OG1 3.39Å; Q920-T923 PolarHBondContact O-OG1 3.29Å; T923-N926 PolarHBondContact O-N 3.24Å; T923-H927 PolarHBondContact O-N 2.97Å
924	K	56.7	Low	58.6	Low	155 Å²	155	125.3 Å²	125.3	67%	0.674	63%	0.629	S	S	*	*	H	α-helix	trans	-65.2	-33.2	172.2	-84	179.8	175.4	172.5	0	113.5	Q920 T921	Q920-K924 PolarHBondContact O-N 3.38Å; Q920-K924 VanDerWaalsContact O-N 3.14Å; T921-K924 PolarHBondContact O-N 2.82Å
925	Y	50.3	Low	56.3	Low	183 Å²	183	125.9 Å²	125.9	72%	0.718	63%	0.632	S	S	*	*	H	α-helix	trans	-65.6	-46	170.9	-94.6	-79.6	0	0	0	111.5	T921 N922 H927 K928	T921-Y925 WeakPolarHBondContact O-CD2 3.21Å; T921-Y925 PolarHBondContact O-N 2.98Å; T921-Y925 VanDerWaalsContact O-N 3.11Å; N922-Y925 PolarHBondContact O-N 3.07Å; Y925-H927 PolarHBondContact O-N 2.81Å; Y925-K928 PolarHBondContact O-N 2.75Å
926	N	48.3	Very low	53.9	Low	104 Å²	104	127.6 Å²	127.6	56%	0.556	64%	0.639	S	S	*	*	H	α-helix	trans	-64.6	-36.9	179	-72.1	-12.2	0	0	0	113.2	N922 T923 K928 N929	N922-N926 PolarHBondContact O-N 2.98Å; N922-N926 VanDerWaalsContact O-N 3.14Å; T923-N926 PolarHBondContact O-N 3.24Å; N926-K928 VanDerWaalsContact C-N 3.31Å; N926-K928 PolarHBondContact O-N 3.33Å; N926-N929 PolarHBondContact O-N 3.06Å
927	H	53.6	Low	51.9	Low	149 Å²	149	129.3 Å²	129.3	69%	0.69	65%	0.654	S	S	*	*	H	α-helix	trans	-71.7	-16.2	179.3	-107.2	49.7	0	0	0	115.1	T923 Y925 N929	T923-H927 PolarHBondContact O-N 2.97Å; Y925-H927 PolarHBondContact O-N 2.81Å; H927-N929 VanDerWaalsContact C-N 3.33Å
928	K	49	Very low	49.6	Very low	174 Å²	174	135 Å²	135	76%	0.757	67%	0.672	S	S	*	*	H	α-helix	trans	-76.8	-20.1	172.5	-84.6	-169.4	171	-173.2	0	113.3	Y925 N926	Y925-K928 PolarHBondContact O-N 2.75Å; N926-K928 VanDerWaalsContact C-N 3.31Å; N926-K928 PolarHBondContact O-N 3.33Å
929	N	46.1	Very low	47.5	Very low	145 Å²	145	136.3 Å²	136.3	78%	0.775	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.4	2.4	-178.8	-70.5	-0.2	0	0	0	114	N926 H927	N926-N929 PolarHBondContact O-N 3.06Å; H927-N929 VanDerWaalsContact C-N 3.33Å
930	S	44.9	Very low	45.4	Very low	82 Å²	82	137.1 Å²	137.1	57%	0.573	70%	0.702	S	S	*	*	S	Bend	trans	-116.8	28.3	-176.1	75.3	0	0	0	0	114.1
931	K	42.3	Very low	43.8	Very low	192 Å²	192	139.1 Å²	139.1	84%	0.835	71%	0.711	S	S	*	*	S	Bend	trans	-141.4	28.8	-175.9	-134.4	177.8	-173.8	-176.7	0	115.6
932	I	44.1	Very low	42.3	Very low	155 Å²	155	142.2 Å²	142.2	80%	0.795	73%	0.725	S	S	*	*			trans	-132	144.6	168.9	-58.5	178.3	0	0	0	107.4
933	V	40.7	Very low	41	Very low	142 Å²	142	145.3 Å²	145.3	86%	0.861	74%	0.742	S	S	*	*			trans	106.3	129.7	-176.5	179.6	0	0	0	0	113.3
934	E	36.9	Very low	39.6	Very low	190 Å²	190	149.6 Å²	149.6	89%	0.888	76%	0.756	S	S	*	*			trans	-114.4	-173.5	-169.1	-64.5	176.7	120.7	0	0	112.7
935	D	38.7	Very low	38.5	Very low	125 Å²	125	150.4 Å²	150.4	67%	0.668	77%	0.767	S	S	*	*			trans	-31	138.4	-176.1	-96.5	-59.9	0	0	0	121.6
936	K	32.9	Very low	38	Very low	177 Å²	177	147 Å²	147	77%	0.77	77%	0.766	S	S	*	*			trans	78.6	157.8	136.3	-77	176.8	-175.7	92.6	0	120.7
937	P	36.9	Very low	37.1	Very low	107 Å²	107	149.8 Å²	149.8	70%	0.695	78%	0.778	S	S	*	*			trans	-135.3	179.2	-136.6	44.8	-29.1	0	0	0	117.6
938	K	29.4	Very low	36	Very low	203 Å²	203	151.2 Å²	151.2	88%	0.883	79%	0.787	S	S	*	*			trans	78.3	96	163.1	-62.1	-176.3	178.6	-177.7	0	118.7
939	S	28	Very low	35.2	Very low	131 Å²	131	149.8 Å²	149.8	92%	0.916	79%	0.787	S	S	*	*				-148.6	166.8	124.9	63.1	0	0	0	0	109.8
940	S	26.7	Very low	34.5	Very low	104 Å²	104	149.4 Å²	149.4	73%	0.727	78%	0.784	S	S	*	*			trans	-104.1	128.6	-169.6	50.9	0	0	0	0	113.9
941	H	30.8	Very low	33.9	Very low	168 Å²	168	152.2 Å²	152.2	78%	0.778	79%	0.792	S	S	*	*				-170.1	147	124.5	-111.1	-73.2	0	0	0	112.1
942	D	33.7	Very low	33.5	Very low	130 Å²	130	148.3 Å²	148.3	70%	0.695	79%	0.788	S	S	*	*			trans	43.1	104.5	150.5	-52.3	-10.1	0	0	0	121.5
943	D	31.5	Very low	32.9	Very low	153 Å²	153	147.6 Å²	147.6	82%	0.818	79%	0.786	S	S	*	*				45.4	92.9	119.6	-69	4.8	0	0	0	120
944	H	30.1	Very low	32.4	Very low	172 Å²	172	148.3 Å²	148.3	80%	0.796	79%	0.785	S	S	*	*				70.7	66.7	117.6	-147.3	52.6	0	0	0	118
945	N	33.3	Very low	32.4	Very low	172 Å²	172	147 Å²	147	92%	0.92	78%	0.783	S	S	*	*			trans	-112.3	105.7	157.6	-111.9	-50.9	0	0	0	111
946	T	39.1	Very low	32.4	Very low	113 Å²	113	146 Å²	146	69%	0.693	79%	0.786	S	S	*	*			trans	-128.5	132.2	178	-69.3	0	0	0	0	110.5
947	M	29.9	Very low	32.5	Very low	162 Å²	162	143.7 Å²	143.7	80%	0.798	78%	0.781	S	S	*	*			trans	70.4	94.2	163.1	-169.5	172.1	64.3	0	0	117.8
948	M	31.7	Very low	32.5	Very low	179 Å²	179	144.6 Å²	144.6	88%	0.882	79%	0.788	S	S	*	*			trans	-128.5	88.7	139.6	-109	-64.1	-175.7	0	0	109.6
949	N	31.6	Very low	32.7	Very low	143 Å²	143	145.3 Å²	145.3	77%	0.765	79%	0.785	S	S	*	*			trans	-162.9	145	153.3	-120.4	-36.9	0	0	0	110.2
950	L	31.1	Very low	33	Very low	137 Å²	137	147.5 Å²	147.5	72%	0.717	78%	0.784	S	S	*	*			trans	63.6	129.2	-151.9	-44.1	177	0	0	0	110.6
951	I	33.2	Very low	33.3	Very low	141 Å²	141	147.5 Å²	147.5	72%	0.723	78%	0.78	S	S	*	*			cis	-129	130.2	23.1	-65.3	165.2	0	0	0	111.9
952	S	33.7	Very low	33.4	Very low	110 Å²	110	146.5 Å²	146.5	77%	0.769	78%	0.775	S	S	*	*			trans	-132	127.9	137.9	-73.5	0	0	0	0	105.7
953	N	31	Very low	33.2	Very low	140 Å²	140	146.4 Å²	146.4	75%	0.749	78%	0.775	S	S	*	*	S	Bend	cis	-120.6	136.4	16.7	-60.1	-38.2	0	0	0	112.8
954	N	31.1	Very low	33.2	Very low	157 Å²	157	150.2 Å²	150.2	84%	0.84	78%	0.777	S	S	*	*			trans	-174.3	104.2	133.3	-96.6	-30	0	0	0	110.8
955	I	35.6	Very low	33.1	Very low	164 Å²	164	147.6 Å²	147.6	84%	0.841	78%	0.778	S	S	*	*			trans	-127.2	131.8	170.5	-67.1	171	0	0	0	103.9
956	S	38.7	Very low	33.1	Very low	104 Å²	104	151.2 Å²	151.2	73%	0.727	78%	0.779	S	S	*	*			cis	-119.1	147.7	11.2	-70.2	0	0	0	0	111.2
957	N	35.6	Very low	32.7	Very low	127 Å²	127	151.7 Å²	151.7	68%	0.679	79%	0.787	S	S	*	*				72.3	127	50.3	-162	-0.3	0	0	0	113.2	R959	N957-R959 PolarHBondContact OD1-N 2.8Å
958	P	37.2	Very low	32.8	Very low	127 Å²	127	156 Å²	156	83%	0.825	79%	0.794	S	S	*	*				-130.4	145.5	126	37.6	-31.3	0	0	0	114.6
959	R	33.2	Very low	32.9	Very low	217 Å²	217	152.3 Å²	152.3	82%	0.819	79%	0.786	S	S	*	*			trans	-66.6	143.1	176.6	-53.8	160.7	176.9	143.7	-4.5	111.9	N957	N957-R959 PolarHBondContact OD1-N 2.8Å
960	I	34.3	Very low	32.8	Very low	177 Å²	177	153.1 Å²	153.1	91%	0.908	79%	0.791	S	S	*	*				-126.6	144.3	121.7	-67.5	-171.9	0	0	0	106.8
961	V	34.2	Very low	33	Very low	105 Å²	105	150.8 Å²	150.8	64%	0.636	79%	0.791	S	S	*	*			trans	-123.3	142.3	-167.7	91.8	0	0	0	0	111.8
962	H	32.6	Very low	32.9	Very low	147 Å²	147	150.7 Å²	150.7	68%	0.681	79%	0.792	S	S	*	*			trans	60.3	120.4	160.1	-74.3	-49.1	0	0	0	121.8
963	N	28.1	Very low	32.8	Very low	127 Å²	127	154 Å²	154	68%	0.679	79%	0.792	S	S	*	*				75.6	152.7	129.7	-55.9	-9	0	0	0	117
964	R	32.4	Very low	32.8	Very low	233 Å²	233	154.9 Å²	154.9	88%	0.879	80%	0.796	S	S	*	*			cis	-148.4	150.6	12.3	-142.2	164.9	-164.4	167.1	2.1	110.2
965	S	28.2	Very low	32.6	Very low	117 Å²	117	153.3 Å²	153.3	82%	0.818	79%	0.788	S	S	*	*			trans	-65.3	138.6	-178	-34.4	0	0	0	0	113.4
966	R	33.3	Very low	32.3	Very low	249 Å²	249	154.5 Å²	154.5	94%	0.94	79%	0.787	S	S	*	*			trans	-167.4	111.7	141.8	-112.1	166.2	-173.3	173.3	2.3	112.7
967	S	29.8	Very low	31.9	Very low	122 Å²	122	154.4 Å²	154.4	85%	0.853	79%	0.787	S	S	*	*			trans	-76.7	134.3	164.9	-45.4	0	0	0	0	110.2
968	R	32.8	Very low	31.4	Very low	253 Å²	253	155.7 Å²	155.7	96%	0.955	79%	0.794	S	S	*	*			trans	-162.3	153.3	150	-114.4	172.7	-173.5	-179.7	1.3	110.3
969	S	33.3	Very low	31.3	Very low	101 Å²	101	154.9 Å²	154.9	71%	0.706	79%	0.788	S	S	*	*			trans	-127.3	139.7	-162.4	52.4	0	0	0	0	113.7
970	N	30.5	Very low	31	Very low	161 Å²	161	148.8 Å²	148.8	86%	0.861	78%	0.779	S	S	*	*			trans	72.3	151.5	154.8	-69.7	-4.7	0	0	0	121.4
971	A	34.1	Very low	30.5	Very low	88 Å²	88	147.7 Å²	147.7	73%	0.727	78%	0.775	S	S	*	*			trans	71.6	134.5	166.8	0	0	0	0	0	117.4
972	N	31.5	Very low	30.3	Very low	139 Å²	139	148.6 Å²	148.6	74%	0.743	79%	0.786	S	S	*	*			cis	-163.2	150.4	-8	-122.6	-27	0	0	0	111.9
973	K	31	Very low	30	Very low	178 Å²	178	151.4 Å²	151.4	77%	0.774	80%	0.797	S	S	*	*			trans	49	130.7	158.6	-59.4	178.9	178.9	178.4	0	118.2
974	L	31.2	Very low	30	Very low	159 Å²	159	150.9 Å²	150.9	83%	0.832	80%	0.803	S	S	*	*				-155.3	177	67.4	-90.9	168.2	0	0	0	113.8
975	N	27.4	Very low	29.8	Very low	124 Å²	124	148.5 Å²	148.5	66%	0.663	80%	0.799	S	S	*	*			trans	-84.7	158.9	-170.1	-46.4	-34.6	0	0	0	112.4
976	F	29.3	Very low	29.5	Very low	189 Å²	189	147.5 Å²	147.5	83%	0.829	79%	0.791	S	S	*	*				-174.8	160.2	74.7	-113.5	-77.1	0	0	0	115.5
977	S	29.6	Very low	29	Very low	103 Å²	103	141.6 Å²	141.6	72%	0.72	78%	0.782	S	S	*	*			trans	54.9	107.7	149.8	58.3	0	0	0	0	122.8
978	N	25.8	Very low	29	Very low	153 Å²	153	144 Å²	144	82%	0.818	78%	0.784	S	S	*	*				-65.2	163.8	127.9	-108.6	-28.9	0	0	0	109.5
979	P	34	Very low	28.6	Very low	110 Å²	110	139.7 Å²	139.7	71%	0.714	78%	0.775	S	S	*	*				-158	162.6	53	44.1	-22.6	0	0	0	121.1
980	S	27.2	Very low	28.3	Very low	89 Å²	89	141.2 Å²	141.2	62%	0.622	78%	0.775	S	S	*	*			trans	56.4	133.5	136.7	69.5	0	0	0	0	124.9
981	N	25.1	Very low	28.2	Very low	155 Å²	155	141.3 Å²	141.3	83%	0.829	77%	0.768	S	S	*	*			trans	68.1	120	139.7	-67.9	-6.2	0	0	0	121.9
982	S	29.6	Very low	27.8	Very low	124 Å²	124	144.3 Å²	144.3	87%	0.867	77%	0.772	S	S	*	*				-162.4	164.9	116.7	31.7	0	0	0	0	111.6
983	F	24.9	Very low	27.7	Very low	206 Å²	206	145.9 Å²	145.9	90%	0.904	78%	0.779	S	S	*	*			trans	-100.1	172.7	-175.6	-109.9	-107.4	0	0	0	112.2
984	S	29.9	Very low	27.4	Very low	115 Å²	115	144.6 Å²	144.6	80%	0.804	78%	0.781	S	S	*	*			trans	92.4	159.1	165.4	82.3	0	0	0	0	117.9
985	K	27.1	Very low	27.5	Very low	184 Å²	184	145.7 Å²	145.7	80%	0.8	78%	0.779	S	S	*	*				179	146.5	-54	165.7	173.8	179.1	-173.8	0	108.1
986	C	22.7	Very low	27.5	Very low	96 Å²	96	146.5 Å²	146.5	65%	0.649	78%	0.783	S	S	*	*			trans	74	108.1	166.9	-79.9	0	0	0	0	119.9
987	T	22.8	Very low	27.7	Very low	124 Å²	124	145.9 Å²	145.9	76%	0.761	78%	0.78	S	S	*	*				47.2	115.1	123.6	59.9	0	0	0	0	121.2
988	I	29.6	Very low	27.7	Very low	172 Å²	172	147.1 Å²	147.1	88%	0.882	78%	0.779	S	S	*	*			trans	-132.2	136.8	133.1	-66	-175.5	0	0	0	108
989	E	23.6	Very low	27.7	Very low	164 Å²	164	149.8 Å²	149.8	77%	0.766	78%	0.779	S	S	*	*			trans	-92.2	142.6	169.2	-56	179.2	120	0	0	110.6
990	N	28	Very low	27.6	Very low	133 Å²	133	149.7 Å²	149.7	71%	0.711	78%	0.776	S	S	*	*				-175.6	117.1	123.9	-101.8	-62.1	0	0	0	114.2
991	K	28.1	Very low	27.7	Very low	163 Å²	163	151.6 Å²	151.6	71%	0.709	78%	0.78	S	S	*	*				36	115.6	128.5	-62	173.1	-169.1	151.9	0	119.9
992	N	24.6	Very low	27.9	Very low	151 Å²	151	151.5 Å²	151.5	81%	0.807	77%	0.774	S	S	*	*				61.9	122.7	126.3	-55.7	-6.4	0	0	0	120.3
993	L	29.8	Very low	28	Very low	172 Å²	172	151.6 Å²	151.6	90%	0.901	76%	0.764	S	S	*	*				-152.9	130.3	118.4	-113	166.5	0	0	0	110.5
994	N	25	Very low	28.2	Very low	151 Å²	151	148.2 Å²	148.2	81%	0.807	76%	0.755	S	S	*	*			trans	-105	141.7	-176.1	-164.9	3.4	0	0	0	110.6
995	K	33.3	Very low	27.9	Very low	181 Å²	181	151 Å²	151	79%	0.787	76%	0.758	S	S	*	*			trans	-146.9	107.7	173.6	-80.3	-172	177.1	176.5	0	111.8
996	N	26.7	Very low	27.8	Very low	141 Å²	141	148.8 Å²	148.8	75%	0.754	76%	0.76	S	S	*	*				35.9	118.5	120.9	-69.9	1.5	0	0	0	116.6
997	K	34.4	Very low	28	Very low	176 Å²	176	149.6 Å²	149.6	77%	0.765	77%	0.766	S	S	*	*				-174.6	156.6	50.4	-111.1	162.3	177.5	-173.1	0	112.6
998	N	30.4	Very low	28.1	Very low	130 Å²	130	150.7 Å²	150.7	70%	0.695	76%	0.761	S	S	*	*			trans	64.9	134.9	151.9	-59.2	10.6	0	0	0	117.6
999	Y	24.8	Very low	27.8	Very low	208 Å²	208	147.4 Å²	147.4	82%	0.816	75%	0.753	S	S	*	*				56.1	124.5	62.7	-75.2	-75.8	0	0	0	111.8
1000	T	31.2	Very low	28	Very low	109 Å²	109	146.6 Å²	146.6	67%	0.669	76%	0.759	S	S	*	*			cis	-138	129.5	20.4	44.5	0	0	0	0	110.7
1001	D	30.2	Very low	28	Very low	129 Å²	129	147.5 Å²	147.5	69%	0.69	76%	0.764	S	S	*	*				92	140.3	100.1	-61.4	-5.4	0	0	0	112.4
1002	E	30.2	Very low	27.9	Very low	153 Å²	153	147.1 Å²	147.1	72%	0.715	77%	0.768	S	S	*	*			cis	-155.9	152	-5.4	-115.9	-163.2	145.8	0	0	110.8
1003	L	30.8	Very low	27.9	Very low	126 Å²	126	143.8 Å²	143.8	66%	0.66	76%	0.757	S	S	*	*			trans	43.5	148.1	146.1	-50.5	173.5	0	0	0	121.7
1004	N	29.2	Very low	27.8	Very low	134 Å²	134	144.2 Å²	144.2	72%	0.717	75%	0.754	S	S	*	*			cis	-167.5	156.7	-25.2	-112	-14.7	0	0	0	106.1
1005	M	24.5	Very low	27.7	Very low	175 Å²	175	141.3 Å²	141.3	86%	0.862	75%	0.746	S	S	*	*			cis	-147.4	133.4	41.9	-71.5	177.2	58.4	0	0	114.2
1006	V	24.2	Very low	27.4	Very low	137 Å²	137	139.7 Å²	139.7	83%	0.83	75%	0.751	S	S	*	*			trans	-157	150.5	150.5	-107.1	0	0	0	0	107.8
1007	S	27.2	Very low	27.3	Very low	113 Å²	113	138 Å²	138	79%	0.79	75%	0.75	S	S	*	*			cis	-145.6	-168.5	1.8	-164.6	0	0	0	0	110.5
1008	K	24.4	Very low	26.8	Very low	147 Å²	147	135.1 Å²	135.1	64%	0.639	75%	0.747	S	S	*	*			trans	-68	149.9	167.2	-67.1	178.3	155.4	-160	0	112.4	E907	E907-K1008 IonicContact OE2-NZ 2.65Å
1009	S	23.8	Very low	26.6	Very low	103 Å²	103	136.7 Å²	136.7	72%	0.72	75%	0.748	S	S	*	*			trans	46.6	119.8	138.2	66.7	0	0	0	0	121.1
1010	T	27.2	Very low	26.5	Very low	147 Å²	147	135.9 Å²	135.9	90%	0.902	75%	0.752	S	S	*	*			trans	-122.6	118.7	135	48.6	0	0	0	0	109.4
1011	N	27.2	Very low	26.2	Very low	151 Å²	151	138.5 Å²	138.5	81%	0.807	76%	0.756	S	S	*	*			trans	-92.7	-176.6	158.2	-147.4	-5.5	0	0	0	107.7
1012	I	27.2	Very low	26	Very low	155 Å²	155	138.4 Å²	138.4	80%	0.795	77%	0.765	S	S	*	*			trans	76.5	128.1	176.1	-52.6	170.3	0	0	0	113
1013	S	24.1	Very low	25.7	Very low	82 Å²	82	136.3 Å²	136.3	57%	0.573	77%	0.767	S	S	*	*			cis	-165.4	156.4	-12.1	52.1	0	0	0	0	112.6
1014	H	27.9	Very low	25.4	Very low	180 Å²	180	136.6 Å²	136.6	83%	0.833	78%	0.775	S	S	*	*				-136.1	133.3	124.6	-83.4	-74	0	0	0	106.3
1015	S	23.7	Very low	25.4	Very low	91 Å²	91	137.9 Å²	137.9	64%	0.636	78%	0.781	S	S	*	*			cis	74.8	69.2	31.8	85.1	0	0	0	0	114.8
1016	T	27.2	Very low	25.6	Very low	146 Å²	146	135.6 Å²	135.6	90%	0.896	78%	0.778	S	S	*	*			trans	-116.1	121	157.3	39.4	0	0	0	0	109.5
1017	S	23.6	Very low	25.6	Very low	107 Å²	107	136.6 Å²	136.6	75%	0.748	78%	0.778	S	S	*	*			trans	-115.9	156.6	167.7	52.3	0	0	0	0	109.2
1018	V	24	Very low	25.7	Very low	114 Å²	114	135 Å²	135	69%	0.691	78%	0.78	S	S	*	*			trans	64.7	105.8	171	-151.1	0	0	0	0	115.6
1019	F	26.2	Very low	25.9	Very low	164 Å²	164	136.2 Å²	136.2	72%	0.719	79%	0.785	S	S	*	*				179.7	114.4	102.2	-106.2	-73.3	0	0	0	112.1	H1021	F1019-H1021 AromaticContact CD1-CD2 3.79Å; F1019-H1021 AromaticContact CE1-CD2 3.76Å; F1019-H1021 AromaticContact CE1-NE2 3.9Å
1020	E	21.8	Very low	26.1	Very low	191 Å²	191	138 Å²	138	89%	0.893	79%	0.786	S	S	*	*			trans	-91.4	92.9	159.8	-73.6	-171.4	129	0	0	109.6
1021	H	25.5	Very low	26.2	Very low	164 Å²	164	137.3 Å²	137.3	76%	0.759	78%	0.778	S	S	*	*			trans	-141.2	99.2	166.2	-85.1	-11.1	0	0	0	109.6	F1019	F1019-H1021 AromaticContact CD1-CD2 3.79Å; F1019-H1021 AromaticContact CE1-CD2 3.76Å; F1019-H1021 AromaticContact CE1-NE2 3.9Å
1022	S	26.7	Very low	26.2	Very low	127 Å²	127	138.6 Å²	138.6	89%	0.888	78%	0.784	S	S	*	*			trans	-118.9	41.4	178.3	48.6	0	0	0	0	112.4
1023	S	23.6	Very low	26.3	Very low	108 Å²	108	137.4 Å²	137.4	76%	0.755	78%	0.778	S	S	*	*			trans	-103.8	107.1	169.9	-63.2	0	0	0	0	110.8
1024	T	25.4	Very low	26.4	Very low	132 Å²	132	143.9 Å²	143.9	81%	0.81	79%	0.79	S	S	*	*			trans	40	109.9	152.9	58.5	0	0	0	0	118.8
1025	N	27.4	Very low	26.4	Very low	161 Å²	161	142.5 Å²	142.5	86%	0.861	79%	0.787	S	S	*	*				-151	151.8	122.9	-131.1	-33.4	0	0	0	113.6
1026	T	29.2	Very low	26.6	Very low	128 Å²	128	148.4 Å²	148.4	79%	0.785	80%	0.795	S	S	*	*			trans	-97	170.2	-174.3	48.6	0	0	0	0	112.7	G1028	T1026-G1028 PolarHBondContact O-N 3.45Å
1027	N	25.2	Very low	26.7	Very low	157 Å²	157	146.3 Å²	146.3	84%	0.84	79%	0.787	S	S	*	*			trans	-45.2	104.8	-177.6	-73.2	-63.6	0	0	0	115.4
1028	G	27.9	Very low	27	Very low	80 Å²	80	152 Å²	152	83%	0.825	79%	0.792	S	S	*	*			trans	-105.1	93.2	162.9	0	0	0	0	0	111.5	T1026	T1026-G1028 PolarHBondContact O-N 3.45Å
1029	K	30.1	Very low	27.3	Very low	172 Å²	172	154.9 Å²	154.9	75%	0.748	80%	0.798	S	S	*	*			trans	-81.4	140.1	177.3	-71.8	-178.9	178.1	176.4	0	111.7
1030	N	27.7	Very low	27.4	Very low	140 Å²	140	152.1 Å²	152.1	75%	0.749	80%	0.799	S	S	*	*			trans	65.2	139.2	162.6	-50.9	-14	0	0	0	114.9
1031	N	29.8	Very low	27.8	Very low	134 Å²	134	148.8 Å²	148.8	72%	0.717	79%	0.791	S	S	*	*			cis	-148.3	140.5	45.4	-75.7	-64.8	0	0	0	113.4	I1033	N1031-I1033 HydrophobicContact CB-CD1 4.5Å; N1031-I1033 HydrophobicContact CB-CG1 4.27Å
1032	N	25.5	Very low	28.1	Very low	177 Å²	177	144.6 Å²	144.6	95%	0.947	79%	0.793	S	S	*	*			trans	-82.8	109.3	158.7	-93.8	-38.9	0	0	0	109.4
1033	I	30.2	Very low	28.2	Very low	130 Å²	130	146.1 Å²	146.1	67%	0.667	79%	0.786	S	S	*	*			trans	-127.7	107.2	166.7	-60.8	-179.8	0	0	0	109	N1031 I1035	N1031-I1033 HydrophobicContact CB-CD1 4.5Å; N1031-I1033 HydrophobicContact CB-CG1 4.27Å; I1033-I1035 HydrophobicContact CG2-CD1 3.97Å; I1033-I1035 HydrophobicContact CG2-CG1 3.95Å
1034	R	25.7	Very low	28.5	Very low	219 Å²	219	148.8 Å²	148.8	83%	0.826	79%	0.786	S	S	*	*			trans	-117.1	75.4	173.2	-169	-178.5	-172	165.1	5.2	110.5
1035	I	29.3	Very low	28.7	Very low	151 Å²	151	152.7 Å²	152.7	77%	0.774	79%	0.786	S	S	*	*			trans	-87	142.2	169.2	-64.4	174.1	0	0	0	108.6	I1033	I1033-I1035 HydrophobicContact CG2-CD1 3.97Å; I1033-I1035 HydrophobicContact CG2-CG1 3.95Å
1036	R	26.3	Very low	28.9	Very low	214 Å²	214	151.9 Å²	151.9	81%	0.808	78%	0.779	S	S	*	*			trans	-140.8	107.3	-172.5	-154.9	-177.3	-167.2	-171.3	3.1	112.7
1037	S	30.8	Very low	28.9	Very low	103 Å²	103	152.2 Å²	152.2	72%	0.72	78%	0.776	S	S	*	*			trans	-124.7	133.3	163.9	44.1	0	0	0	0	106.8
1038	R	29.3	Very low	29.1	Very low	225 Å²	225	150.3 Å²	150.3	85%	0.849	77%	0.77	S	S	*	*				57.4	118.7	57.8	-70.2	-169.7	174.3	-169	0.2	111
1039	Q	30	Very low	29.2	Very low	176 Å²	176	155.2 Å²	155.2	82%	0.822	77%	0.769	S	S	*	*			cis	-133.8	-175.7	1.9	-87.7	139.3	-64.7	0	0	108.5
1040	S	28.8	Very low	29	Very low	105 Å²	105	156.5 Å²	156.5	73%	0.734	77%	0.774	S	S	*	*			cis	-148	133	21.1	54.3	0	0	0	0	111.8
1041	V	29.4	Very low	28.9	Very low	121 Å²	121	157.9 Å²	157.9	73%	0.733	78%	0.777	S	S	*	*				62.3	111.4	98.9	-174.6	0	0	0	0	115.8
1042	G	31.1	Very low	28.8	Very low	77 Å²	77	158.6 Å²	158.6	79%	0.794	78%	0.779	S	S	*	*			trans	-144.1	131.3	152.1	0	0	0	0	0	108.7
1043	Q	29.8	Very low	28.9	Very low	158 Å²	158	156.3 Å²	156.3	74%	0.738	77%	0.765	S	S	*	*			trans	-101.6	160.8	177.5	-57.9	157.7	-62.9	0	0	108.2
1044	H	30.3	Very low	28.7	Very low	165 Å²	165	156.6 Å²	156.6	76%	0.764	77%	0.768	S	S	*	*			cis	-136.3	-170.3	13.8	-75.3	-88.6	0	0	0	108.9
1045	R	29.7	Very low	28.7	Very low	214 Å²	214	152.4 Å²	152.4	81%	0.808	76%	0.762	S	S	*	*			cis	-166.3	146.7	22.4	-153.6	176.9	-177.4	163.5	-1.1	111.2
1046	M	31.7	Very low	28.4	Very low	143 Å²	143	152.2 Å²	152.2	70%	0.704	76%	0.758	S	S	*	*			trans	61	129.7	173.9	-51.2	-44.6	-164.1	0	0	116.6
1047	N	27.7	Very low	28.4	Very low	135 Å²	135	150.4 Å²	150.4	72%	0.722	76%	0.756	S	S	*	*			cis	77	129.2	44.7	-64.3	-3.7	0	0	0	113.5
1048	T	29.5	Very low	28.1	Very low	117 Å²	117	152.7 Å²	152.7	72%	0.718	76%	0.756	S	S	*	*			cis	-164	154.6	-5.1	9.6	0	0	0	0	112.6
1049	K	29.6	Very low	28	Very low	184 Å²	184	151.7 Å²	151.7	80%	0.8	75%	0.752	S	S	*	*			trans	74.3	141.6	166.1	-66.1	177.5	178.8	-177.5	0	116.8
1050	F	26.3	Very low	27.9	Very low	198 Å²	198	151.9 Å²	151.9	87%	0.868	75%	0.753	S	S	*	*			cis	-105.5	156	11.3	-89.3	-104.9	0	0	0	115.6
1051	Q	25.7	Very low	27.8	Very low	170 Å²	170	157.8 Å²	157.8	79%	0.794	76%	0.759	S	S	*	*			trans	-117.6	-177.7	156.8	-75.2	-177.3	-76.2	0	0	107.9
1052	I	28.4	Very low	28.1	Very low	148 Å²	148	155.3 Å²	155.3	76%	0.759	76%	0.758	S	S	*	*			trans	84.5	101.4	172.8	-51.9	178.8	0	0	0	110.6
1053	I	26.5	Very low	28.2	Very low	130 Å²	130	157 Å²	157	67%	0.667	76%	0.755	S	S	*	*				74.4	135.6	60.9	-60.4	161.6	0	0	0	108.6
1054	D	27.7	Very low	28.1	Very low	136 Å²	136	160.9 Å²	160.9	73%	0.727	76%	0.763	S	S	*	*			cis	-103.8	178.2	15.6	-75.1	-74.9	0	0	0	113.6
1055	N	24.1	Very low	27.9	Very low	130 Å²	130	158.1 Å²	158.1	70%	0.695	76%	0.762	S	S	*	*			cis	59.7	154.9	39.9	-85.7	39.9	0	0	0	112.2
1056	E	24.1	Very low	27.9	Very low	147 Å²	147	156 Å²	156	69%	0.687	76%	0.761	S	S	*	*			cis	-170.5	141.6	-17.5	170.1	166	-142	0	0	107.1
1057	F	26.1	Very low	27.6	Very low	176 Å²	176	156.3 Å²	156.3	77%	0.772	76%	0.764	S	S	*	*			trans	170.7	113.4	163.4	-97.5	-63.5	0	0	0	106.2
1058	E	24.5	Very low	27.5	Very low	152 Å²	152	157.7 Å²	157.7	71%	0.71	77%	0.766	S	S	*	*			cis	59	63.6	44.5	-78.7	-100.4	128.7	0	0	113.2
1059	R	26.4	Very low	27.4	Very low	204 Å²	204	159.2 Å²	159.2	77%	0.77	77%	0.77	S	S	*	*			trans	-156.4	136.8	148.9	-107.5	174.5	-72.7	-178.6	-0.7	106.9
1060	E	28.3	Very low	27.3	Very low	180 Å²	180	159.5 Å²	159.5	84%	0.841	78%	0.775	S	S	*	*			cis	-133.5	152	13.3	-57.8	-177.5	138.1	0	0	111.9
1061	R	27.2	Very low	27.4	Very low	228 Å²	228	155.7 Å²	155.7	86%	0.86	77%	0.772	S	S	*	*			trans	-105.9	125.2	153.9	-62.2	-173.7	-168.7	-169	5.3	107.1
1062	G	35.3	Very low	27.4	Very low	70 Å²	70	155.6 Å²	155.6	72%	0.722	78%	0.775	S	S	*	*			trans	-87.7	175.3	175.9	0	0	0	0	0	113.3
1063	P	34	Very low	27.4	Very low	112 Å²	112	156.3 Å²	156.3	73%	0.727	78%	0.781	S	S	*	*			trans	-88.3	165.6	144.6	14	6.4	0	0	0	109.4
1064	W	27.4	Very low	27.5	Very low	240 Å²	240	155.8 Å²	155.8	91%	0.909	79%	0.789	S	S	*	*			cis	-124.5	146.5	25	-78.6	67	0	0	0	113.8
1065	S	25.2	Very low	27.5	Very low	106 Å²	106	154.7 Å²	154.7	74%	0.741	79%	0.792	S	S	*	*			trans	-104.7	134	171.3	48.5	0	0	0	0	110.8
1066	Q	30	Very low	27.8	Very low	169 Å²	169	157.7 Å²	157.7	79%	0.79	80%	0.799	S	S	*	*			trans	-161.3	132	151.6	-115	172.4	-13.8	0	0	111.7
1067	I	25.5	Very low	28.2	Very low	150 Å²	150	158.7 Å²	158.7	77%	0.769	81%	0.809	S	S	*	*			trans	59	100.3	156.8	-51	158	0	0	0	114.8
1068	Q	26.4	Very low	28.3	Very low	164 Å²	164	153.7 Å²	153.7	77%	0.766	81%	0.807	S	S	*	*				-155.9	136.5	71.4	-78.8	-172.7	-23.9	0	0	113.2
1069	N	26.5	Very low	28.6	Very low	150 Å²	150	153.9 Å²	153.9	80%	0.802	81%	0.811	S	S	*	*				160.8	117.7	118.8	-87.8	-38.5	0	0	0	112
1070	Q	27.6	Very low	28.7	Very low	190 Å²	190	151.1 Å²	151.1	89%	0.888	81%	0.811	S	S	*	*			trans	-142.1	157.3	155.8	-78.4	-162.7	-4.6	0	0	109.6
1071	S	28	Very low	28.8	Very low	117 Å²	117	151.4 Å²	151.4	82%	0.818	81%	0.813	S	S	*	*			trans	52.5	100.1	174.1	59.5	0	0	0	0	117.9
1072	I	26.9	Very low	28.8	Very low	168 Å²	168	149.2 Å²	149.2	86%	0.862	81%	0.812	S	S	*	*			trans	-111.8	109.1	137.6	-64.1	176.4	0	0	0	106.1
1073	N	27.1	Very low	28.5	Very low	163 Å²	163	153.2 Å²	153.2	87%	0.872	82%	0.816	S	S	*	*			trans	-169.9	73.7	163.1	-112.2	-9.5	0	0	0	112.6
1074	S	29.8	Very low	28.2	Very low	119 Å²	119	153.9 Å²	153.9	83%	0.832	81%	0.814	S	S	*	*			trans	-162.5	146.1	158.4	46.3	0	0	0	0	109
1075	S	26.7	Very low	28	Very low	113 Å²	113	152.5 Å²	152.5	79%	0.79	82%	0.817	S	S	*	*			trans	-136.4	161.3	-174.5	-56.1	0	0	0	0	112.2
1076	K	31.8	Very low	28.1	Very low	194 Å²	194	151.5 Å²	151.5	84%	0.843	81%	0.811	S	S	*	*			trans	86.9	151.5	170.3	-55.1	-178.4	176.7	-178.2	0	116.4
1077	N	31.6	Very low	28	Very low	168 Å²	168	151.8 Å²	151.8	90%	0.898	81%	0.809	S	S	*	*			trans	71.3	131.4	-178.1	-50	-8.4	0	0	0	114.4
1078	G	29.3	Very low	28.1	Very low	71 Å²	71	149.3 Å²	149.3	73%	0.732	81%	0.811	S	S	*	*			cis	168.7	111.4	-11.5	0	0	0	0	0	115.2
1079	I	29.5	Very low	28.3	Very low	155 Å²	155	149.1 Å²	149.1	80%	0.795	82%	0.815	S	S	*	*			trans	45.9	95.9	143.5	-51.2	172.8	0	0	0	118
1080	N	27.9	Very low	28.4	Very low	146 Å²	146	149 Å²	149	78%	0.781	81%	0.81	S	S	*	*				167.6	165.1	117.6	-94.9	-32.2	0	0	0	113.8
1081	Q	31.5	Very low	28.7	Very low	187 Å²	187	144.6 Å²	144.6	87%	0.874	80%	0.8	S	S	*	*			trans	74.1	112.6	-169.4	-55.8	177.5	-1.1	0	0	112.1
1082	Q	26.7	Very low	29.2	Very low	182 Å²	182	142.6 Å²	142.6	85%	0.85	79%	0.786	S	S	*	*			cis	72.7	77.1	18.3	-150.1	-174.5	26.3	0	0	114.8
1083	L	28.7	Very low	29.7	Very low	153 Å²	153	139.5 Å²	139.5	80%	0.801	77%	0.771	S	S	*	*			trans	-172.2	150.4	136	-100.5	157.6	0	0	0	111.8
1084	D	28.4	Very low	30.4	Very low	126 Å²	126	139.3 Å²	139.3	67%	0.674	77%	0.765	S	S	*	*			trans	57.6	69.7	159.2	-58.3	-22.2	0	0	0	122	S1086	D1084-S1086 VanDerWaalsContact C-N 3.26Å; D1084-S1086 PolarHBondContact O-N 3.5Å
1085	E	24	Very low	31	Very low	211 Å²	211	140.3 Å²	140.3	99%	0.986	76%	0.757	S	S	*	*			trans	-73.4	78	146.8	-75	-164.9	140.4	0	0	110.8
1086	S	26.2	Very low	32.4	Very low	86 Å²	86	139.1 Å²	139.1	60%	0.601	75%	0.745	S	S	*	*			trans	-144.4	30.4	177.9	63.9	0	0	0	0	115.5	D1084	D1084-S1086 VanDerWaalsContact C-N 3.26Å; D1084-S1086 PolarHBondContact O-N 3.5Å
1087	K	27.5	Very low	33.9	Very low	175 Å²	175	133.6 Å²	133.6	76%	0.761	73%	0.727	S	S	*	*			trans	-151.6	80.6	172.4	-108.7	152.5	-172.3	172.7	0	114
1088	A	28.3	Very low	35.8	Very low	97 Å²	97	133.5 Å²	133.5	80%	0.802	72%	0.715	S	S	*	*	S	Bend	trans	-139.6	40.4	172.9	0	0	0	0	0	112.5
1089	N	30.6	Very low	37.5	Very low	160 Å²	160	136.2 Å²	136.2	86%	0.856	71%	0.709	S	S	*	*	S	Bend	trans	-155.6	39.2	174.8	-101.6	-27.1	0	0	0	111.9
1090	Q	29	Very low	39.3	Very low	147 Å²	147	134 Å²	134	69%	0.687	70%	0.698	S	S	*	*			trans	-143.2	78.9	176.5	-70.3	-171	-48.8	0	0	110.2
1091	S	32.3	Very low	41.3	Very low	99 Å²	99	131.1 Å²	131.1	69%	0.692	68%	0.682	S	S	*	*	S	Bend	trans	-155	-17.6	169.4	62.4	0	0	0	0	115.6	D1093	S1091-D1093 VanDerWaalsContact C-N 3.34Å
1092	S	39.5	Very low	43.6	Very low	74 Å²	74	124.7 Å²	124.7	52%	0.517	65%	0.653	S	S	.	*	H	α-helix	trans	-71	-28.7	170.5	45.5	0	0	0	0	113.6	T1096	S1092-T1096 WeakPolarHBondContact O-CG2 3.38Å; S1092-T1096 PolarHBondContact O-OG1 3.31Å
1093	D	37.8	Very low	45.9	Very low	104 Å²	104	125 Å²	125	56%	0.556	65%	0.646	S	S	*	*	H	α-helix	trans	-91.7	-30.3	-161.4	-67.2	17.9	0	0	0	111.9	S1091 T1096 V1097	S1091-D1093 VanDerWaalsContact C-N 3.34Å; D1093-T1096 WeakPolarHBondContact CA-OG1 3.33Å; D1093-T1096 PolarHBondContact O-OG1 2.82Å; D1093-T1096 VanDerWaalsContact O-OG1 3.12Å; D1093-V1097 WeakPolarHBondContact O-CB 3.39Å; D1093-V1097 WeakPolarHBondContact O-CG2 3.5Å; D1093-V1097 PolarHBondContact O-N 3.42Å
1094	E	40.9	Very low	48.2	Very low	159 Å²	159	122.1 Å²	122.1	74%	0.743	63%	0.63	S	S	*	*	H	α-helix	trans	-72	-39.9	177	-64.9	-162.6	141.2	0	0	112.3	V1097 Y1098	E1094-V1097 PolarHBondContact O-N 3.01Å; E1094-Y1098 VanDerWaalsContact O-CB 3.26Å; E1094-Y1098 WeakPolarHBondContact O-CB 3.33Å; E1094-Y1098 PolarHBondContact O-N 2.89Å
1095	E	42.3	Very low	50.5	Low	139 Å²	139	122.5 Å²	122.5	65%	0.65	63%	0.626	S	S	*	*	H	α-helix	trans	-68.5	-38	177.5	-171.2	169	-138.5	0	0	111.5	H1099	E1095-H1099 WeakPolarHBondContact O-CB 3.41Å; E1095-H1099 PolarHBondContact O-N 2.84Å
1096	T	56.6	Low	52.7	Low	88 Å²	88	120.3 Å²	120.3	54%	0.54	61%	0.609	S	S	.	*	H	α-helix	trans	-70.5	-40	174.1	51	0	0	0	0	112.5	S1092 D1093 H1099 L1100	S1092-T1096 WeakPolarHBondContact O-CG2 3.38Å; S1092-T1096 PolarHBondContact O-OG1 3.31Å; D1093-T1096 WeakPolarHBondContact CA-OG1 3.33Å; D1093-T1096 PolarHBondContact O-OG1 2.82Å; D1093-T1096 VanDerWaalsContact O-OG1 3.12Å; T1096-H1099 PolarHBondContact O-N 3.06Å; T1096-L1100 WeakPolarHBondContact O-CB 3.43Å; T1096-L1100 PolarHBondContact O-N 3.27Å
1097	V	63.2	Low	54.7	Low	78 Å²	78	120.9 Å²	120.9	47%	0.473	60%	0.604	S	S	.	*	H	α-helix	trans	-65.6	-37.7	172.8	166.1	0	0	0	0	112	D1093 E1094 L1100 N1101	D1093-V1097 WeakPolarHBondContact O-CB 3.39Å; D1093-V1097 WeakPolarHBondContact O-CG2 3.5Å; D1093-V1097 PolarHBondContact O-N 3.42Å; E1094-V1097 PolarHBondContact O-N 3.01Å; V1097-L1100 PolarHBondContact O-N 2.77Å; V1097-N1101 WeakPolarHBondContact O-CB 3.18Å; V1097-N1101 PolarHBondContact O-N 2.74Å; V1097-N1101 PolarHBondContact O-ND2 3.03Å
1098	Y	70.6	Confident	56.5	Low	167 Å²	167	115.1 Å²	115.1	66%	0.655	59%	0.589	S	S	*	*	H	α-helix	trans	-64.1	-46.5	174.8	-170.5	-96.1	0	0	0	111.1	E1094 L1100 N1101 E1102	E1094-Y1098 VanDerWaalsContact O-CB 3.26Å; E1094-Y1098 WeakPolarHBondContact O-CB 3.33Å; E1094-Y1098 PolarHBondContact O-N 2.89Å; Y1098-L1100 VanDerWaalsContact C-N 3.3Å; Y1098-L1100 PolarHBondContact O-N 3.04Å; Y1098-N1101 PolarHBondContact O-N 3.37Å; Y1098-E1102 PolarHBondContact O-N 2.98Å
1099	H	65.8	Low	58	Low	128 Å²	128	116.7 Å²	116.7	59%	0.593	58%	0.584	S	S	*	*	H	α-helix	trans	-61.7	-35.5	172.7	-94.4	-65.5	0	0	0	113.1	E1095 T1096 R1103	E1095-H1099 WeakPolarHBondContact O-CB 3.41Å; E1095-H1099 PolarHBondContact O-N 2.84Å; T1096-H1099 PolarHBondContact O-N 3.06Å; H1099-R1103 VanDerWaalsContact O-CB 3.3Å; H1099-R1103 WeakPolarHBondContact O-CB 3.48Å; H1099-R1103 PolarHBondContact O-N 3.01Å
1100	L	68.2	Low	59.2	Low	107 Å²	107	116.7 Å²	116.7	56%	0.56	58%	0.576	S	S	*	*	H	α-helix	trans	-66.1	-46.4	175.1	-148.9	79.9	0	0	0	111.1	T1096 V1097 Y1098 R1103 I1104	T1096-L1100 WeakPolarHBondContact O-CB 3.43Å; T1096-L1100 PolarHBondContact O-N 3.27Å; V1097-L1100 PolarHBondContact O-N 2.77Å; Y1098-L1100 VanDerWaalsContact C-N 3.3Å; Y1098-L1100 PolarHBondContact O-N 3.04Å; L1100-R1103 WeakPolarHBondContact O-CB 3.32Å; L1100-R1103 PolarHBondContact O-N 3.18Å; L1100-R1103 VanDerWaalsContact O-N 3.16Å; L1100-I1104 HydrophobicContact CD2-CD1 4.47Å; L1100-I1104 HydrophobicContact CG-CD1 4.35Å; L1100-I1104 VanDerWaalsContact O-CG1 3.3Å; L1100-I1104 WeakPolarHBondContact O-CG1 3.37Å; L1100-I1104 PolarHBondContact O-N 3.04Å
1101	N	69	Low	60.1	Low	86 Å²	86	116.9 Å²	116.9	46%	0.46	58%	0.575	S	S	.	*	H	α-helix	trans	-63.7	-40.7	178.1	-89.9	-43.8	0	0	0	112.7	V1097 Y1098 R1103 I1104 K1105	V1097-N1101 WeakPolarHBondContact O-CB 3.18Å; V1097-N1101 PolarHBondContact O-N 2.74Å; V1097-N1101 PolarHBondContact O-ND2 3.03Å; Y1098-N1101 PolarHBondContact O-N 3.37Å; N1101-R1103 VanDerWaalsContact C-N 3.33Å; N1101-I1104 PolarHBondContact O-N 3.46Å; N1101-K1105 WeakPolarHBondContact O-CG 3.25Å; N1101-K1105 PolarHBondContact O-N 3.43Å
1102	E	79.4	Confident	60.8	Low	53 Å²	53	119.2 Å²	119.2	25%	0.248	58%	0.579	C	S	.	*	H	α-helix	trans	-63.9	-38.7	172.3	-103.9	-63.3	103.8	0	0	112	Y1098 K1105 R1106	Y1098-E1102 PolarHBondContact O-N 2.98Å; E1102-K1105 PolarHBondContact O-N 3.14Å; E1102-R1106 WeakPolarHBondContact O-CB 3.31Å; E1102-R1106 VanDerWaalsContact O-CG 3.23Å; E1102-R1106 WeakPolarHBondContact O-CG 3.46Å; E1102-R1106 PolarHBondContact O-N 3.38Å; E1102-R1106 IonicContact OE2-CZ 2.65Å; E1102-R1106 IonicContact OE2-NE 2.76Å; E1102-R1106 PolarHBondContact OE2-NE 3Å; E1102-R1106 IonicContact OE2-NH2 3.96Å; E1102-R1106 PolarHBondContact OE2-NH2 3.06Å
1103	R	74.9	Confident	60.8	Low	188 Å²	188	124.8 Å²	124.8	71%	0.709	60%	0.595	S	S	*	*	H	α-helix	trans	-66.6	-37.6	176.3	-161.5	169.6	-173.6	162.4	-0.8	111.8	H1099 L1100 N1101 L1107	H1099-R1103 VanDerWaalsContact O-CB 3.3Å; H1099-R1103 WeakPolarHBondContact O-CB 3.48Å; H1099-R1103 PolarHBondContact O-N 3.01Å; L1100-R1103 WeakPolarHBondContact O-CB 3.32Å; L1100-R1103 PolarHBondContact O-N 3.18Å; L1100-R1103 VanDerWaalsContact O-N 3.16Å; N1101-R1103 VanDerWaalsContact C-N 3.33Å; R1103-L1107 VanDerWaalsContact O-CG 3.3Å; R1103-L1107 WeakPolarHBondContact O-CG 3.25Å; R1103-L1107 PolarHBondContact O-N 3.27Å
1104	I	78.3	Confident	60.6	Low	93 Å²	93	126.9 Å²	126.9	48%	0.477	62%	0.617	S	S	.	*	H	α-helix	trans	-66.5	-47.2	173.5	-69.6	163.5	0	0	0	110.9	L1100 N1101 R1106 L1107 A1108	L1100-I1104 HydrophobicContact CD2-CD1 4.47Å; L1100-I1104 HydrophobicContact CG-CD1 4.35Å; L1100-I1104 VanDerWaalsContact O-CG1 3.3Å; L1100-I1104 WeakPolarHBondContact O-CG1 3.37Å; L1100-I1104 PolarHBondContact O-N 3.04Å; N1101-I1104 PolarHBondContact O-N 3.46Å; I1104-R1106 VanDerWaalsContact C-N 3.32Å; I1104-R1106 PolarHBondContact O-N 3.12Å; I1104-L1107 PolarHBondContact O-N 3.39Å; I1104-L1107 VanDerWaalsContact O-N 3.1Å; I1104-A1108 PolarHBondContact O-N 2.73Å
1105	K	75.5	Confident	61.6	Low	133 Å²	133	125.3 Å²	125.3	58%	0.578	61%	0.611	S	S	*	*	H	α-helix	trans	-56	-44.6	174.5	-78.2	176.6	177.1	176.6	0	112.2	N1101 E1102 L1107 A1108 L1109	N1101-K1105 WeakPolarHBondContact O-CG 3.25Å; N1101-K1105 PolarHBondContact O-N 3.43Å; E1102-K1105 PolarHBondContact O-N 3.14Å; K1105-L1107 VanDerWaalsContact C-N 3.32Å; K1105-L1107 PolarHBondContact O-N 2.8Å; K1105-A1108 PolarHBondContact O-N 3.07Å; K1105-L1109 WeakPolarHBondContact O-CB 3.23Å; K1105-L1109 PolarHBondContact O-N 2.78Å
1106	R	70.6	Confident	62.6	Low	166 Å²	166	124.5 Å²	124.5	63%	0.626	61%	0.609	S	S	*	*	H	α-helix	trans	-67.6	-28.4	177.5	-69.1	171.6	-165.2	-151.8	4.4	113.4	E1102 I1104 K1110	E1102-R1106 WeakPolarHBondContact O-CB 3.31Å; E1102-R1106 VanDerWaalsContact O-CG 3.23Å; E1102-R1106 WeakPolarHBondContact O-CG 3.46Å; E1102-R1106 PolarHBondContact O-N 3.38Å; E1102-R1106 IonicContact OE2-CZ 2.65Å; E1102-R1106 IonicContact OE2-NE 2.76Å; E1102-R1106 PolarHBondContact OE2-NE 3Å; E1102-R1106 IonicContact OE2-NH2 3.96Å; E1102-R1106 PolarHBondContact OE2-NH2 3.06Å; I1104-R1106 VanDerWaalsContact C-N 3.32Å; I1104-R1106 PolarHBondContact O-N 3.12Å; R1106-K1110 PolarHBondContact O-N 2.78Å
1107	L	67.7	Low	63	Low	97 Å²	97	126.6 Å²	126.6	51%	0.508	61%	0.612	S	S	.	*	H	α-helix	trans	-76.1	-42.1	172.6	-74.1	167.4	0	0	0	111.9	R1103 I1104 K1105 L1109 K1110 F1111	R1103-L1107 VanDerWaalsContact O-CG 3.3Å; R1103-L1107 WeakPolarHBondContact O-CG 3.25Å; R1103-L1107 PolarHBondContact O-N 3.27Å; I1104-L1107 PolarHBondContact O-N 3.39Å; I1104-L1107 VanDerWaalsContact O-N 3.1Å; K1105-L1107 VanDerWaalsContact C-N 3.32Å; K1105-L1107 PolarHBondContact O-N 2.8Å; L1107-L1109 PolarHBondContact O-N 2.81Å; L1107-K1110 WeakPolarHBondContact O-CA 3.28Å; L1107-K1110 WeakPolarHBondContact O-CB 3.25Å; L1107-K1110 PolarHBondContact O-N 2.87Å; L1107-F1111 PolarHBondContact O-N 2.94Å
1108	A	65.2	Low	63	Low	54 Å²	54	129.4 Å²	129.4	45%	0.446	62%	0.621	S	S	.	*	H	α-helix	trans	-61.3	-41.8	174	0	0	0	0	0	112.1	I1104 K1105 K1110 F1111 N1112	I1104-A1108 PolarHBondContact O-N 2.73Å; K1105-A1108 PolarHBondContact O-N 3.07Å; A1108-K1110 PolarHBondContact O-N 2.93Å; A1108-F1111 PolarHBondContact O-N 2.8Å; A1108-N1112 PolarHBondContact O-N 2.83Å
1109	L	61.4	Low	62.5	Low	130 Å²	130	127.1 Å²	127.1	68%	0.681	62%	0.619	S	S	*	*	H	α-helix	trans	-67.5	-16.4	173.1	-82.1	164.5	0	0	0	114.3	K1105 L1107	K1105-L1109 WeakPolarHBondContact O-CB 3.23Å; K1105-L1109 PolarHBondContact O-N 2.78Å; L1107-L1109 PolarHBondContact O-N 2.81Å
1110	K	55	Low	62.3	Low	160 Å²	160	127 Å²	127	70%	0.696	62%	0.62	S	S	*	*	H	α-helix	trans	-84.2	-41.9	168.5	-97.9	-171.2	170.2	-170.5	0	112.2	R1106 L1107 A1108 K1113	R1106-K1110 PolarHBondContact O-N 2.78Å; L1107-K1110 WeakPolarHBondContact O-CA 3.28Å; L1107-K1110 WeakPolarHBondContact O-CB 3.25Å; L1107-K1110 PolarHBondContact O-N 2.87Å; A1108-K1110 PolarHBondContact O-N 2.93Å; K1110-K1113 PolarHBondContact O-N 3.22Å
1111	F	47.3	Very low	61.8	Low	152 Å²	152	128.4 Å²	128.4	67%	0.667	63%	0.625	S	S	*	*	H	α-helix	trans	-67.5	-36.1	178.7	-97.3	-82.7	0	0	0	112.9	L1107 A1108 K1113 S1114	L1107-F1111 PolarHBondContact O-N 2.94Å; A1108-F1111 PolarHBondContact O-N 2.8Å; F1111-K1113 PolarHBondContact O-N 2.8Å; F1111-S1114 PolarHBondContact O-N 3.22Å; F1111-S1114 PolarHBondContact O-OG 2.88Å; F1111-S1114 VanDerWaalsContact O-OG 3.1Å
1112	N	46.7	Very low	61.3	Low	147 Å²	147	131.7 Å²	131.7	79%	0.786	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.8	21.3	171.6	-73.7	-4.9	0	0	0	113.7	A1108	A1108-N1112 PolarHBondContact O-N 2.83Å
1113	K	40.5	Very low	59.8	Low	192 Å²	192	138.3 Å²	138.3	84%	0.835	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-135.2	15.3	174.5	-100.9	-174.9	176.4	-179.1	0	113.7	K1110 F1111	K1110-K1113 PolarHBondContact O-N 3.22Å; F1111-K1113 PolarHBondContact O-N 2.8Å
1114	S	34.2	Very low	58.4	Low	147 Å²	147	133.7 Å²	133.7	100%	1.028	67%	0.666	S	S	*	*			trans	-120.7	0	168.7	58.4	0	0	0	0	110.1	F1111	F1111-S1114 PolarHBondContact O-N 3.22Å; F1111-S1114 PolarHBondContact O-OG 2.88Å; F1111-S1114 VanDerWaalsContact O-OG 3.1Å

Retrieved 1,114 of 1,114 residues in 448.8 ms (Link to these results)

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