A0A096MJT2_RAT Loading...

Tyrosine-protein phosphatase non-receptor type

May act at junctions between the membrane and the cytoskeleton.

AlphaFold DB (F1LQQ5), UniProt , Accession A0A096MJT2, Species RAT (Rattus norvegicus, Rat), Gene Ptpn3, Length 1,018 aa.

						>A0A096MJT2_RAT|A0A096MJT2|Ptpn3
MGRKVQSERRKAGVGGGGRGRLERRPLGALKALGRANLPGVLGPAKEPRDSQLSHGAAGVGATPNSATEPPSKARCHFRFVVRQALAIPRHAIPESQAHSYSAAVMTSRLRALGGRINNIRTSELPKEKTRSEVTCSIRFLDGLVQTFKVNKQDLGQSLLDMAYGHLGVTEKEYFGLQHGDDPVDSPRWLEASKPLRKQLKGGLPCILHFRVRYFIPDPNTLQQEQTRHLYFLQLKMDVCEGRLTCPLNSAVVLASYAVQSHIGDFNSSIHHPGYLADSQFIPDQNDDFLSKVESLHEQHSGLKQSEAESCYINIARTLDFYGVELHGGRDLHNLDLMIGIASAGIAVYRKYICTSFYPWVNILKISFKRKKFFIHQRQKQAESREHIVAFNMLNYRSCKNLWKSCVEHHSFFQAKKLLPQEKNVLSQYWTLGSRNPKKSVNNQYCKKVIGGMVWNPVMRRSLSVERLETKSLPSRSPPITPNWRSPRLRHEIRKPRHSSADNLANEMTYITETEDVFYTYKGSLSPKDSDSEVSQNHSPHRGSLSENNPAQSCLTQKSSSSVSPCSNAPGSFSPDGVDQQFLEDYHKVTKGGSIEEASQYYCDKNDDGDGYLVLIRITPDKEGRFGFNLKGGVDQKMPLVVSRINPESPADTCMPKLNEGDQIVLINGRDISEHTHDQVVMFIKASRESHSRELALVIRRKAVRSLAEIRSEDELSQLFPEAMFPACPEGGDSLEGSMELLKKGLESGTVLIQFEQLYRKKPGLAVTFAKLPQNLDKNRYKDVLPYDTTRVLLQGNEDYINASYVNMEIPAANLVNKYIATQGPLPHTCAQFWQVVWDQKLSLVVMLTTLTERGRTKCHQYWPDPPDIMDHGIFHIQCQAEDCTIAYVSREMLVTNTETGEEHTVTHLQYVAWPDHGVPDDSSDFLEFVKYVRSLRVGGEPALVHCSAGIGRTGVLVTMETAMCLIERNLPVYPLDIVRKMRDQRAMMVQTSSQYKFVCEAILRVYEEGLVQTLDPS
					

Structure Viewer

Loading PAE data...

(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	37.8	Very low	39.5	Very low	255 Å²	255	178.1 Å²	178.1	100%	1.256	85%	0.847	S	S	*	*				0	141.1	0	-52.8	168	-174.8	0	0	106.6
2	G	43.2	Very low	39.3	Very low	67 Å²	67	172.2 Å²	172.2	69%	0.691	85%	0.85	S	S	*	*			cis	-135.4	147.7	-26.9	0	0	0	0	0	107.5
3	R	38.9	Very low	39.2	Very low	245 Å²	245	165.2 Å²	165.2	93%	0.925	85%	0.85	S	S	*	*				52.9	132	97.1	-75.2	-168.6	-177.8	-167.9	3.9	115
4	K	40	Very low	39.2	Very low	189 Å²	189	164.6 Å²	164.6	82%	0.822	86%	0.857	S	S	*	*			cis	-173.4	-177.6	-9.4	-154.3	-173.3	175.9	-171.5	0	109.1
5	V	49.8	Very low	39.1	Very low	130 Å²	130	158.7 Å²	158.7	79%	0.788	85%	0.851	S	S	*	*			trans	104.4	133.1	155.5	-170.3	0	0	0	0	116.3
6	Q	36.3	Very low	39	Very low	174 Å²	174	154.3 Å²	154.3	81%	0.813	86%	0.855	S	S	*	*			trans	-125.4	174.7	173.4	-61.8	168.4	-71.2	0	0	108.3
7	S	39	Very low	38.9	Very low	111 Å²	111	150.2 Å²	150.2	78%	0.776	86%	0.857	S	S	*	*			trans	71.3	160.2	156.8	76.3	0	0	0	0	116.5
8	E	37.7	Very low	39	Very low	183 Å²	183	146.4 Å²	146.4	86%	0.855	86%	0.856	S	S	*	*			cis	-138.8	-144.2	7.6	-151.9	163.2	-159.7	0	0	114.4
9	R	35.8	Very low	38.9	Very low	211 Å²	211	152.4 Å²	152.4	80%	0.796	86%	0.862	S	S	*	*			trans	-132.2	163.8	-151.9	-90.8	175.6	156	175.6	-4.8	114.3
10	R	37.4	Very low	39	Very low	206 Å²	206	148.8 Å²	148.8	78%	0.777	86%	0.86	S	S	*	*			trans	93.7	124.8	141.8	-84.8	161.3	173	-172.4	-2	122.1
11	K	38.6	Very low	39	Very low	188 Å²	188	153 Å²	153	82%	0.817	86%	0.862	S	S	*	*			trans	79.8	107.2	131	-78.8	-172.8	169.8	-166.5	0	122.3
12	A	37.5	Very low	38.9	Very low	107 Å²	107	147.8 Å²	147.8	88%	0.884	84%	0.838	S	S	*	*				63.6	129.4	114.5	0	0	0	0	0	121.5
13	G	37.9	Very low	38.6	Very low	82 Å²	82	153.8 Å²	153.8	85%	0.845	85%	0.848	S	S	*	*			trans	-171.3	103.5	171.5	0	0	0	0	0	113.7
14	V	38.8	Very low	38.4	Very low	157 Å²	157	152.7 Å²	152.7	95%	0.952	84%	0.844	S	S	*	*			trans	-58.4	146.6	-176.9	171	0	0	0	0	115.8
15	G	37.9	Very low	38.3	Very low	75 Å²	75	155.3 Å²	155.3	77%	0.773	85%	0.849	S	S	*	*			trans	126.2	144.8	131.1	0	0	0	0	0	119.6
16	G	38	Very low	38	Very low	88 Å²	88	154.1 Å²	154.1	91%	0.907	84%	0.844	S	S	*	*			trans	123.7	127.6	169.2	0	0	0	0	0	113.8
17	G	37.1	Very low	37.9	Very low	86 Å²	86	154.3 Å²	154.3	89%	0.887	85%	0.85	S	S	*	*			trans	-152.3	169.9	-179.5	0	0	0	0	0	113.8
18	G	39.8	Very low	37.9	Very low	81 Å²	81	153 Å²	153	84%	0.835	85%	0.853	S	S	*	*			trans	-145.1	152.7	178.6	0	0	0	0	0	111.5
19	R	38.3	Very low	37.7	Very low	261 Å²	261	149 Å²	149	99%	0.985	85%	0.851	S	S	*	*			trans	-121.8	149	-171.2	-74.8	-179.1	169.4	-172.4	-2.4	113.1
20	G	40.4	Very low	37.7	Very low	79 Å²	79	147.5 Å²	147.5	81%	0.814	86%	0.858	S	S	*	*			trans	134.3	155.9	144.3	0	0	0	0	0	115.2
21	R	37.9	Very low	37.4	Very low	239 Å²	239	147 Å²	147	90%	0.902	86%	0.862	S	S	*	*			cis	-155.3	155.8	-29.3	-166.8	176.5	-177.3	-168.4	0.1	107.8
22	L	35.8	Very low	37.4	Very low	145 Å²	145	142.9 Å²	142.9	76%	0.759	86%	0.862	S	S	*	*			trans	-48.5	150.6	180	-59.9	71.7	0	0	0	114.2
23	E	37.4	Very low	37.2	Very low	192 Å²	192	146.4 Å²	146.4	90%	0.897	87%	0.866	S	S	*	*				-150.4	169.5	108.8	-123	173.8	-171.7	0	0	113.7
24	R	35.7	Very low	37	Very low	223 Å²	223	146.3 Å²	146.3	84%	0.842	87%	0.865	S	S	*	*			trans	-137.1	150.8	-178.3	-64.5	175.9	173	-178.8	-4.1	108.7
25	R	38.1	Very low	36.7	Very low	243 Å²	243	150.9 Å²	150.9	92%	0.917	87%	0.865	S	S	*	*				174.7	165.6	123.8	-94.9	175.3	178.2	-141.7	-3.2	112.8
26	P	43.4	Very low	36.6	Very low	106 Å²	106	151.7 Å²	151.7	69%	0.688	86%	0.864	S	S	*	*			trans	-135.6	-160.9	-154.3	42.6	-23.3	0	0	0	115
27	L	34	Very low	36.5	Very low	178 Å²	178	155.4 Å²	155.4	93%	0.932	86%	0.863	S	S	*	*			trans	80	136.5	162.5	-68.3	160.7	0	0	0	118.3
28	G	38.5	Very low	36.2	Very low	82 Å²	82	159.2 Å²	159.2	85%	0.845	86%	0.862	S	S	*	*			trans	164.2	93.4	173.7	0	0	0	0	0	111.3
29	A	33.8	Very low	36.2	Very low	99 Å²	99	161.2 Å²	161.2	82%	0.818	86%	0.86	S	S	*	*			trans	-121.7	145.5	-177.5	0	0	0	0	0	111.5
30	L	35.5	Very low	36	Very low	180 Å²	180	152.3 Å²	152.3	94%	0.942	85%	0.85	S	S	*	*			trans	-158.9	146	163.1	-114.9	158	0	0	0	111.7
31	K	31.8	Very low	36	Very low	196 Å²	196	155.7 Å²	155.7	85%	0.852	86%	0.855	S	S	*	*			trans	-92.1	151.1	-180	-64.3	175.1	176	178.2	0	111.3
32	A	37.5	Very low	35.9	Very low	101 Å²	101	152.7 Å²	152.7	84%	0.835	86%	0.855	S	S	*	*			trans	-145.2	143.1	152.1	0	0	0	0	0	109.6
33	L	32.9	Very low	35.8	Very low	181 Å²	181	149 Å²	149	95%	0.948	85%	0.852	S	S	*	*			trans	-95.4	146.3	172.8	-70.6	93.9	0	0	0	110.3
34	G	35.2	Very low	36.1	Very low	80 Å²	80	146.1 Å²	146.1	83%	0.825	85%	0.851	S	S	*	*			trans	-155.3	115.9	169.8	0	0	0	0	0	111.8
35	R	31.7	Very low	36	Very low	254 Å²	254	140.1 Å²	140.1	96%	0.958	85%	0.848	S	S	*	*			trans	-89.8	130.6	168	-72.4	174.4	166.7	179.1	-5.5	109.2
36	A	36.9	Very low	36.1	Very low	91 Å²	91	138.7 Å²	138.7	75%	0.752	85%	0.849	S	S	*	*			trans	-166.3	113.8	151	0	0	0	0	0	113.4
37	N	34.2	Very low	35.5	Very low	166 Å²	166	141.3 Å²	141.3	89%	0.888	85%	0.852	S	S	*	*			trans	33.7	137.7	138.9	-57.6	-3.4	0	0	0	123.5
38	L	31.5	Very low	36	Very low	167 Å²	167	137.9 Å²	137.9	87%	0.874	84%	0.84	S	S	*	*	P	Polyproline II helix	trans	-50.8	148.1	160.8	-64.8	149.4	0	0	0	114.4
39	P	40	Very low	35.9	Very low	122 Å²	122	143.6 Å²	143.6	79%	0.792	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-94.6	117.5	146.1	33.4	-25	0	0	0	110.5
40	G	33.3	Very low	36.1	Very low	74 Å²	74	145.3 Å²	145.3	76%	0.763	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-84.8	141.6	166.4	0	0	0	0	0	111.1
41	V	40.2	Very low	36.2	Very low	151 Å²	151	141.8 Å²	141.8	92%	0.915	82%	0.822	S	S	*	*			trans	-106.2	125	172.8	179.9	0	0	0	0	109.1
42	L	36.3	Very low	36.5	Very low	175 Å²	175	140.2 Å²	140.2	92%	0.916	82%	0.818	S	S	*	*			trans	-128.2	128.5	-168.8	-109.8	169.4	0	0	0	111.6
43	G	33.4	Very low	36.5	Very low	68 Å²	68	142.5 Å²	142.5	70%	0.701	82%	0.815	S	S	*	*			trans	75.4	-174.6	165.3	0	0	0	0	0	116.2
44	P	43.4	Very low	36.8	Very low	132 Å²	132	138 Å²	138	86%	0.857	80%	0.799	S	S	*	*			cis	-101.9	154.1	10.9	37.7	-33.1	0	0	0	114.7
45	A	34.3	Very low	37.1	Very low	96 Å²	96	143.4 Å²	143.4	79%	0.793	80%	0.802	S	S	*	*			trans	-82.9	157.7	166.6	0	0	0	0	0	111.8
46	K	40.9	Very low	37.5	Very low	213 Å²	213	134.6 Å²	134.6	93%	0.926	79%	0.79	S	S	*	*			trans	-131.9	103.6	159.8	-88.5	-171.5	174.5	179.2	0	110.6
47	E	31.1	Very low	37.6	Very low	161 Å²	161	135.4 Å²	135.4	75%	0.752	80%	0.797	S	S	*	*			trans	-65.4	159.7	157.3	-132	-171.6	-120.5	0	0	109.7
48	P	44.2	Very low	37.8	Very low	107 Å²	107	132.4 Å²	132.4	70%	0.695	80%	0.796	S	S	*	*				-146.3	152	74	37.5	-19.4	0	0	0	117
49	R	36.1	Very low	38.1	Very low	201 Å²	201	127.8 Å²	127.8	76%	0.758	79%	0.788	S	S	*	*				40	133.7	128.8	-48.6	177.5	-167.2	-175.5	2.6	119
50	D	37.2	Very low	38	Very low	136 Å²	136	129.5 Å²	129.5	73%	0.727	80%	0.796	S	S	*	*			cis	-177.2	151.1	48.1	-113.5	-38.2	0	0	0	111.5
51	S	37.7	Very low	38.2	Very low	105 Å²	105	129.1 Å²	129.1	73%	0.734	79%	0.792	S	S	*	*			trans	66	153.8	152.9	81.2	0	0	0	0	120.2
52	Q	37.9	Very low	38	Very low	164 Å²	164	126.5 Å²	126.5	77%	0.766	79%	0.786	S	S	*	*			cis	-165.8	155.1	-22.5	-116	-176.6	31.5	0	0	109.9
53	L	38.8	Very low	38.2	Very low	149 Å²	149	124.7 Å²	124.7	78%	0.78	78%	0.783	S	S	*	*			trans	66.4	149.9	159.8	-61.4	161.4	0	0	0	117.3
54	S	39.1	Very low	38.7	Very low	87 Å²	87	126.3 Å²	126.3	61%	0.608	78%	0.781	S	S	*	*			cis	-168.6	144.9	-13.4	50.2	0	0	0	0	112.1
55	H	41.2	Very low	38.4	Very low	193 Å²	193	127 Å²	127	89%	0.894	78%	0.778	S	S	*	*			trans	38.8	140	155	-54	-63.2	0	0	0	122.3
56	G	39.1	Very low	38.5	Very low	68 Å²	68	128 Å²	128	70%	0.701	78%	0.779	S	S	*	*			cis	155.9	171.1	-7	0	0	0	0	0	115
57	A	39.3	Very low	38.3	Very low	108 Å²	108	121.8 Å²	121.8	89%	0.893	77%	0.767	S	S	*	*			trans	67.2	162.7	164.6	0	0	0	0	0	120
58	A	38.5	Very low	38.6	Very low	104 Å²	104	120.8 Å²	120.8	86%	0.86	77%	0.772	S	S	*	*			cis	-177.9	153.9	-42.9	0	0	0	0	0	110.4
59	G	38.2	Very low	38.1	Very low	69 Å²	69	124.4 Å²	124.4	71%	0.711	78%	0.78	S	S	*	*			trans	122.3	112	170.8	0	0	0	0	0	113.1
60	V	38.4	Very low	38.5	Very low	158 Å²	158	120.4 Å²	120.4	96%	0.958	78%	0.779	S	S	*	*			cis	98.3	122.7	26.2	-178.2	0	0	0	0	113.9
61	G	36.9	Very low	38.7	Very low	67 Å²	67	119.6 Å²	119.6	69%	0.691	78%	0.782	S	S	*	*			trans	126.3	102.4	176.7	0	0	0	0	0	111.7
62	A	36.9	Very low	38.7	Very low	96 Å²	96	120.6 Å²	120.6	79%	0.793	79%	0.789	S	S	*	*			cis	71.5	131	45.8	0	0	0	0	0	113.2
63	T	38.9	Very low	38.4	Very low	136 Å²	136	120.4 Å²	120.4	83%	0.834	79%	0.785	S	S	*	*			cis	-165.9	171.9	-10.6	7.1	0	0	0	0	108.1
64	P	44.8	Very low	38.2	Very low	102 Å²	102	118.3 Å²	118.3	66%	0.662	79%	0.79	S	S	*	*			trans	-101.3	175.4	-166.6	40.5	-38.2	0	0	0	115.5
65	N	37.2	Very low	37.7	Very low	148 Å²	148	122.4 Å²	122.4	79%	0.791	79%	0.791	S	S	*	*				174.2	158.2	120.6	-94.2	-36.7	0	0	0	116.4
66	S	36.7	Very low	37.2	Very low	117 Å²	117	119.4 Å²	119.4	82%	0.818	79%	0.791	S	S	*	*			trans	69.6	149	153.8	68.5	0	0	0	0	120.2
67	A	35.4	Very low	36.7	Very low	82 Å²	82	124.5 Å²	124.5	68%	0.678	80%	0.796	S	S	*	*			cis	-172	-176.5	-19.3	0	0	0	0	0	111.1
68	T	37.3	Very low	36.2	Very low	140 Å²	140	129.3 Å²	129.3	86%	0.859	80%	0.797	S	S	*	*			trans	88	167.4	163.5	70.6	0	0	0	0	118.9
69	E	34.2	Very low	35.6	Very low	183 Å²	183	134.5 Å²	134.5	86%	0.855	79%	0.794	S	S	*	*			trans	-124.1	164.4	-131.8	-75.7	178.6	119.1	0	0	116.8
70	P	45.5	Very low	35	Very low	116 Å²	116	139.8 Å²	139.8	75%	0.753	80%	0.798	S	S	*	*			trans	-88.1	-157	172.5	42.7	-40.5	0	0	0	110.7
71	P	41.5	Very low	34.5	Very low	120 Å²	120	137.3 Å²	137.3	78%	0.779	78%	0.783	S	S	*	*			cis	-139	-176.2	-3.1	43.9	-26	0	0	0	116.4
72	S	36.7	Very low	34	Very low	125 Å²	125	139.9 Å²	139.9	87%	0.874	79%	0.785	S	S	*	*			trans	-167.9	158	146.8	38.2	0	0	0	0	113.4
73	K	31.5	Very low	33.5	Very low	161 Å²	161	145.8 Å²	145.8	70%	0.7	79%	0.787	S	S	*	*			trans	-87.4	149.4	-175.6	-69.1	176.8	172	177.9	0	113.2	D529	K73-D529 IonicContact NZ-OD1 3.59Å; K73-D529 PolarHBondContact NZ-OD1 3.36Å; K73-D529 IonicContact NZ-OD2 3.73Å; K73-D529 PolarHBondContact NZ-OD2 3.07Å
74	A	35.5	Very low	33	Very low	105 Å²	105	147.7 Å²	147.7	87%	0.868	79%	0.787	S	S	*	*			trans	-152	136.7	148.2	0	0	0	0	0	111.9
75	R	28.1	Very low	32.4	Very low	172 Å²	172	147 Å²	147	65%	0.649	79%	0.79	S	S	*	*			trans	-110.9	144.3	173.8	-68.7	156.3	92.3	157	1.3	109.3	K528 D529	R75-K528 PolarHBondContact NH1-O 2.76Å; R75-D529 IonicContact NH1-OD2 3.78Å
76	C	31.1	Very low	32.1	Very low	130 Å²	130	148.2 Å²	148.2	88%	0.878	80%	0.795	S	S	*	*			trans	-159	149.9	145.3	-144.3	0	0	0	0	112.7
77	H	27.3	Very low	31.8	Very low	175 Å²	175	147.3 Å²	147.3	81%	0.81	79%	0.794	S	S	*	*			trans	-82.1	162.7	170.2	-70.1	-88.2	0	0	0	111.1
78	F	29.7	Very low	31.9	Very low	209 Å²	209	151 Å²	151	92%	0.917	80%	0.802	S	S	*	*				-158.8	171.1	119.7	-124.4	-88.8	0	0	0	112.9
79	R	25.4	Very low	31.7	Very low	213 Å²	213	149.1 Å²	149.1	80%	0.804	79%	0.792	S	S	*	*			trans	-106.8	162.9	-176.9	-94.2	178.7	168.2	172	-4	112.4
80	F	26	Very low	31.7	Very low	180 Å²	180	151.1 Å²	151.1	79%	0.789	79%	0.791	S	S	*	*			trans	83.9	123.3	143.3	-103.6	-130.8	0	0	0	121.3
81	V	28	Very low	31.3	Very low	107 Å²	107	154.5 Å²	154.5	65%	0.648	80%	0.796	S	S	*	*				72.4	107.6	128	170.3	0	0	0	0	120.6
82	V	26.9	Very low	30.9	Very low	121 Å²	121	153 Å²	153	73%	0.733	80%	0.795	S	S	*	*			trans	58.1	119.7	130.1	-174.6	0	0	0	0	120.1
83	R	26.8	Very low	30.8	Very low	219 Å²	219	155 Å²	155	83%	0.826	79%	0.794	S	S	*	*			trans	81	125.5	152.8	-85.8	178.2	-179.8	179.8	1.2	120.5
84	Q	28.2	Very low	31	Very low	177 Å²	177	152.4 Å²	152.4	83%	0.827	79%	0.793	S	S	*	*				106.1	138.8	126.9	-117.3	172	-39.4	0	0	120
85	A	31.7	Very low	31	Very low	88 Å²	88	156.1 Å²	156.1	73%	0.727	79%	0.793	S	S	*	*			trans	62.5	95.9	154.3	0	0	0	0	0	118.3
86	L	30.7	Very low	31.3	Very low	173 Å²	173	152.7 Å²	152.7	91%	0.906	80%	0.795	S	S	*	*			trans	-55.7	135.1	150	-70.9	162.5	0	0	0	110.1
87	A	31.4	Very low	31.5	Very low	97 Å²	97	155.7 Å²	155.7	80%	0.802	80%	0.796	S	S	*	*			trans	-130.1	110.4	167.6	0	0	0	0	0	109.4
88	I	37	Very low	31.7	Very low	161 Å²	161	151.4 Å²	151.4	83%	0.826	79%	0.791	S	S	*	*			trans	-102.9	127.6	175.6	-57.9	175.8	0	0	0	107.9
89	P	33.6	Very low	32	Very low	100 Å²	100	150 Å²	150	65%	0.649	79%	0.787	S	S	*	*			trans	-103.7	157.8	-173.4	39.3	-35.7	0	0	0	114.5
90	R	32.8	Very low	32.3	Very low	224 Å²	224	143.4 Å²	143.4	85%	0.845	77%	0.774	S	S	*	*			trans	69.9	128.2	169.5	-44.9	179.5	-179.5	-178.7	-0.6	114.5
91	H	37.1	Very low	32.6	Very low	187 Å²	187	145.6 Å²	145.6	87%	0.866	78%	0.778	S	S	*	*			cis	-140.9	-178.4	45.1	-98.2	-97.4	0	0	0	113.4
92	A	33.4	Very low	32.7	Very low	90 Å²	90	146.2 Å²	146.2	74%	0.744	79%	0.787	S	S	*	*			trans	-124.6	159.6	-166.8	0	0	0	0	0	114.4
93	I	35.5	Very low	32.7	Very low	167 Å²	167	145 Å²	145	86%	0.856	79%	0.79	S	S	*	*			trans	-166.8	147.9	145.5	-97.5	149.8	0	0	0	107.7
94	P	35.1	Very low	33	Very low	106 Å²	106	139.6 Å²	139.6	69%	0.688	79%	0.792	S	S	*	*			trans	-115.7	-169.5	-161.3	42.5	-32.3	0	0	0	116.2
95	E	35	Very low	33	Very low	182 Å²	182	137.9 Å²	137.9	85%	0.85	79%	0.793	S	S	*	*			trans	75.3	127.6	164.4	-69	-177.9	-170.2	0	0	117.8
96	S	34.9	Very low	32.9	Very low	100 Å²	100	142.7 Å²	142.7	70%	0.699	80%	0.803	S	S	*	*			cis	-177.9	177.3	22.9	52.5	0	0	0	0	112.3
97	Q	34.9	Very low	32.9	Very low	194 Å²	194	141 Å²	141	91%	0.907	80%	0.8	S	S	*	*			trans	71.4	156.4	165.2	-55.6	-165.9	7.8	0	0	119
98	A	31.9	Very low	33.2	Very low	84 Å²	84	142.2 Å²	142.2	69%	0.694	80%	0.803	S	S	*	*			trans	-137.1	169.4	-164.6	0	0	0	0	0	111.7
99	H	36.1	Very low	33	Very low	179 Å²	179	145.9 Å²	145.9	83%	0.829	81%	0.806	S	S	*	*			trans	-179.1	95.5	130.4	-96.6	-63	0	0	0	114
100	S	31.4	Very low	33	Very low	76 Å²	76	148.7 Å²	148.7	53%	0.531	82%	0.815	S	S	.	*				44.5	124.5	122.3	64.3	0	0	0	0	123.2
101	Y	31.9	Very low	33.2	Very low	226 Å²	226	150.3 Å²	150.3	89%	0.886	82%	0.821	S	S	*	*			trans	64.4	146.7	157.2	-51.1	-64.2	0	0	0	117.4
102	S	31	Very low	33.1	Very low	120 Å²	120	145.3 Å²	145.3	84%	0.839	81%	0.812	S	S	*	*			cis	-157.5	173.3	21.7	-167.3	0	0	0	0	111.3
103	A	27.3	Very low	33.3	Very low	96 Å²	96	149.6 Å²	149.6	79%	0.793	82%	0.822	S	S	*	*			trans	-109.4	140.4	175.3	0	0	0	0	0	112.3
104	A	31.3	Very low	33.2	Very low	104 Å²	104	145.7 Å²	145.7	86%	0.86	82%	0.822	S	S	*	*			trans	-142.5	117.8	171.4	0	0	0	0	0	111.1
105	V	28.6	Very low	33.1	Very low	141 Å²	141	144 Å²	144	86%	0.855	83%	0.825	S	S	*	*			trans	-100	125.4	169.7	174.5	0	0	0	0	108.2
106	M	30.7	Very low	33	Very low	190 Å²	190	147.1 Å²	147.1	94%	0.936	83%	0.829	S	S	*	*			trans	-148.2	134.6	160.3	-117	-177.9	-170.2	0	0	112.3
107	T	31.1	Very low	33.2	Very low	136 Å²	136	149.9 Å²	149.9	83%	0.834	83%	0.834	S	S	*	*			trans	-104.5	133.9	171.1	54.2	0	0	0	0	109.4
108	S	35.8	Very low	33.2	Very low	124 Å²	124	147.6 Å²	147.6	87%	0.867	83%	0.828	S	S	*	*			trans	-146.2	160	169	67.9	0	0	0	0	110.8
109	R	34.8	Very low	33.7	Very low	237 Å²	237	151.5 Å²	151.5	89%	0.894	84%	0.837	S	S	*	*			trans	-113.6	141.2	-171.8	-75.3	176.9	170.2	172.4	-2.5	111.6
110	L	32.5	Very low	33.9	Very low	160 Å²	160	150.5 Å²	150.5	84%	0.838	84%	0.836	S	S	*	*			trans	26.7	107.3	139.3	-66.8	163.9	0	0	0	117.9
111	R	36.5	Very low	34.2	Very low	257 Å²	257	158 Å²	158	97%	0.97	85%	0.853	S	S	*	*				-156	165.2	116.1	-123.8	171.3	-85.9	-151.5	-0.1	111.4
112	A	35.8	Very low	34.5	Very low	83 Å²	83	152.5 Å²	152.5	69%	0.686	84%	0.843	S	S	*	*			trans	-130.3	154.2	177.4	0	0	0	0	0	109
113	L	37.4	Very low	34.7	Very low	180 Å²	180	152 Å²	152	94%	0.942	84%	0.84	S	S	*	*			trans	161.2	133.8	137.4	-88.3	161.4	0	0	0	111
114	G	32.7	Very low	35	Very low	84 Å²	84	155 Å²	155	87%	0.866	84%	0.837	S	S	*	*			trans	75.6	148.5	168.2	0	0	0	0	0	116.4
115	G	33.5	Very low	35.2	Very low	72 Å²	72	157.3 Å²	157.3	74%	0.742	83%	0.834	S	S	*	*			cis	166.9	117.1	-12.7	0	0	0	0	0	114.2
116	R	32.6	Very low	35.5	Very low	247 Å²	247	156.6 Å²	156.6	93%	0.932	83%	0.832	S	S	*	*			trans	44.3	125.5	160.1	-62	179	179	171.2	-0.8	119.2
117	I	39.6	Very low	35.8	Very low	157 Å²	157	155.2 Å²	155.2	81%	0.805	82%	0.821	S	S	*	*				-159.5	138.3	117.4	-98	148	0	0	0	107.7
118	N	35.1	Very low	36	Very low	147 Å²	147	157.1 Å²	157.1	79%	0.786	82%	0.821	S	S	*	*			trans	-96.2	148.1	171.6	-72.8	-8.9	0	0	0	109.1
119	N	42	Very low	36.3	Very low	166 Å²	166	160.6 Å²	160.6	89%	0.888	82%	0.82	S	S	*	*			trans	-141.3	141.6	153.9	-106.9	-28.4	0	0	0	109.6
120	I	41	Very low	36.8	Very low	157 Å²	157	155 Å²	155	81%	0.805	81%	0.813	S	S	*	*			trans	-112.4	127.8	-170.5	-63.9	168.3	0	0	0	109
121	R	37	Very low	37.9	Very low	233 Å²	233	156.8 Å²	156.8	88%	0.879	81%	0.808	S	S	*	*			trans	-153.4	111.9	154.9	-120.1	178.6	177.7	168.3	-0.4	113.2
122	T	37.6	Very low	39.6	Very low	112 Å²	112	147.2 Å²	147.2	69%	0.687	78%	0.78	S	S	*	*			trans	42.8	118.1	140.2	51.8	0	0	0	0	121.4
123	S	35.4	Very low	41.7	Very low	110 Å²	110	148.6 Å²	148.6	77%	0.769	77%	0.773	S	S	*	*			trans	60.5	91.8	136.1	63.6	0	0	0	0	120.3
124	E	34.5	Very low	44	Very low	158 Å²	158	140.5 Å²	140.5	74%	0.738	73%	0.731	S	S	*	*			trans	-131.6	161.6	138.3	-80	-164.5	147.1	0	0	109.5	K127	E124-K127 IonicContact OE2-NZ 3.65Å; E124-K127 PolarHBondContact OE2-NZ 3.43Å
125	L	35.4	Very low	46.6	Very low	153 Å²	153	139.4 Å²	139.4	80%	0.801	71%	0.707	S	S	*	*			trans	-64	156.6	-177.4	-77.7	86.2	0	0	0	112.8	K127	L125-K127 PolarHBondContact O-N 2.93Å
126	P	34.5	Very low	49.2	Very low	125 Å²	125	136 Å²	136	81%	0.812	67%	0.672	S	S	*	*			trans	-63.9	98	-177.6	26.3	-35.7	0	0	0	111.9	E128	P126-E128 PolarHBondContact O-N 2.93Å
127	K	37.9	Very low	52	Low	161 Å²	161	124.9 Å²	124.9	70%	0.7	63%	0.632	S	S	*	*			trans	-60	109.3	176.3	-82.3	167.3	174.4	159.3	0	110.3	E124 L125 K129	E124-K127 IonicContact OE2-NZ 3.65Å; E124-K127 PolarHBondContact OE2-NZ 3.43Å; L125-K127 PolarHBondContact O-N 2.93Å; K127-K129 PolarHBondContact O-N 3.24Å
128	E	35.5	Very low	54.6	Low	177 Å²	177	117.4 Å²	117.4	83%	0.827	59%	0.594	S	S	*	*			trans	-55.2	115.5	-174.9	-169.4	170.3	-144.7	0	0	110.8	P126 T130	P126-E128 PolarHBondContact O-N 2.93Å; E128-T130 PolarHBondContact O-N 3.44Å
129	K	42.2	Very low	57.3	Low	196 Å²	196	116.1 Å²	116.1	85%	0.852	58%	0.578	S	S	*	*			trans	-74.7	83.2	176.9	-81.2	-179.9	176.9	169.3	0	109.2	K127 R131	K127-K129 PolarHBondContact O-N 3.24Å; K129-R131 PolarHBondContact O-N 3.02Å
130	T	44.7	Very low	59.9	Low	121 Å²	121	108.6 Å²	108.6	74%	0.742	54%	0.538	S	S	*	.			trans	-42.7	103	177.4	39.8	0	0	0	0	111.2	E128 S132	E128-T130 PolarHBondContact O-N 3.44Å; T130-S132 PolarHBondContact O-N 3.37Å
131	R	54.6	Low	62.4	Low	197 Å²	197	101.9 Å²	101.9	74%	0.743	50%	0.503	S	S	*	.			trans	-62.3	112.6	175.4	-79.7	175.2	156.8	175.9	-7.5	106.6	K129 E133	K129-R131 PolarHBondContact O-N 3.02Å; R131-E133 VanDerWaalsContact C-N 3.32Å; R131-E133 PolarHBondContact O-N 3.27Å
132	S	72.1	Confident	64.9	Low	55 Å²	55	94.8 Å²	94.8	39%	0.385	48%	0.483	S	S	.	.			trans	-79.1	88.5	-176.9	33	0	0	0	0	109.7	T130 K152	T130-S132 PolarHBondContact O-N 3.37Å; S132-K152 WeakPolarHBondContact O-CB 3.35Å; S132-K152 WeakPolarHBondContact O-CD 3.46Å; S132-K152 WeakPolarHBondContact O-CG 3.39Å; S132-K152 PolarHBondContact O-N 3.09Å; S132-K152 VanDerWaalsContact O-N 3.14Å
133	E	81.5	Confident	67.3	Low	112 Å²	112	91.7 Å²	91.7	52%	0.523	47%	0.473	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.8	161.4	170.5	-66.1	-175.5	179.7	0	0	112.1	R131 V150 K152	R131-E133 VanDerWaalsContact C-N 3.32Å; R131-E133 PolarHBondContact O-N 3.27Å; E133-V150 CarbonylContact C-O 3.59Å; E133-V150 WeakPolarHBondContact CA-O 3.32Å; E133-K152 WeakPolarHBondContact O-CE 3.49Å
134	V	84.4	Confident	70	Confident	10 Å²	10	91.6 Å²	91.6	6%	0.061	46%	0.463	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	135.9	174.5	156.3	0	0	0	0	108.4	K149 V150 K152 L200 L204	V134-K149 WeakPolarHBondContact O-CA 3.48Å; V134-V150 HydrophobicContact CB-CG2 4.19Å; V134-V150 HydrophobicContact CG1-CG2 4.16Å; V134-V150 PolarHBondContact N-O 3.19Å; V134-V150 PolarHBondContact O-N 2.98Å; V134-K152 HydrophobicContact CB-CG 4.48Å; V134-K152 HydrophobicContact CG2-CD 3.99Å; V134-K152 HydrophobicContact CG2-CG 3.45Å; V134-K152 VanDerWaalsContact CG2-CG 3.45Å; V134-L200 HydrophobicContact CG1-CD1 3.96Å; V134-L204 HydrophobicContact CB-CD2 4.4Å; V134-L204 HydrophobicContact CG1-CD2 3.8Å; V134-L204 HydrophobicContact CG2-CD2 3.99Å
135	T	87.6	Confident	72.8	Confident	61 Å²	61	87.9 Å²	87.9	37%	0.374	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	114.4	167	-49.4	0	0	0	0	108.9	T147 P205 C206	T135-T147 HydrophobicContact CG2-CG2 3.26Å; T135-P205 HydrophobicContact CG2-CB 4.3Å; T135-C206 PolarHBondContact O-N 3.46Å
136	C	88.4	Confident	75.6	Confident	0 Å²	0	84.1 Å²	84.1	0%	0	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	129.8	171.4	-82.7	0	0	0	0	109.2	T147 F148 V150 L159 L200 C206	C136-T147 WeakPolarHBondContact O-CA 3.27Å; C136-F148 PolarHBondContact N-O 3.05Å; C136-F148 PolarHBondContact O-N 3.03Å; C136-V150 HydrophobicContact CB-CG2 4.45Å; C136-L159 HydrophobicContact CB-CD1 4.12Å; C136-L159 HydrophobicContact CB-CD2 4.01Å; C136-L200 VanDerWaalsContact SG-CD1 3.52Å; C136-C206 WeakPolarHBondContact CA-O 3.47Å
137	S	91.7	Very high	78.3	Confident	14 Å²	14	81.1 Å²	81.1	10%	0.098	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	120.2	174.5	-58.9	0	0	0	0	108.6	T147 C206 I207 L208	S137-T147 PolarHBondContact OG-OG1 2.84Å; S137-C206 PolarHBondContact N-O 2.98Å; S137-I207 WeakPolarHBondContact O-CA 2.96Å; S137-L208 PolarHBondContact O-N 2.68Å
138	I	92.8	Very high	80.9	Confident	0 Å²	0	74.6 Å²	74.6	0%	0	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	120.2	179.6	-60.7	-178.7	0	0	0	108	F140 V145 Q146 F148 L159 A163 L177 L208 F210	I138-F140 HydrophobicContact CB-CZ 4.4Å; I138-F140 HydrophobicContact CG2-CD1 4.1Å; I138-F140 HydrophobicContact CG2-CE1 3.78Å; I138-F140 HydrophobicContact CG2-CE2 4.22Å; I138-F140 HydrophobicContact CG2-CG 4.46Å; I138-F140 HydrophobicContact CG2-CZ 3.85Å; I138-V145 CarbonylContact O-C 3.46Å; I138-V145 VanDerWaalsContact O-CA 3.32Å; I138-V145 WeakPolarHBondContact O-CA 3.31Å; I138-Q146 PolarHBondContact N-O 3.44Å; I138-Q146 PolarHBondContact O-N 3.28Å; I138-F148 HydrophobicContact CB-CD2 4.38Å; I138-F148 HydrophobicContact CB-CE2 4.12Å; I138-F148 HydrophobicContact CD1-CD2 3.71Å; I138-F148 HydrophobicContact CD1-CE2 3.71Å; I138-F148 HydrophobicContact CG1-CD2 3.97Å; I138-F148 HydrophobicContact CG1-CE2 4.1Å; I138-L159 HydrophobicContact CD1-CD1 3.85Å; I138-L159 HydrophobicContact CD1-CG 4.22Å; I138-A163 HydrophobicContact CD1-CB 3.81Å; I138-L177 HydrophobicContact CD1-CD1 3.76Å; I138-L177 HydrophobicContact CD1-CD2 3.81Å; I138-L177 HydrophobicContact CD1-CG 4.47Å; I138-L177 HydrophobicContact CG1-CD2 4.16Å; I138-L177 HydrophobicContact CG2-CD2 3.61Å; I138-L208 CarbonylContact C-O 3.52Å; I138-L208 VanDerWaalsContact CA-O 3.3Å; I138-L208 WeakPolarHBondContact CA-O 3.28Å; I138-L208 HydrophobicContact CG1-CB 4.42Å; I138-F210 HydrophobicContact CG2-CB 4.19Å
139	R	93.7	Very high	83.5	Confident	121 Å²	121	73.4 Å²	73.4	46%	0.457	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	125.6	165.7	-176.2	179.3	-71	164	-1.3	109	L144 V145 L208 H209 F210	R139-L144 CarbonylContact C-O 3.57Å; R139-L144 WeakPolarHBondContact CA-O 3.42Å; R139-V145 HydrophobicContact CB-CG2 4.12Å; R139-V145 HydrophobicContact CG-CG2 4.14Å; R139-L208 PolarHBondContact N-O 3.27Å; R139-H209 WeakPolarHBondContact O-CA 3.47Å; R139-F210 PolarHBondContact O-N 2.61Å
140	F	95	Very high	85.7	Confident	8 Å²	8	64.2 Å²	64.2	4%	0.035	33%	0.333	C	S	.	.			trans	-93	176.1	175.7	-69.1	-67.8	0	0	0	111.9	I138 D142 G143 L144 Q146 F148 A163 H166 L167 F210	I138-F140 HydrophobicContact CB-CZ 4.4Å; I138-F140 HydrophobicContact CG2-CD1 4.1Å; I138-F140 HydrophobicContact CG2-CE1 3.78Å; I138-F140 HydrophobicContact CG2-CE2 4.22Å; I138-F140 HydrophobicContact CG2-CG 4.46Å; I138-F140 HydrophobicContact CG2-CZ 3.85Å; F140-D142 VanDerWaalsContact C-N 3.31Å; F140-D142 WeakPolarHBondContact CB-OD1 3.47Å; F140-G143 PolarHBondContact O-N 2.87Å; F140-G143 VanDerWaalsContact O-N 3.14Å; F140-L144 PolarHBondContact N-O 3.02Å; F140-Q146 HydrophobicContact CD2-CB 4.4Å; F140-Q146 HydrophobicContact CE2-CB 3.71Å; F140-F148 HydrophobicContact CE2-CE2 4.43Å; F140-F148 HydrophobicContact CZ-CE2 4.28Å; F140-F148 HydrophobicContact CZ-CZ 4.35Å; F140-A163 HydrophobicContact CE1-CB 4.14Å; F140-A163 HydrophobicContact CZ-CB 4.28Å; F140-H166 AromaticContact CE2-CD2 3.22Å; F140-H166 WeakPolarHBondContact CE2-CD2 3.44Å; F140-H166 AromaticContact CE2-NE2 3.65Å; F140-H166 HydrophobicContact CZ-CB 4.4Å; F140-H166 AromaticContact CZ-CD2 3.58Å; F140-L167 HydrophobicContact CD1-CD1 3.72Å; F140-L167 HydrophobicContact CD1-CD2 3.97Å; F140-L167 HydrophobicContact CD1-CG 3.98Å; F140-L167 HydrophobicContact CE1-CD1 3.77Å; F140-L167 HydrophobicContact CE1-CD2 4.19Å; F140-L167 HydrophobicContact CE1-CG 3.81Å; F140-L167 HydrophobicContact CG-CD2 4.19Å; F140-L167 HydrophobicContact CZ-CG 4.34Å; F140-F210 HydrophobicContact CD1-CB 3.57Å; F140-F210 HydrophobicContact CD1-CD1 4.25Å; F140-F210 HydrophobicContact CD1-CD2 4.18Å; F140-F210 AromaticContact CD1-CG 3.77Å; F140-F210 HydrophobicContact CD1-CG 3.77Å; F140-F210 HydrophobicContact CE1-CB 4.04Å; F140-F210 AromaticContact CE1-CD2 3.99Å; F140-F210 HydrophobicContact CE1-CD2 3.99Å; F140-F210 HydrophobicContact CE1-CG 4.06Å
141	L	93.2	Very high	87.7	Confident	15 Å²	15	59.4 Å²	59.4	8%	0.079	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78	-17.2	-171.4	-64.8	171.3	0	0	0	113.5	G143 F210 L230 L233 Q234 M237	L141-G143 VanDerWaalsContact C-N 3.26Å; L141-F210 HydrophobicContact CD1-CD1 3.91Å; L141-F210 HydrophobicContact CD1-CE1 4.16Å; L141-F210 VanDerWaalsContact CD2-O 3.25Å; L141-F210 WeakPolarHBondContact CD2-O 3.33Å; L141-F210 HydrophobicContact CG-CD1 4.07Å; L141-L230 HydrophobicContact CD1-CB 4.17Å; L141-L230 HydrophobicContact CD1-CD2 4.09Å; L141-L230 WeakPolarHBondContact CD1-O 3.39Å; L141-L233 HydrophobicContact CB-CB 3.8Å; L141-L233 HydrophobicContact CB-CD1 4.14Å; L141-Q234 HydrophobicContact CD1-CB 4.19Å; L141-Q234 HydrophobicContact CD2-CB 4.13Å; L141-M237 HydrophobicContact CD2-CE 3.31Å
142	D	90.4	Very high	89.2	Confident	85 Å²	85	53 Å²	53	46%	0.455	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-4.6	167.6	54	11.6	0	0	0	112.9	F140 L144 L233	F140-D142 VanDerWaalsContact C-N 3.31Å; F140-D142 WeakPolarHBondContact CB-OD1 3.47Å; D142-L144 VanDerWaalsContact C-N 3.35Å; D142-L144 WeakPolarHBondContact OD1-CB 3.37Å; D142-L144 PolarHBondContact OD1-N 3.02Å; D142-L144 WeakPolarHBondContact OD2-CD1 3.48Å; D142-L233 HydrophobicContact CB-CD1 4.36Å
143	G	88.5	Confident	89.9	Confident	47 Å²	47	57 Å²	57	49%	0.485	29%	0.293	S	S	.	.	S	Bend	trans	87	-8.5	-174.8	0	0	0	0	0	115	F140 L141	F140-G143 PolarHBondContact O-N 2.87Å; F140-G143 VanDerWaalsContact O-N 3.14Å; L141-G143 VanDerWaalsContact C-N 3.26Å
144	L	92.5	Very high	90.2	Very high	107 Å²	107	54.1 Å²	54.1	56%	0.56	28%	0.281	S	S	*	.			trans	-64.9	143.3	179	-64.7	-177.3	0	0	0	111.1	R139 F140 D142	R139-L144 CarbonylContact C-O 3.57Å; R139-L144 WeakPolarHBondContact CA-O 3.42Å; F140-L144 PolarHBondContact N-O 3.02Å; D142-L144 VanDerWaalsContact C-N 3.35Å; D142-L144 WeakPolarHBondContact OD1-CB 3.37Å; D142-L144 PolarHBondContact OD1-N 3.02Å; D142-L144 WeakPolarHBondContact OD2-CD1 3.48Å
145	V	92.7	Very high	90.6	Very high	80 Å²	80	57.8 Å²	57.8	49%	0.485	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	94.4	-179.8	-176	0	0	0	0	110.4	I138 R139	I138-V145 CarbonylContact O-C 3.46Å; I138-V145 VanDerWaalsContact O-CA 3.32Å; I138-V145 WeakPolarHBondContact O-CA 3.31Å; R139-V145 HydrophobicContact CB-CG2 4.12Å; R139-V145 HydrophobicContact CG-CG2 4.14Å
146	Q	93.1	Very high	90.8	Very high	74 Å²	74	54.9 Å²	54.9	35%	0.346	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	136.7	174.6	-176.3	54.9	53.4	0	0	110.7	I138 F140 F148	I138-Q146 PolarHBondContact N-O 3.44Å; I138-Q146 PolarHBondContact O-N 3.28Å; F140-Q146 HydrophobicContact CD2-CB 4.4Å; F140-Q146 HydrophobicContact CE2-CB 3.71Å; Q146-F148 HydrophobicContact CB-CD2 4.48Å; Q146-F148 HydrophobicContact CB-CE2 3.7Å; Q146-F148 HydrophobicContact CB-CZ 4.02Å; Q146-F148 HydrophobicContact CG-CD2 4.09Å; Q146-F148 HydrophobicContact CG-CE1 4.01Å; Q146-F148 HydrophobicContact CG-CE2 3.44Å; Q146-F148 VanDerWaalsContact CG-CE2 3.44Å; Q146-F148 HydrophobicContact CG-CZ 3.4Å; Q146-F148 VanDerWaalsContact CG-CZ 3.4Å
147	T	92.4	Very high	91	Very high	63 Å²	63	58.5 Å²	58.5	39%	0.387	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	132.4	174.6	-67.4	0	0	0	0	111.1	T135 C136 S137	T135-T147 HydrophobicContact CG2-CG2 3.26Å; C136-T147 WeakPolarHBondContact O-CA 3.27Å; S137-T147 PolarHBondContact OG-OG1 2.84Å
148	F	91.8	Very high	91	Very high	24 Å²	24	59.8 Å²	59.8	11%	0.105	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	142.4	-179.5	-61.6	-88.7	0	0	0	110.4	C136 I138 F140 Q146 L159 M162 H166	C136-F148 PolarHBondContact N-O 3.05Å; C136-F148 PolarHBondContact O-N 3.03Å; I138-F148 HydrophobicContact CB-CD2 4.38Å; I138-F148 HydrophobicContact CB-CE2 4.12Å; I138-F148 HydrophobicContact CD1-CD2 3.71Å; I138-F148 HydrophobicContact CD1-CE2 3.71Å; I138-F148 HydrophobicContact CG1-CD2 3.97Å; I138-F148 HydrophobicContact CG1-CE2 4.1Å; F140-F148 HydrophobicContact CE2-CE2 4.43Å; F140-F148 HydrophobicContact CZ-CE2 4.28Å; F140-F148 HydrophobicContact CZ-CZ 4.35Å; Q146-F148 HydrophobicContact CB-CD2 4.48Å; Q146-F148 HydrophobicContact CB-CE2 3.7Å; Q146-F148 HydrophobicContact CB-CZ 4.02Å; Q146-F148 HydrophobicContact CG-CD2 4.09Å; Q146-F148 HydrophobicContact CG-CE1 4.01Å; Q146-F148 HydrophobicContact CG-CE2 3.44Å; Q146-F148 VanDerWaalsContact CG-CE2 3.44Å; Q146-F148 HydrophobicContact CG-CZ 3.4Å; Q146-F148 VanDerWaalsContact CG-CZ 3.4Å; F148-L159 HydrophobicContact CB-CD1 4.07Å; F148-L159 HydrophobicContact CG-CD1 4.44Å; F148-M162 HydrophobicContact CD1-CB 3.8Å; F148-M162 HydrophobicContact CD1-CG 4.25Å; F148-M162 HydrophobicContact CD1-SD 4.18Å; F148-M162 HydrophobicContact CE1-CB 3.9Å; F148-H166 HydrophobicContact CE1-CB 4.31Å; F148-H166 HydrophobicContact CZ-CB 3.87Å
149	K	90.3	Very high	91	Very high	152 Å²	152	59.8 Å²	59.8	66%	0.661	31%	0.308	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.9	125.8	170.5	-68.2	-175.6	176.4	-172.9	0	109.4	V134	V134-K149 WeakPolarHBondContact O-CA 3.48Å
150	V	88.4	Confident	91	Very high	3 Å²	3	54.4 Å²	54.4	2%	0.018	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	147.4	-176	-69.7	0	0	0	0	111.2	E133 V134 C136 L159 M162 L196	E133-V150 CarbonylContact C-O 3.59Å; E133-V150 WeakPolarHBondContact CA-O 3.32Å; V134-V150 HydrophobicContact CB-CG2 4.19Å; V134-V150 HydrophobicContact CG1-CG2 4.16Å; V134-V150 PolarHBondContact N-O 3.19Å; V134-V150 PolarHBondContact O-N 2.98Å; C136-V150 HydrophobicContact CB-CG2 4.45Å; V150-L159 HydrophobicContact CG1-CB 4.38Å; V150-L159 HydrophobicContact CG1-CD1 3.83Å; V150-M162 HydrophobicContact CG1-CE 3.55Å; V150-M162 HydrophobicContact CG1-SD 4.09Å; V150-L196 HydrophobicContact CB-CD1 3.75Å; V150-L196 HydrophobicContact CG1-CD1 4.44Å; V150-L196 HydrophobicContact CG2-CD1 3.55Å
151	N	87.7	Confident	90.9	Very high	19 Å²	19	57.2 Å²	57.2	10%	0.102	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	137.5	177.5	-173.7	-27.6	0	0	0	109.5	Q153 D154	N151-Q153 PolarHBondContact O-N 3.28Å; N151-Q153 PolarHBondContact OD1-N 3.03Å; N151-D154 VanDerWaalsContact CB-OD2 3.29Å; N151-D154 WeakPolarHBondContact CB-OD2 3.46Å; N151-D154 PolarHBondContact N-OD2 3.12Å; N151-D154 WeakPolarHBondContact O-CB 3.43Å; N151-D154 PolarHBondContact O-N 3.45Å
152	K	85.1	Confident	90.9	Very high	62 Å²	62	59.4 Å²	59.4	27%	0.27	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.2	-27	174.2	-75.6	170.6	-160.4	176.8	0	112.9	S132 E133 V134 R197	S132-K152 WeakPolarHBondContact O-CB 3.35Å; S132-K152 WeakPolarHBondContact O-CD 3.46Å; S132-K152 WeakPolarHBondContact O-CG 3.39Å; S132-K152 PolarHBondContact O-N 3.09Å; S132-K152 VanDerWaalsContact O-N 3.14Å; E133-K152 WeakPolarHBondContact O-CE 3.49Å; V134-K152 HydrophobicContact CB-CG 4.48Å; V134-K152 HydrophobicContact CG2-CD 3.99Å; V134-K152 HydrophobicContact CG2-CG 3.45Å; V134-K152 VanDerWaalsContact CG2-CG 3.45Å; K152-R197 HydrophobicContact CB-CB 4.07Å; K152-R197 HydrophobicContact CB-CG 4.15Å; K152-R197 VanDerWaalsContact O-CB 3.29Å; K152-R197 WeakPolarHBondContact O-CB 3.49Å; K152-R197 PolarHBondContact O-N 3.07Å
153	Q	85.8	Confident	91.1	Very high	139 Å²	139	55.4 Å²	55.4	65%	0.65	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.2	-20.5	-179.5	-58.5	-173.8	44.3	0	0	114	N151	N151-Q153 PolarHBondContact O-N 3.28Å; N151-Q153 PolarHBondContact OD1-N 3.03Å
154	D	89.3	Confident	91.3	Very high	53 Å²	53	54 Å²	54	28%	0.283	27%	0.273	S	S	.	.	S	Bend	trans	-64.9	150.7	-177.1	-61.1	-21.9	0	0	0	111.4	N151 P195 L196	N151-D154 VanDerWaalsContact CB-OD2 3.29Å; N151-D154 WeakPolarHBondContact CB-OD2 3.46Å; N151-D154 PolarHBondContact N-OD2 3.12Å; N151-D154 WeakPolarHBondContact O-CB 3.43Å; N151-D154 PolarHBondContact O-N 3.45Å; D154-P195 CarbonylContact O-C 3.59Å; D154-P195 WeakPolarHBondContact O-CA 3.29Å; D154-L196 HydrophobicContact CB-CD1 4.38Å; D154-L196 WeakPolarHBondContact O-CG 3.47Å; D154-L196 PolarHBondContact O-N 2.65Å
155	L	92.8	Very high	91.3	Very high	87 Å²	87	51.5 Å²	51.5	46%	0.455	27%	0.274	S	S	.	.	B	Isolated β-bridge	trans	-71.1	152.9	172.8	-59.3	-177.9	0	0	0	110.7	Q157 S158 A192 P195	L155-Q157 HydrophobicContact CB-CB 4.43Å; L155-Q157 PolarHBondContact O-N 2.94Å; L155-S158 VanDerWaalsContact O-CB 3.3Å; L155-S158 WeakPolarHBondContact O-CB 3.47Å; L155-S158 PolarHBondContact O-N 3.11Å; L155-A192 WeakPolarHBondContact CB-O 3.31Å; L155-P195 HydrophobicContact CD2-CG 4.03Å
156	G	90.8	Very high	91.3	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-52.8	-29.3	174	0	0	0	0	0	113.5	S158 L159 L160 A192 K194	G156-S158 VanDerWaalsContact C-N 3.27Å; G156-S158 PolarHBondContact O-N 3.1Å; G156-L159 PolarHBondContact O-N 3.42Å; G156-L160 WeakPolarHBondContact O-CG 3.45Å; G156-L160 PolarHBondContact O-N 2.88Å; G156-L160 VanDerWaalsContact O-N 3.08Å; G156-A192 PolarHBondContact N-O 3.11Å; G156-K194 PolarHBondContact N-O 3.49Å
157	Q	92.3	Very high	91.2	Very high	75 Å²	75	49.8 Å²	49.8	35%	0.35	26%	0.261	S	S	.	.	H	α-helix	trans	-54.2	-38.8	172.7	-171.6	58.5	44.4	0	0	113.1	L155 L159 L160 D161 A192	L155-Q157 HydrophobicContact CB-CB 4.43Å; L155-Q157 PolarHBondContact O-N 2.94Å; Q157-L159 VanDerWaalsContact C-N 3.35Å; Q157-L159 PolarHBondContact O-N 3Å; Q157-L160 WeakPolarHBondContact O-CB 3.44Å; Q157-L160 PolarHBondContact O-N 2.99Å; Q157-D161 WeakPolarHBondContact CG-OD2 3.48Å; Q157-D161 PolarHBondContact NE2-OD1 2.85Å; Q157-D161 PolarHBondContact NE2-OD2 3.43Å; Q157-D161 WeakPolarHBondContact O-CB 3.49Å; Q157-D161 PolarHBondContact O-N 2.84Å; Q157-A192 HydrophobicContact CB-CB 4.27Å; Q157-A192 PolarHBondContact N-O 2.71Å
158	S	92.6	Very high	91	Very high	41 Å²	41	48.9 Å²	48.9	29%	0.287	27%	0.265	S	S	.	.	H	α-helix	trans	-59.2	-45.1	178.9	-175.2	0	0	0	0	111.9	L155 G156 D161 M162	L155-S158 VanDerWaalsContact O-CB 3.3Å; L155-S158 WeakPolarHBondContact O-CB 3.47Å; L155-S158 PolarHBondContact O-N 3.11Å; G156-S158 VanDerWaalsContact C-N 3.27Å; G156-S158 PolarHBondContact O-N 3.1Å; S158-D161 PolarHBondContact O-N 3.17Å; S158-M162 WeakPolarHBondContact O-CE 3.44Å; S158-M162 PolarHBondContact O-N 2.96Å; S158-M162 WeakPolarHBondContact OG-CE 3.33Å
159	L	92.5	Very high	90.9	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-74.7	-29.6	179.2	-174.5	57.6	0	0	0	112.3	C136 I138 F148 V150 G156 Q157 A163 L177 L190 L196 L208	C136-L159 HydrophobicContact CB-CD1 4.12Å; C136-L159 HydrophobicContact CB-CD2 4.01Å; I138-L159 HydrophobicContact CD1-CD1 3.85Å; I138-L159 HydrophobicContact CD1-CG 4.22Å; F148-L159 HydrophobicContact CB-CD1 4.07Å; F148-L159 HydrophobicContact CG-CD1 4.44Å; V150-L159 HydrophobicContact CG1-CB 4.38Å; V150-L159 HydrophobicContact CG1-CD1 3.83Å; G156-L159 PolarHBondContact O-N 3.42Å; Q157-L159 VanDerWaalsContact C-N 3.35Å; Q157-L159 PolarHBondContact O-N 3Å; L159-A163 PolarHBondContact O-N 3.07Å; L159-A163 VanDerWaalsContact O-N 3.14Å; L159-L177 HydrophobicContact CG-CD1 3.98Å; L159-L190 HydrophobicContact CB-CD2 4.27Å; L159-L190 HydrophobicContact CD2-CD2 4.09Å; L159-L190 HydrophobicContact CG-CD2 4.4Å; L159-L196 HydrophobicContact CB-CD1 4.46Å; L159-L196 HydrophobicContact CB-CD2 4.43Å; L159-L196 HydrophobicContact CD2-CD2 4.12Å; L159-L208 HydrophobicContact CD2-CD1 3.51Å; L159-L208 HydrophobicContact CG-CD1 4.39Å
160	L	93.2	Very high	90.8	Very high	8 Å²	8	45 Å²	45	4%	0.042	26%	0.255	C	S	.	.	H	α-helix	trans	-66.8	-47.4	170.4	-70.8	163.4	0	0	0	111.1	G156 Q157 M162 A163 Y164 L177 L190 A192	G156-L160 WeakPolarHBondContact O-CG 3.45Å; G156-L160 PolarHBondContact O-N 2.88Å; G156-L160 VanDerWaalsContact O-N 3.08Å; Q157-L160 WeakPolarHBondContact O-CB 3.44Å; Q157-L160 PolarHBondContact O-N 2.99Å; L160-M162 VanDerWaalsContact C-N 3.32Å; L160-M162 PolarHBondContact O-N 3.27Å; L160-A163 WeakPolarHBondContact O-CB 3.49Å; L160-A163 PolarHBondContact O-N 3Å; L160-A163 VanDerWaalsContact O-N 3.09Å; L160-Y164 HydrophobicContact CB-CD2 4.33Å; L160-Y164 HydrophobicContact CB-CE2 3.77Å; L160-Y164 WeakPolarHBondContact O-CD2 3.45Å; L160-Y164 PolarHBondContact O-N 2.67Å; L160-L177 HydrophobicContact CD2-CB 4.03Å; L160-L177 HydrophobicContact CD2-CD1 3.81Å; L160-L177 HydrophobicContact CD2-CG 3.73Å; L160-L177 HydrophobicContact CG-CD1 4.27Å; L160-L190 HydrophobicContact CG-CD2 4.35Å; L160-A192 HydrophobicContact CD1-CB 3.79Å
161	D	93.6	Very high	90.9	Very high	68 Å²	68	45.8 Å²	45.8	36%	0.364	26%	0.259	S	S	.	.	H	α-helix	trans	-64.9	-34.3	179	-72.8	-39.5	0	0	0	112.7	Q157 S158 G165	Q157-D161 WeakPolarHBondContact CG-OD2 3.48Å; Q157-D161 PolarHBondContact NE2-OD1 2.85Å; Q157-D161 PolarHBondContact NE2-OD2 3.43Å; Q157-D161 WeakPolarHBondContact O-CB 3.49Å; Q157-D161 PolarHBondContact O-N 2.84Å; S158-D161 PolarHBondContact O-N 3.17Å; D161-G165 PolarHBondContact O-N 3.22Å
162	M	93.3	Very high	91.1	Very high	61 Å²	61	48.7 Å²	48.7	30%	0.3	27%	0.271	S	S	.	.	H	α-helix	trans	-63.8	-41.8	169.3	-87.2	175.9	-95	0	0	112.8	F148 V150 S158 L160 H166	F148-M162 HydrophobicContact CD1-CB 3.8Å; F148-M162 HydrophobicContact CD1-CG 4.25Å; F148-M162 HydrophobicContact CD1-SD 4.18Å; F148-M162 HydrophobicContact CE1-CB 3.9Å; V150-M162 HydrophobicContact CG1-CE 3.55Å; V150-M162 HydrophobicContact CG1-SD 4.09Å; S158-M162 WeakPolarHBondContact O-CE 3.44Å; S158-M162 PolarHBondContact O-N 2.96Å; S158-M162 WeakPolarHBondContact OG-CE 3.33Å; L160-M162 VanDerWaalsContact C-N 3.32Å; L160-M162 PolarHBondContact O-N 3.27Å; M162-H166 WeakPolarHBondContact O-CB 3.45Å; M162-H166 PolarHBondContact O-N 2.92Å
163	A	93.6	Very high	91.4	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-66.9	-44.9	176	0	0	0	0	0	112.1	I138 F140 L159 L160 H166 L167 L177 F210	I138-A163 HydrophobicContact CD1-CB 3.81Å; F140-A163 HydrophobicContact CE1-CB 4.14Å; F140-A163 HydrophobicContact CZ-CB 4.28Å; L159-A163 PolarHBondContact O-N 3.07Å; L159-A163 VanDerWaalsContact O-N 3.14Å; L160-A163 WeakPolarHBondContact O-CB 3.49Å; L160-A163 PolarHBondContact O-N 3Å; L160-A163 VanDerWaalsContact O-N 3.09Å; A163-H166 PolarHBondContact O-N 2.99Å; A163-L167 PolarHBondContact O-N 3.44Å; A163-L177 HydrophobicContact CB-CD1 4.29Å; A163-L177 HydrophobicContact CB-CD2 4.38Å; A163-F210 HydrophobicContact CB-CD2 4.31Å
164	Y	94.1	Very high	91.7	Very high	17 Å²	17	43.5 Å²	43.5	7%	0.067	25%	0.247	C	C	.	.	H	α-helix	trans	-64.7	-39.1	176.2	-57.9	-38.2	0	0	0	112.2	L160 G168 V169 K172 F175 F210	L160-Y164 HydrophobicContact CB-CD2 4.33Å; L160-Y164 HydrophobicContact CB-CE2 3.77Å; L160-Y164 WeakPolarHBondContact O-CD2 3.45Å; L160-Y164 PolarHBondContact O-N 2.67Å; Y164-G168 WeakPolarHBondContact O-CA 3.36Å; Y164-G168 PolarHBondContact O-N 2.88Å; Y164-V169 PolarHBondContact O-N 2.83Å; Y164-K172 HydrophobicContact CD1-CB 4.41Å; Y164-K172 HydrophobicContact CD1-CG 4.27Å; Y164-K172 HydrophobicContact CD2-CB 4Å; Y164-K172 HydrophobicContact CD2-CD 3.65Å; Y164-K172 HydrophobicContact CD2-CG 3.88Å; Y164-K172 HydrophobicContact CE1-CB 4.44Å; Y164-K172 HydrophobicContact CE2-CB 3.98Å; Y164-K172 HydrophobicContact CE2-CD 4.36Å; Y164-K172 HydrophobicContact CE2-CG 4.38Å; Y164-K172 HydrophobicContact CG-CB 4.22Å; Y164-K172 HydrophobicContact CG-CD 3.92Å; Y164-K172 HydrophobicContact CG-CG 3.82Å; Y164-K172 PolarHBondContact OH-O 3.38Å; Y164-F175 HydrophobicContact CE1-CB 3.97Å; Y164-F175 PolarHBondContact OH-O 3.34Å; Y164-F210 AromaticContact CD1-CE2 3.81Å; Y164-F210 HydrophobicContact CD1-CE2 3.81Å; Y164-F210 HydrophobicContact CD1-CZ 4.32Å; Y164-F210 AromaticContact CE1-CE2 3.76Å; Y164-F210 HydrophobicContact CE1-CE2 3.76Å; Y164-F210 HydrophobicContact CE1-CZ 4.31Å
165	G	92.2	Very high	92	Very high	56 Å²	56	41.3 Å²	41.3	58%	0.577	24%	0.235	S	C	*	.	H	α-helix	trans	-70.2	-32	178	0	0	0	0	0	113.6	D161	D161-G165 PolarHBondContact O-N 3.22Å
166	H	92.4	Very high	92.1	Very high	87 Å²	87	37.5 Å²	37.5	40%	0.403	22%	0.217	S	C	.	.	H	α-helix	trans	-68.3	-39.6	174	179.2	80.8	0	0	0	112.4	F140 F148 M162 A163	F140-H166 AromaticContact CE2-CD2 3.22Å; F140-H166 WeakPolarHBondContact CE2-CD2 3.44Å; F140-H166 AromaticContact CE2-NE2 3.65Å; F140-H166 HydrophobicContact CZ-CB 4.4Å; F140-H166 AromaticContact CZ-CD2 3.58Å; F148-H166 HydrophobicContact CE1-CB 4.31Å; F148-H166 HydrophobicContact CZ-CB 3.87Å; M162-H166 WeakPolarHBondContact O-CB 3.45Å; M162-H166 PolarHBondContact O-N 2.92Å; A163-H166 PolarHBondContact O-N 2.99Å
167	L	90.3	Very high	92.2	Very high	30 Å²	30	37.5 Å²	37.5	16%	0.157	22%	0.217	C	C	.	.	H	α-helix	trans	-81.2	-28	175.6	-65	178.3	0	0	0	113.4	F140 A163 V169 F210 Q226 L230	F140-L167 HydrophobicContact CD1-CD1 3.72Å; F140-L167 HydrophobicContact CD1-CD2 3.97Å; F140-L167 HydrophobicContact CD1-CG 3.98Å; F140-L167 HydrophobicContact CE1-CD1 3.77Å; F140-L167 HydrophobicContact CE1-CD2 4.19Å; F140-L167 HydrophobicContact CE1-CG 3.81Å; F140-L167 HydrophobicContact CG-CD2 4.19Å; F140-L167 HydrophobicContact CZ-CG 4.34Å; A163-L167 PolarHBondContact O-N 3.44Å; L167-V169 HydrophobicContact CB-CG2 3.8Å; L167-V169 HydrophobicContact CD1-CG2 4.2Å; L167-F210 HydrophobicContact CD1-CD1 4.08Å; L167-F210 HydrophobicContact CD1-CD2 4.36Å; L167-F210 HydrophobicContact CD1-CE1 3.66Å; L167-F210 HydrophobicContact CD1-CE2 3.97Å; L167-F210 HydrophobicContact CD1-CG 4.41Å; L167-F210 HydrophobicContact CD1-CZ 3.6Å; L167-Q226 PolarHBondContact O-NE2 2.77Å; L167-L230 HydrophobicContact CD1-CD1 4.37Å; L167-L230 HydrophobicContact CD1-CD2 4.35Å
168	G	89.2	Confident	92.2	Very high	45 Å²	45	35.2 Å²	35.2	46%	0.464	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	88.9	4.9	-173.1	0	0	0	0	0	115.2	Y164 T170	Y164-G168 WeakPolarHBondContact O-CA 3.36Å; Y164-G168 PolarHBondContact O-N 2.88Å; G168-T170 PolarHBondContact O-N 3.45Å
169	V	88.5	Confident	91.8	Very high	2 Å²	2	35.2 Å²	35.2	1%	0.012	20%	0.201	C	C	.	.			trans	-58.6	129	-172.8	176.4	0	0	0	0	112.3	Y164 L167 K172 F175 L230	Y164-V169 PolarHBondContact O-N 2.83Å; L167-V169 HydrophobicContact CB-CG2 3.8Å; L167-V169 HydrophobicContact CD1-CG2 4.2Å; V169-K172 HydrophobicContact CG1-CG 4.24Å; V169-K172 WeakPolarHBondContact O-CE 3.15Å; V169-K172 WeakPolarHBondContact O-CG 3.14Å; V169-F175 HydrophobicContact CG1-CD2 3.88Å; V169-F175 HydrophobicContact CG1-CE2 3.77Å; V169-L230 HydrophobicContact CG2-CD1 3.4Å; V169-L230 VanDerWaalsContact CG2-CD1 3.4Å
170	T	88.8	Confident	90.6	Very high	91 Å²	91	36.4 Å²	36.4	56%	0.558	21%	0.214	S	C	*	.	S	Bend	trans	-96.4	-44.5	176.7	52.4	0	0	0	0	112.7	G168 K172 Q224	G168-T170 PolarHBondContact O-N 3.45Å; T170-K172 PolarHBondContact O-N 3.2Å; T170-Q224 WeakPolarHBondContact OG1-CG 3.48Å
171	E	89.8	Confident	89	Confident	21 Å²	21	43.1 Å²	43.1	10%	0.098	25%	0.25	C	C	.	.			trans	-77.5	58.2	173.6	-64.4	178.9	101.8	0	0	111.5	E173 Y174 F175 Q223 Q224 T227	E171-E173 VanDerWaalsContact C-OE2 3.25Å; E171-E173 PolarHBondContact O-N 3.17Å; E171-Y174 HydrophobicContact CB-CD2 3.76Å; E171-Y174 HydrophobicContact CB-CE2 3.68Å; E171-Y174 HydrophobicContact CG-CE2 4.22Å; E171-Y174 WeakPolarHBondContact O-CD2 3.45Å; E171-F175 WeakPolarHBondContact O-CD2 3.42Å; E171-Q223 PolarHBondContact OE1-N 2.93Å; E171-Q223 VanDerWaalsContact OE1-N 3.15Å; E171-Q223 PolarHBondContact OE2-N 3.04Å; E171-Q224 HydrophobicContact CG-CG 4.1Å; E171-Q224 WeakPolarHBondContact OE2-CB 3.24Å; E171-Q224 WeakPolarHBondContact OE2-CG 3.27Å; E171-Q224 PolarHBondContact OE2-N 3.33Å; E171-T227 HydrophobicContact CB-CG2 4.18Å; E171-T227 VanDerWaalsContact OE2-CB 3.23Å; E171-T227 WeakPolarHBondContact OE2-CB 3.28Å; E171-T227 PolarHBondContact OE2-OG1 2.98Å
172	K	92.8	Very high	87.3	Confident	79 Å²	79	43.2 Å²	43.2	34%	0.343	25%	0.25	S	S	.	.	G	3₁₀ helix	trans	-64.4	-23.1	-170.3	-64.2	173.2	-179.1	-170.7	0	113.8	Y164 V169 T170 Y174 F175	Y164-K172 HydrophobicContact CD1-CB 4.41Å; Y164-K172 HydrophobicContact CD1-CG 4.27Å; Y164-K172 HydrophobicContact CD2-CB 4Å; Y164-K172 HydrophobicContact CD2-CD 3.65Å; Y164-K172 HydrophobicContact CD2-CG 3.88Å; Y164-K172 HydrophobicContact CE1-CB 4.44Å; Y164-K172 HydrophobicContact CE2-CB 3.98Å; Y164-K172 HydrophobicContact CE2-CD 4.36Å; Y164-K172 HydrophobicContact CE2-CG 4.38Å; Y164-K172 HydrophobicContact CG-CB 4.22Å; Y164-K172 HydrophobicContact CG-CD 3.92Å; Y164-K172 HydrophobicContact CG-CG 3.82Å; Y164-K172 PolarHBondContact OH-O 3.38Å; V169-K172 HydrophobicContact CG1-CG 4.24Å; V169-K172 WeakPolarHBondContact O-CE 3.15Å; V169-K172 WeakPolarHBondContact O-CG 3.14Å; T170-K172 PolarHBondContact O-N 3.2Å; K172-Y174 PolarHBondContact O-N 3.48Å; K172-F175 PolarHBondContact O-N 3.42Å
173	E	91.2	Very high	85.3	Confident	83 Å²	83	46.4 Å²	46.4	39%	0.388	28%	0.275	S	S	.	.	G	3₁₀ helix	trans	-70	-18.1	-171.2	75.4	-87.1	-152.7	0	0	114.1	E171 F175 Y214 F412 K416	E171-E173 VanDerWaalsContact C-OE2 3.25Å; E171-E173 PolarHBondContact O-N 3.17Å; E173-F175 VanDerWaalsContact C-N 3.34Å; E173-Y214 VanDerWaalsContact O-CD2 3.31Å; E173-Y214 WeakPolarHBondContact O-CD2 3.39Å; E173-F412 HydrophobicContact CB-CE2 4.04Å; E173-F412 HydrophobicContact CG-CE2 3.66Å; E173-F412 HydrophobicContact CG-CZ 3.99Å; E173-K416 WeakPolarHBondContact OE1-CE 3.48Å; E173-K416 IonicContact OE1-NZ 2.67Å; E173-K416 PolarHBondContact OE1-NZ 3.36Å
174	Y	93.3	Very high	83.4	Confident	9 Å²	9	51.9 Å²	51.9	4%	0.035	31%	0.309	C	S	.	.	G	3₁₀ helix	trans	-78.8	-15.2	178.6	-60	-55.5	0	0	0	114	E171 K172 R213 Y214 I216 L222 T227 Y231 F412 K416	E171-Y174 HydrophobicContact CB-CD2 3.76Å; E171-Y174 HydrophobicContact CB-CE2 3.68Å; E171-Y174 HydrophobicContact CG-CE2 4.22Å; E171-Y174 WeakPolarHBondContact O-CD2 3.45Å; K172-Y174 PolarHBondContact O-N 3.48Å; Y174-R213 WeakPolarHBondContact O-CA 3.34Å; Y174-R213 WeakPolarHBondContact O-CB 3.42Å; Y174-R213 PolarHBondContact O-N 3.16Å; Y174-Y214 PolarHBondContact O-N 2.88Å; Y174-I216 HydrophobicContact CD1-CD1 4.13Å; Y174-I216 HydrophobicContact CD1-CG1 4.25Å; Y174-I216 HydrophobicContact CE1-CD1 3.38Å; Y174-I216 HydrophobicContact CE1-CG1 3.86Å; Y174-I216 HydrophobicContact CE2-CD1 4.35Å; Y174-L222 HydrophobicContact CD2-CD2 3.96Å; Y174-L222 HydrophobicContact CE2-CD2 3.57Å; Y174-T227 HydrophobicContact CD2-CG2 3.84Å; Y174-T227 HydrophobicContact CE2-CG2 4.27Å; Y174-Y231 WeakPolarHBondContact CB-OH 3.34Å; Y174-Y231 WeakPolarHBondContact CD1-OH 3.43Å; Y174-Y231 HydrophobicContact CG-CE2 4.32Å; Y174-F412 HydrophobicContact CD1-CE1 4.31Å; Y174-F412 AromaticContact CD1-CZ 3.64Å; Y174-F412 HydrophobicContact CD1-CZ 3.64Å; Y174-F412 HydrophobicContact CE1-CE1 4.31Å; Y174-F412 AromaticContact CE1-CZ 3.74Å; Y174-F412 HydrophobicContact CE1-CZ 3.74Å; Y174-K416 VanDerWaalsContact CZ-NZ 3.34Å; Y174-K416 PolarHBondContact OH-NZ 3Å
175	F	95.1	Very high	81.6	Confident	7 Å²	7	52.2 Å²	52.2	3%	0.031	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	168	-167.6	-59.6	-79.7	0	0	0	112.7	Y164 V169 E171 K172 E173 F210 R211 V212 T227 L230 Y231	Y164-F175 HydrophobicContact CE1-CB 3.97Å; Y164-F175 PolarHBondContact OH-O 3.34Å; V169-F175 HydrophobicContact CG1-CD2 3.88Å; V169-F175 HydrophobicContact CG1-CE2 3.77Å; E171-F175 WeakPolarHBondContact O-CD2 3.42Å; K172-F175 PolarHBondContact O-N 3.42Å; E173-F175 VanDerWaalsContact C-N 3.34Å; F175-F210 HydrophobicContact CB-CE1 4.12Å; F175-F210 HydrophobicContact CB-CE2 4.03Å; F175-F210 HydrophobicContact CB-CZ 3.54Å; F175-F210 HydrophobicContact CD1-CD1 4.49Å; F175-F210 AromaticContact CD1-CE1 3.49Å; F175-F210 HydrophobicContact CD1-CE1 3.49Å; F175-F210 VanDerWaalsContact CD1-CE1 3.49Å; F175-F210 AromaticContact CD1-CZ 3.71Å; F175-F210 HydrophobicContact CD1-CZ 3.71Å; F175-F210 HydrophobicContact CD2-CZ 4.33Å; F175-F210 HydrophobicContact CE1-CE1 4.1Å; F175-F210 AromaticContact CG-CE1 3.91Å; F175-F210 HydrophobicContact CG-CE1 3.91Å; F175-F210 AromaticContact CG-CZ 3.6Å; F175-F210 HydrophobicContact CG-CZ 3.6Å; F175-R211 WeakPolarHBondContact CA-O 3.37Å; F175-V212 HydrophobicContact CD1-CG2 4.08Å; F175-V212 HydrophobicContact CE1-CG2 3.79Å; F175-T227 HydrophobicContact CE2-CG2 3.93Å; F175-T227 HydrophobicContact CZ-CG2 3.9Å; F175-L230 HydrophobicContact CE1-CB 3.63Å; F175-L230 HydrophobicContact CE1-CD1 4.12Å; F175-L230 HydrophobicContact CE2-CD1 4.4Å; F175-L230 HydrophobicContact CZ-CB 3.72Å; F175-L230 HydrophobicContact CZ-CD1 3.84Å; F175-L230 HydrophobicContact CZ-CG 4.46Å; F175-Y231 HydrophobicContact CE1-CD2 4.34Å; F175-Y231 HydrophobicContact CE1-CE2 4.37Å; F175-Y231 HydrophobicContact CZ-CD2 4.15Å; F175-Y231 HydrophobicContact CZ-CE2 4.1Å
176	G	94.2	Very high	80.3	Confident	7 Å²	7	50.2 Å²	50.2	7%	0.072	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-169	169.5	172.5	0	0	0	0	0	113.3	R211	G176-R211 PolarHBondContact N-O 3.26Å; G176-R211 PolarHBondContact O-N 3.48Å
177	L	93.8	Very high	79.3	Confident	1 Å²	1	48.8 Å²	48.8	1%	0.005	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	130.7	173.8	-67.7	168.7	0	0	0	110.4	I138 L159 L160 A163 W189 L190 L208 H209 F210	I138-L177 HydrophobicContact CD1-CD1 3.76Å; I138-L177 HydrophobicContact CD1-CD2 3.81Å; I138-L177 HydrophobicContact CD1-CG 4.47Å; I138-L177 HydrophobicContact CG1-CD2 4.16Å; I138-L177 HydrophobicContact CG2-CD2 3.61Å; L159-L177 HydrophobicContact CG-CD1 3.98Å; L160-L177 HydrophobicContact CD2-CB 4.03Å; L160-L177 HydrophobicContact CD2-CD1 3.81Å; L160-L177 HydrophobicContact CD2-CG 3.73Å; L160-L177 HydrophobicContact CG-CD1 4.27Å; A163-L177 HydrophobicContact CB-CD1 4.29Å; A163-L177 HydrophobicContact CB-CD2 4.38Å; L177-W189 CarbonylContact O-C 3.49Å; L177-W189 WeakPolarHBondContact O-CA 3.43Å; L177-L190 HydrophobicContact CB-CB 4.02Å; L177-L190 HydrophobicContact CB-CD2 4.2Å; L177-L190 HydrophobicContact CD1-CD2 3.94Å; L177-L190 WeakPolarHBondContact O-CB 3.38Å; L177-L190 PolarHBondContact O-N 3.3Å; L177-L208 HydrophobicContact CB-CB 4.49Å; L177-L208 HydrophobicContact CB-CD1 4.26Å; L177-L208 HydrophobicContact CD1-CD1 4.13Å; L177-L208 HydrophobicContact CD2-CB 4.39Å; L177-H209 WeakPolarHBondContact CA-O 3.46Å; L177-F210 HydrophobicContact CD2-CB 4.13Å; L177-F210 HydrophobicContact CD2-CD2 4.21Å
178	Q	90.7	Very high	79	Confident	27 Å²	27	50.3 Å²	50.3	13%	0.126	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	137.7	178.7	-172.6	176.5	94.3	0	0	109	P187 W189 L208 H209	Q178-P187 HydrophobicContact CG-CB 3.91Å; Q178-W189 HydrophobicContact CB-CE3 4.07Å; Q178-W189 HydrophobicContact CB-CZ3 4.09Å; Q178-L208 CarbonylContact O-C 3.57Å; Q178-L208 VanDerWaalsContact O-CA 3.23Å; Q178-L208 WeakPolarHBondContact O-CA 3.4Å; Q178-H209 PolarHBondContact N-O 2.8Å; Q178-H209 PolarHBondContact O-N 2.77Å
179	H	86.1	Confident	79.1	Confident	40 Å²	40	49.9 Å²	49.9	19%	0.185	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	133.7	177.7	-62	72.9	0	0	0	110.5	R188 L208	H179-R188 PolarHBondContact N-O 2.92Å; H179-R188 PolarHBondContact ND1-O 3.3Å; H179-L208 HydrophobicContact CB-CD2 4.18Å
180	G	67	Low	79.2	Confident	25 Å²	25	50.3 Å²	50.3	26%	0.258	28%	0.278	S	S	.	.			trans	-69	140.2	175.4	0	0	0	0	0	113	I207	G180-I207 PolarHBondContact N-O 3.37Å
181	D	58.9	Low	79.2	Confident	149 Å²	149	48.2 Å²	48.2	80%	0.797	26%	0.261	S	S	*	.			trans	36.7	82.6	159.5	-55.3	-16.7	0	0	0	118.6
182	D	57	Low	79.3	Confident	71 Å²	71	48.8 Å²	48.8	38%	0.38	27%	0.27	S	S	.	.			trans	-123.1	86.9	153.9	-175.7	-8.4	0	0	0	107.5	V184 D185 R188 R397	D182-V184 PolarHBondContact O-N 3.16Å; D182-D185 PolarHBondContact O-N 3.16Å; D182-R188 IonicContact OD2-CZ 3.25Å; D182-R188 IonicContact OD2-NH1 3.44Å; D182-R188 PolarHBondContact OD2-NH1 3.36Å; D182-R188 IonicContact OD2-NH2 4Å; D182-R188 PolarHBondContact OD2-NH2 3.29Å; D182-R397 IonicContact OD2-NH1 3.41Å
183	P	53.4	Low	79.1	Confident	127 Å²	127	49.5 Å²	49.5	83%	0.825	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	8.2	-158.8	28	-37.1	0	0	0	115.7
184	V	53.2	Low	79	Confident	116 Å²	116	49 Å²	49	70%	0.703	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.8	-14.4	-178.3	-173.8	0	0	0	0	112.3	D182	D182-V184 PolarHBondContact O-N 3.16Å
185	D	56.2	Low	78.9	Confident	23 Å²	23	50.2 Å²	50.2	12%	0.123	29%	0.29	C	S	.	.	S	Bend	trans	-128.1	153.8	-176.2	-106.5	-32.8	0	0	0	111.1	D182 R188 N395 R397 S398	D182-D185 PolarHBondContact O-N 3.16Å; D185-R188 IonicContact OD2-NH2 2.8Å; D185-N395 PolarHBondContact OD1-ND2 3.44Å; D185-R397 VanDerWaalsContact OD2-CD 3.28Å; D185-R397 WeakPolarHBondContact OD2-CD 3.19Å; D185-R397 IonicContact OD2-CZ 2.81Å; D185-R397 IonicContact OD2-NE 3.11Å; D185-R397 IonicContact OD2-NH1 2.7Å; D185-R397 PolarHBondContact OD2-NH1 3.47Å; D185-S398 PolarHBondContact OD1-OG 2.85Å
186	S	64.7	Low	78.5	Confident	15 Å²	15	50 Å²	50	11%	0.105	29%	0.289	C	S	.	.			trans	-54.6	145.4	174.6	53.6	0	0	0	0	112.5	R188 H327 N401	S186-R188 PolarHBondContact O-N 3.09Å; S186-H327 WeakPolarHBondContact CB-ND1 3.07Å; S186-H327 PolarHBondContact OG-ND1 2.86Å; S186-N401 PolarHBondContact OG-ND2 2.88Å; S186-N401 VanDerWaalsContact OG-ND2 3.12Å
187	P	71.4	Confident	78.1	Confident	56 Å²	56	58.5 Å²	58.5	36%	0.364	32%	0.319	S	S	.	.			trans	-54.4	135.9	179.7	21.1	-32.7	0	0	0	110.5	Q178	Q178-P187 HydrophobicContact CG-CB 3.91Å
188	R	84.3	Confident	77.7	Confident	62 Å²	62	65.3 Å²	65.3	23%	0.234	35%	0.349	C	S	.	.			trans	-108.3	118.1	-172.9	-91.3	163.6	-88.9	162.8	-8.2	110.7	H179 D182 D185 S186	H179-R188 PolarHBondContact N-O 2.92Å; H179-R188 PolarHBondContact ND1-O 3.3Å; D182-R188 IonicContact OD2-CZ 3.25Å; D182-R188 IonicContact OD2-NH1 3.44Å; D182-R188 PolarHBondContact OD2-NH1 3.36Å; D182-R188 IonicContact OD2-NH2 4Å; D182-R188 PolarHBondContact OD2-NH2 3.29Å; D185-R188 IonicContact OD2-NH2 2.8Å; S186-R188 PolarHBondContact O-N 3.09Å
189	W	89.8	Confident	77.4	Confident	36 Å²	36	65.2 Å²	65.2	14%	0.136	35%	0.348	C	S	.	.	B	Isolated β-bridge	trans	-73	148.7	171	-59.9	99.7	0	0	0	111.8	L177 Q178 E191 R211 V212 R213	L177-W189 CarbonylContact O-C 3.49Å; L177-W189 WeakPolarHBondContact O-CA 3.43Å; Q178-W189 HydrophobicContact CB-CE3 4.07Å; Q178-W189 HydrophobicContact CB-CZ3 4.09Å; W189-E191 PolarHBondContact O-N 3.43Å; W189-R211 HydrophobicContact CH2-CB 3.82Å; W189-R211 HydrophobicContact CZ3-CB 4.04Å; W189-V212 WeakPolarHBondContact CH2-O 3.13Å; W189-R213 VanDerWaalsContact CD2-CD 3.44Å; W189-R213 HydrophobicContact CH2-CB 4.41Å; W189-R213 HydrophobicContact CZ3-CB 4.37Å; W189-R213 VanDerWaalsContact NE1-CZ 3.34Å
190	L	91.3	Very high	77.2	Confident	12 Å²	12	64.6 Å²	64.6	6%	0.063	35%	0.346	C	S	.	.			trans	-76.9	116.1	174.2	-171.9	70.2	0	0	0	109.7	L159 L160 L177 A192 L196 Q199 L200 L208	L159-L190 HydrophobicContact CB-CD2 4.27Å; L159-L190 HydrophobicContact CD2-CD2 4.09Å; L159-L190 HydrophobicContact CG-CD2 4.4Å; L160-L190 HydrophobicContact CG-CD2 4.35Å; L177-L190 HydrophobicContact CB-CB 4.02Å; L177-L190 HydrophobicContact CB-CD2 4.2Å; L177-L190 HydrophobicContact CD1-CD2 3.94Å; L177-L190 WeakPolarHBondContact O-CB 3.38Å; L177-L190 PolarHBondContact O-N 3.3Å; L190-A192 PolarHBondContact O-N 3.15Å; L190-L196 HydrophobicContact CD1-CD2 3.98Å; L190-L196 HydrophobicContact CD2-CD2 4.32Å; L190-Q199 HydrophobicContact CD1-CB 4.22Å; L190-L200 HydrophobicContact CD1-CD2 4.27Å; L190-L208 HydrophobicContact CD2-CD1 4.28Å
191	E	89.8	Confident	77.1	Confident	46 Å²	46	71.8 Å²	71.8	22%	0.215	37%	0.37	C	S	.	.			trans	-78.1	106.5	-178	-50.8	-172.4	-105.4	0	0	109.8	W189 S193 K194 Q199 K404	W189-E191 PolarHBondContact O-N 3.43Å; E191-S193 PolarHBondContact O-N 3.13Å; E191-K194 HydrophobicContact CB-CB 4.31Å; E191-K194 HydrophobicContact CB-CD 4Å; E191-K194 HydrophobicContact CB-CG 4.42Å; E191-K194 HydrophobicContact CG-CD 4.34Å; E191-K194 PolarHBondContact O-N 3.22Å; E191-K194 VanDerWaalsContact O-N 3.08Å; E191-K194 VanDerWaalsContact OE1-CD 3.29Å; E191-K194 WeakPolarHBondContact OE1-CD 3.42Å; E191-K194 IonicContact OE1-NZ 3.47Å; E191-K194 PolarHBondContact OE1-NZ 3.13Å; E191-K194 IonicContact OE2-NZ 3.71Å; E191-K194 PolarHBondContact OE2-NZ 3.04Å; E191-Q199 VanDerWaalsContact CB-OE1 3.26Å; E191-Q199 PolarHBondContact O-NE2 3.05Å; E191-K404 IonicContact OE1-NZ 3.44Å; E191-K404 PolarHBondContact OE1-NZ 3.46Å; E191-K404 WeakPolarHBondContact OE2-CE 3.47Å; E191-K404 IonicContact OE2-NZ 3.4Å; E191-K404 PolarHBondContact OE2-NZ 2.87Å
192	A	90.1	Very high	77.2	Confident	33 Å²	33	67.8 Å²	67.8	27%	0.273	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-46.5	-41.9	-178.1	0	0	0	0	0	113.7	L155 G156 Q157 L160 L190 K194	L155-A192 WeakPolarHBondContact CB-O 3.31Å; G156-A192 PolarHBondContact N-O 3.11Å; Q157-A192 HydrophobicContact CB-CB 4.27Å; Q157-A192 PolarHBondContact N-O 2.71Å; L160-A192 HydrophobicContact CD1-CB 3.79Å; L190-A192 PolarHBondContact O-N 3.15Å; A192-K194 VanDerWaalsContact C-N 3.3Å; A192-K194 PolarHBondContact O-N 2.99Å
193	S	89.1	Confident	77.3	Confident	94 Å²	94	67.4 Å²	67.4	66%	0.657	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.9	5.7	-175.1	59.7	0	0	0	0	116	E191	E191-S193 PolarHBondContact O-N 3.13Å
194	K	90.1	Very high	77.8	Confident	74 Å²	74	66.5 Å²	66.5	32%	0.322	36%	0.364	S	S	.	.	S	Bend	trans	-122.3	138.6	-174.8	-76.6	172.3	-177	157.4	0	113.9	G156 E191 A192 L196 Q199	G156-K194 PolarHBondContact N-O 3.49Å; E191-K194 HydrophobicContact CB-CB 4.31Å; E191-K194 HydrophobicContact CB-CD 4Å; E191-K194 HydrophobicContact CB-CG 4.42Å; E191-K194 HydrophobicContact CG-CD 4.34Å; E191-K194 PolarHBondContact O-N 3.22Å; E191-K194 VanDerWaalsContact O-N 3.08Å; E191-K194 VanDerWaalsContact OE1-CD 3.29Å; E191-K194 WeakPolarHBondContact OE1-CD 3.42Å; E191-K194 IonicContact OE1-NZ 3.47Å; E191-K194 PolarHBondContact OE1-NZ 3.13Å; E191-K194 IonicContact OE2-NZ 3.71Å; E191-K194 PolarHBondContact OE2-NZ 3.04Å; A192-K194 VanDerWaalsContact C-N 3.3Å; A192-K194 PolarHBondContact O-N 2.99Å; K194-L196 PolarHBondContact O-N 2.91Å; K194-Q199 HydrophobicContact CB-CG 4.15Å; K194-Q199 PolarHBondContact O-NE2 3.27Å
195	P	90.3	Very high	78.4	Confident	34 Å²	34	64.7 Å²	64.7	22%	0.221	36%	0.355	C	S	.	.	B	Isolated β-bridge	trans	-54.9	133.9	173.6	-28.8	35.1	0	0	0	113	D154 L155 R197 K198	D154-P195 CarbonylContact O-C 3.59Å; D154-P195 WeakPolarHBondContact O-CA 3.29Å; L155-P195 HydrophobicContact CD2-CG 4.03Å; P195-R197 PolarHBondContact O-N 3.05Å; P195-R197 VanDerWaalsContact O-N 3.17Å; P195-K198 WeakPolarHBondContact O-CB 3.43Å; P195-K198 PolarHBondContact O-N 3.1Å
196	L	87.3	Confident	79.5	Confident	1 Å²	1	64.4 Å²	64.4	1%	0.005	36%	0.355	C	S	.	.	G	3₁₀ helix	trans	-53.1	-39	-177	-69.2	175.2	0	0	0	112.4	V150 D154 L159 L190 K194 K198 Q199 L200	V150-L196 HydrophobicContact CB-CD1 3.75Å; V150-L196 HydrophobicContact CG1-CD1 4.44Å; V150-L196 HydrophobicContact CG2-CD1 3.55Å; D154-L196 HydrophobicContact CB-CD1 4.38Å; D154-L196 WeakPolarHBondContact O-CG 3.47Å; D154-L196 PolarHBondContact O-N 2.65Å; L159-L196 HydrophobicContact CB-CD1 4.46Å; L159-L196 HydrophobicContact CB-CD2 4.43Å; L159-L196 HydrophobicContact CD2-CD2 4.12Å; L190-L196 HydrophobicContact CD1-CD2 3.98Å; L190-L196 HydrophobicContact CD2-CD2 4.32Å; K194-L196 PolarHBondContact O-N 2.91Å; L196-K198 PolarHBondContact O-N 3.39Å; L196-Q199 PolarHBondContact O-N 3.05Å; L196-L200 HydrophobicContact CB-CD1 3.96Å; L196-L200 HydrophobicContact CB-CG 4.25Å; L196-L200 HydrophobicContact CD2-CD1 4.2Å; L196-L200 HydrophobicContact CD2-CG 4.34Å; L196-L200 HydrophobicContact CG-CD1 4.48Å; L196-L200 PolarHBondContact O-N 3.41Å
197	R	85.3	Confident	80.6	Confident	187 Å²	187	67.9 Å²	67.9	71%	0.706	37%	0.371	S	S	*	.	G	3₁₀ helix	trans	-55.6	-19	174.6	-151.2	-176.6	89.1	164.7	6.7	115.1	K152 P195	K152-R197 HydrophobicContact CB-CB 4.07Å; K152-R197 HydrophobicContact CB-CG 4.15Å; K152-R197 VanDerWaalsContact O-CB 3.29Å; K152-R197 WeakPolarHBondContact O-CB 3.49Å; K152-R197 PolarHBondContact O-N 3.07Å; P195-R197 PolarHBondContact O-N 3.05Å; P195-R197 VanDerWaalsContact O-N 3.17Å
198	K	84.9	Confident	81.5	Confident	144 Å²	144	65.2 Å²	65.2	63%	0.626	35%	0.354	S	S	*	.	G	3₁₀ helix	trans	-92.4	-18	178.3	-64.1	-178.8	-177.7	172.9	0	112.6	P195 L196 K201	P195-K198 WeakPolarHBondContact O-CB 3.43Å; P195-K198 PolarHBondContact O-N 3.1Å; L196-K198 PolarHBondContact O-N 3.39Å; K198-K201 WeakPolarHBondContact O-CE 3.37Å
199	Q	85.8	Confident	81.9	Confident	25 Å²	25	63.2 Å²	63.2	12%	0.117	35%	0.347	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.9	-55.4	-172.2	-47.8	-159.3	69.5	0	0	111.1	L190 E191 K194 L196 K201	L190-Q199 HydrophobicContact CD1-CB 4.22Å; E191-Q199 VanDerWaalsContact CB-OE1 3.26Å; E191-Q199 PolarHBondContact O-NE2 3.05Å; K194-Q199 HydrophobicContact CB-CG 4.15Å; K194-Q199 PolarHBondContact O-NE2 3.27Å; L196-Q199 PolarHBondContact O-N 3.05Å; Q199-K201 PolarHBondContact O-N 3.22Å
200	L	80.4	Confident	82.1	Confident	26 Å²	26	61.6 Å²	61.6	14%	0.136	34%	0.341	C	S	.	.			trans	-69.6	97.4	179.3	-48.2	-176.4	0	0	0	109.1	V134 C136 L190 L196 L208	V134-L200 HydrophobicContact CG1-CD1 3.96Å; C136-L200 VanDerWaalsContact SG-CD1 3.52Å; L190-L200 HydrophobicContact CD1-CD2 4.27Å; L196-L200 HydrophobicContact CB-CD1 3.96Å; L196-L200 HydrophobicContact CB-CG 4.25Å; L196-L200 HydrophobicContact CD2-CD1 4.2Å; L196-L200 HydrophobicContact CD2-CG 4.34Å; L196-L200 HydrophobicContact CG-CD1 4.48Å; L196-L200 PolarHBondContact O-N 3.41Å; L200-L208 HydrophobicContact CD2-CD2 4.36Å
201	K	65.4	Low	82.3	Confident	177 Å²	177	62 Å²	62	77%	0.77	34%	0.342	S	S	*	.			trans	-129.8	73.6	-177.7	-68.1	-169	178.8	-167.8	0	110.3	K198 Q199	K198-K201 WeakPolarHBondContact O-CE 3.37Å; Q199-K201 PolarHBondContact O-N 3.22Å
202	G	61.6	Low	82.5	Confident	64 Å²	64	60 Å²	60	66%	0.66	33%	0.333	S	S	*	.	S	Bend	trans	-160.3	-169.2	177.2	0	0	0	0	0	110.3
203	G	59.1	Low	82.7	Confident	63 Å²	63	59.2 Å²	59.2	65%	0.649	32%	0.323	S	S	*	.	S	Bend	trans	-62	161.9	168.8	0	0	0	0	0	112.2
204	L	63.4	Low	82.9	Confident	108 Å²	108	56.2 Å²	56.2	57%	0.565	30%	0.297	S	S	*	.	S	Bend	trans	-104	140.3	168.6	-68.3	170.8	0	0	0	108.5	V134	V134-L204 HydrophobicContact CB-CD2 4.4Å; V134-L204 HydrophobicContact CG1-CD2 3.8Å; V134-L204 HydrophobicContact CG2-CD2 3.99Å
205	P	66.5	Low	83.1	Confident	78 Å²	78	53.8 Å²	53.8	51%	0.506	29%	0.287	S	S	.	.	S	Bend	cis	-70.6	149.7	-1	31.7	-36.2	0	0	0	112.6	T135	T135-P205 HydrophobicContact CG2-CB 4.3Å
206	C	79.1	Confident	83.1	Confident	17 Å²	17	53.1 Å²	53.1	12%	0.115	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	121.8	176	-175.2	0	0	0	0	110.1	T135 C136 S137	T135-C206 PolarHBondContact O-N 3.46Å; C136-C206 WeakPolarHBondContact CA-O 3.47Å; S137-C206 PolarHBondContact N-O 2.98Å
207	I	86.9	Confident	83	Confident	89 Å²	89	56.9 Å²	56.9	46%	0.456	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	128	179	-57.8	175.5	0	0	0	109.9	S137 G180	S137-I207 WeakPolarHBondContact O-CA 2.96Å; G180-I207 PolarHBondContact N-O 3.37Å
208	L	90.3	Very high	83.1	Confident	0 Å²	0	50 Å²	50	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	148.3	171	-54.8	178.1	0	0	0	109.3	S137 I138 R139 L159 L177 Q178 H179 L190 L200	S137-L208 PolarHBondContact O-N 2.68Å; I138-L208 CarbonylContact C-O 3.52Å; I138-L208 VanDerWaalsContact CA-O 3.3Å; I138-L208 WeakPolarHBondContact CA-O 3.28Å; I138-L208 HydrophobicContact CG1-CB 4.42Å; R139-L208 PolarHBondContact N-O 3.27Å; L159-L208 HydrophobicContact CD2-CD1 3.51Å; L159-L208 HydrophobicContact CG-CD1 4.39Å; L177-L208 HydrophobicContact CB-CB 4.49Å; L177-L208 HydrophobicContact CB-CD1 4.26Å; L177-L208 HydrophobicContact CD1-CD1 4.13Å; L177-L208 HydrophobicContact CD2-CB 4.39Å; Q178-L208 CarbonylContact O-C 3.57Å; Q178-L208 VanDerWaalsContact O-CA 3.23Å; Q178-L208 WeakPolarHBondContact O-CA 3.4Å; H179-L208 HydrophobicContact CB-CD2 4.18Å; L190-L208 HydrophobicContact CD2-CD1 4.28Å; L200-L208 HydrophobicContact CD2-CD2 4.36Å
209	H	92.5	Very high	82.9	Confident	19 Å²	19	43.4 Å²	43.4	9%	0.088	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	130.8	172.2	-60.4	172.7	0	0	0	109.3	R139 L177 Q178 R211	R139-H209 WeakPolarHBondContact O-CA 3.47Å; L177-H209 WeakPolarHBondContact CA-O 3.46Å; Q178-H209 PolarHBondContact N-O 2.8Å; Q178-H209 PolarHBondContact O-N 2.77Å; H209-R211 HydrophobicContact CB-CG 4.35Å
210	F	95	Very high	82.7	Confident	2 Å²	2	46.6 Å²	46.6	1%	0.009	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	128.3	167.4	-173.6	-89.9	0	0	0	108.8	I138 R139 F140 L141 A163 Y164 L167 F175 L177 L230	I138-F210 HydrophobicContact CG2-CB 4.19Å; R139-F210 PolarHBondContact O-N 2.61Å; F140-F210 HydrophobicContact CD1-CB 3.57Å; F140-F210 HydrophobicContact CD1-CD1 4.25Å; F140-F210 HydrophobicContact CD1-CD2 4.18Å; F140-F210 AromaticContact CD1-CG 3.77Å; F140-F210 HydrophobicContact CD1-CG 3.77Å; F140-F210 HydrophobicContact CE1-CB 4.04Å; F140-F210 AromaticContact CE1-CD2 3.99Å; F140-F210 HydrophobicContact CE1-CD2 3.99Å; F140-F210 HydrophobicContact CE1-CG 4.06Å; L141-F210 HydrophobicContact CD1-CD1 3.91Å; L141-F210 HydrophobicContact CD1-CE1 4.16Å; L141-F210 VanDerWaalsContact CD2-O 3.25Å; L141-F210 WeakPolarHBondContact CD2-O 3.33Å; L141-F210 HydrophobicContact CG-CD1 4.07Å; A163-F210 HydrophobicContact CB-CD2 4.31Å; Y164-F210 AromaticContact CD1-CE2 3.81Å; Y164-F210 HydrophobicContact CD1-CE2 3.81Å; Y164-F210 HydrophobicContact CD1-CZ 4.32Å; Y164-F210 AromaticContact CE1-CE2 3.76Å; Y164-F210 HydrophobicContact CE1-CE2 3.76Å; Y164-F210 HydrophobicContact CE1-CZ 4.31Å; L167-F210 HydrophobicContact CD1-CD1 4.08Å; L167-F210 HydrophobicContact CD1-CD2 4.36Å; L167-F210 HydrophobicContact CD1-CE1 3.66Å; L167-F210 HydrophobicContact CD1-CE2 3.97Å; L167-F210 HydrophobicContact CD1-CG 4.41Å; L167-F210 HydrophobicContact CD1-CZ 3.6Å; F175-F210 HydrophobicContact CB-CE1 4.12Å; F175-F210 HydrophobicContact CB-CE2 4.03Å; F175-F210 HydrophobicContact CB-CZ 3.54Å; F175-F210 HydrophobicContact CD1-CD1 4.49Å; F175-F210 AromaticContact CD1-CE1 3.49Å; F175-F210 HydrophobicContact CD1-CE1 3.49Å; F175-F210 VanDerWaalsContact CD1-CE1 3.49Å; F175-F210 AromaticContact CD1-CZ 3.71Å; F175-F210 HydrophobicContact CD1-CZ 3.71Å; F175-F210 HydrophobicContact CD2-CZ 4.33Å; F175-F210 HydrophobicContact CE1-CE1 4.1Å; F175-F210 AromaticContact CG-CE1 3.91Å; F175-F210 HydrophobicContact CG-CE1 3.91Å; F175-F210 AromaticContact CG-CZ 3.6Å; F175-F210 HydrophobicContact CG-CZ 3.6Å; L177-F210 HydrophobicContact CD2-CB 4.13Å; L177-F210 HydrophobicContact CD2-CD2 4.21Å; F210-L230 HydrophobicContact CE1-CD1 4.45Å
211	R	94.8	Very high	83	Confident	21 Å²	21	48.1 Å²	48.1	8%	0.079	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145	158.1	-177.7	-66.8	-160.1	-171.1	-72.9	13.6	111.7	F175 G176 W189 H209 R213 Q234 M237	F175-R211 WeakPolarHBondContact CA-O 3.37Å; G176-R211 PolarHBondContact N-O 3.26Å; G176-R211 PolarHBondContact O-N 3.48Å; W189-R211 HydrophobicContact CH2-CB 3.82Å; W189-R211 HydrophobicContact CZ3-CB 4.04Å; H209-R211 HydrophobicContact CB-CG 4.35Å; R211-R213 PolarHBondContact O-N 3.39Å; R211-Q234 VanDerWaalsContact CA-OE1 3.31Å; R211-Q234 VanDerWaalsContact CB-OE1 3.27Å; R211-M237 PolarHBondContact NH1-SD 2.71Å
212	V	94.7	Very high	84	Confident	5 Å²	5	39.9 Å²	39.9	3%	0.03	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	127	165.7	179.6	0	0	0	0	108.6	F175 W189 F215 Y231 Q234	F175-V212 HydrophobicContact CD1-CG2 4.08Å; F175-V212 HydrophobicContact CE1-CG2 3.79Å; W189-V212 WeakPolarHBondContact CH2-O 3.13Å; V212-F215 HydrophobicContact CB-CD2 4.47Å; V212-F215 HydrophobicContact CB-CE1 4.26Å; V212-F215 HydrophobicContact CB-CE2 3.91Å; V212-F215 HydrophobicContact CB-CZ 3.8Å; V212-F215 HydrophobicContact CG1-CD1 4.2Å; V212-F215 HydrophobicContact CG1-CD2 3.83Å; V212-F215 HydrophobicContact CG1-CE1 4.15Å; V212-F215 HydrophobicContact CG1-CE2 3.77Å; V212-F215 HydrophobicContact CG1-CG 4.06Å; V212-F215 HydrophobicContact CG1-CZ 3.96Å; V212-Y231 HydrophobicContact CG1-CE1 3.94Å; V212-Y231 HydrophobicContact CG1-CE2 4.05Å; V212-Y231 HydrophobicContact CG2-CD2 3.95Å; V212-Y231 HydrophobicContact CG2-CE2 4.12Å; V212-Y231 HydrophobicContact CG2-CG 4.23Å; V212-Q234 HydrophobicContact CB-CG 3.96Å; V212-Q234 HydrophobicContact CG2-CB 3.78Å; V212-Q234 HydrophobicContact CG2-CG 3.74Å
213	R	93.5	Very high	85.1	Confident	15 Å²	15	43.2 Å²	43.2	6%	0.057	25%	0.246	C	C	.	.	S	Bend	trans	-89.6	-36.9	178.9	-180	70.6	-162.7	107.8	-16.8	112.2	Y174 W189 R211 E325 S405 E408 H409	Y174-R213 WeakPolarHBondContact O-CA 3.34Å; Y174-R213 WeakPolarHBondContact O-CB 3.42Å; Y174-R213 PolarHBondContact O-N 3.16Å; W189-R213 VanDerWaalsContact CD2-CD 3.44Å; W189-R213 HydrophobicContact CH2-CB 4.41Å; W189-R213 HydrophobicContact CZ3-CB 4.37Å; W189-R213 VanDerWaalsContact NE1-CZ 3.34Å; R211-R213 PolarHBondContact O-N 3.39Å; R213-E325 IonicContact CZ-OE2 3.33Å; R213-E325 IonicContact NH1-OE2 2.68Å; R213-E325 PolarHBondContact NH1-OE2 2.92Å; R213-E325 IonicContact NH2-OE2 2.84Å; R213-E325 PolarHBondContact NH2-OE2 3.39Å; R213-S405 PolarHBondContact NH2-OG 2.99Å; R213-E408 IonicContact CZ-OE2 3.3Å; R213-E408 IonicContact NE-OE2 2.72Å; R213-E408 IonicContact NH2-OE2 2.92Å; R213-E408 PolarHBondContact NH2-OE2 2.79Å; R213-H409 PolarHBondContact NH1-CE1 3.34Å
214	Y	93.9	Very high	86.6	Confident	31 Å²	31	44.7 Å²	44.7	12%	0.122	24%	0.236	C	C	.	.			trans	-137	109.9	-174	-53	-68.7	0	0	0	111.8	E173 Y174 Y231 F412 F413	E173-Y214 VanDerWaalsContact O-CD2 3.31Å; E173-Y214 WeakPolarHBondContact O-CD2 3.39Å; Y174-Y214 PolarHBondContact O-N 2.88Å; Y214-Y231 PolarHBondContact O-OH 3.4Å; Y214-F412 HydrophobicContact CD1-CB 4.15Å; Y214-F412 HydrophobicContact CD1-CD1 4.12Å; Y214-F412 HydrophobicContact CD1-CG 4.02Å; Y214-F412 HydrophobicContact CD2-CB 4.48Å; Y214-F412 HydrophobicContact CD2-CD1 4.02Å; Y214-F412 AromaticContact CD2-CD2 3.44Å; Y214-F412 HydrophobicContact CD2-CD2 3.44Å; Y214-F412 VanDerWaalsContact CD2-CD2 3.44Å; Y214-F412 HydrophobicContact CD2-CE1 4.06Å; Y214-F412 AromaticContact CD2-CE2 3.47Å; Y214-F412 HydrophobicContact CD2-CE2 3.47Å; Y214-F412 VanDerWaalsContact CD2-CE2 3.47Å; Y214-F412 AromaticContact CD2-CG 3.73Å; Y214-F412 HydrophobicContact CD2-CG 3.73Å; Y214-F412 AromaticContact CD2-CZ 3.8Å; Y214-F412 HydrophobicContact CD2-CZ 3.8Å; Y214-F412 HydrophobicContact CE1-CB 3.93Å; Y214-F412 HydrophobicContact CE1-CG 4.16Å; Y214-F412 HydrophobicContact CE2-CB 4.28Å; Y214-F412 AromaticContact CE2-CD2 3.44Å; Y214-F412 HydrophobicContact CE2-CD2 3.44Å; Y214-F412 VanDerWaalsContact CE2-CD2 3.44Å; Y214-F412 AromaticContact CE2-CE2 3.84Å; Y214-F412 HydrophobicContact CE2-CE2 3.84Å; Y214-F412 AromaticContact CE2-CG 3.88Å; Y214-F412 HydrophobicContact CE2-CG 3.88Å; Y214-F412 HydrophobicContact CG-CB 4.41Å; Y214-F412 AromaticContact CG-CD1 3.74Å; Y214-F412 HydrophobicContact CG-CD1 3.74Å; Y214-F412 HydrophobicContact CG-CD2 4.01Å; Y214-F412 AromaticContact CG-CE1 3.92Å; Y214-F412 HydrophobicContact CG-CE1 3.92Å; Y214-F412 HydrophobicContact CG-CE2 4.17Å; Y214-F412 AromaticContact CG-CG 3.79Å; Y214-F412 HydrophobicContact CG-CG 3.79Å; Y214-F412 HydrophobicContact CG-CZ 4.13Å; Y214-F413 HydrophobicContact CD1-CE2 4.1Å; Y214-F413 HydrophobicContact CG-CE2 4.49Å
215	F	93.6	Very high	87.9	Confident	23 Å²	23	44.7 Å²	44.7	10%	0.101	23%	0.233	C	C	.	.			trans	-85.3	130.3	177.7	-66.6	-105.6	0	0	0	110.8	V212 Y231 Q234 L235 Y322 G323 F413	V212-F215 HydrophobicContact CB-CD2 4.47Å; V212-F215 HydrophobicContact CB-CE1 4.26Å; V212-F215 HydrophobicContact CB-CE2 3.91Å; V212-F215 HydrophobicContact CB-CZ 3.8Å; V212-F215 HydrophobicContact CG1-CD1 4.2Å; V212-F215 HydrophobicContact CG1-CD2 3.83Å; V212-F215 HydrophobicContact CG1-CE1 4.15Å; V212-F215 HydrophobicContact CG1-CE2 3.77Å; V212-F215 HydrophobicContact CG1-CG 4.06Å; V212-F215 HydrophobicContact CG1-CZ 3.96Å; F215-Y231 HydrophobicContact CD1-CD1 4.33Å; F215-Y231 HydrophobicContact CD1-CE1 4.24Å; F215-Q234 HydrophobicContact CE1-CG 4.12Å; F215-Q234 HydrophobicContact CZ-CG 3.7Å; F215-L235 HydrophobicContact CD1-CD2 4.3Å; F215-L235 HydrophobicContact CE1-CD2 3.75Å; F215-L235 HydrophobicContact CE1-CG 4.2Å; F215-Y322 HydrophobicContact CB-CE1 3.93Å; F215-Y322 HydrophobicContact CD1-CE2 4.02Å; F215-Y322 AromaticContact CD1-CZ 3.99Å; F215-G323 VanDerWaalsContact CG-CA 3.4Å; F215-F413 VanDerWaalsContact O-CZ 3.3Å; F215-F413 WeakPolarHBondContact O-CZ 3.33Å
216	I	91	Very high	89.1	Confident	20 Å²	20	44.7 Å²	44.7	10%	0.103	23%	0.226	C	C	.	.			trans	-85.6	138.6	-178.3	-42.7	-178.4	0	0	0	109.5	Y174 D218 L222 Y322	Y174-I216 HydrophobicContact CD1-CD1 4.13Å; Y174-I216 HydrophobicContact CD1-CG1 4.25Å; Y174-I216 HydrophobicContact CE1-CD1 3.38Å; Y174-I216 HydrophobicContact CE1-CG1 3.86Å; Y174-I216 HydrophobicContact CE2-CD1 4.35Å; I216-D218 WeakPolarHBondContact CG2-O 3.48Å; I216-D218 PolarHBondContact O-N 3.07Å; I216-L222 HydrophobicContact CD1-CD2 3.35Å; I216-L222 HydrophobicContact CD1-CG 4.06Å; I216-L222 HydrophobicContact CG1-CD2 4.31Å; I216-Y322 WeakPolarHBondContact O-CE1 3.45Å; I216-Y322 PolarHBondContact O-OH 2.91Å
217	P	86	Confident	89.8	Confident	80 Å²	80	43.9 Å²	43.9	52%	0.519	22%	0.221	S	C	.	.	S	Bend	trans	-57.3	-33.1	173.4	-25.8	34.2	0	0	0	114.5
218	D	85.8	Confident	90.2	Very high	44 Å²	44	42.1 Å²	42.1	24%	0.235	21%	0.208	C	C	.	.			trans	-119.5	100.8	177.2	-178	7.4	0	0	0	109.8	I216 N220 T221	I216-D218 WeakPolarHBondContact CG2-O 3.48Å; I216-D218 PolarHBondContact O-N 3.07Å; D218-N220 PolarHBondContact O-N 3.46Å; D218-N220 WeakPolarHBondContact OD1-CB 3.22Å; D218-N220 PolarHBondContact OD1-N 2.78Å; D218-N220 VanDerWaalsContact OD1-N 3.09Å; D218-N220 PolarHBondContact OD1-ND2 2.7Å; D218-T221 HydrophobicContact CB-CG2 4.15Å; D218-T221 PolarHBondContact O-N 2.73Å; D218-T221 PolarHBondContact O-OG1 2.94Å
219	P	81.8	Confident	90.4	Very high	4 Å²	4	44.8 Å²	44.8	3%	0.026	22%	0.22	C	C	.	.	G	3₁₀ helix	trans	-71.3	-15.3	-178.7	32.3	-37.3	0	0	0	112.5	T221 L222 I313 R317	P219-T221 PolarHBondContact O-N 3.19Å; P219-L222 HydrophobicContact CB-CD1 4.4Å; P219-L222 VanDerWaalsContact O-CB 3.23Å; P219-L222 WeakPolarHBondContact O-CB 3.04Å; P219-L222 VanDerWaalsContact O-CG 3.29Å; P219-L222 WeakPolarHBondContact O-CG 3.21Å; P219-L222 PolarHBondContact O-N 3.4Å; P219-I313 HydrophobicContact CB-CG2 3.45Å; P219-I313 VanDerWaalsContact CB-CG2 3.45Å; P219-I313 HydrophobicContact CG-CG2 3.83Å; P219-R317 VanDerWaalsContact CD-CD 3.46Å
220	N	81.1	Confident	90.5	Very high	93 Å²	93	44.4 Å²	44.4	50%	0.497	22%	0.219	S	C	.	.	G	3₁₀ helix	trans	-71.1	-9.6	177.1	-48.7	-73.6	0	0	0	111.6	D218 L222 N314	D218-N220 PolarHBondContact O-N 3.46Å; D218-N220 WeakPolarHBondContact OD1-CB 3.22Å; D218-N220 PolarHBondContact OD1-N 2.78Å; D218-N220 VanDerWaalsContact OD1-N 3.09Å; D218-N220 PolarHBondContact OD1-ND2 2.7Å; N220-L222 VanDerWaalsContact C-N 3.35Å; N220-N314 PolarHBondContact ND2-OD1 3.39Å; N220-N314 VanDerWaalsContact ND2-OD1 3.11Å; N220-N314 PolarHBondContact OD1-ND2 3.22Å
221	T	86.2	Confident	90.5	Very high	58 Å²	58	44.3 Å²	44.3	36%	0.356	22%	0.219	S	C	.	.	G	3₁₀ helix	trans	-78.6	-12.6	168.4	66	0	0	0	0	114	D218 P219 Q223	D218-T221 HydrophobicContact CB-CG2 4.15Å; D218-T221 PolarHBondContact O-N 2.73Å; D218-T221 PolarHBondContact O-OG1 2.94Å; P219-T221 PolarHBondContact O-N 3.19Å; T221-Q223 PolarHBondContact O-N 3.44Å; T221-Q223 PolarHBondContact O-NE2 2.93Å
222	L	86.8	Confident	90.6	Very high	3 Å²	3	43.5 Å²	43.5	2%	0.016	22%	0.216	C	C	.	.			trans	-69.2	111.9	174.2	-63.9	176.9	0	0	0	109.7	Y174 I216 P219 N220 T227 R228 Y231	Y174-L222 HydrophobicContact CD2-CD2 3.96Å; Y174-L222 HydrophobicContact CE2-CD2 3.57Å; I216-L222 HydrophobicContact CD1-CD2 3.35Å; I216-L222 HydrophobicContact CD1-CG 4.06Å; I216-L222 HydrophobicContact CG1-CD2 4.31Å; P219-L222 HydrophobicContact CB-CD1 4.4Å; P219-L222 VanDerWaalsContact O-CB 3.23Å; P219-L222 WeakPolarHBondContact O-CB 3.04Å; P219-L222 VanDerWaalsContact O-CG 3.29Å; P219-L222 WeakPolarHBondContact O-CG 3.21Å; P219-L222 PolarHBondContact O-N 3.4Å; N220-L222 VanDerWaalsContact C-N 3.35Å; L222-T227 HydrophobicContact CD1-CG2 4.37Å; L222-T227 HydrophobicContact CD2-CG2 3.74Å; L222-T227 HydrophobicContact CG-CG2 4.44Å; L222-R228 HydrophobicContact CB-CG 3.82Å; L222-R228 HydrophobicContact CD1-CG 4.12Å; L222-R228 PolarHBondContact O-NH1 2.86Å; L222-Y231 HydrophobicContact CD1-CD1 3.98Å; L222-Y231 HydrophobicContact CD1-CD2 3.85Å; L222-Y231 HydrophobicContact CD1-CE1 4.16Å; L222-Y231 HydrophobicContact CD1-CE2 4.01Å; L222-Y231 HydrophobicContact CD1-CG 3.81Å; L222-Y231 HydrophobicContact CD2-CE2 4.08Å
223	Q	85.9	Confident	90.6	Very high	135 Å²	135	44.6 Å²	44.6	63%	0.631	22%	0.221	S	C	*	.			trans	-71.8	-44.6	-170.4	-60.9	-59.1	-72.7	0	0	111.4	E171 T221 R228	E171-Q223 PolarHBondContact OE1-N 2.93Å; E171-Q223 VanDerWaalsContact OE1-N 3.15Å; E171-Q223 PolarHBondContact OE2-N 3.04Å; T221-Q223 PolarHBondContact O-N 3.44Å; T221-Q223 PolarHBondContact O-NE2 2.93Å; Q223-R228 PolarHBondContact O-NH1 3.19Å
224	Q	90.3	Very high	90.7	Very high	94 Å²	94	44.1 Å²	44.1	44%	0.439	22%	0.22	S	C	.	.			trans	-91.5	140.5	-171	-51	-65	-40.9	0	0	112.2	T170 E171 Q226 T227 R228	T170-Q224 WeakPolarHBondContact OG1-CG 3.48Å; E171-Q224 HydrophobicContact CG-CG 4.1Å; E171-Q224 WeakPolarHBondContact OE2-CB 3.24Å; E171-Q224 WeakPolarHBondContact OE2-CG 3.27Å; E171-Q224 PolarHBondContact OE2-N 3.33Å; Q224-Q226 VanDerWaalsContact C-N 3.32Å; Q224-Q226 PolarHBondContact O-N 3.46Å; Q224-T227 WeakPolarHBondContact O-CB 3.33Å; Q224-T227 PolarHBondContact O-N 3.5Å; Q224-T227 VanDerWaalsContact O-N 3.1Å; Q224-R228 PolarHBondContact O-N 3.3Å; Q224-R228 VanDerWaalsContact O-N 3.16Å
225	E	89.7	Confident	90.8	Very high	107 Å²	107	42.7 Å²	42.7	50%	0.5	21%	0.214	S	C	.	.	H	α-helix	trans	-60.7	-41.8	175.7	-166.3	163.9	119.3	0	0	112	T227 R228 H229 S306	E225-T227 VanDerWaalsContact C-N 3.27Å; E225-T227 PolarHBondContact O-N 2.88Å; E225-R228 WeakPolarHBondContact O-CB 3.37Å; E225-R228 PolarHBondContact O-N 3.06Å; E225-R228 VanDerWaalsContact O-N 3.1Å; E225-R228 IonicContact OE2-NH2 3.11Å; E225-H229 PolarHBondContact O-N 3.23Å; E225-S306 WeakPolarHBondContact OE1-CB 3.4Å; E225-S306 WeakPolarHBondContact OE2-CB 3.18Å
226	Q	92.8	Very high	90.9	Very high	78 Å²	78	44.1 Å²	44.1	36%	0.364	22%	0.22	S	C	.	.	H	α-helix	trans	-58.7	-36.5	173.6	-177.6	175.8	63.4	0	0	112.8	L167 Q224 H229 L230	L167-Q226 PolarHBondContact O-NE2 2.77Å; Q224-Q226 VanDerWaalsContact C-N 3.32Å; Q224-Q226 PolarHBondContact O-N 3.46Å; Q226-H229 PolarHBondContact O-N 3.23Å; Q226-L230 HydrophobicContact CG-CD1 4.16Å; Q226-L230 VanDerWaalsContact O-CG 3.32Å; Q226-L230 WeakPolarHBondContact O-CG 3.41Å; Q226-L230 PolarHBondContact O-N 2.93Å
227	T	93.7	Very high	91	Very high	1 Å²	1	45 Å²	45	1%	0.006	23%	0.225	C	C	.	.	H	α-helix	trans	-66.7	-43.1	176.1	-48.4	0	0	0	0	110.5	E171 Y174 F175 L222 Q224 E225 L230 Y231	E171-T227 HydrophobicContact CB-CG2 4.18Å; E171-T227 VanDerWaalsContact OE2-CB 3.23Å; E171-T227 WeakPolarHBondContact OE2-CB 3.28Å; E171-T227 PolarHBondContact OE2-OG1 2.98Å; Y174-T227 HydrophobicContact CD2-CG2 3.84Å; Y174-T227 HydrophobicContact CE2-CG2 4.27Å; F175-T227 HydrophobicContact CE2-CG2 3.93Å; F175-T227 HydrophobicContact CZ-CG2 3.9Å; L222-T227 HydrophobicContact CD1-CG2 4.37Å; L222-T227 HydrophobicContact CD2-CG2 3.74Å; L222-T227 HydrophobicContact CG-CG2 4.44Å; Q224-T227 WeakPolarHBondContact O-CB 3.33Å; Q224-T227 PolarHBondContact O-N 3.5Å; Q224-T227 VanDerWaalsContact O-N 3.1Å; E225-T227 VanDerWaalsContact C-N 3.27Å; E225-T227 PolarHBondContact O-N 2.88Å; T227-L230 PolarHBondContact O-N 2.85Å; T227-Y231 HydrophobicContact CG2-CD2 4.17Å; T227-Y231 HydrophobicContact CG2-CE2 3.99Å; T227-Y231 VanDerWaalsContact O-CD2 3.24Å; T227-Y231 WeakPolarHBondContact O-CD2 3.25Å; T227-Y231 PolarHBondContact O-N 3.46Å
228	R	93.7	Very high	91.3	Very high	51 Å²	51	41.9 Å²	41.9	19%	0.192	20%	0.204	C	C	.	.	H	α-helix	trans	-60.8	-47.1	174.5	-64.3	-172.5	-64.6	-86.3	2	110.9	L222 Q223 Q224 E225 L230 Y231 F232 I313	L222-R228 HydrophobicContact CB-CG 3.82Å; L222-R228 HydrophobicContact CD1-CG 4.12Å; L222-R228 PolarHBondContact O-NH1 2.86Å; Q223-R228 PolarHBondContact O-NH1 3.19Å; Q224-R228 PolarHBondContact O-N 3.3Å; Q224-R228 VanDerWaalsContact O-N 3.16Å; E225-R228 WeakPolarHBondContact O-CB 3.37Å; E225-R228 PolarHBondContact O-N 3.06Å; E225-R228 VanDerWaalsContact O-N 3.1Å; E225-R228 IonicContact OE2-NH2 3.11Å; R228-L230 PolarHBondContact O-N 3.38Å; R228-Y231 CarbonylContact O-C 3.57Å; R228-Y231 WeakPolarHBondContact O-CA 3.09Å; R228-Y231 WeakPolarHBondContact O-CB 3.44Å; R228-Y231 PolarHBondContact O-N 3.05Å; R228-F232 PolarHBondContact O-N 2.68Å; R228-I313 HydrophobicContact CB-CD1 4.03Å; R228-I313 VanDerWaalsContact O-CD1 3.24Å; R228-I313 WeakPolarHBondContact O-CD1 3.48Å
229	H	95.1	Very high	91.7	Very high	56 Å²	56	40.2 Å²	40.2	26%	0.259	20%	0.195	S	C	.	.	H	α-helix	trans	-55.4	-46.3	175.9	-176.6	71.8	0	0	0	113.2	E225 Q226 Y231 F232 L233 Q305 E309	E225-H229 PolarHBondContact O-N 3.23Å; Q226-H229 PolarHBondContact O-N 3.23Å; H229-Y231 VanDerWaalsContact C-N 3.34Å; H229-Y231 PolarHBondContact O-N 3.13Å; H229-F232 WeakPolarHBondContact O-CB 3.32Å; H229-F232 PolarHBondContact O-N 2.89Å; H229-L233 WeakPolarHBondContact NE2-CD1 3.38Å; H229-L233 WeakPolarHBondContact O-CG 3.35Å; H229-L233 PolarHBondContact O-N 2.61Å; H229-Q305 PolarHBondContact CE1-NE2 3.08Å; H229-E309 WeakPolarHBondContact CA-OE2 3.23Å; H229-E309 VanDerWaalsContact CB-OE2 3.32Å; H229-E309 WeakPolarHBondContact CB-OE2 3.49Å; H229-E309 IonicContact CE1-OE1 3.79Å; H229-E309 PolarHBondContact CE1-OE1 3.2Å; H229-E309 IonicContact CG-OE1 3.02Å; H229-E309 IonicContact CG-OE2 2.73Å; H229-E309 IonicContact ND1-OE1 2.68Å; H229-E309 PolarHBondContact ND1-OE1 2.94Å; H229-E309 IonicContact ND1-OE2 2.63Å; H229-E309 PolarHBondContact ND1-OE2 3.16Å
230	L	95.3	Very high	92.2	Very high	11 Å²	11	41.5 Å²	41.5	6%	0.058	20%	0.204	C	C	.	.	H	α-helix	trans	-67.5	-31.9	176.8	-67.4	168.3	0	0	0	112.7	L141 L167 V169 F175 F210 Q226 T227 R228 Q234	L141-L230 HydrophobicContact CD1-CB 4.17Å; L141-L230 HydrophobicContact CD1-CD2 4.09Å; L141-L230 WeakPolarHBondContact CD1-O 3.39Å; L167-L230 HydrophobicContact CD1-CD1 4.37Å; L167-L230 HydrophobicContact CD1-CD2 4.35Å; V169-L230 HydrophobicContact CG2-CD1 3.4Å; V169-L230 VanDerWaalsContact CG2-CD1 3.4Å; F175-L230 HydrophobicContact CE1-CB 3.63Å; F175-L230 HydrophobicContact CE1-CD1 4.12Å; F175-L230 HydrophobicContact CE2-CD1 4.4Å; F175-L230 HydrophobicContact CZ-CB 3.72Å; F175-L230 HydrophobicContact CZ-CD1 3.84Å; F175-L230 HydrophobicContact CZ-CG 4.46Å; F210-L230 HydrophobicContact CE1-CD1 4.45Å; Q226-L230 HydrophobicContact CG-CD1 4.16Å; Q226-L230 VanDerWaalsContact O-CG 3.32Å; Q226-L230 WeakPolarHBondContact O-CG 3.41Å; Q226-L230 PolarHBondContact O-N 2.93Å; T227-L230 PolarHBondContact O-N 2.85Å; R228-L230 PolarHBondContact O-N 3.38Å; L230-Q234 WeakPolarHBondContact O-CB 3.43Å; L230-Q234 PolarHBondContact O-N 3.1Å; L230-Q234 VanDerWaalsContact O-N 3.12Å
231	Y	95	Very high	92.6	Very high	0 Å²	0	42 Å²	42	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-66.8	-43.1	169.9	-90.2	-117.3	0	0	0	111.6	Y174 F175 V212 Y214 F215 L222 T227 R228 H229 Q234 L235	Y174-Y231 WeakPolarHBondContact CB-OH 3.34Å; Y174-Y231 WeakPolarHBondContact CD1-OH 3.43Å; Y174-Y231 HydrophobicContact CG-CE2 4.32Å; F175-Y231 HydrophobicContact CE1-CD2 4.34Å; F175-Y231 HydrophobicContact CE1-CE2 4.37Å; F175-Y231 HydrophobicContact CZ-CD2 4.15Å; F175-Y231 HydrophobicContact CZ-CE2 4.1Å; V212-Y231 HydrophobicContact CG1-CE1 3.94Å; V212-Y231 HydrophobicContact CG1-CE2 4.05Å; V212-Y231 HydrophobicContact CG2-CD2 3.95Å; V212-Y231 HydrophobicContact CG2-CE2 4.12Å; V212-Y231 HydrophobicContact CG2-CG 4.23Å; Y214-Y231 PolarHBondContact O-OH 3.4Å; F215-Y231 HydrophobicContact CD1-CD1 4.33Å; F215-Y231 HydrophobicContact CD1-CE1 4.24Å; L222-Y231 HydrophobicContact CD1-CD1 3.98Å; L222-Y231 HydrophobicContact CD1-CD2 3.85Å; L222-Y231 HydrophobicContact CD1-CE1 4.16Å; L222-Y231 HydrophobicContact CD1-CE2 4.01Å; L222-Y231 HydrophobicContact CD1-CG 3.81Å; L222-Y231 HydrophobicContact CD2-CE2 4.08Å; T227-Y231 HydrophobicContact CG2-CD2 4.17Å; T227-Y231 HydrophobicContact CG2-CE2 3.99Å; T227-Y231 VanDerWaalsContact O-CD2 3.24Å; T227-Y231 WeakPolarHBondContact O-CD2 3.25Å; T227-Y231 PolarHBondContact O-N 3.46Å; R228-Y231 CarbonylContact O-C 3.57Å; R228-Y231 WeakPolarHBondContact O-CA 3.09Å; R228-Y231 WeakPolarHBondContact O-CB 3.44Å; R228-Y231 PolarHBondContact O-N 3.05Å; H229-Y231 VanDerWaalsContact C-N 3.34Å; H229-Y231 PolarHBondContact O-N 3.13Å; Y231-Q234 PolarHBondContact O-N 2.95Å; Y231-L235 WeakPolarHBondContact O-CB 3.36Å; Y231-L235 WeakPolarHBondContact O-CD1 3.25Å; Y231-L235 WeakPolarHBondContact O-CG 3.21Å; Y231-L235 PolarHBondContact O-N 3.44Å
232	F	96	Very high	92.6	Very high	4 Å²	4	41.1 Å²	41.1	2%	0.018	21%	0.206	C	C	.	.	H	α-helix	trans	-57.7	-51.1	174.7	158.6	-106.1	0	0	0	111.6	R228 H229 Q234 L235 K236 A258 S261 E309 Y312 I313	R228-F232 PolarHBondContact O-N 2.68Å; H229-F232 WeakPolarHBondContact O-CB 3.32Å; H229-F232 PolarHBondContact O-N 2.89Å; F232-Q234 PolarHBondContact O-N 3.43Å; F232-L235 PolarHBondContact O-N 3.01Å; F232-L235 VanDerWaalsContact O-N 3.17Å; F232-K236 HydrophobicContact CE2-CD 4.42Å; F232-K236 HydrophobicContact CZ-CD 3.98Å; F232-K236 WeakPolarHBondContact O-CB 3.42Å; F232-K236 PolarHBondContact O-N 2.84Å; F232-A258 HydrophobicContact CE2-CB 3.87Å; F232-A258 HydrophobicContact CZ-CB 3.99Å; F232-S261 WeakPolarHBondContact CE1-OG 3.48Å; F232-S261 VanDerWaalsContact CZ-OG 3.25Å; F232-S261 WeakPolarHBondContact CZ-OG 3.25Å; F232-E309 HydrophobicContact CB-CB 4.11Å; F232-E309 HydrophobicContact CB-CG 4.1Å; F232-E309 HydrophobicContact CD1-CG 3.61Å; F232-E309 HydrophobicContact CD2-CB 4.46Å; F232-E309 HydrophobicContact CD2-CG 4.07Å; F232-E309 HydrophobicContact CE1-CG 3.96Å; F232-E309 HydrophobicContact CE2-CG 4.39Å; F232-E309 HydrophobicContact CG-CB 4.13Å; F232-E309 HydrophobicContact CG-CG 3.66Å; F232-E309 HydrophobicContact CZ-CG 4.32Å; F232-Y312 AromaticContact CD2-CD1 3.73Å; F232-Y312 HydrophobicContact CD2-CD1 3.73Å; F232-Y312 AromaticContact CD2-CD2 3.94Å; F232-Y312 HydrophobicContact CD2-CD2 3.94Å; F232-Y312 HydrophobicContact CD2-CE1 4.32Å; F232-Y312 HydrophobicContact CD2-CE2 4.48Å; F232-Y312 AromaticContact CD2-CG 3.56Å; F232-Y312 HydrophobicContact CD2-CG 3.56Å; F232-Y312 HydrophobicContact CE2-CD1 4.28Å; F232-Y312 AromaticContact CE2-CD2 3.67Å; F232-Y312 HydrophobicContact CE2-CD2 3.67Å; F232-Y312 HydrophobicContact CE2-CE2 4.11Å; F232-Y312 AromaticContact CE2-CG 3.79Å; F232-Y312 HydrophobicContact CE2-CG 3.79Å; F232-I313 HydrophobicContact CB-CD1 4.15Å; F232-I313 HydrophobicContact CB-CG1 4.16Å
233	L	96.3	Very high	92.5	Very high	29 Å²	29	46 Å²	46	15%	0.152	22%	0.224	C	C	.	.	H	α-helix	trans	-60.5	-42.5	178.3	-68.2	179.6	0	0	0	112.5	L141 D142 H229 L235 M237	L141-L233 HydrophobicContact CB-CB 3.8Å; L141-L233 HydrophobicContact CB-CD1 4.14Å; D142-L233 HydrophobicContact CB-CD1 4.36Å; H229-L233 WeakPolarHBondContact NE2-CD1 3.38Å; H229-L233 WeakPolarHBondContact O-CG 3.35Å; H229-L233 PolarHBondContact O-N 2.61Å; L233-L235 PolarHBondContact O-N 3.39Å; L233-M237 WeakPolarHBondContact O-CB 3.48Å; L233-M237 PolarHBondContact O-N 3.07Å
234	Q	95.5	Very high	92.7	Very high	4 Å²	4	39.9 Å²	39.9	2%	0.019	20%	0.195	C	C	.	.	H	α-helix	trans	-59.9	-45.1	174.5	173.5	68.9	64	0	0	111.7	L141 R211 V212 F215 L230 Y231 F232 D238	L141-Q234 HydrophobicContact CD1-CB 4.19Å; L141-Q234 HydrophobicContact CD2-CB 4.13Å; R211-Q234 VanDerWaalsContact CA-OE1 3.31Å; R211-Q234 VanDerWaalsContact CB-OE1 3.27Å; V212-Q234 HydrophobicContact CB-CG 3.96Å; V212-Q234 HydrophobicContact CG2-CB 3.78Å; V212-Q234 HydrophobicContact CG2-CG 3.74Å; F215-Q234 HydrophobicContact CE1-CG 4.12Å; F215-Q234 HydrophobicContact CZ-CG 3.7Å; L230-Q234 WeakPolarHBondContact O-CB 3.43Å; L230-Q234 PolarHBondContact O-N 3.1Å; L230-Q234 VanDerWaalsContact O-N 3.12Å; Y231-Q234 PolarHBondContact O-N 2.95Å; F232-Q234 PolarHBondContact O-N 3.43Å; Q234-D238 PolarHBondContact NE2-OD1 2.88Å; Q234-D238 PolarHBondContact NE2-OD2 3.5Å; Q234-D238 WeakPolarHBondContact O-CB 3.44Å; Q234-D238 PolarHBondContact O-N 3.45Å
235	L	95.3	Very high	92.4	Very high	1 Å²	1	38.6 Å²	38.6	1%	0.005	19%	0.194	C	C	.	.	H	α-helix	trans	-71.6	-38.8	-178.8	-67.8	162.3	0	0	0	112.3	F215 Y231 F232 L233 M237 D238 V239 L244 Y312 I313 A316 Y322	F215-L235 HydrophobicContact CD1-CD2 4.3Å; F215-L235 HydrophobicContact CE1-CD2 3.75Å; F215-L235 HydrophobicContact CE1-CG 4.2Å; Y231-L235 WeakPolarHBondContact O-CB 3.36Å; Y231-L235 WeakPolarHBondContact O-CD1 3.25Å; Y231-L235 WeakPolarHBondContact O-CG 3.21Å; Y231-L235 PolarHBondContact O-N 3.44Å; F232-L235 PolarHBondContact O-N 3.01Å; F232-L235 VanDerWaalsContact O-N 3.17Å; L233-L235 PolarHBondContact O-N 3.39Å; L235-M237 VanDerWaalsContact C-N 3.35Å; L235-M237 PolarHBondContact O-N 3.08Å; L235-D238 PolarHBondContact O-N 3.18Å; L235-D238 VanDerWaalsContact O-N 3.13Å; L235-V239 WeakPolarHBondContact O-CG2 3.44Å; L235-V239 PolarHBondContact O-N 2.86Å; L235-L244 HydrophobicContact CD2-CD2 3.79Å; L235-Y312 HydrophobicContact CB-CD1 4.44Å; L235-Y312 HydrophobicContact CB-CE1 3.81Å; L235-I313 HydrophobicContact CD1-CB 4.38Å; L235-I313 HydrophobicContact CD1-CG1 4.15Å; L235-I313 HydrophobicContact CD1-CG2 3.96Å; L235-A316 HydrophobicContact CB-CB 4.5Å; L235-A316 HydrophobicContact CD1-CB 4.04Å; L235-A316 HydrophobicContact CD2-CB 4.34Å; L235-Y322 HydrophobicContact CD1-CE2 3.96Å; L235-Y322 HydrophobicContact CD2-CD2 3.8Å; L235-Y322 HydrophobicContact CD2-CE2 3.74Å
236	K	94.9	Very high	92.1	Very high	53 Å²	53	35.2 Å²	35.2	23%	0.23	18%	0.182	C	C	.	.	H	α-helix	trans	-57.4	-47.4	172.5	-176.7	176.3	179.9	173.2	0	111	F232 C240 A258 Y312	F232-K236 HydrophobicContact CE2-CD 4.42Å; F232-K236 HydrophobicContact CZ-CD 3.98Å; F232-K236 WeakPolarHBondContact O-CB 3.42Å; F232-K236 PolarHBondContact O-N 2.84Å; K236-C240 VanDerWaalsContact O-CB 3.29Å; K236-C240 WeakPolarHBondContact O-CB 3.29Å; K236-C240 PolarHBondContact O-N 3.15Å; K236-A258 HydrophobicContact CD-CB 4.09Å; K236-Y312 WeakPolarHBondContact CA-OH 3.08Å
237	M	93.5	Very high	91.7	Very high	39 Å²	39	35.2 Å²	35.2	19%	0.192	19%	0.189	C	C	.	.	H	α-helix	trans	-64.6	-39.7	172.7	173.2	-175.9	41.8	0	0	112.4	L141 R211 L233 L235 V239 C240 E241	L141-M237 HydrophobicContact CD2-CE 3.31Å; R211-M237 PolarHBondContact NH1-SD 2.71Å; L233-M237 WeakPolarHBondContact O-CB 3.48Å; L233-M237 PolarHBondContact O-N 3.07Å; L235-M237 VanDerWaalsContact C-N 3.35Å; L235-M237 PolarHBondContact O-N 3.08Å; M237-V239 PolarHBondContact O-N 3.29Å; M237-C240 PolarHBondContact O-N 2.99Å; M237-E241 HydrophobicContact CG-CG 4.1Å; M237-E241 WeakPolarHBondContact CG-OE2 3.22Å; M237-E241 VanDerWaalsContact O-CB 3.26Å; M237-E241 WeakPolarHBondContact O-CB 3.24Å; M237-E241 WeakPolarHBondContact O-CG 3.02Å; M237-E241 PolarHBondContact O-N 3.34Å
238	D	93.1	Very high	91.3	Very high	15 Å²	15	39.3 Å²	39.3	8%	0.08	21%	0.21	C	C	.	.	H	α-helix	trans	-66.8	-34.7	179.2	-73.2	-33.9	0	0	0	112.8	Q234 L235 G242 R243 L244	Q234-D238 PolarHBondContact NE2-OD1 2.88Å; Q234-D238 PolarHBondContact NE2-OD2 3.5Å; Q234-D238 WeakPolarHBondContact O-CB 3.44Å; Q234-D238 PolarHBondContact O-N 3.45Å; L235-D238 PolarHBondContact O-N 3.18Å; L235-D238 VanDerWaalsContact O-N 3.13Å; D238-G242 PolarHBondContact O-N 3.3Å; D238-R243 HydrophobicContact CB-CB 4.22Å; D238-R243 WeakPolarHBondContact O-CA 3.35Å; D238-R243 PolarHBondContact O-N 3.26Å; D238-R243 IonicContact OD1-CZ 2.79Å; D238-R243 IonicContact OD1-NE 3.19Å; D238-R243 PolarHBondContact OD1-NE 2.97Å; D238-R243 IonicContact OD1-NH2 2.77Å; D238-R243 PolarHBondContact OD1-NH2 2.94Å; D238-L244 HydrophobicContact CB-CB 3.88Å; D238-L244 PolarHBondContact O-N 2.96Å
239	V	93.4	Very high	90.8	Very high	8 Å²	8	43.1 Å²	43.1	5%	0.048	23%	0.234	C	C	.	.	H	α-helix	trans	-70.6	-48.2	171.9	174.5	0	0	0	0	110.6	L235 M237 E241 G242 L244 C246 L254 I282	L235-V239 WeakPolarHBondContact O-CG2 3.44Å; L235-V239 PolarHBondContact O-N 2.86Å; M237-V239 PolarHBondContact O-N 3.29Å; V239-E241 PolarHBondContact O-N 3.3Å; V239-G242 PolarHBondContact O-N 3.23Å; V239-L244 HydrophobicContact CG2-CB 4.11Å; V239-L244 HydrophobicContact CG2-CD2 4.01Å; V239-L244 HydrophobicContact CG2-CG 4.2Å; V239-C246 HydrophobicContact CG1-CB 4.49Å; V239-L254 HydrophobicContact CG2-CD1 4.44Å; V239-I282 HydrophobicContact CG1-CG2 4.03Å
240	C	92.6	Very high	90.5	Very high	32 Å²	32	42.3 Å²	42.3	22%	0.216	24%	0.235	C	C	.	.	H	α-helix	trans	-64.9	-35.1	-179	-171.2	0	0	0	0	113.5	K236 M237 G242 F281 P283	K236-C240 VanDerWaalsContact O-CB 3.29Å; K236-C240 WeakPolarHBondContact O-CB 3.29Å; K236-C240 PolarHBondContact O-N 3.15Å; M237-C240 PolarHBondContact O-N 2.99Å; C240-G242 VanDerWaalsContact C-N 3.29Å; C240-F281 WeakPolarHBondContact CA-O 3.44Å; C240-P283 WeakPolarHBondContact O-CG 3.22Å
241	E	89	Confident	90.3	Very high	103 Å²	103	42 Å²	42	48%	0.481	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.5	5.4	174.7	-64.5	-177.5	151.7	0	0	112.7	M237 V239 R243	M237-E241 HydrophobicContact CG-CG 4.1Å; M237-E241 WeakPolarHBondContact CG-OE2 3.22Å; M237-E241 VanDerWaalsContact O-CB 3.26Å; M237-E241 WeakPolarHBondContact O-CB 3.24Å; M237-E241 WeakPolarHBondContact O-CG 3.02Å; M237-E241 PolarHBondContact O-N 3.34Å; V239-E241 PolarHBondContact O-N 3.3Å; E241-R243 PolarHBondContact O-N 3.45Å; E241-R243 IonicContact OE2-CZ 3.85Å; E241-R243 IonicContact OE2-NH1 2.78Å; E241-R243 PolarHBondContact OE2-NH1 3.27Å; E241-R243 IonicContact OE2-NH2 3.16Å; E241-R243 PolarHBondContact OE2-NH2 3.37Å
242	G	85.7	Confident	90.1	Very high	40 Å²	40	42.6 Å²	42.6	41%	0.412	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	67.6	14.3	177.6	0	0	0	0	0	115.6	D238 V239 C240	D238-G242 PolarHBondContact O-N 3.3Å; V239-G242 PolarHBondContact O-N 3.23Å; C240-G242 VanDerWaalsContact C-N 3.29Å
243	R	85.8	Confident	89.8	Confident	106 Å²	106	44.6 Å²	44.6	40%	0.4	25%	0.25	S	C	.	.	S	Bend	trans	-73.7	-34.7	173.8	-78.8	-158.3	-67.5	-81.2	-12.5	112.7	D238 E241	D238-R243 HydrophobicContact CB-CB 4.22Å; D238-R243 WeakPolarHBondContact O-CA 3.35Å; D238-R243 PolarHBondContact O-N 3.26Å; D238-R243 IonicContact OD1-CZ 2.79Å; D238-R243 IonicContact OD1-NE 3.19Å; D238-R243 PolarHBondContact OD1-NE 2.97Å; D238-R243 IonicContact OD1-NH2 2.77Å; D238-R243 PolarHBondContact OD1-NH2 2.94Å; E241-R243 PolarHBondContact O-N 3.45Å; E241-R243 IonicContact OE2-CZ 3.85Å; E241-R243 IonicContact OE2-NH1 2.78Å; E241-R243 PolarHBondContact OE2-NH1 3.27Å; E241-R243 IonicContact OE2-NH2 3.16Å; E241-R243 PolarHBondContact OE2-NH2 3.37Å
244	L	89.5	Confident	89.7	Confident	6 Å²	6	43.3 Å²	43.3	3%	0.031	24%	0.243	C	C	.	.	S	Bend	trans	-104.8	99.8	175.9	-176	56.8	0	0	0	108.9	L235 D238 V239 C246 A316 L319 D320 F321	L235-L244 HydrophobicContact CD2-CD2 3.79Å; D238-L244 HydrophobicContact CB-CB 3.88Å; D238-L244 PolarHBondContact O-N 2.96Å; V239-L244 HydrophobicContact CG2-CB 4.11Å; V239-L244 HydrophobicContact CG2-CD2 4.01Å; V239-L244 HydrophobicContact CG2-CG 4.2Å; L244-C246 PolarHBondContact O-N 3.39Å; L244-A316 HydrophobicContact CD2-CB 4.46Å; L244-L319 HydrophobicContact CD1-CB 4Å; L244-L319 HydrophobicContact CD1-CD1 4.41Å; L244-L319 HydrophobicContact CD2-CD1 3.98Å; L244-L319 HydrophobicContact CG-CB 4.39Å; L244-L319 HydrophobicContact CG-CD1 3.88Å; L244-D320 WeakPolarHBondContact CD1-O 3.42Å; L244-F321 HydrophobicContact CD1-CB 4.38Å
245	T	85.5	Confident	89.6	Confident	67 Å²	67	43.2 Å²	43.2	41%	0.411	24%	0.243	S	C	.	.			trans	-68.1	119.4	-177.4	52.3	0	0	0	0	110.9	F321	T245-F321 WeakPolarHBondContact OG1-CD2 3.38Å
246	C	82.1	Confident	89.5	Confident	35 Å²	35	43.2 Å²	43.2	24%	0.236	24%	0.243	C	C	.	.			trans	-121.7	134	-174.9	-169.7	0	0	0	0	111.2	V239 L244 S250 A251 L319	V239-C246 HydrophobicContact CG1-CB 4.49Å; L244-C246 PolarHBondContact O-N 3.39Å; C246-S250 VanDerWaalsContact SG-C 3.56Å; C246-S250 WeakPolarHBondContact SG-CB 3.47Å; C246-A251 HydrophobicContact CB-CB 4.24Å; C246-A251 PolarHBondContact SG-N 2.99Å; C246-L319 HydrophobicContact CB-CD1 3.89Å; C246-L319 HydrophobicContact CB-CD2 4.48Å
247	P	85	Confident	89.5	Confident	79 Å²	79	42.5 Å²	42.5	51%	0.513	24%	0.239	S	C	.	.			trans	-59.6	147	165.8	-21.4	33.3	0	0	0	111.2	N249 S250 A251	P247-N249 PolarHBondContact O-N 3.06Å; P247-S250 WeakPolarHBondContact O-CB 3.22Å; P247-S250 PolarHBondContact O-N 3.4Å; P247-S250 VanDerWaalsContact O-N 3.09Å; P247-A251 PolarHBondContact O-N 2.96Å
248	L	85.6	Confident	89.6	Confident	87 Å²	87	40.7 Å²	40.7	46%	0.455	23%	0.231	S	C	.	.	H	α-helix	trans	-55.1	-48.3	-173.4	-170.7	66.8	0	0	0	112.8	S250 A251 V252 I282 F289	L248-S250 VanDerWaalsContact C-N 3.32Å; L248-S250 PolarHBondContact O-N 3.31Å; L248-A251 WeakPolarHBondContact O-CA 3.45Å; L248-A251 WeakPolarHBondContact O-CB 3.11Å; L248-A251 PolarHBondContact O-N 2.73Å; L248-V252 WeakPolarHBondContact O-CG2 3.33Å; L248-V252 PolarHBondContact O-N 2.87Å; L248-I282 HydrophobicContact CD1-CD1 4.15Å; L248-F289 HydrophobicContact CD1-CD2 3.72Å; L248-F289 HydrophobicContact CD1-CE2 4.31Å
249	N	83.6	Confident	89.8	Confident	130 Å²	130	40.1 Å²	40.1	70%	0.695	23%	0.228	S	C	*	.	H	α-helix	trans	-60.5	-41.5	179.3	-57.1	26.4	0	0	0	111.7	P247 A251 V252 V253	P247-N249 PolarHBondContact O-N 3.06Å; N249-A251 VanDerWaalsContact C-N 3.31Å; N249-A251 PolarHBondContact O-N 2.87Å; N249-V252 PolarHBondContact O-N 3.46Å; N249-V253 WeakPolarHBondContact O-CG2 3.47Å; N249-V253 PolarHBondContact O-N 3.03Å; N249-V253 VanDerWaalsContact O-N 3.14Å
250	S	87.1	Confident	89.8	Confident	39 Å²	39	39.9 Å²	39.9	27%	0.273	23%	0.226	S	C	.	.	H	α-helix	trans	-67.4	-32.9	175	-57.6	0	0	0	0	111.9	C246 P247 L248 L254	C246-S250 VanDerWaalsContact SG-C 3.56Å; C246-S250 WeakPolarHBondContact SG-CB 3.47Å; P247-S250 WeakPolarHBondContact O-CB 3.22Å; P247-S250 PolarHBondContact O-N 3.4Å; P247-S250 VanDerWaalsContact O-N 3.09Å; L248-S250 VanDerWaalsContact C-N 3.32Å; L248-S250 PolarHBondContact O-N 3.31Å; S250-L254 WeakPolarHBondContact O-CB 3.45Å; S250-L254 VanDerWaalsContact O-CG 3.23Å; S250-L254 WeakPolarHBondContact O-CG 3.25Å; S250-L254 PolarHBondContact O-N 3.15Å
251	A	91.1	Very high	89.9	Confident	4 Å²	4	38.8 Å²	38.8	3%	0.033	22%	0.219	C	C	.	.	H	α-helix	trans	-71.1	-36.7	176.8	0	0	0	0	0	112	C246 P247 L248 N249 A255 I282 F289	C246-A251 HydrophobicContact CB-CB 4.24Å; C246-A251 PolarHBondContact SG-N 2.99Å; P247-A251 PolarHBondContact O-N 2.96Å; L248-A251 WeakPolarHBondContact O-CA 3.45Å; L248-A251 WeakPolarHBondContact O-CB 3.11Å; L248-A251 PolarHBondContact O-N 2.73Å; N249-A251 VanDerWaalsContact C-N 3.31Å; N249-A251 PolarHBondContact O-N 2.87Å; A251-A255 VanDerWaalsContact O-CB 3.24Å; A251-A255 WeakPolarHBondContact O-CB 3.35Å; A251-A255 PolarHBondContact O-N 2.99Å; A251-I282 HydrophobicContact CB-CG2 3.91Å; A251-F289 HydrophobicContact CB-CE2 3.86Å; A251-F289 HydrophobicContact CB-CZ 4.4Å
252	V	90.7	Very high	90.1	Very high	13 Å²	13	40.7 Å²	40.7	8%	0.079	23%	0.227	C	C	.	.	H	α-helix	trans	-61.1	-49.6	171.9	170.5	0	0	0	0	110.3	L248 N249 L254 A255 S256 F289 K292 V293 L296	L248-V252 WeakPolarHBondContact O-CG2 3.33Å; L248-V252 PolarHBondContact O-N 2.87Å; N249-V252 PolarHBondContact O-N 3.46Å; V252-L254 PolarHBondContact O-N 3.49Å; V252-A255 PolarHBondContact O-N 3.37Å; V252-S256 PolarHBondContact O-N 3.34Å; V252-F289 HydrophobicContact CB-CE2 4.27Å; V252-F289 HydrophobicContact CG2-CD2 3.37Å; V252-F289 HydrophobicContact CG2-CE2 3.54Å; V252-F289 HydrophobicContact CG2-CG 4.18Å; V252-F289 HydrophobicContact CG2-CZ 4.45Å; V252-K292 HydrophobicContact CG1-CB 3.74Å; V252-K292 HydrophobicContact CG2-CB 4.35Å; V252-V293 HydrophobicContact CB-CG2 4.37Å; V252-V293 HydrophobicContact CG1-CG2 4.03Å; V252-L296 HydrophobicContact CG1-CD1 3.85Å
253	V	90.5	Very high	90.4	Very high	47 Å²	47	42.4 Å²	42.4	29%	0.285	23%	0.226	S	C	.	.	H	α-helix	trans	-62.6	-45.9	178.4	176.9	0	0	0	0	111.1	N249 A255 S256 Y257 L296 I315	N249-V253 WeakPolarHBondContact O-CG2 3.47Å; N249-V253 PolarHBondContact O-N 3.03Å; N249-V253 VanDerWaalsContact O-N 3.14Å; V253-A255 PolarHBondContact O-N 3.33Å; V253-S256 PolarHBondContact O-N 3.49Å; V253-S256 PolarHBondContact O-OG 2.73Å; V253-Y257 HydrophobicContact CG1-CD2 3.93Å; V253-Y257 HydrophobicContact CG1-CE2 3.58Å; V253-Y257 VanDerWaalsContact O-CD2 3.3Å; V253-Y257 WeakPolarHBondContact O-CD2 3.38Å; V253-Y257 PolarHBondContact O-N 3.24Å; V253-L296 HydrophobicContact CB-CD1 4.47Å; V253-L296 HydrophobicContact CG2-CD1 3.84Å; V253-I315 HydrophobicContact CG1-CD1 3.6Å
254	L	93.7	Very high	90.7	Very high	1 Å²	1	38.6 Å²	38.6	1%	0.005	22%	0.22	C	C	.	.	H	α-helix	trans	-59	-45.3	174.8	-76	175.5	0	0	0	111.9	V239 S250 V252 S256 Y257 A258 Y312 I315 A316 L319	V239-L254 HydrophobicContact CG2-CD1 4.44Å; S250-L254 WeakPolarHBondContact O-CB 3.45Å; S250-L254 VanDerWaalsContact O-CG 3.23Å; S250-L254 WeakPolarHBondContact O-CG 3.25Å; S250-L254 PolarHBondContact O-N 3.15Å; V252-L254 PolarHBondContact O-N 3.49Å; L254-S256 PolarHBondContact O-N 2.96Å; L254-Y257 PolarHBondContact O-N 3.27Å; L254-A258 WeakPolarHBondContact O-CB 3.49Å; L254-A258 PolarHBondContact O-N 3.48Å; L254-Y312 HydrophobicContact CB-CD2 4.1Å; L254-Y312 HydrophobicContact CB-CE2 3.59Å; L254-Y312 HydrophobicContact CD2-CD1 3.87Å; L254-Y312 HydrophobicContact CD2-CD2 3.74Å; L254-Y312 HydrophobicContact CD2-CE1 3.92Å; L254-Y312 HydrophobicContact CD2-CE2 3.83Å; L254-Y312 HydrophobicContact CD2-CG 3.74Å; L254-Y312 VanDerWaalsContact CD2-O 3.3Å; L254-Y312 WeakPolarHBondContact CD2-O 3.48Å; L254-Y312 HydrophobicContact CG-CE2 4.24Å; L254-Y312 WeakPolarHBondContact O-CD2 3.4Å; L254-Y312 WeakPolarHBondContact O-CE2 3.49Å; L254-I315 HydrophobicContact CD1-CG2 4.44Å; L254-I315 HydrophobicContact CD2-CB 3.8Å; L254-I315 HydrophobicContact CD2-CG2 3.72Å; L254-I315 HydrophobicContact CG-CG2 3.93Å; L254-A316 HydrophobicContact CD2-CB 4.35Å; L254-L319 HydrophobicContact CD1-CD1 3.97Å
255	A	94.4	Very high	90.8	Very high	3 Å²	3	42.3 Å²	42.3	3%	0.025	24%	0.24	C	C	.	.	H	α-helix	trans	-60.1	-43.2	176.2	0	0	0	0	0	111.8	A251 V252 V253 Y257 A258 V259 F281 F289 V293	A251-A255 VanDerWaalsContact O-CB 3.24Å; A251-A255 WeakPolarHBondContact O-CB 3.35Å; A251-A255 PolarHBondContact O-N 2.99Å; V252-A255 PolarHBondContact O-N 3.37Å; V253-A255 PolarHBondContact O-N 3.33Å; A255-Y257 PolarHBondContact O-N 3.26Å; A255-A258 CarbonylContact O-C 3.54Å; A255-A258 WeakPolarHBondContact O-CA 3.47Å; A255-A258 WeakPolarHBondContact O-CB 3.38Å; A255-A258 PolarHBondContact O-N 3.2Å; A255-V259 WeakPolarHBondContact O-CG2 3.23Å; A255-V259 PolarHBondContact O-N 2.66Å; A255-F281 HydrophobicContact CB-CB 3.85Å; A255-F281 HydrophobicContact CB-CD1 3.62Å; A255-F281 HydrophobicContact CB-CD2 4.19Å; A255-F281 HydrophobicContact CB-CE1 4.21Å; A255-F281 HydrophobicContact CB-CG 3.62Å; A255-F289 HydrophobicContact CB-CE1 4.06Å; A255-F289 HydrophobicContact CB-CZ 3.78Å; A255-V293 HydrophobicContact CB-CB 4.44Å; A255-V293 HydrophobicContact CB-CG1 3.91Å; A255-V293 HydrophobicContact CB-CG2 3.54Å
256	S	93.5	Very high	91	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-60.7	-41.6	178.4	69.1	0	0	0	0	113.3	V252 V253 L254 A258 V259 Q260 L296 H300	V252-S256 PolarHBondContact O-N 3.34Å; V253-S256 PolarHBondContact O-N 3.49Å; V253-S256 PolarHBondContact O-OG 2.73Å; L254-S256 PolarHBondContact O-N 2.96Å; S256-A258 VanDerWaalsContact C-N 3.33Å; S256-A258 PolarHBondContact O-N 3.12Å; S256-V259 PolarHBondContact O-N 2.93Å; S256-Q260 PolarHBondContact O-N 3Å; S256-L296 VanDerWaalsContact CB-CB 3.48Å; S256-H300 WeakPolarHBondContact CB-NE2 3.42Å; S256-H300 PolarHBondContact OG-NE2 3.42Å
257	Y	95.1	Very high	91.4	Very high	38 Å²	38	42.8 Å²	42.8	15%	0.149	24%	0.236	C	C	.	.	H	α-helix	trans	-67	-32.6	171	-72.7	-62.2	0	0	0	112.9	V253 L254 A255 V259 S261 H300 L303 A308 C311 I315	V253-Y257 HydrophobicContact CG1-CD2 3.93Å; V253-Y257 HydrophobicContact CG1-CE2 3.58Å; V253-Y257 VanDerWaalsContact O-CD2 3.3Å; V253-Y257 WeakPolarHBondContact O-CD2 3.38Å; V253-Y257 PolarHBondContact O-N 3.24Å; L254-Y257 PolarHBondContact O-N 3.27Å; A255-Y257 PolarHBondContact O-N 3.26Å; Y257-V259 VanDerWaalsContact C-N 3.29Å; Y257-S261 WeakPolarHBondContact O-CB 3.23Å; Y257-S261 PolarHBondContact O-N 2.74Å; Y257-H300 AromaticContact CD1-CE1 3.94Å; Y257-H300 AromaticContact CE1-CE1 3.38Å; Y257-H300 WeakPolarHBondContact CE1-CE1 3.39Å; Y257-H300 AromaticContact CE1-ND1 3.48Å; Y257-H300 WeakPolarHBondContact CE1-ND1 3.17Å; Y257-H300 AromaticContact CE1-NE2 3.98Å; Y257-H300 AromaticContact CZ-CE1 3.45Å; Y257-H300 VanDerWaalsContact CZ-CE1 3.45Å; Y257-H300 AromaticContact CZ-ND1 3.95Å; Y257-L303 HydrophobicContact CD1-CD1 4.4Å; Y257-L303 HydrophobicContact CE1-CD1 3.84Å; Y257-A308 HydrophobicContact CD1-CB 4.23Å; Y257-C311 HydrophobicContact CD1-CB 3.84Å; Y257-C311 HydrophobicContact CD2-CB 4.23Å; Y257-C311 HydrophobicContact CE1-CB 3.64Å; Y257-C311 HydrophobicContact CE2-CB 4.05Å; Y257-C311 HydrophobicContact CG-CB 4.14Å; Y257-I315 HydrophobicContact CD2-CD1 4Å; Y257-I315 HydrophobicContact CE2-CD1 3.58Å
258	A	95.7	Very high	91.4	Very high	2 Å²	2	43.5 Å²	43.5	2%	0.017	24%	0.242	C	C	.	.	H	α-helix	trans	-75.6	-15.1	175.9	0	0	0	0	0	114.2	F232 K236 L254 A255 S256 H262 F281 Y312	F232-A258 HydrophobicContact CE2-CB 3.87Å; F232-A258 HydrophobicContact CZ-CB 3.99Å; K236-A258 HydrophobicContact CD-CB 4.09Å; L254-A258 WeakPolarHBondContact O-CB 3.49Å; L254-A258 PolarHBondContact O-N 3.48Å; A255-A258 CarbonylContact O-C 3.54Å; A255-A258 WeakPolarHBondContact O-CA 3.47Å; A255-A258 WeakPolarHBondContact O-CB 3.38Å; A255-A258 PolarHBondContact O-N 3.2Å; S256-A258 VanDerWaalsContact C-N 3.33Å; S256-A258 PolarHBondContact O-N 3.12Å; A258-H262 WeakPolarHBondContact O-CB 3.39Å; A258-F281 HydrophobicContact CB-CE1 4.49Å; A258-Y312 HydrophobicContact CB-CD2 4.04Å; A258-Y312 HydrophobicContact CB-CE2 3.84Å
259	V	95.3	Very high	91.4	Very high	3 Å²	3	43.4 Å²	43.4	2%	0.018	25%	0.249	C	C	.	.	H	α-helix	trans	-82.6	-53.5	167.8	177.2	0	0	0	0	109.5	A255 S256 Y257 S261 H262 I263 Y275 L276 F281 V293 H297	A255-V259 WeakPolarHBondContact O-CG2 3.23Å; A255-V259 PolarHBondContact O-N 2.66Å; S256-V259 PolarHBondContact O-N 2.93Å; Y257-V259 VanDerWaalsContact C-N 3.29Å; V259-S261 VanDerWaalsContact C-N 3.26Å; V259-S261 PolarHBondContact O-N 2.95Å; V259-H262 PolarHBondContact O-N 3.44Å; V259-I263 HydrophobicContact CG1-CD1 3.96Å; V259-I263 HydrophobicContact CG1-CG1 4.31Å; V259-I263 PolarHBondContact O-N 2.95Å; V259-Y275 HydrophobicContact CG1-CE2 4.37Å; V259-L276 HydrophobicContact CG1-CD2 4.03Å; V259-L276 HydrophobicContact CG2-CD1 3.76Å; V259-L276 HydrophobicContact CG2-CD2 3.86Å; V259-F281 HydrophobicContact CG2-CE1 3.77Å; V259-F281 HydrophobicContact CG2-CE2 4.48Å; V259-F281 HydrophobicContact CG2-CZ 3.46Å; V259-F281 VanDerWaalsContact CG2-CZ 3.46Å; V259-V293 HydrophobicContact CG2-CG1 3.91Å; V259-H297 HydrophobicContact CG1-CB 4.39Å; V259-H297 VanDerWaalsContact CG1-CE1 3.49Å; V259-H297 WeakPolarHBondContact CG1-CE1 3.47Å; V259-H297 WeakPolarHBondContact CG1-ND1 3.25Å
260	Q	95	Very high	91.6	Very high	2 Å²	2	42.2 Å²	42.2	1%	0.009	24%	0.241	C	C	.	.	H	α-helix	trans	-53.1	-42.3	175.8	-178.2	69	29.4	0	0	112.1	S256 H262 G264 D265 H297 H300 L303 A308	S256-Q260 PolarHBondContact O-N 3Å; Q260-H262 VanDerWaalsContact C-N 3.3Å; Q260-H262 PolarHBondContact O-N 3.22Å; Q260-G264 WeakPolarHBondContact O-CA 3.48Å; Q260-G264 PolarHBondContact O-N 3.32Å; Q260-G264 VanDerWaalsContact O-N 3.09Å; Q260-D265 PolarHBondContact NE2-OD1 2.91Å; Q260-H297 PolarHBondContact OE1-CD2 2.76Å; Q260-H297 PolarHBondContact OE1-NE2 3.24Å; Q260-H300 HydrophobicContact CB-CB 4.06Å; Q260-H300 HydrophobicContact CG-CB 3.86Å; Q260-H300 PolarHBondContact NE2-O 3.17Å; Q260-H300 PolarHBondContact OE1-O 3.39Å; Q260-L303 HydrophobicContact CG-CB 4.1Å; Q260-L303 PolarHBondContact NE2-O 3.08Å; Q260-A308 HydrophobicContact CB-CB 4.16Å; Q260-A308 HydrophobicContact CG-CB 3.9Å
261	S	94.2	Very high	91.7	Very high	9 Å²	9	41.1 Å²	41.1	6%	0.063	23%	0.232	C	C	.	.	H	α-helix	trans	-61.3	-32.3	175	155.5	0	0	0	0	113.8	F232 Y257 V259 Q305 E309	F232-S261 WeakPolarHBondContact CE1-OG 3.48Å; F232-S261 VanDerWaalsContact CZ-OG 3.25Å; F232-S261 WeakPolarHBondContact CZ-OG 3.25Å; Y257-S261 WeakPolarHBondContact O-CB 3.23Å; Y257-S261 PolarHBondContact O-N 2.74Å; V259-S261 VanDerWaalsContact C-N 3.26Å; V259-S261 PolarHBondContact O-N 2.95Å; S261-Q305 WeakPolarHBondContact O-CG 3.41Å; S261-E309 WeakPolarHBondContact OG-CG 3.26Å; S261-E309 PolarHBondContact OG-OE1 3.24Å
262	H	92.2	Very high	91.4	Very high	144 Å²	144	46.8 Å²	46.8	67%	0.667	26%	0.257	S	S	*	.	H	α-helix	trans	-99.8	-36.2	-170.8	-173.7	43.2	0	0	0	113.9	A258 V259 Q260	A258-H262 WeakPolarHBondContact O-CB 3.39Å; V259-H262 PolarHBondContact O-N 3.44Å; Q260-H262 VanDerWaalsContact C-N 3.3Å; Q260-H262 PolarHBondContact O-N 3.22Å
263	I	91.8	Very high	91	Very high	76 Å²	76	52.3 Å²	52.3	39%	0.39	29%	0.294	S	S	.	.	H	α-helix	trans	-105.8	-26.2	-173.1	-53	-170.2	0	0	0	111.2	V259 H271 Y275 L276	V259-I263 HydrophobicContact CG1-CD1 3.96Å; V259-I263 HydrophobicContact CG1-CG1 4.31Å; V259-I263 PolarHBondContact O-N 2.95Å; I263-H271 VanDerWaalsContact CG2-NE2 3.28Å; I263-H271 WeakPolarHBondContact CG2-NE2 3.49Å; I263-Y275 HydrophobicContact CD1-CD2 4.49Å; I263-Y275 HydrophobicContact CD1-CE2 4.31Å; I263-L276 HydrophobicContact CD1-CD2 4.3Å
264	G	92.3	Very high	90.7	Very high	26 Å²	26	52 Å²	52	27%	0.268	30%	0.3	S	S	.	.			trans	74.8	-176.7	-167	0	0	0	0	0	112.1	Q260 H297	Q260-G264 WeakPolarHBondContact O-CA 3.48Å; Q260-G264 PolarHBondContact O-N 3.32Å; Q260-G264 VanDerWaalsContact O-N 3.09Å; G264-H297 PolarHBondContact O-CE1 3.36Å; G264-H297 VanDerWaalsContact O-CE1 3.27Å; G264-H297 PolarHBondContact O-NE2 2.93Å
265	D	92.3	Very high	90.5	Very high	84 Å²	84	54.4 Å²	54.4	45%	0.449	31%	0.31	S	S	.	.	S	Bend	trans	-44.5	142.9	-170	-61.6	-20.3	0	0	0	115	Q260 N267 G302	Q260-D265 PolarHBondContact NE2-OD1 2.91Å; D265-N267 PolarHBondContact O-N 3.13Å; D265-G302 VanDerWaalsContact CG-N 3.31Å; D265-G302 PolarHBondContact OD1-N 2.83Å; D265-G302 PolarHBondContact OD2-N 2.68Å
266	F	89.9	Confident	90.4	Very high	46 Å²	46	54.3 Å²	54.3	20%	0.202	31%	0.309	C	S	.	.			trans	-62.6	126.5	176.4	178.2	-93.9	0	0	0	111.9	H271 Y275 E298	F266-H271 HydrophobicContact CD2-CB 3.74Å; F266-H271 AromaticContact CD2-ND1 3.65Å; F266-H271 HydrophobicContact CE2-CB 3.45Å; F266-H271 VanDerWaalsContact CE2-CB 3.45Å; F266-H271 HydrophobicContact CZ-CB 4.27Å; F266-Y275 HydrophobicContact CE2-CE1 4.23Å; F266-E298 HydrophobicContact CB-CG 4.48Å; F266-E298 HydrophobicContact CD1-CB 4.32Å; F266-E298 HydrophobicContact CD1-CG 3.79Å; F266-E298 HydrophobicContact CD2-CG 4.02Å; F266-E298 HydrophobicContact CE1-CG 3.92Å; F266-E298 WeakPolarHBondContact CE1-OE1 3.3Å; F266-E298 HydrophobicContact CE2-CG 4.15Å; F266-E298 HydrophobicContact CG-CB 4.38Å; F266-E298 HydrophobicContact CG-CG 3.84Å; F266-E298 HydrophobicContact CZ-CG 4.1Å; F266-E298 WeakPolarHBondContact CZ-OE1 3.28Å
267	N	89.1	Confident	90	Very high	66 Å²	66	57.6 Å²	57.6	35%	0.353	34%	0.336	S	S	.	.			trans	-127.2	112.2	175.1	-179.7	-6.9	0	0	0	110.2	D265 S269 I270 H271	D265-N267 PolarHBondContact O-N 3.13Å; N267-S269 PolarHBondContact ND2-OG 3.13Å; N267-S269 PolarHBondContact O-N 3.5Å; N267-S269 VanDerWaalsContact O-N 3.1Å; N267-S269 PolarHBondContact OD1-N 2.93Å; N267-S269 PolarHBondContact OD1-OG 3.43Å; N267-I270 HydrophobicContact CB-CD1 4.34Å; N267-I270 HydrophobicContact CB-CG1 4.38Å; N267-I270 PolarHBondContact O-N 2.68Å; N267-H271 PolarHBondContact N-ND1 3.42Å; N267-H271 PolarHBondContact O-N 3.46Å
268	S	86.2	Confident	89.6	Confident	94 Å²	94	64.1 Å²	64.1	66%	0.657	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-14.2	-178.4	56	0	0	0	0	115	I270	S268-I270 VanDerWaalsContact C-N 3.34Å
269	S	85.4	Confident	89.3	Confident	85 Å²	85	66 Å²	66	59%	0.594	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	-7	171.9	79.2	0	0	0	0	113.8	N267	N267-S269 PolarHBondContact ND2-OG 3.13Å; N267-S269 PolarHBondContact O-N 3.5Å; N267-S269 VanDerWaalsContact O-N 3.1Å; N267-S269 PolarHBondContact OD1-N 2.93Å; N267-S269 PolarHBondContact OD1-OG 3.43Å
270	I	88.6	Confident	89.1	Confident	104 Å²	104	71.6 Å²	71.6	53%	0.533	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120.9	-52.1	-179.1	-52.7	179.1	0	0	0	109.4	N267 S268 H272	N267-I270 HydrophobicContact CB-CD1 4.34Å; N267-I270 HydrophobicContact CB-CG1 4.38Å; N267-I270 PolarHBondContact O-N 2.68Å; S268-I270 VanDerWaalsContact C-N 3.34Å; I270-H272 VanDerWaalsContact C-N 3.33Å; I270-H272 PolarHBondContact O-N 2.95Å; I270-H272 PolarHBondContact O-ND1 3.37Å
271	H	88.6	Confident	89	Confident	17 Å²	17	72.2 Å²	72.2	8%	0.079	42%	0.415	C	S	.	.			trans	-84.6	74.2	-175.6	-54.3	157.8	0	0	0	110.4	I263 F266 N267 Y275 H297	I263-H271 VanDerWaalsContact CG2-NE2 3.28Å; I263-H271 WeakPolarHBondContact CG2-NE2 3.49Å; F266-H271 HydrophobicContact CD2-CB 3.74Å; F266-H271 AromaticContact CD2-ND1 3.65Å; F266-H271 HydrophobicContact CE2-CB 3.45Å; F266-H271 VanDerWaalsContact CE2-CB 3.45Å; F266-H271 HydrophobicContact CZ-CB 4.27Å; N267-H271 PolarHBondContact N-ND1 3.42Å; N267-H271 PolarHBondContact O-N 3.46Å; H271-Y275 HydrophobicContact CB-CD1 3.79Å; H271-Y275 HydrophobicContact CB-CD2 4.04Å; H271-Y275 HydrophobicContact CB-CE1 3.81Å; H271-Y275 HydrophobicContact CB-CE2 4.06Å; H271-Y275 HydrophobicContact CB-CG 3.92Å; H271-Y275 AromaticContact CG-CE2 3.91Å; H271-H297 AromaticContact ND1-CE1 3.98Å
272	H	84.4	Confident	88.8	Confident	122 Å²	122	72.6 Å²	72.6	57%	0.565	42%	0.416	S	S	*	.			trans	-69.2	146.1	171.6	-60.3	68.6	0	0	0	109.2	I270 G274 Y275	I270-H272 VanDerWaalsContact C-N 3.33Å; I270-H272 PolarHBondContact O-N 2.95Å; I270-H272 PolarHBondContact O-ND1 3.37Å; H272-G274 PolarHBondContact O-N 3.16Å; H272-Y275 WeakPolarHBondContact O-CB 3.35Å; H272-Y275 VanDerWaalsContact O-CD1 3.31Å; H272-Y275 WeakPolarHBondContact O-CD1 3.47Å; H272-Y275 PolarHBondContact O-N 2.92Å
273	P	81.8	Confident	88.7	Confident	129 Å²	129	68.8 Å²	68.8	84%	0.838	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.8	130.3	-177.2	-28.7	35.5	0	0	0	113.2
274	G	84.4	Confident	88.4	Confident	41 Å²	41	72.4 Å²	72.4	42%	0.423	42%	0.424	S	S	.	.	T	Hydrogen-bonded Turn	trans	88.5	9	-172.5	0	0	0	0	0	115.2	H272 L276 A277 E294	H272-G274 PolarHBondContact O-N 3.16Å; G274-L276 PolarHBondContact O-N 3.39Å; G274-L276 VanDerWaalsContact O-N 3.1Å; G274-A277 VanDerWaalsContact O-CB 3.24Å; G274-A277 WeakPolarHBondContact O-CB 3.48Å; G274-A277 PolarHBondContact O-N 2.85Å; G274-E294 VanDerWaalsContact C-OE1 3.25Å; G274-E294 WeakPolarHBondContact CA-OE1 3.29Å; G274-E294 PolarHBondContact N-OE1 2.94Å; G274-E294 VanDerWaalsContact N-OE1 3.16Å; G274-E294 PolarHBondContact N-OE2 3.05Å
275	Y	91	Very high	88.1	Confident	52 Å²	52	73.6 Å²	73.6	20%	0.204	42%	0.423	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-17.8	174.5	70.9	-76.3	0	0	0	113.7	V259 I263 F266 H271 H272 E294 H297	V259-Y275 HydrophobicContact CG1-CE2 4.37Å; I263-Y275 HydrophobicContact CD1-CD2 4.49Å; I263-Y275 HydrophobicContact CD1-CE2 4.31Å; F266-Y275 HydrophobicContact CE2-CE1 4.23Å; H271-Y275 HydrophobicContact CB-CD1 3.79Å; H271-Y275 HydrophobicContact CB-CD2 4.04Å; H271-Y275 HydrophobicContact CB-CE1 3.81Å; H271-Y275 HydrophobicContact CB-CE2 4.06Å; H271-Y275 HydrophobicContact CB-CG 3.92Å; H271-Y275 AromaticContact CG-CE2 3.91Å; H272-Y275 WeakPolarHBondContact O-CB 3.35Å; H272-Y275 VanDerWaalsContact O-CD1 3.31Å; H272-Y275 WeakPolarHBondContact O-CD1 3.47Å; H272-Y275 PolarHBondContact O-N 2.92Å; Y275-E294 HydrophobicContact CD1-CG 4.07Å; Y275-E294 WeakPolarHBondContact CD1-OE1 3.43Å; Y275-E294 HydrophobicContact CE1-CB 3.92Å; Y275-E294 HydrophobicContact CE1-CG 3.43Å; Y275-E294 VanDerWaalsContact CE1-CG 3.43Å; Y275-E294 PolarHBondContact N-OE1 2.87Å; Y275-E294 VanDerWaalsContact N-OE1 3.13Å; Y275-H297 AromaticContact CZ-ND1 3.82Å; Y275-H297 PolarHBondContact OH-ND1 2.76Å
276	L	90.7	Very high	87.9	Confident	1 Å²	1	73.3 Å²	73.3	1%	0.005	42%	0.421	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.2	5.7	174	-61.2	-175.8	0	0	0	114.7	V259 I263 G274 D278 S279 F281 L290 V293 E294	V259-L276 HydrophobicContact CG1-CD2 4.03Å; V259-L276 HydrophobicContact CG2-CD1 3.76Å; V259-L276 HydrophobicContact CG2-CD2 3.86Å; I263-L276 HydrophobicContact CD1-CD2 4.3Å; G274-L276 PolarHBondContact O-N 3.39Å; G274-L276 VanDerWaalsContact O-N 3.1Å; L276-D278 VanDerWaalsContact C-N 3.31Å; L276-D278 PolarHBondContact O-N 3.22Å; L276-S279 WeakPolarHBondContact O-CB 3.3Å; L276-S279 PolarHBondContact O-N 2.89Å; L276-F281 HydrophobicContact CD1-CE2 4.41Å; L276-F281 HydrophobicContact CD1-CZ 4.47Å; L276-F281 HydrophobicContact CD2-CZ 4.45Å; L276-L290 HydrophobicContact CB-CD2 3.83Å; L276-V293 HydrophobicContact CD1-CB 4.19Å; L276-V293 HydrophobicContact CD1-CG1 3.54Å; L276-E294 HydrophobicContact CB-CG 4.26Å; L276-E294 HydrophobicContact CD1-CG 3.59Å; L276-E294 HydrophobicContact CG-CG 3.83Å; L276-E294 PolarHBondContact N-OE1 2.87Å
277	A	86.4	Confident	87.8	Confident	69 Å²	69	77.4 Å²	77.4	57%	0.57	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.3	-38.2	-176.4	0	0	0	0	0	114.4	G274 S279	G274-A277 VanDerWaalsContact O-CB 3.24Å; G274-A277 WeakPolarHBondContact O-CB 3.48Å; G274-A277 PolarHBondContact O-N 2.85Å; A277-S279 VanDerWaalsContact C-N 3.29Å; A277-S279 PolarHBondContact O-N 2.67Å
278	D	86.1	Confident	87.8	Confident	174 Å²	174	77.7 Å²	77.7	93%	0.93	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-3.3	177	-71.5	-37.5	0	0	0	113.6	L276	L276-D278 VanDerWaalsContact C-N 3.31Å; L276-D278 PolarHBondContact O-N 3.22Å
279	S	88.8	Confident	88	Confident	41 Å²	41	73.2 Å²	73.2	29%	0.287	42%	0.415	S	S	.	.			trans	-94.6	125.3	-177.8	-66.5	0	0	0	0	112.2	L276 A277 F281 Q285	L276-S279 WeakPolarHBondContact O-CB 3.3Å; L276-S279 PolarHBondContact O-N 2.89Å; A277-S279 VanDerWaalsContact C-N 3.29Å; A277-S279 PolarHBondContact O-N 2.67Å; S279-F281 VanDerWaalsContact CB-CE2 3.46Å; S279-Q285 PolarHBondContact O-NE2 3.47Å
280	Q	91.8	Very high	88.4	Confident	121 Å²	121	70 Å²	70	57%	0.565	39%	0.391	S	S	*	.			trans	-102.7	126.1	172.5	-167	174	17.8	0	0	111.5	I282	Q280-I282 WeakPolarHBondContact CG-O 3.31Å; Q280-I282 PolarHBondContact NE2-O 3Å
281	F	92	Very high	88.4	Confident	15 Å²	15	68.5 Å²	68.5	7%	0.066	39%	0.39	C	S	.	.			trans	-116	-28.9	178	-56.3	-84.1	0	0	0	113.2	C240 A255 A258 V259 L276 S279 F289 L290	C240-F281 WeakPolarHBondContact CA-O 3.44Å; A255-F281 HydrophobicContact CB-CB 3.85Å; A255-F281 HydrophobicContact CB-CD1 3.62Å; A255-F281 HydrophobicContact CB-CD2 4.19Å; A255-F281 HydrophobicContact CB-CE1 4.21Å; A255-F281 HydrophobicContact CB-CG 3.62Å; A258-F281 HydrophobicContact CB-CE1 4.49Å; V259-F281 HydrophobicContact CG2-CE1 3.77Å; V259-F281 HydrophobicContact CG2-CE2 4.48Å; V259-F281 HydrophobicContact CG2-CZ 3.46Å; V259-F281 VanDerWaalsContact CG2-CZ 3.46Å; L276-F281 HydrophobicContact CD1-CE2 4.41Å; L276-F281 HydrophobicContact CD1-CZ 4.47Å; L276-F281 HydrophobicContact CD2-CZ 4.45Å; S279-F281 VanDerWaalsContact CB-CE2 3.46Å; F281-F289 HydrophobicContact CB-CE1 3.92Å; F281-F289 HydrophobicContact CB-CZ 4.1Å; F281-F289 HydrophobicContact CD2-CE1 4.06Å; F281-F289 HydrophobicContact CG-CE1 4.31Å; F281-L290 HydrophobicContact CD2-CD2 4.26Å; F281-L290 HydrophobicContact CE2-CD2 4.08Å
282	I	91.7	Very high	88.5	Confident	18 Å²	18	72.5 Å²	72.5	9%	0.092	41%	0.407	C	S	.	.	S	Bend	trans	-136.9	159.8	178.8	58.4	172.4	0	0	0	111	V239 L248 A251 Q280 Q285 F289	V239-I282 HydrophobicContact CG1-CG2 4.03Å; L248-I282 HydrophobicContact CD1-CD1 4.15Å; A251-I282 HydrophobicContact CB-CG2 3.91Å; Q280-I282 WeakPolarHBondContact CG-O 3.31Å; Q280-I282 PolarHBondContact NE2-O 3Å; I282-Q285 HydrophobicContact CG1-CB 3.83Å; I282-Q285 HydrophobicContact CG1-CG 4.21Å; I282-F289 HydrophobicContact CD1-CD2 3.78Å; I282-F289 HydrophobicContact CD1-CE2 3.76Å; I282-F289 HydrophobicContact CD1-CG 4.18Å; I282-F289 HydrophobicContact CD1-CZ 4.15Å; I282-F289 HydrophobicContact CG1-CE1 4.4Å; I282-F289 HydrophobicContact CG1-CE2 4.34Å; I282-F289 HydrophobicContact CG1-CZ 4.23Å; I282-F289 HydrophobicContact CG2-CE2 4.41Å; I282-F289 HydrophobicContact CG2-CZ 4.23Å
283	P	88.6	Confident	88.8	Confident	64 Å²	64	66.7 Å²	66.7	42%	0.416	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-48.9	176.6	-24.2	33.2	0	0	0	113.5	C240 Q285	C240-P283 WeakPolarHBondContact O-CG 3.22Å; P283-Q285 PolarHBondContact O-N 2.95Å
284	D	85.2	Confident	89.3	Confident	151 Å²	151	61.6 Å²	61.6	81%	0.807	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.1	57.1	-173.3	-58.5	-62.6	0	0	0	111.1
285	Q	87.2	Confident	89.6	Confident	51 Å²	51	62.6 Å²	62.6	24%	0.238	35%	0.346	C	S	.	.			trans	-76	147.3	-177	-164.5	170.6	-75.2	0	0	112.4	S279 I282 P283 F289 L290	S279-Q285 PolarHBondContact O-NE2 3.47Å; I282-Q285 HydrophobicContact CG1-CB 3.83Å; I282-Q285 HydrophobicContact CG1-CG 4.21Å; P283-Q285 PolarHBondContact O-N 2.95Å; Q285-F289 HydrophobicContact CG-CD1 3.77Å; Q285-F289 HydrophobicContact CG-CE1 4.31Å; Q285-F289 HydrophobicContact CG-CG 4.45Å; Q285-L290 HydrophobicContact CG-CG 4.37Å
286	N	88.5	Confident	89.4	Confident	78 Å²	78	61.9 Å²	61.9	42%	0.417	35%	0.345	S	S	.	.			trans	-139.2	170	174.3	68.6	-3.5	0	0	0	111.9	D288 F289 L290	N286-D288 VanDerWaalsContact C-N 3.29Å; N286-D288 PolarHBondContact O-N 2.63Å; N286-F289 WeakPolarHBondContact O-CB 3.39Å; N286-F289 PolarHBondContact O-N 3.48Å; N286-F289 WeakPolarHBondContact OD1-CB 3.34Å; N286-F289 PolarHBondContact OD1-N 2.62Å; N286-L290 PolarHBondContact O-N 3.07Å; N286-L290 VanDerWaalsContact O-N 3.12Å
287	D	87.5	Confident	89.5	Confident	132 Å²	132	61.8 Å²	61.8	71%	0.706	35%	0.345	S	S	*	.	H	α-helix	trans	-67.1	-30.4	-175	-46.9	-37.8	0	0	0	112.6	L290 S291	D287-L290 PolarHBondContact O-N 3.49Å; D287-S291 WeakPolarHBondContact O-CB 3.47Å; D287-S291 PolarHBondContact O-N 3.48Å; D287-S291 PolarHBondContact O-OG 2.67Å
288	D	88.8	Confident	89.6	Confident	72 Å²	72	63.3 Å²	63.3	39%	0.385	34%	0.34	S	S	.	.	H	α-helix	trans	-62.9	-44	172.3	171.9	73.3	0	0	0	112.3	N286 S291 K292	N286-D288 VanDerWaalsContact C-N 3.29Å; N286-D288 PolarHBondContact O-N 2.63Å; D288-S291 PolarHBondContact O-N 3.49Å; D288-K292 WeakPolarHBondContact O-CD 3.5Å; D288-K292 VanDerWaalsContact O-CG 3.31Å; D288-K292 WeakPolarHBondContact O-CG 3.42Å; D288-K292 PolarHBondContact O-N 3.24Å; D288-K292 VanDerWaalsContact O-N 3.13Å; D288-K292 WeakPolarHBondContact OD1-CE 3.47Å; D288-K292 IonicContact OD1-NZ 3.83Å; D288-K292 PolarHBondContact OD1-NZ 2.92Å; D288-K292 IonicContact OD2-NZ 3.27Å; D288-K292 PolarHBondContact OD2-NZ 3.41Å
289	F	91.5	Very high	89.7	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-60.9	-48.7	172.8	175.4	-84.7	0	0	0	110.8	L248 A251 V252 A255 F281 I282 Q285 N286 S291 K292 V293	L248-F289 HydrophobicContact CD1-CD2 3.72Å; L248-F289 HydrophobicContact CD1-CE2 4.31Å; A251-F289 HydrophobicContact CB-CE2 3.86Å; A251-F289 HydrophobicContact CB-CZ 4.4Å; V252-F289 HydrophobicContact CB-CE2 4.27Å; V252-F289 HydrophobicContact CG2-CD2 3.37Å; V252-F289 HydrophobicContact CG2-CE2 3.54Å; V252-F289 HydrophobicContact CG2-CG 4.18Å; V252-F289 HydrophobicContact CG2-CZ 4.45Å; A255-F289 HydrophobicContact CB-CE1 4.06Å; A255-F289 HydrophobicContact CB-CZ 3.78Å; F281-F289 HydrophobicContact CB-CE1 3.92Å; F281-F289 HydrophobicContact CB-CZ 4.1Å; F281-F289 HydrophobicContact CD2-CE1 4.06Å; F281-F289 HydrophobicContact CG-CE1 4.31Å; I282-F289 HydrophobicContact CD1-CD2 3.78Å; I282-F289 HydrophobicContact CD1-CE2 3.76Å; I282-F289 HydrophobicContact CD1-CG 4.18Å; I282-F289 HydrophobicContact CD1-CZ 4.15Å; I282-F289 HydrophobicContact CG1-CE1 4.4Å; I282-F289 HydrophobicContact CG1-CE2 4.34Å; I282-F289 HydrophobicContact CG1-CZ 4.23Å; I282-F289 HydrophobicContact CG2-CE2 4.41Å; I282-F289 HydrophobicContact CG2-CZ 4.23Å; Q285-F289 HydrophobicContact CG-CD1 3.77Å; Q285-F289 HydrophobicContact CG-CE1 4.31Å; Q285-F289 HydrophobicContact CG-CG 4.45Å; N286-F289 WeakPolarHBondContact O-CB 3.39Å; N286-F289 PolarHBondContact O-N 3.48Å; N286-F289 WeakPolarHBondContact OD1-CB 3.34Å; N286-F289 PolarHBondContact OD1-N 2.62Å; F289-S291 PolarHBondContact O-N 3.22Å; F289-K292 PolarHBondContact O-N 3.22Å; F289-V293 HydrophobicContact CD1-CG2 4.02Å; F289-V293 HydrophobicContact CE1-CG2 3.67Å; F289-V293 HydrophobicContact CZ-CG2 3.98Å; F289-V293 WeakPolarHBondContact O-CG2 3.34Å; F289-V293 PolarHBondContact O-N 3.43Å
290	L	92.5	Very high	89.6	Confident	17 Å²	17	60.1 Å²	60.1	9%	0.089	32%	0.315	C	S	.	.	H	α-helix	trans	-59.6	-47.1	178.3	-75.9	-178.7	0	0	0	111.7	L276 F281 Q285 N286 D287 K292 V293 E294	L276-L290 HydrophobicContact CB-CD2 3.83Å; F281-L290 HydrophobicContact CD2-CD2 4.26Å; F281-L290 HydrophobicContact CE2-CD2 4.08Å; Q285-L290 HydrophobicContact CG-CG 4.37Å; N286-L290 PolarHBondContact O-N 3.07Å; N286-L290 VanDerWaalsContact O-N 3.12Å; D287-L290 PolarHBondContact O-N 3.49Å; L290-K292 PolarHBondContact O-N 3.44Å; L290-V293 WeakPolarHBondContact O-CA 3.45Å; L290-V293 WeakPolarHBondContact O-CB 3.24Å; L290-V293 PolarHBondContact O-N 3.23Å; L290-E294 WeakPolarHBondContact O-CG 3.46Å; L290-E294 PolarHBondContact O-N 2.95Å
291	S	89.3	Confident	89.3	Confident	73 Å²	73	57.5 Å²	57.5	51%	0.51	31%	0.31	S	S	.	.	H	α-helix	trans	-57.1	-38.7	178.8	-56.2	0	0	0	0	112.3	D287 D288 F289 S295	D287-S291 WeakPolarHBondContact O-CB 3.47Å; D287-S291 PolarHBondContact O-N 3.48Å; D287-S291 PolarHBondContact O-OG 2.67Å; D288-S291 PolarHBondContact O-N 3.49Å; F289-S291 PolarHBondContact O-N 3.22Å; S291-S295 PolarHBondContact O-N 3.39Å; S291-S295 VanDerWaalsContact O-N 3.07Å
292	K	89.6	Confident	89.1	Confident	101 Å²	101	59.5 Å²	59.5	44%	0.439	34%	0.335	S	S	.	.	H	α-helix	trans	-73.1	-32.2	176.2	-69.5	165.4	-179.4	164.7	0	112.9	V252 D288 F289 L290 L296	V252-K292 HydrophobicContact CG1-CB 3.74Å; V252-K292 HydrophobicContact CG2-CB 4.35Å; D288-K292 WeakPolarHBondContact O-CD 3.5Å; D288-K292 VanDerWaalsContact O-CG 3.31Å; D288-K292 WeakPolarHBondContact O-CG 3.42Å; D288-K292 PolarHBondContact O-N 3.24Å; D288-K292 VanDerWaalsContact O-N 3.13Å; D288-K292 WeakPolarHBondContact OD1-CE 3.47Å; D288-K292 IonicContact OD1-NZ 3.83Å; D288-K292 PolarHBondContact OD1-NZ 2.92Å; D288-K292 IonicContact OD2-NZ 3.27Å; D288-K292 PolarHBondContact OD2-NZ 3.41Å; F289-K292 PolarHBondContact O-N 3.22Å; L290-K292 PolarHBondContact O-N 3.44Å; K292-L296 WeakPolarHBondContact O-CG 3.47Å; K292-L296 PolarHBondContact O-N 2.87Å; K292-L296 VanDerWaalsContact O-N 3.12Å
293	V	92.2	Very high	89	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-70.1	-41.3	172.9	175	0	0	0	0	111.1	V252 A255 V259 L276 F289 L290 L296 H297	V252-V293 HydrophobicContact CB-CG2 4.37Å; V252-V293 HydrophobicContact CG1-CG2 4.03Å; A255-V293 HydrophobicContact CB-CB 4.44Å; A255-V293 HydrophobicContact CB-CG1 3.91Å; A255-V293 HydrophobicContact CB-CG2 3.54Å; V259-V293 HydrophobicContact CG2-CG1 3.91Å; L276-V293 HydrophobicContact CD1-CB 4.19Å; L276-V293 HydrophobicContact CD1-CG1 3.54Å; F289-V293 HydrophobicContact CD1-CG2 4.02Å; F289-V293 HydrophobicContact CE1-CG2 3.67Å; F289-V293 HydrophobicContact CZ-CG2 3.98Å; F289-V293 WeakPolarHBondContact O-CG2 3.34Å; F289-V293 PolarHBondContact O-N 3.43Å; L290-V293 WeakPolarHBondContact O-CA 3.45Å; L290-V293 WeakPolarHBondContact O-CB 3.24Å; L290-V293 PolarHBondContact O-N 3.23Å; V293-L296 PolarHBondContact O-N 2.86Å; V293-H297 PolarHBondContact O-N 3.23Å
294	E	92.3	Very high	89.2	Confident	23 Å²	23	64.5 Å²	64.5	11%	0.107	35%	0.352	C	S	.	.	H	α-helix	trans	-61.8	-46.5	175.7	-67.1	-170.3	175.7	0	0	110.8	G274 Y275 L276 L290 L296 H297	G274-E294 VanDerWaalsContact C-OE1 3.25Å; G274-E294 WeakPolarHBondContact CA-OE1 3.29Å; G274-E294 PolarHBondContact N-OE1 2.94Å; G274-E294 VanDerWaalsContact N-OE1 3.16Å; G274-E294 PolarHBondContact N-OE2 3.05Å; Y275-E294 HydrophobicContact CD1-CG 4.07Å; Y275-E294 WeakPolarHBondContact CD1-OE1 3.43Å; Y275-E294 HydrophobicContact CE1-CB 3.92Å; Y275-E294 HydrophobicContact CE1-CG 3.43Å; Y275-E294 VanDerWaalsContact CE1-CG 3.43Å; Y275-E294 PolarHBondContact N-OE1 2.87Å; Y275-E294 VanDerWaalsContact N-OE1 3.13Å; L276-E294 HydrophobicContact CB-CG 4.26Å; L276-E294 HydrophobicContact CD1-CG 3.59Å; L276-E294 HydrophobicContact CG-CG 3.83Å; L276-E294 PolarHBondContact N-OE1 2.87Å; L290-E294 WeakPolarHBondContact O-CG 3.46Å; L290-E294 PolarHBondContact O-N 2.95Å; E294-L296 PolarHBondContact O-N 3.45Å; E294-H297 WeakPolarHBondContact O-CB 3.46Å; E294-H297 PolarHBondContact O-N 2.87Å; E294-H297 VanDerWaalsContact O-N 3.13Å
295	S	89.4	Confident	89.6	Confident	61 Å²	61	62 Å²	62	43%	0.427	34%	0.336	S	S	.	.	H	α-helix	trans	-63.1	-38.1	176.9	177.9	0	0	0	0	114	S291 H297	S291-S295 PolarHBondContact O-N 3.39Å; S291-S295 VanDerWaalsContact O-N 3.07Å; S295-H297 VanDerWaalsContact C-N 3.34Å
296	L	88.1	Confident	89.9	Confident	37 Å²	37	60.6 Å²	60.6	19%	0.194	33%	0.331	C	S	.	.	H	α-helix	trans	-72.3	-25.8	173.7	-73.1	-170.2	0	0	0	113.1	V252 V253 S256 K292 V293 E294 E298 Q299 H300	V252-L296 HydrophobicContact CG1-CD1 3.85Å; V253-L296 HydrophobicContact CB-CD1 4.47Å; V253-L296 HydrophobicContact CG2-CD1 3.84Å; S256-L296 VanDerWaalsContact CB-CB 3.48Å; K292-L296 WeakPolarHBondContact O-CG 3.47Å; K292-L296 PolarHBondContact O-N 2.87Å; K292-L296 VanDerWaalsContact O-N 3.12Å; V293-L296 PolarHBondContact O-N 2.86Å; E294-L296 PolarHBondContact O-N 3.45Å; L296-E298 VanDerWaalsContact C-N 3.3Å; L296-E298 PolarHBondContact O-N 2.93Å; L296-Q299 WeakPolarHBondContact O-CB 3.46Å; L296-Q299 PolarHBondContact O-N 3.48Å; L296-H300 PolarHBondContact O-CD2 3.17Å; L296-H300 PolarHBondContact O-NE2 3.13Å
297	H	92.2	Very high	90	Very high	0 Å²	0	60.5 Å²	60.5	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-64.1	-36.6	177.9	-174.7	-148.8	0	0	0	111.9	V259 Q260 G264 H271 Y275 V293 E294 S295 Q299 H300	V259-H297 HydrophobicContact CG1-CB 4.39Å; V259-H297 VanDerWaalsContact CG1-CE1 3.49Å; V259-H297 WeakPolarHBondContact CG1-CE1 3.47Å; V259-H297 WeakPolarHBondContact CG1-ND1 3.25Å; Q260-H297 PolarHBondContact OE1-CD2 2.76Å; Q260-H297 PolarHBondContact OE1-NE2 3.24Å; G264-H297 PolarHBondContact O-CE1 3.36Å; G264-H297 VanDerWaalsContact O-CE1 3.27Å; G264-H297 PolarHBondContact O-NE2 2.93Å; H271-H297 AromaticContact ND1-CE1 3.98Å; Y275-H297 AromaticContact CZ-ND1 3.82Å; Y275-H297 PolarHBondContact OH-ND1 2.76Å; V293-H297 PolarHBondContact O-N 3.23Å; E294-H297 WeakPolarHBondContact O-CB 3.46Å; E294-H297 PolarHBondContact O-N 2.87Å; E294-H297 VanDerWaalsContact O-N 3.13Å; S295-H297 VanDerWaalsContact C-N 3.34Å; H297-Q299 PolarHBondContact O-N 3.45Å; H297-H300 PolarHBondContact O-N 2.64Å; H297-H300 VanDerWaalsContact O-N 3.17Å
298	E	89.3	Confident	90.3	Very high	101 Å²	101	54.2 Å²	54.2	47%	0.472	30%	0.295	S	S	.	.	H	α-helix	trans	-55.6	-38.3	174.6	-51.8	-168.6	158.4	0	0	112	F266 L296 H300 S301	F266-E298 HydrophobicContact CB-CG 4.48Å; F266-E298 HydrophobicContact CD1-CB 4.32Å; F266-E298 HydrophobicContact CD1-CG 3.79Å; F266-E298 HydrophobicContact CD2-CG 4.02Å; F266-E298 HydrophobicContact CE1-CG 3.92Å; F266-E298 WeakPolarHBondContact CE1-OE1 3.3Å; F266-E298 HydrophobicContact CE2-CG 4.15Å; F266-E298 HydrophobicContact CG-CB 4.38Å; F266-E298 HydrophobicContact CG-CG 3.84Å; F266-E298 HydrophobicContact CZ-CG 4.1Å; F266-E298 WeakPolarHBondContact CZ-OE1 3.28Å; L296-E298 VanDerWaalsContact C-N 3.3Å; L296-E298 PolarHBondContact O-N 2.93Å; E298-H300 VanDerWaalsContact C-N 3.33Å; E298-H300 PolarHBondContact O-N 2.86Å; E298-S301 PolarHBondContact O-OG 3.38Å
299	Q	86.5	Confident	90.6	Very high	129 Å²	129	51 Å²	51	60%	0.603	28%	0.277	S	S	*	.	H	α-helix	trans	-75.1	-17	-176.8	-56.6	-179.2	4.6	0	0	114	L296 H297	L296-Q299 WeakPolarHBondContact O-CB 3.46Å; L296-Q299 PolarHBondContact O-N 3.48Å; H297-Q299 PolarHBondContact O-N 3.45Å
300	H	87	Confident	90.6	Very high	18 Å²	18	52.3 Å²	52.3	8%	0.083	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.4	-0.9	-178.5	-66.9	-42.9	0	0	0	114.2	S256 Y257 Q260 L296 H297 E298 G302 L303	S256-H300 WeakPolarHBondContact CB-NE2 3.42Å; S256-H300 PolarHBondContact OG-NE2 3.42Å; Y257-H300 AromaticContact CD1-CE1 3.94Å; Y257-H300 AromaticContact CE1-CE1 3.38Å; Y257-H300 WeakPolarHBondContact CE1-CE1 3.39Å; Y257-H300 AromaticContact CE1-ND1 3.48Å; Y257-H300 WeakPolarHBondContact CE1-ND1 3.17Å; Y257-H300 AromaticContact CE1-NE2 3.98Å; Y257-H300 AromaticContact CZ-CE1 3.45Å; Y257-H300 VanDerWaalsContact CZ-CE1 3.45Å; Y257-H300 AromaticContact CZ-ND1 3.95Å; Q260-H300 HydrophobicContact CB-CB 4.06Å; Q260-H300 HydrophobicContact CG-CB 3.86Å; Q260-H300 PolarHBondContact NE2-O 3.17Å; Q260-H300 PolarHBondContact OE1-O 3.39Å; L296-H300 PolarHBondContact O-CD2 3.17Å; L296-H300 PolarHBondContact O-NE2 3.13Å; H297-H300 PolarHBondContact O-N 2.64Å; H297-H300 VanDerWaalsContact O-N 3.17Å; E298-H300 VanDerWaalsContact C-N 3.33Å; E298-H300 PolarHBondContact O-N 2.86Å; H300-G302 PolarHBondContact O-N 2.84Å; H300-L303 HydrophobicContact CB-CD1 4.11Å; H300-L303 WeakPolarHBondContact O-CB 3.44Å; H300-L303 WeakPolarHBondContact O-CG 3.46Å; H300-L303 PolarHBondContact O-N 2.93Å
301	S	86.7	Confident	90.6	Very high	66 Å²	66	53.5 Å²	53.5	46%	0.462	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.3	123	-178.2	-59.8	0	0	0	0	112.7	E298	E298-S301 PolarHBondContact O-OG 3.38Å
302	G	87.7	Confident	90.8	Very high	57 Å²	57	50.3 Å²	50.3	59%	0.588	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	101.8	-10.9	-176.9	0	0	0	0	0	114.7	D265 H300	D265-G302 VanDerWaalsContact CG-N 3.31Å; D265-G302 PolarHBondContact OD1-N 2.83Å; D265-G302 PolarHBondContact OD2-N 2.68Å; H300-G302 PolarHBondContact O-N 2.84Å
303	L	89	Confident	91	Very high	54 Å²	54	45.6 Å²	45.6	28%	0.283	25%	0.252	S	S	.	.			trans	-76.9	126	174.2	-69.6	178.6	0	0	0	111.3	Y257 Q260 H300 E307	Y257-L303 HydrophobicContact CD1-CD1 4.4Å; Y257-L303 HydrophobicContact CE1-CD1 3.84Å; Q260-L303 HydrophobicContact CG-CB 4.1Å; Q260-L303 PolarHBondContact NE2-O 3.08Å; H300-L303 HydrophobicContact CB-CD1 4.11Å; H300-L303 WeakPolarHBondContact O-CB 3.44Å; H300-L303 WeakPolarHBondContact O-CG 3.46Å; H300-L303 PolarHBondContact O-N 2.93Å; L303-E307 HydrophobicContact CD2-CB 4.46Å
304	K	92.4	Very high	90.8	Very high	134 Å²	134	47.2 Å²	47.2	58%	0.583	26%	0.261	S	S	*	.			trans	-68.8	156.7	173.4	-62.5	170.5	-172.6	164.4	0	111	S306 E307 A308	K304-S306 VanDerWaalsContact C-N 3.27Å; K304-S306 PolarHBondContact O-N 2.83Å; K304-E307 HydrophobicContact CB-CB 4.47Å; K304-E307 HydrophobicContact CB-CG 4.29Å; K304-E307 VanDerWaalsContact CB-OE2 3.29Å; K304-E307 WeakPolarHBondContact CB-OE2 3.48Å; K304-E307 WeakPolarHBondContact CG-OE2 3.35Å; K304-E307 PolarHBondContact N-OE2 2.97Å; K304-E307 WeakPolarHBondContact O-CA 3.47Å; K304-E307 WeakPolarHBondContact O-CB 3.32Å; K304-E307 PolarHBondContact O-N 3Å; K304-A308 PolarHBondContact O-N 3.21Å
305	Q	94.1	Very high	90.6	Very high	99 Å²	99	48.2 Å²	48.2	46%	0.463	27%	0.266	S	S	.	.	H	α-helix	trans	-44.9	-51.2	171.9	176.2	177.4	6.1	0	0	112.4	H229 S261 E307 A308 E309	H229-Q305 PolarHBondContact CE1-NE2 3.08Å; S261-Q305 WeakPolarHBondContact O-CG 3.41Å; Q305-E307 VanDerWaalsContact C-N 3.26Å; Q305-E307 PolarHBondContact O-N 3.13Å; Q305-A308 PolarHBondContact O-N 2.94Å; Q305-E309 HydrophobicContact CG-CG 4.36Å; Q305-E309 WeakPolarHBondContact CG-OE1 3.42Å; Q305-E309 PolarHBondContact NE2-OE1 3.46Å; Q305-E309 WeakPolarHBondContact O-CB 3.46Å; Q305-E309 WeakPolarHBondContact O-CG 3.39Å; Q305-E309 PolarHBondContact O-N 3.4Å
306	S	92.4	Very high	90.7	Very high	21 Å²	21	45.3 Å²	45.3	15%	0.147	25%	0.246	C	C	.	.	H	α-helix	trans	-66.4	-24.3	-178.5	58.4	0	0	0	0	114.7	E225 K304 S310	E225-S306 WeakPolarHBondContact OE1-CB 3.4Å; E225-S306 WeakPolarHBondContact OE2-CB 3.18Å; K304-S306 VanDerWaalsContact C-N 3.27Å; K304-S306 PolarHBondContact O-N 2.83Å; S306-S310 WeakPolarHBondContact O-CB 3.44Å; S306-S310 PolarHBondContact O-N 3.25Å; S306-S310 PolarHBondContact O-OG 2.94Å
307	E	91.9	Very high	90.8	Very high	76 Å²	76	48.4 Å²	48.4	36%	0.355	26%	0.255	S	S	.	.	H	α-helix	trans	-82.6	-47.9	177.3	-67.2	161.4	164.6	0	0	109.6	L303 K304 Q305 E309 S310 C311	L303-E307 HydrophobicContact CD2-CB 4.46Å; K304-E307 HydrophobicContact CB-CB 4.47Å; K304-E307 HydrophobicContact CB-CG 4.29Å; K304-E307 VanDerWaalsContact CB-OE2 3.29Å; K304-E307 WeakPolarHBondContact CB-OE2 3.48Å; K304-E307 WeakPolarHBondContact CG-OE2 3.35Å; K304-E307 PolarHBondContact N-OE2 2.97Å; K304-E307 WeakPolarHBondContact O-CA 3.47Å; K304-E307 WeakPolarHBondContact O-CB 3.32Å; K304-E307 PolarHBondContact O-N 3Å; Q305-E307 VanDerWaalsContact C-N 3.26Å; Q305-E307 PolarHBondContact O-N 3.13Å; E307-E309 PolarHBondContact O-N 3.35Å; E307-S310 WeakPolarHBondContact O-CB 3.29Å; E307-S310 PolarHBondContact O-N 2.65Å; E307-S310 VanDerWaalsContact O-N 3.09Å; E307-C311 PolarHBondContact O-N 3.16Å; E307-C311 PolarHBondContact O-SG 3.16Å
308	A	92.9	Very high	90.5	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-58.9	-42.1	173.6	0	0	0	0	0	112.7	Y257 Q260 K304 Q305 S310 C311 Y312	Y257-A308 HydrophobicContact CD1-CB 4.23Å; Q260-A308 HydrophobicContact CB-CB 4.16Å; Q260-A308 HydrophobicContact CG-CB 3.9Å; K304-A308 PolarHBondContact O-N 3.21Å; Q305-A308 PolarHBondContact O-N 2.94Å; A308-S310 VanDerWaalsContact C-N 3.35Å; A308-C311 PolarHBondContact O-N 3.13Å; A308-Y312 PolarHBondContact O-N 3.26Å
309	E	95.6	Very high	90.4	Very high	3 Å²	3	48.8 Å²	48.8	1%	0.014	26%	0.264	C	S	.	.	H	α-helix	trans	-64.3	-38.5	173.7	-71	177.1	-172.3	0	0	112	H229 F232 S261 Q305 E307 Y312 I313	H229-E309 WeakPolarHBondContact CA-OE2 3.23Å; H229-E309 VanDerWaalsContact CB-OE2 3.32Å; H229-E309 WeakPolarHBondContact CB-OE2 3.49Å; H229-E309 IonicContact CE1-OE1 3.79Å; H229-E309 PolarHBondContact CE1-OE1 3.2Å; H229-E309 IonicContact CG-OE1 3.02Å; H229-E309 IonicContact CG-OE2 2.73Å; H229-E309 IonicContact ND1-OE1 2.68Å; H229-E309 PolarHBondContact ND1-OE1 2.94Å; H229-E309 IonicContact ND1-OE2 2.63Å; H229-E309 PolarHBondContact ND1-OE2 3.16Å; F232-E309 HydrophobicContact CB-CB 4.11Å; F232-E309 HydrophobicContact CB-CG 4.1Å; F232-E309 HydrophobicContact CD1-CG 3.61Å; F232-E309 HydrophobicContact CD2-CB 4.46Å; F232-E309 HydrophobicContact CD2-CG 4.07Å; F232-E309 HydrophobicContact CE1-CG 3.96Å; F232-E309 HydrophobicContact CE2-CG 4.39Å; F232-E309 HydrophobicContact CG-CB 4.13Å; F232-E309 HydrophobicContact CG-CG 3.66Å; F232-E309 HydrophobicContact CZ-CG 4.32Å; S261-E309 WeakPolarHBondContact OG-CG 3.26Å; S261-E309 PolarHBondContact OG-OE1 3.24Å; Q305-E309 HydrophobicContact CG-CG 4.36Å; Q305-E309 WeakPolarHBondContact CG-OE1 3.42Å; Q305-E309 PolarHBondContact NE2-OE1 3.46Å; Q305-E309 WeakPolarHBondContact O-CB 3.46Å; Q305-E309 WeakPolarHBondContact O-CG 3.39Å; Q305-E309 PolarHBondContact O-N 3.4Å; E307-E309 PolarHBondContact O-N 3.35Å; E309-Y312 WeakPolarHBondContact O-CB 3.4Å; E309-Y312 PolarHBondContact O-N 2.85Å; E309-I313 VanDerWaalsContact O-CD1 3.31Å; E309-I313 WeakPolarHBondContact O-CD1 3.45Å; E309-I313 WeakPolarHBondContact O-CG1 3.48Å; E309-I313 PolarHBondContact O-N 3.45Å
310	S	92.2	Very high	90.1	Very high	29 Å²	29	47.6 Å²	47.6	20%	0.203	26%	0.262	C	S	.	.	H	α-helix	trans	-67.8	-36.1	176.3	-62	0	0	0	0	112.1	S306 E307 A308 N314	S306-S310 WeakPolarHBondContact O-CB 3.44Å; S306-S310 PolarHBondContact O-N 3.25Å; S306-S310 PolarHBondContact O-OG 2.94Å; E307-S310 WeakPolarHBondContact O-CB 3.29Å; E307-S310 PolarHBondContact O-N 2.65Å; E307-S310 VanDerWaalsContact O-N 3.09Å; A308-S310 VanDerWaalsContact C-N 3.35Å; S310-N314 WeakPolarHBondContact O-CB 3.32Å; S310-N314 PolarHBondContact O-N 3.11Å; S310-N314 PolarHBondContact O-ND2 3.17Å
311	C	91.1	Very high	90.1	Very high	42 Å²	42	47.8 Å²	47.8	28%	0.284	26%	0.262	S	S	.	.	H	α-helix	trans	-64.3	-47	170.1	-69.9	0	0	0	0	111.6	Y257 E307 A308 I313 N314 I315	Y257-C311 HydrophobicContact CD1-CB 3.84Å; Y257-C311 HydrophobicContact CD2-CB 4.23Å; Y257-C311 HydrophobicContact CE1-CB 3.64Å; Y257-C311 HydrophobicContact CE2-CB 4.05Å; Y257-C311 HydrophobicContact CG-CB 4.14Å; E307-C311 PolarHBondContact O-N 3.16Å; E307-C311 PolarHBondContact O-SG 3.16Å; A308-C311 PolarHBondContact O-N 3.13Å; C311-I313 PolarHBondContact O-N 3.43Å; C311-N314 PolarHBondContact O-N 2.79Å; C311-I315 WeakPolarHBondContact O-CG1 3.48Å; C311-I315 PolarHBondContact O-N 3.08Å
312	Y	94.8	Very high	90.3	Very high	6 Å²	6	46 Å²	46	2%	0.024	25%	0.246	C	C	.	.	H	α-helix	trans	-53.6	-50.5	176.3	-170.8	-73	0	0	0	111.5	F232 L235 K236 L254 A258 A308 E309 N314 I315 A316	F232-Y312 AromaticContact CD2-CD1 3.73Å; F232-Y312 HydrophobicContact CD2-CD1 3.73Å; F232-Y312 AromaticContact CD2-CD2 3.94Å; F232-Y312 HydrophobicContact CD2-CD2 3.94Å; F232-Y312 HydrophobicContact CD2-CE1 4.32Å; F232-Y312 HydrophobicContact CD2-CE2 4.48Å; F232-Y312 AromaticContact CD2-CG 3.56Å; F232-Y312 HydrophobicContact CD2-CG 3.56Å; F232-Y312 HydrophobicContact CE2-CD1 4.28Å; F232-Y312 AromaticContact CE2-CD2 3.67Å; F232-Y312 HydrophobicContact CE2-CD2 3.67Å; F232-Y312 HydrophobicContact CE2-CE2 4.11Å; F232-Y312 AromaticContact CE2-CG 3.79Å; F232-Y312 HydrophobicContact CE2-CG 3.79Å; L235-Y312 HydrophobicContact CB-CD1 4.44Å; L235-Y312 HydrophobicContact CB-CE1 3.81Å; K236-Y312 WeakPolarHBondContact CA-OH 3.08Å; L254-Y312 HydrophobicContact CB-CD2 4.1Å; L254-Y312 HydrophobicContact CB-CE2 3.59Å; L254-Y312 HydrophobicContact CD2-CD1 3.87Å; L254-Y312 HydrophobicContact CD2-CD2 3.74Å; L254-Y312 HydrophobicContact CD2-CE1 3.92Å; L254-Y312 HydrophobicContact CD2-CE2 3.83Å; L254-Y312 HydrophobicContact CD2-CG 3.74Å; L254-Y312 VanDerWaalsContact CD2-O 3.3Å; L254-Y312 WeakPolarHBondContact CD2-O 3.48Å; L254-Y312 HydrophobicContact CG-CE2 4.24Å; L254-Y312 WeakPolarHBondContact O-CD2 3.4Å; L254-Y312 WeakPolarHBondContact O-CE2 3.49Å; A258-Y312 HydrophobicContact CB-CD2 4.04Å; A258-Y312 HydrophobicContact CB-CE2 3.84Å; A308-Y312 PolarHBondContact O-N 3.26Å; E309-Y312 WeakPolarHBondContact O-CB 3.4Å; E309-Y312 PolarHBondContact O-N 2.85Å; Y312-N314 PolarHBondContact O-N 2.98Å; Y312-I315 PolarHBondContact O-N 2.97Å; Y312-A316 HydrophobicContact CD1-CB 4.38Å; Y312-A316 HydrophobicContact CE1-CB 4.29Å; Y312-A316 VanDerWaalsContact O-CB 3.29Å; Y312-A316 WeakPolarHBondContact O-CB 3.36Å; Y312-A316 PolarHBondContact O-N 2.94Å
313	I	92.8	Very high	90.4	Very high	1 Å²	1	44 Å²	44	1%	0.005	23%	0.225	C	C	.	.	H	α-helix	trans	-67.8	-36.8	-178.4	-55.8	155.1	0	0	0	111	P219 R228 F232 L235 E309 C311 I315 A316 R317	P219-I313 HydrophobicContact CB-CG2 3.45Å; P219-I313 VanDerWaalsContact CB-CG2 3.45Å; P219-I313 HydrophobicContact CG-CG2 3.83Å; R228-I313 HydrophobicContact CB-CD1 4.03Å; R228-I313 VanDerWaalsContact O-CD1 3.24Å; R228-I313 WeakPolarHBondContact O-CD1 3.48Å; F232-I313 HydrophobicContact CB-CD1 4.15Å; F232-I313 HydrophobicContact CB-CG1 4.16Å; L235-I313 HydrophobicContact CD1-CB 4.38Å; L235-I313 HydrophobicContact CD1-CG1 4.15Å; L235-I313 HydrophobicContact CD1-CG2 3.96Å; E309-I313 VanDerWaalsContact O-CD1 3.31Å; E309-I313 WeakPolarHBondContact O-CD1 3.45Å; E309-I313 WeakPolarHBondContact O-CG1 3.48Å; E309-I313 PolarHBondContact O-N 3.45Å; C311-I313 PolarHBondContact O-N 3.43Å; I313-I315 VanDerWaalsContact C-N 3.32Å; I313-I315 PolarHBondContact O-N 2.66Å; I313-A316 PolarHBondContact O-N 3.44Å; I313-R317 PolarHBondContact O-N 3.28Å
314	N	89	Confident	90.5	Very high	35 Å²	35	42.7 Å²	42.7	19%	0.187	22%	0.219	C	C	.	.	H	α-helix	trans	-69.6	-24.4	176.9	-88.9	-64.8	0	0	0	114	N220 S310 C311 Y312 R317	N220-N314 PolarHBondContact ND2-OD1 3.39Å; N220-N314 VanDerWaalsContact ND2-OD1 3.11Å; N220-N314 PolarHBondContact OD1-ND2 3.22Å; S310-N314 WeakPolarHBondContact O-CB 3.32Å; S310-N314 PolarHBondContact O-N 3.11Å; S310-N314 PolarHBondContact O-ND2 3.17Å; C311-N314 PolarHBondContact O-N 2.79Å; Y312-N314 PolarHBondContact O-N 2.98Å; N314-R317 WeakPolarHBondContact O-CG 3.43Å; N314-R317 PolarHBondContact O-NE 3.26Å; N314-R317 PolarHBondContact OD1-NE 2.75Å; N314-R317 PolarHBondContact OD1-NH2 3.39Å
315	I	87.7	Confident	90.4	Very high	43 Å²	43	37.4 Å²	37.4	22%	0.221	20%	0.197	C	C	.	.	H	α-helix	trans	-81.5	-47.8	168.9	-66.3	170.9	0	0	0	110	V253 L254 Y257 C311 Y312 I313 R317 T318	V253-I315 HydrophobicContact CG1-CD1 3.6Å; L254-I315 HydrophobicContact CD1-CG2 4.44Å; L254-I315 HydrophobicContact CD2-CB 3.8Å; L254-I315 HydrophobicContact CD2-CG2 3.72Å; L254-I315 HydrophobicContact CG-CG2 3.93Å; Y257-I315 HydrophobicContact CD2-CD1 4Å; Y257-I315 HydrophobicContact CE2-CD1 3.58Å; C311-I315 WeakPolarHBondContact O-CG1 3.48Å; C311-I315 PolarHBondContact O-N 3.08Å; Y312-I315 PolarHBondContact O-N 2.97Å; I313-I315 VanDerWaalsContact C-N 3.32Å; I313-I315 PolarHBondContact O-N 2.66Å; I315-R317 VanDerWaalsContact C-N 3.26Å; I315-R317 PolarHBondContact O-N 2.67Å; I315-T318 WeakPolarHBondContact O-CB 3.32Å; I315-T318 PolarHBondContact O-N 3.43Å; I315-T318 PolarHBondContact O-OG1 2.7Å
316	A	91	Very high	90.2	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-59.4	-32.2	-177.8	0	0	0	0	0	113.4	L235 L244 L254 Y312 I313 T318 L319 Y322	L235-A316 HydrophobicContact CB-CB 4.5Å; L235-A316 HydrophobicContact CD1-CB 4.04Å; L235-A316 HydrophobicContact CD2-CB 4.34Å; L244-A316 HydrophobicContact CD2-CB 4.46Å; L254-A316 HydrophobicContact CD2-CB 4.35Å; Y312-A316 HydrophobicContact CD1-CB 4.38Å; Y312-A316 HydrophobicContact CE1-CB 4.29Å; Y312-A316 VanDerWaalsContact O-CB 3.29Å; Y312-A316 WeakPolarHBondContact O-CB 3.36Å; Y312-A316 PolarHBondContact O-N 2.94Å; I313-A316 PolarHBondContact O-N 3.44Å; A316-T318 PolarHBondContact O-N 3.01Å; A316-T318 VanDerWaalsContact O-N 3.15Å; A316-L319 WeakPolarHBondContact O-CB 3.45Å; A316-L319 PolarHBondContact O-N 3.47Å; A316-Y322 WeakPolarHBondContact O-CD2 2.98Å
317	R	90.7	Very high	90.1	Very high	103 Å²	103	33.9 Å²	33.9	39%	0.389	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64	-12.2	173.3	69.9	171.3	176.1	74.1	4.6	115.1	P219 I313 N314 I315 Y322	P219-R317 VanDerWaalsContact CD-CD 3.46Å; I313-R317 PolarHBondContact O-N 3.28Å; N314-R317 WeakPolarHBondContact O-CG 3.43Å; N314-R317 PolarHBondContact O-NE 3.26Å; N314-R317 PolarHBondContact OD1-NE 2.75Å; N314-R317 PolarHBondContact OD1-NH2 3.39Å; I315-R317 VanDerWaalsContact C-N 3.26Å; I315-R317 PolarHBondContact O-N 2.67Å; R317-Y322 HydrophobicContact CB-CD1 4.26Å; R317-Y322 HydrophobicContact CB-CD2 4.3Å; R317-Y322 HydrophobicContact CB-CE1 4.03Å; R317-Y322 HydrophobicContact CB-CE2 4.04Å; R317-Y322 HydrophobicContact CB-CG 4.39Å
318	T	86.4	Confident	89.9	Confident	92 Å²	92	31.3 Å²	31.3	56%	0.564	17%	0.173	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.6	-13.3	178.4	72.7	0	0	0	0	113.1	I315 A316	I315-T318 WeakPolarHBondContact O-CB 3.32Å; I315-T318 PolarHBondContact O-N 3.43Å; I315-T318 PolarHBondContact O-OG1 2.7Å; A316-T318 PolarHBondContact O-N 3.01Å; A316-T318 VanDerWaalsContact O-N 3.15Å
319	L	86.2	Confident	89.5	Confident	16 Å²	16	31.4 Å²	31.4	8%	0.084	17%	0.174	C	C	.	.	S	Bend	trans	-75	142.7	-178.6	-61.1	-179.6	0	0	0	111.8	L244 C246 L254 A316 Y322	L244-L319 HydrophobicContact CD1-CB 4Å; L244-L319 HydrophobicContact CD1-CD1 4.41Å; L244-L319 HydrophobicContact CD2-CD1 3.98Å; L244-L319 HydrophobicContact CG-CB 4.39Å; L244-L319 HydrophobicContact CG-CD1 3.88Å; C246-L319 HydrophobicContact CB-CD1 3.89Å; C246-L319 HydrophobicContact CB-CD2 4.48Å; L254-L319 HydrophobicContact CD1-CD1 3.97Å; A316-L319 WeakPolarHBondContact O-CB 3.45Å; A316-L319 PolarHBondContact O-N 3.47Å; L319-Y322 WeakPolarHBondContact O-CB 3.5Å; L319-Y322 PolarHBondContact O-N 2.91Å
320	D	80.5	Confident	88.7	Confident	105 Å²	105	35 Å²	35	56%	0.561	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.5	142.6	165.4	-87	-59.2	0	0	0	109.8	L244 Y322	L244-D320 WeakPolarHBondContact CD1-O 3.42Å; D320-Y322 VanDerWaalsContact C-N 3.33Å; D320-Y322 PolarHBondContact O-N 3.22Å
321	F	87.5	Confident	87.8	Confident	21 Å²	21	34.3 Å²	34.3	9%	0.092	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.5	4.4	-172	-56.2	-84.5	0	0	0	117.6	L244 T245 G323 V324 L326 Y349 Y352	L244-F321 HydrophobicContact CD1-CB 4.38Å; T245-F321 WeakPolarHBondContact OG1-CD2 3.38Å; F321-G323 PolarHBondContact O-N 3.29Å; F321-V324 HydrophobicContact CB-CB 4.49Å; F321-V324 HydrophobicContact CD1-CB 4.27Å; F321-V324 HydrophobicContact CD1-CG1 4.3Å; F321-V324 PolarHBondContact O-N 2.88Å; F321-L326 HydrophobicContact CD1-CD1 4.09Å; F321-L326 HydrophobicContact CD1-CD2 4.19Å; F321-L326 HydrophobicContact CD1-CG 4.48Å; F321-L326 HydrophobicContact CE1-CD1 4.17Å; F321-L326 HydrophobicContact CE1-CD2 4.01Å; F321-Y349 HydrophobicContact CD1-CE1 4.14Å; F321-Y349 AromaticContact CE1-CD1 3.46Å; F321-Y349 HydrophobicContact CE1-CD1 3.46Å; F321-Y349 VanDerWaalsContact CE1-CD1 3.46Å; F321-Y349 HydrophobicContact CE1-CD2 4.1Å; F321-Y349 AromaticContact CE1-CE1 3.27Å; F321-Y349 HydrophobicContact CE1-CE1 3.27Å; F321-Y349 AromaticContact CE1-CE2 3.94Å; F321-Y349 HydrophobicContact CE1-CE2 3.94Å; F321-Y349 AromaticContact CE1-CG 3.89Å; F321-Y349 HydrophobicContact CE1-CG 3.89Å; F321-Y349 AromaticContact CE1-CZ 3.54Å; F321-Y349 HydrophobicContact CE2-CE1 4.37Å; F321-Y349 AromaticContact CZ-CD1 3.4Å; F321-Y349 HydrophobicContact CZ-CD1 3.4Å; F321-Y349 VanDerWaalsContact CZ-CD1 3.4Å; F321-Y349 AromaticContact CZ-CE1 3.41Å; F321-Y349 HydrophobicContact CZ-CE1 3.41Å; F321-Y349 VanDerWaalsContact CZ-CE1 3.41Å; F321-Y349 HydrophobicContact CZ-CG 4.16Å; F321-Y352 HydrophobicContact CE1-CD1 4.38Å; F321-Y352 HydrophobicContact CE2-CD1 4.43Å; F321-Y352 AromaticContact CZ-CD1 3.99Å; F321-Y352 HydrophobicContact CZ-CD1 3.99Å; F321-Y352 HydrophobicContact CZ-CG 4.49Å; F321-Y352 VanDerWaalsContact CZ-O 3.25Å; F321-Y352 WeakPolarHBondContact CZ-O 3.36Å
322	Y	91.4	Very high	86.8	Confident	29 Å²	29	38.2 Å²	38.2	11%	0.114	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50.6	113	170.1	175.4	-98.9	0	0	0	111.5	F215 I216 L235 A316 R317 L319 D320 V324	F215-Y322 HydrophobicContact CB-CE1 3.93Å; F215-Y322 HydrophobicContact CD1-CE2 4.02Å; F215-Y322 AromaticContact CD1-CZ 3.99Å; I216-Y322 WeakPolarHBondContact O-CE1 3.45Å; I216-Y322 PolarHBondContact O-OH 2.91Å; L235-Y322 HydrophobicContact CD1-CE2 3.96Å; L235-Y322 HydrophobicContact CD2-CD2 3.8Å; L235-Y322 HydrophobicContact CD2-CE2 3.74Å; A316-Y322 WeakPolarHBondContact O-CD2 2.98Å; R317-Y322 HydrophobicContact CB-CD1 4.26Å; R317-Y322 HydrophobicContact CB-CD2 4.3Å; R317-Y322 HydrophobicContact CB-CE1 4.03Å; R317-Y322 HydrophobicContact CB-CE2 4.04Å; R317-Y322 HydrophobicContact CB-CG 4.39Å; L319-Y322 WeakPolarHBondContact O-CB 3.5Å; L319-Y322 PolarHBondContact O-N 2.91Å; D320-Y322 VanDerWaalsContact C-N 3.33Å; D320-Y322 PolarHBondContact O-N 3.22Å; Y322-V324 VanDerWaalsContact C-N 3.34Å; Y322-V324 PolarHBondContact O-N 3.4Å
323	G	89.8	Confident	85.5	Confident	15 Å²	15	44.7 Å²	44.7	16%	0.155	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	66.7	21.6	178.5	0	0	0	0	0	117	F215 F321	F215-G323 VanDerWaalsContact CG-CA 3.4Å; F321-G323 PolarHBondContact O-N 3.29Å
324	V	90.5	Very high	84.5	Confident	27 Å²	27	49.1 Å²	49.1	16%	0.164	25%	0.253	C	S	.	.			trans	-91.3	111.3	-176.7	-179	0	0	0	0	112.2	F321 Y322 L326 I341 A342 Y349	F321-V324 HydrophobicContact CB-CB 4.49Å; F321-V324 HydrophobicContact CD1-CB 4.27Å; F321-V324 HydrophobicContact CD1-CG1 4.3Å; F321-V324 PolarHBondContact O-N 2.88Å; Y322-V324 VanDerWaalsContact C-N 3.34Å; Y322-V324 PolarHBondContact O-N 3.4Å; V324-L326 HydrophobicContact CG1-CD2 3.78Å; V324-L326 HydrophobicContact CG1-CG 4.25Å; V324-L326 PolarHBondContact O-N 3.05Å; V324-I341 WeakPolarHBondContact CA-O 3.32Å; V324-A342 HydrophobicContact CG2-CB 4.33Å; V324-Y349 HydrophobicContact CG1-CE2 4.01Å
325	E	91	Very high	83.9	Confident	22 Å²	22	51.6 Å²	51.6	10%	0.103	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	100.8	175.5	-171.6	-170.5	152.3	0	0	110.8	R213 H327 G340 I341 S405 H409	R213-E325 IonicContact CZ-OE2 3.33Å; R213-E325 IonicContact NH1-OE2 2.68Å; R213-E325 PolarHBondContact NH1-OE2 2.92Å; R213-E325 IonicContact NH2-OE2 2.84Å; R213-E325 PolarHBondContact NH2-OE2 3.39Å; E325-H327 IonicContact OE1-CD2 3.21Å; E325-H327 IonicContact OE1-CE1 2.81Å; E325-H327 PolarHBondContact OE1-CE1 3.06Å; E325-H327 IonicContact OE1-NE2 2.69Å; E325-H327 PolarHBondContact OE1-NE2 3.16Å; E325-G340 CarbonylContact O-C 3.57Å; E325-G340 WeakPolarHBondContact O-CA 3.3Å; E325-I341 HydrophobicContact CB-CB 4.26Å; E325-I341 PolarHBondContact N-O 2.86Å; E325-I341 PolarHBondContact O-N 3.11Å; E325-S405 VanDerWaalsContact OE1-CB 3.23Å; E325-S405 WeakPolarHBondContact OE1-CB 3.49Å; E325-S405 PolarHBondContact OE1-OG 3.1Å; E325-S405 WeakPolarHBondContact OE2-CB 3.26Å; E325-S405 PolarHBondContact OE2-OG 2.95Å; E325-H409 IonicContact OE2-CE1 3.55Å; E325-H409 PolarHBondContact OE2-CE1 2.9Å; E325-H409 VanDerWaalsContact OE2-CE1 3.31Å; E325-H409 IonicContact OE2-ND1 3.68Å
326	L	89.6	Confident	83.6	Confident	46 Å²	46	54.3 Å²	54.3	24%	0.241	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	130.4	-177	-63.9	173.8	0	0	0	113.9	F321 V324 M338 Y349 Y352	F321-L326 HydrophobicContact CD1-CD1 4.09Å; F321-L326 HydrophobicContact CD1-CD2 4.19Å; F321-L326 HydrophobicContact CD1-CG 4.48Å; F321-L326 HydrophobicContact CE1-CD1 4.17Å; F321-L326 HydrophobicContact CE1-CD2 4.01Å; V324-L326 HydrophobicContact CG1-CD2 3.78Å; V324-L326 HydrophobicContact CG1-CG 4.25Å; V324-L326 PolarHBondContact O-N 3.05Å; L326-M338 HydrophobicContact CB-CE 3.9Å; L326-M338 HydrophobicContact CD2-CB 4.12Å; L326-Y349 HydrophobicContact CD2-CD2 3.85Å; L326-Y349 HydrophobicContact CD2-CE2 3.97Å; L326-Y352 HydrophobicContact CD1-CE1 4.33Å
327	H	89.9	Confident	83.5	Confident	1 Å²	1	54.6 Å²	54.6	1%	0.005	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	121.7	175.8	-72.9	-103.9	0	0	0	111.9	S186 E325 M338 I339 M393 L402	S186-H327 WeakPolarHBondContact CB-ND1 3.07Å; S186-H327 PolarHBondContact OG-ND1 2.86Å; E325-H327 IonicContact OE1-CD2 3.21Å; E325-H327 IonicContact OE1-CE1 2.81Å; E325-H327 PolarHBondContact OE1-CE1 3.06Å; E325-H327 IonicContact OE1-NE2 2.69Å; E325-H327 PolarHBondContact OE1-NE2 3.16Å; H327-M338 CarbonylContact O-C 3.56Å; H327-M338 WeakPolarHBondContact O-CA 3.39Å; H327-I339 PolarHBondContact N-O 3Å; H327-I339 PolarHBondContact O-N 3.15Å; H327-M393 HydrophobicContact CB-CE 4Å; H327-L402 HydrophobicContact CB-CD1 3.91Å
328	G	86.9	Confident	83.3	Confident	22 Å²	22	52.6 Å²	52.6	23%	0.227	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	134.3	177.4	0	0	0	0	0	114	M393	G328-M393 WeakPolarHBondContact O-CE 3.46Å
329	G	84.3	Confident	83.5	Confident	2 Å²	2	48.2 Å²	48.2	2%	0.021	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.2	-172.7	179.1	0	0	0	0	0	112.7	L337	G329-L337 CarbonylContact C-O 3.35Å; G329-L337 PolarHBondContact N-O 2.92Å; G329-L337 PolarHBondContact O-N 2.96Å
330	R	80.1	Confident	83.8	Confident	79 Å²	79	47.4 Å²	47.4	30%	0.298	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	154	179.7	-65.5	-173.3	174.8	177.2	-6.3	112.2	N334 L335 D336 N392	R330-N334 WeakPolarHBondContact CD-OD1 3.36Å; R330-N334 PolarHBondContact NH1-OD1 2.76Å; R330-L335 VanDerWaalsContact CA-O 3.26Å; R330-L335 WeakPolarHBondContact CA-O 3.09Å; R330-D336 WeakPolarHBondContact CG-OD1 3.42Å; R330-D336 IonicContact CZ-OD1 2.73Å; R330-D336 IonicContact NE-OD1 3.5Å; R330-D336 PolarHBondContact NE-OD1 3.25Å; R330-D336 IonicContact NH2-OD1 2.84Å; R330-D336 PolarHBondContact NH2-OD1 3.33Å; R330-D336 IonicContact NH2-OD2 3.23Å; R330-N392 PolarHBondContact N-O 2.84Å; R330-N392 PolarHBondContact O-N 3.31Å
331	D	72.2	Confident	84.4	Confident	13 Å²	13	42.4 Å²	42.4	7%	0.07	22%	0.22	C	C	.	.			trans	-80.5	-174.7	169.7	73.3	7.4	0	0	0	112.7	H333 N334 L335 L337 R350	D331-H333 PolarHBondContact O-N 2.79Å; D331-H333 VanDerWaalsContact OD1-C 3.26Å; D331-H333 VanDerWaalsContact OD1-CA 3.28Å; D331-H333 WeakPolarHBondContact OD1-CA 3.36Å; D331-H333 WeakPolarHBondContact OD1-CB 3.48Å; D331-H333 PolarHBondContact OD1-N 3.07Å; D331-H333 IonicContact OD2-CD2 3.51Å; D331-N334 PolarHBondContact O-N 2.91Å; D331-N334 PolarHBondContact OD1-N 3.4Å; D331-N334 VanDerWaalsContact OD1-N 3.07Å; D331-L335 PolarHBondContact N-O 3.24Å; D331-L335 PolarHBondContact OD1-N 3.18Å; D331-L337 HydrophobicContact CB-CD2 3.89Å; D331-R350 IonicContact OD2-CZ 2.73Å; D331-R350 IonicContact OD2-NH1 3.31Å; D331-R350 PolarHBondContact OD2-NH1 2.86Å; D331-R350 IonicContact OD2-NH2 2.67Å; D331-R350 PolarHBondContact OD2-NH2 2.68Å
332	L	69.5	Low	84.6	Confident	125 Å²	125	42.1 Å²	42.1	65%	0.654	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-16.3	177.6	-63.7	173.4	0	0	0	113.4
333	H	69.6	Low	84.5	Confident	141 Å²	141	42.3 Å²	42.3	65%	0.653	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97.6	10.1	175.8	-51.3	-79.2	0	0	0	112	D331 L335	D331-H333 PolarHBondContact O-N 2.79Å; D331-H333 VanDerWaalsContact OD1-C 3.26Å; D331-H333 VanDerWaalsContact OD1-CA 3.28Å; D331-H333 WeakPolarHBondContact OD1-CA 3.36Å; D331-H333 WeakPolarHBondContact OD1-CB 3.48Å; D331-H333 PolarHBondContact OD1-N 3.07Å; D331-H333 IonicContact OD2-CD2 3.51Å; H333-L335 HydrophobicContact CB-CD1 4.45Å; H333-L335 HydrophobicContact CB-CG 4.36Å; H333-L335 PolarHBondContact O-N 2.89Å
334	N	70.8	Confident	84.4	Confident	94 Å²	94	44.4 Å²	44.4	50%	0.503	24%	0.243	S	C	.	.			trans	62	21.1	-178.2	-174.5	71.4	0	0	0	114	R330 D331	R330-N334 WeakPolarHBondContact CD-OD1 3.36Å; R330-N334 PolarHBondContact NH1-OD1 2.76Å; D331-N334 PolarHBondContact O-N 2.91Å; D331-N334 PolarHBondContact OD1-N 3.4Å; D331-N334 VanDerWaalsContact OD1-N 3.07Å
335	L	76.1	Confident	84.4	Confident	88 Å²	88	43.1 Å²	43.1	46%	0.461	24%	0.235	S	C	.	.			trans	-80.6	135.7	170.7	-61.5	172.1	0	0	0	110.2	R330 D331 H333	R330-L335 VanDerWaalsContact CA-O 3.26Å; R330-L335 WeakPolarHBondContact CA-O 3.09Å; D331-L335 PolarHBondContact N-O 3.24Å; D331-L335 PolarHBondContact OD1-N 3.18Å; H333-L335 HydrophobicContact CB-CD1 4.45Å; H333-L335 HydrophobicContact CB-CG 4.36Å; H333-L335 PolarHBondContact O-N 2.89Å
336	D	82.5	Confident	84.5	Confident	99 Å²	99	42 Å²	42	53%	0.529	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	141.1	-179.3	-67.4	-56.1	0	0	0	112.8	R330	R330-D336 WeakPolarHBondContact CG-OD1 3.42Å; R330-D336 IonicContact CZ-OD1 2.73Å; R330-D336 IonicContact NE-OD1 3.5Å; R330-D336 PolarHBondContact NE-OD1 3.25Å; R330-D336 IonicContact NH2-OD1 2.84Å; R330-D336 PolarHBondContact NH2-OD1 3.33Å; R330-D336 IonicContact NH2-OD2 3.23Å
337	L	87.1	Confident	84.5	Confident	7 Å²	7	40 Å²	40	4%	0.037	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	163	178.5	55.5	74.4	0	0	0	111	G329 D331 I339 V348 Y349 R350 F391	G329-L337 CarbonylContact C-O 3.35Å; G329-L337 PolarHBondContact N-O 2.92Å; G329-L337 PolarHBondContact O-N 2.96Å; D331-L337 HydrophobicContact CB-CD2 3.89Å; L337-I339 HydrophobicContact CD1-CD1 4.29Å; L337-I339 HydrophobicContact CD1-CG1 3.74Å; L337-V348 HydrophobicContact CB-CG1 4.24Å; L337-V348 HydrophobicContact CD1-CG1 4.11Å; L337-V348 HydrophobicContact CD2-CG1 3.93Å; L337-V348 HydrophobicContact CG-CG1 4.33Å; L337-Y349 WeakPolarHBondContact CA-O 3.37Å; L337-Y349 WeakPolarHBondContact CB-O 3.12Å; L337-R350 HydrophobicContact CB-CG 4.34Å; L337-F391 HydrophobicContact CD2-CD1 4.15Å
338	M	88	Confident	84.4	Confident	60 Å²	60	40 Å²	40	30%	0.296	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	122.3	173.9	-56.7	-60.7	-69	0	0	109.2	L326 H327 V348 Y349	L326-M338 HydrophobicContact CB-CE 3.9Å; L326-M338 HydrophobicContact CD2-CB 4.12Å; H327-M338 CarbonylContact O-C 3.56Å; H327-M338 WeakPolarHBondContact O-CA 3.39Å; M338-V348 CarbonylContact O-C 3.58Å; M338-V348 WeakPolarHBondContact O-CA 3.43Å; M338-Y349 PolarHBondContact N-O 3.16Å; M338-Y349 PolarHBondContact O-N 2.83Å
339	I	90.5	Very high	84.3	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	112.2	172.3	-55.5	-174.2	0	0	0	107.6	H327 L337 I346 A347 V348 F391 M393 L402	H327-I339 PolarHBondContact N-O 3Å; H327-I339 PolarHBondContact O-N 3.15Å; L337-I339 HydrophobicContact CD1-CD1 4.29Å; L337-I339 HydrophobicContact CD1-CG1 3.74Å; I339-I346 HydrophobicContact CG2-CG2 3.55Å; I339-A347 CarbonylContact C-O 3.58Å; I339-A347 WeakPolarHBondContact CA-O 3.46Å; I339-A347 WeakPolarHBondContact CG2-O 3.34Å; I339-V348 HydrophobicContact CG1-CG1 4.44Å; I339-V348 HydrophobicContact CG1-CG2 4.29Å; I339-V348 HydrophobicContact CG2-CG2 4.43Å; I339-F391 HydrophobicContact CD1-CB 3.72Å; I339-F391 HydrophobicContact CD1-CD1 4.1Å; I339-F391 HydrophobicContact CD1-CD2 4.01Å; I339-F391 HydrophobicContact CD1-CG 3.66Å; I339-M393 HydrophobicContact CD1-CE 4.44Å; I339-M393 HydrophobicContact CD1-SD 3.7Å; I339-L402 HydrophobicContact CB-CD1 4Å; I339-L402 HydrophobicContact CB-CD2 4.46Å; I339-L402 HydrophobicContact CD1-CD2 3.8Å; I339-L402 HydrophobicContact CG2-CD1 3.66Å; I339-L402 HydrophobicContact CG2-CD2 4.3Å
340	G	91.1	Very high	84.2	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	139.4	177	0	0	0	0	0	111.5	E325 A347	E325-G340 CarbonylContact O-C 3.57Å; E325-G340 WeakPolarHBondContact O-CA 3.3Å; G340-A347 PolarHBondContact N-O 3.19Å; G340-A347 PolarHBondContact O-N 3.31Å; G340-A347 VanDerWaalsContact O-O 3.05Å
341	I	93.7	Very high	84.1	Confident	0 Å²	0	44 Å²	44	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	131.7	173.9	-45.8	167.9	0	0	0	107.9	V324 E325 W360 L402 C406 H409	V324-I341 WeakPolarHBondContact CA-O 3.32Å; E325-I341 HydrophobicContact CB-CB 4.26Å; E325-I341 PolarHBondContact N-O 2.86Å; E325-I341 PolarHBondContact O-N 3.11Å; I341-W360 HydrophobicContact CG2-CH2 4.04Å; I341-W360 HydrophobicContact CG2-CZ2 3.69Å; I341-L402 HydrophobicContact CD1-CD1 4.05Å; I341-L402 HydrophobicContact CG1-CD1 4.21Å; I341-C406 VanDerWaalsContact CD1-SG 3.53Å; I341-H409 HydrophobicContact CG2-CB 3.79Å; I341-H409 VanDerWaalsContact CG2-CG 3.5Å
342	A	91.2	Very high	84.4	Confident	15 Å²	15	49.8 Å²	49.8	12%	0.124	25%	0.253	C	S	.	.			trans	-134.2	169.4	-178.8	0	0	0	0	0	111.4	V324 A344 G345 W360	V324-A342 HydrophobicContact CG2-CB 4.33Å; A342-A344 PolarHBondContact O-N 2.77Å; A342-G345 PolarHBondContact N-O 3.33Å; A342-G345 PolarHBondContact O-N 3.44Å; A342-W360 PolarHBondContact O-NE1 3.18Å
343	S	91.1	Very high	84.6	Confident	33 Å²	33	45.3 Å²	45.3	23%	0.231	23%	0.229	C	C	.	.	S	Bend	trans	-56.3	-31	173.7	52.2	0	0	0	0	113.7	W360	S343-W360 VanDerWaalsContact O-CD1 3.24Å; S343-W360 PolarHBondContact O-NE1 3.47Å
344	A	87.4	Confident	85.2	Confident	58 Å²	58	39.3 Å²	39.3	48%	0.479	20%	0.203	S	C	.	.	S	Bend	trans	-90.2	-24.6	-179.5	0	0	0	0	0	115.2	A342 F357 W360	A342-A344 PolarHBondContact O-N 2.77Å; A344-F357 HydrophobicContact CB-CZ 3.9Å; A344-W360 PolarHBondContact O-N 3.09Å
345	G	90.6	Very high	85.6	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	169.2	-166.7	-174.8	0	0	0	0	0	114.9	A342 Y358	A342-G345 PolarHBondContact N-O 3.33Å; A342-G345 PolarHBondContact O-N 3.44Å; G345-Y358 CarbonylContact C-O 3.59Å; G345-Y358 VanDerWaalsContact CA-O 3.24Å; G345-Y358 WeakPolarHBondContact CA-O 3.28Å
346	I	92.3	Very high	85.9	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	119.2	172.6	-57	176.6	0	0	0	109	I339 F357 Y358 W360 I363 I366 F373 I375 C406	I339-I346 HydrophobicContact CG2-CG2 3.55Å; I346-F357 CarbonylContact O-C 3.52Å; I346-F357 WeakPolarHBondContact O-CA 3.2Å; I346-Y358 PolarHBondContact N-O 2.99Å; I346-Y358 PolarHBondContact O-N 2.87Å; I346-W360 HydrophobicContact CD1-CH2 3.92Å; I346-W360 HydrophobicContact CD1-CZ3 3.76Å; I346-W360 HydrophobicContact CG1-CE3 4.44Å; I346-W360 HydrophobicContact CG1-CH2 3.44Å; I346-W360 VanDerWaalsContact CG1-CH2 3.44Å; I346-W360 HydrophobicContact CG1-CZ2 4.19Å; I346-W360 HydrophobicContact CG1-CZ3 3.6Å; I346-I363 HydrophobicContact CD1-CD1 3.97Å; I346-I363 HydrophobicContact CG1-CD1 4.17Å; I346-I366 HydrophobicContact CD1-CG2 4.34Å; I346-F373 HydrophobicContact CD1-CE1 4.41Å; I346-F373 HydrophobicContact CD1-CZ 4.33Å; I346-I375 HydrophobicContact CB-CD1 4.37Å; I346-I375 HydrophobicContact CD1-CD1 3.94Å; I346-I375 HydrophobicContact CD1-CG1 4.4Å; I346-I375 HydrophobicContact CG2-CD1 4.12Å; I346-C406 HydrophobicContact CD1-CB 4.12Å; I346-C406 VanDerWaalsContact CD1-SG 3.58Å
347	A	89.9	Confident	86.2	Confident	2 Å²	2	29.1 Å²	29.1	2%	0.017	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	161.6	170	0	0	0	0	0	111.5	I339 G340 Y349 S356 F357	I339-A347 CarbonylContact C-O 3.58Å; I339-A347 WeakPolarHBondContact CA-O 3.46Å; I339-A347 WeakPolarHBondContact CG2-O 3.34Å; G340-A347 PolarHBondContact N-O 3.19Å; G340-A347 PolarHBondContact O-N 3.31Å; G340-A347 VanDerWaalsContact O-O 3.05Å; A347-Y349 HydrophobicContact CB-CD2 4.23Å; A347-Y349 HydrophobicContact CB-CE2 3.4Å; A347-S356 CarbonylContact C-O 3.56Å; A347-S356 VanDerWaalsContact C-O 3.31Å; A347-S356 VanDerWaalsContact CA-O 3.22Å; A347-S356 WeakPolarHBondContact CA-O 3.4Å; A347-F357 HydrophobicContact CB-CD2 4.03Å
348	V	87.6	Confident	86.2	Confident	1 Å²	1	29.1 Å²	29.1	1%	0.006	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	125.5	174.1	-176	0	0	0	0	106.5	L337 M338 I339 T355 S356 Y358 F391	L337-V348 HydrophobicContact CB-CG1 4.24Å; L337-V348 HydrophobicContact CD1-CG1 4.11Å; L337-V348 HydrophobicContact CD2-CG1 3.93Å; L337-V348 HydrophobicContact CG-CG1 4.33Å; M338-V348 CarbonylContact O-C 3.58Å; M338-V348 WeakPolarHBondContact O-CA 3.43Å; I339-V348 HydrophobicContact CG1-CG1 4.44Å; I339-V348 HydrophobicContact CG1-CG2 4.29Å; I339-V348 HydrophobicContact CG2-CG2 4.43Å; V348-T355 VanDerWaalsContact C-OG1 3.28Å; V348-T355 CarbonylContact O-C 3.46Å; V348-T355 WeakPolarHBondContact O-CA 3.5Å; V348-T355 WeakPolarHBondContact O-CB 3.21Å; V348-T355 PolarHBondContact O-N 2.93Å; V348-T355 PolarHBondContact O-OG1 3.26Å; V348-S356 PolarHBondContact N-O 3.07Å; V348-S356 PolarHBondContact O-N 2.91Å; V348-S356 VanDerWaalsContact O-N 3.15Å; V348-Y358 HydrophobicContact CG2-CE2 4.33Å; V348-F391 HydrophobicContact CG1-CE1 4.09Å; V348-F391 HydrophobicContact CG2-CE1 3.84Å; V348-F391 HydrophobicContact CG2-CE2 4.45Å; V348-F391 HydrophobicContact CG2-CZ 3.73Å
349	Y	85.1	Confident	86.2	Confident	13 Å²	13	27 Å²	27	5%	0.051	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	142.3	-176.1	-58.4	-103.4	0	0	0	110.2	F321 V324 L326 L337 M338 A347 I353 C354	F321-Y349 HydrophobicContact CD1-CE1 4.14Å; F321-Y349 AromaticContact CE1-CD1 3.46Å; F321-Y349 HydrophobicContact CE1-CD1 3.46Å; F321-Y349 VanDerWaalsContact CE1-CD1 3.46Å; F321-Y349 HydrophobicContact CE1-CD2 4.1Å; F321-Y349 AromaticContact CE1-CE1 3.27Å; F321-Y349 HydrophobicContact CE1-CE1 3.27Å; F321-Y349 AromaticContact CE1-CE2 3.94Å; F321-Y349 HydrophobicContact CE1-CE2 3.94Å; F321-Y349 AromaticContact CE1-CG 3.89Å; F321-Y349 HydrophobicContact CE1-CG 3.89Å; F321-Y349 AromaticContact CE1-CZ 3.54Å; F321-Y349 HydrophobicContact CE2-CE1 4.37Å; F321-Y349 AromaticContact CZ-CD1 3.4Å; F321-Y349 HydrophobicContact CZ-CD1 3.4Å; F321-Y349 VanDerWaalsContact CZ-CD1 3.4Å; F321-Y349 AromaticContact CZ-CE1 3.41Å; F321-Y349 HydrophobicContact CZ-CE1 3.41Å; F321-Y349 VanDerWaalsContact CZ-CE1 3.41Å; F321-Y349 HydrophobicContact CZ-CG 4.16Å; V324-Y349 HydrophobicContact CG1-CE2 4.01Å; L326-Y349 HydrophobicContact CD2-CD2 3.85Å; L326-Y349 HydrophobicContact CD2-CE2 3.97Å; L337-Y349 WeakPolarHBondContact CA-O 3.37Å; L337-Y349 WeakPolarHBondContact CB-O 3.12Å; M338-Y349 PolarHBondContact N-O 3.16Å; M338-Y349 PolarHBondContact O-N 2.83Å; A347-Y349 HydrophobicContact CB-CD2 4.23Å; A347-Y349 HydrophobicContact CB-CE2 3.4Å; Y349-I353 CarbonylContact C-O 3.58Å; Y349-I353 WeakPolarHBondContact CA-O 3.48Å; Y349-C354 VanDerWaalsContact CD1-CA 3.47Å; Y349-C354 HydrophobicContact CD1-CB 4.04Å; Y349-C354 HydrophobicContact CE1-CB 3.85Å
350	R	81.7	Confident	86.1	Confident	48 Å²	48	27.6 Å²	27.6	18%	0.181	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	124.8	162.8	-68.5	-177.2	-165.7	-118	0.1	107.6	D331 L337 Y352 I353 T355	D331-R350 IonicContact OD2-CZ 2.73Å; D331-R350 IonicContact OD2-NH1 3.31Å; D331-R350 PolarHBondContact OD2-NH1 2.86Å; D331-R350 IonicContact OD2-NH2 2.67Å; D331-R350 PolarHBondContact OD2-NH2 2.68Å; L337-R350 HydrophobicContact CB-CG 4.34Å; R350-Y352 VanDerWaalsContact C-N 3.26Å; R350-Y352 PolarHBondContact O-N 3.28Å; R350-I353 PolarHBondContact N-O 3.09Å; R350-I353 PolarHBondContact O-N 3.17Å; R350-T355 HydrophobicContact CB-CG2 3.87Å; R350-T355 HydrophobicContact CG-CG2 3.65Å
351	K	78.7	Confident	85.8	Confident	127 Å²	127	31.5 Å²	31.5	55%	0.552	17%	0.165	S	C	*	.	T	Hydrogen-bonded Turn	trans	48.4	42.7	-179.1	-52.2	173.8	168.6	-179.3	0	113.6	I353 H691	K351-I353 VanDerWaalsContact C-N 3.33Å; K351-I353 WeakPolarHBondContact O-CD1 3.2Å; K351-I353 PolarHBondContact O-N 2.82Å; K351-H691 HydrophobicContact CB-CB 3.54Å; K351-H691 VanDerWaalsContact CD-C 3.47Å; K351-H691 HydrophobicContact CD-CB 3.77Å; K351-H691 WeakPolarHBondContact CD-O 3.45Å; K351-H691 HydrophobicContact CG-CB 4.3Å; K351-H691 PolarHBondContact NZ-O 3.37Å; K351-H691 PolarHBondContact O-ND1 2.71Å
352	Y	77	Confident	85.4	Confident	135 Å²	135	33 Å²	33	53%	0.529	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	68	10.9	-174.6	-55.1	-77.8	0	0	0	117.9	F321 L326 R350	F321-Y352 HydrophobicContact CE1-CD1 4.38Å; F321-Y352 HydrophobicContact CE2-CD1 4.43Å; F321-Y352 AromaticContact CZ-CD1 3.99Å; F321-Y352 HydrophobicContact CZ-CD1 3.99Å; F321-Y352 HydrophobicContact CZ-CG 4.49Å; F321-Y352 VanDerWaalsContact CZ-O 3.25Å; F321-Y352 WeakPolarHBondContact CZ-O 3.36Å; L326-Y352 HydrophobicContact CD1-CE1 4.33Å; R350-Y352 VanDerWaalsContact C-N 3.26Å; R350-Y352 PolarHBondContact O-N 3.28Å
353	I	74.8	Confident	85.2	Confident	31 Å²	31	32.5 Å²	32.5	16%	0.159	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	131.9	170.6	-67.3	85.5	0	0	0	108.4	Y349 R350 K351 T355 S690 H691	Y349-I353 CarbonylContact C-O 3.58Å; Y349-I353 WeakPolarHBondContact CA-O 3.48Å; R350-I353 PolarHBondContact N-O 3.09Å; R350-I353 PolarHBondContact O-N 3.17Å; K351-I353 VanDerWaalsContact C-N 3.33Å; K351-I353 WeakPolarHBondContact O-CD1 3.2Å; K351-I353 PolarHBondContact O-N 2.82Å; I353-T355 PolarHBondContact O-N 2.94Å; I353-S690 VanDerWaalsContact CD1-CA 3.46Å; I353-H691 HydrophobicContact CD1-CB 4.15Å; I353-H691 VanDerWaalsContact CD1-N 3.32Å
354	C	81.5	Confident	84.9	Confident	15 Å²	15	33.3 Å²	33.3	10%	0.101	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.8	105.8	178.6	-169.6	0	0	0	0	108.1	Y349 N668 R670	Y349-C354 VanDerWaalsContact CD1-CA 3.47Å; Y349-C354 HydrophobicContact CD1-CB 4.04Å; Y349-C354 HydrophobicContact CE1-CB 3.85Å; C354-N668 VanDerWaalsContact O-CB 3.29Å; C354-N668 WeakPolarHBondContact O-CB 3.44Å; C354-N668 VanDerWaalsContact O-O 3.11Å; C354-R670 PolarHBondContact SG-NE 2.89Å; C354-R670 PolarHBondContact SG-NH2 2.85Å
355	T	79.4	Confident	84.9	Confident	15 Å²	15	32.9 Å²	32.9	9%	0.092	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	-129.2	153.7	61.1	0	0	0	0	107.9	V348 R350 I353 N668 G669 R670	V348-T355 VanDerWaalsContact C-OG1 3.28Å; V348-T355 CarbonylContact O-C 3.46Å; V348-T355 WeakPolarHBondContact O-CA 3.5Å; V348-T355 WeakPolarHBondContact O-CB 3.21Å; V348-T355 PolarHBondContact O-N 2.93Å; V348-T355 PolarHBondContact O-OG1 3.26Å; R350-T355 HydrophobicContact CB-CG2 3.87Å; R350-T355 HydrophobicContact CG-CG2 3.65Å; I353-T355 PolarHBondContact O-N 2.94Å; T355-N668 CarbonylContact C-O 3.49Å; T355-N668 WeakPolarHBondContact CA-O 3.5Å; T355-G669 CarbonylContact O-C 3.47Å; T355-R670 PolarHBondContact O-N 3.16Å
356	S	82.1	Confident	84.9	Confident	19 Å²	19	32.9 Å²	32.9	13%	0.133	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-48.8	142.6	-170.6	-54.2	0	0	0	0	116.3	A347 V348 Y358 G669	A347-S356 CarbonylContact C-O 3.56Å; A347-S356 VanDerWaalsContact C-O 3.31Å; A347-S356 VanDerWaalsContact CA-O 3.22Å; A347-S356 WeakPolarHBondContact CA-O 3.4Å; V348-S356 PolarHBondContact N-O 3.07Å; V348-S356 PolarHBondContact O-N 2.91Å; V348-S356 VanDerWaalsContact O-N 3.15Å; S356-Y358 VanDerWaalsContact CB-CZ 3.46Å; S356-Y358 VanDerWaalsContact CB-OH 3.23Å; S356-Y358 WeakPolarHBondContact CB-OH 3.42Å; S356-Y358 PolarHBondContact OG-OH 3.46Å; S356-G669 CarbonylContact C-O 3.59Å; S356-G669 WeakPolarHBondContact CA-O 3.4Å
357	F	88.8	Confident	84.8	Confident	32 Å²	32	33.1 Å²	33.1	14%	0.14	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	134.3	163.3	-178.1	-115.5	0	0	0	110.1	A344 I346 A347 P359 G669 R670 D671	A344-F357 HydrophobicContact CB-CZ 3.9Å; I346-F357 CarbonylContact O-C 3.52Å; I346-F357 WeakPolarHBondContact O-CA 3.2Å; A347-F357 HydrophobicContact CB-CD2 4.03Å; F357-P359 HydrophobicContact CD1-CG 4.09Å; F357-P359 HydrophobicContact CE1-CB 4.28Å; F357-P359 HydrophobicContact CE1-CG 3.76Å; F357-G669 PolarHBondContact N-O 3.28Å; F357-R670 HydrophobicContact CB-CB 4.19Å; F357-R670 HydrophobicContact CB-CG 3.85Å; F357-D671 VanDerWaalsContact O-CB 3.27Å; F357-D671 WeakPolarHBondContact O-CB 3.39Å; F357-D671 PolarHBondContact O-N 3.2Å
358	Y	87.6	Confident	84.8	Confident	8 Å²	8	33.5 Å²	33.5	3%	0.031	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	100.3	-178.7	-55.3	-70.1	0	0	0	108.3	G345 I346 V348 S356 I375 Q377 V389 F391	G345-Y358 CarbonylContact C-O 3.59Å; G345-Y358 VanDerWaalsContact CA-O 3.24Å; G345-Y358 WeakPolarHBondContact CA-O 3.28Å; I346-Y358 PolarHBondContact N-O 2.99Å; I346-Y358 PolarHBondContact O-N 2.87Å; V348-Y358 HydrophobicContact CG2-CE2 4.33Å; S356-Y358 VanDerWaalsContact CB-CZ 3.46Å; S356-Y358 VanDerWaalsContact CB-OH 3.23Å; S356-Y358 WeakPolarHBondContact CB-OH 3.42Å; S356-Y358 PolarHBondContact OG-OH 3.46Å; Y358-I375 HydrophobicContact CD2-CD1 3.62Å; Y358-I375 HydrophobicContact CE2-CD1 4Å; Y358-I375 HydrophobicContact CG-CD1 4.27Å; Y358-Q377 HydrophobicContact CD1-CG 4.41Å; Y358-V389 HydrophobicContact CE1-CG2 4.13Å; Y358-F391 HydrophobicContact CE2-CE2 4.32Å; Y358-F391 AromaticContact CE2-CZ 3.98Å; Y358-F391 HydrophobicContact CE2-CZ 3.98Å
359	P	87.7	Confident	84.7	Confident	15 Å²	15	38.8 Å²	38.8	10%	0.097	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.9	141.9	176.8	-22.6	31.2	0	0	0	111.1	F357 V361 N362 D671	F357-P359 HydrophobicContact CD1-CG 4.09Å; F357-P359 HydrophobicContact CE1-CB 4.28Å; F357-P359 HydrophobicContact CE1-CG 3.76Å; P359-V361 HydrophobicContact CB-CG2 3.91Å; P359-V361 PolarHBondContact O-N 3.25Å; P359-V361 VanDerWaalsContact O-N 3.07Å; P359-N362 PolarHBondContact O-N 3.46Å; P359-D671 HydrophobicContact CG-CB 4.45Å
360	W	89.9	Confident	84.9	Confident	13 Å²	13	47.1 Å²	47.1	5%	0.049	22%	0.215	C	C	.	.	G	3₁₀ helix	trans	-56	-31.3	-179.5	-71.3	126.8	0	0	0	113.4	I341 A342 S343 A344 I346 N362 I363 C406 H409 H410	I341-W360 HydrophobicContact CG2-CH2 4.04Å; I341-W360 HydrophobicContact CG2-CZ2 3.69Å; A342-W360 PolarHBondContact O-NE1 3.18Å; S343-W360 VanDerWaalsContact O-CD1 3.24Å; S343-W360 PolarHBondContact O-NE1 3.47Å; A344-W360 PolarHBondContact O-N 3.09Å; I346-W360 HydrophobicContact CD1-CH2 3.92Å; I346-W360 HydrophobicContact CD1-CZ3 3.76Å; I346-W360 HydrophobicContact CG1-CE3 4.44Å; I346-W360 HydrophobicContact CG1-CH2 3.44Å; I346-W360 VanDerWaalsContact CG1-CH2 3.44Å; I346-W360 HydrophobicContact CG1-CZ2 4.19Å; I346-W360 HydrophobicContact CG1-CZ3 3.6Å; W360-N362 VanDerWaalsContact C-N 3.28Å; W360-N362 PolarHBondContact O-N 2.87Å; W360-I363 HydrophobicContact CE3-CD1 3.94Å; W360-I363 HydrophobicContact CZ3-CD1 4.13Å; W360-I363 PolarHBondContact O-N 3.15Å; W360-C406 HydrophobicContact CH2-CB 3.97Å; W360-C406 WeakPolarHBondContact CH2-O 3.2Å; W360-C406 HydrophobicContact CZ3-CB 4.46Å; W360-H409 HydrophobicContact CH2-CB 4.39Å; W360-H409 HydrophobicContact CZ2-CB 3.69Å; W360-H410 HydrophobicContact CD2-CB 4.15Å; W360-H410 HydrophobicContact CE3-CB 3.88Å; W360-H410 AromaticContact CE3-CD2 3.65Å; W360-H410 HydrophobicContact CH2-CB 4.33Å; W360-H410 HydrophobicContact CZ3-CB 3.96Å
361	V	84.6	Confident	85.2	Confident	82 Å²	82	49.7 Å²	49.7	50%	0.497	23%	0.227	S	C	.	.	G	3₁₀ helix	trans	-66.9	-25.4	176.4	-65.7	0	0	0	0	113.7	P359 R378	P359-V361 HydrophobicContact CB-CG2 3.91Å; P359-V361 PolarHBondContact O-N 3.25Å; P359-V361 VanDerWaalsContact O-N 3.07Å; V361-R378 VanDerWaalsContact O-CD 3.28Å; V361-R378 WeakPolarHBondContact O-CD 3.39Å; V361-R378 PolarHBondContact O-NE 3.39Å
362	N	85.1	Confident	85.6	Confident	30 Å²	30	48.3 Å²	48.3	16%	0.16	22%	0.221	C	C	.	.	G	3₁₀ helix	trans	-91.9	-0.8	-177.7	-70.5	-6.1	0	0	0	112.7	P359 W360 Q377 R378 D671	P359-N362 PolarHBondContact O-N 3.46Å; W360-N362 VanDerWaalsContact C-N 3.28Å; W360-N362 PolarHBondContact O-N 2.87Å; N362-Q377 CarbonylContact O-C 3.57Å; N362-Q377 WeakPolarHBondContact O-CA 3.47Å; N362-R378 PolarHBondContact O-N 3.41Å; N362-D671 PolarHBondContact ND2-OD2 3.45Å
363	I	86.1	Confident	86.3	Confident	6 Å²	6	41.9 Å²	41.9	3%	0.031	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	120.3	-177.2	-57	177.4	0	0	0	110.3	I346 W360 I366 I375 L468	I346-I363 HydrophobicContact CD1-CD1 3.97Å; I346-I363 HydrophobicContact CG1-CD1 4.17Å; W360-I363 HydrophobicContact CE3-CD1 3.94Å; W360-I363 HydrophobicContact CZ3-CD1 4.13Å; W360-I363 PolarHBondContact O-N 3.15Å; I363-I366 HydrophobicContact CG2-CG2 3.89Å; I363-I375 HydrophobicContact CB-CG2 4.44Å; I363-I375 HydrophobicContact CD1-CG2 3.95Å; I363-I375 HydrophobicContact CG1-CG2 3.88Å; I363-I375 HydrophobicContact CG2-CG2 3.83Å; I363-L468 HydrophobicContact CG2-CD1 3.92Å
364	L	84.8	Confident	87	Confident	50 Å²	50	42.4 Å²	42.4	26%	0.262	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	-38	172.1	-75.3	173.4	0	0	0	112.4	H376 R378 E469	L364-H376 PolarHBondContact N-O 2.93Å; L364-R378 HydrophobicContact CD1-CG 4.42Å; L364-R378 HydrophobicContact CD2-CG 3.66Å; L364-R378 HydrophobicContact CG-CB 4.44Å; L364-R378 HydrophobicContact CG-CG 3.65Å; L364-E469 PolarHBondContact O-N 2.75Å
365	K	87.2	Confident	87.4	Confident	48 Å²	48	41.7 Å²	41.7	21%	0.209	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.5	131.6	-159	-179.9	169.8	-178.4	163.6	0	112.4	H376 E469	K365-H376 HydrophobicContact CB-CB 3.96Å; K365-H376 PolarHBondContact N-O 3.45Å; K365-H376 PolarHBondContact O-N 3Å; K365-H376 PolarHBondContact O-ND1 2.88Å; K365-E469 WeakPolarHBondContact CA-O 3.3Å; K365-E469 HydrophobicContact CB-CB 3.81Å; K365-E469 HydrophobicContact CD-CB 3.75Å; K365-E469 HydrophobicContact CD-CG 4.41Å; K365-E469 WeakPolarHBondContact CD-OE2 3.42Å; K365-E469 WeakPolarHBondContact CE-OE2 3.49Å; K365-E469 HydrophobicContact CG-CB 3.55Å; K365-E469 WeakPolarHBondContact CG-O 3.16Å; K365-E469 IonicContact NZ-OE2 2.77Å; K365-E469 PolarHBondContact NZ-OE2 3.22Å
366	I	91.2	Very high	87.8	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	127.6	170.2	55.8	179.2	0	0	0	110.5	I346 I363 F373 F374 I375 W403 C406 V407 L468 E469	I346-I366 HydrophobicContact CD1-CG2 4.34Å; I363-I366 HydrophobicContact CG2-CG2 3.89Å; I366-F373 HydrophobicContact CB-CE2 4.2Å; I366-F373 HydrophobicContact CB-CZ 4.1Å; I366-F373 HydrophobicContact CG2-CZ 4.05Å; I366-F374 WeakPolarHBondContact CA-O 3.35Å; I366-I375 HydrophobicContact CG2-CG1 4.44Å; I366-W403 PolarHBondContact O-NE1 3.06Å; I366-C406 HydrophobicContact CD1-CB 3.44Å; I366-C406 VanDerWaalsContact CD1-CB 3.44Å; I366-V407 HydrophobicContact CD1-CG2 3.62Å; I366-V407 HydrophobicContact CG1-CG2 4.09Å; I366-L468 HydrophobicContact CD1-CD2 3.81Å; I366-L468 HydrophobicContact CG1-CD1 4.47Å; I366-L468 HydrophobicContact CG1-CD2 3.84Å; I366-L468 HydrophobicContact CG1-CG 4.33Å; I366-E469 PolarHBondContact N-O 2.83Å
367	S	89.6	Confident	87.8	Confident	6 Å²	6	42.2 Å²	42.2	4%	0.042	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	169.8	-179.2	77.7	0	0	0	0	111	F373 F374 H376 K471	S367-F373 WeakPolarHBondContact O-CD2 3.21Å; S367-F374 PolarHBondContact N-O 3.05Å; S367-F374 PolarHBondContact O-N 2.93Å; S367-H376 PolarHBondContact OG-CE1 2.83Å; S367-K471 VanDerWaalsContact CB-O 3.27Å; S367-K471 WeakPolarHBondContact CB-O 3.36Å
368	F	89.8	Confident	87.2	Confident	10 Å²	10	45.3 Å²	45.3	4%	0.044	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	152.7	173.9	74.7	-70.6	0	0	0	112	K372 F373 Y396 C399 K400 W403	F368-K372 CarbonylContact C-O 3.59Å; F368-K372 WeakPolarHBondContact CA-O 3.46Å; F368-K372 WeakPolarHBondContact CB-O 3.32Å; F368-F373 HydrophobicContact CB-CD2 4.38Å; F368-Y396 HydrophobicContact CD2-CE2 4.44Å; F368-Y396 HydrophobicContact CE2-CD2 4.07Å; F368-Y396 AromaticContact CE2-CE2 3.55Å; F368-Y396 HydrophobicContact CE2-CE2 3.55Å; F368-Y396 HydrophobicContact CZ-CE2 4.32Å; F368-C399 HydrophobicContact CD2-CB 4.33Å; F368-K400 HydrophobicContact CE2-CB 3.78Å; F368-K400 HydrophobicContact CE2-CG 4.18Å; F368-K400 HydrophobicContact CZ-CB 3.86Å; F368-K400 HydrophobicContact CZ-CD 4.18Å; F368-K400 HydrophobicContact CZ-CG 3.74Å; F368-W403 HydrophobicContact CD1-CB 3.88Å; F368-W403 AromaticContact CD1-CD1 3.88Å; F368-W403 AromaticContact CD1-CD2 3.81Å; F368-W403 HydrophobicContact CD1-CD2 3.81Å; F368-W403 HydrophobicContact CD1-CE3 4.37Å; F368-W403 AromaticContact CD1-CG 3.56Å; F368-W403 HydrophobicContact CD1-CG 3.56Å; F368-W403 HydrophobicContact CE1-CB 4.3Å; F368-W403 AromaticContact CE1-CD2 3.72Å; F368-W403 HydrophobicContact CE1-CD2 3.72Å; F368-W403 AromaticContact CE1-CE3 3.82Å; F368-W403 HydrophobicContact CE1-CE3 3.82Å; F368-W403 AromaticContact CE1-CG 3.95Å; F368-W403 HydrophobicContact CE1-CG 3.95Å; F368-W403 HydrophobicContact CE1-CZ3 4.42Å; F368-W403 HydrophobicContact CG-CB 4.41Å; F368-W403 HydrophobicContact CG-CG 4.48Å
369	K	86.3	Confident	86.2	Confident	112 Å²	112	51.1 Å²	51.1	49%	0.487	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	112.4	178.4	-164.6	177	-175	176.3	0	109.5	K371 K372 F374 L473	K369-K371 PolarHBondContact O-N 3.02Å; K369-K371 VanDerWaalsContact O-N 3.16Å; K369-K372 PolarHBondContact N-O 3.08Å; K369-K372 PolarHBondContact O-N 2.68Å; K369-F374 HydrophobicContact CB-CE2 3.91Å; K369-L473 HydrophobicContact CD-CD1 4.08Å; K369-L473 HydrophobicContact CG-CB 4.5Å
370	R	88.3	Confident	84.7	Confident	188 Å²	188	53.8 Å²	53.8	71%	0.709	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.3	-108.7	-172.5	-58.4	178.9	178.5	172.1	-1.1	111.5	Y396	R370-Y396 WeakPolarHBondContact O-CD2 3.32Å
371	K	88.4	Confident	82.6	Confident	101 Å²	101	63.1 Å²	63.1	44%	0.439	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.4	-12.9	175.6	-66.3	-168	-179.1	-161.3	0	113.6	K369 N392 M393 L394 C399	K369-K371 PolarHBondContact O-N 3.02Å; K369-K371 VanDerWaalsContact O-N 3.16Å; K371-N392 WeakPolarHBondContact CB-OD1 2.95Å; K371-M393 WeakPolarHBondContact CD-O 3.19Å; K371-M393 PolarHBondContact O-N 3.03Å; K371-L394 VanDerWaalsContact CE-O 3.31Å; K371-L394 WeakPolarHBondContact CE-O 3.24Å; K371-L394 PolarHBondContact NZ-O 3.46Å; K371-C399 PolarHBondContact O-SG 3.42Å; K371-C399 VanDerWaalsContact O-SG 3.35Å
372	K	88	Confident	81.1	Confident	98 Å²	98	63.1 Å²	63.1	43%	0.426	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	123.4	-176.2	-64.4	-166.7	176.2	-167.3	0	111.1	F368 K369 F374 F391	F368-K372 CarbonylContact C-O 3.59Å; F368-K372 WeakPolarHBondContact CA-O 3.46Å; F368-K372 WeakPolarHBondContact CB-O 3.32Å; K369-K372 PolarHBondContact N-O 3.08Å; K369-K372 PolarHBondContact O-N 2.68Å; K372-F374 HydrophobicContact CB-CE1 4.4Å; K372-F374 HydrophobicContact CB-CE2 3.64Å; K372-F374 HydrophobicContact CB-CZ 3.56Å; K372-F374 HydrophobicContact CD-CZ 4.15Å; K372-F374 HydrophobicContact CG-CZ 4.49Å; K372-F374 WeakPolarHBondContact O-CE2 3.36Å; K372-F391 CarbonylContact C-O 3.48Å; K372-F391 VanDerWaalsContact CA-O 3.26Å; K372-F391 WeakPolarHBondContact CA-O 3.11Å
373	F	91.1	Very high	79.3	Confident	0 Å²	0	62.3 Å²	62.3	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	143	169.5	179.3	-110.5	0	0	0	109.2	I346 I366 S367 F368 I375 A390 F391 M393 L402 W403	I346-F373 HydrophobicContact CD1-CE1 4.41Å; I346-F373 HydrophobicContact CD1-CZ 4.33Å; I366-F373 HydrophobicContact CB-CE2 4.2Å; I366-F373 HydrophobicContact CB-CZ 4.1Å; I366-F373 HydrophobicContact CG2-CZ 4.05Å; S367-F373 WeakPolarHBondContact O-CD2 3.21Å; F368-F373 HydrophobicContact CB-CD2 4.38Å; F373-I375 HydrophobicContact CD1-CG1 4.25Å; F373-I375 HydrophobicContact CE1-CD1 4.02Å; F373-I375 HydrophobicContact CE1-CG1 3.6Å; F373-I375 HydrophobicContact CZ-CG1 4.28Å; F373-A390 VanDerWaalsContact O-CA 3.32Å; F373-A390 WeakPolarHBondContact O-CA 3.48Å; F373-F391 HydrophobicContact CD1-CD2 4.2Å; F373-F391 PolarHBondContact N-O 2.97Å; F373-F391 PolarHBondContact O-N 2.72Å; F373-M393 HydrophobicContact CB-CG 4.3Å; F373-L402 HydrophobicContact CB-CD2 4.09Å; F373-L402 HydrophobicContact CD1-CD2 3.53Å; F373-L402 HydrophobicContact CD2-CD2 4Å; F373-L402 HydrophobicContact CE1-CD2 3.87Å; F373-L402 HydrophobicContact CE1-CG 4.43Å; F373-L402 HydrophobicContact CE2-CD2 4.3Å; F373-L402 HydrophobicContact CE2-CG 4.44Å; F373-L402 HydrophobicContact CG-CD2 3.61Å; F373-L402 HydrophobicContact CZ-CD2 4.25Å; F373-L402 HydrophobicContact CZ-CG 4.4Å; F373-W403 HydrophobicContact CD2-CB 4.14Å; F373-W403 HydrophobicContact CE2-CB 3.9Å; F373-W403 HydrophobicContact CE2-CG 4.38Å
374	F	90.3	Very high	77.5	Confident	43 Å²	43	66.2 Å²	66.2	19%	0.189	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	131.1	-175.3	-56.7	-91.2	0	0	0	111.6	I366 S367 K369 K372 I388 V389 A390	I366-F374 WeakPolarHBondContact CA-O 3.35Å; S367-F374 PolarHBondContact N-O 3.05Å; S367-F374 PolarHBondContact O-N 2.93Å; K369-F374 HydrophobicContact CB-CE2 3.91Å; K372-F374 HydrophobicContact CB-CE1 4.4Å; K372-F374 HydrophobicContact CB-CE2 3.64Å; K372-F374 HydrophobicContact CB-CZ 3.56Å; K372-F374 HydrophobicContact CD-CZ 4.15Å; K372-F374 HydrophobicContact CG-CZ 4.49Å; K372-F374 WeakPolarHBondContact O-CE2 3.36Å; F374-I388 HydrophobicContact CB-CG2 4.23Å; F374-I388 HydrophobicContact CD1-CG2 4.05Å; F374-V389 CarbonylContact C-O 3.55Å; F374-V389 VanDerWaalsContact CA-O 3.3Å; F374-V389 WeakPolarHBondContact CA-O 3.47Å; F374-A390 HydrophobicContact CD1-CB 3.66Å; F374-A390 HydrophobicContact CE1-CB 3.73Å
375	I	89.9	Confident	75.9	Confident	0 Å²	0	73.1 Å²	73.1	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	123.5	171.2	-52.5	177.9	0	0	0	107.3	I346 Y358 I363 I366 F373 I388 V389 F391	I346-I375 HydrophobicContact CB-CD1 4.37Å; I346-I375 HydrophobicContact CD1-CD1 3.94Å; I346-I375 HydrophobicContact CD1-CG1 4.4Å; I346-I375 HydrophobicContact CG2-CD1 4.12Å; Y358-I375 HydrophobicContact CD2-CD1 3.62Å; Y358-I375 HydrophobicContact CE2-CD1 4Å; Y358-I375 HydrophobicContact CG-CD1 4.27Å; I363-I375 HydrophobicContact CB-CG2 4.44Å; I363-I375 HydrophobicContact CD1-CG2 3.95Å; I363-I375 HydrophobicContact CG1-CG2 3.88Å; I363-I375 HydrophobicContact CG2-CG2 3.83Å; I366-I375 HydrophobicContact CG2-CG1 4.44Å; F373-I375 HydrophobicContact CD1-CG1 4.25Å; F373-I375 HydrophobicContact CE1-CD1 4.02Å; F373-I375 HydrophobicContact CE1-CG1 3.6Å; F373-I375 HydrophobicContact CZ-CG1 4.28Å; I375-I388 CarbonylContact O-C 3.59Å; I375-I388 WeakPolarHBondContact O-CA 3.46Å; I375-V389 PolarHBondContact N-O 3.47Å; I375-V389 PolarHBondContact O-N 2.63Å; I375-F391 HydrophobicContact CD1-CE2 3.91Å; I375-F391 HydrophobicContact CG1-CE2 4.4Å
376	H	87.3	Confident	74.3	Confident	17 Å²	17	76.8 Å²	76.8	8%	0.079	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	125.4	174.4	-38.2	48.7	0	0	0	107	L364 K365 S367 I388	L364-H376 PolarHBondContact N-O 2.93Å; K365-H376 HydrophobicContact CB-CB 3.96Å; K365-H376 PolarHBondContact N-O 3.45Å; K365-H376 PolarHBondContact O-N 3Å; K365-H376 PolarHBondContact O-ND1 2.88Å; S367-H376 PolarHBondContact OG-CE1 2.83Å; H376-I388 HydrophobicContact CB-CG1 4.36Å
377	Q	81.7	Confident	73.3	Confident	28 Å²	28	80.2 Å²	80.2	13%	0.131	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	155.8	-175.4	-69.1	173.3	87.8	0	0	112	Y358 N362 H387	Y358-Q377 HydrophobicContact CD1-CG 4.41Å; N362-Q377 CarbonylContact O-C 3.57Å; N362-Q377 WeakPolarHBondContact O-CA 3.47Å; Q377-H387 HydrophobicContact CB-CB 4.41Å; Q377-H387 PolarHBondContact N-O 3.1Å
378	R	76.2	Confident	73	Confident	97 Å²	97	84.1 Å²	84.1	37%	0.366	39%	0.391	S	S	.	.	P	Polyproline II helix	trans	-62	139.5	170.3	-74.3	-170.8	175.9	-143.2	-10.8	110.4	V361 N362 L364 K380	V361-R378 VanDerWaalsContact O-CD 3.28Å; V361-R378 WeakPolarHBondContact O-CD 3.39Å; V361-R378 PolarHBondContact O-NE 3.39Å; N362-R378 PolarHBondContact O-N 3.41Å; L364-R378 HydrophobicContact CD1-CG 4.42Å; L364-R378 HydrophobicContact CD2-CG 3.66Å; L364-R378 HydrophobicContact CG-CB 4.44Å; L364-R378 HydrophobicContact CG-CG 3.65Å; R378-K380 PolarHBondContact O-N 2.99Å
379	Q	65.8	Low	72.7	Confident	130 Å²	130	85.3 Å²	85.3	61%	0.607	40%	0.399	S	S	*	.	P	Polyproline II helix	trans	-61.4	120.9	172.3	-170.1	178	9.2	0	0	109.4	E383	Q379-E383 VanDerWaalsContact CG-O 3.24Å; Q379-E383 WeakPolarHBondContact CG-O 3.47Å; Q379-E383 PolarHBondContact NE2-O 2.83Å
380	K	57.9	Low	72.7	Confident	70 Å²	70	81.3 Å²	81.3	30%	0.304	39%	0.387	S	S	.	.	P	Polyproline II helix	trans	-76.6	142.7	169.9	-70.6	-176.5	176	-179.5	0	107.9	R378 A382 E383 D671	R378-K380 PolarHBondContact O-N 2.99Å; K380-A382 VanDerWaalsContact C-N 3.26Å; K380-A382 PolarHBondContact O-N 3.08Å; K380-E383 PolarHBondContact O-N 3.05Å; K380-D671 IonicContact NZ-OD1 3.67Å; K380-D671 IonicContact NZ-OD2 3.4Å
381	Q	45.1	Very low	72.6	Confident	209 Å²	209	73 Å²	73	98%	0.977	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	79.8	-176.9	-72.8	-177.7	-17.1	0	0	111.9
382	A	52.1	Low	72.5	Confident	82 Å²	82	70.6 Å²	70.6	68%	0.678	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-179.7	-39	169.6	0	0	0	0	0	110.5	K380	K380-A382 VanDerWaalsContact C-N 3.26Å; K380-A382 PolarHBondContact O-N 3.08Å
383	E	48.5	Very low	72.5	Confident	14 Å²	14	66 Å²	66	7%	0.065	33%	0.328	C	S	.	.			trans	-89.9	140.6	-168.3	-78.3	153.4	164.5	0	0	112.6	Q379 K380 D610 R700	Q379-E383 VanDerWaalsContact CG-O 3.24Å; Q379-E383 WeakPolarHBondContact CG-O 3.47Å; Q379-E383 PolarHBondContact NE2-O 2.83Å; K380-E383 PolarHBondContact O-N 3.05Å; E383-D610 VanDerWaalsContact CG-OD1 3.23Å; E383-D610 WeakPolarHBondContact CG-OD1 3.16Å; E383-R700 IonicContact OE1-CZ 2.68Å; E383-R700 IonicContact OE1-NE 3.45Å; E383-R700 PolarHBondContact OE1-NE 3.13Å; E383-R700 IonicContact OE1-NH2 2.93Å; E383-R700 PolarHBondContact OE1-NH2 3.27Å; E383-R700 IonicContact OE2-CZ 2.62Å; E383-R700 IonicContact OE2-NH2 2.72Å; E383-R700 PolarHBondContact OE2-NH2 3.25Å
384	S	48.2	Very low	72.1	Confident	87 Å²	87	69.8 Å²	69.8	61%	0.608	35%	0.348	S	S	*	.			trans	-88.3	1.9	-173.3	57.8	0	0	0	0	115.9	D610	S384-D610 PolarHBondContact N-OD2 3.23Å; S384-D610 PolarHBondContact OG-OD2 3.28Å
385	R	50.4	Low	71.8	Confident	196 Å²	196	70 Å²	70	74%	0.74	35%	0.351	S	S	*	.	S	Bend	trans	-136.6	148.4	-167.9	-70.5	-179.2	170	177	-2.7	114.8	H387	R385-H387 PolarHBondContact O-N 3.47Å
386	E	55.3	Low	71.7	Confident	125 Å²	125	75.7 Å²	75.7	58%	0.584	37%	0.373	S	S	*	.			trans	-65.9	123.2	171.2	-68.3	-170.4	171.7	0	0	111.7	I388	E386-I388 HydrophobicContact CB-CG1 4.46Å; E386-I388 PolarHBondContact O-N 2.94Å
387	H	70.1	Confident	71.6	Confident	71 Å²	71	80.4 Å²	80.4	33%	0.329	39%	0.39	S	S	.	.			trans	-87.1	100.9	173.5	-85.2	-92	0	0	0	111.8	Q377 R385 L613	Q377-H387 HydrophobicContact CB-CB 4.41Å; Q377-H387 PolarHBondContact N-O 3.1Å; R385-H387 PolarHBondContact O-N 3.47Å; H387-L613 VanDerWaalsContact CE1-CD1 3.46Å; H387-L613 WeakPolarHBondContact CE1-CD1 3.22Å
388	I	81.8	Confident	71.9	Confident	89 Å²	89	79.3 Å²	79.3	46%	0.456	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	118.4	176.8	-49.2	179.4	0	0	0	110.4	F374 I375 H376 E386	F374-I388 HydrophobicContact CB-CG2 4.23Å; F374-I388 HydrophobicContact CD1-CG2 4.05Å; I375-I388 CarbonylContact O-C 3.59Å; I375-I388 WeakPolarHBondContact O-CA 3.46Å; H376-I388 HydrophobicContact CB-CG1 4.36Å; E386-I388 HydrophobicContact CB-CG1 4.46Å; E386-I388 PolarHBondContact O-N 2.94Å
389	V	83.7	Confident	72.5	Confident	34 Å²	34	74.7 Å²	74.7	21%	0.206	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	137.9	173.1	-172.9	0	0	0	0	109.4	Y358 F374 I375 F391	Y358-V389 HydrophobicContact CE1-CG2 4.13Å; F374-V389 CarbonylContact C-O 3.55Å; F374-V389 VanDerWaalsContact CA-O 3.3Å; F374-V389 WeakPolarHBondContact CA-O 3.47Å; I375-V389 PolarHBondContact N-O 3.47Å; I375-V389 PolarHBondContact O-N 2.63Å; V389-F391 HydrophobicContact CB-CE2 4.32Å; V389-F391 HydrophobicContact CG1-CD2 4.4Å; V389-F391 HydrophobicContact CG1-CE1 4.33Å; V389-F391 HydrophobicContact CG1-CE2 3.52Å; V389-F391 HydrophobicContact CG1-CZ 3.46Å; V389-F391 VanDerWaalsContact CG1-CZ 3.46Å
390	A	86	Confident	73.7	Confident	28 Å²	28	72.1 Å²	72.1	23%	0.231	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	134.5	-177.6	0	0	0	0	0	113.1	F373 F374	F373-A390 VanDerWaalsContact O-CA 3.32Å; F373-A390 WeakPolarHBondContact O-CA 3.48Å; F374-A390 HydrophobicContact CD1-CB 3.66Å; F374-A390 HydrophobicContact CE1-CB 3.73Å
391	F	86.2	Confident	75.2	Confident	13 Å²	13	69.5 Å²	69.5	6%	0.057	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	149.7	177.7	-57.2	-83.5	0	0	0	110.8	L337 I339 V348 Y358 K372 F373 I375 V389	L337-F391 HydrophobicContact CD2-CD1 4.15Å; I339-F391 HydrophobicContact CD1-CB 3.72Å; I339-F391 HydrophobicContact CD1-CD1 4.1Å; I339-F391 HydrophobicContact CD1-CD2 4.01Å; I339-F391 HydrophobicContact CD1-CG 3.66Å; V348-F391 HydrophobicContact CG1-CE1 4.09Å; V348-F391 HydrophobicContact CG2-CE1 3.84Å; V348-F391 HydrophobicContact CG2-CE2 4.45Å; V348-F391 HydrophobicContact CG2-CZ 3.73Å; Y358-F391 HydrophobicContact CE2-CE2 4.32Å; Y358-F391 AromaticContact CE2-CZ 3.98Å; Y358-F391 HydrophobicContact CE2-CZ 3.98Å; K372-F391 CarbonylContact C-O 3.48Å; K372-F391 VanDerWaalsContact CA-O 3.26Å; K372-F391 WeakPolarHBondContact CA-O 3.11Å; F373-F391 HydrophobicContact CD1-CD2 4.2Å; F373-F391 PolarHBondContact N-O 2.97Å; F373-F391 PolarHBondContact O-N 2.72Å; I375-F391 HydrophobicContact CD1-CE2 3.91Å; I375-F391 HydrophobicContact CG1-CE2 4.4Å; V389-F391 HydrophobicContact CB-CE2 4.32Å; V389-F391 HydrophobicContact CG1-CD2 4.4Å; V389-F391 HydrophobicContact CG1-CE1 4.33Å; V389-F391 HydrophobicContact CG1-CE2 3.52Å; V389-F391 HydrophobicContact CG1-CZ 3.46Å; V389-F391 VanDerWaalsContact CG1-CZ 3.46Å
392	N	86.6	Confident	77.4	Confident	52 Å²	52	59.6 Å²	59.6	28%	0.278	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	102.6	-177.8	-170.6	38.3	0	0	0	110.6	R330 K371	R330-N392 PolarHBondContact N-O 2.84Å; R330-N392 PolarHBondContact O-N 3.31Å; K371-N392 WeakPolarHBondContact CB-OD1 2.95Å
393	M	87.9	Confident	79.3	Confident	2 Å²	2	57.6 Å²	57.6	1%	0.01	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	154.7	-175.2	-56.6	-55.4	-68.9	0	0	111.9	H327 G328 I339 K371 F373 N395 C399 L402	H327-M393 HydrophobicContact CB-CE 4Å; G328-M393 WeakPolarHBondContact O-CE 3.46Å; I339-M393 HydrophobicContact CD1-CE 4.44Å; I339-M393 HydrophobicContact CD1-SD 3.7Å; K371-M393 WeakPolarHBondContact CD-O 3.19Å; K371-M393 PolarHBondContact O-N 3.03Å; F373-M393 HydrophobicContact CB-CG 4.3Å; M393-N395 VanDerWaalsContact C-N 3.3Å; M393-N395 PolarHBondContact O-N 2.94Å; M393-C399 HydrophobicContact CB-CB 3.78Å; M393-C399 HydrophobicContact CG-CB 3.93Å; M393-L402 HydrophobicContact CE-CB 4.38Å; M393-L402 HydrophobicContact CE-CD2 3.83Å; M393-L402 HydrophobicContact CG-CD2 4.29Å; M393-L402 HydrophobicContact SD-CD2 3.81Å
394	L	83.4	Confident	81.3	Confident	78 Å²	78	58.8 Å²	58.8	41%	0.408	28%	0.278	S	S	.	.	S	Bend	trans	-50.4	-47.6	-176	-61.2	174.8	0	0	0	112.6	K371	K371-L394 VanDerWaalsContact CE-O 3.31Å; K371-L394 WeakPolarHBondContact CE-O 3.24Å; K371-L394 PolarHBondContact NZ-O 3.46Å
395	N	84.7	Confident	83.4	Confident	47 Å²	47	54.9 Å²	54.9	25%	0.251	25%	0.251	S	S	.	.	S	Bend	trans	-145.4	174.4	173.7	76.5	62.7	0	0	0	112.9	D185 M393 R397 S398 C399	D185-N395 PolarHBondContact OD1-ND2 3.44Å; M393-N395 VanDerWaalsContact C-N 3.3Å; M393-N395 PolarHBondContact O-N 2.94Å; N395-R397 VanDerWaalsContact C-N 3.31Å; N395-R397 PolarHBondContact O-N 2.73Å; N395-R397 VanDerWaalsContact OD1-CA 3.28Å; N395-R397 WeakPolarHBondContact OD1-CA 3.24Å; N395-R397 WeakPolarHBondContact OD1-CB 3.31Å; N395-R397 PolarHBondContact OD1-N 3.25Å; N395-S398 PolarHBondContact N-OG 2.76Å; N395-S398 PolarHBondContact ND2-OG 2.78Å; N395-S398 PolarHBondContact O-N 3.48Å; N395-S398 PolarHBondContact OD1-N 2.83Å; N395-S398 VanDerWaalsContact OD1-N 3.11Å; N395-S398 PolarHBondContact OD1-OG 3.38Å; N395-C399 WeakPolarHBondContact O-CB 3.23Å; N395-C399 PolarHBondContact O-N 3.22Å
396	Y	87	Confident	85.5	Confident	121 Å²	121	45.6 Å²	45.6	48%	0.475	22%	0.216	S	C	.	.	H	α-helix	trans	-62.2	-33.9	-179.8	164.6	-91.4	0	0	0	113.2	F368 R370 K400	F368-Y396 HydrophobicContact CD2-CE2 4.44Å; F368-Y396 HydrophobicContact CE2-CD2 4.07Å; F368-Y396 AromaticContact CE2-CE2 3.55Å; F368-Y396 HydrophobicContact CE2-CE2 3.55Å; F368-Y396 HydrophobicContact CZ-CE2 4.32Å; R370-Y396 WeakPolarHBondContact O-CD2 3.32Å; Y396-K400 HydrophobicContact CE1-CD 4.04Å; Y396-K400 VanDerWaalsContact O-CB 3.28Å; Y396-K400 WeakPolarHBondContact O-CB 3.48Å; Y396-K400 PolarHBondContact O-N 3.07Å; Y396-K400 PolarHBondContact OH-NZ 3.19Å
397	R	85.6	Confident	87.2	Confident	116 Å²	116	41.1 Å²	41.1	44%	0.438	20%	0.197	S	C	.	.	H	α-helix	trans	-69.2	-49	177.4	-163.1	-168.8	-64.3	157.1	-13.5	110.2	D182 D185 N395 C399 K400 N401	D182-R397 IonicContact OD2-NH1 3.41Å; D185-R397 VanDerWaalsContact OD2-CD 3.28Å; D185-R397 WeakPolarHBondContact OD2-CD 3.19Å; D185-R397 IonicContact OD2-CZ 2.81Å; D185-R397 IonicContact OD2-NE 3.11Å; D185-R397 IonicContact OD2-NH1 2.7Å; D185-R397 PolarHBondContact OD2-NH1 3.47Å; N395-R397 VanDerWaalsContact C-N 3.31Å; N395-R397 PolarHBondContact O-N 2.73Å; N395-R397 VanDerWaalsContact OD1-CA 3.28Å; N395-R397 WeakPolarHBondContact OD1-CA 3.24Å; N395-R397 WeakPolarHBondContact OD1-CB 3.31Å; N395-R397 PolarHBondContact OD1-N 3.25Å; R397-C399 VanDerWaalsContact C-N 3.29Å; R397-C399 PolarHBondContact O-N 2.77Å; R397-K400 CarbonylContact O-C 3.55Å; R397-K400 WeakPolarHBondContact O-CB 3.4Å; R397-K400 PolarHBondContact O-N 3.29Å; R397-K400 VanDerWaalsContact O-N 3.09Å; R397-N401 WeakPolarHBondContact O-CB 3.33Å; R397-N401 PolarHBondContact O-N 2.9Å; R397-N401 PolarHBondContact O-OD1 2.79Å
398	S	87.2	Confident	88.2	Confident	4 Å²	4	40.3 Å²	40.3	3%	0.028	19%	0.193	C	C	.	.	H	α-helix	trans	-58.1	-42.6	175	-14	0	0	0	0	111.3	D185 N395 K400 N401 L402	D185-S398 PolarHBondContact OD1-OG 2.85Å; N395-S398 PolarHBondContact N-OG 2.76Å; N395-S398 PolarHBondContact ND2-OG 2.78Å; N395-S398 PolarHBondContact O-N 3.48Å; N395-S398 PolarHBondContact OD1-N 2.83Å; N395-S398 VanDerWaalsContact OD1-N 3.11Å; N395-S398 PolarHBondContact OD1-OG 3.38Å; S398-K400 PolarHBondContact O-N 3.48Å; S398-N401 PolarHBondContact O-N 3.4Å; S398-L402 WeakPolarHBondContact O-CB 3.47Å; S398-L402 PolarHBondContact O-N 2.86Å
399	C	89.9	Confident	88.7	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-59.9	-41.8	174.5	-161.7	0	0	0	0	113.3	F368 K371 M393 N395 R397 W403	F368-C399 HydrophobicContact CD2-CB 4.33Å; K371-C399 PolarHBondContact O-SG 3.42Å; K371-C399 VanDerWaalsContact O-SG 3.35Å; M393-C399 HydrophobicContact CB-CB 3.78Å; M393-C399 HydrophobicContact CG-CB 3.93Å; N395-C399 WeakPolarHBondContact O-CB 3.23Å; N395-C399 PolarHBondContact O-N 3.22Å; R397-C399 VanDerWaalsContact C-N 3.29Å; R397-C399 PolarHBondContact O-N 2.77Å; C399-W403 WeakPolarHBondContact O-CB 3.48Å; C399-W403 PolarHBondContact O-N 2.84Å; C399-W403 VanDerWaalsContact O-N 3.1Å
400	K	89.7	Confident	89	Confident	77 Å²	77	35.1 Å²	35.1	34%	0.335	17%	0.165	S	C	.	.	H	α-helix	trans	-71.6	-35.6	176.6	-174.1	172.1	-167.9	166.4	0	112.8	F368 Y396 R397 S398 K404	F368-K400 HydrophobicContact CE2-CB 3.78Å; F368-K400 HydrophobicContact CE2-CG 4.18Å; F368-K400 HydrophobicContact CZ-CB 3.86Å; F368-K400 HydrophobicContact CZ-CD 4.18Å; F368-K400 HydrophobicContact CZ-CG 3.74Å; Y396-K400 HydrophobicContact CE1-CD 4.04Å; Y396-K400 VanDerWaalsContact O-CB 3.28Å; Y396-K400 WeakPolarHBondContact O-CB 3.48Å; Y396-K400 PolarHBondContact O-N 3.07Å; Y396-K400 PolarHBondContact OH-NZ 3.19Å; R397-K400 CarbonylContact O-C 3.55Å; R397-K400 WeakPolarHBondContact O-CB 3.4Å; R397-K400 PolarHBondContact O-N 3.29Å; R397-K400 VanDerWaalsContact O-N 3.09Å; S398-K400 PolarHBondContact O-N 3.48Å; K400-K404 WeakPolarHBondContact O-CG 3.38Å; K400-K404 PolarHBondContact O-N 3.14Å; K400-K404 VanDerWaalsContact O-N 3.09Å
401	N	89.1	Confident	89.2	Confident	15 Å²	15	37.1 Å²	37.1	8%	0.08	18%	0.177	C	C	.	.	H	α-helix	trans	-64.8	-53.7	176.2	-66.6	-8	0	0	0	109.6	S186 R397 S398 W403 K404 S405	S186-N401 PolarHBondContact OG-ND2 2.88Å; S186-N401 VanDerWaalsContact OG-ND2 3.12Å; R397-N401 WeakPolarHBondContact O-CB 3.33Å; R397-N401 PolarHBondContact O-N 2.9Å; R397-N401 PolarHBondContact O-OD1 2.79Å; S398-N401 PolarHBondContact O-N 3.4Å; N401-W403 VanDerWaalsContact C-N 3.33Å; N401-W403 PolarHBondContact O-N 3.29Å; N401-K404 WeakPolarHBondContact O-CB 3.32Å; N401-K404 PolarHBondContact O-N 2.9Å; N401-K404 VanDerWaalsContact O-N 3.11Å; N401-S405 PolarHBondContact O-N 2.87Å; N401-S405 PolarHBondContact O-OG 2.94Å
402	L	91.5	Very high	89.4	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-50.4	-52.3	173.9	175.3	74.9	0	0	0	111.3	H327 I339 I341 F373 M393 S398 K404 S405 C406	H327-L402 HydrophobicContact CB-CD1 3.91Å; I339-L402 HydrophobicContact CB-CD1 4Å; I339-L402 HydrophobicContact CB-CD2 4.46Å; I339-L402 HydrophobicContact CD1-CD2 3.8Å; I339-L402 HydrophobicContact CG2-CD1 3.66Å; I339-L402 HydrophobicContact CG2-CD2 4.3Å; I341-L402 HydrophobicContact CD1-CD1 4.05Å; I341-L402 HydrophobicContact CG1-CD1 4.21Å; F373-L402 HydrophobicContact CB-CD2 4.09Å; F373-L402 HydrophobicContact CD1-CD2 3.53Å; F373-L402 HydrophobicContact CD2-CD2 4Å; F373-L402 HydrophobicContact CE1-CD2 3.87Å; F373-L402 HydrophobicContact CE1-CG 4.43Å; F373-L402 HydrophobicContact CE2-CD2 4.3Å; F373-L402 HydrophobicContact CE2-CG 4.44Å; F373-L402 HydrophobicContact CG-CD2 3.61Å; F373-L402 HydrophobicContact CZ-CD2 4.25Å; F373-L402 HydrophobicContact CZ-CG 4.4Å; M393-L402 HydrophobicContact CE-CB 4.38Å; M393-L402 HydrophobicContact CE-CD2 3.83Å; M393-L402 HydrophobicContact CG-CD2 4.29Å; M393-L402 HydrophobicContact SD-CD2 3.81Å; S398-L402 WeakPolarHBondContact O-CB 3.47Å; S398-L402 PolarHBondContact O-N 2.86Å; L402-K404 VanDerWaalsContact C-N 3.3Å; L402-K404 PolarHBondContact O-N 2.8Å; L402-S405 PolarHBondContact O-N 2.84Å; L402-C406 WeakPolarHBondContact O-CB 3.3Å; L402-C406 PolarHBondContact O-N 2.68Å; L402-C406 PolarHBondContact O-SG 2.75Å
403	W	92.9	Very high	89.4	Confident	41 Å²	41	36.7 Å²	36.7	16%	0.155	17%	0.173	C	C	.	.	H	α-helix	trans	-57.7	-41.5	-179.5	174.1	83.7	0	0	0	112.5	I366 F368 F373 C399 N401 V407	I366-W403 PolarHBondContact O-NE1 3.06Å; F368-W403 HydrophobicContact CD1-CB 3.88Å; F368-W403 AromaticContact CD1-CD1 3.88Å; F368-W403 AromaticContact CD1-CD2 3.81Å; F368-W403 HydrophobicContact CD1-CD2 3.81Å; F368-W403 HydrophobicContact CD1-CE3 4.37Å; F368-W403 AromaticContact CD1-CG 3.56Å; F368-W403 HydrophobicContact CD1-CG 3.56Å; F368-W403 HydrophobicContact CE1-CB 4.3Å; F368-W403 AromaticContact CE1-CD2 3.72Å; F368-W403 HydrophobicContact CE1-CD2 3.72Å; F368-W403 AromaticContact CE1-CE3 3.82Å; F368-W403 HydrophobicContact CE1-CE3 3.82Å; F368-W403 AromaticContact CE1-CG 3.95Å; F368-W403 HydrophobicContact CE1-CG 3.95Å; F368-W403 HydrophobicContact CE1-CZ3 4.42Å; F368-W403 HydrophobicContact CG-CB 4.41Å; F368-W403 HydrophobicContact CG-CG 4.48Å; F373-W403 HydrophobicContact CD2-CB 4.14Å; F373-W403 HydrophobicContact CE2-CB 3.9Å; F373-W403 HydrophobicContact CE2-CG 4.38Å; C399-W403 WeakPolarHBondContact O-CB 3.48Å; C399-W403 PolarHBondContact O-N 2.84Å; C399-W403 VanDerWaalsContact O-N 3.1Å; N401-W403 VanDerWaalsContact C-N 3.33Å; N401-W403 PolarHBondContact O-N 3.29Å; W403-V407 HydrophobicContact CZ2-CG2 4.39Å; W403-V407 WeakPolarHBondContact O-CG2 3.49Å; W403-V407 PolarHBondContact O-N 3.45Å; W403-V407 VanDerWaalsContact O-N 3.14Å
404	K	91	Very high	89.1	Confident	39 Å²	39	39.5 Å²	39.5	17%	0.17	19%	0.186	C	C	.	.	H	α-helix	trans	-64.7	-52.8	173.5	-71.9	-171.2	-152.4	168	0	112.2	E191 K400 N401 L402 C406 V407 E408	E191-K404 IonicContact OE1-NZ 3.44Å; E191-K404 PolarHBondContact OE1-NZ 3.46Å; E191-K404 WeakPolarHBondContact OE2-CE 3.47Å; E191-K404 IonicContact OE2-NZ 3.4Å; E191-K404 PolarHBondContact OE2-NZ 2.87Å; K400-K404 WeakPolarHBondContact O-CG 3.38Å; K400-K404 PolarHBondContact O-N 3.14Å; K400-K404 VanDerWaalsContact O-N 3.09Å; N401-K404 WeakPolarHBondContact O-CB 3.32Å; N401-K404 PolarHBondContact O-N 2.9Å; N401-K404 VanDerWaalsContact O-N 3.11Å; L402-K404 VanDerWaalsContact C-N 3.3Å; L402-K404 PolarHBondContact O-N 2.8Å; K404-C406 PolarHBondContact O-N 2.83Å; K404-C406 VanDerWaalsContact O-N 3.16Å; K404-V407 CarbonylContact O-C 3.57Å; K404-V407 WeakPolarHBondContact O-CA 3.39Å; K404-V407 WeakPolarHBondContact O-CB 3.37Å; K404-V407 PolarHBondContact O-N 2.9Å; K404-E408 WeakPolarHBondContact O-CB 3.43Å; K404-E408 WeakPolarHBondContact O-CG 3.21Å; K404-E408 PolarHBondContact O-N 2.85Å
405	S	92.1	Very high	88.3	Confident	5 Å²	5	38.4 Å²	38.4	4%	0.035	19%	0.188	C	C	.	.	H	α-helix	trans	-57	-34.8	-177.2	-68	0	0	0	0	111.4	R213 E325 N401 L402 H409	R213-S405 PolarHBondContact NH2-OG 2.99Å; E325-S405 VanDerWaalsContact OE1-CB 3.23Å; E325-S405 WeakPolarHBondContact OE1-CB 3.49Å; E325-S405 PolarHBondContact OE1-OG 3.1Å; E325-S405 WeakPolarHBondContact OE2-CB 3.26Å; E325-S405 PolarHBondContact OE2-OG 2.95Å; N401-S405 PolarHBondContact O-N 2.87Å; N401-S405 PolarHBondContact O-OG 2.94Å; L402-S405 PolarHBondContact O-N 2.84Å; S405-H409 WeakPolarHBondContact O-CB 3.43Å; S405-H409 PolarHBondContact O-N 3.03Å; S405-H409 PolarHBondContact O-ND1 3.28Å
406	C	93.2	Very high	87	Confident	0 Å²	0	40 Å²	40	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-68.4	-42.6	172.8	-67.9	0	0	0	0	113.2	I341 I346 W360 I366 L402 K404 H410	I341-C406 VanDerWaalsContact CD1-SG 3.53Å; I346-C406 HydrophobicContact CD1-CB 4.12Å; I346-C406 VanDerWaalsContact CD1-SG 3.58Å; W360-C406 HydrophobicContact CH2-CB 3.97Å; W360-C406 WeakPolarHBondContact CH2-O 3.2Å; W360-C406 HydrophobicContact CZ3-CB 4.46Å; I366-C406 HydrophobicContact CD1-CB 3.44Å; I366-C406 VanDerWaalsContact CD1-CB 3.44Å; L402-C406 WeakPolarHBondContact O-CB 3.3Å; L402-C406 PolarHBondContact O-N 2.68Å; L402-C406 PolarHBondContact O-SG 2.75Å; K404-C406 PolarHBondContact O-N 2.83Å; K404-C406 VanDerWaalsContact O-N 3.16Å; C406-H410 VanDerWaalsContact O-CB 3.28Å; C406-H410 WeakPolarHBondContact O-CB 3.2Å; C406-H410 PolarHBondContact O-N 3.09Å
407	V	91.6	Very high	85.3	Confident	31 Å²	31	42.2 Å²	42.2	19%	0.188	21%	0.205	C	C	.	.	H	α-helix	trans	-62.8	-45.8	173.9	172.5	0	0	0	0	110.6	I366 W403 K404 H410 S411 T470	I366-V407 HydrophobicContact CD1-CG2 3.62Å; I366-V407 HydrophobicContact CG1-CG2 4.09Å; W403-V407 HydrophobicContact CZ2-CG2 4.39Å; W403-V407 WeakPolarHBondContact O-CG2 3.49Å; W403-V407 PolarHBondContact O-N 3.45Å; W403-V407 VanDerWaalsContact O-N 3.14Å; K404-V407 CarbonylContact O-C 3.57Å; K404-V407 WeakPolarHBondContact O-CA 3.39Å; K404-V407 WeakPolarHBondContact O-CB 3.37Å; K404-V407 PolarHBondContact O-N 2.9Å; V407-H410 PolarHBondContact O-N 3.42Å; V407-S411 VanDerWaalsContact O-CB 3.31Å; V407-S411 WeakPolarHBondContact O-CB 3.15Å; V407-S411 PolarHBondContact O-N 2.9Å; V407-S411 PolarHBondContact O-OG 2.8Å; V407-T470 HydrophobicContact CG1-CG2 4.16Å; V407-T470 HydrophobicContact CG2-CG2 3.58Å
408	E	90.8	Very high	83	Confident	54 Å²	54	43 Å²	43	25%	0.252	22%	0.217	S	C	.	.	H	α-helix	trans	-58.1	-53	178.6	-73.3	164.5	-162.6	0	0	111.4	R213 K404 S411 F412	R213-E408 IonicContact CZ-OE2 3.3Å; R213-E408 IonicContact NE-OE2 2.72Å; R213-E408 IonicContact NH2-OE2 2.92Å; R213-E408 PolarHBondContact NH2-OE2 2.79Å; K404-E408 WeakPolarHBondContact O-CB 3.43Å; K404-E408 WeakPolarHBondContact O-CG 3.21Å; K404-E408 PolarHBondContact O-N 2.85Å; E408-S411 PolarHBondContact O-N 3.1Å; E408-F412 WeakPolarHBondContact O-CB 3.49Å; E408-F412 PolarHBondContact O-N 3.3Å
409	H	92.1	Very high	80.3	Confident	4 Å²	4	49 Å²	49	2%	0.019	25%	0.248	C	C	.	.	H	α-helix	trans	-59.3	-50.3	176.2	-84.1	79.7	0	0	0	112.6	R213 E325 I341 W360 S405 S411 F412 F413	R213-H409 PolarHBondContact NH1-CE1 3.34Å; E325-H409 IonicContact OE2-CE1 3.55Å; E325-H409 PolarHBondContact OE2-CE1 2.9Å; E325-H409 VanDerWaalsContact OE2-CE1 3.31Å; E325-H409 IonicContact OE2-ND1 3.68Å; I341-H409 HydrophobicContact CG2-CB 3.79Å; I341-H409 VanDerWaalsContact CG2-CG 3.5Å; W360-H409 HydrophobicContact CH2-CB 4.39Å; W360-H409 HydrophobicContact CZ2-CB 3.69Å; S405-H409 WeakPolarHBondContact O-CB 3.43Å; S405-H409 PolarHBondContact O-N 3.03Å; S405-H409 PolarHBondContact O-ND1 3.28Å; H409-S411 VanDerWaalsContact C-N 3.31Å; H409-S411 PolarHBondContact O-N 3.47Å; H409-F412 PolarHBondContact O-N 2.84Å; H409-F413 HydrophobicContact CB-CD2 4.5Å; H409-F413 AromaticContact CD2-CE2 3.81Å; H409-F413 WeakPolarHBondContact O-CD2 3.49Å; H409-F413 PolarHBondContact O-N 3.39Å
410	H	90.7	Very high	77.3	Confident	11 Å²	11	54 Å²	54	5%	0.051	28%	0.28	C	S	.	.	H	α-helix	trans	-59.3	-44.2	179.2	178.8	-63.3	0	0	0	111.2	W360 C406 V407 Q414 L468	W360-H410 HydrophobicContact CD2-CB 4.15Å; W360-H410 HydrophobicContact CE3-CB 3.88Å; W360-H410 AromaticContact CE3-CD2 3.65Å; W360-H410 HydrophobicContact CH2-CB 4.33Å; W360-H410 HydrophobicContact CZ3-CB 3.96Å; C406-H410 VanDerWaalsContact O-CB 3.28Å; C406-H410 WeakPolarHBondContact O-CB 3.2Å; C406-H410 PolarHBondContact O-N 3.09Å; V407-H410 PolarHBondContact O-N 3.42Å; H410-Q414 PolarHBondContact CE1-NE2 2.84Å; H410-Q414 VanDerWaalsContact CE1-NE2 3.25Å; H410-Q414 PolarHBondContact CE1-OE1 2.64Å; H410-Q414 PolarHBondContact NE2-NE2 3.46Å; H410-Q414 WeakPolarHBondContact O-CB 3.3Å; H410-Q414 WeakPolarHBondContact O-CG 3.49Å; H410-Q414 PolarHBondContact O-N 3.18Å; H410-L468 HydrophobicContact CB-CD2 4.02Å
411	S	89.5	Confident	74.5	Confident	70 Å²	70	59 Å²	59	49%	0.49	31%	0.305	S	S	.	.	H	α-helix	trans	-61.1	-44.6	175.9	-73.8	0	0	0	0	111.8	V407 E408 H409 A415	V407-S411 VanDerWaalsContact O-CB 3.31Å; V407-S411 WeakPolarHBondContact O-CB 3.15Å; V407-S411 PolarHBondContact O-N 2.9Å; V407-S411 PolarHBondContact O-OG 2.8Å; E408-S411 PolarHBondContact O-N 3.1Å; H409-S411 VanDerWaalsContact C-N 3.31Å; H409-S411 PolarHBondContact O-N 3.47Å; S411-A415 WeakPolarHBondContact O-CB 3.37Å; S411-A415 PolarHBondContact O-N 2.84Å
412	F	90.5	Very high	71.6	Confident	25 Å²	25	66.1 Å²	66.1	11%	0.11	34%	0.338	C	S	.	.	H	α-helix	trans	-62.9	-56.3	179.5	-172.5	-93.9	0	0	0	112.4	E173 Y174 Y214 E408 H409 Q414 A415 K416	E173-F412 HydrophobicContact CB-CE2 4.04Å; E173-F412 HydrophobicContact CG-CE2 3.66Å; E173-F412 HydrophobicContact CG-CZ 3.99Å; Y174-F412 HydrophobicContact CD1-CE1 4.31Å; Y174-F412 AromaticContact CD1-CZ 3.64Å; Y174-F412 HydrophobicContact CD1-CZ 3.64Å; Y174-F412 HydrophobicContact CE1-CE1 4.31Å; Y174-F412 AromaticContact CE1-CZ 3.74Å; Y174-F412 HydrophobicContact CE1-CZ 3.74Å; Y214-F412 HydrophobicContact CD1-CB 4.15Å; Y214-F412 HydrophobicContact CD1-CD1 4.12Å; Y214-F412 HydrophobicContact CD1-CG 4.02Å; Y214-F412 HydrophobicContact CD2-CB 4.48Å; Y214-F412 HydrophobicContact CD2-CD1 4.02Å; Y214-F412 AromaticContact CD2-CD2 3.44Å; Y214-F412 HydrophobicContact CD2-CD2 3.44Å; Y214-F412 VanDerWaalsContact CD2-CD2 3.44Å; Y214-F412 HydrophobicContact CD2-CE1 4.06Å; Y214-F412 AromaticContact CD2-CE2 3.47Å; Y214-F412 HydrophobicContact CD2-CE2 3.47Å; Y214-F412 VanDerWaalsContact CD2-CE2 3.47Å; Y214-F412 AromaticContact CD2-CG 3.73Å; Y214-F412 HydrophobicContact CD2-CG 3.73Å; Y214-F412 AromaticContact CD2-CZ 3.8Å; Y214-F412 HydrophobicContact CD2-CZ 3.8Å; Y214-F412 HydrophobicContact CE1-CB 3.93Å; Y214-F412 HydrophobicContact CE1-CG 4.16Å; Y214-F412 HydrophobicContact CE2-CB 4.28Å; Y214-F412 AromaticContact CE2-CD2 3.44Å; Y214-F412 HydrophobicContact CE2-CD2 3.44Å; Y214-F412 VanDerWaalsContact CE2-CD2 3.44Å; Y214-F412 AromaticContact CE2-CE2 3.84Å; Y214-F412 HydrophobicContact CE2-CE2 3.84Å; Y214-F412 AromaticContact CE2-CG 3.88Å; Y214-F412 HydrophobicContact CE2-CG 3.88Å; Y214-F412 HydrophobicContact CG-CB 4.41Å; Y214-F412 AromaticContact CG-CD1 3.74Å; Y214-F412 HydrophobicContact CG-CD1 3.74Å; Y214-F412 HydrophobicContact CG-CD2 4.01Å; Y214-F412 AromaticContact CG-CE1 3.92Å; Y214-F412 HydrophobicContact CG-CE1 3.92Å; Y214-F412 HydrophobicContact CG-CE2 4.17Å; Y214-F412 AromaticContact CG-CG 3.79Å; Y214-F412 HydrophobicContact CG-CG 3.79Å; Y214-F412 HydrophobicContact CG-CZ 4.13Å; E408-F412 WeakPolarHBondContact O-CB 3.49Å; E408-F412 PolarHBondContact O-N 3.3Å; H409-F412 PolarHBondContact O-N 2.84Å; F412-Q414 PolarHBondContact O-N 3.3Å; F412-A415 PolarHBondContact O-N 2.89Å; F412-K416 PolarHBondContact O-N 3.03Å
413	F	87.8	Confident	68.6	Low	30 Å²	30	75.8 Å²	75.8	13%	0.132	38%	0.38	C	S	.	.	H	α-helix	trans	-75.8	-18.6	-173.6	-70.5	-73.1	0	0	0	114	Y214 F215 H409	Y214-F413 HydrophobicContact CD1-CE2 4.1Å; Y214-F413 HydrophobicContact CG-CE2 4.49Å; F215-F413 VanDerWaalsContact O-CZ 3.3Å; F215-F413 WeakPolarHBondContact O-CZ 3.33Å; H409-F413 HydrophobicContact CB-CD2 4.5Å; H409-F413 AromaticContact CD2-CE2 3.81Å; H409-F413 WeakPolarHBondContact O-CD2 3.49Å; H409-F413 PolarHBondContact O-N 3.39Å
414	Q	79.9	Confident	65.5	Low	61 Å²	61	79.8 Å²	79.8	29%	0.285	40%	0.404	S	S	.	.	H	α-helix	trans	-86.8	-31.7	166	-67	-161.8	1.4	0	0	113.4	H410 F412 K416 K417 L418	H410-Q414 PolarHBondContact CE1-NE2 2.84Å; H410-Q414 VanDerWaalsContact CE1-NE2 3.25Å; H410-Q414 PolarHBondContact CE1-OE1 2.64Å; H410-Q414 PolarHBondContact NE2-NE2 3.46Å; H410-Q414 WeakPolarHBondContact O-CB 3.3Å; H410-Q414 WeakPolarHBondContact O-CG 3.49Å; H410-Q414 PolarHBondContact O-N 3.18Å; F412-Q414 PolarHBondContact O-N 3.3Å; Q414-K416 PolarHBondContact O-N 3.39Å; Q414-K417 WeakPolarHBondContact O-CB 3.31Å; Q414-K417 PolarHBondContact O-N 2.85Å; Q414-K417 VanDerWaalsContact O-N 3.11Å; Q414-L418 PolarHBondContact O-N 3.37Å
415	A	67	Low	62.5	Low	55 Å²	55	84.2 Å²	84.2	46%	0.455	43%	0.434	S	S	.	.	H	α-helix	trans	-62.9	-40.8	175.9	0	0	0	0	0	112.2	S411 F412 K417 L418 L419	S411-A415 WeakPolarHBondContact O-CB 3.37Å; S411-A415 PolarHBondContact O-N 2.84Å; F412-A415 PolarHBondContact O-N 2.89Å; A415-K417 PolarHBondContact O-N 3.06Å; A415-L418 PolarHBondContact O-N 3.05Å; A415-L419 PolarHBondContact O-N 3.48Å
416	K	57.6	Low	59.5	Low	81 Å²	81	92.1 Å²	92.1	35%	0.352	48%	0.475	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-18.2	174.8	-66.7	-149.9	175.7	-156.9	0	113.9	E173 Y174 F412 Q414 L418	E173-K416 WeakPolarHBondContact OE1-CE 3.48Å; E173-K416 IonicContact OE1-NZ 2.67Å; E173-K416 PolarHBondContact OE1-NZ 3.36Å; Y174-K416 VanDerWaalsContact CZ-NZ 3.34Å; Y174-K416 PolarHBondContact OH-NZ 3Å; F412-K416 PolarHBondContact O-N 3.03Å; Q414-K416 PolarHBondContact O-N 3.39Å; K416-L418 VanDerWaalsContact C-N 3.29Å
417	K	52.2	Low	56.5	Low	168 Å²	168	97.6 Å²	97.6	73%	0.73	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.8	-8.5	167.7	-69	-170.2	177.9	-168.9	0	114	Q414 A415	Q414-K417 WeakPolarHBondContact O-CB 3.31Å; Q414-K417 PolarHBondContact O-N 2.85Å; Q414-K417 VanDerWaalsContact O-N 3.11Å; A415-K417 PolarHBondContact O-N 3.06Å
418	L	37.6	Very low	53.7	Low	132 Å²	132	105 Å²	105	69%	0.691	55%	0.546	S	S	*	.	S	Bend	trans	-109.6	-1	-177.4	-67.7	171.5	0	0	0	113.6	Q414 A415 K416 P420	Q414-L418 PolarHBondContact O-N 3.37Å; A415-L418 PolarHBondContact O-N 3.05Å; K416-L418 VanDerWaalsContact C-N 3.29Å; L418-P420 VanDerWaalsContact O-CD 3.24Å; L418-P420 WeakPolarHBondContact O-CD 3.42Å
419	L	28.9	Very low	50.8	Low	131 Å²	131	113.3 Å²	113.3	69%	0.686	58%	0.576	S	S	*	*			trans	-69.6	115.1	167.9	-96.6	162.2	0	0	0	109.3	A415	A415-L419 PolarHBondContact O-N 3.48Å
420	P	28.4	Very low	47.8	Very low	103 Å²	103	124.8 Å²	124.8	67%	0.669	62%	0.62	S	S	*	*			trans	-72.1	140.8	168.8	-7.7	26.2	0	0	0	108.7	L418 E422	L418-P420 VanDerWaalsContact O-CD 3.24Å; L418-P420 WeakPolarHBondContact O-CD 3.42Å; P420-E422 PolarHBondContact O-N 3.19Å
421	Q	29.4	Very low	45.1	Very low	183 Å²	183	130.1 Å²	130.1	86%	0.855	65%	0.653	S	S	*	*			trans	-55.5	133.9	149.9	-76.2	179.4	-39.7	0	0	107.8	K423	Q421-K423 PolarHBondContact O-N 2.96Å
422	E	29.1	Very low	42.4	Very low	165 Å²	165	135.3 Å²	135.3	77%	0.771	68%	0.675	S	S	*	*			trans	-60.9	111.1	-175.8	-71.4	-162.5	98.8	0	0	111.4	P420 N424	P420-E422 PolarHBondContact O-N 3.19Å; E422-N424 HydrophobicContact CB-CB 4.37Å; E422-N424 PolarHBondContact O-N 3Å; E422-N424 PolarHBondContact OE1-ND2 3.33Å
423	K	27.9	Very low	39.5	Very low	202 Å²	202	137.8 Å²	137.8	88%	0.878	71%	0.707	S	S	*	*			trans	-76.9	63.3	169.3	-71.8	-170.1	169.7	-168.6	0	110.6	Q421	Q421-K423 PolarHBondContact O-N 2.96Å
424	N	27.4	Very low	36.8	Very low	126 Å²	126	141.8 Å²	141.8	67%	0.674	74%	0.739	S	S	*	*			trans	-118.3	25	-176.8	-87.1	-27.3	0	0	0	114	E422	E422-N424 HydrophobicContact CB-CB 4.37Å; E422-N424 PolarHBondContact O-N 3Å; E422-N424 PolarHBondContact OE1-ND2 3.33Å
425	V	28.7	Very low	34.7	Very low	132 Å²	132	149.3 Å²	149.3	80%	0.8	76%	0.764	S	S	*	*	S	Bend	trans	-136.3	152.9	157.1	-165.9	0	0	0	0	108.3
426	L	29.4	Very low	33.1	Very low	171 Å²	171	153.7 Å²	153.7	90%	0.895	78%	0.78	S	S	*	*	S	Bend	trans	74.1	50.4	-179.4	-55.5	173.7	0	0	0	117
427	S	30.5	Very low	32	Very low	114 Å²	114	155.7 Å²	155.7	80%	0.797	80%	0.801	S	S	*	*	S	Bend	trans	-151.9	33.4	158.1	-169.6	0	0	0	0	114.6
428	Q	31.9	Very low	31.1	Very low	186 Å²	186	157.2 Å²	157.2	87%	0.869	81%	0.808	S	S	*	*			trans	-161.1	73.7	175.9	-120.5	160.9	75.8	0	0	112.4
429	Y	30.3	Very low	30.9	Very low	229 Å²	229	160.4 Å²	160.4	90%	0.898	82%	0.816	S	S	*	*			trans	-145.4	71	171.7	-105.1	-77	0	0	0	112
430	W	29.2	Very low	31	Very low	245 Å²	245	159.5 Å²	159.5	93%	0.928	82%	0.821	S	S	*	*			trans	-143.7	150.8	157.6	-83.8	108	0	0	0	109.3
431	T	34.9	Very low	31.3	Very low	123 Å²	123	160.7 Å²	160.7	76%	0.755	83%	0.826	S	S	*	*	S	Bend	trans	62.7	93.5	175.1	36.9	0	0	0	0	119.5
432	L	32.2	Very low	31.3	Very low	180 Å²	180	157.7 Å²	157.7	94%	0.942	82%	0.816	S	S	*	*			trans	56.5	129.5	130.3	-85.5	64.7	0	0	0	122
433	G	29.8	Very low	31.4	Very low	76 Å²	76	157.2 Å²	157.2	78%	0.784	82%	0.819	S	S	*	*			trans	121.2	77.5	159.5	0	0	0	0	0	114.7
434	S	31.6	Very low	31.5	Very low	114 Å²	114	154.5 Å²	154.5	80%	0.797	81%	0.809	S	S	*	*				93.5	130.9	73.1	-170.9	0	0	0	0	114.7
435	R	34.4	Very low	31.5	Very low	219 Å²	219	158.5 Å²	158.5	83%	0.826	82%	0.816	S	S	*	*			trans	81	93.1	170	-69	179.7	171.3	-176.5	-3.2	121.5
436	N	33.2	Very low	31.3	Very low	148 Å²	148	157.6 Å²	157.6	79%	0.791	81%	0.814	S	S	*	*				76.6	113.4	122.5	-61	1.1	0	0	0	122.1
437	P	34.8	Very low	31.1	Very low	122 Å²	122	159.1 Å²	159.1	79%	0.792	81%	0.814	S	S	*	*			trans	-102.3	169.6	166.5	39.7	-34.1	0	0	0	114.1
438	K	33.5	Very low	30.9	Very low	201 Å²	201	162.6 Å²	162.6	87%	0.874	82%	0.815	S	S	*	*			trans	-170.3	145.1	159	-113	161.7	-173.5	177.6	0	114.4
439	K	34.7	Very low	30.7	Very low	198 Å²	198	160 Å²	160	86%	0.861	81%	0.811	S	S	*	*			trans	71.5	123.9	178.1	-51.8	179.4	-178.3	-177.2	0	113.6
440	S	31	Very low	30.6	Very low	112 Å²	112	155.3 Å²	155.3	78%	0.783	80%	0.8	S	S	*	*			cis	74.6	131.6	42	-153	0	0	0	0	111.7
441	V	33.6	Very low	30.5	Very low	128 Å²	128	146.2 Å²	146.2	78%	0.776	78%	0.783	S	S	*	*			cis	-145.6	144.4	45.9	169.6	0	0	0	0	114.7
442	N	29.2	Very low	30.2	Very low	121 Å²	121	143.3 Å²	143.3	65%	0.647	78%	0.778	S	S	*	*			trans	5.8	132.2	152.9	-163.6	29.4	0	0	0	122
443	N	30.8	Very low	30	Very low	155 Å²	155	140.9 Å²	140.9	83%	0.829	76%	0.763	S	S	*	*				-157.6	139.1	125.2	-134.6	2.9	0	0	0	112.2
444	Q	30.3	Very low	29.9	Very low	145 Å²	145	143.5 Å²	143.5	68%	0.678	76%	0.764	S	S	*	*			trans	-98.8	159.7	171.4	-65.7	172	-64.1	0	0	110.2
445	Y	27.2	Very low	29.8	Very low	210 Å²	210	148.3 Å²	148.3	82%	0.824	76%	0.764	S	S	*	*				178.4	151.2	115.1	-102.8	-74.7	0	0	0	112.7
446	C	24.5	Very low	29.5	Very low	112 Å²	112	143.7 Å²	143.7	76%	0.757	76%	0.756	S	S	*	*			trans	37.9	97.6	163.8	-67.2	0	0	0	0	119.9
447	K	25	Very low	29.5	Very low	203 Å²	203	142.6 Å²	142.6	88%	0.883	76%	0.757	S	S	*	*			trans	-66.1	141.1	136	-67.5	179.6	178.7	179.4	0	108.4
448	K	28.1	Very low	29.1	Very low	187 Å²	187	142.2 Å²	142.2	81%	0.813	75%	0.752	S	S	*	*			trans	-129.8	130.8	157.8	-143.6	-177.8	-175.9	-168.8	0	107.1
449	V	26.9	Very low	28.9	Very low	132 Å²	132	140.7 Å²	140.7	80%	0.8	75%	0.75	S	S	*	*			trans	-113.6	125.7	-177.7	-179.8	0	0	0	0	107.3
450	I	28.7	Very low	28.7	Very low	130 Å²	130	142 Å²	142	67%	0.667	75%	0.75	S	S	*	*			trans	-135.7	144.8	173.8	-62.7	-179.5	0	0	0	106.7	G452	I450-G452 PolarHBondContact O-N 3.31Å
451	G	26.7	Very low	28.4	Very low	54 Å²	54	149 Å²	149	56%	0.557	76%	0.759	S	S	*	*			trans	-70	117.9	-166.2	0	0	0	0	0	113.8
452	G	28.7	Very low	28.1	Very low	63 Å²	63	148.2 Å²	148.2	65%	0.649	76%	0.759	S	S	*	*			trans	-123.7	125.3	166.3	0	0	0	0	0	110.3	I450 V454	I450-G452 PolarHBondContact O-N 3.31Å; G452-V454 PolarHBondContact O-N 3.46Å
453	M	27.8	Very low	28	Very low	128 Å²	128	150.4 Å²	150.4	63%	0.631	77%	0.77	S	S	*	*			trans	-64.2	103.5	176.3	-68.3	-167.5	91.9	0	0	110.4	W455 V919	M453-W455 PolarHBondContact O-N 2.92Å; M453-V919 HydrophobicContact CE-CG2 3.78Å; M453-V919 HydrophobicContact SD-CG2 3.59Å; M453-V919 VanDerWaalsContact SD-CG2 3.59Å
454	V	28.3	Very low	27.9	Very low	132 Å²	132	146.2 Å²	146.2	80%	0.8	75%	0.753	S	S	*	*			trans	-63.7	107.3	178.3	178.6	0	0	0	0	110	G452 N456	G452-V454 PolarHBondContact O-N 3.46Å; V454-N456 VanDerWaalsContact C-N 3.25Å; V454-N456 PolarHBondContact O-N 3.37Å
455	W	29	Very low	27.9	Very low	214 Å²	214	146.4 Å²	146.4	81%	0.811	76%	0.764	S	S	*	*			trans	-64.4	83.1	167.9	-73.8	92.5	0	0	0	110.1	M453 P457	M453-W455 PolarHBondContact O-N 2.92Å; W455-P457 WeakPolarHBondContact O-CD 3.5Å; W455-P457 VanDerWaalsContact O-CG 3.31Å; W455-P457 WeakPolarHBondContact O-CG 3.37Å
456	N	28.4	Very low	28.3	Very low	123 Å²	123	141.9 Å²	141.9	66%	0.658	75%	0.75	S	S	*	*			trans	-71.1	107.6	179.8	-172.5	-14.8	0	0	0	110.5	V454 V458	V454-N456 VanDerWaalsContact C-N 3.25Å; V454-N456 PolarHBondContact O-N 3.37Å; N456-V458 PolarHBondContact O-N 3.47Å; N456-V458 VanDerWaalsContact O-N 3.16Å; N456-V458 PolarHBondContact OD1-N 3.42Å
457	P	31.6	Very low	29.5	Very low	124 Å²	124	147.9 Å²	147.9	81%	0.805	76%	0.757	S	S	*	*			trans	-82.7	9.7	-169.8	-10.8	30.3	0	0	0	114	W455	W455-P457 WeakPolarHBondContact O-CD 3.5Å; W455-P457 VanDerWaalsContact O-CG 3.31Å; W455-P457 WeakPolarHBondContact O-CG 3.37Å
458	V	26.5	Very low	30.6	Very low	115 Å²	115	139 Å²	139	70%	0.697	72%	0.719	S	S	*	*			trans	-109.1	78.6	-160.1	-167.7	0	0	0	0	112.7	N456	N456-V458 PolarHBondContact O-N 3.47Å; N456-V458 VanDerWaalsContact O-N 3.16Å; N456-V458 PolarHBondContact OD1-N 3.42Å
459	M	29.2	Very low	31.7	Very low	169 Å²	169	133.5 Å²	133.5	83%	0.833	70%	0.696	S	S	*	*			trans	-125.2	100.8	164	-85.1	-82.2	-174.2	0	0	111.7
460	R	30.8	Very low	33	Very low	225 Å²	225	130.3 Å²	130.3	85%	0.849	68%	0.677	S	S	*	*			trans	53.6	96	149.5	-58	-172	-178.8	-160.2	-0.7	119.2	S462	R460-S462 PolarHBondContact O-N 2.84Å
461	R	25.7	Very low	33.7	Very low	258 Å²	258	129.5 Å²	129.5	97%	0.974	67%	0.669	S	S	*	*			trans	-10	116.9	148.2	-64.3	171.2	173.3	163.3	-3.9	116.4
462	S	27	Very low	34.4	Very low	113 Å²	113	130.3 Å²	130.3	79%	0.79	67%	0.666	S	S	*	*			trans	-151	152	139.2	-164.5	0	0	0	0	110.7	R460	R460-S462 PolarHBondContact O-N 2.84Å
463	L	26.2	Very low	34.7	Very low	167 Å²	167	131.6 Å²	131.6	87%	0.874	66%	0.658	S	S	*	*	S	Bend	trans	-44.8	141.8	-176.7	-50.8	162.4	0	0	0	112.7
464	S	29.9	Very low	34.9	Very low	66 Å²	66	130.3 Å²	130.3	46%	0.462	66%	0.659	S	S	.	*			cis	-144.9	162.4	19.6	59.1	0	0	0	0	113.1	E466	S464-E466 PolarHBondContact O-N 3.28Å
465	V	28.9	Very low	35.3	Very low	149 Å²	149	128.8 Å²	128.8	90%	0.903	65%	0.654	S	S	*	*			trans	-91.9	87.3	176.8	-175.9	0	0	0	0	110.3
466	E	36.4	Very low	35.3	Very low	115 Å²	115	129 Å²	129	54%	0.537	65%	0.654	S	S	.	*			trans	-108.1	127.8	177.3	-72.9	-169.8	143.7	0	0	112.9	S464	S464-E466 PolarHBondContact O-N 3.28Å
467	R	49.5	Very low	35.4	Very low	238 Å²	238	128.3 Å²	128.3	90%	0.898	66%	0.659	S	S	*	*			trans	-80.5	125.3	177.3	-168.5	-177.6	-163.1	166.2	5.3	108.8	E469	R467-E469 PolarHBondContact O-N 2.89Å
468	L	49.1	Very low	35.4	Very low	18 Å²	18	128 Å²	128	9%	0.094	66%	0.658	C	S	.	*			trans	-42	122.6	177.8	-176.9	75.7	0	0	0	111.9	I363 I366 H410 T470	I363-L468 HydrophobicContact CG2-CD1 3.92Å; I366-L468 HydrophobicContact CD1-CD2 3.81Å; I366-L468 HydrophobicContact CG1-CD1 4.47Å; I366-L468 HydrophobicContact CG1-CD2 3.84Å; I366-L468 HydrophobicContact CG1-CG 4.33Å; H410-L468 HydrophobicContact CB-CD2 4.02Å; L468-T470 HydrophobicContact CD2-CG2 4.11Å; L468-T470 HydrophobicContact CG-CG2 4.27Å; L468-T470 PolarHBondContact O-N 3.42Å
469	E	51.4	Low	35.5	Very low	70 Å²	70	127.9 Å²	127.9	33%	0.327	66%	0.659	S	S	.	*	B	Isolated β-bridge	trans	-72.4	121.7	176.8	-84.7	-130.5	134.2	0	0	110.7	L364 K365 I366 R467 K471	L364-E469 PolarHBondContact O-N 2.75Å; K365-E469 WeakPolarHBondContact CA-O 3.3Å; K365-E469 HydrophobicContact CB-CB 3.81Å; K365-E469 HydrophobicContact CD-CB 3.75Å; K365-E469 HydrophobicContact CD-CG 4.41Å; K365-E469 WeakPolarHBondContact CD-OE2 3.42Å; K365-E469 WeakPolarHBondContact CE-OE2 3.49Å; K365-E469 HydrophobicContact CG-CB 3.55Å; K365-E469 WeakPolarHBondContact CG-O 3.16Å; K365-E469 IonicContact NZ-OE2 2.77Å; K365-E469 PolarHBondContact NZ-OE2 3.22Å; I366-E469 PolarHBondContact N-O 2.83Å; R467-E469 PolarHBondContact O-N 2.89Å; E469-K471 VanDerWaalsContact CD-NZ 3.34Å; E469-K471 VanDerWaalsContact OE1-CE 3.26Å; E469-K471 WeakPolarHBondContact OE1-CE 3.17Å; E469-K471 IonicContact OE1-NZ 3.77Å; E469-K471 PolarHBondContact OE1-NZ 3.39Å; E469-K471 IonicContact OE2-NZ 3.57Å; E469-K471 PolarHBondContact OE2-NZ 3.2Å
470	T	53.2	Low	35.7	Very low	66 Å²	66	127.3 Å²	127.3	41%	0.405	66%	0.658	S	S	.	*			trans	-119.7	67.2	-177.7	61.8	0	0	0	0	111.8	V407 L468	V407-T470 HydrophobicContact CG1-CG2 4.16Å; V407-T470 HydrophobicContact CG2-CG2 3.58Å; L468-T470 HydrophobicContact CD2-CG2 4.11Å; L468-T470 HydrophobicContact CG-CG2 4.27Å; L468-T470 PolarHBondContact O-N 3.42Å
471	K	43.1	Very low	35.7	Very low	112 Å²	112	123.1 Å²	123.1	49%	0.487	66%	0.657	S	S	.	*			trans	-99.7	107.3	-178.5	-73	171.4	177.7	158.8	0	111.8	S367 E469	S367-K471 VanDerWaalsContact CB-O 3.27Å; S367-K471 WeakPolarHBondContact CB-O 3.36Å; E469-K471 VanDerWaalsContact CD-NZ 3.34Å; E469-K471 VanDerWaalsContact OE1-CE 3.26Å; E469-K471 WeakPolarHBondContact OE1-CE 3.17Å; E469-K471 IonicContact OE1-NZ 3.77Å; E469-K471 PolarHBondContact OE1-NZ 3.39Å; E469-K471 IonicContact OE2-NZ 3.57Å; E469-K471 PolarHBondContact OE2-NZ 3.2Å
472	S	41.2	Very low	36.1	Very low	72 Å²	72	116.7 Å²	116.7	50%	0.503	65%	0.649	S	S	.	*	P	Polyproline II helix	trans	-78.6	116.3	168.3	63	0	0	0	0	110.4
473	L	36.4	Very low	36.2	Very low	90 Å²	90	118.5 Å²	118.5	47%	0.471	65%	0.65	S	S	.	*	P	Polyproline II helix	trans	-72.4	132.7	-177.1	-67.9	175.9	0	0	0	111.6	K369	K369-L473 HydrophobicContact CD-CD1 4.08Å; K369-L473 HydrophobicContact CG-CB 4.5Å
474	P	31.3	Very low	36.5	Very low	101 Å²	101	122.8 Å²	122.8	66%	0.656	66%	0.655	S	S	*	*	P	Polyproline II helix	trans	-54.7	142.8	174.6	-27.6	35.7	0	0	0	113	R476	P474-R476 VanDerWaalsContact C-N 3.29Å; P474-R476 PolarHBondContact O-N 3.42Å
475	S	36.4	Very low	36.6	Very low	100 Å²	100	130.3 Å²	130.3	70%	0.699	67%	0.673	S	S	*	*	S	Bend	trans	-84	-1	-178.1	56.9	0	0	0	0	114.4
476	R	29.6	Very low	36.6	Very low	217 Å²	217	127.9 Å²	127.9	82%	0.819	66%	0.663	S	S	*	*	S	Bend	trans	-131.3	139.7	177.8	-70.6	178	171.3	-94.3	-1.3	109.5	P474	P474-R476 VanDerWaalsContact C-N 3.29Å; P474-R476 PolarHBondContact O-N 3.42Å
477	S	29.9	Very low	36.6	Very low	109 Å²	109	128.6 Å²	128.6	76%	0.762	68%	0.677	S	S	*	*	P	Polyproline II helix	trans	-63.8	151.5	168.9	-44.3	0	0	0	0	110.8
478	P	31	Very low	35.8	Very low	119 Å²	119	128.4 Å²	128.4	77%	0.773	68%	0.676	S	S	*	*	P	Polyproline II helix	trans	-58.7	145.4	163	-19.1	32.4	0	0	0	110.7
479	P	30.1	Very low	35.2	Very low	111 Å²	111	135.8 Å²	135.8	72%	0.721	72%	0.715	S	S	*	*	P	Polyproline II helix	trans	-75.9	171.6	166.5	34.2	-34.7	0	0	0	111.3
480	I	31.8	Very low	34.2	Very low	158 Å²	158	142.1 Å²	142.1	81%	0.81	74%	0.736	S	S	*	*			trans	85.2	92.7	175.6	-48.3	160.2	0	0	0	115.1
481	T	32.8	Very low	33.3	Very low	136 Å²	136	145.3 Å²	145.3	83%	0.834	75%	0.746	S	S	*	*				-168.3	157.8	115.5	32.3	0	0	0	0	110.1
482	P	32.2	Very low	32.8	Very low	124 Å²	124	147.4 Å²	147.4	81%	0.805	76%	0.757	S	S	*	*			trans	-109.7	168.4	-163.6	10.5	13.1	0	0	0	116.3
483	N	30.2	Very low	32.6	Very low	151 Å²	151	150.8 Å²	150.8	81%	0.807	77%	0.768	S	S	*	*			trans	-74.7	149	-179	-72.3	-26.1	0	0	0	115.4
484	W	32.9	Very low	32.3	Very low	257 Å²	257	158 Å²	158	97%	0.973	79%	0.789	S	S	*	*			trans	-140	173.4	148.2	-80.4	103.8	0	0	0	110.5
485	R	30.9	Very low	32.6	Very low	224 Å²	224	162.6 Å²	162.6	85%	0.845	80%	0.799	S	S	*	*			trans	-136.6	151	-155.1	-88.2	-170	178.4	-87.6	9.5	116.9
486	S	30.5	Very low	32.6	Very low	98 Å²	98	163.9 Å²	163.9	69%	0.685	81%	0.805	S	S	*	*			trans	72	165.9	141	-72	0	0	0	0	120.3
487	P	35.7	Very low	32.8	Very low	129 Å²	129	163.9 Å²	163.9	84%	0.838	81%	0.805	S	S	*	*			cis	-134.9	-167	-26.3	33.3	-11.5	0	0	0	115.4
488	R	32.2	Very low	33.1	Very low	235 Å²	235	166 Å²	166	89%	0.887	80%	0.802	S	S	*	*			trans	-94.4	165.5	-170.7	-60.7	168.5	164.8	148.3	-8.4	116.4
489	L	36.1	Very low	33.4	Very low	173 Å²	173	165 Å²	165	91%	0.906	80%	0.799	S	S	*	*			trans	-150.8	-173.3	149.4	-107.8	170.1	0	0	0	112.7
490	R	31.6	Very low	33.9	Very low	202 Å²	202	165.1 Å²	165.1	76%	0.762	80%	0.802	S	S	*	*			trans	-128	-168.8	-163.1	-45.9	-177.1	-175.8	177	1.7	113.5
491	H	34.8	Very low	34	Very low	134 Å²	134	161.2 Å²	161.2	62%	0.62	79%	0.793	S	S	*	*			cis	-167.3	141.9	13.4	-130.1	-32.8	0	0	0	114.6
492	E	32.3	Very low	34.3	Very low	155 Å²	155	161.6 Å²	161.6	72%	0.724	79%	0.79	S	S	*	*			trans	70.3	165.8	137.6	-84.8	-73.3	173.2	0	0	127
493	I	35.5	Very low	34.4	Very low	143 Å²	143	161.8 Å²	161.8	73%	0.733	79%	0.785	S	S	*	*			trans	96.4	86.8	158.6	-42.3	-167.4	0	0	0	122.4
494	R	30.9	Very low	34.6	Very low	241 Å²	241	162.2 Å²	162.2	91%	0.909	79%	0.786	S	S	*	*			trans	65.3	173	130.4	-71.6	-176	171.2	175.9	-2.7	125.3
495	K	36.9	Very low	34.6	Very low	199 Å²	199	153.7 Å²	153.7	87%	0.865	77%	0.77	S	S	*	*			trans	-135.2	177.4	-158.2	-63.8	171.8	173.1	166.1	0	110.2
496	P	36.9	Very low	34.7	Very low	127 Å²	127	150.4 Å²	150.4	83%	0.825	77%	0.769	S	S	*	*				-156.4	-161.2	64.6	43.2	-17.9	0	0	0	119.5
497	R	34.5	Very low	34.9	Very low	217 Å²	217	154.1 Å²	154.1	82%	0.819	78%	0.776	S	S	*	*			trans	-74.9	-175	-166.1	-75.5	172.1	166.3	149.2	-9.4	116.1
498	H	35.8	Very low	34.5	Very low	152 Å²	152	156.1 Å²	156.1	70%	0.704	78%	0.776	S	S	*	*			cis	-156.7	144.6	41	-77.2	-96.9	0	0	0	111.9
499	S	38.1	Very low	34.3	Very low	100 Å²	100	149.9 Å²	149.9	70%	0.699	76%	0.764	S	S	*	*				57.4	145.6	80.1	86	0	0	0	0	115.8
500	S	38.9	Very low	34.1	Very low	113 Å²	113	152.6 Å²	152.6	79%	0.79	76%	0.764	S	S	*	*			cis	-147.3	-155.7	14.6	-48.4	0	0	0	0	110
501	A	35.2	Very low	33.9	Very low	76 Å²	76	149.8 Å²	149.8	63%	0.628	76%	0.763	S	S	*	*			cis	-164.3	-175.4	-4.7	0	0	0	0	0	111.3
502	D	37.9	Very low	33.7	Very low	144 Å²	144	150.4 Å²	150.4	77%	0.77	78%	0.776	S	S	*	*			trans	71	151.2	147.9	-61.7	-39.3	0	0	0	125
503	N	34.2	Very low	33.5	Very low	128 Å²	128	151.3 Å²	151.3	68%	0.684	78%	0.78	S	S	*	*			cis	-172.6	162.3	-41.3	-125.4	-41.8	0	0	0	114.8
504	L	35.7	Very low	33.1	Very low	160 Å²	160	150.4 Å²	150.4	84%	0.838	78%	0.781	S	S	*	*			trans	65.7	158.6	158.8	-60.8	163.8	0	0	0	120.5
505	A	33	Very low	33	Very low	77 Å²	77	147.1 Å²	147.1	64%	0.636	78%	0.776	S	S	*	*			cis	-169.8	152.5	-26.9	0	0	0	0	0	115.2
506	N	32.2	Very low	32.4	Very low	156 Å²	156	144 Å²	144	83%	0.834	77%	0.769	S	S	*	*			trans	57	165	143.1	-77.9	14.4	0	0	0	126.9
507	E	34.6	Very low	32	Very low	176 Å²	176	143.7 Å²	143.7	82%	0.822	77%	0.765	S	S	*	*			trans	81.5	144.4	164.5	-69	-172.7	-164.8	0	0	120.1
508	M	28.1	Very low	31.4	Very low	170 Å²	170	141.4 Å²	141.4	84%	0.837	76%	0.761	S	S	*	*			cis	-158.1	175.7	-32.5	-137.7	172.4	-173.5	0	0	111.7
509	T	28.1	Very low	31.2	Very low	105 Å²	105	144.8 Å²	144.8	64%	0.644	77%	0.769	S	S	*	*			trans	-54	153.6	-178	46.3	0	0	0	0	117.7
510	Y	30.3	Very low	30.5	Very low	229 Å²	229	145 Å²	145	90%	0.898	77%	0.766	S	S	*	*				-161.3	163.3	118.2	-109.1	-72.3	0	0	0	112.8
511	I	29.3	Very low	29.9	Very low	144 Å²	144	151.1 Å²	151.1	74%	0.738	77%	0.774	S	S	*	*			trans	-126.8	140.4	-176.3	-63.2	163.6	0	0	0	109
512	T	28.6	Very low	29.6	Very low	146 Å²	146	156.5 Å²	156.5	90%	0.896	78%	0.783	S	S	*	*			trans	-158.1	168.1	148.2	10.4	0	0	0	0	111.5
513	E	29.1	Very low	29.2	Very low	175 Å²	175	153.6 Å²	153.6	82%	0.818	79%	0.787	S	S	*	*			trans	-112.3	-162.7	-164.9	-58.5	169	121.2	0	0	112.4
514	T	26.4	Very low	28.9	Very low	123 Å²	123	153 Å²	153	76%	0.755	79%	0.793	S	S	*	*			trans	71.7	150.4	178.3	88.2	0	0	0	0	116.2
515	E	28.4	Very low	28.7	Very low	172 Å²	172	153.9 Å²	153.9	80%	0.804	80%	0.798	S	S	*	*			cis	-145.3	177.4	5.4	-144.7	146.4	-108.3	0	0	112.1
516	D	26.2	Very low	28.4	Very low	133 Å²	133	155.5 Å²	155.5	71%	0.711	80%	0.804	S	S	*	*			trans	-74.2	163.8	-167.8	-68.4	-84.1	0	0	0	116.8
517	V	27	Very low	28.6	Very low	122 Å²	122	152.8 Å²	152.8	74%	0.739	80%	0.795	S	S	*	*				-166.8	118.5	107.7	154.9	0	0	0	0	108.6	Y519	V517-Y519 HydrophobicContact CG1-CD2 4.06Å; V517-Y519 HydrophobicContact CG1-CE2 4.22Å
518	F	23.2	Very low	28.6	Very low	168 Å²	168	152.5 Å²	152.5	74%	0.737	79%	0.791	S	S	*	*			trans	-93.9	146.4	165.6	-92.6	-99.4	0	0	0	110.3	T520	F518-T520 HydrophobicContact CD1-CG2 4.09Å
519	Y	29.9	Very low	29.1	Very low	223 Å²	223	148.7 Å²	148.7	88%	0.875	77%	0.774	S	S	*	*			trans	-131.7	121.3	148.4	-90.6	-78.9	0	0	0	110.3	V517	V517-Y519 HydrophobicContact CG1-CD2 4.06Å; V517-Y519 HydrophobicContact CG1-CE2 4.22Å
520	T	24.6	Very low	29.4	Very low	104 Å²	104	148.5 Å²	148.5	64%	0.638	78%	0.777	S	S	*	*			trans	-105.4	120.4	-176.7	50.5	0	0	0	0	111.3	F518	F518-T520 HydrophobicContact CD1-CG2 4.09Å
521	Y	26.5	Very low	29.7	Very low	242 Å²	242	143.9 Å²	143.9	95%	0.949	77%	0.768	S	S	*	*			trans	-83	111.1	156.1	-99.1	-93.4	0	0	0	109.5
522	K	28.7	Very low	29.9	Very low	190 Å²	190	142 Å²	142	83%	0.826	77%	0.768	S	S	*	*			trans	-131.7	101.5	164.6	-89.2	-168.8	174.5	-178.4	0	109
523	G	29.5	Very low	30.2	Very low	82 Å²	82	143.7 Å²	143.7	85%	0.845	77%	0.766	S	S	*	*			trans	-62.9	135.4	160.3	0	0	0	0	0	109.5
524	S	27.3	Very low	30.5	Very low	117 Å²	117	141.2 Å²	141.2	82%	0.818	76%	0.762	S	S	*	*			trans	-96.9	135.5	179.3	51.6	0	0	0	0	110.9
525	L	31.2	Very low	30.8	Very low	178 Å²	178	139.9 Å²	139.9	93%	0.932	76%	0.758	S	S	*	*			trans	-122.3	119.8	163.9	-81.1	170.6	0	0	0	108.3
526	S	27.9	Very low	31.2	Very low	110 Å²	110	139.8 Å²	139.8	77%	0.769	76%	0.757	S	S	*	*			trans	-87.2	164	177.3	72.5	0	0	0	0	111.8
527	P	35.7	Very low	31.5	Very low	99 Å²	99	139.3 Å²	139.3	64%	0.643	76%	0.755	S	S	*	*			trans	-136.8	140.3	137.9	34.8	-22.3	0	0	0	113.8
528	K	35.2	Very low	31.9	Very low	170 Å²	170	141.4 Å²	141.4	74%	0.739	76%	0.756	S	S	*	*			trans	-57.4	155.6	171.6	-64.9	-178.2	175.7	-179	0	111.7	R75	R75-K528 PolarHBondContact NH1-O 2.76Å
529	D	37.6	Very low	32.4	Very low	90 Å²	90	138.4 Å²	138.4	48%	0.481	76%	0.756	S	S	.	*				-156.4	136.2	62.7	-68.2	-53.9	0	0	0	108.5	K73 R75	K73-D529 IonicContact NZ-OD1 3.59Å; K73-D529 PolarHBondContact NZ-OD1 3.36Å; K73-D529 IonicContact NZ-OD2 3.73Å; K73-D529 PolarHBondContact NZ-OD2 3.07Å; R75-D529 IonicContact NH1-OD2 3.78Å
530	S	35.2	Very low	32.9	Very low	102 Å²	102	133.4 Å²	133.4	71%	0.713	75%	0.751	S	S	*	*				60	135.5	109.5	-103.8	0	0	0	0	116.5
531	D	35.8	Very low	33.3	Very low	132 Å²	132	137.1 Å²	137.1	71%	0.706	76%	0.761	S	S	*	*			cis	-143.7	150.6	19.1	-73.5	-56.4	0	0	0	111.8
532	S	35.1	Very low	33.5	Very low	105 Å²	105	137.1 Å²	137.1	73%	0.734	76%	0.759	S	S	*	*				59	134.3	94	-37.9	0	0	0	0	115
533	E	34.9	Very low	33.6	Very low	181 Å²	181	131.7 Å²	131.7	85%	0.846	76%	0.757	S	S	*	*			cis	-143.8	137.6	20	-71	-172	121.6	0	0	112.4
534	V	34.1	Very low	33.5	Very low	122 Å²	122	132.6 Å²	132.6	74%	0.739	75%	0.75	S	S	*	*				76.8	100.3	96.1	-176.6	0	0	0	0	118.6
535	S	33.4	Very low	33.7	Very low	96 Å²	96	134.4 Å²	134.4	67%	0.671	75%	0.75	S	S	*	*			trans	63	155.3	136	-62.1	0	0	0	0	122.4
536	Q	35.7	Very low	33.7	Very low	169 Å²	169	130.1 Å²	130.1	79%	0.79	74%	0.735	S	S	*	*			cis	-156.9	165.8	-9	-119.6	168.8	12.6	0	0	112.4
537	N	33.5	Very low	33.7	Very low	123 Å²	123	132.3 Å²	132.3	66%	0.658	73%	0.733	S	S	*	*			trans	-22.4	144.4	169.4	-51.3	-26.3	0	0	0	119.4
538	H	34.5	Very low	33.7	Very low	166 Å²	166	134.1 Å²	134.1	77%	0.769	74%	0.737	S	S	*	*				-177.7	128.9	97.6	-100.2	-69.1	0	0	0	116.5
539	S	34.3	Very low	33.5	Very low	106 Å²	106	133.3 Å²	133.3	74%	0.741	74%	0.741	S	S	*	*			trans	63.4	140.7	142.8	-52.5	0	0	0	0	121.9
540	P	39.7	Very low	33.5	Very low	117 Å²	117	134.3 Å²	134.3	76%	0.76	75%	0.753	S	S	*	*			trans	-116.5	151.2	-173	41.1	-32.2	0	0	0	117.3
541	H	34.9	Very low	33.1	Very low	182 Å²	182	133.5 Å²	133.5	84%	0.843	75%	0.752	S	S	*	*			trans	-147.1	124.9	156.9	-88.6	-19.8	0	0	0	108.5
542	R	29.8	Very low	32.8	Very low	243 Å²	243	135.7 Å²	135.7	92%	0.917	76%	0.758	S	S	*	*				87.9	104.2	70.6	-169.9	-168.4	-164.3	-141.5	5.2	112
543	G	30.4	Very low	32.4	Very low	76 Å²	76	135.6 Å²	135.6	78%	0.784	76%	0.757	S	S	*	*			trans	142.5	116.8	171.5	0	0	0	0	0	111.6
544	S	28.4	Very low	31.9	Very low	100 Å²	100	131.8 Å²	131.8	70%	0.699	75%	0.749	S	S	*	*			cis	140.9	111.4	5.6	164	0	0	0	0	106.6
545	L	30.6	Very low	31.5	Very low	155 Å²	155	133.1 Å²	133.1	81%	0.812	75%	0.751	S	S	*	*			trans	80.6	148.1	151.7	-65.9	170.7	0	0	0	122.5
546	S	30.3	Very low	31.2	Very low	88 Å²	88	133.4 Å²	133.4	62%	0.615	75%	0.749	S	S	*	*			trans	74.9	135.8	146.8	-67	0	0	0	0	120.7
547	E	29.9	Very low	30.8	Very low	156 Å²	156	131.8 Å²	131.8	73%	0.729	74%	0.742	S	S	*	*			cis	-170.2	177.6	-16.3	-128.6	160.5	153.1	0	0	112.3
548	N	34	Very low	30.5	Very low	137 Å²	137	133.9 Å²	133.9	73%	0.733	75%	0.745	S	S	*	*			trans	68.7	83.9	151.9	-62.1	-21.8	0	0	0	121.5
549	N	31.5	Very low	30.3	Very low	153 Å²	153	131.2 Å²	131.2	82%	0.818	75%	0.745	S	S	*	*				-29.2	171.9	115.6	-100.3	-28.1	0	0	0	116
550	P	37.4	Very low	30.2	Very low	112 Å²	112	131.2 Å²	131.2	73%	0.727	75%	0.745	S	S	*	*			cis	-141.3	-168.5	-11.5	34.4	-11.8	0	0	0	115.2
551	A	27.9	Very low	29.8	Very low	84 Å²	84	130.4 Å²	130.4	69%	0.694	74%	0.742	S	S	*	*			trans	93	151.7	134.5	0	0	0	0	0	123.6
552	Q	29	Very low	29.6	Very low	179 Å²	179	126.7 Å²	126.7	84%	0.836	74%	0.737	S	S	*	*			trans	69.6	91	150	-77.8	174.3	-3.4	0	0	122.3
553	S	26.1	Very low	29.8	Very low	102 Å²	102	121.4 Å²	121.4	71%	0.713	73%	0.731	S	S	*	*				91.2	157.8	108.3	82.2	0	0	0	0	121.6
554	C	24	Very low	30	Very low	102 Å²	102	122.9 Å²	122.9	69%	0.689	73%	0.73	S	S	*	*			trans	65.2	105.7	145.9	-71.1	0	0	0	0	121.5
555	L	26.4	Very low	30.4	Very low	149 Å²	149	123.9 Å²	123.9	78%	0.78	73%	0.734	S	S	*	*				80.4	140.6	119.9	-71.4	168	0	0	0	121.5
556	T	26	Very low	30.3	Very low	103 Å²	103	122 Å²	122	63%	0.632	73%	0.732	S	S	*	*			trans	76.5	111.8	142.9	46.4	0	0	0	0	122.6
557	Q	27.6	Very low	30.5	Very low	135 Å²	135	122.4 Å²	122.4	63%	0.631	74%	0.735	S	S	*	*				95.6	124.2	119.3	-76.1	179	63.2	0	0	121.8
558	K	27.7	Very low	30.7	Very low	166 Å²	166	122.2 Å²	122.2	72%	0.722	74%	0.739	S	S	*	*			trans	69.3	115.9	133.3	-65.6	173.2	-179.4	163	0	117.6
559	S	30.2	Very low	30.7	Very low	110 Å²	110	120.1 Å²	120.1	77%	0.769	74%	0.741	S	S	*	*				97.7	143.4	93.9	65.8	0	0	0	0	111.8
560	S	31.6	Very low	31	Very low	106 Å²	106	119.2 Å²	119.2	74%	0.741	74%	0.743	S	S	*	*			cis	-163.6	-168.3	-8.7	47.8	0	0	0	0	107
561	S	32.1	Very low	30.9	Very low	100 Å²	100	117.8 Å²	117.8	70%	0.699	75%	0.749	S	S	*	*			cis	-160.9	178.4	23.7	-36	0	0	0	0	114
562	S	29.6	Very low	31.1	Very low	104 Å²	104	118.1 Å²	118.1	73%	0.727	75%	0.746	S	S	*	*			trans	-30	170	154.6	56.4	0	0	0	0	119.1
563	V	34.9	Very low	31.2	Very low	132 Å²	132	119 Å²	119	80%	0.8	75%	0.748	S	S	*	*			cis	-152.9	148.4	35	-171.4	0	0	0	0	112.5
564	S	33.8	Very low	31.4	Very low	108 Å²	108	118.7 Å²	118.7	76%	0.755	75%	0.746	S	S	*	*			trans	-103.4	159.6	169.7	-41.6	0	0	0	0	112
565	P	37.6	Very low	32.1	Very low	121 Å²	121	119.5 Å²	119.5	79%	0.786	75%	0.75	S	S	*	*				-152.1	168.3	112.2	37	-19	0	0	0	118.2
566	C	28.7	Very low	32.3	Very low	115 Å²	115	119.5 Å²	119.5	78%	0.777	75%	0.75	S	S	*	*			trans	-13.1	165	157.8	-48.2	0	0	0	0	120.3
567	S	34.1	Very low	32.6	Very low	97 Å²	97	118.2 Å²	118.2	68%	0.678	76%	0.758	S	S	*	*			cis	-166.3	158.8	35.5	-36.1	0	0	0	0	116.3
568	N	33.9	Very low	32.7	Very low	151 Å²	151	117.8 Å²	117.8	81%	0.807	76%	0.764	S	S	*	*			trans	67.5	96.3	142.8	-57.4	-12.4	0	0	0	123.3
569	A	34.1	Very low	32.9	Very low	94 Å²	94	117.3 Å²	117.3	78%	0.777	77%	0.769	S	S	*	*				47.5	165.5	99.4	0	0	0	0	0	122.2
570	P	38.3	Very low	33	Very low	133 Å²	133	119.8 Å²	119.8	86%	0.864	77%	0.769	S	S	*	*			cis	-132.4	173.1	-12.1	34.9	-15.8	0	0	0	116
571	G	35.2	Very low	32.9	Very low	83 Å²	83	123.9 Å²	123.9	86%	0.856	78%	0.777	S	S	*	*			trans	171.8	109.5	163.2	0	0	0	0	0	113.5
572	S	32.1	Very low	32.7	Very low	90 Å²	90	128.4 Å²	128.4	63%	0.629	78%	0.784	S	S	*	*			trans	-112.7	154	-165.8	55.7	0	0	0	0	115.1
573	F	30.4	Very low	32.6	Very low	197 Å²	197	130.6 Å²	130.6	86%	0.864	79%	0.787	S	S	*	*				176.2	114.3	110.7	-89	-61.6	0	0	0	112.8
574	S	32.1	Very low	32.3	Very low	97 Å²	97	132.7 Å²	132.7	68%	0.678	79%	0.788	S	S	*	*			trans	-108.2	172.7	157.3	-52.5	0	0	0	0	108.5
575	P	37.2	Very low	32.2	Very low	118 Å²	118	135.4 Å²	135.4	77%	0.766	79%	0.794	S	S	*	*				-147.9	-178.3	75.3	37.7	-18.3	0	0	0	114.2
576	D	32.2	Very low	31.7	Very low	149 Å²	149	139.5 Å²	139.5	80%	0.797	80%	0.795	S	S	*	*			cis	-167.5	172.5	-37.1	-87	-30.9	0	0	0	107
577	G	32.2	Very low	31.8	Very low	77 Å²	77	141.5 Å²	141.5	79%	0.794	79%	0.792	S	S	*	*			trans	128.4	69.3	160.9	0	0	0	0	0	117.1
578	V	29.8	Very low	31.5	Very low	126 Å²	126	146.1 Å²	146.1	76%	0.764	80%	0.8	S	S	*	*			trans	-80.6	172.1	154.4	-143	0	0	0	0	108.1
579	D	31.7	Very low	31.1	Very low	155 Å²	155	144.7 Å²	144.7	83%	0.829	80%	0.797	S	S	*	*				-162.1	175.5	79.1	-136.4	-33.8	0	0	0	114.2
580	Q	30.7	Very low	30.8	Very low	162 Å²	162	145.6 Å²	145.6	76%	0.757	79%	0.793	S	S	*	*			trans	-116.5	121.3	-174.5	-60.5	176.8	-89.3	0	0	113.9
581	Q	29.9	Very low	30.2	Very low	193 Å²	193	149 Å²	149	90%	0.902	79%	0.794	S	S	*	*			trans	-163.2	120.3	157.9	-96.9	139.6	29.3	0	0	105.6
582	F	27.5	Very low	29.8	Very low	195 Å²	195	149 Å²	149	86%	0.855	80%	0.795	S	S	*	*			cis	82.5	87.3	21.3	-138.9	-72.8	0	0	0	115.1
583	L	29.4	Very low	29.5	Very low	150 Å²	150	148.6 Å²	148.6	79%	0.785	81%	0.805	S	S	*	*			trans	69.5	166.4	173.8	-136.8	68.8	0	0	0	116.2
584	E	27.4	Very low	29.6	Very low	175 Å²	175	144.7 Å²	144.7	82%	0.818	80%	0.802	S	S	*	*			trans	59.5	89.9	172.1	-58.4	-175.4	-177.8	0	0	117.5
585	D	32.6	Very low	29.6	Very low	166 Å²	166	146.6 Å²	146.6	89%	0.888	80%	0.803	S	S	*	*				-169.2	115.5	117.4	-119.9	-17.7	0	0	0	112.6
586	Y	26.5	Very low	29.3	Very low	207 Å²	207	148.4 Å²	148.4	81%	0.812	80%	0.801	S	S	*	*			trans	-126.3	128.9	171.8	-130.1	-99.1	0	0	0	108.2
587	H	29.7	Very low	29.2	Very low	156 Å²	156	150.5 Å²	150.5	72%	0.722	81%	0.806	S	S	*	*			trans	67.3	104.7	-179	-47.3	-87	0	0	0	118.2
588	K	28.9	Very low	29.3	Very low	194 Å²	194	152 Å²	152	84%	0.843	81%	0.811	S	S	*	*				179.9	123.7	102.6	-94.6	153.6	-174	167.9	0	116.5
589	V	26	Very low	29.2	Very low	122 Å²	122	151.3 Å²	151.3	74%	0.739	81%	0.812	S	S	*	*				63.7	87.4	127.1	-172.9	0	0	0	0	120.3
590	T	26.3	Very low	29.1	Very low	113 Å²	113	153.1 Å²	153.1	69%	0.693	82%	0.815	S	S	*	*				72.4	123.4	109.4	-55.9	0	0	0	0	123.2
591	K	26.2	Very low	28.9	Very low	203 Å²	203	154.9 Å²	154.9	88%	0.883	82%	0.816	S	S	*	*			trans	99.7	114.3	144.3	-90.4	165.7	-168.7	169.9	0	122
592	G	26.3	Very low	28.9	Very low	84 Å²	84	156.7 Å²	156.7	87%	0.866	82%	0.817	S	S	*	*			trans	103.4	126.4	157.6	0	0	0	0	0	112.9
593	G	27.1	Very low	29	Very low	82 Å²	82	152.4 Å²	152.4	85%	0.845	81%	0.81	S	S	*	*			cis	137.4	149.4	6.6	0	0	0	0	0	108.7
594	S	31.2	Very low	28.9	Very low	115 Å²	115	152.4 Å²	152.4	80%	0.804	81%	0.81	S	S	*	*			cis	-161.9	-166.7	3.9	-171.2	0	0	0	0	108.3
595	I	33.9	Very low	28.9	Very low	137 Å²	137	152.9 Å²	152.9	70%	0.703	81%	0.81	S	S	*	*			trans	77.2	131.4	164.8	-58.8	172.7	0	0	0	115.3
596	E	30.2	Very low	28.7	Very low	155 Å²	155	152.6 Å²	152.6	72%	0.724	81%	0.808	S	S	*	*			cis	-165.5	140.7	-19.3	-115.4	156.2	-146.9	0	0	108.2
597	E	30.1	Very low	28.8	Very low	194 Å²	194	147.9 Å²	147.9	91%	0.907	80%	0.797	S	S	*	*			trans	166.8	154.5	130.7	-94.5	-166.5	161.1	0	0	112.6
598	A	33.1	Very low	28.8	Very low	107 Å²	107	148 Å²	148	88%	0.884	80%	0.803	S	S	*	*			trans	61.5	60.2	165	0	0	0	0	0	118.8
599	S	28.1	Very low	28.9	Very low	112 Å²	112	142.7 Å²	142.7	78%	0.783	80%	0.803	S	S	*	*			trans	-120.3	130.4	149.1	62.7	0	0	0	0	110.3
600	Q	29.1	Very low	29.6	Very low	193 Å²	193	140.5 Å²	140.5	90%	0.902	79%	0.787	S	S	*	*			trans	-159.3	129.6	162.8	-117.3	162.9	28.9	0	0	113.5
601	Y	26.9	Very low	30.6	Very low	199 Å²	199	136 Å²	136	78%	0.78	76%	0.764	S	S	*	*			trans	-37.9	149.1	173.9	-63.1	-98.1	0	0	0	117.4
602	Y	30.9	Very low	32.4	Very low	232 Å²	232	135.2 Å²	135.2	91%	0.91	76%	0.756	S	S	*	*				-143.8	133.5	110.1	-118.7	-85.6	0	0	0	109.7
603	C	28.6	Very low	35	Very low	105 Å²	105	133.8 Å²	133.8	71%	0.709	73%	0.729	S	S	*	*			trans	-105.7	145.3	161.9	-67.3	0	0	0	0	107.6
604	D	28.6	Very low	37.5	Very low	150 Å²	150	130.9 Å²	130.9	80%	0.802	69%	0.694	S	S	*	*			trans	-137.5	154.1	152.3	-158.4	1.6	0	0	0	109.3
605	K	27.4	Very low	40.1	Very low	184 Å²	184	129.4 Å²	129.4	80%	0.8	68%	0.677	S	S	*	*			trans	-107	109.6	-175.3	-62.7	174.6	-179.2	176.9	0	109.3
606	N	27.2	Very low	42.6	Very low	160 Å²	160	122.9 Å²	122.9	86%	0.856	64%	0.644	S	S	*	*			trans	-146	148.3	155.8	-89.1	-55	0	0	0	109.8
607	D	28.3	Very low	45.4	Very low	108 Å²	108	119.1 Å²	119.1	58%	0.578	62%	0.623	S	S	*	*			trans	-99.4	108.9	-170.4	-168.2	32.3	0	0	0	110.4	R705	D607-R705 IonicContact OD1-CZ 2.59Å; D607-R705 IonicContact OD1-NH1 3.23Å; D607-R705 PolarHBondContact OD1-NH1 3.11Å; D607-R705 IonicContact OD1-NH2 3.41Å; D607-R705 PolarHBondContact OD1-NH2 2.83Å; D607-R705 IonicContact OD2-CZ 3.75Å; D607-R705 IonicContact OD2-NH1 3.28Å; D607-R705 PolarHBondContact OD2-NH1 3.44Å; D607-R705 IonicContact OD2-NH2 3.86Å
608	D	29.9	Very low	48.2	Very low	158 Å²	158	110 Å²	110	85%	0.845	58%	0.58	S	S	*	*			trans	-167.1	154.1	148.1	-110.1	-35.6	0	0	0	111.3	D610	D608-D610 PolarHBondContact O-N 3Å
609	G	31.4	Very low	50.7	Low	83 Å²	83	109.5 Å²	109.5	86%	0.856	57%	0.566	S	S	*	*			trans	-89.5	100	-158.6	0	0	0	0	0	117.1
610	D	40.4	Very low	53.5	Low	76 Å²	76	105.4 Å²	105.4	41%	0.406	54%	0.537	S	S	.	.	P	Polyproline II helix	trans	-97.9	145.5	171.6	-151.2	-15.5	0	0	0	112.3	E383 S384 D608	E383-D610 VanDerWaalsContact CG-OD1 3.23Å; E383-D610 WeakPolarHBondContact CG-OD1 3.16Å; S384-D610 PolarHBondContact N-OD2 3.23Å; S384-D610 PolarHBondContact OG-OD2 3.28Å; D608-D610 PolarHBondContact O-N 3Å
611	G	48.2	Very low	56.1	Low	19 Å²	19	98 Å²	98	20%	0.196	50%	0.504	C	S	.	.	P	Polyproline II helix	trans	-98.8	119.7	-162.6	0	0	0	0	0	115.3	L613	G611-L613 PolarHBondContact O-N 2.99Å
612	Y	63.4	Low	58.4	Low	186 Å²	186	98.5 Å²	98.5	73%	0.729	51%	0.51	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.4	126.8	-175.4	-158.9	-83.5	0	0	0	112.5	V614 R701	Y612-V614 HydrophobicContact CD1-CG2 3.89Å; Y612-V614 HydrophobicContact CE1-CG2 4.42Å; Y612-R701 PolarHBondContact N-O 3.4Å; Y612-R701 PolarHBondContact O-N 3.48Å
613	L	80.2	Confident	60.5	Low	54 Å²	54	92.1 Å²	92.1	28%	0.283	49%	0.488	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	132	174	-64	-173.1	0	0	0	111.8	H387 G611 V665 I699 R700	H387-L613 VanDerWaalsContact CE1-CD1 3.46Å; H387-L613 WeakPolarHBondContact CE1-CD1 3.22Å; G611-L613 PolarHBondContact O-N 2.99Å; L613-V665 HydrophobicContact CD2-CG2 4.2Å; L613-I699 CarbonylContact C-O 3.48Å; L613-I699 VanDerWaalsContact CA-O 3.24Å; L613-I699 WeakPolarHBondContact CA-O 3.16Å; L613-R700 HydrophobicContact CD2-CB 3.63Å; L613-R700 HydrophobicContact CD2-CG 3.97Å
614	V	80.7	Confident	62.8	Low	21 Å²	21	87.8 Å²	87.8	13%	0.127	46%	0.462	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	135.3	178.3	-174	0	0	0	0	110.1	Y612 I616 P656 V698 I699	Y612-V614 HydrophobicContact CD1-CG2 3.89Å; Y612-V614 HydrophobicContact CE1-CG2 4.42Å; V614-I616 HydrophobicContact CG1-CG1 4.07Å; V614-P656 HydrophobicContact CG1-CB 3.99Å; V614-P656 HydrophobicContact CG1-CG 3.85Å; V614-V698 WeakPolarHBondContact O-CA 2.98Å; V614-I699 HydrophobicContact CB-CD1 4.1Å; V614-I699 HydrophobicContact CB-CG1 3.85Å; V614-I699 PolarHBondContact N-O 2.87Å; V614-I699 WeakPolarHBondContact O-CG1 3.46Å; V614-I699 PolarHBondContact O-N 3.03Å
615	L	85.4	Confident	65.4	Low	84 Å²	84	87.4 Å²	87.4	44%	0.44	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	124.8	167	176.2	68.3	0	0	0	108.9	P656 A696 L697 V698	L615-P656 WeakPolarHBondContact O-CD 3.33Å; L615-A696 HydrophobicContact CD1-CB 4.34Å; L615-L697 CarbonylContact C-O 3.43Å; L615-L697 WeakPolarHBondContact CA-O 3.49Å; L615-V698 HydrophobicContact CD1-CG2 3.79Å
616	I	87.4	Confident	68.3	Low	0 Å²	0	79.1 Å²	79.1	0%	0	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	141.1	176.1	-66.2	-178.9	0	0	0	108.2	V614 I618 C654 P656 L658 A696 L697 I699	V614-I616 HydrophobicContact CG1-CG1 4.07Å; I616-I618 HydrophobicContact CG2-CD1 4.18Å; I616-I618 HydrophobicContact CG2-CG1 3.79Å; I616-C654 HydrophobicContact CG2-CB 4.28Å; I616-C654 VanDerWaalsContact CG2-SG 3.59Å; I616-P656 HydrophobicContact CG1-CB 4.31Å; I616-P656 WeakPolarHBondContact CG1-O 3.42Å; I616-L658 HydrophobicContact CD1-CB 4.07Å; I616-L658 HydrophobicContact CD1-CD1 3.57Å; I616-L658 HydrophobicContact CD1-CG 4.46Å; I616-A696 CarbonylContact O-C 3.51Å; I616-A696 WeakPolarHBondContact O-CA 3.48Å; I616-L697 PolarHBondContact N-O 2.93Å; I616-L697 PolarHBondContact O-N 3.02Å; I616-I699 HydrophobicContact CD1-CD1 3.51Å; I616-I699 HydrophobicContact CD1-CG1 4.08Å; I616-I699 HydrophobicContact CG1-CD1 4.37Å
617	R	87.3	Confident	71.3	Confident	77 Å²	77	72 Å²	72	29%	0.291	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	126.7	177.1	-74.9	170.8	174	-91.2	3.9	108.8	E694	R617-E694 WeakPolarHBondContact CB-OE1 3.43Å; R617-E694 VanDerWaalsContact CD-OE1 3.23Å; R617-E694 WeakPolarHBondContact CD-OE1 3.44Å; R617-E694 VanDerWaalsContact CG-OE1 3.28Å; R617-E694 WeakPolarHBondContact CG-OE1 3.48Å; R617-E694 IonicContact CZ-OE1 2.71Å; R617-E694 IonicContact NE-OE1 3.61Å; R617-E694 IonicContact NH1-OE1 2.71Å; R617-E694 PolarHBondContact NH1-OE1 3.46Å; R617-E694 IonicContact NH1-OE2 3.85Å; R617-E694 PolarHBondContact NH1-OE2 2.82Å
618	I	89.8	Confident	74.3	Confident	1 Å²	1	68.1 Å²	68.1	1%	0.005	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	109.4	-176.3	-42	-179.6	0	0	0	108.2	I616 F626 F628 P650 A651 C654 L658 L695 L697	I616-I618 HydrophobicContact CG2-CD1 4.18Å; I616-I618 HydrophobicContact CG2-CG1 3.79Å; I618-F626 HydrophobicContact CB-CD1 4.09Å; I618-F626 HydrophobicContact CG2-CB 4.29Å; I618-F626 HydrophobicContact CG2-CD1 3.82Å; I618-F626 WeakPolarHBondContact O-CE1 3.44Å; I618-F628 HydrophobicContact CD1-CD1 4.36Å; I618-F628 HydrophobicContact CD1-CE1 4.19Å; I618-P650 HydrophobicContact CG2-CB 3.52Å; I618-A651 HydrophobicContact CD1-CB 4.12Å; I618-C654 HydrophobicContact CG1-CB 4.2Å; I618-L658 HydrophobicContact CD1-CD2 4.41Å; I618-L695 HydrophobicContact CB-CB 4.34Å; I618-L695 HydrophobicContact CD1-CD2 4.47Å; I618-L695 PolarHBondContact N-O 3.38Å; I618-L695 PolarHBondContact O-N 2.89Å; I618-L697 HydrophobicContact CD1-CD1 4.18Å
619	T	86.3	Confident	77.2	Confident	97 Å²	97	63 Å²	63	60%	0.595	33%	0.328	S	S	*	.			trans	-72.6	138.2	164.1	-48.7	0	0	0	0	107.8	P650	T619-P650 WeakPolarHBondContact O-CB 3.45Å
620	P	85.7	Confident	80	Confident	26 Å²	26	60 Å²	60	17%	0.169	29%	0.293	C	S	.	.			trans	-71.6	161.7	176.6	29.7	-32.2	0	0	0	112	G624 R625 F626 R693	P620-G624 VanDerWaalsContact CB-C 3.43Å; P620-G624 WeakPolarHBondContact CB-O 3.32Å; P620-R625 CarbonylContact C-O 3.58Å; P620-R625 VanDerWaalsContact CA-O 3.3Å; P620-R625 WeakPolarHBondContact CA-O 3.45Å; P620-F626 HydrophobicContact CB-CD1 4.06Å; P620-F626 HydrophobicContact CB-CE1 3.59Å; P620-F626 HydrophobicContact CB-CZ 3.95Å; P620-F626 HydrophobicContact CG-CE1 4.04Å; P620-F626 HydrophobicContact CG-CZ 4.3Å; P620-R693 WeakPolarHBondContact CD-O 3.48Å
621	D	83.6	Confident	82.3	Confident	39 Å²	39	62.6 Å²	62.6	21%	0.209	30%	0.301	C	S	.	.			trans	-70.4	-179.6	168.6	64.8	21.4	0	0	0	112.1	E623 G624 R625 P650	D621-E623 PolarHBondContact O-N 2.74Å; D621-E623 VanDerWaalsContact OD1-C 3.24Å; D621-E623 WeakPolarHBondContact OD1-CA 3.31Å; D621-E623 WeakPolarHBondContact OD1-CB 3.25Å; D621-E623 PolarHBondContact OD1-N 2.88Å; D621-G624 WeakPolarHBondContact O-CA 3.49Å; D621-G624 PolarHBondContact O-N 3.16Å; D621-G624 PolarHBondContact OD1-N 3.5Å; D621-R625 PolarHBondContact N-O 3.2Å; D621-R625 WeakPolarHBondContact OD1-CA 3.43Å; D621-R625 WeakPolarHBondContact OD1-CB 3.42Å; D621-R625 PolarHBondContact OD1-N 3.23Å; D621-R625 IonicContact OD1-NE 3.91Å; D621-R625 WeakPolarHBondContact OD2-CB 3.48Å; D621-R625 IonicContact OD2-CZ 2.67Å; D621-R625 IonicContact OD2-NE 3.57Å; D621-R625 PolarHBondContact OD2-NE 2.85Å; D621-R625 IonicContact OD2-NH2 3.91Å; D621-R625 PolarHBondContact OD2-NH2 3.4Å; D621-P650 HydrophobicContact CB-CG 3.91Å
622	K	75.9	Confident	84.2	Confident	208 Å²	208	61.7 Å²	61.7	90%	0.904	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-28.2	179.9	-64.7	177.6	-177.5	176.8	0	111.9	G624	K622-G624 VanDerWaalsContact C-N 3.28Å
623	E	75.1	Confident	85.1	Confident	98 Å²	98	53 Å²	53	46%	0.458	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.7	7.5	176.9	-51.5	69.6	-140.2	0	0	112.2	D621 R625 R688	D621-E623 PolarHBondContact O-N 2.74Å; D621-E623 VanDerWaalsContact OD1-C 3.24Å; D621-E623 WeakPolarHBondContact OD1-CA 3.31Å; D621-E623 WeakPolarHBondContact OD1-CB 3.25Å; D621-E623 PolarHBondContact OD1-N 2.88Å; E623-R625 VanDerWaalsContact C-N 3.31Å; E623-R625 HydrophobicContact CB-CG 4.06Å; E623-R625 VanDerWaalsContact CD-NH2 3.35Å; E623-R625 PolarHBondContact O-N 3.15Å; E623-R625 IonicContact OE2-CZ 3.52Å; E623-R625 IonicContact OE2-NE 3.46Å; E623-R625 IonicContact OE2-NH2 2.68Å; E623-R625 PolarHBondContact OE2-NH2 3.4Å; E623-R688 PolarHBondContact O-NH2 3.09Å
624	G	77.3	Confident	85.3	Confident	15 Å²	15	53.6 Å²	53.6	16%	0.155	26%	0.264	C	S	.	.	S	Bend	trans	76.4	6.8	178.8	0	0	0	0	0	114.8	P620 D621 K622 R688	P620-G624 VanDerWaalsContact CB-C 3.43Å; P620-G624 WeakPolarHBondContact CB-O 3.32Å; D621-G624 WeakPolarHBondContact O-CA 3.49Å; D621-G624 PolarHBondContact O-N 3.16Å; D621-G624 PolarHBondContact OD1-N 3.5Å; K622-G624 VanDerWaalsContact C-N 3.28Å; G624-R688 WeakPolarHBondContact O-CD 3.42Å; G624-R688 WeakPolarHBondContact O-CG 3.49Å; G624-R688 PolarHBondContact O-NE 3.02Å
625	R	82.6	Confident	85.4	Confident	141 Å²	141	55 Å²	55	53%	0.532	27%	0.27	S	S	.	.			trans	-87.7	152.4	-173.9	-42.4	168.7	-71.1	-161	-5.7	110.5	P620 D621 E623	P620-R625 CarbonylContact C-O 3.58Å; P620-R625 VanDerWaalsContact CA-O 3.3Å; P620-R625 WeakPolarHBondContact CA-O 3.45Å; D621-R625 PolarHBondContact N-O 3.2Å; D621-R625 WeakPolarHBondContact OD1-CA 3.43Å; D621-R625 WeakPolarHBondContact OD1-CB 3.42Å; D621-R625 PolarHBondContact OD1-N 3.23Å; D621-R625 IonicContact OD1-NE 3.91Å; D621-R625 WeakPolarHBondContact OD2-CB 3.48Å; D621-R625 IonicContact OD2-CZ 2.67Å; D621-R625 IonicContact OD2-NE 3.57Å; D621-R625 PolarHBondContact OD2-NE 2.85Å; D621-R625 IonicContact OD2-NH2 3.91Å; D621-R625 PolarHBondContact OD2-NH2 3.4Å; E623-R625 VanDerWaalsContact C-N 3.31Å; E623-R625 HydrophobicContact CB-CG 4.06Å; E623-R625 VanDerWaalsContact CD-NH2 3.35Å; E623-R625 PolarHBondContact O-N 3.15Å; E623-R625 IonicContact OE2-CZ 3.52Å; E623-R625 IonicContact OE2-NE 3.46Å; E623-R625 IonicContact OE2-NH2 2.68Å; E623-R625 PolarHBondContact OE2-NH2 3.4Å
626	F	88.7	Confident	85.4	Confident	11 Å²	11	53.7 Å²	53.7	5%	0.048	26%	0.262	C	S	.	.			trans	-103.3	-22	175.3	-59.2	-71.9	0	0	0	113.5	I618 P620 F628 A651 I684 S687 R688 L695	I618-F626 HydrophobicContact CB-CD1 4.09Å; I618-F626 HydrophobicContact CG2-CB 4.29Å; I618-F626 HydrophobicContact CG2-CD1 3.82Å; I618-F626 WeakPolarHBondContact O-CE1 3.44Å; P620-F626 HydrophobicContact CB-CD1 4.06Å; P620-F626 HydrophobicContact CB-CE1 3.59Å; P620-F626 HydrophobicContact CB-CZ 3.95Å; P620-F626 HydrophobicContact CG-CE1 4.04Å; P620-F626 HydrophobicContact CG-CZ 4.3Å; F626-F628 HydrophobicContact CB-CD1 4.01Å; F626-F628 HydrophobicContact CB-CE1 3.79Å; F626-A651 WeakPolarHBondContact O-CB 3.46Å; F626-A651 PolarHBondContact O-N 3.2Å; F626-I684 HydrophobicContact CD2-CG2 4.03Å; F626-I684 HydrophobicContact CE2-CG2 4.44Å; F626-S687 VanDerWaalsContact CE2-OG 3.27Å; F626-S687 WeakPolarHBondContact CE2-OG 3.43Å; F626-S687 WeakPolarHBondContact CZ-OG 3.49Å; F626-R688 HydrophobicContact CE2-CG 3.75Å; F626-R688 HydrophobicContact CZ-CG 4.11Å; F626-L695 HydrophobicContact CB-CD2 4.1Å; F626-L695 HydrophobicContact CD1-CB 3.83Å; F626-L695 HydrophobicContact CD1-CD2 3.89Å; F626-L695 HydrophobicContact CD2-CD2 3.71Å; F626-L695 HydrophobicContact CE1-CB 3.49Å; F626-L695 VanDerWaalsContact CE1-CB 3.49Å; F626-L695 HydrophobicContact CE1-CD2 4.26Å; F626-L695 HydrophobicContact CE2-CB 4.27Å; F626-L695 HydrophobicContact CE2-CD2 4.1Å; F626-L695 HydrophobicContact CG-CB 4.36Å; F626-L695 HydrophobicContact CG-CD2 3.61Å; F626-L695 HydrophobicContact CZ-CB 3.76Å; F626-L695 HydrophobicContact CZ-CD2 4.38Å
627	G	89.4	Confident	85.1	Confident	11 Å²	11	61.4 Å²	61.4	11%	0.113	30%	0.296	C	S	.	.			trans	86	18.1	169.3	0	0	0	0	0	118	N646 S649	G627-N646 VanDerWaalsContact O-CB 3.31Å; G627-N646 WeakPolarHBondContact O-CB 3.28Å; G627-N646 PolarHBondContact O-N 2.9Å; G627-S649 WeakPolarHBondContact CA-OG 3.31Å; G627-S649 PolarHBondContact O-OG 3.25Å
628	F	92.2	Very high	84.9	Confident	25 Å²	25	62.4 Å²	62.4	11%	0.11	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	150.8	172.4	69.9	-79.6	0	0	0	112.1	I618 F626 V642 R644 I645 A651 L658 I664 I684 L695 L697	I618-F628 HydrophobicContact CD1-CD1 4.36Å; I618-F628 HydrophobicContact CD1-CE1 4.19Å; F626-F628 HydrophobicContact CB-CD1 4.01Å; F626-F628 HydrophobicContact CB-CE1 3.79Å; F628-V642 HydrophobicContact CB-CG1 4.3Å; F628-V642 HydrophobicContact CD2-CG1 4.42Å; F628-V642 HydrophobicContact CD2-CG2 4.3Å; F628-R644 CarbonylContact C-O 3.49Å; F628-R644 WeakPolarHBondContact CA-O 3.2Å; F628-I645 HydrophobicContact CB-CG1 4.17Å; F628-A651 HydrophobicContact CB-CB 3.93Å; F628-A651 HydrophobicContact CD1-CB 3.88Å; F628-A651 HydrophobicContact CG-CB 4.32Å; F628-L658 HydrophobicContact CB-CD2 4Å; F628-L658 HydrophobicContact CD1-CD2 4.18Å; F628-L658 HydrophobicContact CD2-CD2 4.24Å; F628-L658 HydrophobicContact CG-CD2 3.87Å; F628-I664 HydrophobicContact CE2-CD1 4Å; F628-I684 HydrophobicContact CE2-CD1 4.06Å; F628-I684 HydrophobicContact CZ-CD1 3.9Å; F628-I684 HydrophobicContact CZ-CG1 4.48Å; F628-I684 HydrophobicContact CZ-CG2 4.25Å; F628-L695 HydrophobicContact CE1-CD2 3.64Å; F628-L695 HydrophobicContact CZ-CD2 3.92Å; F628-L697 HydrophobicContact CZ-CD1 4.33Å; F628-L697 HydrophobicContact CZ-CD2 3.96Å
629	N	89.7	Confident	84.6	Confident	50 Å²	50	66 Å²	66	27%	0.267	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	147.4	172.2	-64.8	-25.4	0	0	0	110.1	S643 R644	N629-S643 WeakPolarHBondContact CB-OG 3.13Å; N629-S643 PolarHBondContact O-N 3.18Å; N629-S643 PolarHBondContact O-OG 3.47Å; N629-R644 HydrophobicContact CB-CB 4.16Å; N629-R644 PolarHBondContact N-O 3.4Å
630	L	90.7	Very high	84.7	Confident	22 Å²	22	61.9 Å²	61.9	12%	0.115	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	153.1	178	-164.5	65.3	0	0	0	110.6	L640 S643 I664 V680 V681 I684	L630-L640 HydrophobicContact CD2-CD2 3.82Å; L630-L640 HydrophobicContact CG-CD2 4.21Å; L630-S643 PolarHBondContact O-OG 3.31Å; L630-I664 HydrophobicContact CD1-CD1 3.41Å; L630-I664 VanDerWaalsContact CD1-CD1 3.41Å; L630-I664 HydrophobicContact CD1-CG1 3.96Å; L630-V680 HydrophobicContact CD2-CB 4.41Å; L630-V680 HydrophobicContact CD2-CG1 3.66Å; L630-V681 HydrophobicContact CD2-CG2 4.42Å; L630-I684 HydrophobicContact CD2-CD1 3.93Å
631	K	87.9	Confident	84.9	Confident	130 Å²	130	62.5 Å²	62.5	57%	0.565	31%	0.305	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-133.3	161.6	163.5	-79.4	176.8	-173.7	176.3	0	109.2	L640 V641 S643	K631-L640 CarbonylContact O-C 2.97Å; K631-L640 VanDerWaalsContact O-CA 3.31Å; K631-L640 WeakPolarHBondContact O-CA 3.5Å; K631-V641 PolarHBondContact N-O 3.48Å; K631-V641 PolarHBondContact O-N 3.09Å; K631-S643 VanDerWaalsContact CG-CB 3.48Å
632	G	88.1	Confident	85.3	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	88.5	-179.4	-179.8	0	0	0	0	0	113.7	Q636 L640 H677	G632-Q636 VanDerWaalsContact CA-OE1 3.25Å; G632-L640 WeakPolarHBondContact O-CD2 3.33Å; G632-H677 WeakPolarHBondContact O-CB 3.39Å; G632-H677 PolarHBondContact O-ND1 2.92Å
633	G	84.1	Confident	85.9	Confident	2 Å²	2	52.3 Å²	52.3	2%	0.021	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	139.9	158.7	-168.9	0	0	0	0	0	110.3	D635 Q636 K637 M638	G633-D635 PolarHBondContact O-N 2.72Å; G633-Q636 CarbonylContact O-C 3.39Å; G633-Q636 WeakPolarHBondContact O-CA 3.45Å; G633-Q636 PolarHBondContact O-N 2.78Å; G633-K637 PolarHBondContact O-N 2.74Å; G633-K637 VanDerWaalsContact O-N 3.17Å; G633-M638 PolarHBondContact N-O 2.73Å; G633-M638 PolarHBondContact O-N 3.33Å
634	V	82.9	Confident	86.6	Confident	68 Å²	68	55 Å²	55	41%	0.412	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	-62.3	-33.3	-177.6	78.6	0	0	0	0	112.4	Q636 K637 H675 T676	V634-Q636 VanDerWaalsContact C-N 3.26Å; V634-Q636 PolarHBondContact O-N 2.84Å; V634-K637 PolarHBondContact O-N 2.98Å; V634-H675 PolarHBondContact N-O 2.92Å; V634-T676 HydrophobicContact CG1-CG2 3.98Å
635	D	83.5	Confident	87.1	Confident	50 Å²	50	55 Å²	55	27%	0.267	27%	0.266	S	S	.	.	G	3₁₀ helix	trans	-66.7	-21.4	171.9	64.3	-62.8	0	0	0	114.2	G633 T676 H677	G633-D635 PolarHBondContact O-N 2.72Å; D635-T676 HydrophobicContact CB-CG2 4.08Å; D635-T676 WeakPolarHBondContact OD1-CA 3.5Å; D635-T676 WeakPolarHBondContact OD1-CB 3.39Å; D635-H677 PolarHBondContact OD1-N 3.32Å
636	Q	85.3	Confident	87.3	Confident	57 Å²	57	51.2 Å²	51.2	27%	0.266	26%	0.256	S	S	.	.	G	3₁₀ helix	trans	-98.2	-4.4	177.4	-50.3	-165.6	-4.3	0	0	111.9	G632 G633 V634 M638 H677	G632-Q636 VanDerWaalsContact CA-OE1 3.25Å; G633-Q636 CarbonylContact O-C 3.39Å; G633-Q636 WeakPolarHBondContact O-CA 3.45Å; G633-Q636 PolarHBondContact O-N 2.78Å; V634-Q636 VanDerWaalsContact C-N 3.26Å; V634-Q636 PolarHBondContact O-N 2.84Å; Q636-M638 HydrophobicContact CB-CB 4.37Å; Q636-M638 HydrophobicContact CB-CE 4.21Å; Q636-M638 PolarHBondContact O-N 3.2Å; Q636-M638 VanDerWaalsContact O-N 3.08Å; Q636-H677 HydrophobicContact CG-CB 4.37Å; Q636-H677 VanDerWaalsContact NE2-CB 3.33Å; Q636-H677 VanDerWaalsContact NE2-CG 3.31Å
637	K	81.2	Confident	87.1	Confident	162 Å²	162	55.7 Å²	55.7	70%	0.704	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.8	28.1	-172.5	-58.2	177.1	-173.7	171.6	0	112.9	G633 V634 E756	G633-K637 PolarHBondContact O-N 2.74Å; G633-K637 VanDerWaalsContact O-N 3.17Å; V634-K637 PolarHBondContact O-N 2.98Å; K637-E756 IonicContact NZ-OE2 2.99Å; K637-E756 PolarHBondContact NZ-OE2 3.37Å
638	M	82.5	Confident	86.8	Confident	97 Å²	97	63.6 Å²	63.6	48%	0.478	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	143.8	-177.6	-77.6	-163.4	-58.1	0	0	110.8	G633 Q636	G633-M638 PolarHBondContact N-O 2.73Å; G633-M638 PolarHBondContact O-N 3.33Å; Q636-M638 HydrophobicContact CB-CB 4.37Å; Q636-M638 HydrophobicContact CB-CE 4.21Å; Q636-M638 PolarHBondContact O-N 3.2Å; Q636-M638 VanDerWaalsContact O-N 3.08Å
639	P	83.4	Confident	86.6	Confident	77 Å²	77	63 Å²	63	50%	0.5	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.7	147.6	170.7	28.7	-35.2	0	0	0	110.7	V641 Q663	P639-V641 HydrophobicContact CB-CG2 4.48Å; P639-V641 HydrophobicContact CG-CG2 4.33Å; P639-V641 PolarHBondContact O-N 2.98Å; P639-Q663 HydrophobicContact CB-CG 4.22Å
640	L	88.2	Confident	86.5	Confident	10 Å²	10	61.6 Å²	61.6	5%	0.052	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	119.4	179.7	-71.3	147	0	0	0	109.7	L630 K631 G632 Q663 I664 I672 V680	L630-L640 HydrophobicContact CD2-CD2 3.82Å; L630-L640 HydrophobicContact CG-CD2 4.21Å; K631-L640 CarbonylContact O-C 2.97Å; K631-L640 VanDerWaalsContact O-CA 3.31Å; K631-L640 WeakPolarHBondContact O-CA 3.5Å; G632-L640 WeakPolarHBondContact O-CD2 3.33Å; L640-Q663 CarbonylContact O-C 3.6Å; L640-Q663 WeakPolarHBondContact O-CA 3.2Å; L640-Q663 WeakPolarHBondContact O-CG 3.19Å; L640-I664 PolarHBondContact O-N 3.27Å; L640-I672 HydrophobicContact CB-CD1 4.01Å; L640-I672 HydrophobicContact CD1-CB 3.8Å; L640-I672 HydrophobicContact CD1-CD1 3.58Å; L640-I672 HydrophobicContact CD1-CG1 3.99Å; L640-I672 WeakPolarHBondContact CD1-O 3.49Å; L640-I672 HydrophobicContact CG-CD1 4.38Å; L640-V680 HydrophobicContact CD1-CB 4.42Å; L640-V680 HydrophobicContact CD1-CG1 4.21Å; L640-V680 HydrophobicContact CD1-CG2 3.59Å; L640-V680 HydrophobicContact CD2-CB 4.09Å; L640-V680 HydrophobicContact CD2-CG1 3.95Å; L640-V680 HydrophobicContact CD2-CG2 4Å; L640-V680 HydrophobicContact CG-CG2 4.46Å
641	V	90.6	Very high	86.3	Confident	39 Å²	39	60.6 Å²	60.6	24%	0.236	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	136	-169.9	174.8	0	0	0	0	110.6	K631 P639 S643 D662 Q663	K631-V641 PolarHBondContact N-O 3.48Å; K631-V641 PolarHBondContact O-N 3.09Å; P639-V641 HydrophobicContact CB-CG2 4.48Å; P639-V641 HydrophobicContact CG-CG2 4.33Å; P639-V641 PolarHBondContact O-N 2.98Å; V641-S643 PolarHBondContact O-N 3.14Å; V641-D662 WeakPolarHBondContact CA-O 3.43Å; V641-Q663 HydrophobicContact CG2-CB 4.27Å; V641-Q663 HydrophobicContact CG2-CG 4.45Å
642	V	91.2	Very high	86.4	Confident	1 Å²	1	56.4 Å²	56.4	1%	0.006	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.4	117.9	172.3	179.4	0	0	0	0	109	F628 I645 L658 N659 G661 D662 I664	F628-V642 HydrophobicContact CB-CG1 4.3Å; F628-V642 HydrophobicContact CD2-CG1 4.42Å; F628-V642 HydrophobicContact CD2-CG2 4.3Å; V642-I645 HydrophobicContact CG1-CD1 4.09Å; V642-I645 HydrophobicContact CG1-CG1 3.74Å; V642-L658 HydrophobicContact CG1-CD2 4.01Å; V642-L658 HydrophobicContact CG1-CG 4.31Å; V642-L658 HydrophobicContact CG2-CD1 3.99Å; V642-L658 HydrophobicContact CG2-CD2 3.9Å; V642-L658 HydrophobicContact CG2-CG 4.04Å; V642-N659 WeakPolarHBondContact CB-O 3.28Å; V642-N659 WeakPolarHBondContact CG1-O 3.36Å; V642-G661 PolarHBondContact O-N 3.18Å; V642-D662 HydrophobicContact CG2-CB 4.29Å; V642-D662 PolarHBondContact N-O 3.01Å; V642-I664 HydrophobicContact CG2-CD1 3.85Å; V642-I664 HydrophobicContact CG2-CG1 3.98Å
643	S	90.2	Very high	86.2	Confident	33 Å²	33	60.8 Å²	60.8	23%	0.231	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	-15.1	-165.5	68.6	0	0	0	0	115	N629 L630 K631 V641	N629-S643 WeakPolarHBondContact CB-OG 3.13Å; N629-S643 PolarHBondContact O-N 3.18Å; N629-S643 PolarHBondContact O-OG 3.47Å; L630-S643 PolarHBondContact O-OG 3.31Å; K631-S643 VanDerWaalsContact CG-CB 3.48Å; V641-S643 PolarHBondContact O-N 3.14Å
644	R	88	Confident	86.3	Confident	153 Å²	153	61.2 Å²	61.2	58%	0.577	32%	0.321	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-160.8	148.8	163.1	178.8	173	-69	-171.3	-2.6	109	F628 N629 E660	F628-R644 CarbonylContact C-O 3.49Å; F628-R644 WeakPolarHBondContact CA-O 3.2Å; N629-R644 HydrophobicContact CB-CB 4.16Å; N629-R644 PolarHBondContact N-O 3.4Å; R644-E660 WeakPolarHBondContact CA-OE1 3.34Å
645	I	89.2	Confident	86	Confident	16 Å²	16	65.4 Å²	65.4	8%	0.082	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	136.9	164.7	-62	173.7	0	0	0	108.8	F628 V642 A651 D652 L658 E660	F628-I645 HydrophobicContact CB-CG1 4.17Å; V642-I645 HydrophobicContact CG1-CD1 4.09Å; V642-I645 HydrophobicContact CG1-CG1 3.74Å; I645-A651 HydrophobicContact CG2-CB 4.2Å; I645-D652 HydrophobicContact CG2-CB 3.76Å; I645-L658 HydrophobicContact CD1-CB 3.83Å; I645-L658 HydrophobicContact CD1-CD2 4.07Å; I645-L658 HydrophobicContact CD1-CG 3.9Å; I645-L658 WeakPolarHBondContact CD1-O 3.36Å; I645-L658 HydrophobicContact CG1-CD2 4.4Å; I645-E660 HydrophobicContact CB-CG 4.48Å; I645-E660 HydrophobicContact CD1-CG 4.47Å; I645-E660 HydrophobicContact CG1-CG 4.17Å; I645-E660 PolarHBondContact N-OE1 3.35Å
646	N	86.9	Confident	85.9	Confident	62 Å²	62	65.6 Å²	65.6	33%	0.332	34%	0.342	S	S	.	.			trans	-79.2	128.4	172.8	-65.5	-7.3	0	0	0	108.5	G627 S649 D652	G627-N646 VanDerWaalsContact O-CB 3.31Å; G627-N646 WeakPolarHBondContact O-CB 3.28Å; G627-N646 PolarHBondContact O-N 2.9Å; N646-S649 VanDerWaalsContact O-CB 3.3Å; N646-S649 WeakPolarHBondContact O-CB 3.34Å; N646-S649 PolarHBondContact O-N 3.44Å; N646-S649 PolarHBondContact O-OG 2.91Å; N646-D652 WeakPolarHBondContact O-CB 3.38Å
647	P	84	Confident	85.8	Confident	105 Å²	105	66.9 Å²	66.9	68%	0.682	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.5	150.5	171.4	-26.6	35.2	0	0	0	112.5	S649	P647-S649 PolarHBondContact O-N 2.82Å
648	E	82.9	Confident	86.2	Confident	176 Å²	176	59.2 Å²	59.2	82%	0.822	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.1	-9.5	176.9	-54.9	-178.4	167.7	0	0	115.5	D652	E648-D652 PolarHBondContact N-OD2 3.46Å
649	S	87.8	Confident	86.4	Confident	13 Å²	13	57.8 Å²	57.8	9%	0.091	31%	0.308	C	S	.	.	S	Bend	trans	-72.1	166.9	-178.8	77.3	0	0	0	0	112.9	G627 N646 P647 A651 D652 T653	G627-S649 WeakPolarHBondContact CA-OG 3.31Å; G627-S649 PolarHBondContact O-OG 3.25Å; N646-S649 VanDerWaalsContact O-CB 3.3Å; N646-S649 WeakPolarHBondContact O-CB 3.34Å; N646-S649 PolarHBondContact O-N 3.44Å; N646-S649 PolarHBondContact O-OG 2.91Å; P647-S649 PolarHBondContact O-N 2.82Å; S649-A651 PolarHBondContact O-N 3.39Å; S649-D652 WeakPolarHBondContact O-CB 3.5Å; S649-D652 PolarHBondContact O-N 2.85Å; S649-T653 PolarHBondContact O-N 2.68Å; S649-T653 PolarHBondContact O-OG1 3.4Å
650	P	87.6	Confident	86.6	Confident	21 Å²	21	59.5 Å²	59.5	14%	0.136	31%	0.309	C	S	.	.	H	α-helix	trans	-58	-31.1	178.3	-27.5	36	0	0	0	114.9	I618 T619 D621 T653 C654	I618-P650 HydrophobicContact CG2-CB 3.52Å; T619-P650 WeakPolarHBondContact O-CB 3.45Å; D621-P650 HydrophobicContact CB-CG 3.91Å; P650-T653 WeakPolarHBondContact CA-OG1 3.23Å; P650-T653 PolarHBondContact O-OG1 3.36Å; P650-C654 WeakPolarHBondContact O-CB 3.14Å; P650-C654 PolarHBondContact O-N 2.93Å
651	A	87.9	Confident	86.4	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-72.8	-27.6	174.4	0	0	0	0	0	113.5	I618 F626 F628 I645 S649 C654 L658	I618-A651 HydrophobicContact CD1-CB 4.12Å; F626-A651 WeakPolarHBondContact O-CB 3.46Å; F626-A651 PolarHBondContact O-N 3.2Å; F628-A651 HydrophobicContact CB-CB 3.93Å; F628-A651 HydrophobicContact CD1-CB 3.88Å; F628-A651 HydrophobicContact CG-CB 4.32Å; I645-A651 HydrophobicContact CG2-CB 4.2Å; S649-A651 PolarHBondContact O-N 3.39Å; A651-C654 PolarHBondContact O-SG 3Å; A651-L658 HydrophobicContact CB-CD2 4.03Å
652	D	88.8	Confident	86.4	Confident	43 Å²	43	59.6 Å²	59.6	23%	0.23	32%	0.319	C	S	.	.	H	α-helix	trans	-79.6	-30	176.4	-167.7	48.6	0	0	0	112.4	I645 N646 E648 S649 K657	I645-D652 HydrophobicContact CG2-CB 3.76Å; N646-D652 WeakPolarHBondContact O-CB 3.38Å; E648-D652 PolarHBondContact N-OD2 3.46Å; S649-D652 WeakPolarHBondContact O-CB 3.5Å; S649-D652 PolarHBondContact O-N 2.85Å; D652-K657 VanDerWaalsContact CG-NZ 3.33Å; D652-K657 WeakPolarHBondContact O-CD 3.26Å; D652-K657 VanDerWaalsContact O-CE 3.24Å; D652-K657 WeakPolarHBondContact O-CE 3.46Å; D652-K657 PolarHBondContact O-NZ 2.86Å; D652-K657 VanDerWaalsContact OD1-CE 3.31Å; D652-K657 WeakPolarHBondContact OD1-CE 3.24Å; D652-K657 IonicContact OD1-NZ 2.76Å; D652-K657 PolarHBondContact OD1-NZ 3.02Å; D652-K657 IonicContact OD2-NZ 2.72Å
653	T	84.7	Confident	86.3	Confident	91 Å²	91	62 Å²	62	56%	0.558	33%	0.331	S	S	*	.	H	α-helix	trans	-100	-8.2	-176.9	53.8	0	0	0	0	114.3	S649 P650	S649-T653 PolarHBondContact O-N 2.68Å; S649-T653 PolarHBondContact O-OG1 3.4Å; P650-T653 WeakPolarHBondContact CA-OG1 3.23Å; P650-T653 PolarHBondContact O-OG1 3.36Å
654	C	85.2	Confident	86.3	Confident	12 Å²	12	60.6 Å²	60.6	8%	0.081	32%	0.321	C	S	.	.			trans	-63.1	156.6	179.1	65.5	0	0	0	0	113.7	I616 I618 P650 A651 P656 K657	I616-C654 HydrophobicContact CG2-CB 4.28Å; I616-C654 VanDerWaalsContact CG2-SG 3.59Å; I618-C654 HydrophobicContact CG1-CB 4.2Å; P650-C654 WeakPolarHBondContact O-CB 3.14Å; P650-C654 PolarHBondContact O-N 2.93Å; A651-C654 PolarHBondContact O-SG 3Å; C654-P656 CarbonylContact O-C 3.49Å; C654-P656 PolarHBondContact SG-O 3.22Å; C654-P656 VanDerWaalsContact SG-O 3.41Å; C654-K657 WeakPolarHBondContact O-CA 3.37Å; C654-K657 PolarHBondContact O-N 2.98Å; C654-K657 VanDerWaalsContact O-N 3.11Å
655	M	76.5	Confident	86.3	Confident	156 Å²	156	54.3 Å²	54.3	77%	0.768	30%	0.299	S	S	*	.	S	Bend	trans	-127.7	118.1	177.2	-74.8	-95.1	78.3	0	0	109.7
656	P	82.3	Confident	86.3	Confident	53 Å²	53	54.6 Å²	54.6	34%	0.344	30%	0.3	S	S	.	.	S	Bend	cis	-62.1	144.2	-5.5	-19.3	32.9	0	0	0	112.6	V614 L615 I616 C654	V614-P656 HydrophobicContact CG1-CB 3.99Å; V614-P656 HydrophobicContact CG1-CG 3.85Å; L615-P656 WeakPolarHBondContact O-CD 3.33Å; I616-P656 HydrophobicContact CG1-CB 4.31Å; I616-P656 WeakPolarHBondContact CG1-O 3.42Å; C654-P656 CarbonylContact O-C 3.49Å; C654-P656 PolarHBondContact SG-O 3.22Å; C654-P656 VanDerWaalsContact SG-O 3.41Å
657	K	83.3	Confident	86.4	Confident	85 Å²	85	51.7 Å²	51.7	37%	0.37	29%	0.285	S	S	.	.	P	Polyproline II helix	trans	-61.3	138.7	177.6	178.7	158.6	-175.1	141.9	0	111	D652 C654 R701	D652-K657 VanDerWaalsContact CG-NZ 3.33Å; D652-K657 WeakPolarHBondContact O-CD 3.26Å; D652-K657 VanDerWaalsContact O-CE 3.24Å; D652-K657 WeakPolarHBondContact O-CE 3.46Å; D652-K657 PolarHBondContact O-NZ 2.86Å; D652-K657 VanDerWaalsContact OD1-CE 3.31Å; D652-K657 WeakPolarHBondContact OD1-CE 3.24Å; D652-K657 IonicContact OD1-NZ 2.76Å; D652-K657 PolarHBondContact OD1-NZ 3.02Å; D652-K657 IonicContact OD2-NZ 2.72Å; C654-K657 WeakPolarHBondContact O-CA 3.37Å; C654-K657 PolarHBondContact O-N 2.98Å; C654-K657 VanDerWaalsContact O-N 3.11Å; K657-R701 PolarHBondContact O-NH2 2.8Å
658	L	88.7	Confident	86.5	Confident	1 Å²	1	47 Å²	47	1%	0.005	25%	0.254	C	S	.	.	P	Polyproline II helix	trans	-79.1	143.2	170	-166.7	71.3	0	0	0	109.4	I616 I618 F628 V642 I645 A651 D662 L697 I699	I616-L658 HydrophobicContact CD1-CB 4.07Å; I616-L658 HydrophobicContact CD1-CD1 3.57Å; I616-L658 HydrophobicContact CD1-CG 4.46Å; I618-L658 HydrophobicContact CD1-CD2 4.41Å; F628-L658 HydrophobicContact CB-CD2 4Å; F628-L658 HydrophobicContact CD1-CD2 4.18Å; F628-L658 HydrophobicContact CD2-CD2 4.24Å; F628-L658 HydrophobicContact CG-CD2 3.87Å; V642-L658 HydrophobicContact CG1-CD2 4.01Å; V642-L658 HydrophobicContact CG1-CG 4.31Å; V642-L658 HydrophobicContact CG2-CD1 3.99Å; V642-L658 HydrophobicContact CG2-CD2 3.9Å; V642-L658 HydrophobicContact CG2-CG 4.04Å; I645-L658 HydrophobicContact CD1-CB 3.83Å; I645-L658 HydrophobicContact CD1-CD2 4.07Å; I645-L658 HydrophobicContact CD1-CG 3.9Å; I645-L658 WeakPolarHBondContact CD1-O 3.36Å; I645-L658 HydrophobicContact CG1-CD2 4.4Å; A651-L658 HydrophobicContact CB-CD2 4.03Å; L658-D662 HydrophobicContact CD1-CB 4.46Å; L658-L697 HydrophobicContact CD1-CD1 4.24Å; L658-I699 HydrophobicContact CD1-CD1 4.38Å; L658-I699 HydrophobicContact CD1-CG2 4.05Å
659	N	87.2	Confident	86	Confident	67 Å²	67	39 Å²	39	36%	0.358	22%	0.218	S	C	.	.			trans	-112.8	155.1	172.5	-65.4	0.8	0	0	0	111.6	V642 D662 R701	V642-N659 WeakPolarHBondContact CB-O 3.28Å; V642-N659 WeakPolarHBondContact CG1-O 3.36Å; N659-D662 WeakPolarHBondContact CB-OD2 3.21Å; N659-D662 PolarHBondContact N-OD2 2.82Å; N659-D662 WeakPolarHBondContact O-CB 3.25Å; N659-D662 PolarHBondContact O-N 3.15Å; N659-R701 PolarHBondContact ND2-NH2 3.43Å; N659-R701 PolarHBondContact OD1-NH2 2.85Å
660	E	87.7	Confident	85.7	Confident	112 Å²	112	40.6 Å²	40.6	52%	0.523	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.9	137.5	158.3	-55.8	-170.7	172	0	0	109.5	R644 I645	R644-E660 WeakPolarHBondContact CA-OE1 3.34Å; I645-E660 HydrophobicContact CB-CG 4.48Å; I645-E660 HydrophobicContact CD1-CG 4.47Å; I645-E660 HydrophobicContact CG1-CG 4.17Å; I645-E660 PolarHBondContact N-OE1 3.35Å
661	G	83.7	Confident	85.5	Confident	47 Å²	47	39.7 Å²	39.7	49%	0.485	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	89.4	-8.5	-172.5	0	0	0	0	0	115.4	V642 Q663	V642-G661 PolarHBondContact O-N 3.18Å; G661-Q663 PolarHBondContact O-N 3.19Å
662	D	89.9	Confident	85.5	Confident	5 Å²	5	39.7 Å²	39.7	3%	0.027	22%	0.217	C	C	.	.	P	Polyproline II helix	trans	-66.5	121.3	175.5	-75.6	-16.4	0	0	0	110.8	V641 V642 L658 N659 I664 I699 R701	V641-D662 WeakPolarHBondContact CA-O 3.43Å; V642-D662 HydrophobicContact CG2-CB 4.29Å; V642-D662 PolarHBondContact N-O 3.01Å; L658-D662 HydrophobicContact CD1-CB 4.46Å; N659-D662 WeakPolarHBondContact CB-OD2 3.21Å; N659-D662 PolarHBondContact N-OD2 2.82Å; N659-D662 WeakPolarHBondContact O-CB 3.25Å; N659-D662 PolarHBondContact O-N 3.15Å; D662-I664 PolarHBondContact O-N 3.27Å; D662-I699 HydrophobicContact CB-CB 4.24Å; D662-I699 HydrophobicContact CB-CD1 3.79Å; D662-I699 HydrophobicContact CB-CG2 4.25Å; D662-I699 VanDerWaalsContact CG-CD1 3.43Å; D662-I699 WeakPolarHBondContact OD2-CD1 3.26Å; D662-R701 WeakPolarHBondContact OD1-CG 3.2Å; D662-R701 IonicContact OD1-NE 3.68Å; D662-R701 IonicContact OD2-NE 3.73Å; D662-R701 IonicContact OD2-NH2 3.89Å
663	Q	90.3	Very high	85	Confident	51 Å²	51	39.7 Å²	39.7	24%	0.238	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	117.8	178.2	178.9	-175.1	8.7	0	0	109.3	P639 L640 V641 G661 I699 R700	P639-Q663 HydrophobicContact CB-CG 4.22Å; L640-Q663 CarbonylContact O-C 3.6Å; L640-Q663 WeakPolarHBondContact O-CA 3.2Å; L640-Q663 WeakPolarHBondContact O-CG 3.19Å; V641-Q663 HydrophobicContact CG2-CB 4.27Å; V641-Q663 HydrophobicContact CG2-CG 4.45Å; G661-Q663 PolarHBondContact O-N 3.19Å; Q663-I699 CarbonylContact O-C 3.55Å; Q663-I699 WeakPolarHBondContact O-CA 3.5Å; Q663-R700 HydrophobicContact CB-CB 4.37Å; Q663-R700 PolarHBondContact N-O 2.87Å; Q663-R700 PolarHBondContact O-N 3.47Å; Q663-R700 VanDerWaalsContact OE1-NH1 3.07Å
664	I	90.1	Very high	84.8	Confident	4 Å²	4	41.1 Å²	41.1	2%	0.021	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	130.2	175.3	-35	-167.3	0	0	0	109.7	F628 L630 L640 V642 D662 I667 I672 L697 I699	F628-I664 HydrophobicContact CE2-CD1 4Å; L630-I664 HydrophobicContact CD1-CD1 3.41Å; L630-I664 VanDerWaalsContact CD1-CD1 3.41Å; L630-I664 HydrophobicContact CD1-CG1 3.96Å; L640-I664 PolarHBondContact O-N 3.27Å; V642-I664 HydrophobicContact CG2-CD1 3.85Å; V642-I664 HydrophobicContact CG2-CG1 3.98Å; D662-I664 PolarHBondContact O-N 3.27Å; I664-I667 HydrophobicContact CD1-CD1 4.2Å; I664-I667 HydrophobicContact CG2-CD1 3.96Å; I664-I667 HydrophobicContact CG2-CG1 3.58Å; I664-I672 HydrophobicContact CB-CD1 3.84Å; I664-I672 HydrophobicContact CG2-CD1 3.9Å; I664-I672 VanDerWaalsContact O-CD1 3.32Å; I664-I672 WeakPolarHBondContact O-CD1 3.3Å; I664-L697 HydrophobicContact CD1-CD1 4.27Å; I664-L697 HydrophobicContact CD1-CD2 4.09Å; I664-L697 HydrophobicContact CG2-CB 3.93Å; I664-L697 HydrophobicContact CG2-CD2 4.22Å; I664-L697 HydrophobicContact CG2-CG 4.5Å; I664-I699 HydrophobicContact CB-CG2 4.45Å; I664-I699 HydrophobicContact CG1-CG2 4.21Å; I664-I699 HydrophobicContact CG2-CG2 4.28Å
665	V	87.9	Confident	84.6	Confident	21 Å²	21	42.1 Å²	42.1	13%	0.127	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	-38.1	-177.9	-175	0	0	0	0	110.9	L613 I672 V698 R700	L613-V665 HydrophobicContact CD2-CG2 4.2Å; V665-I672 WeakPolarHBondContact O-CG1 3.11Å; V665-V698 PolarHBondContact N-O 3.26Å; V665-R700 HydrophobicContact CG2-CB 3.94Å
666	L	88.8	Confident	85.2	Confident	21 Å²	21	36.2 Å²	36.2	11%	0.11	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	141.1	175.6	-43	172.7	0	0	0	110.9	G669 R670 D671 L697 V698	L666-G669 WeakPolarHBondContact CB-O 3.44Å; L666-R670 VanDerWaalsContact CA-O 3.29Å; L666-R670 WeakPolarHBondContact CA-O 3.34Å; L666-D671 HydrophobicContact CD2-CB 3.88Å; L666-L697 WeakPolarHBondContact O-CB 3.48Å; L666-V698 HydrophobicContact CB-CB 3.86Å; L666-V698 HydrophobicContact CB-CG2 4.24Å; L666-V698 HydrophobicContact CD1-CB 4.06Å; L666-V698 HydrophobicContact CD1-CG1 4.31Å; L666-V698 HydrophobicContact CD1-CG2 4.02Å; L666-V698 HydrophobicContact CG-CB 4.03Å; L666-V698 HydrophobicContact CG-CG1 4.41Å; L666-V698 HydrophobicContact CG-CG2 4.47Å; L666-V698 PolarHBondContact N-O 2.98Å; L666-V698 VanDerWaalsContact N-O 3.12Å; L666-V698 PolarHBondContact O-N 3.23Å
667	I	88.9	Confident	85.4	Confident	1 Å²	1	35.4 Å²	35.4	1%	0.005	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	117.6	-179.9	-68.6	-161.1	0	0	0	111.5	I664 G669 R670 I672 V680 F683 I684 L695 L697	I664-I667 HydrophobicContact CD1-CD1 4.2Å; I664-I667 HydrophobicContact CG2-CD1 3.96Å; I664-I667 HydrophobicContact CG2-CG1 3.58Å; I667-G669 PolarHBondContact O-N 2.9Å; I667-R670 PolarHBondContact N-O 3.41Å; I667-R670 WeakPolarHBondContact O-CB 3.44Å; I667-R670 PolarHBondContact O-N 3.07Å; I667-R670 VanDerWaalsContact O-N 3.08Å; I667-I672 HydrophobicContact CB-CG2 4.07Å; I667-I672 HydrophobicContact CD1-CD1 4.05Å; I667-I672 HydrophobicContact CG1-CD1 3.78Å; I667-I672 HydrophobicContact CG1-CG1 4.46Å; I667-I672 HydrophobicContact CG1-CG2 4.15Å; I667-V680 HydrophobicContact CD1-CG1 3.4Å; I667-V680 HydrophobicContact CG1-CG1 4.38Å; I667-F683 HydrophobicContact CG2-CB 3.9Å; I667-I684 HydrophobicContact CD1-CD1 3.72Å; I667-I684 HydrophobicContact CD1-CG1 3.66Å; I667-I684 HydrophobicContact CG2-CG1 3.74Å; I667-L695 HydrophobicContact CG2-CD1 4.12Å; I667-L697 HydrophobicContact CB-CD2 4.34Å; I667-L697 HydrophobicContact CD1-CD2 3.76Å; I667-L697 HydrophobicContact CG1-CB 4.49Å; I667-L697 HydrophobicContact CG1-CD2 3.71Å; I667-L697 HydrophobicContact CG2-CD2 4.17Å
668	N	85.4	Confident	85.5	Confident	7 Å²	7	32.6 Å²	32.6	4%	0.037	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	39.1	58.5	-151.1	-84.2	1.5	0	0	0	107.2	C354 T355 R670 S687 E694 L695 A696	C354-N668 VanDerWaalsContact O-CB 3.29Å; C354-N668 WeakPolarHBondContact O-CB 3.44Å; C354-N668 VanDerWaalsContact O-O 3.11Å; T355-N668 CarbonylContact C-O 3.49Å; T355-N668 WeakPolarHBondContact CA-O 3.5Å; N668-R670 PolarHBondContact O-N 3.44Å; N668-S687 VanDerWaalsContact ND2-CB 3.33Å; N668-S687 WeakPolarHBondContact ND2-CB 3.48Å; N668-E694 PolarHBondContact ND2-O 2.94Å; N668-E694 PolarHBondContact OD1-O 3.12Å; N668-L695 VanDerWaalsContact OD1-CA 3.31Å; N668-L695 WeakPolarHBondContact OD1-CA 3.46Å; N668-A696 WeakPolarHBondContact CA-O 3.38Å; N668-A696 PolarHBondContact N-O 2.98Å; N668-A696 PolarHBondContact OD1-N 3.3Å
669	G	74	Confident	85.5	Confident	7 Å²	7	35.6 Å²	35.6	7%	0.072	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.3	-16.2	-178.1	0	0	0	0	0	119.3	T355 S356 F357 L666 I667 D671	T355-G669 CarbonylContact O-C 3.47Å; S356-G669 CarbonylContact C-O 3.59Å; S356-G669 WeakPolarHBondContact CA-O 3.4Å; F357-G669 PolarHBondContact N-O 3.28Å; L666-G669 WeakPolarHBondContact CB-O 3.44Å; I667-G669 PolarHBondContact O-N 2.9Å; G669-D671 PolarHBondContact O-N 3.39Å
670	R	80.7	Confident	85.6	Confident	47 Å²	47	32.4 Å²	32.4	18%	0.177	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	124.7	179.8	-177.5	174.4	-75.9	-155.4	0.9	108.8	C354 T355 F357 L666 I667 N668 I672 F683	C354-R670 PolarHBondContact SG-NE 2.89Å; C354-R670 PolarHBondContact SG-NH2 2.85Å; T355-R670 PolarHBondContact O-N 3.16Å; F357-R670 HydrophobicContact CB-CB 4.19Å; F357-R670 HydrophobicContact CB-CG 3.85Å; L666-R670 VanDerWaalsContact CA-O 3.29Å; L666-R670 WeakPolarHBondContact CA-O 3.34Å; I667-R670 PolarHBondContact N-O 3.41Å; I667-R670 WeakPolarHBondContact O-CB 3.44Å; I667-R670 PolarHBondContact O-N 3.07Å; I667-R670 VanDerWaalsContact O-N 3.08Å; N668-R670 PolarHBondContact O-N 3.44Å; R670-I672 PolarHBondContact O-N 3.32Å; R670-F683 VanDerWaalsContact CD-CE2 3.44Å; R670-F683 HydrophobicContact CG-CD2 4.36Å; R670-F683 HydrophobicContact CG-CE2 4.3Å
671	D	83.8	Confident	85.6	Confident	2 Å²	2	28.7 Å²	28.7	1%	0.011	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.8	120.3	174.9	-171.7	-10.4	0	0	0	109.1	F357 P359 N362 K380 L666 G669 S673 H675	F357-D671 VanDerWaalsContact O-CB 3.27Å; F357-D671 WeakPolarHBondContact O-CB 3.39Å; F357-D671 PolarHBondContact O-N 3.2Å; P359-D671 HydrophobicContact CG-CB 4.45Å; N362-D671 PolarHBondContact ND2-OD2 3.45Å; K380-D671 IonicContact NZ-OD1 3.67Å; K380-D671 IonicContact NZ-OD2 3.4Å; L666-D671 HydrophobicContact CD2-CB 3.88Å; G669-D671 PolarHBondContact O-N 3.39Å; D671-S673 VanDerWaalsContact CG-OG 3.25Å; D671-S673 WeakPolarHBondContact OD1-CB 3.42Å; D671-S673 PolarHBondContact OD1-N 2.81Å; D671-S673 PolarHBondContact OD1-OG 3.02Å; D671-S673 PolarHBondContact OD2-OG 2.88Å; D671-H675 PolarHBondContact O-CE1 2.99Å; D671-H675 PolarHBondContact O-ND1 2.66Å
672	I	86.8	Confident	85.7	Confident	1 Å²	1	27.4 Å²	27.4	1%	0.005	14%	0.141	C	C	.	.			trans	-102.1	3.5	-172.8	44.8	158.5	0	0	0	113	L640 I664 V665 I667 R670 E674 H675 V680 F683	L640-I672 HydrophobicContact CB-CD1 4.01Å; L640-I672 HydrophobicContact CD1-CB 3.8Å; L640-I672 HydrophobicContact CD1-CD1 3.58Å; L640-I672 HydrophobicContact CD1-CG1 3.99Å; L640-I672 WeakPolarHBondContact CD1-O 3.49Å; L640-I672 HydrophobicContact CG-CD1 4.38Å; I664-I672 HydrophobicContact CB-CD1 3.84Å; I664-I672 HydrophobicContact CG2-CD1 3.9Å; I664-I672 VanDerWaalsContact O-CD1 3.32Å; I664-I672 WeakPolarHBondContact O-CD1 3.3Å; V665-I672 WeakPolarHBondContact O-CG1 3.11Å; I667-I672 HydrophobicContact CB-CG2 4.07Å; I667-I672 HydrophobicContact CD1-CD1 4.05Å; I667-I672 HydrophobicContact CG1-CD1 3.78Å; I667-I672 HydrophobicContact CG1-CG1 4.46Å; I667-I672 HydrophobicContact CG1-CG2 4.15Å; R670-I672 PolarHBondContact O-N 3.32Å; I672-E674 PolarHBondContact O-N 2.83Å; I672-H675 PolarHBondContact O-N 3.38Å; I672-V680 HydrophobicContact CB-CG1 4.37Å; I672-V680 HydrophobicContact CB-CG2 3.9Å; I672-V680 HydrophobicContact CD1-CG1 4.25Å; I672-V680 HydrophobicContact CG2-CB 4.44Å; I672-V680 HydrophobicContact CG2-CG1 3.97Å; I672-V680 HydrophobicContact CG2-CG2 3.85Å; I672-F683 HydrophobicContact CG2-CD2 4.1Å; I672-F683 HydrophobicContact CG2-CE2 4.46Å
673	S	78.2	Confident	85.5	Confident	42 Å²	42	28.6 Å²	28.6	29%	0.294	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.7	-46.6	178.3	44.1	0	0	0	0	113.6	D671 H675	D671-S673 VanDerWaalsContact CG-OG 3.25Å; D671-S673 WeakPolarHBondContact OD1-CB 3.42Å; D671-S673 PolarHBondContact OD1-N 2.81Å; D671-S673 PolarHBondContact OD1-OG 3.02Å; D671-S673 PolarHBondContact OD2-OG 2.88Å; S673-H675 VanDerWaalsContact C-N 3.32Å; S673-H675 PolarHBondContact O-N 3.33Å
674	E	81.3	Confident	85.3	Confident	122 Å²	122	27 Å²	27	57%	0.57	14%	0.139	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.3	9.3	-178.1	-49.8	-50	123.7	0	0	113.9	I672	I672-E674 PolarHBondContact O-N 2.83Å
675	H	82	Confident	85.1	Confident	32 Å²	32	31.4 Å²	31.4	15%	0.148	16%	0.157	C	C	.	.			trans	-105.6	142.2	-172.5	-71.1	103.9	0	0	0	112.4	V634 D671 I672 S673 Q679 V680 F683	V634-H675 PolarHBondContact N-O 2.92Å; D671-H675 PolarHBondContact O-CE1 2.99Å; D671-H675 PolarHBondContact O-ND1 2.66Å; I672-H675 PolarHBondContact O-N 3.38Å; S673-H675 VanDerWaalsContact C-N 3.32Å; S673-H675 PolarHBondContact O-N 3.33Å; H675-Q679 VanDerWaalsContact CA-OE1 3.31Å; H675-Q679 HydrophobicContact CB-CB 4.15Å; H675-Q679 PolarHBondContact CD2-OE1 2.6Å; H675-V680 HydrophobicContact CB-CG2 3.61Å; H675-F683 HydrophobicContact CB-CE2 4.17Å; H675-F683 AromaticContact CD2-CE2 3.44Å; H675-F683 VanDerWaalsContact CD2-CE2 3.44Å; H675-F683 WeakPolarHBondContact CD2-CE2 3.43Å; H675-F683 AromaticContact CD2-CZ 3.45Å; H675-F683 VanDerWaalsContact CD2-CZ 3.45Å; H675-F683 WeakPolarHBondContact CD2-CZ 3.43Å; H675-F683 AromaticContact CE1-CE2 3.93Å; H675-F683 AromaticContact CG-CE2 3.64Å; H675-F683 AromaticContact ND1-CE2 3.94Å; H675-F683 AromaticContact NE2-CE2 3.62Å; H675-F683 AromaticContact NE2-CZ 3.48Å; H675-F683 WeakPolarHBondContact NE2-CZ 3.44Å
676	T	88.1	Confident	84.8	Confident	33 Å²	33	32.1 Å²	32.1	20%	0.202	17%	0.165	C	C	.	.			trans	-70.8	157.2	176	72.3	0	0	0	0	111.4	V634 D635 D678 Q679 V680	V634-T676 HydrophobicContact CG1-CG2 3.98Å; D635-T676 HydrophobicContact CB-CG2 4.08Å; D635-T676 WeakPolarHBondContact OD1-CA 3.5Å; D635-T676 WeakPolarHBondContact OD1-CB 3.39Å; T676-D678 PolarHBondContact O-N 3.04Å; T676-Q679 CarbonylContact O-C 3.6Å; T676-Q679 WeakPolarHBondContact O-CA 3.37Å; T676-Q679 WeakPolarHBondContact O-CB 3.21Å; T676-Q679 PolarHBondContact O-N 3.27Å; T676-Q679 VanDerWaalsContact OG1-CG 3.28Å; T676-Q679 WeakPolarHBondContact OG1-CG 3.29Å; T676-Q679 PolarHBondContact OG1-N 2.7Å; T676-Q679 VanDerWaalsContact OG1-N 3.15Å; T676-V680 WeakPolarHBondContact O-CG2 3.38Å; T676-V680 PolarHBondContact O-N 2.77Å
677	H	87.3	Confident	84.3	Confident	35 Å²	35	31.1 Å²	31.1	16%	0.162	16%	0.16	C	C	.	.	H	α-helix	trans	-45.6	-50.2	174.1	-175.1	80.7	0	0	0	111.5	G632 D635 Q636 V680 V681	G632-H677 WeakPolarHBondContact O-CB 3.39Å; G632-H677 PolarHBondContact O-ND1 2.92Å; D635-H677 PolarHBondContact OD1-N 3.32Å; Q636-H677 HydrophobicContact CG-CB 4.37Å; Q636-H677 VanDerWaalsContact NE2-CB 3.33Å; Q636-H677 VanDerWaalsContact NE2-CG 3.31Å; H677-V680 PolarHBondContact O-N 3.4Å; H677-V681 WeakPolarHBondContact O-CB 3.41Å; H677-V681 WeakPolarHBondContact O-CG2 3.42Å; H677-V681 PolarHBondContact O-N 2.89Å
678	D	85.5	Confident	83.7	Confident	26 Å²	26	35.8 Å²	35.8	14%	0.139	18%	0.178	C	C	.	.	H	α-helix	trans	-64.1	-44.5	179.1	-62.3	-67.2	0	0	0	112.1	T676 V680 V681 M682 H917	T676-D678 PolarHBondContact O-N 3.04Å; D678-V680 VanDerWaalsContact C-N 3.32Å; D678-V680 PolarHBondContact O-N 3.44Å; D678-V681 CarbonylContact O-C 3.55Å; D678-V681 PolarHBondContact O-N 3.43Å; D678-M682 WeakPolarHBondContact O-CG 3.17Å; D678-M682 PolarHBondContact O-N 2.9Å; D678-H917 WeakPolarHBondContact CB-NE2 3.43Å; D678-H917 VanDerWaalsContact CG-NE2 3.26Å; D678-H917 IonicContact OD1-CE1 2.62Å; D678-H917 PolarHBondContact OD1-CE1 3.32Å; D678-H917 IonicContact OD1-NE2 2.66Å; D678-H917 PolarHBondContact OD1-NE2 2.78Å; D678-H917 IonicContact OD2-CD2 3.91Å; D678-H917 IonicContact OD2-CE1 2.68Å; D678-H917 PolarHBondContact OD2-CE1 2.68Å; D678-H917 IonicContact OD2-CG 2.88Å; D678-H917 IonicContact OD2-ND1 2.77Å; D678-H917 PolarHBondContact OD2-ND1 2.81Å; D678-H917 IonicContact OD2-NE2 3.48Å
679	Q	88.3	Confident	82.8	Confident	65 Å²	65	40.7 Å²	40.7	30%	0.304	20%	0.201	S	C	.	.	H	α-helix	trans	-60.3	-39.1	174	-72.3	169.1	-3.7	0	0	112.5	H675 T676 M682 F683	H675-Q679 VanDerWaalsContact CA-OE1 3.31Å; H675-Q679 HydrophobicContact CB-CB 4.15Å; H675-Q679 PolarHBondContact CD2-OE1 2.6Å; T676-Q679 CarbonylContact O-C 3.6Å; T676-Q679 WeakPolarHBondContact O-CA 3.37Å; T676-Q679 WeakPolarHBondContact O-CB 3.21Å; T676-Q679 PolarHBondContact O-N 3.27Å; T676-Q679 VanDerWaalsContact OG1-CG 3.28Å; T676-Q679 WeakPolarHBondContact OG1-CG 3.29Å; T676-Q679 PolarHBondContact OG1-N 2.7Å; T676-Q679 VanDerWaalsContact OG1-N 3.15Å; Q679-M682 CarbonylContact O-C 3.59Å; Q679-M682 VanDerWaalsContact O-CA 3.24Å; Q679-M682 WeakPolarHBondContact O-CA 3.3Å; Q679-M682 WeakPolarHBondContact O-CB 3.48Å; Q679-M682 PolarHBondContact O-N 2.95Å; Q679-F683 HydrophobicContact CB-CE2 4.43Å; Q679-F683 HydrophobicContact CB-CZ 4.24Å; Q679-F683 VanDerWaalsContact O-CD2 3.27Å; Q679-F683 WeakPolarHBondContact O-CD2 3.49Å; Q679-F683 VanDerWaalsContact O-CE2 3.31Å; Q679-F683 WeakPolarHBondContact O-CE2 3.46Å; Q679-F683 WeakPolarHBondContact O-CG 3.16Å; Q679-F683 WeakPolarHBondContact O-CZ 3.13Å; Q679-F683 PolarHBondContact O-N 3.32Å
680	V	87.9	Confident	82.2	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-69	-44.1	178.6	179.4	0	0	0	0	110.3	L630 L640 I667 I672 H675 T676 H677 D678 M682 F683 I684	L630-V680 HydrophobicContact CD2-CB 4.41Å; L630-V680 HydrophobicContact CD2-CG1 3.66Å; L640-V680 HydrophobicContact CD1-CB 4.42Å; L640-V680 HydrophobicContact CD1-CG1 4.21Å; L640-V680 HydrophobicContact CD1-CG2 3.59Å; L640-V680 HydrophobicContact CD2-CB 4.09Å; L640-V680 HydrophobicContact CD2-CG1 3.95Å; L640-V680 HydrophobicContact CD2-CG2 4Å; L640-V680 HydrophobicContact CG-CG2 4.46Å; I667-V680 HydrophobicContact CD1-CG1 3.4Å; I667-V680 HydrophobicContact CG1-CG1 4.38Å; I672-V680 HydrophobicContact CB-CG1 4.37Å; I672-V680 HydrophobicContact CB-CG2 3.9Å; I672-V680 HydrophobicContact CD1-CG1 4.25Å; I672-V680 HydrophobicContact CG2-CB 4.44Å; I672-V680 HydrophobicContact CG2-CG1 3.97Å; I672-V680 HydrophobicContact CG2-CG2 3.85Å; H675-V680 HydrophobicContact CB-CG2 3.61Å; T676-V680 WeakPolarHBondContact O-CG2 3.38Å; T676-V680 PolarHBondContact O-N 2.77Å; H677-V680 PolarHBondContact O-N 3.4Å; D678-V680 VanDerWaalsContact C-N 3.32Å; D678-V680 PolarHBondContact O-N 3.44Å; V680-M682 PolarHBondContact O-N 3.4Å; V680-F683 PolarHBondContact O-N 3.49Å; V680-I684 PolarHBondContact O-N 3.34Å; V680-I684 VanDerWaalsContact O-N 3.11Å
681	V	89.6	Confident	81.2	Confident	33 Å²	33	44.6 Å²	44.6	20%	0.2	22%	0.219	C	C	.	.	H	α-helix	trans	-61.4	-27.8	167.4	172.5	0	0	0	0	110.8	L630 H677 D678 F683 I684 K685 R856	L630-V681 HydrophobicContact CD2-CG2 4.42Å; H677-V681 WeakPolarHBondContact O-CB 3.41Å; H677-V681 WeakPolarHBondContact O-CG2 3.42Å; H677-V681 PolarHBondContact O-N 2.89Å; D678-V681 CarbonylContact O-C 3.55Å; D678-V681 PolarHBondContact O-N 3.43Å; V681-F683 VanDerWaalsContact C-N 3.33Å; V681-I684 PolarHBondContact O-N 2.79Å; V681-K685 PolarHBondContact O-N 2.77Å; V681-R856 PolarHBondContact O-NH1 2.8Å; V681-R856 PolarHBondContact O-NH2 2.78Å
682	M	84.8	Confident	80.4	Confident	21 Å²	21	46 Å²	46	10%	0.103	23%	0.229	C	C	.	.	H	α-helix	trans	-65.4	-30	171.6	-59.3	-141.7	90	0	0	113	D678 Q679 V680 A686 R854 R856	D678-M682 WeakPolarHBondContact O-CG 3.17Å; D678-M682 PolarHBondContact O-N 2.9Å; Q679-M682 CarbonylContact O-C 3.59Å; Q679-M682 VanDerWaalsContact O-CA 3.24Å; Q679-M682 WeakPolarHBondContact O-CA 3.3Å; Q679-M682 WeakPolarHBondContact O-CB 3.48Å; Q679-M682 PolarHBondContact O-N 2.95Å; V680-M682 PolarHBondContact O-N 3.4Å; M682-A686 WeakPolarHBondContact O-CB 3.39Å; M682-R854 HydrophobicContact CE-CB 3.71Å; M682-R854 HydrophobicContact CE-CG 4.06Å; M682-R854 HydrophobicContact SD-CG 4.44Å; M682-R854 PolarHBondContact SD-NH1 2.97Å; M682-R856 VanDerWaalsContact CE-CD 3.45Å; M682-R856 PolarHBondContact O-NH2 2.86Å
683	F	84.7	Confident	79.9	Confident	30 Å²	30	54.5 Å²	54.5	13%	0.132	26%	0.261	C	S	.	.	H	α-helix	trans	-83.1	-36.6	174.1	-46.9	-39	0	0	0	112.1	I667 R670 I672 H675 Q679 V680 V681 A686 S687	I667-F683 HydrophobicContact CG2-CB 3.9Å; R670-F683 VanDerWaalsContact CD-CE2 3.44Å; R670-F683 HydrophobicContact CG-CD2 4.36Å; R670-F683 HydrophobicContact CG-CE2 4.3Å; I672-F683 HydrophobicContact CG2-CD2 4.1Å; I672-F683 HydrophobicContact CG2-CE2 4.46Å; H675-F683 HydrophobicContact CB-CE2 4.17Å; H675-F683 AromaticContact CD2-CE2 3.44Å; H675-F683 VanDerWaalsContact CD2-CE2 3.44Å; H675-F683 WeakPolarHBondContact CD2-CE2 3.43Å; H675-F683 AromaticContact CD2-CZ 3.45Å; H675-F683 VanDerWaalsContact CD2-CZ 3.45Å; H675-F683 WeakPolarHBondContact CD2-CZ 3.43Å; H675-F683 AromaticContact CE1-CE2 3.93Å; H675-F683 AromaticContact CG-CE2 3.64Å; H675-F683 AromaticContact ND1-CE2 3.94Å; H675-F683 AromaticContact NE2-CE2 3.62Å; H675-F683 AromaticContact NE2-CZ 3.48Å; H675-F683 WeakPolarHBondContact NE2-CZ 3.44Å; Q679-F683 HydrophobicContact CB-CE2 4.43Å; Q679-F683 HydrophobicContact CB-CZ 4.24Å; Q679-F683 VanDerWaalsContact O-CD2 3.27Å; Q679-F683 WeakPolarHBondContact O-CD2 3.49Å; Q679-F683 VanDerWaalsContact O-CE2 3.31Å; Q679-F683 WeakPolarHBondContact O-CE2 3.46Å; Q679-F683 WeakPolarHBondContact O-CG 3.16Å; Q679-F683 WeakPolarHBondContact O-CZ 3.13Å; Q679-F683 PolarHBondContact O-N 3.32Å; V680-F683 PolarHBondContact O-N 3.49Å; V681-F683 VanDerWaalsContact C-N 3.33Å; F683-A686 PolarHBondContact O-N 3.44Å; F683-S687 PolarHBondContact O-N 2.67Å
684	I	88.1	Confident	80	Confident	18 Å²	18	54.7 Å²	54.7	9%	0.092	26%	0.257	C	S	.	.	H	α-helix	trans	-59.5	-60.4	179.1	-64.4	171.1	0	0	0	111.8	F626 F628 L630 I667 V680 V681 A686 S687 L695	F626-I684 HydrophobicContact CD2-CG2 4.03Å; F626-I684 HydrophobicContact CE2-CG2 4.44Å; F628-I684 HydrophobicContact CE2-CD1 4.06Å; F628-I684 HydrophobicContact CZ-CD1 3.9Å; F628-I684 HydrophobicContact CZ-CG1 4.48Å; F628-I684 HydrophobicContact CZ-CG2 4.25Å; L630-I684 HydrophobicContact CD2-CD1 3.93Å; I667-I684 HydrophobicContact CD1-CD1 3.72Å; I667-I684 HydrophobicContact CD1-CG1 3.66Å; I667-I684 HydrophobicContact CG2-CG1 3.74Å; V680-I684 PolarHBondContact O-N 3.34Å; V680-I684 VanDerWaalsContact O-N 3.11Å; V681-I684 PolarHBondContact O-N 2.79Å; I684-A686 PolarHBondContact O-N 3.01Å; I684-S687 PolarHBondContact O-N 3.46Å; I684-S687 PolarHBondContact O-OG 3.25Å; I684-L695 HydrophobicContact CG2-CD1 4.47Å; I684-L695 HydrophobicContact CG2-CD2 4Å
685	K	84.8	Confident	80.4	Confident	95 Å²	95	48.9 Å²	48.9	41%	0.413	23%	0.23	S	C	.	.	H	α-helix	trans	-69.4	-19.2	-179.1	-29.3	179.1	-171.8	-179.8	0	113.3	V681 S687 R688	V681-K685 PolarHBondContact O-N 2.77Å; K685-S687 PolarHBondContact O-N 3.01Å; K685-R688 WeakPolarHBondContact O-CB 3.47Å; K685-R688 VanDerWaalsContact O-CD 3.29Å; K685-R688 WeakPolarHBondContact O-CD 3.3Å; K685-R688 WeakPolarHBondContact O-CG 3.45Å; K685-R688 PolarHBondContact O-N 3.27Å; K685-R688 VanDerWaalsContact O-N 3.1Å
686	A	81.1	Confident	80.7	Confident	36 Å²	36	48 Å²	48	30%	0.298	23%	0.228	S	C	.	.	H	α-helix	trans	-71.7	-16.8	175.2	0	0	0	0	0	112.6	M682 F683 I684 R688 S690 R856	M682-A686 WeakPolarHBondContact O-CB 3.39Å; F683-A686 PolarHBondContact O-N 3.44Å; I684-A686 PolarHBondContact O-N 3.01Å; A686-R688 PolarHBondContact O-N 3.27Å; A686-S690 PolarHBondContact O-N 2.78Å; A686-R856 VanDerWaalsContact N-NH2 3.14Å
687	S	79	Confident	80.8	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-10.9	169.4	78.3	0	0	0	0	113.3	F626 N668 F683 I684 K685 S690 E694	F626-S687 VanDerWaalsContact CE2-OG 3.27Å; F626-S687 WeakPolarHBondContact CE2-OG 3.43Å; F626-S687 WeakPolarHBondContact CZ-OG 3.49Å; N668-S687 VanDerWaalsContact ND2-CB 3.33Å; N668-S687 WeakPolarHBondContact ND2-CB 3.48Å; F683-S687 PolarHBondContact O-N 2.67Å; I684-S687 PolarHBondContact O-N 3.46Å; I684-S687 PolarHBondContact O-OG 3.25Å; K685-S687 PolarHBondContact O-N 3.01Å; S687-S690 VanDerWaalsContact O-CB 3.29Å; S687-S690 WeakPolarHBondContact O-CB 3.27Å; S687-S690 PolarHBondContact O-OG 3.3Å; S687-E694 WeakPolarHBondContact CB-O 3.35Å
688	R	77	Confident	80.8	Confident	99 Å²	99	46 Å²	46	37%	0.374	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-48.6	176	-55	167.1	82.8	-144.4	10.2	111.5	E623 G624 F626 K685 A686 S690	E623-R688 PolarHBondContact O-NH2 3.09Å; G624-R688 WeakPolarHBondContact O-CD 3.42Å; G624-R688 WeakPolarHBondContact O-CG 3.49Å; G624-R688 PolarHBondContact O-NE 3.02Å; F626-R688 HydrophobicContact CE2-CG 3.75Å; F626-R688 HydrophobicContact CZ-CG 4.11Å; K685-R688 WeakPolarHBondContact O-CB 3.47Å; K685-R688 VanDerWaalsContact O-CD 3.29Å; K685-R688 WeakPolarHBondContact O-CD 3.3Å; K685-R688 WeakPolarHBondContact O-CG 3.45Å; K685-R688 PolarHBondContact O-N 3.27Å; K685-R688 VanDerWaalsContact O-N 3.1Å; A686-R688 PolarHBondContact O-N 3.27Å; R688-S690 PolarHBondContact O-N 3.36Å
689	E	65.8	Low	81.1	Confident	111 Å²	111	44.8 Å²	44.8	52%	0.519	21%	0.212	S	C	.	.	S	Bend	trans	-70.9	-7.1	173.6	-67.6	129.5	-112.7	0	0	112.4
690	S	62.2	Low	81	Confident	3 Å²	3	43.4 Å²	43.4	2%	0.021	20%	0.204	C	C	.	.	S	Bend	trans	-63.2	137.9	-179.1	78.6	0	0	0	0	112.9	I353 A686 S687 R688 S692 R693	I353-S690 VanDerWaalsContact CD1-CA 3.46Å; A686-S690 PolarHBondContact O-N 2.78Å; S687-S690 VanDerWaalsContact O-CB 3.29Å; S687-S690 WeakPolarHBondContact O-CB 3.27Å; S687-S690 PolarHBondContact O-OG 3.3Å; R688-S690 PolarHBondContact O-N 3.36Å; S690-S692 VanDerWaalsContact CB-OG 3.29Å; S690-S692 WeakPolarHBondContact CB-OG 3.49Å; S690-S692 PolarHBondContact O-N 3.17Å; S690-S692 PolarHBondContact OG-OG 3.24Å; S690-R693 VanDerWaalsContact O-CG 3.29Å; S690-R693 WeakPolarHBondContact O-CG 3.41Å; S690-R693 PolarHBondContact O-N 3.44Å; S690-R693 WeakPolarHBondContact OG-CA 3.46Å; S690-R693 PolarHBondContact OG-N 3.2Å
691	H	59.6	Low	80.4	Confident	132 Å²	132	46.5 Å²	46.5	61%	0.611	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.2	-16.7	166.4	-62.7	110.6	0	0	0	113.3	K351 I353	K351-H691 HydrophobicContact CB-CB 3.54Å; K351-H691 VanDerWaalsContact CD-C 3.47Å; K351-H691 HydrophobicContact CD-CB 3.77Å; K351-H691 WeakPolarHBondContact CD-O 3.45Å; K351-H691 HydrophobicContact CG-CB 4.3Å; K351-H691 PolarHBondContact NZ-O 3.37Å; K351-H691 PolarHBondContact O-ND1 2.71Å; I353-H691 HydrophobicContact CD1-CB 4.15Å; I353-H691 VanDerWaalsContact CD1-N 3.32Å
692	S	67	Low	79	Confident	31 Å²	31	53.5 Å²	53.5	22%	0.217	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-29	171.6	30.3	0	0	0	0	114.2	S690 E694	S690-S692 VanDerWaalsContact CB-OG 3.29Å; S690-S692 WeakPolarHBondContact CB-OG 3.49Å; S690-S692 PolarHBondContact O-N 3.17Å; S690-S692 PolarHBondContact OG-OG 3.24Å; S692-E694 PolarHBondContact O-N 3.44Å
693	R	74.7	Confident	77	Confident	180 Å²	180	57 Å²	57	68%	0.679	28%	0.276	S	S	*	.			trans	41.6	48.2	-166.1	-62.5	-169.5	176.9	-177	0.1	112.5	P620 S690	P620-R693 WeakPolarHBondContact CD-O 3.48Å; S690-R693 VanDerWaalsContact O-CG 3.29Å; S690-R693 WeakPolarHBondContact O-CG 3.41Å; S690-R693 PolarHBondContact O-N 3.44Å; S690-R693 WeakPolarHBondContact OG-CA 3.46Å; S690-R693 PolarHBondContact OG-N 3.2Å
694	E	81.6	Confident	74.6	Confident	46 Å²	46	62.2 Å²	62.2	22%	0.215	31%	0.31	C	S	.	.			trans	-145.3	138.5	-173.1	-172.6	-172.9	-159	0	0	110.6	R617 N668 S687 S692	R617-E694 WeakPolarHBondContact CB-OE1 3.43Å; R617-E694 VanDerWaalsContact CD-OE1 3.23Å; R617-E694 WeakPolarHBondContact CD-OE1 3.44Å; R617-E694 VanDerWaalsContact CG-OE1 3.28Å; R617-E694 WeakPolarHBondContact CG-OE1 3.48Å; R617-E694 IonicContact CZ-OE1 2.71Å; R617-E694 IonicContact NE-OE1 3.61Å; R617-E694 IonicContact NH1-OE1 2.71Å; R617-E694 PolarHBondContact NH1-OE1 3.46Å; R617-E694 IonicContact NH1-OE2 3.85Å; R617-E694 PolarHBondContact NH1-OE2 2.82Å; N668-E694 PolarHBondContact ND2-O 2.94Å; N668-E694 PolarHBondContact OD1-O 3.12Å; S687-E694 WeakPolarHBondContact CB-O 3.35Å; S692-E694 PolarHBondContact O-N 3.44Å
695	L	88.7	Confident	71.7	Confident	0 Å²	0	70.2 Å²	70.2	0%	0	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	110.9	174.3	-177.8	68	0	0	0	110.8	I618 F626 F628 I667 N668 I684 L697	I618-L695 HydrophobicContact CB-CB 4.34Å; I618-L695 HydrophobicContact CD1-CD2 4.47Å; I618-L695 PolarHBondContact N-O 3.38Å; I618-L695 PolarHBondContact O-N 2.89Å; F626-L695 HydrophobicContact CB-CD2 4.1Å; F626-L695 HydrophobicContact CD1-CB 3.83Å; F626-L695 HydrophobicContact CD1-CD2 3.89Å; F626-L695 HydrophobicContact CD2-CD2 3.71Å; F626-L695 HydrophobicContact CE1-CB 3.49Å; F626-L695 VanDerWaalsContact CE1-CB 3.49Å; F626-L695 HydrophobicContact CE1-CD2 4.26Å; F626-L695 HydrophobicContact CE2-CB 4.27Å; F626-L695 HydrophobicContact CE2-CD2 4.1Å; F626-L695 HydrophobicContact CG-CB 4.36Å; F626-L695 HydrophobicContact CG-CD2 3.61Å; F626-L695 HydrophobicContact CZ-CB 3.76Å; F626-L695 HydrophobicContact CZ-CD2 4.38Å; F628-L695 HydrophobicContact CE1-CD2 3.64Å; F628-L695 HydrophobicContact CZ-CD2 3.92Å; I667-L695 HydrophobicContact CG2-CD1 4.12Å; N668-L695 VanDerWaalsContact OD1-CA 3.31Å; N668-L695 WeakPolarHBondContact OD1-CA 3.46Å; I684-L695 HydrophobicContact CG2-CD1 4.47Å; I684-L695 HydrophobicContact CG2-CD2 4Å; L695-L697 HydrophobicContact CD1-CD2 4Å; L695-L697 HydrophobicContact CD2-CD2 3.95Å; L695-L697 HydrophobicContact CD2-CG 4.3Å; L695-L697 HydrophobicContact CG-CD2 3.93Å; L695-L697 HydrophobicContact CG-CG 4.06Å
696	A	88.6	Confident	68.9	Low	14 Å²	14	70.9 Å²	70.9	12%	0.116	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	94.1	178	0	0	0	0	0	111.2	L615 I616 N668	L615-A696 HydrophobicContact CD1-CB 4.34Å; I616-A696 CarbonylContact O-C 3.51Å; I616-A696 WeakPolarHBondContact O-CA 3.48Å; N668-A696 WeakPolarHBondContact CA-O 3.38Å; N668-A696 PolarHBondContact N-O 2.98Å; N668-A696 PolarHBondContact OD1-N 3.3Å
697	L	90.3	Very high	66.5	Low	0 Å²	0	77 Å²	77	0%	0	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.6	119.6	169.6	65	75.1	0	0	0	113.4	L615 I616 I618 F628 L658 I664 L666 I667 L695	L615-L697 CarbonylContact C-O 3.43Å; L615-L697 WeakPolarHBondContact CA-O 3.49Å; I616-L697 PolarHBondContact N-O 2.93Å; I616-L697 PolarHBondContact O-N 3.02Å; I618-L697 HydrophobicContact CD1-CD1 4.18Å; F628-L697 HydrophobicContact CZ-CD1 4.33Å; F628-L697 HydrophobicContact CZ-CD2 3.96Å; L658-L697 HydrophobicContact CD1-CD1 4.24Å; I664-L697 HydrophobicContact CD1-CD1 4.27Å; I664-L697 HydrophobicContact CD1-CD2 4.09Å; I664-L697 HydrophobicContact CG2-CB 3.93Å; I664-L697 HydrophobicContact CG2-CD2 4.22Å; I664-L697 HydrophobicContact CG2-CG 4.5Å; L666-L697 WeakPolarHBondContact O-CB 3.48Å; I667-L697 HydrophobicContact CB-CD2 4.34Å; I667-L697 HydrophobicContact CD1-CD2 3.76Å; I667-L697 HydrophobicContact CG1-CB 4.49Å; I667-L697 HydrophobicContact CG1-CD2 3.71Å; I667-L697 HydrophobicContact CG2-CD2 4.17Å; L695-L697 HydrophobicContact CD1-CD2 4Å; L695-L697 HydrophobicContact CD2-CD2 3.95Å; L695-L697 HydrophobicContact CD2-CG 4.3Å; L695-L697 HydrophobicContact CG-CD2 3.93Å; L695-L697 HydrophobicContact CG-CG 4.06Å
698	V	88.3	Confident	63.9	Low	27 Å²	27	81.5 Å²	81.5	16%	0.164	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	116.4	155.5	-178	0	0	0	0	108.9	V614 L615 V665 L666	V614-V698 WeakPolarHBondContact O-CA 2.98Å; L615-V698 HydrophobicContact CD1-CG2 3.79Å; V665-V698 PolarHBondContact N-O 3.26Å; L666-V698 HydrophobicContact CB-CB 3.86Å; L666-V698 HydrophobicContact CB-CG2 4.24Å; L666-V698 HydrophobicContact CD1-CB 4.06Å; L666-V698 HydrophobicContact CD1-CG1 4.31Å; L666-V698 HydrophobicContact CD1-CG2 4.02Å; L666-V698 HydrophobicContact CG-CB 4.03Å; L666-V698 HydrophobicContact CG-CG1 4.41Å; L666-V698 HydrophobicContact CG-CG2 4.47Å; L666-V698 PolarHBondContact N-O 2.98Å; L666-V698 VanDerWaalsContact N-O 3.12Å; L666-V698 PolarHBondContact O-N 3.23Å
699	I	90.7	Very high	61.6	Low	0 Å²	0	85.3 Å²	85.3	0%	0	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	157.1	-176.6	57.7	157.3	0	0	0	111.4	L613 V614 I616 L658 D662 Q663 I664 R701	L613-I699 CarbonylContact C-O 3.48Å; L613-I699 VanDerWaalsContact CA-O 3.24Å; L613-I699 WeakPolarHBondContact CA-O 3.16Å; V614-I699 HydrophobicContact CB-CD1 4.1Å; V614-I699 HydrophobicContact CB-CG1 3.85Å; V614-I699 PolarHBondContact N-O 2.87Å; V614-I699 WeakPolarHBondContact O-CG1 3.46Å; V614-I699 PolarHBondContact O-N 3.03Å; I616-I699 HydrophobicContact CD1-CD1 3.51Å; I616-I699 HydrophobicContact CD1-CG1 4.08Å; I616-I699 HydrophobicContact CG1-CD1 4.37Å; L658-I699 HydrophobicContact CD1-CD1 4.38Å; L658-I699 HydrophobicContact CD1-CG2 4.05Å; D662-I699 HydrophobicContact CB-CB 4.24Å; D662-I699 HydrophobicContact CB-CD1 3.79Å; D662-I699 HydrophobicContact CB-CG2 4.25Å; D662-I699 VanDerWaalsContact CG-CD1 3.43Å; D662-I699 WeakPolarHBondContact OD2-CD1 3.26Å; Q663-I699 CarbonylContact O-C 3.55Å; Q663-I699 WeakPolarHBondContact O-CA 3.5Å; I664-I699 HydrophobicContact CB-CG2 4.45Å; I664-I699 HydrophobicContact CG1-CG2 4.21Å; I664-I699 HydrophobicContact CG2-CG2 4.28Å; I699-R701 HydrophobicContact CD1-CG 4.28Å
700	R	85.9	Confident	59.8	Low	36 Å²	36	87.7 Å²	87.7	14%	0.136	46%	0.456	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	116.9	164.9	-172.6	-169.6	-73.7	148.7	-12.8	108.2	E383 L613 Q663 V665	E383-R700 IonicContact OE1-CZ 2.68Å; E383-R700 IonicContact OE1-NE 3.45Å; E383-R700 PolarHBondContact OE1-NE 3.13Å; E383-R700 IonicContact OE1-NH2 2.93Å; E383-R700 PolarHBondContact OE1-NH2 3.27Å; E383-R700 IonicContact OE2-CZ 2.62Å; E383-R700 IonicContact OE2-NH2 2.72Å; E383-R700 PolarHBondContact OE2-NH2 3.25Å; L613-R700 HydrophobicContact CD2-CB 3.63Å; L613-R700 HydrophobicContact CD2-CG 3.97Å; Q663-R700 HydrophobicContact CB-CB 4.37Å; Q663-R700 PolarHBondContact N-O 2.87Å; Q663-R700 PolarHBondContact O-N 3.47Å; Q663-R700 VanDerWaalsContact OE1-NH1 3.07Å; V665-R700 HydrophobicContact CG2-CB 3.94Å
701	R	76.7	Confident	58.2	Low	65 Å²	65	98.9 Å²	98.9	25%	0.245	50%	0.498	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	126.9	173.8	-102.2	175.1	174.3	158.8	-5	110.4	Y612 K657 N659 D662 I699	Y612-R701 PolarHBondContact N-O 3.4Å; Y612-R701 PolarHBondContact O-N 3.48Å; K657-R701 PolarHBondContact O-NH2 2.8Å; N659-R701 PolarHBondContact ND2-NH2 3.43Å; N659-R701 PolarHBondContact OD1-NH2 2.85Å; D662-R701 WeakPolarHBondContact OD1-CG 3.2Å; D662-R701 IonicContact OD1-NE 3.68Å; D662-R701 IonicContact OD2-NE 3.73Å; D662-R701 IonicContact OD2-NH2 3.89Å; I699-R701 HydrophobicContact CD1-CG 4.28Å
702	K	58.9	Low	56.8	Low	180 Å²	180	96.8 Å²	96.8	78%	0.783	50%	0.498	S	S	*	.	P	Polyproline II helix	trans	-78.4	133.2	159.7	-77	-169.9	172.7	-172.5	0	108.8	V704	K702-V704 PolarHBondContact O-N 2.98Å
703	A	43.8	Very low	55.3	Low	95 Å²	95	104.2 Å²	104.2	79%	0.785	53%	0.529	S	S	*	.	P	Polyproline II helix	trans	-69.6	124.6	171.6	0	0	0	0	0	109.6	R705	A703-R705 PolarHBondContact O-N 2.91Å
704	V	33.5	Very low	53.4	Low	139 Å²	139	101.7 Å²	101.7	84%	0.842	53%	0.529	S	S	*	.			trans	-77.5	92.7	179.7	-177	0	0	0	0	109.3	K702 S706	K702-V704 PolarHBondContact O-N 2.98Å; V704-S706 PolarHBondContact O-N 3.17Å
705	R	28.3	Very low	51.1	Low	186 Å²	186	106.7 Å²	106.7	70%	0.702	55%	0.553	S	S	*	*			trans	-74.2	118.2	157.7	-79.5	-171.5	175.7	174.2	1.9	107.6	D607 A703 L707	D607-R705 IonicContact OD1-CZ 2.59Å; D607-R705 IonicContact OD1-NH1 3.23Å; D607-R705 PolarHBondContact OD1-NH1 3.11Å; D607-R705 IonicContact OD1-NH2 3.41Å; D607-R705 PolarHBondContact OD1-NH2 2.83Å; D607-R705 IonicContact OD2-CZ 3.75Å; D607-R705 IonicContact OD2-NH1 3.28Å; D607-R705 PolarHBondContact OD2-NH1 3.44Å; D607-R705 IonicContact OD2-NH2 3.86Å; A703-R705 PolarHBondContact O-N 2.91Å; R705-L707 PolarHBondContact O-N 2.91Å
706	S	24.8	Very low	48.7	Very low	109 Å²	109	112.9 Å²	112.9	76%	0.762	59%	0.585	S	S	*	*			trans	-65.1	117.9	169	173.7	0	0	0	0	109.2	V704	V704-S706 PolarHBondContact O-N 3.17Å
707	L	30.3	Very low	46.1	Very low	163 Å²	163	116.7 Å²	116.7	85%	0.853	61%	0.611	S	S	*	*			trans	-142.1	96.7	161.2	-154.3	76.6	0	0	0	108.9	R705 E709	R705-L707 PolarHBondContact O-N 2.91Å; L707-E709 PolarHBondContact O-N 2.86Å
708	A	25.4	Very low	43.4	Very low	95 Å²	95	125.1 Å²	125.1	79%	0.785	65%	0.65	S	S	*	*			trans	-85.3	104.2	171.3	0	0	0	0	0	108.7
709	E	28.9	Very low	40.6	Very low	180 Å²	180	130.2 Å²	130.2	84%	0.841	68%	0.676	S	S	*	*			trans	-142.3	131.1	159.6	-134.9	170	-128.3	0	0	110.4	L707	L707-E709 PolarHBondContact O-N 2.86Å
710	I	27.6	Very low	37.8	Very low	161 Å²	161	138.4 Å²	138.4	83%	0.826	71%	0.712	S	S	*	*			trans	-94	123.9	-161.2	-62.2	158.7	0	0	0	109.8
711	R	29.6	Very low	35	Very low	238 Å²	238	141.9 Å²	141.9	90%	0.898	74%	0.739	S	S	*	*			trans	-137.4	141.5	155.8	-65.9	-164.7	177.4	-158.5	-3.1	110.1
712	S	30.3	Very low	32.7	Very low	87 Å²	87	148.5 Å²	148.5	61%	0.608	77%	0.773	S	S	*	*			trans	-89	154.6	-161.9	38.3	0	0	0	0	114.2	D714	S712-D714 PolarHBondContact O-N 3.44Å
713	E	33.9	Very low	31.2	Very low	188 Å²	188	143.9 Å²	143.9	88%	0.879	77%	0.768	S	S	*	*	G	3₁₀ helix	trans	-72.1	-5.8	-176.5	-63	-171	115.9	0	0	114.9	E715	E713-E715 PolarHBondContact O-N 2.8Å
714	D	34.7	Very low	30.4	Very low	126 Å²	126	147.9 Å²	147.9	67%	0.674	77%	0.772	S	S	*	*	G	3₁₀ helix	trans	-72.2	-26.9	-172.3	-91	-44.9	0	0	0	115.4	S712	S712-D714 PolarHBondContact O-N 3.44Å
715	E	34.7	Very low	30.4	Very low	152 Å²	152	149.5 Å²	149.5	71%	0.71	77%	0.769	S	S	*	*	G	3₁₀ helix	trans	-79.9	-21.3	-171.2	-65.6	-170	138.8	0	0	114.2	E713 S717	E713-E715 PolarHBondContact O-N 2.8Å; E715-S717 PolarHBondContact O-N 3.17Å
716	L	37.6	Very low	30.4	Very low	130 Å²	130	145.9 Å²	145.9	68%	0.681	77%	0.769	S	S	*	*	G	3₁₀ helix	trans	-73.1	-12.5	177.5	-98.8	151.2	0	0	0	113.5	Q718	L716-Q718 VanDerWaalsContact C-N 3.34Å
717	S	33.5	Very low	30.6	Very low	94 Å²	94	145 Å²	145	66%	0.657	77%	0.769	S	S	*	*	G	3₁₀ helix	trans	-81	-8.3	-179	-59.6	0	0	0	0	114.3	E715	E715-S717 PolarHBondContact O-N 3.17Å
718	Q	33.5	Very low	30.8	Very low	176 Å²	176	141.5 Å²	141.5	82%	0.822	76%	0.757	S	S	*	*	G	3₁₀ helix	trans	-108.2	5.4	-174	-59.5	-169.8	14.9	0	0	114.5	L716	L716-Q718 VanDerWaalsContact C-N 3.34Å
719	L	30.7	Very low	31.3	Very low	135 Å²	135	141.3 Å²	141.3	71%	0.707	75%	0.748	S	S	*	*	S	Bend	trans	-101.1	11.5	-176.5	-72.9	170	0	0	0	114.8
720	F	31	Very low	31.5	Very low	172 Å²	172	142.6 Å²	142.6	75%	0.754	75%	0.754	S	S	*	*			trans	-114.4	102.5	177.5	-67.8	-79.7	0	0	0	111.1	E722	F720-E722 PolarHBondContact O-N 3.39Å
721	P	27.8	Very low	32	Very low	108 Å²	108	137.9 Å²	137.9	70%	0.701	75%	0.745	S	S	*	*			trans	-61.5	130.8	168.4	-21.1	33.4	0	0	0	110.5	A723	P721-A723 PolarHBondContact O-N 2.7Å
722	E	28.3	Very low	32.9	Very low	205 Å²	205	127 Å²	127	96%	0.958	71%	0.706	S	S	*	*	S	Bend	trans	-73.4	21.3	-173.2	-151.7	166.9	-158.1	0	0	113.9	F720	F720-E722 PolarHBondContact O-N 3.39Å
723	A	26.7	Very low	34.7	Very low	82 Å²	82	129.4 Å²	129.4	68%	0.678	71%	0.712	S	S	*	*			trans	-148.3	63.5	-165.6	0	0	0	0	0	113.3	P721	P721-A723 PolarHBondContact O-N 2.7Å
724	M	27.4	Very low	37.4	Very low	179 Å²	179	123 Å²	123	88%	0.882	69%	0.688	S	S	*	*			trans	-131.5	35.9	163	-67.1	-152.2	90.8	0	0	113.4
725	F	33.7	Very low	40.2	Very low	174 Å²	174	117.2 Å²	117.2	76%	0.763	66%	0.657	S	S	*	*	S	Bend	trans	-85.8	128.1	151.4	-67.9	-78.6	0	0	0	107.7	A727	F725-A727 PolarHBondContact O-N 3.24Å
726	P	28.3	Very low	43	Very low	110 Å²	110	116.5 Å²	116.5	71%	0.714	65%	0.654	S	S	*	*	P	Polyproline II helix	trans	-63.3	125.7	166.4	27.8	-31.7	0	0	0	107.9
727	A	28.5	Very low	45.6	Very low	91 Å²	91	111.6 Å²	111.6	75%	0.752	64%	0.635	S	S	*	*	P	Polyproline II helix	trans	-56.7	146.2	165.3	0	0	0	0	0	108.8	F725	F725-A727 PolarHBondContact O-N 3.24Å
728	C	34.4	Very low	48.6	Very low	89 Å²	89	107.2 Å²	107.2	60%	0.601	60%	0.604	S	S	*	*	P	Polyproline II helix	trans	-53	130.4	-176.3	-62.4	0	0	0	0	110.4	E730	C728-E730 PolarHBondContact O-N 3.45Å
729	P	36.5	Very low	51.6	Low	91 Å²	91	99 Å²	99	59%	0.591	57%	0.566	S	S	*	*	P	Polyproline II helix	trans	-61.3	136.9	171.5	26.8	-33	0	0	0	108.9	G731 G732	P729-G731 PolarHBondContact O-N 2.73Å; P729-G732 PolarHBondContact O-N 2.67Å
730	E	33.7	Very low	54.6	Low	207 Å²	207	96.7 Å²	96.7	97%	0.967	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.7	114.2	-179	-62.7	176.2	138.7	0	0	109.4	C728	C728-E730 PolarHBondContact O-N 3.45Å
731	G	37	Very low	57.5	Low	62 Å²	62	92.9 Å²	92.9	64%	0.639	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	118.1	-2.5	-169	0	0	0	0	0	115.7	P729 D733	P729-G731 PolarHBondContact O-N 2.73Å; G731-D733 VanDerWaalsContact C-N 3.34Å; G731-D733 PolarHBondContact O-N 3.39Å
732	G	48	Very low	60.7	Low	9 Å²	9	88.1 Å²	88.1	9%	0.093	51%	0.507	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-10.6	-178.3	0	0	0	0	0	117.5	P729 S734 Y974	P729-G732 PolarHBondContact O-N 2.67Å; G732-S734 VanDerWaalsContact C-N 3.32Å; G732-S734 PolarHBondContact O-N 3.02Å; G732-Y974 PolarHBondContact O-OH 3.32Å
733	D	68.3	Low	63.8	Low	137 Å²	137	81.6 Å²	81.6	73%	0.733	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.2	-5.1	-166.7	-63.6	-46.1	0	0	0	115.8	G731 P972	G731-D733 VanDerWaalsContact C-N 3.34Å; G731-D733 PolarHBondContact O-N 3.39Å; D733-P972 WeakPolarHBondContact O-CD 3.33Å; D733-P972 WeakPolarHBondContact O-CG 3.37Å
734	S	91.3	Very high	66.8	Low	53 Å²	53	83 Å²	83	37%	0.371	47%	0.466	S	S	.	.	S	Bend	trans	-94.5	151	179.8	72.5	0	0	0	0	113.4	G732 E736 G737 S738	G732-S734 VanDerWaalsContact C-N 3.32Å; G732-S734 PolarHBondContact O-N 3.02Å; S734-E736 PolarHBondContact O-N 3.42Å; S734-G737 PolarHBondContact O-N 3.12Å; S734-G737 PolarHBondContact OG-N 2.92Å; S734-S738 PolarHBondContact O-N 2.97Å
735	L	93.4	Very high	69.3	Low	5 Å²	5	74.6 Å²	74.6	3%	0.026	43%	0.426	C	S	.	.	H	α-helix	trans	-54.5	-50.3	171.3	172.4	58.3	0	0	0	111.5	G737 S738 M739 I967 N970 V973 Y1007	L735-G737 VanDerWaalsContact C-N 3.34Å; L735-G737 PolarHBondContact O-N 3.21Å; L735-S738 PolarHBondContact O-N 3.01Å; L735-S738 VanDerWaalsContact O-N 3.11Å; L735-S738 PolarHBondContact O-OG 3.4Å; L735-M739 HydrophobicContact CD1-CE 4.26Å; L735-M739 HydrophobicContact CD1-CG 3.86Å; L735-M739 HydrophobicContact CD1-SD 4.38Å; L735-M739 HydrophobicContact CG-CG 4.41Å; L735-M739 WeakPolarHBondContact O-CG 3.39Å; L735-M739 PolarHBondContact O-N 3Å; L735-I967 HydrophobicContact CD1-CG1 4Å; L735-I967 HydrophobicContact CD2-CG2 4.33Å; L735-N970 WeakPolarHBondContact CB-OD1 3.37Å; L735-V973 HydrophobicContact CD1-CG2 3.96Å; L735-Y1007 HydrophobicContact CD1-CD2 4.29Å; L735-Y1007 HydrophobicContact CD1-CE2 4.41Å; L735-Y1007 HydrophobicContact CD2-CD2 3.93Å; L735-Y1007 HydrophobicContact CD2-CE2 3.76Å; L735-Y1007 HydrophobicContact CG-CD2 4.04Å; L735-Y1007 HydrophobicContact CG-CE2 3.72Å
736	E	93.3	Very high	71.9	Confident	138 Å²	138	67.7 Å²	67.7	65%	0.645	40%	0.397	S	S	*	.	H	α-helix	trans	-54.4	-46.7	176.9	-176.3	179.6	-165.3	0	0	112.3	S734 S738 M739 E740	S734-E736 PolarHBondContact O-N 3.42Å; E736-S738 VanDerWaalsContact C-N 3.35Å; E736-S738 PolarHBondContact O-N 2.83Å; E736-M739 PolarHBondContact O-N 3.26Å; E736-E740 WeakPolarHBondContact O-CB 3.33Å; E736-E740 PolarHBondContact O-N 3.44Å
737	G	92.7	Very high	74.6	Confident	27 Å²	27	69.5 Å²	69.5	28%	0.278	40%	0.396	S	S	.	.	H	α-helix	trans	-61.9	-40.3	176.7	0	0	0	0	0	112.8	S734 L735 L741	S734-G737 PolarHBondContact O-N 3.12Å; S734-G737 PolarHBondContact OG-N 2.92Å; L735-G737 VanDerWaalsContact C-N 3.34Å; L735-G737 PolarHBondContact O-N 3.21Å; G737-L741 VanDerWaalsContact O-CB 3.28Å; G737-L741 WeakPolarHBondContact O-CB 3.43Å; G737-L741 PolarHBondContact O-N 2.94Å
738	S	96	Very high	77	Confident	2 Å²	2	68.6 Å²	68.6	1%	0.014	38%	0.384	C	S	.	.	H	α-helix	trans	-67	-36	175.9	76.7	0	0	0	0	113	S734 L735 E736 L742 P972 V973	S734-S738 PolarHBondContact O-N 2.97Å; L735-S738 PolarHBondContact O-N 3.01Å; L735-S738 VanDerWaalsContact O-N 3.11Å; L735-S738 PolarHBondContact O-OG 3.4Å; E736-S738 VanDerWaalsContact C-N 3.35Å; E736-S738 PolarHBondContact O-N 2.83Å; S738-L742 VanDerWaalsContact O-CB 3.31Å; S738-L742 WeakPolarHBondContact O-CB 3.49Å; S738-L742 PolarHBondContact O-N 3.47Å; S738-P972 WeakPolarHBondContact OG-CA 3.46Å; S738-V973 PolarHBondContact OG-N 2.87Å
739	M	96.2	Very high	78.8	Confident	3 Å²	3	65.5 Å²	65.5	2%	0.015	37%	0.367	C	S	.	.	H	α-helix	trans	-72	-45.1	177.7	-66.3	-66.6	97.9	0	0	111.8	L735 E736 L741 L742 K743 V973 I1003 L1004 Y1007	L735-M739 HydrophobicContact CD1-CE 4.26Å; L735-M739 HydrophobicContact CD1-CG 3.86Å; L735-M739 HydrophobicContact CD1-SD 4.38Å; L735-M739 HydrophobicContact CG-CG 4.41Å; L735-M739 WeakPolarHBondContact O-CG 3.39Å; L735-M739 PolarHBondContact O-N 3Å; E736-M739 PolarHBondContact O-N 3.26Å; M739-L741 VanDerWaalsContact C-N 3.31Å; M739-L741 PolarHBondContact O-N 3.49Å; M739-L742 HydrophobicContact CE-CD2 4.05Å; M739-L742 PolarHBondContact O-N 3.36Å; M739-K743 WeakPolarHBondContact O-CB 3.4Å; M739-K743 PolarHBondContact O-N 2.83Å; M739-V973 HydrophobicContact CE-CB 3.61Å; M739-V973 HydrophobicContact CE-CG1 4.46Å; M739-V973 HydrophobicContact CE-CG2 3.93Å; M739-I1003 HydrophobicContact CE-CG2 3.79Å; M739-I1003 HydrophobicContact SD-CG2 4.06Å; M739-L1004 HydrophobicContact CB-CD2 4.17Å; M739-L1004 WeakPolarHBondContact O-CD2 3.21Å; M739-L1004 HydrophobicContact SD-CD2 3.96Å; M739-Y1007 HydrophobicContact CB-CD1 3.76Å; M739-Y1007 HydrophobicContact CB-CE1 3.7Å; M739-Y1007 HydrophobicContact CB-CG 4.36Å; M739-Y1007 HydrophobicContact CG-CD1 3.5Å; M739-Y1007 VanDerWaalsContact CG-CD1 3.5Å; M739-Y1007 HydrophobicContact CG-CD2 3.88Å; M739-Y1007 HydrophobicContact CG-CE1 3.71Å; M739-Y1007 HydrophobicContact CG-CE2 4.1Å; M739-Y1007 HydrophobicContact CG-CG 3.58Å; M739-Y1007 HydrophobicContact SD-CD1 4.08Å; M739-Y1007 HydrophobicContact SD-CD2 4.44Å; M739-Y1007 HydrophobicContact SD-CG 3.84Å
740	E	93.9	Very high	80.7	Confident	86 Å²	86	64.2 Å²	64.2	40%	0.402	36%	0.358	S	S	.	.	H	α-helix	trans	-64.3	-35.9	176	177.8	64.2	177.2	0	0	111.9	E736 K744	E736-E740 WeakPolarHBondContact O-CB 3.33Å; E736-E740 PolarHBondContact O-N 3.44Å; E740-K744 HydrophobicContact CG-CD 4.35Å; E740-K744 WeakPolarHBondContact O-CB 3.24Å; E740-K744 WeakPolarHBondContact O-CG 3.45Å; E740-K744 PolarHBondContact O-N 2.84Å; E740-K744 VanDerWaalsContact O-N 3.1Å; E740-K744 WeakPolarHBondContact OE1-CE 3.49Å; E740-K744 IonicContact OE1-NZ 2.61Å; E740-K744 PolarHBondContact OE1-NZ 3.21Å
741	L	92.6	Very high	82.8	Confident	92 Å²	92	55 Å²	55	48%	0.482	32%	0.315	S	S	.	.	H	α-helix	trans	-65.6	-44	171.3	-177.3	67.4	0	0	0	111.8	G737 M739 K743 G745 Y974	G737-L741 VanDerWaalsContact O-CB 3.28Å; G737-L741 WeakPolarHBondContact O-CB 3.43Å; G737-L741 PolarHBondContact O-N 2.94Å; M739-L741 VanDerWaalsContact C-N 3.31Å; M739-L741 PolarHBondContact O-N 3.49Å; L741-K743 VanDerWaalsContact C-N 3.34Å; L741-K743 PolarHBondContact O-N 3.48Å; L741-G745 WeakPolarHBondContact O-CA 3.31Å; L741-G745 PolarHBondContact O-N 2.84Å; L741-Y974 HydrophobicContact CD2-CE1 4.03Å
742	L	94.5	Very high	84.8	Confident	8 Å²	8	53.9 Å²	53.9	4%	0.042	30%	0.295	C	S	.	.	H	α-helix	trans	-62.7	-40.8	178.1	-178	59.4	0	0	0	111.7	S738 M739 G745 L746 V751 P975 C1000 I1003 L1004	S738-L742 VanDerWaalsContact O-CB 3.31Å; S738-L742 WeakPolarHBondContact O-CB 3.49Å; S738-L742 PolarHBondContact O-N 3.47Å; M739-L742 HydrophobicContact CE-CD2 4.05Å; M739-L742 PolarHBondContact O-N 3.36Å; L742-G745 CarbonylContact O-C 3.54Å; L742-G745 PolarHBondContact O-N 3Å; L742-L746 WeakPolarHBondContact O-CG 3.27Å; L742-L746 PolarHBondContact O-N 3.06Å; L742-V751 HydrophobicContact CD1-CG1 4.25Å; L742-V751 HydrophobicContact CD1-CG2 4.34Å; L742-P975 HydrophobicContact CD1-CG 3.96Å; L742-P975 HydrophobicContact CD2-CG 3.99Å; L742-C1000 HydrophobicContact CD1-CB 3.94Å; L742-I1003 HydrophobicContact CD2-CB 4.34Å; L742-I1003 HydrophobicContact CD2-CG2 3.79Å; L742-L1004 HydrophobicContact CB-CD2 4.22Å; L742-L1004 HydrophobicContact CD2-CD2 4.08Å; L742-L1004 HydrophobicContact CD2-CG 4.04Å; L742-L1004 HydrophobicContact CG-CD1 4.47Å; L742-L1004 HydrophobicContact CG-CD2 4.23Å; L742-L1004 HydrophobicContact CG-CG 4.21Å
743	K	94.1	Very high	85.8	Confident	68 Å²	68	57.9 Å²	57.9	30%	0.296	31%	0.313	S	S	.	.	H	α-helix	trans	-62.5	-55.9	177	-169.4	168.2	-173.7	163.9	0	112.1	M739 L741 G745 L746 E747 L1004 E1008	M739-K743 WeakPolarHBondContact O-CB 3.4Å; M739-K743 PolarHBondContact O-N 2.83Å; L741-K743 VanDerWaalsContact C-N 3.34Å; L741-K743 PolarHBondContact O-N 3.48Å; K743-G745 PolarHBondContact O-N 3.09Å; K743-L746 PolarHBondContact O-N 3.14Å; K743-L746 VanDerWaalsContact O-N 3.13Å; K743-E747 WeakPolarHBondContact O-CG 3.37Å; K743-E747 PolarHBondContact O-N 3.41Å; K743-L1004 HydrophobicContact CB-CD1 3.97Å; K743-L1004 HydrophobicContact CB-CD2 4.29Å; K743-L1004 HydrophobicContact CG-CD1 4.27Å; K743-E1008 IonicContact NZ-OE1 2.65Å; K743-E1008 PolarHBondContact NZ-OE1 2.82Å
744	K	89.6	Confident	86	Confident	111 Å²	111	55.2 Å²	55.2	48%	0.483	30%	0.296	S	S	.	.	H	α-helix	trans	-55.6	-36.2	171.4	-74.6	167.6	176.1	149	0	112.3	E740 S748	E740-K744 HydrophobicContact CG-CD 4.35Å; E740-K744 WeakPolarHBondContact O-CB 3.24Å; E740-K744 WeakPolarHBondContact O-CG 3.45Å; E740-K744 PolarHBondContact O-N 2.84Å; E740-K744 VanDerWaalsContact O-N 3.1Å; E740-K744 WeakPolarHBondContact OE1-CE 3.49Å; E740-K744 IonicContact OE1-NZ 2.61Å; E740-K744 PolarHBondContact OE1-NZ 3.21Å; K744-S748 VanDerWaalsContact O-CB 3.27Å; K744-S748 WeakPolarHBondContact O-CB 3.24Å; K744-S748 PolarHBondContact O-N 3.08Å; K744-S748 PolarHBondContact O-OG 3.21Å
745	G	79.8	Confident	85.9	Confident	4 Å²	4	53 Å²	53	4%	0.041	28%	0.28	C	S	.	.	H	α-helix	trans	-67.2	-35.7	178.6	0	0	0	0	0	114.4	L741 L742 K743 S748 G749 T750 V751	L741-G745 WeakPolarHBondContact O-CA 3.31Å; L741-G745 PolarHBondContact O-N 2.84Å; L742-G745 CarbonylContact O-C 3.54Å; L742-G745 PolarHBondContact O-N 3Å; K743-G745 PolarHBondContact O-N 3.09Å; G745-S748 PolarHBondContact O-OG 2.68Å; G745-G749 CarbonylContact O-C 3.6Å; G745-G749 PolarHBondContact O-N 3.15Å; G745-T750 WeakPolarHBondContact CA-OG1 3.35Å; G745-T750 PolarHBondContact O-N 2.93Å; G745-T750 PolarHBondContact O-OG1 3.21Å; G745-V751 VanDerWaalsContact CA-CG2 3.5Å; G745-V751 PolarHBondContact O-N 2.74Å; G745-V751 VanDerWaalsContact O-N 3.1Å
746	L	87	Confident	85.1	Confident	28 Å²	28	57.3 Å²	57.3	15%	0.147	30%	0.3	C	S	.	.	H	α-helix	trans	-75	-46.4	173	-77.2	168.1	0	0	0	111.8	L742 K743 S748 G749 V751 L752 K997 C1000 E1001 L1004	L742-L746 WeakPolarHBondContact O-CG 3.27Å; L742-L746 PolarHBondContact O-N 3.06Å; K743-L746 PolarHBondContact O-N 3.14Å; K743-L746 VanDerWaalsContact O-N 3.13Å; L746-S748 VanDerWaalsContact C-N 3.33Å; L746-S748 PolarHBondContact O-N 2.82Å; L746-G749 PolarHBondContact O-N 3.34Å; L746-V751 HydrophobicContact CD2-CG1 4.48Å; L746-L752 HydrophobicContact CD2-CD1 3.94Å; L746-K997 HydrophobicContact CD2-CG 4.1Å; L746-C1000 HydrophobicContact CD1-CB 3.9Å; L746-C1000 HydrophobicContact CD2-CB 3.94Å; L746-C1000 HydrophobicContact CG-CB 4.25Å; L746-E1001 HydrophobicContact CD1-CG 3.9Å; L746-L1004 HydrophobicContact CD1-CD1 3.67Å
747	E	85.3	Confident	84.4	Confident	149 Å²	149	57.7 Å²	57.7	70%	0.696	30%	0.302	S	S	*	.	H	α-helix	trans	-60	-40.8	178.7	-70.9	175.8	179.3	0	0	112.5	K743 G749	K743-E747 WeakPolarHBondContact O-CG 3.37Å; K743-E747 PolarHBondContact O-N 3.41Å; E747-G749 VanDerWaalsContact C-N 3.34Å
748	S	78.9	Confident	84	Confident	72 Å²	72	57.3 Å²	57.3	50%	0.503	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.6	-12.8	175	61.8	0	0	0	0	114.2	K744 G745 L746 T750	K744-S748 VanDerWaalsContact O-CB 3.27Å; K744-S748 WeakPolarHBondContact O-CB 3.24Å; K744-S748 PolarHBondContact O-N 3.08Å; K744-S748 PolarHBondContact O-OG 3.21Å; G745-S748 PolarHBondContact O-OG 2.68Å; L746-S748 VanDerWaalsContact C-N 3.33Å; L746-S748 PolarHBondContact O-N 2.82Å; S748-T750 PolarHBondContact O-N 2.9Å; S748-T750 WeakPolarHBondContact OG-CG2 3.27Å; S748-T750 PolarHBondContact OG-N 3.45Å; S748-T750 PolarHBondContact OG-OG1 3.22Å
749	G	73.3	Confident	83.5	Confident	24 Å²	24	60.7 Å²	60.7	25%	0.247	31%	0.306	C	S	.	.	S	Bend	trans	69.8	2.6	-172.3	0	0	0	0	0	115.1	G745 L746 E747 V751 L752 I753	G745-G749 CarbonylContact O-C 3.6Å; G745-G749 PolarHBondContact O-N 3.15Å; L746-G749 PolarHBondContact O-N 3.34Å; E747-G749 VanDerWaalsContact C-N 3.34Å; G749-V751 VanDerWaalsContact C-N 3.32Å; G749-V751 PolarHBondContact O-N 2.92Å; G749-L752 PolarHBondContact O-N 3.4Å; G749-I753 PolarHBondContact O-N 3.26Å
750	T	75.1	Confident	83.2	Confident	64 Å²	64	66.7 Å²	66.7	39%	0.393	33%	0.329	S	S	.	.	H	α-helix	trans	-63.6	-35.3	-177.7	51.2	0	0	0	0	112.8	G745 S748 L752 I753 Q754	G745-T750 WeakPolarHBondContact CA-OG1 3.35Å; G745-T750 PolarHBondContact O-N 2.93Å; G745-T750 PolarHBondContact O-OG1 3.21Å; S748-T750 PolarHBondContact O-N 2.9Å; S748-T750 WeakPolarHBondContact OG-CG2 3.27Å; S748-T750 PolarHBondContact OG-N 3.45Å; S748-T750 PolarHBondContact OG-OG1 3.22Å; T750-L752 VanDerWaalsContact C-N 3.31Å; T750-L752 PolarHBondContact O-N 3.02Å; T750-I753 PolarHBondContact O-N 3.48Å; T750-I753 VanDerWaalsContact O-N 3.16Å; T750-Q754 WeakPolarHBondContact O-CG 3.43Å; T750-Q754 PolarHBondContact O-N 3.41Å
751	V	78.7	Confident	83.1	Confident	13 Å²	13	67 Å²	67	8%	0.079	33%	0.328	C	S	.	.	H	α-helix	trans	-61	-37.8	176.2	159.9	0	0	0	0	111.9	L742 G745 L746 G749 F755 Y996	L742-V751 HydrophobicContact CD1-CG1 4.25Å; L742-V751 HydrophobicContact CD1-CG2 4.34Å; G745-V751 VanDerWaalsContact CA-CG2 3.5Å; G745-V751 PolarHBondContact O-N 2.74Å; G745-V751 VanDerWaalsContact O-N 3.1Å; L746-V751 HydrophobicContact CD2-CG1 4.48Å; G749-V751 VanDerWaalsContact C-N 3.32Å; G749-V751 PolarHBondContact O-N 2.92Å; V751-F755 PolarHBondContact O-N 3.32Å; V751-Y996 HydrophobicContact CG1-CD1 4.37Å; V751-Y996 HydrophobicContact CG1-CE1 3.47Å; V751-Y996 VanDerWaalsContact CG1-CE1 3.47Å; V751-Y996 WeakPolarHBondContact O-CE1 3.47Å
752	L	78.6	Confident	83.1	Confident	39 Å²	39	66 Å²	66	20%	0.204	32%	0.32	C	S	.	.	H	α-helix	trans	-70.4	-38.5	175.4	-82.2	69.9	0	0	0	111.7	L746 G749 T750 F755 E756 K997	L746-L752 HydrophobicContact CD2-CD1 3.94Å; G749-L752 PolarHBondContact O-N 3.4Å; T750-L752 VanDerWaalsContact C-N 3.31Å; T750-L752 PolarHBondContact O-N 3.02Å; L752-F755 PolarHBondContact O-N 2.98Å; L752-E756 WeakPolarHBondContact O-CG 3.29Å; L752-E756 PolarHBondContact O-N 3.07Å; L752-K997 HydrophobicContact CD1-CB 4.12Å; L752-K997 HydrophobicContact CD1-CG 4.26Å; L752-K997 HydrophobicContact CD2-CB 4.27Å; L752-K997 HydrophobicContact CD2-CD 4.25Å; L752-K997 HydrophobicContact CG-CB 4.41Å
753	I	68.6	Low	82.9	Confident	93 Å²	93	70.4 Å²	70.4	48%	0.477	35%	0.349	S	S	.	.	H	α-helix	trans	-62.8	-44.6	177.6	-64.5	169.7	0	0	0	110.5	G749 T750 F755 E756 Q757	G749-I753 PolarHBondContact O-N 3.26Å; T750-I753 PolarHBondContact O-N 3.48Å; T750-I753 VanDerWaalsContact O-N 3.16Å; I753-F755 VanDerWaalsContact C-N 3.34Å; I753-F755 PolarHBondContact O-N 3.37Å; I753-E756 PolarHBondContact O-N 3.09Å; I753-Q757 WeakPolarHBondContact O-CG 3.47Å; I753-Q757 PolarHBondContact O-N 2.99Å
754	Q	72.5	Confident	82.7	Confident	80 Å²	80	71.3 Å²	71.3	37%	0.374	38%	0.378	S	S	.	.	H	α-helix	trans	-61.3	-40.5	176.1	-70.6	173.4	-14.4	0	0	112.2	T750 Q757 L758 L976	T750-Q754 WeakPolarHBondContact O-CG 3.43Å; T750-Q754 PolarHBondContact O-N 3.41Å; Q754-Q757 PolarHBondContact O-N 3.26Å; Q754-L758 PolarHBondContact O-N 2.73Å; Q754-L976 HydrophobicContact CB-CD1 4.17Å; Q754-L976 HydrophobicContact CB-CD2 3.88Å
755	F	90	Very high	82.9	Confident	8 Å²	8	67.9 Å²	67.9	4%	0.035	37%	0.365	C	S	.	.	H	α-helix	trans	-67	-36.2	175.4	166.7	-90.4	0	0	0	113.5	V751 L752 I753 Q757 L758 L976 V979 R983 V990 Y996	V751-F755 PolarHBondContact O-N 3.32Å; L752-F755 PolarHBondContact O-N 2.98Å; I753-F755 VanDerWaalsContact C-N 3.34Å; I753-F755 PolarHBondContact O-N 3.37Å; F755-Q757 VanDerWaalsContact C-N 3.26Å; F755-Q757 PolarHBondContact O-N 3.24Å; F755-L758 PolarHBondContact O-N 3.16Å; F755-L976 HydrophobicContact CB-CD1 4.17Å; F755-V979 HydrophobicContact CD2-CG1 4.42Å; F755-V979 HydrophobicContact CE2-CG1 4.21Å; F755-R983 VanDerWaalsContact CZ-NH2 3.31Å; F755-V990 HydrophobicContact CE2-CB 4.05Å; F755-V990 HydrophobicContact CE2-CG1 3.69Å; F755-V990 HydrophobicContact CZ-CB 4.45Å; F755-V990 HydrophobicContact CZ-CG1 3.86Å; F755-V990 WeakPolarHBondContact CZ-O 3.47Å; F755-Y996 HydrophobicContact CB-CD1 3.36Å; F755-Y996 HydrophobicContact CB-CD2 4.48Å; F755-Y996 HydrophobicContact CB-CE1 3.38Å; F755-Y996 HydrophobicContact CB-CE2 4.5Å; F755-Y996 HydrophobicContact CB-CG 3.94Å; F755-Y996 HydrophobicContact CD1-CD1 4.09Å; F755-Y996 HydrophobicContact CD1-CG 4.11Å; F755-Y996 AromaticContact CD2-CD1 3.73Å; F755-Y996 HydrophobicContact CD2-CD1 3.73Å; F755-Y996 AromaticContact CD2-CD2 3.42Å; F755-Y996 HydrophobicContact CD2-CD2 3.42Å; F755-Y996 VanDerWaalsContact CD2-CD2 3.42Å; F755-Y996 HydrophobicContact CD2-CE1 4.16Å; F755-Y996 AromaticContact CD2-CE2 3.89Å; F755-Y996 HydrophobicContact CD2-CE2 3.89Å; F755-Y996 AromaticContact CD2-CG 3.31Å; F755-Y996 HydrophobicContact CD2-CG 3.31Å; F755-Y996 AromaticContact CE2-CD2 3.82Å; F755-Y996 HydrophobicContact CE2-CD2 3.82Å; F755-Y996 AromaticContact CE2-CG 3.76Å; F755-Y996 HydrophobicContact CE2-CG 3.76Å; F755-Y996 AromaticContact CG-CD1 3.45Å; F755-Y996 HydrophobicContact CG-CD1 3.45Å; F755-Y996 VanDerWaalsContact CG-CD1 3.45Å; F755-Y996 HydrophobicContact CG-CD2 4.07Å; F755-Y996 AromaticContact CG-CE1 3.94Å; F755-Y996 HydrophobicContact CG-CE1 3.94Å; F755-Y996 HydrophobicContact CG-CE2 4.5Å; F755-Y996 AromaticContact CG-CG 3.51Å; F755-Y996 HydrophobicContact CG-CG 3.51Å; F755-Y996 HydrophobicContact CZ-CG 4.34Å
756	E	77.3	Confident	83.7	Confident	94 Å²	94	69.9 Å²	69.9	44%	0.439	38%	0.381	S	S	.	.	H	α-helix	trans	-70.6	-23.3	174.4	-73.3	-175.5	-170.8	0	0	112.9	K637 L752 I753 S993	K637-E756 IonicContact NZ-OE2 2.99Å; K637-E756 PolarHBondContact NZ-OE2 3.37Å; L752-E756 WeakPolarHBondContact O-CG 3.29Å; L752-E756 PolarHBondContact O-N 3.07Å; I753-E756 PolarHBondContact O-N 3.09Å; E756-S993 WeakPolarHBondContact CG-OG 3.48Å; E756-S993 PolarHBondContact OE1-OG 2.83Å
757	Q	77	Confident	84	Confident	147 Å²	147	69.3 Å²	69.3	69%	0.687	38%	0.379	S	S	*	.	H	α-helix	trans	-84.7	-26.5	172.5	-70.3	169.5	-17.7	0	0	113.2	I753 Q754 F755 Y759	I753-Q757 WeakPolarHBondContact O-CG 3.47Å; I753-Q757 PolarHBondContact O-N 2.99Å; Q754-Q757 PolarHBondContact O-N 3.26Å; F755-Q757 VanDerWaalsContact C-N 3.26Å; F755-Q757 PolarHBondContact O-N 3.24Å; Q757-Y759 PolarHBondContact O-N 3.07Å
758	L	85.8	Confident	84.5	Confident	19 Å²	19	66 Å²	66	10%	0.099	37%	0.369	C	S	.	.	S	Bend	trans	-61.6	129.9	178.6	179.5	64.1	0	0	0	111.2	Q754 F755 R760 L976 V979 R980 R983	Q754-L758 PolarHBondContact O-N 2.73Å; F755-L758 PolarHBondContact O-N 3.16Å; L758-R760 PolarHBondContact O-N 3.07Å; L758-L976 HydrophobicContact CB-CD1 4.2Å; L758-L976 HydrophobicContact CD2-CD1 4Å; L758-L976 HydrophobicContact CD2-CG 4.46Å; L758-V979 HydrophobicContact CD2-CB 4.16Å; L758-V979 HydrophobicContact CD2-CG1 3.74Å; L758-R980 HydrophobicContact CD1-CB 4.14Å; L758-R980 HydrophobicContact CD1-CG 4.07Å; L758-R980 HydrophobicContact CD2-CB 4.34Å; L758-R983 PolarHBondContact O-NH1 2.9Å
759	Y	85.1	Confident	85.4	Confident	72 Å²	72	66.3 Å²	66.3	28%	0.282	36%	0.361	S	S	.	.			trans	-52.7	139.9	-177.8	50.5	-101.2	0	0	0	112.8	Q757 K762 R980 R983 D984	Q757-Y759 PolarHBondContact O-N 3.07Å; Y759-K762 HydrophobicContact CE2-CB 4.11Å; Y759-K762 HydrophobicContact CE2-CG 4.25Å; Y759-R980 HydrophobicContact CE1-CG 4.5Å; Y759-R980 WeakPolarHBondContact OH-CG 3.21Å; Y759-R983 HydrophobicContact CE2-CB 4.48Å; Y759-R983 WeakPolarHBondContact O-CD 3.44Å; Y759-R983 PolarHBondContact O-NH1 2.93Å; Y759-D984 PolarHBondContact OH-OD1 3.12Å
760	R	90.1	Very high	86.5	Confident	130 Å²	130	65.2 Å²	65.2	49%	0.491	35%	0.349	S	S	.	.	S	Bend	trans	-78.1	-31.2	176.3	-73.9	-169.3	-176.3	-156.5	2	112.4	L758 M988	L758-R760 PolarHBondContact O-N 3.07Å; R760-M988 HydrophobicContact CB-CG 4.03Å; R760-M988 WeakPolarHBondContact O-CA 3.16Å; R760-M988 WeakPolarHBondContact O-CG 3.28Å; R760-M988 PolarHBondContact O-N 3.45Å
761	K	91.4	Very high	87.4	Confident	92 Å²	92	68 Å²	68	40%	0.4	36%	0.356	S	S	.	.	S	Bend	trans	-133.8	136.6	174	-176.2	-162	168.6	-166.8	0	107.8	P763 L765 Y787 A987	K761-P763 WeakPolarHBondContact O-CD 3.47Å; K761-L765 VanDerWaalsContact CE-O 3.24Å; K761-L765 WeakPolarHBondContact CE-O 3.39Å; K761-L765 PolarHBondContact NZ-O 2.72Å; K761-Y787 HydrophobicContact CD-CE1 4.18Å; K761-Y787 VanDerWaalsContact CE-CE1 3.47Å; K761-Y787 HydrophobicContact CG-CE1 3.56Å; K761-A987 HydrophobicContact CB-CB 4.17Å; K761-A987 HydrophobicContact CG-CB 4.07Å
762	K	92.9	Very high	88.3	Confident	70 Å²	70	70.5 Å²	70.5	30%	0.304	37%	0.369	S	S	.	.			trans	-61	127.8	173.6	-163.4	-173.8	-160.4	153.8	0	110	Y759 L765 Y787 D984	Y759-K762 HydrophobicContact CE2-CB 4.11Å; Y759-K762 HydrophobicContact CE2-CG 4.25Å; K762-L765 HydrophobicContact CB-CD1 3.91Å; K762-L765 HydrophobicContact CB-CG 4.16Å; K762-L765 HydrophobicContact CD-CD1 3.74Å; K762-L765 HydrophobicContact CD-CG 3.91Å; K762-L765 HydrophobicContact CG-CD1 4.36Å; K762-L765 HydrophobicContact CG-CG 4.39Å; K762-Y787 PolarHBondContact N-OH 2.93Å; K762-D984 HydrophobicContact CD-CB 4.22Å; K762-D984 WeakPolarHBondContact CD-OD1 3.42Å; K762-D984 WeakPolarHBondContact CE-OD1 3.31Å; K762-D984 WeakPolarHBondContact CE-OD2 3.24Å; K762-D984 VanDerWaalsContact CG-OD1 3.24Å; K762-D984 WeakPolarHBondContact CG-OD1 3.24Å; K762-D984 IonicContact NZ-OD1 2.78Å; K762-D984 PolarHBondContact NZ-OD1 3.05Å; K762-D984 IonicContact NZ-OD2 2.76Å; K762-D984 PolarHBondContact NZ-OD2 2.59Å
763	P	89.7	Confident	89	Confident	101 Å²	101	73.5 Å²	73.5	66%	0.656	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	153.4	168.8	-25	35.7	0	0	0	111.8	K761 L765	K761-P763 WeakPolarHBondContact O-CD 3.47Å; P763-L765 PolarHBondContact O-N 3.32Å
764	G	91.2	Very high	90.3	Very high	87 Å²	87	74 Å²	74	90%	0.897	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.3	-23.6	178.3	0	0	0	0	0	116.7	A766	G764-A766 PolarHBondContact O-N 2.78Å
765	L	93.8	Very high	91.5	Very high	39 Å²	39	70.5 Å²	70.5	20%	0.204	38%	0.375	C	S	.	.			trans	-75.9	128.2	179.4	-66.1	-172.9	0	0	0	112.9	K761 K762 P763 Y787 D984	K761-L765 VanDerWaalsContact CE-O 3.24Å; K761-L765 WeakPolarHBondContact CE-O 3.39Å; K761-L765 PolarHBondContact NZ-O 2.72Å; K762-L765 HydrophobicContact CB-CD1 3.91Å; K762-L765 HydrophobicContact CB-CG 4.16Å; K762-L765 HydrophobicContact CD-CD1 3.74Å; K762-L765 HydrophobicContact CD-CG 3.91Å; K762-L765 HydrophobicContact CG-CD1 4.36Å; K762-L765 HydrophobicContact CG-CG 4.39Å; P763-L765 PolarHBondContact O-N 3.32Å; L765-Y787 HydrophobicContact CB-CD1 3.37Å; L765-Y787 HydrophobicContact CB-CE1 3.57Å; L765-Y787 HydrophobicContact CB-CG 4.07Å; L765-Y787 HydrophobicContact CD1-CD1 3.87Å; L765-Y787 HydrophobicContact CD1-CD2 3.88Å; L765-Y787 HydrophobicContact CD1-CE1 3.85Å; L765-Y787 HydrophobicContact CD1-CE2 3.9Å; L765-Y787 HydrophobicContact CD1-CG 3.87Å; L765-Y787 HydrophobicContact CG-CD1 4.28Å; L765-Y787 HydrophobicContact CG-CE1 4.33Å; L765-D984 WeakPolarHBondContact CD1-O 3.42Å
766	A	95	Very high	91.7	Very high	46 Å²	46	74.6 Å²	74.6	38%	0.38	40%	0.397	S	S	.	.			trans	-74.1	148	-178.4	0	0	0	0	0	112.5	G764 Y787 D788	G764-A766 PolarHBondContact O-N 2.78Å; A766-Y787 WeakPolarHBondContact O-CA 3.43Å; A766-D788 HydrophobicContact CB-CB 4.27Å; A766-D788 WeakPolarHBondContact CB-OD2 3.28Å; A766-D788 PolarHBondContact O-N 2.86Å
767	V	94.2	Very high	92.6	Very high	17 Å²	17	74.1 Å²	74.1	10%	0.103	40%	0.397	C	S	.	.			trans	-144.5	81.8	175.9	-179.9	0	0	0	0	106.5	A770 K771 L785 Y787 D788	V767-A770 HydrophobicContact CG1-CB 4.08Å; V767-K771 VanDerWaalsContact O-CD 3.32Å; V767-K771 WeakPolarHBondContact O-CD 3.32Å; V767-K771 VanDerWaalsContact O-CE 3.3Å; V767-K771 WeakPolarHBondContact O-CE 3.17Å; V767-L785 HydrophobicContact CG1-CB 3.59Å; V767-L785 HydrophobicContact CG1-CD1 3.75Å; V767-L785 HydrophobicContact CG1-CG 4.34Å; V767-Y787 HydrophobicContact CG2-CD1 3.88Å; V767-D788 WeakPolarHBondContact CA-OD2 3.12Å; V767-D788 PolarHBondContact N-OD2 3.29Å; V767-D788 VanDerWaalsContact N-OD2 3.1Å
768	T	95.8	Very high	93.6	Very high	80 Å²	80	67.6 Å²	67.6	49%	0.491	37%	0.366	S	S	.	.			trans	-119.7	-49.4	-171.2	60.3	0	0	0	0	111.5	A770 K771 L772 D788	T768-A770 VanDerWaalsContact C-N 3.26Å; T768-A770 PolarHBondContact O-N 2.83Å; T768-K771 PolarHBondContact O-N 2.76Å; T768-L772 PolarHBondContact O-N 3.42Å; T768-D788 WeakPolarHBondContact CB-OD2 3.34Å; T768-D788 PolarHBondContact N-OD1 2.96Å; T768-D788 PolarHBondContact N-OD2 3.05Å; T768-D788 PolarHBondContact OG1-OD1 2.96Å; T768-D788 PolarHBondContact OG1-OD2 3.07Å
769	F	97	Very high	94.2	Very high	78 Å²	78	67.2 Å²	67.2	34%	0.342	37%	0.365	S	S	.	.	G	3₁₀ helix	trans	-59.6	-39.9	178.6	-70.3	-78.4	0	0	0	111.5	K771 L772 N775 D788 R791	F769-K771 PolarHBondContact O-N 2.79Å; F769-K771 VanDerWaalsContact O-N 3.12Å; F769-L772 HydrophobicContact CD1-CD1 3.97Å; F769-L772 PolarHBondContact O-N 3.44Å; F769-N775 PolarHBondContact O-ND2 3.27Å; F769-D788 HydrophobicContact CD2-CB 3.84Å; F769-D788 WeakPolarHBondContact CD2-OD1 2.99Å; F769-D788 HydrophobicContact CE2-CB 4.24Å; F769-D788 PolarHBondContact N-OD1 3.34Å; F769-R791 VanDerWaalsContact CE1-NH2 3.31Å; F769-R791 VanDerWaalsContact CG-NH2 3.29Å
770	A	96.5	Very high	94.8	Very high	0 Å²	0	66 Å²	66	0%	0	36%	0.359	C	S	.	.	G	3₁₀ helix	trans	-65.9	-8.8	176.3	0	0	0	0	0	114.9	V767 T768 N779 L785 P786 Y800	V767-A770 HydrophobicContact CG1-CB 4.08Å; T768-A770 VanDerWaalsContact C-N 3.26Å; T768-A770 PolarHBondContact O-N 2.83Å; A770-N779 PolarHBondContact O-ND2 3.24Å; A770-L785 HydrophobicContact CB-CB 3.93Å; A770-L785 HydrophobicContact CB-CD1 4.3Å; A770-L785 HydrophobicContact CB-CD2 4.23Å; A770-L785 HydrophobicContact CB-CG 4.37Å; A770-P786 HydrophobicContact CB-CG 4.14Å; A770-Y800 HydrophobicContact CB-CE2 3.79Å; A770-Y800 VanDerWaalsContact CB-OH 3.25Å; A770-Y800 WeakPolarHBondContact CB-OH 3.4Å
771	K	95.3	Very high	95	Very high	124 Å²	124	62.7 Å²	62.7	54%	0.539	35%	0.347	S	S	.	.	G	3₁₀ helix	trans	-116	0.4	-179.4	-60.6	-176.4	-175.1	171	0	113.6	V767 T768 F769 L785	V767-K771 VanDerWaalsContact O-CD 3.32Å; V767-K771 WeakPolarHBondContact O-CD 3.32Å; V767-K771 VanDerWaalsContact O-CE 3.3Å; V767-K771 WeakPolarHBondContact O-CE 3.17Å; T768-K771 PolarHBondContact O-N 2.76Å; F769-K771 PolarHBondContact O-N 2.79Å; F769-K771 VanDerWaalsContact O-N 3.12Å; K771-L785 HydrophobicContact CG-CD1 3.88Å
772	L	96.1	Very high	95	Very high	64 Å²	64	65.4 Å²	65.4	34%	0.335	36%	0.359	S	S	.	.	S	Bend	trans	-62.7	142	173.2	-64	174	0	0	0	109.4	T768 F769 Q774 N775 L776	T768-L772 PolarHBondContact O-N 3.42Å; F769-L772 HydrophobicContact CD1-CD1 3.97Å; F769-L772 PolarHBondContact O-N 3.44Å; L772-Q774 VanDerWaalsContact C-N 3.28Å; L772-Q774 PolarHBondContact O-N 3.22Å; L772-N775 WeakPolarHBondContact O-CB 3.44Å; L772-N775 PolarHBondContact O-N 3.47Å; L772-L776 PolarHBondContact O-N 3.19Å
773	P	94.7	Very high	94.8	Very high	103 Å²	103	67.4 Å²	67.4	67%	0.669	37%	0.373	S	S	*	.	G	3₁₀ helix	trans	-51.1	-44.1	-173.1	-29.9	36.3	0	0	0	114.3	N775 L776	P773-N775 PolarHBondContact O-N 3.06Å; P773-N775 VanDerWaalsContact O-N 3.14Å; P773-L776 PolarHBondContact O-N 3.21Å
774	Q	94.9	Very high	95	Very high	104 Å²	104	63 Å²	63	49%	0.486	35%	0.345	S	S	.	.	G	3₁₀ helix	trans	-71.4	1.7	178.9	73.7	-81.4	18.3	0	0	115.2	L772 K778	L772-Q774 VanDerWaalsContact C-N 3.28Å; L772-Q774 PolarHBondContact O-N 3.22Å; Q774-K778 WeakPolarHBondContact O-CE 3.16Å; Q774-K778 PolarHBondContact O-NZ 3.37Å
775	N	97.1	Very high	95.3	Very high	5 Å²	5	59.8 Å²	59.8	3%	0.027	31%	0.306	C	S	.	.	G	3₁₀ helix	trans	-121.2	-5.3	179.2	-68.8	-18.7	0	0	0	112.8	F769 L772 P773 K778 N779 Y800	F769-N775 PolarHBondContact O-ND2 3.27Å; L772-N775 WeakPolarHBondContact O-CB 3.44Å; L772-N775 PolarHBondContact O-N 3.47Å; P773-N775 PolarHBondContact O-N 3.06Å; P773-N775 VanDerWaalsContact O-N 3.14Å; N775-K778 PolarHBondContact O-N 3.31Å; N775-N779 PolarHBondContact O-ND2 3.46Å; N775-Y800 HydrophobicContact CB-CD1 3.58Å; N775-Y800 HydrophobicContact CB-CE1 3.91Å; N775-Y800 HydrophobicContact CB-CG 3.99Å; N775-Y800 VanDerWaalsContact CG-CG 3.48Å; N775-Y800 WeakPolarHBondContact ND2-CB 3.49Å; N775-Y800 WeakPolarHBondContact OD1-CB 3.42Å
776	L	95.8	Very high	95.5	Very high	95 Å²	95	58 Å²	58	50%	0.497	30%	0.297	S	S	.	.	S	Bend	trans	-69.4	-35.1	-174	-70.2	178.2	0	0	0	113.3	L772 P773	L772-L776 PolarHBondContact O-N 3.19Å; P773-L776 PolarHBondContact O-N 3.21Å
777	D	96.3	Very high	95.7	Very high	83 Å²	83	55.8 Å²	55.8	44%	0.444	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-27	179.2	69.3	-51	0	0	0	112.7	N779 L826 H828	D777-N779 PolarHBondContact O-N 3.3Å; D777-L826 VanDerWaalsContact O-CD1 3.26Å; D777-L826 WeakPolarHBondContact O-CD1 3.37Å; D777-H828 PolarHBondContact O-CE1 2.82Å; D777-H828 PolarHBondContact O-NE2 2.85Å; D777-H828 IonicContact OD2-CD2 3.83Å; D777-H828 PolarHBondContact OD2-CD2 3.1Å; D777-H828 IonicContact OD2-NE2 2.78Å; D777-H828 PolarHBondContact OD2-NE2 2.84Å
778	K	97.8	Very high	95.9	Very high	10 Å²	10	56.2 Å²	56.2	4%	0.043	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71	-4.9	173.6	-62.5	168.4	-168	158.5	0	112.8	Q774 N775 E798 Y800 Q823 T829	Q774-K778 WeakPolarHBondContact O-CE 3.16Å; Q774-K778 PolarHBondContact O-NZ 3.37Å; N775-K778 PolarHBondContact O-N 3.31Å; K778-E798 WeakPolarHBondContact CE-OE2 3.4Å; K778-E798 IonicContact NZ-OE1 2.88Å; K778-E798 PolarHBondContact NZ-OE1 3.21Å; K778-E798 IonicContact NZ-OE2 2.89Å; K778-E798 PolarHBondContact NZ-OE2 2.85Å; K778-Y800 HydrophobicContact CB-CD1 4.19Å; K778-Y800 HydrophobicContact CB-CE1 4.19Å; K778-Y800 HydrophobicContact CD-CD1 4.26Å; K778-Q823 PolarHBondContact O-NE2 3.36Å; K778-T829 HydrophobicContact CB-CG2 4.15Å; K778-T829 HydrophobicContact CG-CG2 4.17Å
779	N	97.8	Very high	96	Very high	12 Å²	12	57.2 Å²	57.2	6%	0.064	29%	0.287	C	S	.	.			trans	-100.3	115.5	175.7	-61.7	-51.3	0	0	0	111.6	A770 N775 D777 Y781 L785 Y800 N802	A770-N779 PolarHBondContact O-ND2 3.24Å; N775-N779 PolarHBondContact O-ND2 3.46Å; D777-N779 PolarHBondContact O-N 3.3Å; N779-Y781 PolarHBondContact O-N 2.7Å; N779-L785 HydrophobicContact CB-CD2 4.09Å; N779-Y800 PolarHBondContact OD1-OH 2.81Å; N779-N802 PolarHBondContact OD1-ND2 3.33Å
780	R	96.6	Very high	96	Very high	46 Å²	46	54.6 Å²	54.6	17%	0.174	28%	0.277	C	S	.	.	S	Bend	trans	-63.4	-29.4	175.8	179.9	177.6	-78.3	-82.9	0.1	112.7	G824 P825 L826 T857 K858 S948	R780-G824 PolarHBondContact NE-O 3.44Å; R780-G824 PolarHBondContact NH2-O 2.91Å; R780-P825 PolarHBondContact NH2-O 3.41Å; R780-L826 HydrophobicContact CB-CD1 4.31Å; R780-L826 HydrophobicContact CB-CD2 4.05Å; R780-L826 HydrophobicContact CB-CG 4.19Å; R780-L826 HydrophobicContact CG-CD2 4.14Å; R780-T857 PolarHBondContact NH1-O 3.27Å; R780-T857 VanDerWaalsContact NH1-O 3.12Å; R780-K858 WeakPolarHBondContact CD-O 3.18Å; R780-K858 PolarHBondContact NE-O 3.46Å; R780-K858 VanDerWaalsContact NE-O 3.16Å; R780-K858 PolarHBondContact NH1-O 3.49Å; R780-K858 VanDerWaalsContact NH1-O 3.07Å; R780-S948 WeakPolarHBondContact CD-O 3.44Å
781	Y	94.3	Very high	96.1	Very high	61 Å²	61	55.3 Å²	55.3	24%	0.239	28%	0.28	C	S	.	.	S	Bend	trans	-130.9	130.4	177.5	-65.7	-94.4	0	0	0	109.1	N779 D783 V784 S948 A949	N779-Y781 PolarHBondContact O-N 2.7Å; Y781-D783 PolarHBondContact O-N 2.81Å; Y781-V784 HydrophobicContact CG-CG2 4.37Å; Y781-S948 WeakPolarHBondContact CE2-OG 3.41Å; Y781-S948 PolarHBondContact OH-OG 2.86Å; Y781-A949 HydrophobicContact CD2-CB 3.79Å; Y781-A949 HydrophobicContact CE2-CB 3.7Å
782	K	91.8	Very high	96.2	Very high	148 Å²	148	49.5 Å²	49.5	64%	0.643	26%	0.255	S	S	*	.	S	Bend	trans	-72.4	-14.6	-171.7	-64.7	-179	179.3	177.1	0	114.1
783	D	88.9	Confident	96.3	Very high	112 Å²	112	51.2 Å²	51.2	60%	0.599	26%	0.264	S	S	*	.	S	Bend	trans	-114.6	-17.6	-173.2	58.3	-37.9	0	0	0	113.3	Y781 L785 M988	Y781-D783 PolarHBondContact O-N 2.81Å; D783-L785 PolarHBondContact O-N 2.79Å; D783-M988 WeakPolarHBondContact O-CE 3.29Å
784	V	94.4	Very high	96.4	Very high	10 Å²	10	47.1 Å²	47.1	6%	0.061	24%	0.236	C	C	.	.			trans	-95	91.5	174	-171.2	0	0	0	0	109.2	Y781 N802 A949 I951 M988	Y781-V784 HydrophobicContact CG-CG2 4.37Å; V784-N802 PolarHBondContact O-ND2 3.38Å; V784-A949 HydrophobicContact CG1-CB 4.33Å; V784-A949 WeakPolarHBondContact CG1-O 3.45Å; V784-A949 HydrophobicContact CG2-CB 4.31Å; V784-I951 HydrophobicContact CB-CD1 4.5Å; V784-I951 HydrophobicContact CG1-CD1 3.83Å; V784-I951 HydrophobicContact CG1-CG1 4.04Å; V784-I951 HydrophobicContact CG1-CG2 3.72Å; V784-I951 HydrophobicContact CG2-CD1 3.8Å; V784-M988 HydrophobicContact CB-CE 4.4Å; V784-M988 HydrophobicContact CG2-CE 3.89Å
785	L	97.6	Very high	96.1	Very high	18 Å²	18	48.9 Å²	48.9	9%	0.094	25%	0.245	C	C	.	.			trans	-124.6	145.6	-172.5	-55.8	178.6	0	0	0	111	V767 A770 K771 N779 D783	V767-L785 HydrophobicContact CG1-CB 3.59Å; V767-L785 HydrophobicContact CG1-CD1 3.75Å; V767-L785 HydrophobicContact CG1-CG 4.34Å; A770-L785 HydrophobicContact CB-CB 3.93Å; A770-L785 HydrophobicContact CB-CD1 4.3Å; A770-L785 HydrophobicContact CB-CD2 4.23Å; A770-L785 HydrophobicContact CB-CG 4.37Å; K771-L785 HydrophobicContact CG-CD1 3.88Å; N779-L785 HydrophobicContact CB-CD2 4.09Å; D783-L785 PolarHBondContact O-N 2.79Å
786	P	98.1	Very high	95.6	Very high	1 Å²	1	51.8 Å²	51.8	1%	0.006	28%	0.275	C	S	.	.			trans	-70.4	157	174.7	33.1	-37.6	0	0	0	111.3	A770 R791 Y800 S804	A770-P786 HydrophobicContact CB-CG 4.14Å; P786-R791 HydrophobicContact CB-CB 3.91Å; P786-R791 HydrophobicContact CG-CB 4.11Å; P786-Y800 WeakPolarHBondContact CD-OH 3.44Å; P786-Y800 HydrophobicContact CG-CE2 3.94Å; P786-S804 VanDerWaalsContact CB-OG 3.26Å; P786-S804 WeakPolarHBondContact CB-OG 3.44Å
787	Y	98.4	Very high	95	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	30%	0.297	C	S	.	.			trans	-77.3	147.2	167.4	-56.6	-73	0	0	0	110.6	K761 K762 L765 A766 V767 T789 T790 R791 R983 Q985 A987	K761-Y787 HydrophobicContact CD-CE1 4.18Å; K761-Y787 VanDerWaalsContact CE-CE1 3.47Å; K761-Y787 HydrophobicContact CG-CE1 3.56Å; K762-Y787 PolarHBondContact N-OH 2.93Å; L765-Y787 HydrophobicContact CB-CD1 3.37Å; L765-Y787 HydrophobicContact CB-CE1 3.57Å; L765-Y787 HydrophobicContact CB-CG 4.07Å; L765-Y787 HydrophobicContact CD1-CD1 3.87Å; L765-Y787 HydrophobicContact CD1-CD2 3.88Å; L765-Y787 HydrophobicContact CD1-CE1 3.85Å; L765-Y787 HydrophobicContact CD1-CE2 3.9Å; L765-Y787 HydrophobicContact CD1-CG 3.87Å; L765-Y787 HydrophobicContact CG-CD1 4.28Å; L765-Y787 HydrophobicContact CG-CE1 4.33Å; A766-Y787 WeakPolarHBondContact O-CA 3.43Å; V767-Y787 HydrophobicContact CG2-CD1 3.88Å; Y787-T789 PolarHBondContact O-N 3.16Å; Y787-T789 VanDerWaalsContact O-N 3.13Å; Y787-T790 PolarHBondContact O-N 3.32Å; Y787-T790 VanDerWaalsContact O-N 3.16Å; Y787-R791 WeakPolarHBondContact O-CB 3.46Å; Y787-R791 PolarHBondContact O-N 2.98Å; Y787-R983 WeakPolarHBondContact CE2-O 3.36Å; Y787-R983 PolarHBondContact OH-O 3.46Å; Y787-Q985 WeakPolarHBondContact CD2-O 3.09Å; Y787-A987 HydrophobicContact CE1-CB 4.43Å; Y787-A987 HydrophobicContact CE2-CB 4.4Å
788	D	98.1	Very high	94.6	Very high	26 Å²	26	56 Å²	56	14%	0.139	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-25.7	-179.7	-61.7	-33.6	0	0	0	112.9	A766 V767 T768 F769	A766-D788 HydrophobicContact CB-CB 4.27Å; A766-D788 WeakPolarHBondContact CB-OD2 3.28Å; A766-D788 PolarHBondContact O-N 2.86Å; V767-D788 WeakPolarHBondContact CA-OD2 3.12Å; V767-D788 PolarHBondContact N-OD2 3.29Å; V767-D788 VanDerWaalsContact N-OD2 3.1Å; T768-D788 WeakPolarHBondContact CB-OD2 3.34Å; T768-D788 PolarHBondContact N-OD1 2.96Å; T768-D788 PolarHBondContact N-OD2 3.05Å; T768-D788 PolarHBondContact OG1-OD1 2.96Å; T768-D788 PolarHBondContact OG1-OD2 3.07Å; F769-D788 HydrophobicContact CD2-CB 3.84Å; F769-D788 WeakPolarHBondContact CD2-OD1 2.99Å; F769-D788 HydrophobicContact CE2-CB 4.24Å; F769-D788 PolarHBondContact N-OD1 3.34Å
789	T	97.9	Very high	94.5	Very high	102 Å²	102	58.1 Å²	58.1	63%	0.626	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.4	-13.9	-178.9	51.5	0	0	0	0	114.8	Y787	Y787-T789 PolarHBondContact O-N 3.16Å; Y787-T789 VanDerWaalsContact O-N 3.13Å
790	T	98.1	Very high	94.5	Very high	23 Å²	23	57.6 Å²	57.6	14%	0.141	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-130.1	-1.8	-175.9	59.8	0	0	0	0	113.7	Y787 S804 Y805 Q985	Y787-T790 PolarHBondContact O-N 3.32Å; Y787-T790 VanDerWaalsContact O-N 3.16Å; T790-S804 CarbonylContact O-C 3.56Å; T790-S804 VanDerWaalsContact O-CA 3.3Å; T790-S804 WeakPolarHBondContact O-CA 3.38Å; T790-Y805 WeakPolarHBondContact O-CD2 3.4Å; T790-Y805 PolarHBondContact O-N 3.17Å; T790-Q985 WeakPolarHBondContact CB-O 3.42Å; T790-Q985 HydrophobicContact CG2-CB 4.47Å; T790-Q985 PolarHBondContact OG1-O 3.23Å
791	R	98.1	Very high	94.6	Very high	15 Å²	15	55.9 Å²	55.9	6%	0.057	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.7	147	173.8	68.8	-179.6	-178.5	110.9	-7.1	111.4	F769 P786 Y787 L793 D799 A803	F769-R791 VanDerWaalsContact CE1-NH2 3.31Å; F769-R791 VanDerWaalsContact CG-NH2 3.29Å; P786-R791 HydrophobicContact CB-CB 3.91Å; P786-R791 HydrophobicContact CG-CB 4.11Å; Y787-R791 WeakPolarHBondContact O-CB 3.46Å; Y787-R791 PolarHBondContact O-N 2.98Å; R791-L793 HydrophobicContact CG-CD2 4Å; R791-D799 IonicContact CZ-OD1 3.41Å; R791-D799 IonicContact CZ-OD2 3.07Å; R791-D799 VanDerWaalsContact CZ-OD2 3.28Å; R791-D799 PolarHBondContact NH1-O 2.75Å; R791-D799 IonicContact NH1-OD1 2.78Å; R791-D799 PolarHBondContact NH1-OD1 2.69Å; R791-D799 IonicContact NH1-OD2 3.16Å; R791-D799 PolarHBondContact NH1-OD2 3.33Å; R791-D799 IonicContact NH2-OD1 3.46Å; R791-D799 IonicContact NH2-OD2 3.56Å; R791-D799 PolarHBondContact NH2-OD2 3.11Å; R791-A803 WeakPolarHBondContact CA-O 3.48Å
792	V	98.2	Very high	94.8	Very high	1 Å²	1	53 Å²	53	1%	0.006	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	141.2	165.2	-176.6	0	0	0	0	108.4	I801 A803 Y805 I820 V836	V792-I801 HydrophobicContact CB-CG2 4Å; V792-I801 HydrophobicContact CG1-CG2 4.34Å; V792-A803 HydrophobicContact CB-CB 4.03Å; V792-A803 HydrophobicContact CG2-CB 3.66Å; V792-A803 PolarHBondContact N-O 2.89Å; V792-A803 VanDerWaalsContact N-O 3.15Å; V792-Y805 HydrophobicContact CB-CE2 4.38Å; V792-Y805 HydrophobicContact CG2-CD2 4.32Å; V792-Y805 HydrophobicContact CG2-CE1 4.25Å; V792-Y805 HydrophobicContact CG2-CE2 4.06Å; V792-I820 HydrophobicContact CG2-CG1 4.47Å; V792-I820 HydrophobicContact CG2-CG2 3.83Å; V792-V836 HydrophobicContact CG1-CG1 4.16Å; V792-V836 HydrophobicContact CG1-CG2 3.8Å
793	L	97.5	Very high	95.1	Very high	101 Å²	101	46 Å²	46	53%	0.529	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	135.9	174.2	-54.8	-179.2	0	0	0	108.3	R791	R791-L793 HydrophobicContact CG-CD2 4Å
794	L	95.9	Very high	95.6	Very high	16 Å²	16	40.7 Å²	40.7	8%	0.084	23%	0.229	C	C	.	.	P	Polyproline II helix	trans	-94	154.8	170.6	-54.8	175.6	0	0	0	110.4	E798 D799 I801 Q832 V836	L794-E798 WeakPolarHBondContact CB-O 3.48Å; L794-D799 PolarHBondContact N-O 3.46Å; L794-D799 VanDerWaalsContact N-O 3.14Å; L794-I801 HydrophobicContact CD1-CB 4.25Å; L794-I801 HydrophobicContact CD2-CB 4.29Å; L794-I801 HydrophobicContact CD2-CG2 3.89Å; L794-I801 HydrophobicContact CG-CB 4.38Å; L794-I801 HydrophobicContact CG-CG2 4.17Å; L794-Q832 HydrophobicContact CD1-CB 3.71Å; L794-Q832 HydrophobicContact CD1-CG 3.52Å; L794-V836 HydrophobicContact CD2-CG2 3.51Å
795	Q	90.3	Very high	95.8	Very high	142 Å²	142	43.7 Å²	43.7	66%	0.664	24%	0.24	S	C	*	.	S	Bend	trans	-80.7	142.3	167.1	-66.7	-179.9	87.7	0	0	111.1	D839	Q795-D839 PolarHBondContact NE2-OD1 2.86Å; Q795-D839 VanDerWaalsContact NE2-OD1 3.11Å; Q795-D839 PolarHBondContact NE2-OD2 2.87Å
796	G	85.9	Confident	95.8	Very high	65 Å²	65	42.9 Å²	42.9	67%	0.67	24%	0.235	S	C	*	.	S	Bend	trans	111.7	-161.2	176.4	0	0	0	0	0	114.4	E798	G796-E798 VanDerWaalsContact C-N 3.31Å; G796-E798 PolarHBondContact O-N 3.43Å
797	N	83.2	Confident	95.8	Very high	179 Å²	179	45.3 Å²	45.3	96%	0.957	25%	0.248	S	C	*	.	S	Bend	trans	-73.6	-20.3	-175.7	-68.8	-17	0	0	0	113.8
798	E	88.6	Confident	95.8	Very high	87 Å²	87	45.4 Å²	45.4	41%	0.407	25%	0.249	S	C	.	.			trans	-119.1	99.1	179	-60.5	-152.3	127.2	0	0	110.3	K778 L794 G796 Y800	K778-E798 WeakPolarHBondContact CE-OE2 3.4Å; K778-E798 IonicContact NZ-OE1 2.88Å; K778-E798 PolarHBondContact NZ-OE1 3.21Å; K778-E798 IonicContact NZ-OE2 2.89Å; K778-E798 PolarHBondContact NZ-OE2 2.85Å; L794-E798 WeakPolarHBondContact CB-O 3.48Å; G796-E798 VanDerWaalsContact C-N 3.31Å; G796-E798 PolarHBondContact O-N 3.43Å; E798-Y800 PolarHBondContact O-N 3.32Å
799	D	95.4	Very high	95.6	Very high	55 Å²	55	49.4 Å²	49.4	29%	0.294	27%	0.267	S	S	.	.			trans	-81.6	7.7	-172.5	81.6	-16.8	0	0	0	114.9	R791 L794	R791-D799 IonicContact CZ-OD1 3.41Å; R791-D799 IonicContact CZ-OD2 3.07Å; R791-D799 VanDerWaalsContact CZ-OD2 3.28Å; R791-D799 PolarHBondContact NH1-O 2.75Å; R791-D799 IonicContact NH1-OD1 2.78Å; R791-D799 PolarHBondContact NH1-OD1 2.69Å; R791-D799 IonicContact NH1-OD2 3.16Å; R791-D799 PolarHBondContact NH1-OD2 3.33Å; R791-D799 IonicContact NH2-OD1 3.46Å; R791-D799 IonicContact NH2-OD2 3.56Å; R791-D799 PolarHBondContact NH2-OD2 3.11Å; L794-D799 PolarHBondContact N-O 3.46Å; L794-D799 VanDerWaalsContact N-O 3.14Å
800	Y	98	Very high	95.3	Very high	2 Å²	2	44.8 Å²	44.8	1%	0.008	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	125.4	-161.7	-175.8	-97.5	0	0	0	115.3	A770 N775 K778 N779 P786 E798	A770-Y800 HydrophobicContact CB-CE2 3.79Å; A770-Y800 VanDerWaalsContact CB-OH 3.25Å; A770-Y800 WeakPolarHBondContact CB-OH 3.4Å; N775-Y800 HydrophobicContact CB-CD1 3.58Å; N775-Y800 HydrophobicContact CB-CE1 3.91Å; N775-Y800 HydrophobicContact CB-CG 3.99Å; N775-Y800 VanDerWaalsContact CG-CG 3.48Å; N775-Y800 WeakPolarHBondContact ND2-CB 3.49Å; N775-Y800 WeakPolarHBondContact OD1-CB 3.42Å; K778-Y800 HydrophobicContact CB-CD1 4.19Å; K778-Y800 HydrophobicContact CB-CE1 4.19Å; K778-Y800 HydrophobicContact CD-CD1 4.26Å; N779-Y800 PolarHBondContact OD1-OH 2.81Å; P786-Y800 WeakPolarHBondContact CD-OH 3.44Å; P786-Y800 HydrophobicContact CG-CE2 3.94Å; E798-Y800 PolarHBondContact O-N 3.32Å
801	I	98.2	Very high	94.7	Very high	10 Å²	10	48.5 Å²	48.5	5%	0.051	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	148.9	162.3	-176.1	167.8	0	0	0	109.1	V792 L794 A803 Q832 F833 V836	V792-I801 HydrophobicContact CB-CG2 4Å; V792-I801 HydrophobicContact CG1-CG2 4.34Å; L794-I801 HydrophobicContact CD1-CB 4.25Å; L794-I801 HydrophobicContact CD2-CB 4.29Å; L794-I801 HydrophobicContact CD2-CG2 3.89Å; L794-I801 HydrophobicContact CG-CB 4.38Å; L794-I801 HydrophobicContact CG-CG2 4.17Å; I801-A803 HydrophobicContact CG1-CB 4.37Å; I801-A803 HydrophobicContact CG2-CB 3.96Å; I801-A803 PolarHBondContact O-N 3.14Å; I801-Q832 HydrophobicContact CD1-CB 4.32Å; I801-F833 HydrophobicContact CD1-CB 4.49Å; I801-V836 HydrophobicContact CD1-CG2 4.04Å; I801-V836 HydrophobicContact CG2-CG2 4Å
802	N	98.4	Very high	94.1	Very high	1 Å²	1	52 Å²	52	1%	0.005	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	65.9	172.4	-167.7	-39.9	0	0	0	111.3	N779 V784 T822 Q823 R986	N779-N802 PolarHBondContact OD1-ND2 3.33Å; V784-N802 PolarHBondContact O-ND2 3.38Å; N802-T822 PolarHBondContact O-OG1 2.87Å; N802-T822 VanDerWaalsContact O-OG1 3.09Å; N802-Q823 HydrophobicContact CB-CG 4.19Å; N802-Q823 PolarHBondContact O-N 2.86Å; N802-R986 PolarHBondContact OD1-NH1 3.4Å; N802-R986 VanDerWaalsContact OD1-NH1 3.08Å; N802-R986 PolarHBondContact OD1-NH2 3.26Å
803	A	98.5	Very high	93.3	Very high	1 Å²	1	53.6 Å²	53.6	1%	0.008	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	155.3	173.6	0	0	0	0	0	109.9	R791 V792 I801 I820 A821 T822	R791-A803 WeakPolarHBondContact CA-O 3.48Å; V792-A803 HydrophobicContact CB-CB 4.03Å; V792-A803 HydrophobicContact CG2-CB 3.66Å; V792-A803 PolarHBondContact N-O 2.89Å; V792-A803 VanDerWaalsContact N-O 3.15Å; I801-A803 HydrophobicContact CG1-CB 4.37Å; I801-A803 HydrophobicContact CG2-CB 3.96Å; I801-A803 PolarHBondContact O-N 3.14Å; A803-I820 HydrophobicContact CB-CG2 3.91Å; A803-A821 CarbonylContact C-O 3.57Å; A803-A821 WeakPolarHBondContact CA-O 3.22Å; A803-T822 WeakPolarHBondContact CB-OG1 3.46Å
804	S	98.7	Very high	92.9	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	136.5	176.5	-48.3	0	0	0	0	110.6	P786 T790 V806 A821 R986	P786-S804 VanDerWaalsContact CB-OG 3.26Å; P786-S804 WeakPolarHBondContact CB-OG 3.44Å; T790-S804 CarbonylContact O-C 3.56Å; T790-S804 VanDerWaalsContact O-CA 3.3Å; T790-S804 WeakPolarHBondContact O-CA 3.38Å; S804-V806 PolarHBondContact O-N 2.94Å; S804-A821 PolarHBondContact N-O 3.3Å; S804-A821 PolarHBondContact O-N 3.18Å; S804-R986 PolarHBondContact OG-NH1 2.78Å
805	Y	98.6	Very high	92.7	Very high	73 Å²	73	58.1 Å²	58.1	29%	0.286	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.2	130.4	161.4	-62.5	-70.6	0	0	0	109.1	T790 V792 I820 Q840	T790-Y805 WeakPolarHBondContact O-CD2 3.4Å; T790-Y805 PolarHBondContact O-N 3.17Å; V792-Y805 HydrophobicContact CB-CE2 4.38Å; V792-Y805 HydrophobicContact CG2-CD2 4.32Å; V792-Y805 HydrophobicContact CG2-CE1 4.25Å; V792-Y805 HydrophobicContact CG2-CE2 4.06Å; Y805-I820 HydrophobicContact CD1-CG1 4.12Å; Y805-I820 HydrophobicContact CE1-CD1 4.3Å; Y805-I820 HydrophobicContact CE1-CG1 4.19Å; Y805-Q840 PolarHBondContact OH-NE2 3.14Å; Y805-Q840 VanDerWaalsContact OH-NE2 3.08Å
806	V	98.5	Very high	92.9	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	114.5	171.4	-178.9	0	0	0	0	106.4	S804 M808 Y819 A821 M982 Q985 R986 M989	S804-V806 PolarHBondContact O-N 2.94Å; V806-M808 HydrophobicContact CG1-SD 4.07Å; V806-Y819 PolarHBondContact N-O 3.46Å; V806-Y819 WeakPolarHBondContact O-CB 3.47Å; V806-Y819 WeakPolarHBondContact O-CD2 3.38Å; V806-Y819 PolarHBondContact O-N 2.8Å; V806-A821 HydrophobicContact CG2-CB 3.83Å; V806-M982 HydrophobicContact CG1-CG 4.19Å; V806-Q985 HydrophobicContact CB-CB 4.47Å; V806-Q985 HydrophobicContact CG1-CB 4.36Å; V806-Q985 HydrophobicContact CG2-CB 4.17Å; V806-R986 HydrophobicContact CG2-CB 3.96Å; V806-M989 HydrophobicContact CG1-CE 4.27Å; V806-M989 HydrophobicContact CG1-SD 4.16Å; V806-M989 HydrophobicContact CG2-CE 4.31Å; V806-M989 HydrophobicContact CG2-SD 3.83Å
807	N	97.7	Very high	93.4	Very high	52 Å²	52	51.8 Å²	51.8	28%	0.278	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	123.2	-177.1	-63.7	-40.6	0	0	0	108.9	V816 Q985	N807-V816 HydrophobicContact CB-CG1 3.87Å; N807-Q985 PolarHBondContact O-NE2 3.32Å; N807-Q985 PolarHBondContact O-OE1 3.26Å
808	M	97.3	Very high	94.1	Very high	2 Å²	2	47 Å²	47	1%	0.01	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	94	-178.4	-59.8	-54	-68.7	0	0	109.5	V806 N817 Y819 V958 T962 I978 K981 M982	V806-M808 HydrophobicContact CG1-SD 4.07Å; M808-N817 HydrophobicContact CB-CB 4.48Å; M808-N817 PolarHBondContact N-O 3.22Å; M808-N817 PolarHBondContact O-N 3.48Å; M808-Y819 HydrophobicContact CB-CE2 4.07Å; M808-Y819 HydrophobicContact CG-CD2 4.19Å; M808-Y819 HydrophobicContact CG-CE2 3.66Å; M808-V958 HydrophobicContact CG-CG1 3.58Å; M808-V958 HydrophobicContact SD-CG1 4.1Å; M808-T962 HydrophobicContact CB-CG2 4.42Å; M808-T962 HydrophobicContact CE-CG2 4.18Å; M808-I978 HydrophobicContact CE-CG2 3.74Å; M808-K981 HydrophobicContact CE-CB 4.14Å; M808-M982 HydrophobicContact CE-CG 3.85Å; M808-M982 HydrophobicContact SD-CG 3.61Å
809	E	94.3	Very high	94.5	Very high	111 Å²	111	42.9 Å²	42.9	52%	0.519	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	129.2	179.5	-62.1	170.3	-173	0	0	111.8	V816 K981	E809-V816 HydrophobicContact CG-CG1 4.16Å; E809-V816 HydrophobicContact CG-CG2 4.08Å; E809-K981 PolarHBondContact O-NZ 3.05Å; E809-K981 VanDerWaalsContact O-NZ 3.11Å
810	I	91	Very high	94.7	Very high	5 Å²	5	40.2 Å²	40.2	3%	0.026	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	83.2	168.5	-56.3	177.8	0	0	0	106.9	A812 A813 N814 L815 C965 L966 L971	I810-A812 VanDerWaalsContact C-N 3.34Å; I810-A812 PolarHBondContact O-N 3.21Å; I810-A813 HydrophobicContact CB-CB 4.39Å; I810-A813 HydrophobicContact CG2-CB 3.79Å; I810-A813 PolarHBondContact O-N 2.91Å; I810-N814 PolarHBondContact O-N 2.89Å; I810-L815 HydrophobicContact CB-CB 4.49Å; I810-L815 HydrophobicContact CD1-CD2 4.49Å; I810-L815 PolarHBondContact N-O 3.23Å; I810-L815 PolarHBondContact O-N 2.8Å; I810-C965 HydrophobicContact CD1-CB 3.38Å; I810-L966 HydrophobicContact CD1-CD2 4.39Å; I810-L966 HydrophobicContact CD1-CG 4.34Å; I810-L966 HydrophobicContact CG1-CD2 4.33Å; I810-L966 HydrophobicContact CG2-CD2 3.85Å; I810-L971 HydrophobicContact CG2-CD1 3.72Å
811	P	87.2	Confident	94.7	Very high	101 Å²	101	40.1 Å²	40.1	66%	0.656	23%	0.227	S	C	*	.	G	3₁₀ helix	trans	-61.9	-37.5	-166.9	-26.2	36.2	0	0	0	114	A813 N814	P811-A813 PolarHBondContact O-N 2.97Å; P811-A813 VanDerWaalsContact O-N 3.09Å; P811-N814 PolarHBondContact O-N 3.12Å; P811-N814 VanDerWaalsContact O-N 3.07Å
812	A	84.2	Confident	94.8	Very high	87 Å²	87	39.8 Å²	39.8	72%	0.719	23%	0.225	S	C	*	.	G	3₁₀ helix	trans	-63.1	-13.6	177.5	0	0	0	0	0	114.1	I810 L971	I810-A812 VanDerWaalsContact C-N 3.34Å; I810-A812 PolarHBondContact O-N 3.21Å; A812-L971 HydrophobicContact CB-CD1 4.04Å; A812-L971 HydrophobicContact CB-CD2 3.99Å
813	A	82.7	Confident	94.7	Very high	35 Å²	35	40 Å²	40	29%	0.289	23%	0.226	S	C	.	.	G	3₁₀ helix	trans	-110.6	1.9	177.8	0	0	0	0	0	113.3	I810 P811 L815	I810-A813 HydrophobicContact CB-CB 4.39Å; I810-A813 HydrophobicContact CG2-CB 3.79Å; I810-A813 PolarHBondContact O-N 2.91Å; P811-A813 PolarHBondContact O-N 2.97Å; P811-A813 VanDerWaalsContact O-N 3.09Å; A813-L815 HydrophobicContact CB-CB 3.92Å; A813-L815 PolarHBondContact O-N 3.27Å; A813-L815 VanDerWaalsContact O-N 3.09Å
814	N	89.3	Confident	94.7	Very high	158 Å²	158	40 Å²	40	85%	0.845	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	47.9	31.4	-166.6	-165.2	36.2	0	0	0	113.4	I810 P811	I810-N814 PolarHBondContact O-N 2.89Å; P811-N814 PolarHBondContact O-N 3.12Å; P811-N814 VanDerWaalsContact O-N 3.07Å
815	L	90.9	Very high	94.7	Very high	54 Å²	54	40.1 Å²	40.1	28%	0.283	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	135.7	-171.7	179.2	62	0	0	0	110.5	I810 A813 N817	I810-L815 HydrophobicContact CB-CB 4.49Å; I810-L815 HydrophobicContact CD1-CD2 4.49Å; I810-L815 PolarHBondContact N-O 3.23Å; I810-L815 PolarHBondContact O-N 2.8Å; A813-L815 HydrophobicContact CB-CB 3.92Å; A813-L815 PolarHBondContact O-N 3.27Å; A813-L815 VanDerWaalsContact O-N 3.09Å; L815-N817 WeakPolarHBondContact CG-OD1 3.49Å
816	V	94.8	Very high	94.7	Very high	60 Å²	60	37.9 Å²	37.9	36%	0.364	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	103.8	173.8	-173.5	0	0	0	0	108.6	N807 E809 K818	N807-V816 HydrophobicContact CB-CG1 3.87Å; E809-V816 HydrophobicContact CG-CG1 4.16Å; E809-V816 HydrophobicContact CG-CG2 4.08Å; V816-K818 HydrophobicContact CG1-CG 4.38Å; V816-K818 PolarHBondContact O-N 2.88Å
817	N	95.2	Very high	94.6	Very high	15 Å²	15	41.6 Å²	41.6	8%	0.08	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	112.7	173	-70.9	24.8	0	0	0	107.4	M808 L815 Y819 E961	M808-N817 HydrophobicContact CB-CB 4.48Å; M808-N817 PolarHBondContact N-O 3.22Å; M808-N817 PolarHBondContact O-N 3.48Å; L815-N817 WeakPolarHBondContact CG-OD1 3.49Å; N817-Y819 HydrophobicContact CB-CE2 3.67Å; N817-Y819 VanDerWaalsContact O-CD2 3.25Å; N817-Y819 WeakPolarHBondContact O-CD2 3.14Å; N817-Y819 WeakPolarHBondContact O-CE2 3.19Å; N817-E961 PolarHBondContact ND2-OE1 2.97Å
818	K	97.9	Very high	94.6	Very high	77 Å²	77	43.6 Å²	43.6	34%	0.335	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	145	-179.8	-58.4	-176.3	-167.3	167.8	0	110.7	V816 R937 G940 P942 A943	V816-K818 HydrophobicContact CG1-CG 4.38Å; V816-K818 PolarHBondContact O-N 2.88Å; K818-R937 PolarHBondContact O-NH1 2.76Å; K818-G940 WeakPolarHBondContact CD-O 3.38Å; K818-G940 VanDerWaalsContact CE-O 3.32Å; K818-G940 WeakPolarHBondContact CE-O 3.5Å; K818-G940 PolarHBondContact NZ-O 2.94Å; K818-P942 HydrophobicContact CB-CB 3.98Å; K818-P942 HydrophobicContact CB-CG 4.22Å; K818-P942 HydrophobicContact CD-CG 4.42Å; K818-A943 PolarHBondContact O-N 2.74Å; K818-A943 VanDerWaalsContact O-N 3.17Å
819	Y	98.5	Very high	94.6	Very high	1 Å²	1	43.9 Å²	43.9	0%	0.004	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	148.3	178.3	-51.8	-108.8	0	0	0	110.5	V806 M808 N817 R937 A943 V945 V958 E961	V806-Y819 PolarHBondContact N-O 3.46Å; V806-Y819 WeakPolarHBondContact O-CB 3.47Å; V806-Y819 WeakPolarHBondContact O-CD2 3.38Å; V806-Y819 PolarHBondContact O-N 2.8Å; M808-Y819 HydrophobicContact CB-CE2 4.07Å; M808-Y819 HydrophobicContact CG-CD2 4.19Å; M808-Y819 HydrophobicContact CG-CE2 3.66Å; N817-Y819 HydrophobicContact CB-CE2 3.67Å; N817-Y819 VanDerWaalsContact O-CD2 3.25Å; N817-Y819 WeakPolarHBondContact O-CD2 3.14Å; N817-Y819 WeakPolarHBondContact O-CE2 3.19Å; Y819-R937 VanDerWaalsContact CD1-NH2 3.3Å; Y819-A943 CarbonylContact C-O 3.46Å; Y819-A943 VanDerWaalsContact CA-O 3.25Å; Y819-A943 WeakPolarHBondContact CA-O 3.15Å; Y819-V945 HydrophobicContact CD1-CG2 3.93Å; Y819-V958 HydrophobicContact CD1-CG2 3.66Å; Y819-V958 HydrophobicContact CD2-CG1 4.33Å; Y819-V958 HydrophobicContact CE1-CB 4.15Å; Y819-V958 HydrophobicContact CE1-CG1 4.18Å; Y819-V958 HydrophobicContact CE1-CG2 3.56Å; Y819-V958 HydrophobicContact CE2-CG1 3.89Å; Y819-V958 HydrophobicContact CG-CG2 4.16Å; Y819-E961 VanDerWaalsContact OH-CD 3.29Å; Y819-E961 WeakPolarHBondContact OH-CG 3.11Å; Y819-E961 PolarHBondContact OH-OE2 2.77Å
820	I	98.7	Very high	94.7	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	103.9	162.6	-64.9	172	0	0	0	107.7	V792 A803 Y805 V836 L842 P942 A943 L944 V945	V792-I820 HydrophobicContact CG2-CG1 4.47Å; V792-I820 HydrophobicContact CG2-CG2 3.83Å; A803-I820 HydrophobicContact CB-CG2 3.91Å; Y805-I820 HydrophobicContact CD1-CG1 4.12Å; Y805-I820 HydrophobicContact CE1-CD1 4.3Å; Y805-I820 HydrophobicContact CE1-CG1 4.19Å; I820-V836 HydrophobicContact CD1-CG1 3.84Å; I820-V836 HydrophobicContact CG2-CG1 4.4Å; I820-L842 HydrophobicContact CD1-CD1 3.72Å; I820-L842 HydrophobicContact CD1-CD2 4.37Å; I820-P942 HydrophobicContact CD1-CB 4.17Å; I820-P942 HydrophobicContact CD1-CG 4.5Å; I820-P942 HydrophobicContact CG1-CB 3.92Å; I820-A943 PolarHBondContact N-O 2.84Å; I820-L944 HydrophobicContact CB-CG 4.39Å; I820-L944 HydrophobicContact CG2-CG 4.39Å; I820-V945 PolarHBondContact O-N 2.73Å
821	A	98.7	Very high	95	Very high	0 Å²	0	40 Å²	40	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	109.1	178.5	0	0	0	0	0	109.9	A803 S804 V806 V945 T954 R986 M989	A803-A821 CarbonylContact C-O 3.57Å; A803-A821 WeakPolarHBondContact CA-O 3.22Å; S804-A821 PolarHBondContact N-O 3.3Å; S804-A821 PolarHBondContact O-N 3.18Å; V806-A821 HydrophobicContact CG2-CB 3.83Å; A821-V945 WeakPolarHBondContact CA-O 3.45Å; A821-T954 HydrophobicContact CB-CG2 3.99Å; A821-R986 WeakPolarHBondContact O-CD 3.13Å; A821-R986 PolarHBondContact O-NE 2.94Å; A821-R986 PolarHBondContact O-NH1 3.34Å; A821-M989 HydrophobicContact CB-CE 4.31Å
822	T	98.7	Very high	95.5	Very high	3 Å²	3	37 Å²	37	2%	0.018	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	161.5	-174.4	-170.7	0	0	0	0	113	N802 A803 F833 L944 V945 H946 G950	N802-T822 PolarHBondContact O-OG1 2.87Å; N802-T822 VanDerWaalsContact O-OG1 3.09Å; A803-T822 WeakPolarHBondContact CB-OG1 3.46Å; T822-F833 HydrophobicContact CG2-CD2 4.37Å; T822-F833 HydrophobicContact CG2-CE2 4.02Å; T822-L944 HydrophobicContact CG2-CD1 4.48Å; T822-L944 HydrophobicContact CG2-CD2 3.73Å; T822-L944 HydrophobicContact CG2-CG 4.15Å; T822-V945 PolarHBondContact N-O 3.3Å; T822-V945 VanDerWaalsContact N-O 3.16Å; T822-H946 HydrophobicContact CG2-CB 3.68Å; T822-H946 WeakPolarHBondContact O-CA 3.29Å; T822-H946 WeakPolarHBondContact O-CB 3.42Å; T822-G950 WeakPolarHBondContact O-CA 3.37Å
823	Q	98.3	Very high	96.2	Very high	6 Å²	6	33 Å²	33	3%	0.028	18%	0.184	C	C	.	.	P	Polyproline II helix	trans	-70.4	161.6	169.4	71.4	-178	13	0	0	111.3	K778 N802 P825	K778-Q823 PolarHBondContact O-NE2 3.36Å; N802-Q823 HydrophobicContact CB-CG 4.19Å; N802-Q823 PolarHBondContact O-N 2.86Å; Q823-P825 WeakPolarHBondContact O-CD 3.16Å
824	G	98.1	Very high	96.9	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	17%	0.17	C	C	.	.	P	Polyproline II helix	trans	-67.7	125.3	166.1	0	0	0	0	0	110.2	R780 L826 C859 H946 C947 S948	R780-G824 PolarHBondContact NE-O 3.44Å; R780-G824 PolarHBondContact NH2-O 2.91Å; G824-L826 PolarHBondContact O-N 3.37Å; G824-C859 WeakPolarHBondContact CA-SG 3.43Å; G824-H946 WeakPolarHBondContact CA-ND1 3.43Å; G824-C947 WeakPolarHBondContact CA-O 3.49Å; G824-C947 PolarHBondContact N-O 2.81Å; G824-S948 PolarHBondContact N-O 3.33Å
825	P	98.3	Very high	97.3	Very high	3 Å²	3	25.9 Å²	25.9	2%	0.019	14%	0.14	C	C	.	.	P	Polyproline II helix	trans	-48.1	136.4	-175.5	-34.5	38.6	0	0	0	114.3	R780 Q823 F833 H860 Y862	R780-P825 PolarHBondContact NH2-O 3.41Å; Q823-P825 WeakPolarHBondContact O-CD 3.16Å; P825-F833 HydrophobicContact CG-CB 3.83Å; P825-F833 HydrophobicContact CG-CD1 4.27Å; P825-F833 HydrophobicContact CG-CD2 3.34Å; P825-F833 HydrophobicContact CG-CE2 3.85Å; P825-F833 HydrophobicContact CG-CG 3.56Å; P825-H860 WeakPolarHBondContact O-CB 3.45Å; P825-H860 PolarHBondContact O-N 2.95Å; P825-Y862 HydrophobicContact CB-CD1 4.14Å; P825-Y862 HydrophobicContact CG-CD1 3.64Å; P825-Y862 HydrophobicContact CG-CE1 4.04Å; P825-Y862 HydrophobicContact CG-CG 4.2Å
826	L	97.8	Very high	97.6	Very high	25 Å²	25	23.5 Å²	23.5	13%	0.131	13%	0.127	C	C	.	.	P	Polyproline II helix	trans	-79.5	155.8	159.3	-62.1	165	0	0	0	108.5	D777 R780 G824 H828 T829 C830	D777-L826 VanDerWaalsContact O-CD1 3.26Å; D777-L826 WeakPolarHBondContact O-CD1 3.37Å; R780-L826 HydrophobicContact CB-CD1 4.31Å; R780-L826 HydrophobicContact CB-CD2 4.05Å; R780-L826 HydrophobicContact CB-CG 4.19Å; R780-L826 HydrophobicContact CG-CD2 4.14Å; G824-L826 PolarHBondContact O-N 3.37Å; L826-H828 VanDerWaalsContact C-N 3.31Å; L826-H828 PolarHBondContact O-N 2.94Å; L826-T829 WeakPolarHBondContact CA-OG1 3.44Å; L826-T829 HydrophobicContact CB-CG2 4.14Å; L826-T829 WeakPolarHBondContact CB-OG1 3.24Å; L826-T829 HydrophobicContact CD1-CG2 4.47Å; L826-T829 PolarHBondContact N-OG1 3.13Å; L826-T829 WeakPolarHBondContact O-CA 3.47Å; L826-T829 PolarHBondContact O-N 3.07Å; L826-T829 PolarHBondContact O-OG1 3.46Å; L826-C830 PolarHBondContact O-N 2.89Å; L826-C830 PolarHBondContact O-SG 2.98Å
827	P	97.2	Very high	97.7	Very high	79 Å²	79	20.6 Å²	20.6	51%	0.513	11%	0.11	S	C	.	.	G	3₁₀ helix	trans	-50.7	-49	-176.1	-25.3	32.7	0	0	0	113	T829 C830 H860	P827-T829 PolarHBondContact O-N 3.05Å; P827-T829 VanDerWaalsContact O-N 3.13Å; P827-C830 PolarHBondContact O-N 3.4Å; P827-C830 PolarHBondContact O-SG 3.02Å; P827-H860 HydrophobicContact CG-CB 4.4Å
828	H	96.6	Very high	97.8	Very high	94 Å²	94	20.9 Å²	20.9	44%	0.435	11%	0.11	S	C	.	.	G	3₁₀ helix	trans	-78.5	12.6	179.2	68.2	-69.7	0	0	0	114.9	D777 L826 Q832	D777-H828 PolarHBondContact O-CE1 2.82Å; D777-H828 PolarHBondContact O-NE2 2.85Å; D777-H828 IonicContact OD2-CD2 3.83Å; D777-H828 PolarHBondContact OD2-CD2 3.1Å; D777-H828 IonicContact OD2-NE2 2.78Å; D777-H828 PolarHBondContact OD2-NE2 2.84Å; L826-H828 VanDerWaalsContact C-N 3.31Å; L826-H828 PolarHBondContact O-N 2.94Å; H828-Q832 PolarHBondContact O-OE1 3.45Å
829	T	97.6	Very high	97.7	Very high	8 Å²	8	19.7 Å²	19.7	5%	0.049	11%	0.107	C	C	.	.	G	3₁₀ helix	trans	-123.3	4.1	176.2	63.4	0	0	0	0	113.5	K778 L826 P827 Q832 F833	K778-T829 HydrophobicContact CB-CG2 4.15Å; K778-T829 HydrophobicContact CG-CG2 4.17Å; L826-T829 WeakPolarHBondContact CA-OG1 3.44Å; L826-T829 HydrophobicContact CB-CG2 4.14Å; L826-T829 WeakPolarHBondContact CB-OG1 3.24Å; L826-T829 HydrophobicContact CD1-CG2 4.47Å; L826-T829 PolarHBondContact N-OG1 3.13Å; L826-T829 WeakPolarHBondContact O-CA 3.47Å; L826-T829 PolarHBondContact O-N 3.07Å; L826-T829 PolarHBondContact O-OG1 3.46Å; P827-T829 PolarHBondContact O-N 3.05Å; P827-T829 VanDerWaalsContact O-N 3.13Å; T829-Q832 VanDerWaalsContact CA-OE1 3.26Å; T829-Q832 PolarHBondContact O-N 3.43Å; T829-F833 PolarHBondContact O-N 3.37Å
830	C	97.9	Very high	97.4	Very high	1 Å²	1	22.2 Å²	22.2	1%	0.007	12%	0.119	C	C	.	.	H	α-helix	trans	-71.1	-36.3	-176.2	-54.5	0	0	0	0	112.3	L826 P827 Q832 F833 W834 H872	L826-C830 PolarHBondContact O-N 2.89Å; L826-C830 PolarHBondContact O-SG 2.98Å; P827-C830 PolarHBondContact O-N 3.4Å; P827-C830 PolarHBondContact O-SG 3.02Å; C830-Q832 PolarHBondContact O-N 3.12Å; C830-F833 WeakPolarHBondContact O-CB 3.46Å; C830-F833 PolarHBondContact O-N 2.87Å; C830-W834 VanDerWaalsContact O-CD1 3.27Å; C830-W834 PolarHBondContact O-N 3.46Å; C830-H872 WeakPolarHBondContact CB-NE2 3.4Å
831	A	96.8	Very high	97.3	Very high	32 Å²	32	25.3 Å²	25.3	26%	0.264	13%	0.132	S	C	.	.	H	α-helix	trans	-60.1	-44.3	172.5	0	0	0	0	0	111.7	F833 W834 Q835	A831-F833 VanDerWaalsContact C-N 3.33Å; A831-F833 PolarHBondContact O-N 2.98Å; A831-W834 PolarHBondContact O-N 2.92Å; A831-Q835 WeakPolarHBondContact O-CB 3.1Å; A831-Q835 PolarHBondContact O-N 2.84Å
832	Q	97.4	Very high	97.2	Very high	40 Å²	40	25.3 Å²	25.3	19%	0.187	13%	0.132	C	C	.	.	H	α-helix	trans	-66.5	-33	176.3	-66.5	82.9	-8.1	0	0	112.3	L794 I801 H828 T829 C830 V836	L794-Q832 HydrophobicContact CD1-CB 3.71Å; L794-Q832 HydrophobicContact CD1-CG 3.52Å; I801-Q832 HydrophobicContact CD1-CB 4.32Å; H828-Q832 PolarHBondContact O-OE1 3.45Å; T829-Q832 VanDerWaalsContact CA-OE1 3.26Å; T829-Q832 PolarHBondContact O-N 3.43Å; C830-Q832 PolarHBondContact O-N 3.12Å; Q832-V836 WeakPolarHBondContact O-CG2 3.47Å; Q832-V836 PolarHBondContact O-N 2.92Å
833	F	98.3	Very high	97.2	Very high	2 Å²	2	26.5 Å²	26.5	1%	0.009	14%	0.141	C	C	.	.	H	α-helix	trans	-64.9	-49.2	173.5	177.9	-86.8	0	0	0	111.2	I801 T822 P825 T829 C830 A831 Q835 V836 V837 V845 Y862 L944	I801-F833 HydrophobicContact CD1-CB 4.49Å; T822-F833 HydrophobicContact CG2-CD2 4.37Å; T822-F833 HydrophobicContact CG2-CE2 4.02Å; P825-F833 HydrophobicContact CG-CB 3.83Å; P825-F833 HydrophobicContact CG-CD1 4.27Å; P825-F833 HydrophobicContact CG-CD2 3.34Å; P825-F833 HydrophobicContact CG-CE2 3.85Å; P825-F833 HydrophobicContact CG-CG 3.56Å; T829-F833 PolarHBondContact O-N 3.37Å; C830-F833 WeakPolarHBondContact O-CB 3.46Å; C830-F833 PolarHBondContact O-N 2.87Å; A831-F833 VanDerWaalsContact C-N 3.33Å; A831-F833 PolarHBondContact O-N 2.98Å; F833-Q835 VanDerWaalsContact C-N 3.33Å; F833-Q835 PolarHBondContact O-N 3.49Å; F833-V836 WeakPolarHBondContact O-CB 3.4Å; F833-V836 PolarHBondContact O-N 3.14Å; F833-V836 VanDerWaalsContact O-N 3.15Å; F833-V837 HydrophobicContact CD1-CG2 4.43Å; F833-V837 HydrophobicContact CE1-CG2 4.18Å; F833-V837 PolarHBondContact O-N 3.42Å; F833-V845 HydrophobicContact CZ-CG1 4.13Å; F833-Y862 HydrophobicContact CD1-CD2 4.04Å; F833-Y862 HydrophobicContact CD1-CE2 4.17Å; F833-Y862 HydrophobicContact CD1-CG 4.47Å; F833-Y862 AromaticContact CE1-CD2 3.67Å; F833-Y862 HydrophobicContact CE1-CD2 3.67Å; F833-Y862 HydrophobicContact CE1-CE1 4.44Å; F833-Y862 AromaticContact CE1-CE2 3.34Å; F833-Y862 HydrophobicContact CE1-CE2 3.34Å; F833-Y862 HydrophobicContact CE1-CG 4.37Å; F833-Y862 AromaticContact CE1-CZ 3.75Å; F833-Y862 HydrophobicContact CZ-CD2 4.35Å; F833-Y862 HydrophobicContact CZ-CE1 4.21Å; F833-Y862 AromaticContact CZ-CE2 3.69Å; F833-Y862 HydrophobicContact CZ-CE2 3.69Å; F833-Y862 AromaticContact CZ-CZ 3.58Å; F833-L944 HydrophobicContact CE2-CD1 4.08Å; F833-L944 HydrophobicContact CE2-CD2 3.62Å; F833-L944 HydrophobicContact CZ-CD1 4.2Å; F833-L944 HydrophobicContact CZ-CD2 3.69Å
834	W	97.9	Very high	97.2	Very high	1 Å²	1	26.4 Å²	26.4	0%	0.004	14%	0.14	C	C	.	.	H	α-helix	trans	-69.1	-29.3	177	-72.5	110.1	0	0	0	113	C830 A831 V836 V837 W838 Y862 H872 F875 I877 M893 V895 V906	C830-W834 VanDerWaalsContact O-CD1 3.27Å; C830-W834 PolarHBondContact O-N 3.46Å; A831-W834 PolarHBondContact O-N 2.92Å; W834-V836 VanDerWaalsContact C-N 3.32Å; W834-V836 PolarHBondContact O-N 3.28Å; W834-V837 HydrophobicContact CE3-CB 3.95Å; W834-V837 HydrophobicContact CE3-CG1 3.89Å; W834-V837 HydrophobicContact CE3-CG2 4.1Å; W834-V837 HydrophobicContact CZ3-CB 4.44Å; W834-V837 HydrophobicContact CZ3-CG1 3.97Å; W834-V837 HydrophobicContact CZ3-CG2 4.44Å; W834-V837 PolarHBondContact O-N 2.76Å; W834-W838 VanDerWaalsContact O-CB 3.3Å; W834-W838 WeakPolarHBondContact O-CB 3.45Å; W834-W838 PolarHBondContact O-N 2.93Å; W834-Y862 AromaticContact CE2-CD2 3.9Å; W834-Y862 AromaticContact CZ2-CD2 3.73Å; W834-Y862 HydrophobicContact CZ2-CD2 3.73Å; W834-Y862 HydrophobicContact CZ2-CE2 4.1Å; W834-Y862 AromaticContact NE1-CD2 3.77Å; W834-Y862 PolarHBondContact NE1-O 2.96Å; W834-H872 AromaticContact CD1-CD2 3.44Å; W834-H872 VanDerWaalsContact CD1-CD2 3.44Å; W834-H872 AromaticContact NE1-CD2 3.5Å; W834-F875 HydrophobicContact CB-CB 4.38Å; W834-F875 HydrophobicContact CB-CD2 3.89Å; W834-F875 HydrophobicContact CB-CG 4.28Å; W834-I877 HydrophobicContact CB-CD1 4.43Å; W834-I877 HydrophobicContact CD2-CD1 3.52Å; W834-I877 HydrophobicContact CD2-CG1 4.22Å; W834-I877 HydrophobicContact CE3-CD1 3.89Å; W834-I877 HydrophobicContact CG-CD1 3.77Å; W834-I877 HydrophobicContact CG-CG1 4.35Å; W834-I877 HydrophobicContact CH2-CD1 4.46Å; W834-I877 HydrophobicContact CH2-CG2 4.13Å; W834-I877 HydrophobicContact CZ2-CD1 4.14Å; W834-I877 HydrophobicContact CZ2-CG1 4.28Å; W834-I877 HydrophobicContact CZ2-CG2 3.71Å; W834-I877 HydrophobicContact CZ3-CD1 4.35Å; W834-M893 HydrophobicContact CH2-CB 4.31Å; W834-M893 HydrophobicContact CH2-CG 4.26Å; W834-V895 HydrophobicContact CE3-CG2 3.67Å; W834-V895 HydrophobicContact CH2-CG2 4.19Å; W834-V895 HydrophobicContact CZ3-CG2 3.37Å; W834-V906 HydrophobicContact CZ3-CG2 4.36Å
835	Q	97.1	Very high	97.2	Very high	43 Å²	43	26.4 Å²	26.4	20%	0.201	14%	0.14	C	C	.	.	H	α-helix	trans	-59.1	-40.4	168.5	-167	75.6	55.5	0	0	111.8	A831 F833 W838 D839 F875	A831-Q835 WeakPolarHBondContact O-CB 3.1Å; A831-Q835 PolarHBondContact O-N 2.84Å; F833-Q835 VanDerWaalsContact C-N 3.33Å; F833-Q835 PolarHBondContact O-N 3.49Å; Q835-W838 PolarHBondContact O-N 2.92Å; Q835-D839 PolarHBondContact NE2-OD1 3.15Å; Q835-D839 WeakPolarHBondContact O-CB 3.25Å; Q835-D839 VanDerWaalsContact O-CG 3.24Å; Q835-D839 PolarHBondContact O-N 2.86Å; Q835-F875 HydrophobicContact CB-CE2 4.03Å
836	V	97.6	Very high	97.2	Very high	3 Å²	3	26.3 Å²	26.3	2%	0.018	14%	0.14	C	C	.	.	H	α-helix	trans	-66.2	-40.9	175.4	172.2	0	0	0	0	111.9	V792 L794 I801 I820 Q832 F833 W834 W838 Q840 L842 L944	V792-V836 HydrophobicContact CG1-CG1 4.16Å; V792-V836 HydrophobicContact CG1-CG2 3.8Å; L794-V836 HydrophobicContact CD2-CG2 3.51Å; I801-V836 HydrophobicContact CD1-CG2 4.04Å; I801-V836 HydrophobicContact CG2-CG2 4Å; I820-V836 HydrophobicContact CD1-CG1 3.84Å; I820-V836 HydrophobicContact CG2-CG1 4.4Å; Q832-V836 WeakPolarHBondContact O-CG2 3.47Å; Q832-V836 PolarHBondContact O-N 2.92Å; F833-V836 WeakPolarHBondContact O-CB 3.4Å; F833-V836 PolarHBondContact O-N 3.14Å; F833-V836 VanDerWaalsContact O-N 3.15Å; W834-V836 VanDerWaalsContact C-N 3.32Å; W834-V836 PolarHBondContact O-N 3.28Å; V836-W838 VanDerWaalsContact C-N 3.33Å; V836-Q840 PolarHBondContact O-N 2.91Å; V836-L842 HydrophobicContact CG1-CD1 4.26Å; V836-L944 HydrophobicContact CG1-CD1 4.33Å
837	V	97.7	Very high	97.2	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-62	-43.2	175.6	174.1	0	0	0	0	110.6	F833 W834 K841 L842 V845 V906 L944	F833-V837 HydrophobicContact CD1-CG2 4.43Å; F833-V837 HydrophobicContact CE1-CG2 4.18Å; F833-V837 PolarHBondContact O-N 3.42Å; W834-V837 HydrophobicContact CE3-CB 3.95Å; W834-V837 HydrophobicContact CE3-CG1 3.89Å; W834-V837 HydrophobicContact CE3-CG2 4.1Å; W834-V837 HydrophobicContact CZ3-CB 4.44Å; W834-V837 HydrophobicContact CZ3-CG1 3.97Å; W834-V837 HydrophobicContact CZ3-CG2 4.44Å; W834-V837 PolarHBondContact O-N 2.76Å; V837-K841 CarbonylContact O-C 3.44Å; V837-K841 WeakPolarHBondContact O-CA 3.37Å; V837-K841 PolarHBondContact O-N 2.81Å; V837-L842 HydrophobicContact CG1-CB 4.34Å; V837-L842 HydrophobicContact CG2-CD1 4.48Å; V837-L842 PolarHBondContact O-N 3.03Å; V837-V845 HydrophobicContact CG2-CG2 4.24Å; V837-V906 HydrophobicContact CG1-CG1 4.38Å; V837-V906 HydrophobicContact CG1-CG2 3.75Å; V837-L944 HydrophobicContact CG2-CD1 3.97Å
838	W	96.8	Very high	97.2	Very high	21 Å²	21	21.3 Å²	21.3	8%	0.08	11%	0.109	C	C	.	.	H	α-helix	trans	-70.6	-52	-179.7	-173.5	-97.6	0	0	0	113.6	W834 Q835 V836 Q840 K841 F875 V895 N897 E902 H904	W834-W838 VanDerWaalsContact O-CB 3.3Å; W834-W838 WeakPolarHBondContact O-CB 3.45Å; W834-W838 PolarHBondContact O-N 2.93Å; Q835-W838 PolarHBondContact O-N 2.92Å; V836-W838 VanDerWaalsContact C-N 3.33Å; W838-Q840 PolarHBondContact O-N 3.41Å; W838-K841 WeakPolarHBondContact O-CD 3.38Å; W838-K841 PolarHBondContact O-N 3.49Å; W838-F875 HydrophobicContact CB-CD1 4.42Å; W838-F875 HydrophobicContact CB-CE1 3.62Å; W838-F875 HydrophobicContact CB-CZ 3.67Å; W838-F875 AromaticContact CD1-CE1 3.7Å; W838-F875 AromaticContact CD1-CZ 3.89Å; W838-F875 HydrophobicContact CD2-CD1 4.21Å; W838-F875 AromaticContact CD2-CE1 3.55Å; W838-F875 HydrophobicContact CD2-CE1 3.55Å; W838-F875 HydrophobicContact CD2-CZ 4.39Å; W838-F875 HydrophobicContact CE3-CD1 4.27Å; W838-F875 HydrophobicContact CE3-CE1 4.06Å; W838-F875 HydrophobicContact CG-CD1 4.27Å; W838-F875 AromaticContact CG-CE1 3.3Å; W838-F875 HydrophobicContact CG-CE1 3.3Å; W838-F875 AromaticContact CG-CZ 3.69Å; W838-F875 HydrophobicContact CG-CZ 3.69Å; W838-V895 HydrophobicContact CE3-CG1 3.83Å; W838-V895 HydrophobicContact CZ3-CG1 4.17Å; W838-N897 HydrophobicContact CH2-CB 3.58Å; W838-N897 HydrophobicContact CZ2-CB 3.41Å; W838-N897 VanDerWaalsContact CZ2-CB 3.41Å; W838-N897 HydrophobicContact CZ3-CB 4.21Å; W838-E902 HydrophobicContact CH2-CB 3.74Å; W838-E902 HydrophobicContact CH2-CG 3.83Å; W838-E902 WeakPolarHBondContact CH2-O 3.04Å; W838-E902 HydrophobicContact CZ2-CB 3.96Å; W838-E902 HydrophobicContact CZ2-CG 4.16Å; W838-E902 WeakPolarHBondContact CZ2-OE2 3.49Å; W838-H904 HydrophobicContact CE3-CB 4.06Å; W838-H904 HydrophobicContact CH2-CB 4.4Å; W838-H904 HydrophobicContact CZ3-CB 3.57Å
839	D	94.9	Very high	97	Very high	52 Å²	52	16.9 Å²	16.9	28%	0.278	9%	0.088	S	C	.	.	H	α-helix	trans	-61	-28.3	-175.6	-80	6.7	0	0	0	112.7	Q795 Q835	Q795-D839 PolarHBondContact NE2-OD1 2.86Å; Q795-D839 VanDerWaalsContact NE2-OD1 3.11Å; Q795-D839 PolarHBondContact NE2-OD2 2.87Å; Q835-D839 PolarHBondContact NE2-OD1 3.15Å; Q835-D839 WeakPolarHBondContact O-CB 3.25Å; Q835-D839 VanDerWaalsContact O-CG 3.24Å; Q835-D839 PolarHBondContact O-N 2.86Å
840	Q	93.8	Very high	96.8	Very high	53 Å²	53	18.3 Å²	18.3	25%	0.248	10%	0.097	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.8	4.2	179.1	-60.7	-173.5	58.7	0	0	113	Y805 V836 W838 L842	Y805-Q840 PolarHBondContact OH-NE2 3.14Å; Y805-Q840 VanDerWaalsContact OH-NE2 3.08Å; V836-Q840 PolarHBondContact O-N 2.91Å; W838-Q840 PolarHBondContact O-N 3.41Å; Q840-L842 VanDerWaalsContact C-N 3.27Å; Q840-L842 HydrophobicContact CB-CD1 4.48Å; Q840-L842 HydrophobicContact CB-CD2 3.44Å; Q840-L842 VanDerWaalsContact CB-CD2 3.44Å; Q840-L842 HydrophobicContact CB-CG 3.85Å; Q840-L842 PolarHBondContact O-N 2.91Å
841	K	95.2	Very high	96.5	Very high	65 Å²	65	20.4 Å²	20.4	28%	0.283	11%	0.108	S	C	.	.	T	Hydrogen-bonded Turn	trans	47.1	47.9	-179	-61.6	-72.2	174.4	167	0	112.6	V837 W838 S843 E902 H904	V837-K841 CarbonylContact O-C 3.44Å; V837-K841 WeakPolarHBondContact O-CA 3.37Å; V837-K841 PolarHBondContact O-N 2.81Å; W838-K841 WeakPolarHBondContact O-CD 3.38Å; W838-K841 PolarHBondContact O-N 3.49Å; K841-S843 PolarHBondContact O-N 3.49Å; K841-E902 IonicContact NZ-OE1 2.69Å; K841-E902 PolarHBondContact NZ-OE1 3.19Å; K841-E902 IonicContact NZ-OE2 2.7Å; K841-E902 PolarHBondContact NZ-OE2 3.17Å; K841-H904 PolarHBondContact O-CE1 3.32Å
842	L	97.3	Very high	95.9	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	12%	0.119	C	C	.	.			trans	-72.1	122.1	-174.4	-50.5	-179	0	0	0	110.4	I820 V836 V837 Q840 H904 V906 P942 L944	I820-L842 HydrophobicContact CD1-CD1 3.72Å; I820-L842 HydrophobicContact CD1-CD2 4.37Å; V836-L842 HydrophobicContact CG1-CD1 4.26Å; V837-L842 HydrophobicContact CG1-CB 4.34Å; V837-L842 HydrophobicContact CG2-CD1 4.48Å; V837-L842 PolarHBondContact O-N 3.03Å; Q840-L842 VanDerWaalsContact C-N 3.27Å; Q840-L842 HydrophobicContact CB-CD1 4.48Å; Q840-L842 HydrophobicContact CB-CD2 3.44Å; Q840-L842 VanDerWaalsContact CB-CD2 3.44Å; Q840-L842 HydrophobicContact CB-CG 3.85Å; Q840-L842 PolarHBondContact O-N 2.91Å; L842-H904 PolarHBondContact O-NE2 3.27Å; L842-V906 WeakPolarHBondContact O-CG2 3.38Å; L842-P942 HydrophobicContact CD2-CB 4.37Å; L842-P942 HydrophobicContact CD2-CG 4.23Å; L842-P942 WeakPolarHBondContact CD2-O 3.37Å; L842-L944 HydrophobicContact CD1-CB 4Å; L842-L944 HydrophobicContact CD1-CD1 3.98Å
843	S	97.5	Very high	95	Very high	29 Å²	29	22 Å²	22	20%	0.203	12%	0.116	C	C	.	.			trans	-83.7	-21	178.8	62.5	0	0	0	0	113.6	K841 V906 T907 E941	K841-S843 PolarHBondContact O-N 3.49Å; S843-V906 CarbonylContact O-C 3.47Å; S843-V906 WeakPolarHBondContact O-CA 3.45Å; S843-T907 PolarHBondContact O-N 2.7Å; S843-E941 WeakPolarHBondContact CB-OE1 3.46Å; S843-E941 PolarHBondContact N-OE1 2.93Å; S843-E941 PolarHBondContact OG-OE1 3.13Å; S843-E941 PolarHBondContact OG-OE2 3.49Å
844	L	98.3	Very high	93.9	Very high	4 Å²	4	30.3 Å²	30.3	2%	0.021	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	122.7	-171.7	-179.9	66	0	0	0	113.6	V846 T907 L909 V933 L936 A943 L944	L844-V846 HydrophobicContact CD1-CG2 4.2Å; L844-V846 HydrophobicContact CD2-CG2 4.22Å; L844-V846 HydrophobicContact CG-CG2 4.01Å; L844-T907 HydrophobicContact CD1-CG2 4.31Å; L844-L909 HydrophobicContact CD1-CD1 4.2Å; L844-L909 HydrophobicContact CD1-CG 4.22Å; L844-V933 HydrophobicContact CD2-CG1 4.41Å; L844-L936 HydrophobicContact CD1-CB 4.28Å; L844-L936 HydrophobicContact CD1-CD1 3.94Å; L844-L936 HydrophobicContact CD2-CB 4.08Å; L844-A943 HydrophobicContact CD2-CB 4.14Å; L844-L944 PolarHBondContact O-N 2.69Å
845	V	98.6	Very high	92.6	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	123.3	172.1	172.9	0	0	0	0	110.3	F833 V837 Y862 V906 T907 H908 L909 L944	F833-V845 HydrophobicContact CZ-CG1 4.13Å; V837-V845 HydrophobicContact CG2-CG2 4.24Å; V845-Y862 WeakPolarHBondContact CG1-OH 3.44Å; V845-V906 HydrophobicContact CB-CG1 4.38Å; V845-V906 HydrophobicContact CG2-CG1 3.72Å; V845-T907 PolarHBondContact N-O 3.08Å; V845-H908 WeakPolarHBondContact O-CA 3.49Å; V845-L909 PolarHBondContact O-N 2.84Å; V845-L944 HydrophobicContact CG1-CD2 4.04Å; V845-L944 HydrophobicContact CG2-CB 4.24Å; V845-L944 HydrophobicContact CG2-CD2 4.4Å
846	V	98.6	Very high	91.7	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	109.4	179.5	-172.9	0	0	0	0	110.6	L844 L848 F929 V933 L944 V945 H946 L957	L844-V846 HydrophobicContact CD1-CG2 4.2Å; L844-V846 HydrophobicContact CD2-CG2 4.22Å; L844-V846 HydrophobicContact CG-CG2 4.01Å; V846-L848 HydrophobicContact CG1-CD2 3.95Å; V846-L848 HydrophobicContact CG1-CG 4.25Å; V846-F929 HydrophobicContact CG1-CE1 3.83Å; V846-F929 HydrophobicContact CG1-CZ 3.86Å; V846-V933 HydrophobicContact CG1-CG2 4.24Å; V846-V933 HydrophobicContact CG2-CG1 4.17Å; V846-V933 HydrophobicContact CG2-CG2 4.06Å; V846-L944 PolarHBondContact N-O 2.63Å; V846-V945 HydrophobicContact CB-CG1 4.31Å; V846-V945 HydrophobicContact CB-CG2 4.23Å; V846-V945 HydrophobicContact CG1-CG1 4.49Å; V846-V945 WeakPolarHBondContact O-CA 3.23Å; V846-H946 PolarHBondContact O-N 3.02Å; V846-L957 HydrophobicContact CG1-CD2 3.77Å
847	M	98.1	Very high	91.3	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	104.5	-178.7	177	167.1	-174.3	0	0	111	T849 L851 C859 Y862 W863 L909 Q910 Y911 H946	M847-T849 VanDerWaalsContact C-N 3.34Å; M847-T849 HydrophobicContact CE-CG2 3.68Å; M847-T849 WeakPolarHBondContact CE-O 3.46Å; M847-T849 HydrophobicContact CG-CG2 4.07Å; M847-T849 PolarHBondContact O-N 2.89Å; M847-L851 HydrophobicContact CE-CD2 4.08Å; M847-C859 HydrophobicContact CE-CB 3.55Å; M847-Y862 HydrophobicContact SD-CE1 4.35Å; M847-W863 HydrophobicContact CE-CH2 3.77Å; M847-W863 HydrophobicContact CE-CZ3 3.95Å; M847-W863 HydrophobicContact SD-CH2 3.54Å; M847-W863 VanDerWaalsContact SD-CH2 3.54Å; M847-W863 HydrophobicContact SD-CZ3 3.52Å; M847-W863 VanDerWaalsContact SD-CZ3 3.52Å; M847-L909 PolarHBondContact N-O 2.92Å; M847-Q910 HydrophobicContact CB-CB 4.24Å; M847-Q910 HydrophobicContact CB-CG 4.28Å; M847-Q910 HydrophobicContact CG-CB 4.41Å; M847-Q910 HydrophobicContact CG-CG 3.93Å; M847-Q910 CarbonylContact O-C 3.51Å; M847-Q910 WeakPolarHBondContact O-CA 3.38Å; M847-Q910 HydrophobicContact SD-CG 4.01Å; M847-Y911 PolarHBondContact O-N 2.82Å; M847-H946 WeakPolarHBondContact CB-NE2 3.33Å; M847-H946 WeakPolarHBondContact CG-CE1 3.47Å; M847-H946 WeakPolarHBondContact CG-NE2 3.49Å
848	L	97.1	Very high	91.1	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.192	C	C	.	.			trans	-95.1	52.3	-179.7	-56.4	174	0	0	0	111.5	V846 W914 F929 V945 H946 C947 R953 L957	V846-L848 HydrophobicContact CG1-CD2 3.95Å; V846-L848 HydrophobicContact CG1-CG 4.25Å; L848-W914 HydrophobicContact CB-CE3 4.44Å; L848-W914 HydrophobicContact CB-CZ3 4.49Å; L848-W914 HydrophobicContact CD1-CZ3 4Å; L848-W914 HydrophobicContact CD2-CE3 4.23Å; L848-W914 HydrophobicContact CD2-CZ3 4.01Å; L848-W914 HydrophobicContact CG-CZ3 4.4Å; L848-F929 HydrophobicContact CD2-CE1 3.84Å; L848-V945 HydrophobicContact CD1-CG1 3.93Å; L848-V945 HydrophobicContact CG-CG1 4.44Å; L848-H946 WeakPolarHBondContact CB-O 3.25Å; L848-H946 PolarHBondContact N-O 2.88Å; L848-C947 HydrophobicContact CB-CB 4.11Å; L848-C947 WeakPolarHBondContact O-CB 3.48Å; L848-R953 HydrophobicContact CB-CB 3.93Å; L848-R953 HydrophobicContact CD1-CB 4.25Å; L848-R953 WeakPolarHBondContact CD1-O 3.16Å; L848-R953 VanDerWaalsContact O-CD 3.3Å; L848-R953 WeakPolarHBondContact O-CD 3.14Å; L848-R953 VanDerWaalsContact O-CZ 3.26Å; L848-R953 PolarHBondContact O-NE 3.29Å; L848-R953 PolarHBondContact O-NH1 2.97Å; L848-L957 HydrophobicContact CD1-CB 3.86Å; L848-L957 HydrophobicContact CD1-CD2 4Å; L848-L957 HydrophobicContact CD2-CD2 4.4Å
849	T	93.5	Very high	91.1	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	19%	0.188	C	C	.	.	S	Bend	trans	-164.6	149.5	176.8	-171.6	0	0	0	0	111.9	M847 E853 C859 Q910 Y911 R953	M847-T849 VanDerWaalsContact C-N 3.34Å; M847-T849 HydrophobicContact CE-CG2 3.68Å; M847-T849 WeakPolarHBondContact CE-O 3.46Å; M847-T849 HydrophobicContact CG-CG2 4.07Å; M847-T849 PolarHBondContact O-N 2.89Å; T849-E853 PolarHBondContact OG1-OE1 3.36Å; T849-C859 HydrophobicContact CG2-CB 4.06Å; T849-Q910 PolarHBondContact O-NE2 2.95Å; T849-Y911 PolarHBondContact N-O 3.29Å; T849-R953 PolarHBondContact OG1-NH2 3.09Å; T849-R953 VanDerWaalsContact OG1-NH2 3.16Å
850	T	91.9	Very high	91.2	Very high	39 Å²	39	36 Å²	36	24%	0.239	19%	0.19	C	C	.	.			trans	-69.5	162.2	157.4	57.1	0	0	0	0	110.4	T852 E853 V912	T850-T852 VanDerWaalsContact C-N 3.35Å; T850-T852 PolarHBondContact OG1-O 3.39Å; T850-E853 VanDerWaalsContact OG1-CG 3.27Å; T850-E853 WeakPolarHBondContact OG1-CG 3.48Å; T850-V912 HydrophobicContact CG2-CB 4.12Å; T850-V912 HydrophobicContact CG2-CG1 4.22Å
851	L	91.2	Very high	91.3	Very high	44 Å²	44	35.6 Å²	35.6	23%	0.23	19%	0.188	C	C	.	.	S	Bend	trans	-63.5	-40.6	172.9	-71.4	169.6	0	0	0	111.9	M847 T857 K858 C859 Q861 W863	M847-L851 HydrophobicContact CE-CD2 4.08Å; L851-T857 CarbonylContact O-C 3.56Å; L851-T857 WeakPolarHBondContact O-CA 3.5Å; L851-K858 PolarHBondContact O-N 3.11Å; L851-C859 HydrophobicContact CD2-CB 4.35Å; L851-C859 PolarHBondContact O-N 3.47Å; L851-Q861 HydrophobicContact CD1-CB 4.01Å; L851-Q861 HydrophobicContact CD1-CG 4.38Å; L851-Q861 VanDerWaalsContact CD1-OE1 3.27Å; L851-Q861 HydrophobicContact CD2-CB 3.79Å; L851-W863 HydrophobicContact CD1-CH2 4.32Å; L851-W863 HydrophobicContact CD1-CZ2 4.24Å; L851-W863 HydrophobicContact CD2-CH2 3.64Å; L851-W863 HydrophobicContact CD2-CZ2 4.36Å; L851-W863 HydrophobicContact CD2-CZ3 4.15Å; L851-W863 HydrophobicContact CG-CH2 4.06Å; L851-W863 HydrophobicContact CG-CZ2 4.44Å
852	T	85.2	Confident	91.4	Very high	81 Å²	81	32.5 Å²	32.5	50%	0.497	18%	0.175	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	148.1	175.9	71.2	0	0	0	0	113.2	T850 R856	T850-T852 VanDerWaalsContact C-N 3.35Å; T850-T852 PolarHBondContact OG1-O 3.39Å; T852-R856 CarbonylContact C-O 3.6Å; T852-R856 WeakPolarHBondContact CA-O 3.44Å
853	E	79.1	Confident	91.4	Very high	26 Å²	26	32.6 Å²	32.6	12%	0.121	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	126.1	169.7	-60	169.6	-155.9	0	0	109.5	T849 T850 G855 R856 K858 D916 R953	T849-E853 PolarHBondContact OG1-OE1 3.36Å; T850-E853 VanDerWaalsContact OG1-CG 3.27Å; T850-E853 WeakPolarHBondContact OG1-CG 3.48Å; E853-G855 PolarHBondContact O-N 2.95Å; E853-R856 PolarHBondContact N-O 3.48Å; E853-R856 PolarHBondContact O-N 3.41Å; E853-R856 VanDerWaalsContact O-N 3.09Å; E853-K858 HydrophobicContact CB-CG 4.14Å; E853-K858 HydrophobicContact CG-CD 4.49Å; E853-K858 HydrophobicContact CG-CG 3.83Å; E853-K858 IonicContact OE1-NZ 3.37Å; E853-K858 WeakPolarHBondContact OE2-CE 3.15Å; E853-K858 IonicContact OE2-NZ 3.24Å; E853-K858 PolarHBondContact OE2-NZ 3.13Å; E853-D916 WeakPolarHBondContact OE2-CB 3.31Å; E853-D916 PolarHBondContact OE2-N 2.95Å; E853-R953 IonicContact OE1-CZ 2.71Å; E853-R953 VanDerWaalsContact OE1-CZ 3.3Å; E853-R953 IonicContact OE1-NH1 2.73Å; E853-R953 PolarHBondContact OE1-NH1 2.85Å; E853-R953 IonicContact OE1-NH2 2.73Å; E853-R953 PolarHBondContact OE1-NH2 2.97Å
854	R	74	Confident	91.3	Very high	176 Å²	176	31.3 Å²	31.3	66%	0.664	17%	0.166	S	C	*	.	T	Hydrogen-bonded Turn	trans	42.4	60.1	-175.7	-47.1	-175.6	-173.3	141.5	-2.1	112.1	M682 R856	M682-R854 HydrophobicContact CE-CB 3.71Å; M682-R854 HydrophobicContact CE-CG 4.06Å; M682-R854 HydrophobicContact SD-CG 4.44Å; M682-R854 PolarHBondContact SD-NH1 2.97Å; R854-R856 VanDerWaalsContact C-N 3.3Å; R854-R856 WeakPolarHBondContact O-CD 3.17Å; R854-R856 PolarHBondContact O-N 3Å
855	G	71.8	Confident	91	Very high	48 Å²	48	35.2 Å²	35.2	50%	0.495	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	80	-11.7	178.9	0	0	0	0	0	116.4	E853	E853-G855 PolarHBondContact O-N 2.95Å
856	R	78.4	Confident	90.5	Very high	24 Å²	24	38 Å²	38	9%	0.091	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	129.4	-169.4	-61.8	129	-179.1	-92.4	-13.7	114.3	V681 M682 A686 T852 E853 R854 K858	V681-R856 PolarHBondContact O-NH1 2.8Å; V681-R856 PolarHBondContact O-NH2 2.78Å; M682-R856 VanDerWaalsContact CE-CD 3.45Å; M682-R856 PolarHBondContact O-NH2 2.86Å; A686-R856 VanDerWaalsContact N-NH2 3.14Å; T852-R856 CarbonylContact C-O 3.6Å; T852-R856 WeakPolarHBondContact CA-O 3.44Å; E853-R856 PolarHBondContact N-O 3.48Å; E853-R856 PolarHBondContact O-N 3.41Å; E853-R856 VanDerWaalsContact O-N 3.09Å; R854-R856 VanDerWaalsContact C-N 3.3Å; R854-R856 WeakPolarHBondContact O-CD 3.17Å; R854-R856 PolarHBondContact O-N 3Å; R856-K858 PolarHBondContact O-N 3.23Å; R856-K858 VanDerWaalsContact O-N 3.07Å
857	T	88.7	Confident	90.1	Very high	85 Å²	85	43.1 Å²	43.1	52%	0.521	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-53.3	106.4	163.1	-40.1	0	0	0	0	111.8	R780 L851 C859	R780-T857 PolarHBondContact NH1-O 3.27Å; R780-T857 VanDerWaalsContact NH1-O 3.12Å; L851-T857 CarbonylContact O-C 3.56Å; L851-T857 WeakPolarHBondContact O-CA 3.5Å; T857-C859 WeakPolarHBondContact CG2-O 3.29Å
858	K	93	Very high	89.8	Confident	13 Å²	13	48.1 Å²	48.1	6%	0.057	27%	0.265	C	S	.	.	S	Bend	trans	-87.8	-36.1	170.8	-69.1	-75.4	177.5	133.4	0	111.1	R780 L851 E853 R856 D916 S948	R780-K858 WeakPolarHBondContact CD-O 3.18Å; R780-K858 PolarHBondContact NE-O 3.46Å; R780-K858 VanDerWaalsContact NE-O 3.16Å; R780-K858 PolarHBondContact NH1-O 3.49Å; R780-K858 VanDerWaalsContact NH1-O 3.07Å; L851-K858 PolarHBondContact O-N 3.11Å; E853-K858 HydrophobicContact CB-CG 4.14Å; E853-K858 HydrophobicContact CG-CD 4.49Å; E853-K858 HydrophobicContact CG-CG 3.83Å; E853-K858 IonicContact OE1-NZ 3.37Å; E853-K858 WeakPolarHBondContact OE2-CE 3.15Å; E853-K858 IonicContact OE2-NZ 3.24Å; E853-K858 PolarHBondContact OE2-NZ 3.13Å; R856-K858 PolarHBondContact O-N 3.23Å; R856-K858 VanDerWaalsContact O-N 3.07Å; K858-D916 VanDerWaalsContact NZ-CG 3.34Å; K858-D916 IonicContact NZ-OD2 3.46Å; K858-D916 PolarHBondContact NZ-OD2 2.8Å; K858-S948 WeakPolarHBondContact CD-OG 3.45Å; K858-S948 PolarHBondContact O-OG 3.02Å
859	C	96.1	Very high	89.6	Confident	1 Å²	1	52.2 Å²	52.2	1%	0.007	29%	0.286	C	S	.	.	S	Bend	trans	-135.6	147.2	173.5	-165	0	0	0	0	108.5	G824 M847 T849 L851 T857 H946	G824-C859 WeakPolarHBondContact CA-SG 3.43Å; M847-C859 HydrophobicContact CE-CB 3.55Å; T849-C859 HydrophobicContact CG2-CB 4.06Å; L851-C859 HydrophobicContact CD2-CB 4.35Å; L851-C859 PolarHBondContact O-N 3.47Å; T857-C859 WeakPolarHBondContact CG2-O 3.29Å; C859-H946 VanDerWaalsContact SG-CE1 3.58Å
860	H	96.9	Very high	89.6	Confident	67 Å²	67	54.7 Å²	54.7	31%	0.31	30%	0.298	S	S	.	.			trans	-74.9	154	160.4	-166.8	59.6	0	0	0	108.7	P825 P827 Y862	P825-H860 WeakPolarHBondContact O-CB 3.45Å; P825-H860 PolarHBondContact O-N 2.95Å; P827-H860 HydrophobicContact CG-CB 4.4Å; H860-Y862 WeakPolarHBondContact O-CD1 3.48Å; H860-Y862 PolarHBondContact O-N 2.8Å
861	Q	96.5	Very high	89.8	Confident	45 Å²	45	57.7 Å²	57.7	21%	0.21	31%	0.313	C	S	.	.			trans	-80.7	115.9	170.1	177.9	160.1	-9.6	0	0	107.2	L851 W863 D865	L851-Q861 HydrophobicContact CD1-CB 4.01Å; L851-Q861 HydrophobicContact CD1-CG 4.38Å; L851-Q861 VanDerWaalsContact CD1-OE1 3.27Å; L851-Q861 HydrophobicContact CD2-CB 3.79Å; Q861-W863 HydrophobicContact CG-CD2 4.01Å; Q861-W863 HydrophobicContact CG-CE3 4.34Å; Q861-W863 HydrophobicContact CG-CG 4.41Å; Q861-W863 HydrophobicContact CG-CZ2 4.26Å; Q861-W863 WeakPolarHBondContact CG-O 3.45Å; Q861-W863 PolarHBondContact NE2-O 3.23Å; Q861-W863 VanDerWaalsContact NE2-O 3.11Å; Q861-D865 PolarHBondContact NE2-OD1 3.29Å
862	Y	97.7	Very high	89.9	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	31%	0.307	C	S	.	.			trans	-109.6	17.9	-175.8	57.2	-99.8	0	0	0	111.9	P825 F833 W834 V845 M847 H860 H872 H908 H946	P825-Y862 HydrophobicContact CB-CD1 4.14Å; P825-Y862 HydrophobicContact CG-CD1 3.64Å; P825-Y862 HydrophobicContact CG-CE1 4.04Å; P825-Y862 HydrophobicContact CG-CG 4.2Å; F833-Y862 HydrophobicContact CD1-CD2 4.04Å; F833-Y862 HydrophobicContact CD1-CE2 4.17Å; F833-Y862 HydrophobicContact CD1-CG 4.47Å; F833-Y862 AromaticContact CE1-CD2 3.67Å; F833-Y862 HydrophobicContact CE1-CD2 3.67Å; F833-Y862 HydrophobicContact CE1-CE1 4.44Å; F833-Y862 AromaticContact CE1-CE2 3.34Å; F833-Y862 HydrophobicContact CE1-CE2 3.34Å; F833-Y862 HydrophobicContact CE1-CG 4.37Å; F833-Y862 AromaticContact CE1-CZ 3.75Å; F833-Y862 HydrophobicContact CZ-CD2 4.35Å; F833-Y862 HydrophobicContact CZ-CE1 4.21Å; F833-Y862 AromaticContact CZ-CE2 3.69Å; F833-Y862 HydrophobicContact CZ-CE2 3.69Å; F833-Y862 AromaticContact CZ-CZ 3.58Å; W834-Y862 AromaticContact CE2-CD2 3.9Å; W834-Y862 AromaticContact CZ2-CD2 3.73Å; W834-Y862 HydrophobicContact CZ2-CD2 3.73Å; W834-Y862 HydrophobicContact CZ2-CE2 4.1Å; W834-Y862 AromaticContact NE1-CD2 3.77Å; W834-Y862 PolarHBondContact NE1-O 2.96Å; V845-Y862 WeakPolarHBondContact CG1-OH 3.44Å; M847-Y862 HydrophobicContact SD-CE1 4.35Å; H860-Y862 WeakPolarHBondContact O-CD1 3.48Å; H860-Y862 PolarHBondContact O-N 2.8Å; Y862-H872 PolarHBondContact O-NE2 3.48Å; Y862-H908 AromaticContact CE2-CD2 4Å; Y862-H908 AromaticContact CE2-NE2 3.75Å; Y862-H908 AromaticContact CZ-NE2 3.5Å; Y862-H908 PolarHBondContact OH-CD2 3.39Å; Y862-H908 PolarHBondContact OH-NE2 3.05Å; Y862-H946 AromaticContact CE1-CE1 3.86Å; Y862-H946 AromaticContact CE1-NE2 3.57Å; Y862-H946 AromaticContact CZ-NE2 3.57Å; Y862-H946 PolarHBondContact OH-NE2 3.06Å
863	W	97.7	Very high	90.2	Very high	2 Å²	2	55.8 Å²	55.8	1%	0.008	31%	0.314	C	S	.	.	S	Bend	trans	-142.2	147.6	-178.1	69.2	88.7	0	0	0	108.9	M847 L851 Q861 M870 M893 H908	M847-W863 HydrophobicContact CE-CH2 3.77Å; M847-W863 HydrophobicContact CE-CZ3 3.95Å; M847-W863 HydrophobicContact SD-CH2 3.54Å; M847-W863 VanDerWaalsContact SD-CH2 3.54Å; M847-W863 HydrophobicContact SD-CZ3 3.52Å; M847-W863 VanDerWaalsContact SD-CZ3 3.52Å; L851-W863 HydrophobicContact CD1-CH2 4.32Å; L851-W863 HydrophobicContact CD1-CZ2 4.24Å; L851-W863 HydrophobicContact CD2-CH2 3.64Å; L851-W863 HydrophobicContact CD2-CZ2 4.36Å; L851-W863 HydrophobicContact CD2-CZ3 4.15Å; L851-W863 HydrophobicContact CG-CH2 4.06Å; L851-W863 HydrophobicContact CG-CZ2 4.44Å; Q861-W863 HydrophobicContact CG-CD2 4.01Å; Q861-W863 HydrophobicContact CG-CE3 4.34Å; Q861-W863 HydrophobicContact CG-CG 4.41Å; Q861-W863 HydrophobicContact CG-CZ2 4.26Å; Q861-W863 WeakPolarHBondContact CG-O 3.45Å; Q861-W863 PolarHBondContact NE2-O 3.23Å; Q861-W863 VanDerWaalsContact NE2-O 3.11Å; W863-M870 WeakPolarHBondContact O-CE 3.42Å; W863-M893 HydrophobicContact CB-CE 3.44Å; W863-M893 VanDerWaalsContact CB-CE 3.44Å; W863-M893 HydrophobicContact CB-SD 3.94Å; W863-M893 HydrophobicContact CD2-CE 4.47Å; W863-M893 HydrophobicContact CG-CE 3.6Å; W863-H908 AromaticContact CE3-CE1 3.97Å; W863-H908 AromaticContact CE3-NE2 3.92Å; W863-H908 AromaticContact CZ3-CE1 3.92Å; W863-H908 AromaticContact CZ3-NE2 3.97Å
864	P	95.6	Very high	90.9	Very high	2 Å²	2	56.8 Å²	56.8	1%	0.013	32%	0.319	C	S	.	.	P	Polyproline II helix	trans	-76.4	151.5	174.7	33	-35.2	0	0	0	112	D868 M870 I877 C879	P864-D868 HydrophobicContact CB-CB 3.92Å; P864-D868 WeakPolarHBondContact CB-O 3.4Å; P864-D868 WeakPolarHBondContact CG-O 3.23Å; P864-M870 HydrophobicContact CB-CB 4.17Å; P864-M870 HydrophobicContact CG-CB 4.34Å; P864-I877 WeakPolarHBondContact CG-O 3.47Å; P864-C879 HydrophobicContact CG-CB 4.3Å; P864-C879 WeakPolarHBondContact O-CB 3.29Å
865	D	90.6	Very high	92	Very high	86 Å²	86	48.5 Å²	48.5	46%	0.46	29%	0.288	S	S	.	.	P	Polyproline II helix	trans	-73.4	136.6	163.5	-58.9	-42.7	0	0	0	108.6	Q861 D868	Q861-D865 PolarHBondContact NE2-OD1 3.29Å; D865-D868 VanDerWaalsContact O-CB 3.31Å; D865-D868 WeakPolarHBondContact O-CB 3.2Å; D865-D868 PolarHBondContact O-N 2.87Å
866	P	88.8	Confident	93.2	Very high	60 Å²	60	49.2 Å²	49.2	39%	0.39	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	137.5	-179.8	-22.8	31.6	0	0	0	112.5	C879 E882	P866-C879 HydrophobicContact CG-CB 3.94Å; P866-E882 HydrophobicContact CG-CB 4.2Å
867	P	89.6	Confident	94.2	Very high	106 Å²	106	48.1 Å²	48.1	69%	0.688	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	cis	-98.5	17.8	5.6	41.1	-36.5	0	0	0	113.8
868	D	91.9	Very high	94.6	Very high	106 Å²	106	47.1 Å²	47.1	57%	0.567	26%	0.264	S	S	*	.			trans	-66	170	-174	-71.5	-15.6	0	0	0	112.2	P864 D865	P864-D868 HydrophobicContact CB-CB 3.92Å; P864-D868 WeakPolarHBondContact CB-O 3.4Å; P864-D868 WeakPolarHBondContact CG-O 3.23Å; D865-D868 VanDerWaalsContact O-CB 3.31Å; D865-D868 WeakPolarHBondContact O-CB 3.2Å; D865-D868 PolarHBondContact O-N 2.87Å
869	I	92.5	Very high	94.7	Very high	85 Å²	85	46.7 Å²	46.7	44%	0.436	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	141.7	-175.5	-70.5	175.2	0	0	0	108.2	H876 I877 Q878	I869-H876 WeakPolarHBondContact CG2-CE1 3.21Å; I869-H876 WeakPolarHBondContact CG2-NE2 3.29Å; I869-I877 WeakPolarHBondContact CA-O 3.35Å; I869-Q878 HydrophobicContact CG1-CB 4.36Å; I869-Q878 HydrophobicContact CG1-CG 4.18Å
870	M	94.8	Very high	94.6	Very high	53 Å²	53	51.8 Å²	51.8	26%	0.261	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	120.9	-177.2	-165.7	173.6	-67.1	0	0	111.7	W863 P864 H872 I877	W863-M870 WeakPolarHBondContact O-CE 3.42Å; P864-M870 HydrophobicContact CB-CB 4.17Å; P864-M870 HydrophobicContact CG-CB 4.34Å; M870-H872 PolarHBondContact SD-CE1 3.21Å; M870-H872 PolarHBondContact SD-NE2 2.93Å; M870-H872 VanDerWaalsContact SD-NE2 3.39Å; M870-I877 PolarHBondContact N-O 3.08Å; M870-I877 WeakPolarHBondContact O-CB 3.33Å; M870-I877 WeakPolarHBondContact O-CG1 3.22Å; M870-I877 PolarHBondContact O-N 2.81Å
871	D	95.5	Very high	94.4	Very high	101 Å²	101	50.4 Å²	50.4	54%	0.54	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	129.8	176.9	-70.3	-57.3	0	0	0	112	H876	D871-H876 IonicContact OD1-CE1 3.71Å; D871-H876 IonicContact OD1-CG 3.25Å; D871-H876 IonicContact OD1-ND1 2.6Å; D871-H876 PolarHBondContact OD1-ND1 2.82Å; D871-H876 IonicContact OD2-ND1 2.7Å
872	H	93.8	Very high	94.2	Very high	24 Å²	24	52.1 Å²	52.1	11%	0.111	29%	0.294	C	S	.	.			trans	-134.6	76	-178	-79.2	-16	0	0	0	111.1	C830 W834 Y862 M870 F875	C830-H872 WeakPolarHBondContact CB-NE2 3.4Å; W834-H872 AromaticContact CD1-CD2 3.44Å; W834-H872 VanDerWaalsContact CD1-CD2 3.44Å; W834-H872 AromaticContact NE1-CD2 3.5Å; Y862-H872 PolarHBondContact O-NE2 3.48Å; M870-H872 PolarHBondContact SD-CE1 3.21Å; M870-H872 PolarHBondContact SD-NE2 2.93Å; M870-H872 VanDerWaalsContact SD-NE2 3.39Å; H872-F875 PolarHBondContact N-O 3.43Å; H872-F875 WeakPolarHBondContact O-CD2 3.42Å
873	G	91.4	Very high	93.8	Very high	62 Å²	62	57.4 Å²	57.4	64%	0.639	32%	0.323	S	S	*	.	S	Bend	trans	80.6	-119.1	-173.7	0	0	0	0	0	110.2	F875	G873-F875 VanDerWaalsContact C-N 3.32Å
874	I	94.3	Very high	93.1	Very high	47 Å²	47	61.4 Å²	61.4	24%	0.241	35%	0.35	C	S	.	.	S	Bend	trans	-92.7	11.5	174.2	65.7	173.7	0	0	0	113	N897 T898 E899	I874-N897 WeakPolarHBondContact O-CA 3.24Å; I874-T898 PolarHBondContact O-N 2.93Å; I874-T898 PolarHBondContact O-OG1 2.76Å; I874-E899 HydrophobicContact CB-CG 4.27Å; I874-E899 HydrophobicContact CG2-CG 4.02Å
875	F	97.4	Very high	92.6	Very high	1 Å²	1	64.4 Å²	64.4	0%	0.004	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	119.8	-176.4	-55.3	-62.5	0	0	0	111.4	W834 Q835 W838 H872 G873 I877 V895 T896 N897	W834-F875 HydrophobicContact CB-CB 4.38Å; W834-F875 HydrophobicContact CB-CD2 3.89Å; W834-F875 HydrophobicContact CB-CG 4.28Å; Q835-F875 HydrophobicContact CB-CE2 4.03Å; W838-F875 HydrophobicContact CB-CD1 4.42Å; W838-F875 HydrophobicContact CB-CE1 3.62Å; W838-F875 HydrophobicContact CB-CZ 3.67Å; W838-F875 AromaticContact CD1-CE1 3.7Å; W838-F875 AromaticContact CD1-CZ 3.89Å; W838-F875 HydrophobicContact CD2-CD1 4.21Å; W838-F875 AromaticContact CD2-CE1 3.55Å; W838-F875 HydrophobicContact CD2-CE1 3.55Å; W838-F875 HydrophobicContact CD2-CZ 4.39Å; W838-F875 HydrophobicContact CE3-CD1 4.27Å; W838-F875 HydrophobicContact CE3-CE1 4.06Å; W838-F875 HydrophobicContact CG-CD1 4.27Å; W838-F875 AromaticContact CG-CE1 3.3Å; W838-F875 HydrophobicContact CG-CE1 3.3Å; W838-F875 AromaticContact CG-CZ 3.69Å; W838-F875 HydrophobicContact CG-CZ 3.69Å; H872-F875 PolarHBondContact N-O 3.43Å; H872-F875 WeakPolarHBondContact O-CD2 3.42Å; G873-F875 VanDerWaalsContact C-N 3.32Å; F875-I877 HydrophobicContact CB-CD1 3.95Å; F875-V895 HydrophobicContact CB-CG1 4.25Å; F875-V895 HydrophobicContact CD1-CG1 4.09Å; F875-V895 HydrophobicContact CG-CG1 4.41Å; F875-T896 WeakPolarHBondContact CA-O 3.42Å; F875-N897 HydrophobicContact CD1-CB 4.49Å; F875-N897 HydrophobicContact CE1-CB 4.43Å
876	H	97	Very high	92.1	Very high	64 Å²	64	67.8 Å²	67.8	30%	0.296	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	116.3	170	-151.1	64.9	0	0	0	107.2	I869 D871 T896 T898	I869-H876 WeakPolarHBondContact CG2-CE1 3.21Å; I869-H876 WeakPolarHBondContact CG2-NE2 3.29Å; D871-H876 IonicContact OD1-CE1 3.71Å; D871-H876 IonicContact OD1-CG 3.25Å; D871-H876 IonicContact OD1-ND1 2.6Å; D871-H876 PolarHBondContact OD1-ND1 2.82Å; D871-H876 IonicContact OD2-ND1 2.7Å; H876-T896 PolarHBondContact N-O 2.94Å; H876-T896 PolarHBondContact O-N 3.22Å; H876-T898 HydrophobicContact CB-CG2 3.91Å
877	I	97.9	Very high	91.8	Very high	0 Å²	0	65.2 Å²	65.2	0%	0	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	127.9	-179.3	-46.2	-58	0	0	0	108.9	W834 P864 I869 M870 F875 M893 V895	W834-I877 HydrophobicContact CB-CD1 4.43Å; W834-I877 HydrophobicContact CD2-CD1 3.52Å; W834-I877 HydrophobicContact CD2-CG1 4.22Å; W834-I877 HydrophobicContact CE3-CD1 3.89Å; W834-I877 HydrophobicContact CG-CD1 3.77Å; W834-I877 HydrophobicContact CG-CG1 4.35Å; W834-I877 HydrophobicContact CH2-CD1 4.46Å; W834-I877 HydrophobicContact CH2-CG2 4.13Å; W834-I877 HydrophobicContact CZ2-CD1 4.14Å; W834-I877 HydrophobicContact CZ2-CG1 4.28Å; W834-I877 HydrophobicContact CZ2-CG2 3.71Å; W834-I877 HydrophobicContact CZ3-CD1 4.35Å; P864-I877 WeakPolarHBondContact CG-O 3.47Å; I869-I877 WeakPolarHBondContact CA-O 3.35Å; M870-I877 PolarHBondContact N-O 3.08Å; M870-I877 WeakPolarHBondContact O-CB 3.33Å; M870-I877 WeakPolarHBondContact O-CG1 3.22Å; M870-I877 PolarHBondContact O-N 2.81Å; F875-I877 HydrophobicContact CB-CD1 3.95Å; I877-M893 HydrophobicContact CG2-SD 4.36Å; I877-V895 HydrophobicContact CD1-CB 4.37Å; I877-V895 HydrophobicContact CD1-CG1 3.9Å; I877-V895 HydrophobicContact CD1-CG2 4.06Å
878	Q	96.8	Very high	91.9	Very high	65 Å²	65	62.2 Å²	62.2	30%	0.304	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	133.9	172.4	-172.8	-177.4	28.6	0	0	110.3	I869 M893 L894	I869-Q878 HydrophobicContact CG1-CB 4.36Å; I869-Q878 HydrophobicContact CG1-CG 4.18Å; Q878-M893 CarbonylContact O-C 2.85Å; Q878-M893 WeakPolarHBondContact O-CA 3.31Å; Q878-L894 HydrophobicContact CB-CB 4.47Å; Q878-L894 PolarHBondContact N-O 2.91Å; Q878-L894 PolarHBondContact O-N 2.8Å
879	C	96.1	Very high	91.9	Very high	3 Å²	3	57.9 Å²	57.9	2%	0.02	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	112.5	170.4	-166.6	0	0	0	0	108.9	P864 P866 A881 M893	P864-C879 HydrophobicContact CG-CB 4.3Å; P864-C879 WeakPolarHBondContact O-CB 3.29Å; P866-C879 HydrophobicContact CG-CB 3.94Å; C879-A881 PolarHBondContact SG-O 3.49Å; C879-M893 HydrophobicContact CB-CE 4.32Å; C879-M893 HydrophobicContact CB-SD 3.9Å
880	Q	94.3	Very high	92.1	Very high	109 Å²	109	54.5 Å²	54.5	51%	0.509	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	-31	-175.7	-64.1	-168.3	-34.2	0	0	113	E892 L894	Q880-E892 PolarHBondContact N-O 2.78Å; Q880-L894 HydrophobicContact CG-CB 4.09Å
881	A	91.8	Very high	92.2	Very high	38 Å²	38	52.6 Å²	52.6	31%	0.314	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150	148.5	176.8	0	0	0	0	0	110.3	C879 R891 E892	C879-A881 PolarHBondContact SG-O 3.49Å; A881-R891 WeakPolarHBondContact O-CA 3.45Å; A881-R891 WeakPolarHBondContact O-CB 3.41Å; A881-E892 HydrophobicContact CB-CB 4.48Å; A881-E892 PolarHBondContact O-N 2.76Å; A881-E892 VanDerWaalsContact O-N 3.14Å
882	E	93.4	Very high	92.3	Very high	81 Å²	81	50.6 Å²	50.6	38%	0.379	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	120.4	169.9	179.7	175.4	98.8	0	0	109.1	P866 V889 S890 R891	P866-E882 HydrophobicContact CG-CB 4.2Å; E882-V889 HydrophobicContact CG-CG1 3.51Å; E882-S890 CarbonylContact C-O 3.56Å; E882-S890 WeakPolarHBondContact CA-O 3.35Å; E882-R891 HydrophobicContact CB-CG 4.1Å; E882-R891 HydrophobicContact CG-CG 3.97Å; E882-R891 IonicContact OE2-CZ 2.97Å; E882-R891 IonicContact OE2-NE 3.03Å; E882-R891 PolarHBondContact OE2-NE 3.46Å; E882-R891 IonicContact OE2-NH2 2.68Å; E882-R891 PolarHBondContact OE2-NH2 2.62Å
883	D	88.6	Confident	92.5	Very high	111 Å²	111	49.5 Å²	49.5	59%	0.594	28%	0.277	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.2	133.3	178.2	-71.6	-67.8	0	0	0	110	V889 S890	D883-V889 CarbonylContact O-C 3.53Å; D883-V889 WeakPolarHBondContact O-CA 3.42Å; D883-V889 WeakPolarHBondContact O-CG1 3.42Å; D883-S890 PolarHBondContact N-O 3.21Å; D883-S890 PolarHBondContact O-N 2.81Å
884	C	83.8	Confident	92.8	Very high	85 Å²	85	47.2 Å²	47.2	57%	0.574	25%	0.25	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-108.3	137.3	-177.4	-74.4	0	0	0	0	112.6
885	T	84.7	Confident	93	Very high	65 Å²	65	45 Å²	45	40%	0.399	24%	0.238	S	C	.	.			trans	-117.5	173.9	164.6	74.6	0	0	0	0	110	A887 Y888	T885-A887 PolarHBondContact O-N 2.71Å; T885-A887 PolarHBondContact OG1-N 3.35Å; T885-Y888 WeakPolarHBondContact CB-O 3.47Å; T885-Y888 HydrophobicContact CG2-CD1 4.44Å; T885-Y888 HydrophobicContact CG2-CE1 4Å; T885-Y888 HydrophobicContact CG2-CE2 4.09Å; T885-Y888 PolarHBondContact N-O 3.21Å; T885-Y888 WeakPolarHBondContact OG1-CD1 3.23Å; T885-Y888 WeakPolarHBondContact OG1-CE1 2.91Å; T885-Y888 PolarHBondContact OG1-N 2.62Å; T885-Y888 PolarHBondContact OG1-O 3.07Å
886	I	78.8	Confident	93	Very high	158 Å²	158	46.2 Å²	46.2	81%	0.81	25%	0.246	S	C	*	.	S	Bend	trans	-57.2	-36.1	177.3	-61	173.5	0	0	0	112
887	A	83.7	Confident	93	Very high	5 Å²	5	43.5 Å²	43.5	4%	0.041	23%	0.234	C	C	.	.	S	Bend	trans	-108.8	-26.4	-171	0	0	0	0	0	114.9	T885 Y911 V912 A913 D925	T885-A887 PolarHBondContact O-N 2.71Å; T885-A887 PolarHBondContact OG1-N 3.35Å; A887-Y911 HydrophobicContact CB-CE2 3.99Å; A887-V912 VanDerWaalsContact O-CG2 3.32Å; A887-V912 WeakPolarHBondContact O-CG2 3.46Å; A887-V912 PolarHBondContact O-N 2.73Å; A887-A913 HydrophobicContact CB-CB 4.17Å; A887-A913 PolarHBondContact O-N 3.45Å; A887-D925 HydrophobicContact CB-CB 3.69Å
888	Y	91.3	Very high	92.9	Very high	43 Å²	43	47.3 Å²	47.3	17%	0.169	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	154.4	-177.3	70	-87.8	0	0	0	113.7	T885 Q910 F929 Y932	T885-Y888 WeakPolarHBondContact CB-O 3.47Å; T885-Y888 HydrophobicContact CG2-CD1 4.44Å; T885-Y888 HydrophobicContact CG2-CE1 4Å; T885-Y888 HydrophobicContact CG2-CE2 4.09Å; T885-Y888 PolarHBondContact N-O 3.21Å; T885-Y888 WeakPolarHBondContact OG1-CD1 3.23Å; T885-Y888 WeakPolarHBondContact OG1-CE1 2.91Å; T885-Y888 PolarHBondContact OG1-N 2.62Å; T885-Y888 PolarHBondContact OG1-O 3.07Å; Y888-Q910 CarbonylContact C-O 3.31Å; Y888-Q910 WeakPolarHBondContact CA-O 3.22Å; Y888-Q910 WeakPolarHBondContact CB-O 3.41Å; Y888-F929 HydrophobicContact CD1-CB 4.48Å; Y888-F929 AromaticContact CD1-CD2 3.46Å; Y888-F929 HydrophobicContact CD1-CD2 3.46Å; Y888-F929 VanDerWaalsContact CD1-CD2 3.46Å; Y888-F929 HydrophobicContact CD1-CE2 4.08Å; Y888-F929 HydrophobicContact CD1-CG 4.38Å; Y888-F929 AromaticContact CD2-CD2 3.98Å; Y888-F929 HydrophobicContact CD2-CD2 3.98Å; Y888-F929 AromaticContact CD2-CE2 3.83Å; Y888-F929 HydrophobicContact CD2-CE2 3.83Å; Y888-F929 AromaticContact CE1-CD2 3.87Å; Y888-F929 HydrophobicContact CE1-CD2 3.87Å; Y888-F929 HydrophobicContact CE2-CD2 4.35Å; Y888-F929 HydrophobicContact CE2-CE2 4.45Å; Y888-F929 AromaticContact CG-CD2 3.52Å; Y888-F929 HydrophobicContact CG-CD2 3.52Å; Y888-F929 AromaticContact CG-CE2 3.62Å; Y888-F929 HydrophobicContact CG-CE2 3.62Å; Y888-Y932 AromaticContact CE2-CD1 3.87Å; Y888-Y932 HydrophobicContact CE2-CD1 3.87Å; Y888-Y932 AromaticContact CE2-CE1 3.83Å; Y888-Y932 HydrophobicContact CE2-CE1 3.83Å; Y888-Y932 AromaticContact CZ-CD1 3.84Å; Y888-Y932 WeakPolarHBondContact OH-CD1 3.29Å
889	V	92.4	Very high	92.8	Very high	16 Å²	16	51.4 Å²	51.4	10%	0.097	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	139	168.9	-172.7	0	0	0	0	108.7	E882 D883 R891 L909 Q910	E882-V889 HydrophobicContact CG-CG1 3.51Å; D883-V889 CarbonylContact O-C 3.53Å; D883-V889 WeakPolarHBondContact O-CA 3.42Å; D883-V889 WeakPolarHBondContact O-CG1 3.42Å; V889-R891 HydrophobicContact CG1-CG 4.27Å; V889-L909 CarbonylContact O-C 3.56Å; V889-Q910 HydrophobicContact CB-CB 4.4Å; V889-Q910 PolarHBondContact N-O 2.91Å; V889-Q910 PolarHBondContact O-N 3.02Å
890	S	96.4	Very high	92.8	Very high	13 Å²	13	55.6 Å²	55.6	9%	0.091	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	141.1	172.4	-167.2	0	0	0	0	109.4	E882 D883 H908 L909	E882-S890 CarbonylContact C-O 3.56Å; E882-S890 WeakPolarHBondContact CA-O 3.35Å; D883-S890 PolarHBondContact N-O 3.21Å; D883-S890 PolarHBondContact O-N 2.81Å; S890-H908 CarbonylContact C-O 3.56Å; S890-L909 WeakPolarHBondContact OG-CD2 3.48Å
891	R	97.7	Very high	92.8	Very high	14 Å²	14	53.1 Å²	53.1	5%	0.053	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	146.5	177.9	-59.6	175	-179.6	97.3	6.1	111.4	A881 E882 V889 M893 T907 H908	A881-R891 WeakPolarHBondContact O-CA 3.45Å; A881-R891 WeakPolarHBondContact O-CB 3.41Å; E882-R891 HydrophobicContact CB-CG 4.1Å; E882-R891 HydrophobicContact CG-CG 3.97Å; E882-R891 IonicContact OE2-CZ 2.97Å; E882-R891 IonicContact OE2-NE 3.03Å; E882-R891 PolarHBondContact OE2-NE 3.46Å; E882-R891 IonicContact OE2-NH2 2.68Å; E882-R891 PolarHBondContact OE2-NH2 2.62Å; V889-R891 HydrophobicContact CG1-CG 4.27Å; R891-M893 HydrophobicContact CB-CE 3.84Å; R891-M893 HydrophobicContact CG-CE 4.25Å; R891-T907 CarbonylContact O-C 3.59Å; R891-T907 WeakPolarHBondContact O-CA 3.45Å; R891-H908 HydrophobicContact CB-CB 4.19Å; R891-H908 PolarHBondContact N-O 3.31Å; R891-H908 PolarHBondContact NH1-CE1 3.35Å; R891-H908 PolarHBondContact NH1-ND1 3.01Å; R891-H908 PolarHBondContact O-N 2.97Å
892	E	97.4	Very high	93	Very high	59 Å²	59	55.8 Å²	55.8	28%	0.276	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	117.2	168.5	-71.2	-58.4	129.1	0	0	109.6	Q880 A881 T905 T907	Q880-E892 PolarHBondContact N-O 2.78Å; A881-E892 HydrophobicContact CB-CB 4.48Å; A881-E892 PolarHBondContact O-N 2.76Å; A881-E892 VanDerWaalsContact O-N 3.14Å; E892-T905 WeakPolarHBondContact OE2-CG2 3.38Å; E892-T907 VanDerWaalsContact OE1-CB 3.28Å; E892-T907 WeakPolarHBondContact OE1-CB 3.35Å; E892-T907 VanDerWaalsContact OE1-CG2 3.3Å; E892-T907 WeakPolarHBondContact OE1-CG2 3.33Å; E892-T907 PolarHBondContact OE1-OG1 3.05Å; E892-T907 PolarHBondContact OE2-OG1 3.15Å
893	M	97.7	Very high	93.2	Very high	0 Å²	0	58 Å²	58	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	134	-179.9	-59.5	-72.2	174.9	0	0	110.4	W834 W863 I877 Q878 C879 R891 T905 V906 H908	W834-M893 HydrophobicContact CH2-CB 4.31Å; W834-M893 HydrophobicContact CH2-CG 4.26Å; W863-M893 HydrophobicContact CB-CE 3.44Å; W863-M893 VanDerWaalsContact CB-CE 3.44Å; W863-M893 HydrophobicContact CB-SD 3.94Å; W863-M893 HydrophobicContact CD2-CE 4.47Å; W863-M893 HydrophobicContact CG-CE 3.6Å; I877-M893 HydrophobicContact CG2-SD 4.36Å; Q878-M893 CarbonylContact O-C 2.85Å; Q878-M893 WeakPolarHBondContact O-CA 3.31Å; C879-M893 HydrophobicContact CB-CE 4.32Å; C879-M893 HydrophobicContact CB-SD 3.9Å; R891-M893 HydrophobicContact CB-CE 3.84Å; R891-M893 HydrophobicContact CG-CE 4.25Å; M893-T905 CarbonylContact O-C 3.56Å; M893-T905 WeakPolarHBondContact O-CA 3.27Å; M893-V906 HydrophobicContact CB-CB 4.28Å; M893-V906 WeakPolarHBondContact CB-O 3.35Å; M893-V906 PolarHBondContact N-O 2.69Å; M893-V906 PolarHBondContact O-N 3.1Å; M893-H908 HydrophobicContact CE-CB 4.12Å; M893-H908 HydrophobicContact CG-CB 4.12Å
894	L	97.8	Very high	93.6	Very high	14 Å²	14	54 Å²	54	7%	0.073	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	124.7	163	-169.2	70	0	0	0	109	Q878 Q880 E903	Q878-L894 HydrophobicContact CB-CB 4.47Å; Q878-L894 PolarHBondContact N-O 2.91Å; Q878-L894 PolarHBondContact O-N 2.8Å; Q880-L894 HydrophobicContact CG-CB 4.09Å; L894-E903 HydrophobicContact CD1-CB 4.02Å; L894-E903 HydrophobicContact CD1-CG 4.29Å; L894-E903 HydrophobicContact CD2-CG 4.45Å
895	V	97.9	Very high	94.3	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	112.8	172.1	-175.2	0	0	0	0	107.8	W834 W838 F875 I877 E903 H904 V906	W834-V895 HydrophobicContact CE3-CG2 3.67Å; W834-V895 HydrophobicContact CH2-CG2 4.19Å; W834-V895 HydrophobicContact CZ3-CG2 3.37Å; W838-V895 HydrophobicContact CE3-CG1 3.83Å; W838-V895 HydrophobicContact CZ3-CG1 4.17Å; F875-V895 HydrophobicContact CB-CG1 4.25Å; F875-V895 HydrophobicContact CD1-CG1 4.09Å; F875-V895 HydrophobicContact CG-CG1 4.41Å; I877-V895 HydrophobicContact CD1-CB 4.37Å; I877-V895 HydrophobicContact CD1-CG1 3.9Å; I877-V895 HydrophobicContact CD1-CG2 4.06Å; V895-E903 CarbonylContact O-C 3.56Å; V895-E903 WeakPolarHBondContact O-CA 3.3Å; V895-H904 WeakPolarHBondContact CB-O 3.31Å; V895-H904 PolarHBondContact N-O 3.09Å; V895-H904 PolarHBondContact O-N 3.36Å; V895-V906 HydrophobicContact CG2-CG2 3.88Å
896	T	97.9	Very high	94.9	Very high	27 Å²	27	50.2 Å²	50.2	17%	0.166	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	128.2	174.5	-44.8	0	0	0	0	109.8	F875 H876 E902 E903	F875-T896 WeakPolarHBondContact CA-O 3.42Å; H876-T896 PolarHBondContact N-O 2.94Å; H876-T896 PolarHBondContact O-N 3.22Å; T896-E902 WeakPolarHBondContact CA-O 3.48Å; T896-E903 HydrophobicContact CG2-CG 4.01Å
897	N	96.9	Very high	95.8	Very high	7 Å²	7	43.8 Å²	43.8	4%	0.037	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	118.3	170.7	178	-52.1	0	0	0	109.3	W838 I874 F875 E899 T900 G901 E902	W838-N897 HydrophobicContact CH2-CB 3.58Å; W838-N897 HydrophobicContact CZ2-CB 3.41Å; W838-N897 VanDerWaalsContact CZ2-CB 3.41Å; W838-N897 HydrophobicContact CZ3-CB 4.21Å; I874-N897 WeakPolarHBondContact O-CA 3.24Å; F875-N897 HydrophobicContact CD1-CB 4.49Å; F875-N897 HydrophobicContact CE1-CB 4.43Å; N897-E899 VanDerWaalsContact C-N 3.3Å; N897-E899 PolarHBondContact O-N 3.11Å; N897-E899 WeakPolarHBondContact OD1-CB 3.37Å; N897-E899 PolarHBondContact OD1-N 3.44Å; N897-T900 WeakPolarHBondContact CB-OG1 3.48Å; N897-T900 PolarHBondContact O-N 3.35Å; N897-T900 PolarHBondContact OD1-N 2.94Å; N897-T900 PolarHBondContact OD1-OG1 3.33Å; N897-G901 WeakPolarHBondContact O-CA 3.35Å; N897-G901 PolarHBondContact O-N 2.7Å; N897-E902 PolarHBondContact N-O 2.85Å
898	T	95.5	Very high	96.5	Very high	81 Å²	81	43.6 Å²	43.6	50%	0.497	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-15.8	-172.1	58.9	0	0	0	0	114	I874 H876	I874-T898 PolarHBondContact O-N 2.93Å; I874-T898 PolarHBondContact O-OG1 2.76Å; H876-T898 HydrophobicContact CB-CG2 3.91Å
899	E	94.3	Very high	96.9	Very high	150 Å²	150	41.5 Å²	41.5	70%	0.701	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.9	-32.3	175.4	-59.7	-172.2	145.9	0	0	112.5	I874 N897	I874-E899 HydrophobicContact CB-CG 4.27Å; I874-E899 HydrophobicContact CG2-CG 4.02Å; N897-E899 VanDerWaalsContact C-N 3.3Å; N897-E899 PolarHBondContact O-N 3.11Å; N897-E899 WeakPolarHBondContact OD1-CB 3.37Å; N897-E899 PolarHBondContact OD1-N 3.44Å
900	T	95.5	Very high	97.1	Very high	91 Å²	91	41.2 Å²	41.2	56%	0.558	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-106.2	-23.4	-175.1	66.4	0	0	0	0	114.5	N897 E902	N897-T900 WeakPolarHBondContact CB-OG1 3.48Å; N897-T900 PolarHBondContact O-N 3.35Å; N897-T900 PolarHBondContact OD1-N 2.94Å; N897-T900 PolarHBondContact OD1-OG1 3.33Å; T900-E902 PolarHBondContact O-N 3.27Å; T900-E902 WeakPolarHBondContact OG1-CB 3.1Å; T900-E902 PolarHBondContact OG1-N 3.35Å; T900-E902 VanDerWaalsContact OG1-N 3.17Å
901	G	94.7	Very high	97	Very high	58 Å²	58	40.7 Å²	40.7	60%	0.598	23%	0.226	S	C	*	.			trans	69.1	15.7	-169	0	0	0	0	0	113.9	N897	N897-G901 WeakPolarHBondContact O-CA 3.35Å; N897-G901 PolarHBondContact O-N 2.7Å
902	E	97.2	Very high	96.5	Very high	93 Å²	93	42.5 Å²	42.5	44%	0.435	24%	0.238	S	C	.	.			trans	-78.2	139.7	171.7	-170.7	-169.3	179.3	0	0	110	W838 K841 T896 N897 T900	W838-E902 HydrophobicContact CH2-CB 3.74Å; W838-E902 HydrophobicContact CH2-CG 3.83Å; W838-E902 WeakPolarHBondContact CH2-O 3.04Å; W838-E902 HydrophobicContact CZ2-CB 3.96Å; W838-E902 HydrophobicContact CZ2-CG 4.16Å; W838-E902 WeakPolarHBondContact CZ2-OE2 3.49Å; K841-E902 IonicContact NZ-OE1 2.69Å; K841-E902 PolarHBondContact NZ-OE1 3.19Å; K841-E902 IonicContact NZ-OE2 2.7Å; K841-E902 PolarHBondContact NZ-OE2 3.17Å; T896-E902 WeakPolarHBondContact CA-O 3.48Å; N897-E902 PolarHBondContact N-O 2.85Å; T900-E902 PolarHBondContact O-N 3.27Å; T900-E902 WeakPolarHBondContact OG1-CB 3.1Å; T900-E902 PolarHBondContact OG1-N 3.35Å; T900-E902 VanDerWaalsContact OG1-N 3.17Å
903	E	97.2	Very high	95.8	Very high	127 Å²	127	40.6 Å²	40.6	59%	0.593	23%	0.233	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-109.8	146.7	176.5	-71.6	175.5	-174.7	0	0	111	L894 V895 T896	L894-E903 HydrophobicContact CD1-CB 4.02Å; L894-E903 HydrophobicContact CD1-CG 4.29Å; L894-E903 HydrophobicContact CD2-CG 4.45Å; V895-E903 CarbonylContact O-C 3.56Å; V895-E903 WeakPolarHBondContact O-CA 3.3Å; T896-E903 HydrophobicContact CG2-CG 4.01Å
904	H	97.5	Very high	94.8	Very high	29 Å²	29	40.8 Å²	40.8	13%	0.134	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	127.6	176	179.7	77.4	0	0	0	110.3	W838 K841 L842 V895 V906	W838-H904 HydrophobicContact CE3-CB 4.06Å; W838-H904 HydrophobicContact CH2-CB 4.4Å; W838-H904 HydrophobicContact CZ3-CB 3.57Å; K841-H904 PolarHBondContact O-CE1 3.32Å; L842-H904 PolarHBondContact O-NE2 3.27Å; V895-H904 WeakPolarHBondContact CB-O 3.31Å; V895-H904 PolarHBondContact N-O 3.09Å; V895-H904 PolarHBondContact O-N 3.36Å; H904-V906 VanDerWaalsContact CD2-CG2 3.47Å; H904-V906 WeakPolarHBondContact CD2-CG2 3.19Å
905	T	97.4	Very high	93.3	Very high	70 Å²	70	42.8 Å²	42.8	43%	0.429	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	140.8	-178.4	-51	0	0	0	0	111.3	E892 M893	E892-T905 WeakPolarHBondContact OE2-CG2 3.38Å; M893-T905 CarbonylContact O-C 3.56Å; M893-T905 WeakPolarHBondContact O-CA 3.27Å
906	V	98.2	Very high	91.3	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	117.1	-177.8	-169	0	0	0	0	111	W834 V837 L842 S843 V845 M893 V895 H904 H908	W834-V906 HydrophobicContact CZ3-CG2 4.36Å; V837-V906 HydrophobicContact CG1-CG1 4.38Å; V837-V906 HydrophobicContact CG1-CG2 3.75Å; L842-V906 WeakPolarHBondContact O-CG2 3.38Å; S843-V906 CarbonylContact O-C 3.47Å; S843-V906 WeakPolarHBondContact O-CA 3.45Å; V845-V906 HydrophobicContact CB-CG1 4.38Å; V845-V906 HydrophobicContact CG2-CG1 3.72Å; M893-V906 HydrophobicContact CB-CB 4.28Å; M893-V906 WeakPolarHBondContact CB-O 3.35Å; M893-V906 PolarHBondContact N-O 2.69Å; M893-V906 PolarHBondContact O-N 3.1Å; V895-V906 HydrophobicContact CG2-CG2 3.88Å; H904-V906 VanDerWaalsContact CD2-CG2 3.47Å; H904-V906 WeakPolarHBondContact CD2-CG2 3.19Å; V906-H908 PolarHBondContact O-N 3.25Å
907	T	98.2	Very high	89.4	Confident	22 Å²	22	43.9 Å²	43.9	14%	0.135	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	123.1	168.5	-55.7	0	0	0	0	109.5	S843 L844 V845 R891 E892 L909 L936	S843-T907 PolarHBondContact O-N 2.7Å; L844-T907 HydrophobicContact CD1-CG2 4.31Å; V845-T907 PolarHBondContact N-O 3.08Å; R891-T907 CarbonylContact O-C 3.59Å; R891-T907 WeakPolarHBondContact O-CA 3.45Å; E892-T907 VanDerWaalsContact OE1-CB 3.28Å; E892-T907 WeakPolarHBondContact OE1-CB 3.35Å; E892-T907 VanDerWaalsContact OE1-CG2 3.3Å; E892-T907 WeakPolarHBondContact OE1-CG2 3.33Å; E892-T907 PolarHBondContact OE1-OG1 3.05Å; E892-T907 PolarHBondContact OE2-OG1 3.15Å; T907-L909 HydrophobicContact CG2-CD2 3.87Å; T907-L909 HydrophobicContact CG2-CG 4.17Å; T907-L936 HydrophobicContact CG2-CD1 3.99Å
908	H	98.2	Very high	88	Confident	1 Å²	1	44.6 Å²	44.6	1%	0.005	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	114	179.6	177.7	-89.8	0	0	0	110.3	V845 Y862 W863 S890 R891 M893 V906	V845-H908 WeakPolarHBondContact O-CA 3.49Å; Y862-H908 AromaticContact CE2-CD2 4Å; Y862-H908 AromaticContact CE2-NE2 3.75Å; Y862-H908 AromaticContact CZ-NE2 3.5Å; Y862-H908 PolarHBondContact OH-CD2 3.39Å; Y862-H908 PolarHBondContact OH-NE2 3.05Å; W863-H908 AromaticContact CE3-CE1 3.97Å; W863-H908 AromaticContact CE3-NE2 3.92Å; W863-H908 AromaticContact CZ3-CE1 3.92Å; W863-H908 AromaticContact CZ3-NE2 3.97Å; S890-H908 CarbonylContact C-O 3.56Å; R891-H908 HydrophobicContact CB-CB 4.19Å; R891-H908 PolarHBondContact N-O 3.31Å; R891-H908 PolarHBondContact NH1-CE1 3.35Å; R891-H908 PolarHBondContact NH1-ND1 3.01Å; R891-H908 PolarHBondContact O-N 2.97Å; M893-H908 HydrophobicContact CE-CB 4.12Å; M893-H908 HydrophobicContact CG-CB 4.12Å; V906-H908 PolarHBondContact O-N 3.25Å
909	L	98	Very high	87.1	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	112	-178.4	-61.8	-169.4	0	0	0	111.1	L844 V845 M847 V889 S890 T907 F929 Y932 V933 L936	L844-L909 HydrophobicContact CD1-CD1 4.2Å; L844-L909 HydrophobicContact CD1-CG 4.22Å; V845-L909 PolarHBondContact O-N 2.84Å; M847-L909 PolarHBondContact N-O 2.92Å; V889-L909 CarbonylContact O-C 3.56Å; S890-L909 WeakPolarHBondContact OG-CD2 3.48Å; T907-L909 HydrophobicContact CG2-CD2 3.87Å; T907-L909 HydrophobicContact CG2-CG 4.17Å; L909-F929 HydrophobicContact CB-CE2 3.92Å; L909-F929 HydrophobicContact CB-CZ 3.91Å; L909-F929 HydrophobicContact CD1-CE2 4.06Å; L909-F929 HydrophobicContact CD1-CZ 4.37Å; L909-Y932 HydrophobicContact CD1-CD1 3.78Å; L909-Y932 HydrophobicContact CD1-CE1 3.81Å; L909-Y932 HydrophobicContact CD2-CD1 4.41Å; L909-Y932 HydrophobicContact CD2-CE1 3.7Å; L909-Y932 HydrophobicContact CG-CE1 4.44Å; L909-V933 HydrophobicContact CD1-CG2 3.94Å; L909-L936 HydrophobicContact CD1-CD1 3.75Å; L909-L936 HydrophobicContact CG-CD1 4.42Å
910	Q	97	Very high	86.3	Confident	10 Å²	10	34.4 Å²	34.4	5%	0.047	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	102.1	179.8	-176.9	175.9	17.2	0	0	112.3	M847 T849 Y888 V889 V912	M847-Q910 HydrophobicContact CB-CB 4.24Å; M847-Q910 HydrophobicContact CB-CG 4.28Å; M847-Q910 HydrophobicContact CG-CB 4.41Å; M847-Q910 HydrophobicContact CG-CG 3.93Å; M847-Q910 CarbonylContact O-C 3.51Å; M847-Q910 WeakPolarHBondContact O-CA 3.38Å; M847-Q910 HydrophobicContact SD-CG 4.01Å; T849-Q910 PolarHBondContact O-NE2 2.95Å; Y888-Q910 CarbonylContact C-O 3.31Å; Y888-Q910 WeakPolarHBondContact CA-O 3.22Å; Y888-Q910 WeakPolarHBondContact CB-O 3.41Å; V889-Q910 HydrophobicContact CB-CB 4.4Å; V889-Q910 PolarHBondContact N-O 2.91Å; V889-Q910 PolarHBondContact O-N 3.02Å; Q910-V912 HydrophobicContact CG-CG1 4.07Å; Q910-V912 PolarHBondContact O-N 2.81Å
911	Y	94.3	Very high	85.2	Confident	1 Å²	1	35.4 Å²	35.4	0%	0.004	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	121.4	171.9	-156.7	-81.6	0	0	0	110.7	M847 T849 A887 A913 W914 P920 F926 F929	M847-Y911 PolarHBondContact O-N 2.82Å; T849-Y911 PolarHBondContact N-O 3.29Å; A887-Y911 HydrophobicContact CB-CE2 3.99Å; Y911-A913 HydrophobicContact CE1-CB 4.02Å; Y911-A913 WeakPolarHBondContact CE1-O 3.44Å; Y911-W914 HydrophobicContact CD1-CB 3.69Å; Y911-W914 HydrophobicContact CD1-CE3 4.25Å; Y911-W914 HydrophobicContact CE1-CB 3.83Å; Y911-P920 HydrophobicContact CE1-CB 4.3Å; Y911-F926 PolarHBondContact OH-N 3.24Å; Y911-F929 HydrophobicContact CD2-CB 3.92Å; Y911-F929 AromaticContact CD2-CD1 3.52Å; Y911-F929 HydrophobicContact CD2-CD1 3.52Å; Y911-F929 AromaticContact CD2-CD2 3.79Å; Y911-F929 HydrophobicContact CD2-CD2 3.79Å; Y911-F929 AromaticContact CD2-CE1 3.86Å; Y911-F929 HydrophobicContact CD2-CE1 3.86Å; Y911-F929 HydrophobicContact CD2-CE2 4.08Å; Y911-F929 AromaticContact CD2-CG 3.46Å; Y911-F929 HydrophobicContact CD2-CG 3.46Å; Y911-F929 VanDerWaalsContact CD2-CG 3.46Å; Y911-F929 HydrophobicContact CD2-CZ 4.11Å; Y911-F929 HydrophobicContact CE2-CB 3.69Å; Y911-F929 HydrophobicContact CE2-CD1 4.06Å; Y911-F929 HydrophobicContact CE2-CD2 4.35Å; Y911-F929 AromaticContact CE2-CG 3.79Å; Y911-F929 HydrophobicContact CE2-CG 3.79Å; Y911-F929 HydrophobicContact CG-CD1 4.44Å; Y911-F929 HydrophobicContact CG-CE1 4.43Å
912	V	88.3	Confident	84.3	Confident	52 Å²	52	34.2 Å²	34.2	32%	0.315	19%	0.19	S	C	.	.			trans	-106.9	-30.7	-174.3	-65.6	0	0	0	0	113.6	T850 A887 Q910 W914	T850-V912 HydrophobicContact CG2-CB 4.12Å; T850-V912 HydrophobicContact CG2-CG1 4.22Å; A887-V912 VanDerWaalsContact O-CG2 3.32Å; A887-V912 WeakPolarHBondContact O-CG2 3.46Å; A887-V912 PolarHBondContact O-N 2.73Å; Q910-V912 HydrophobicContact CG-CG1 4.07Å; Q910-V912 PolarHBondContact O-N 2.81Å; V912-W914 PolarHBondContact O-N 2.82Å
913	A	81.4	Confident	83.8	Confident	20 Å²	20	31.2 Å²	31.2	17%	0.165	18%	0.179	C	C	.	.	S	Bend	trans	-79.7	44	-178.3	0	0	0	0	0	114	A887 Y911 P920 D921	A887-A913 HydrophobicContact CB-CB 4.17Å; A887-A913 PolarHBondContact O-N 3.45Å; Y911-A913 HydrophobicContact CE1-CB 4.02Å; Y911-A913 WeakPolarHBondContact CE1-O 3.44Å; A913-P920 WeakPolarHBondContact O-CA 3.32Å; A913-D921 PolarHBondContact O-N 3.13Å
914	W	78.2	Confident	83.4	Confident	4 Å²	4	26.8 Å²	26.8	2%	0.015	16%	0.162	C	C	.	.			trans	-148.2	93.9	-178.1	-170.6	-2.3	0	0	0	112.1	L848 Y911 V912 G918 V919 P920 F926 R953 V956	L848-W914 HydrophobicContact CB-CE3 4.44Å; L848-W914 HydrophobicContact CB-CZ3 4.49Å; L848-W914 HydrophobicContact CD1-CZ3 4Å; L848-W914 HydrophobicContact CD2-CE3 4.23Å; L848-W914 HydrophobicContact CD2-CZ3 4.01Å; L848-W914 HydrophobicContact CG-CZ3 4.4Å; Y911-W914 HydrophobicContact CD1-CB 3.69Å; Y911-W914 HydrophobicContact CD1-CE3 4.25Å; Y911-W914 HydrophobicContact CE1-CB 3.83Å; V912-W914 PolarHBondContact O-N 2.82Å; W914-G918 PolarHBondContact NE1-O 2.87Å; W914-V919 VanDerWaalsContact CD1-O 3.3Å; W914-P920 HydrophobicContact CD2-CG 3.76Å; W914-P920 HydrophobicContact CE3-CG 4.02Å; W914-P920 HydrophobicContact CG-CG 4.12Å; W914-P920 HydrophobicContact CH2-CG 4.41Å; W914-P920 HydrophobicContact CZ2-CG 4.19Å; W914-P920 HydrophobicContact CZ3-CG 4.34Å; W914-F926 AromaticContact CH2-CE2 3.93Å; W914-F926 HydrophobicContact CH2-CE2 3.93Å; W914-F926 HydrophobicContact CZ3-CD2 4.12Å; W914-F926 AromaticContact CZ3-CE2 3.8Å; W914-F926 HydrophobicContact CZ3-CE2 3.8Å; W914-R953 HydrophobicContact CD2-CB 4.11Å; W914-R953 HydrophobicContact CD2-CG 3.88Å; W914-R953 HydrophobicContact CE3-CB 4.21Å; W914-R953 HydrophobicContact CE3-CG 4.47Å; W914-R953 HydrophobicContact CG-CG 4.26Å; W914-R953 HydrophobicContact CH2-CB 3.9Å; W914-R953 HydrophobicContact CH2-CG 4.48Å; W914-R953 VanDerWaalsContact CH2-O 3.23Å; W914-R953 WeakPolarHBondContact CH2-O 3.31Å; W914-R953 HydrophobicContact CZ2-CB 3.78Å; W914-R953 HydrophobicContact CZ2-CG 3.89Å; W914-R953 HydrophobicContact CZ3-CB 4.1Å; W914-R953 PolarHBondContact O-NH1 2.92Å; W914-V956 HydrophobicContact CH2-CB 3.67Å; W914-V956 HydrophobicContact CH2-CG1 3.55Å; W914-V956 HydrophobicContact CZ2-CB 3.77Å; W914-V956 HydrophobicContact CZ2-CG1 3.7Å; W914-V956 HydrophobicContact CZ2-CG2 4.31Å
915	P	65.3	Low	83	Confident	55 Å²	55	27.7 Å²	27.7	36%	0.357	17%	0.168	S	C	.	.			trans	-65.8	146.4	178.1	25.9	-34.6	0	0	0	112.9	G918	P915-G918 WeakPolarHBondContact O-CA 3.3Å; P915-G918 PolarHBondContact O-N 3.02Å; P915-G918 VanDerWaalsContact O-N 3.09Å
916	D	56.6	Low	82.9	Confident	17 Å²	17	24.3 Å²	24.3	9%	0.091	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.1	143.6	-178	-145.7	14.2	0	0	0	112.6	E853 K858 G918 R953	E853-D916 WeakPolarHBondContact OE2-CB 3.31Å; E853-D916 PolarHBondContact OE2-N 2.95Å; K858-D916 VanDerWaalsContact NZ-CG 3.34Å; K858-D916 IonicContact NZ-OD2 3.46Å; K858-D916 PolarHBondContact NZ-OD2 2.8Å; D916-G918 PolarHBondContact O-N 2.89Å; D916-R953 IonicContact OD1-CZ 2.61Å; D916-R953 VanDerWaalsContact OD1-CZ 3.25Å; D916-R953 IonicContact OD1-NE 2.68Å; D916-R953 PolarHBondContact OD1-NE 3.02Å; D916-R953 IonicContact OD1-NH2 3.41Å; D916-R953 PolarHBondContact OD1-NH2 2.9Å; D916-R953 IonicContact OD2-NH2 3.39Å; D916-R953 PolarHBondContact OD2-NH2 3.17Å
917	H	57.2	Low	82.7	Confident	33 Å²	33	24.5 Å²	24.5	15%	0.153	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.2	-7.9	-172	-33.1	-70.6	0	0	0	114.9	D678 Q991 T992	D678-H917 WeakPolarHBondContact CB-NE2 3.43Å; D678-H917 VanDerWaalsContact CG-NE2 3.26Å; D678-H917 IonicContact OD1-CE1 2.62Å; D678-H917 PolarHBondContact OD1-CE1 3.32Å; D678-H917 IonicContact OD1-NE2 2.66Å; D678-H917 PolarHBondContact OD1-NE2 2.78Å; D678-H917 IonicContact OD2-CD2 3.91Å; D678-H917 IonicContact OD2-CE1 2.68Å; D678-H917 PolarHBondContact OD2-CE1 2.68Å; D678-H917 IonicContact OD2-CG 2.88Å; D678-H917 IonicContact OD2-ND1 2.77Å; D678-H917 PolarHBondContact OD2-ND1 2.81Å; D678-H917 IonicContact OD2-NE2 3.48Å; H917-Q991 PolarHBondContact ND1-OE1 2.96Å; H917-T992 HydrophobicContact CB-CG2 4.18Å; H917-T992 PolarHBondContact O-OG1 2.9Å
918	G	68.6	Low	82.4	Confident	22 Å²	22	30 Å²	30	23%	0.227	17%	0.172	C	C	.	.	S	Bend	trans	-85.5	-164.4	168.1	0	0	0	0	0	113.2	W914 P915 D916 Q995	W914-G918 PolarHBondContact NE1-O 2.87Å; P915-G918 WeakPolarHBondContact O-CA 3.3Å; P915-G918 PolarHBondContact O-N 3.02Å; P915-G918 VanDerWaalsContact O-N 3.09Å; D916-G918 PolarHBondContact O-N 2.89Å; G918-Q995 VanDerWaalsContact O-CG 3.26Å; G918-Q995 WeakPolarHBondContact O-CG 3.48Å; G918-Q995 PolarHBondContact O-NE2 3.02Å; G918-Q995 VanDerWaalsContact O-NE2 3.17Å
919	V	74.8	Confident	82.3	Confident	13 Å²	13	29.9 Å²	29.9	8%	0.079	17%	0.172	C	C	.	.			trans	-117.2	165	177.4	-59	0	0	0	0	108.2	M453 W914 F998	M453-V919 HydrophobicContact CE-CG2 3.78Å; M453-V919 HydrophobicContact SD-CG2 3.59Å; M453-V919 VanDerWaalsContact SD-CG2 3.59Å; W914-V919 VanDerWaalsContact CD1-O 3.3Å; V919-F998 HydrophobicContact CB-CB 4.1Å; V919-F998 HydrophobicContact CB-CD1 4.46Å; V919-F998 HydrophobicContact CB-CD2 3.88Å; V919-F998 HydrophobicContact CB-CE2 4.46Å; V919-F998 HydrophobicContact CB-CG 3.88Å; V919-F998 HydrophobicContact CG1-CB 3.52Å; V919-F998 HydrophobicContact CG1-CD2 4.26Å; V919-F998 HydrophobicContact CG1-CG 3.88Å; V919-F998 HydrophobicContact CG2-CD2 4.31Å
920	P	79	Confident	82.2	Confident	4 Å²	4	29.9 Å²	29.9	3%	0.026	17%	0.172	C	C	.	.			trans	-55.9	143	169	-23.6	34.8	0	0	0	111.3	Y911 A913 W914 D922 F926 F998	Y911-P920 HydrophobicContact CE1-CB 4.3Å; A913-P920 WeakPolarHBondContact O-CA 3.32Å; W914-P920 HydrophobicContact CD2-CG 3.76Å; W914-P920 HydrophobicContact CE3-CG 4.02Å; W914-P920 HydrophobicContact CG-CG 4.12Å; W914-P920 HydrophobicContact CH2-CG 4.41Å; W914-P920 HydrophobicContact CZ2-CG 4.19Å; W914-P920 HydrophobicContact CZ3-CG 4.34Å; P920-D922 WeakPolarHBondContact CB-O 3.38Å; P920-F926 HydrophobicContact CB-CB 3.78Å; P920-F926 HydrophobicContact CB-CG 4.29Å; P920-F926 HydrophobicContact CG-CB 3.78Å; P920-F926 HydrophobicContact CG-CD1 4.46Å; P920-F926 HydrophobicContact CG-CD2 3.67Å; P920-F926 HydrophobicContact CG-CE2 4.41Å; P920-F926 HydrophobicContact CG-CG 3.7Å; P920-F998 HydrophobicContact CB-CZ 4.11Å; P920-F998 VanDerWaalsContact CD-CE1 3.49Å; P920-F998 VanDerWaalsContact CD-CZ 3.47Å; P920-F998 HydrophobicContact CG-CE1 3.77Å; P920-F998 HydrophobicContact CG-CE2 4.38Å; P920-F998 HydrophobicContact CG-CZ 3.6Å
921	D	71.2	Confident	82.1	Confident	113 Å²	113	33.3 Å²	33.3	60%	0.604	19%	0.187	S	C	*	.	S	Bend	trans	-70.3	-33.2	-173.1	-69.4	-57.6	0	0	0	113.1	A913	A913-D921 PolarHBondContact O-N 3.13Å
922	D	76.4	Confident	82.2	Confident	33 Å²	33	36.8 Å²	36.8	18%	0.176	20%	0.2	C	C	.	.			trans	-118.5	146.3	157	-158.8	-60.3	0	0	0	110.6	P920 S924	P920-D922 WeakPolarHBondContact CB-O 3.38Å; D922-S924 VanDerWaalsContact OD1-CB 3.27Å; D922-S924 WeakPolarHBondContact OD1-CB 3.47Å; D922-S924 PolarHBondContact OD1-N 3.31Å; D922-S924 PolarHBondContact OD1-OG 3Å
923	S	87	Confident	82.6	Confident	29 Å²	29	34.3 Å²	34.3	20%	0.203	19%	0.185	C	C	.	.	H	α-helix	trans	-74.8	-25.2	175.6	65.5	0	0	0	0	113.9	L927 R1005	S923-L927 VanDerWaalsContact O-CG 3.25Å; S923-L927 WeakPolarHBondContact O-CG 3.44Å; S923-L927 PolarHBondContact O-N 3.01Å; S923-L927 VanDerWaalsContact O-N 3.12Å; S923-R1005 PolarHBondContact OG-NH1 3.49Å
924	S	88.8	Confident	83.2	Confident	34 Å²	34	35.7 Å²	35.7	24%	0.238	19%	0.186	C	C	.	.	H	α-helix	trans	-74.1	-54.5	-174.3	-43.3	0	0	0	0	109.7	D922 F926 L927 E928 R1005	D922-S924 VanDerWaalsContact OD1-CB 3.27Å; D922-S924 WeakPolarHBondContact OD1-CB 3.47Å; D922-S924 PolarHBondContact OD1-N 3.31Å; D922-S924 PolarHBondContact OD1-OG 3Å; S924-F926 PolarHBondContact O-N 3.1Å; S924-L927 WeakPolarHBondContact O-CA 3.48Å; S924-L927 PolarHBondContact O-N 2.84Å; S924-E928 PolarHBondContact O-N 3.48Å; S924-R1005 PolarHBondContact OG-NH1 2.98Å
925	D	89.5	Confident	84	Confident	48 Å²	48	39.5 Å²	39.5	26%	0.257	21%	0.214	S	C	.	.	H	α-helix	trans	-51.6	-41.8	173.2	-56.3	18.3	0	0	0	111.8	A887 F929	A887-D925 HydrophobicContact CB-CB 3.69Å; D925-F929 VanDerWaalsContact O-CB 3.25Å; D925-F929 WeakPolarHBondContact O-CB 3.3Å; D925-F929 PolarHBondContact O-N 2.87Å
926	F	93.8	Very high	85.5	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-64.8	-44.2	175.3	170.5	-105.9	0	0	0	112.4	Y911 W914 P920 S924 F929 V930 V956 M960 F998	Y911-F926 PolarHBondContact OH-N 3.24Å; W914-F926 AromaticContact CH2-CE2 3.93Å; W914-F926 HydrophobicContact CH2-CE2 3.93Å; W914-F926 HydrophobicContact CZ3-CD2 4.12Å; W914-F926 AromaticContact CZ3-CE2 3.8Å; W914-F926 HydrophobicContact CZ3-CE2 3.8Å; P920-F926 HydrophobicContact CB-CB 3.78Å; P920-F926 HydrophobicContact CB-CG 4.29Å; P920-F926 HydrophobicContact CG-CB 3.78Å; P920-F926 HydrophobicContact CG-CD1 4.46Å; P920-F926 HydrophobicContact CG-CD2 3.67Å; P920-F926 HydrophobicContact CG-CE2 4.41Å; P920-F926 HydrophobicContact CG-CG 3.7Å; S924-F926 PolarHBondContact O-N 3.1Å; F926-F929 PolarHBondContact O-N 2.87Å; F926-V930 HydrophobicContact CD1-CG2 4.35Å; F926-V930 HydrophobicContact CD2-CG2 4.17Å; F926-V930 HydrophobicContact CE1-CG2 3.97Å; F926-V930 HydrophobicContact CE2-CG2 3.76Å; F926-V930 HydrophobicContact CG-CG2 4.45Å; F926-V930 HydrophobicContact CZ-CG2 3.65Å; F926-V930 WeakPolarHBondContact O-CG2 3.48Å; F926-V930 PolarHBondContact O-N 2.98Å; F926-V956 HydrophobicContact CE1-CG1 4.45Å; F926-V956 HydrophobicContact CE2-CG1 4.29Å; F926-V956 HydrophobicContact CZ-CG1 3.79Å; F926-M960 HydrophobicContact CE1-CB 3.92Å; F926-M960 HydrophobicContact CE1-CG 3.62Å; F926-M960 HydrophobicContact CE1-SD 4.15Å; F926-M960 HydrophobicContact CZ-CB 3.81Å; F926-M960 HydrophobicContact CZ-CG 3.99Å; F926-F998 HydrophobicContact CB-CZ 4.32Å; F926-F998 AromaticContact CD1-CE1 3.61Å; F926-F998 HydrophobicContact CD1-CE1 3.61Å; F926-F998 AromaticContact CD1-CZ 3.64Å; F926-F998 HydrophobicContact CD1-CZ 3.64Å; F926-F998 AromaticContact CE1-CE1 3.67Å; F926-F998 HydrophobicContact CE1-CE1 3.67Å; F926-F998 HydrophobicContact CE1-CZ 4.18Å; F926-F998 HydrophobicContact CG-CE1 4.18Å; F926-F998 HydrophobicContact CG-CZ 4.06Å; F926-F998 HydrophobicContact CZ-CE1 4.3Å
927	L	94.6	Very high	87.2	Confident	4 Å²	4	41.1 Å²	41.1	2%	0.021	22%	0.215	C	C	.	.	H	α-helix	trans	-68.3	-36.2	178.8	-73.5	174	0	0	0	112.3	S923 S924 V930 K931 M960 M964 A1002 V1006 L1011	S923-L927 VanDerWaalsContact O-CG 3.25Å; S923-L927 WeakPolarHBondContact O-CG 3.44Å; S923-L927 PolarHBondContact O-N 3.01Å; S923-L927 VanDerWaalsContact O-N 3.12Å; S924-L927 WeakPolarHBondContact O-CA 3.48Å; S924-L927 PolarHBondContact O-N 2.84Å; L927-V930 PolarHBondContact O-N 3.26Å; L927-K931 WeakPolarHBondContact O-CG 3.26Å; L927-K931 PolarHBondContact O-N 3.13Å; L927-M960 HydrophobicContact CD2-CE 4.01Å; L927-M960 HydrophobicContact CD2-CG 4.01Å; L927-M960 HydrophobicContact CD2-SD 3.61Å; L927-M964 HydrophobicContact CD2-CE 3.68Å; L927-A1002 HydrophobicContact CD2-CB 4.36Å; L927-V1006 HydrophobicContact CD1-CG2 3.94Å; L927-V1006 HydrophobicContact CD2-CG2 3.44Å; L927-V1006 VanDerWaalsContact CD2-CG2 3.44Å; L927-V1006 HydrophobicContact CG-CG2 4.3Å; L927-L1011 HydrophobicContact CD1-CD1 3.96Å
928	E	92.8	Very high	88.8	Confident	136 Å²	136	43.2 Å²	43.2	64%	0.636	23%	0.23	S	C	*	.	H	α-helix	trans	-67.8	-41.9	172.3	-69.1	-173.5	-179.8	0	0	111.5	S924 V930 K931 Y932	S924-E928 PolarHBondContact O-N 3.48Å; E928-V930 PolarHBondContact O-N 2.83Å; E928-K931 WeakPolarHBondContact O-CB 3.37Å; E928-K931 PolarHBondContact O-N 2.75Å; E928-K931 VanDerWaalsContact O-N 3.15Å; E928-Y932 PolarHBondContact O-N 3.49Å
929	F	95.4	Very high	89.5	Confident	0 Å²	0	46 Å²	46	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-61.8	-40.4	172.4	-175.8	-104.3	0	0	0	112.7	V846 L848 Y888 L909 Y911 D925 F926 K931 Y932 V933	V846-F929 HydrophobicContact CG1-CE1 3.83Å; V846-F929 HydrophobicContact CG1-CZ 3.86Å; L848-F929 HydrophobicContact CD2-CE1 3.84Å; Y888-F929 HydrophobicContact CD1-CB 4.48Å; Y888-F929 AromaticContact CD1-CD2 3.46Å; Y888-F929 HydrophobicContact CD1-CD2 3.46Å; Y888-F929 VanDerWaalsContact CD1-CD2 3.46Å; Y888-F929 HydrophobicContact CD1-CE2 4.08Å; Y888-F929 HydrophobicContact CD1-CG 4.38Å; Y888-F929 AromaticContact CD2-CD2 3.98Å; Y888-F929 HydrophobicContact CD2-CD2 3.98Å; Y888-F929 AromaticContact CD2-CE2 3.83Å; Y888-F929 HydrophobicContact CD2-CE2 3.83Å; Y888-F929 AromaticContact CE1-CD2 3.87Å; Y888-F929 HydrophobicContact CE1-CD2 3.87Å; Y888-F929 HydrophobicContact CE2-CD2 4.35Å; Y888-F929 HydrophobicContact CE2-CE2 4.45Å; Y888-F929 AromaticContact CG-CD2 3.52Å; Y888-F929 HydrophobicContact CG-CD2 3.52Å; Y888-F929 AromaticContact CG-CE2 3.62Å; Y888-F929 HydrophobicContact CG-CE2 3.62Å; L909-F929 HydrophobicContact CB-CE2 3.92Å; L909-F929 HydrophobicContact CB-CZ 3.91Å; L909-F929 HydrophobicContact CD1-CE2 4.06Å; L909-F929 HydrophobicContact CD1-CZ 4.37Å; Y911-F929 HydrophobicContact CD2-CB 3.92Å; Y911-F929 AromaticContact CD2-CD1 3.52Å; Y911-F929 HydrophobicContact CD2-CD1 3.52Å; Y911-F929 AromaticContact CD2-CD2 3.79Å; Y911-F929 HydrophobicContact CD2-CD2 3.79Å; Y911-F929 AromaticContact CD2-CE1 3.86Å; Y911-F929 HydrophobicContact CD2-CE1 3.86Å; Y911-F929 HydrophobicContact CD2-CE2 4.08Å; Y911-F929 AromaticContact CD2-CG 3.46Å; Y911-F929 HydrophobicContact CD2-CG 3.46Å; Y911-F929 VanDerWaalsContact CD2-CG 3.46Å; Y911-F929 HydrophobicContact CD2-CZ 4.11Å; Y911-F929 HydrophobicContact CE2-CB 3.69Å; Y911-F929 HydrophobicContact CE2-CD1 4.06Å; Y911-F929 HydrophobicContact CE2-CD2 4.35Å; Y911-F929 AromaticContact CE2-CG 3.79Å; Y911-F929 HydrophobicContact CE2-CG 3.79Å; Y911-F929 HydrophobicContact CG-CD1 4.44Å; Y911-F929 HydrophobicContact CG-CE1 4.43Å; D925-F929 VanDerWaalsContact O-CB 3.25Å; D925-F929 WeakPolarHBondContact O-CB 3.3Å; D925-F929 PolarHBondContact O-N 2.87Å; F926-F929 PolarHBondContact O-N 2.87Å; F929-K931 VanDerWaalsContact C-N 3.34Å; F929-K931 PolarHBondContact O-N 2.94Å; F929-Y932 PolarHBondContact O-N 2.87Å; F929-V933 HydrophobicContact CD1-CG2 4.04Å; F929-V933 HydrophobicContact CE1-CG2 3.7Å; F929-V933 HydrophobicContact CE2-CG2 4.36Å; F929-V933 HydrophobicContact CZ-CG2 3.9Å; F929-V933 WeakPolarHBondContact O-CB 3.39Å; F929-V933 WeakPolarHBondContact O-CG2 3.41Å; F929-V933 PolarHBondContact O-N 2.83Å
930	V	96.4	Very high	90	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-62.9	-41.1	173.5	-178.9	0	0	0	0	110.5	F926 L927 E928 Y932 R934 L957 M960 E961 M964	F926-V930 HydrophobicContact CD1-CG2 4.35Å; F926-V930 HydrophobicContact CD2-CG2 4.17Å; F926-V930 HydrophobicContact CE1-CG2 3.97Å; F926-V930 HydrophobicContact CE2-CG2 3.76Å; F926-V930 HydrophobicContact CG-CG2 4.45Å; F926-V930 HydrophobicContact CZ-CG2 3.65Å; F926-V930 WeakPolarHBondContact O-CG2 3.48Å; F926-V930 PolarHBondContact O-N 2.98Å; L927-V930 PolarHBondContact O-N 3.26Å; E928-V930 PolarHBondContact O-N 2.83Å; V930-Y932 VanDerWaalsContact C-N 3.35Å; V930-Y932 PolarHBondContact O-N 3.14Å; V930-R934 HydrophobicContact CG1-CG 4.42Å; V930-R934 WeakPolarHBondContact O-CB 3.46Å; V930-R934 WeakPolarHBondContact O-CG 3.37Å; V930-R934 PolarHBondContact O-N 2.75Å; V930-L957 HydrophobicContact CB-CD1 4.31Å; V930-L957 HydrophobicContact CG1-CD1 4.29Å; V930-L957 HydrophobicContact CG2-CD1 3.59Å; V930-M960 HydrophobicContact CB-CG 4.47Å; V930-M960 HydrophobicContact CG1-CG 4.19Å; V930-M960 HydrophobicContact CG2-CB 4.33Å; V930-M960 HydrophobicContact CG2-CG 3.95Å; V930-E961 HydrophobicContact CG1-CB 4.14Å; V930-M964 HydrophobicContact CB-CE 3.97Å; V930-M964 HydrophobicContact CB-SD 4.41Å; V930-M964 HydrophobicContact CG1-CE 3.84Å; V930-M964 HydrophobicContact CG1-SD 3.7Å
931	K	94.8	Very high	90.7	Very high	81 Å²	81	49.5 Å²	49.5	35%	0.352	29%	0.287	S	S	.	.	H	α-helix	trans	-60.9	-42.3	173.4	-71.2	174.8	-179.4	-172.7	0	111.9	L927 E928 F929 R934 S935 M964 L1011	L927-K931 WeakPolarHBondContact O-CG 3.26Å; L927-K931 PolarHBondContact O-N 3.13Å; E928-K931 WeakPolarHBondContact O-CB 3.37Å; E928-K931 PolarHBondContact O-N 2.75Å; E928-K931 VanDerWaalsContact O-N 3.15Å; F929-K931 VanDerWaalsContact C-N 3.34Å; F929-K931 PolarHBondContact O-N 2.94Å; K931-R934 PolarHBondContact O-N 2.81Å; K931-S935 PolarHBondContact O-N 3.41Å; K931-M964 HydrophobicContact CG-CE 4.38Å; K931-L1011 WeakPolarHBondContact CE-O 3.37Å; K931-L1011 PolarHBondContact NZ-O 2.82Å
932	Y	95.2	Very high	91.9	Very high	75 Å²	75	44.9 Å²	44.9	29%	0.294	26%	0.263	S	S	.	.	H	α-helix	trans	-66.2	-48.5	178.8	-174.9	-133.2	0	0	0	112	Y888 L909 E928 F929 V930 R934 S935 L936	Y888-Y932 AromaticContact CE2-CD1 3.87Å; Y888-Y932 HydrophobicContact CE2-CD1 3.87Å; Y888-Y932 AromaticContact CE2-CE1 3.83Å; Y888-Y932 HydrophobicContact CE2-CE1 3.83Å; Y888-Y932 AromaticContact CZ-CD1 3.84Å; Y888-Y932 WeakPolarHBondContact OH-CD1 3.29Å; L909-Y932 HydrophobicContact CD1-CD1 3.78Å; L909-Y932 HydrophobicContact CD1-CE1 3.81Å; L909-Y932 HydrophobicContact CD2-CD1 4.41Å; L909-Y932 HydrophobicContact CD2-CE1 3.7Å; L909-Y932 HydrophobicContact CG-CE1 4.44Å; E928-Y932 PolarHBondContact O-N 3.49Å; F929-Y932 PolarHBondContact O-N 2.87Å; V930-Y932 VanDerWaalsContact C-N 3.35Å; V930-Y932 PolarHBondContact O-N 3.14Å; Y932-R934 PolarHBondContact O-N 2.85Å; Y932-S935 WeakPolarHBondContact O-CB 3.43Å; Y932-S935 PolarHBondContact O-N 2.98Å; Y932-S935 PolarHBondContact O-OG 3.05Å; Y932-L936 HydrophobicContact CD1-CD1 4.47Å; Y932-L936 HydrophobicContact CD2-CD1 4.46Å; Y932-L936 HydrophobicContact CE1-CD1 4.1Å; Y932-L936 HydrophobicContact CE2-CD1 4.07Å; Y932-L936 HydrophobicContact CE2-CD2 4.34Å; Y932-L936 HydrophobicContact CE2-CG 4.22Å; Y932-L936 PolarHBondContact O-N 3.16Å
933	V	96.8	Very high	92.9	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-53.5	-41.1	172.1	167.4	0	0	0	0	111.6	L844 V846 L909 F929 L936	L844-V933 HydrophobicContact CD2-CG1 4.41Å; V846-V933 HydrophobicContact CG1-CG2 4.24Å; V846-V933 HydrophobicContact CG2-CG1 4.17Å; V846-V933 HydrophobicContact CG2-CG2 4.06Å; L909-V933 HydrophobicContact CD1-CG2 3.94Å; F929-V933 HydrophobicContact CD1-CG2 4.04Å; F929-V933 HydrophobicContact CE1-CG2 3.7Å; F929-V933 HydrophobicContact CE2-CG2 4.36Å; F929-V933 HydrophobicContact CZ-CG2 3.9Å; F929-V933 WeakPolarHBondContact O-CB 3.39Å; F929-V933 WeakPolarHBondContact O-CG2 3.41Å; F929-V933 PolarHBondContact O-N 2.83Å; V933-L936 PolarHBondContact O-N 3.42Å
934	R	94.9	Very high	93.5	Very high	48 Å²	48	42.1 Å²	42.1	18%	0.181	25%	0.247	C	C	.	.	H	α-helix	trans	-68.5	-34.9	176.5	-71.1	177.8	79	-126.1	-10.7	113	V930 K931 Y932 L936 R937 E961 C965 E968	V930-R934 HydrophobicContact CG1-CG 4.42Å; V930-R934 WeakPolarHBondContact O-CB 3.46Å; V930-R934 WeakPolarHBondContact O-CG 3.37Å; V930-R934 PolarHBondContact O-N 2.75Å; K931-R934 PolarHBondContact O-N 2.81Å; Y932-R934 PolarHBondContact O-N 2.85Å; R934-L936 VanDerWaalsContact C-N 3.26Å; R934-L936 PolarHBondContact O-N 3.31Å; R934-R937 PolarHBondContact O-N 2.94Å; R934-E961 HydrophobicContact CG-CG 3.82Å; R934-C965 PolarHBondContact NH2-SG 3.49Å; R934-E968 IonicContact CZ-OE1 3.87Å; R934-E968 IonicContact CZ-OE2 2.81Å; R934-E968 IonicContact NH1-OE1 2.97Å; R934-E968 PolarHBondContact NH1-OE1 2.89Å; R934-E968 IonicContact NH2-OE1 3.35Å; R934-E968 PolarHBondContact NH2-OE1 2.92Å; R934-E968 IonicContact NH2-OE2 3.34Å; R934-E968 PolarHBondContact NH2-OE2 2.79Å
935	S	95.3	Very high	93.9	Very high	85 Å²	85	40.5 Å²	40.5	59%	0.594	24%	0.235	S	C	*	.	H	α-helix	trans	-67.7	-24.6	177.3	74.6	0	0	0	0	113.7	K931 Y932	K931-S935 PolarHBondContact O-N 3.41Å; Y932-S935 WeakPolarHBondContact O-CB 3.43Å; Y932-S935 PolarHBondContact O-N 2.98Å; Y932-S935 PolarHBondContact O-OG 3.05Å
936	L	95.8	Very high	94.4	Very high	50 Å²	50	38.2 Å²	38.2	26%	0.262	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.3	4	179	-63.7	172.5	0	0	0	113.8	L844 T907 L909 Y932 V933 R934 V938	L844-L936 HydrophobicContact CD1-CB 4.28Å; L844-L936 HydrophobicContact CD1-CD1 3.94Å; L844-L936 HydrophobicContact CD2-CB 4.08Å; T907-L936 HydrophobicContact CG2-CD1 3.99Å; L909-L936 HydrophobicContact CD1-CD1 3.75Å; L909-L936 HydrophobicContact CG-CD1 4.42Å; Y932-L936 HydrophobicContact CD1-CD1 4.47Å; Y932-L936 HydrophobicContact CD2-CD1 4.46Å; Y932-L936 HydrophobicContact CE1-CD1 4.1Å; Y932-L936 HydrophobicContact CE2-CD1 4.07Å; Y932-L936 HydrophobicContact CE2-CD2 4.34Å; Y932-L936 HydrophobicContact CE2-CG 4.22Å; Y932-L936 PolarHBondContact O-N 3.16Å; V933-L936 PolarHBondContact O-N 3.42Å; R934-L936 VanDerWaalsContact C-N 3.26Å; R934-L936 PolarHBondContact O-N 3.31Å; L936-V938 PolarHBondContact O-N 2.92Å
937	R	93.5	Very high	94.4	Very high	55 Å²	55	38.3 Å²	38.3	21%	0.208	22%	0.223	C	C	.	.			trans	-80.6	119.3	-176.7	-76.9	-163.1	178	-97.1	0.1	113.8	K818 Y819 R934 A943 E961	K818-R937 PolarHBondContact O-NH1 2.76Å; Y819-R937 VanDerWaalsContact CD1-NH2 3.3Å; R934-R937 PolarHBondContact O-N 2.94Å; R937-A943 VanDerWaalsContact NH1-CB 3.27Å; R937-E961 VanDerWaalsContact CD-OE1 3.28Å; R937-E961 WeakPolarHBondContact CD-OE1 3.23Å; R937-E961 IonicContact CZ-OE1 3.69Å; R937-E961 IonicContact CZ-OE2 2.8Å; R937-E961 VanDerWaalsContact NE-CD 3.33Å; R937-E961 IonicContact NE-OE1 3.99Å; R937-E961 PolarHBondContact NE-OE1 3.36Å; R937-E961 IonicContact NE-OE2 3.6Å; R937-E961 PolarHBondContact NE-OE2 3.39Å; R937-E961 IonicContact NH2-OE1 2.75Å; R937-E961 PolarHBondContact NH2-OE1 2.74Å; R937-E961 IonicContact NH2-OE2 3.96Å; R937-E961 PolarHBondContact NH2-OE2 2.71Å
938	V	89.8	Confident	94.5	Very high	78 Å²	78	38.1 Å²	38.1	47%	0.473	22%	0.222	S	C	.	.			trans	-75.8	134.1	165.7	-175.7	0	0	0	0	110.5	L936 G940 E941	L936-V938 PolarHBondContact O-N 2.92Å; V938-G940 PolarHBondContact O-N 2.95Å; V938-E941 HydrophobicContact CB-CB 3.97Å; V938-E941 WeakPolarHBondContact CB-OE2 3.41Å; V938-E941 HydrophobicContact CG1-CB 4.34Å; V938-E941 PolarHBondContact O-N 2.8Å
939	G	84.5	Confident	94.6	Very high	81 Å²	81	32 Å²	32	84%	0.835	20%	0.195	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.6	115.5	-176.9	0	0	0	0	0	113.1
940	G	84	Confident	94.6	Very high	49 Å²	49	32 Å²	32	51%	0.505	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	89	-2.2	178.3	0	0	0	0	0	115.1	K818 V938	K818-G940 WeakPolarHBondContact CD-O 3.38Å; K818-G940 VanDerWaalsContact CE-O 3.32Å; K818-G940 WeakPolarHBondContact CE-O 3.5Å; K818-G940 PolarHBondContact NZ-O 2.94Å; V938-G940 PolarHBondContact O-N 2.95Å
941	E	93.5	Very high	94.7	Very high	41 Å²	41	32.1 Å²	32.1	19%	0.192	20%	0.196	C	C	.	.	P	Polyproline II helix	trans	-88.3	145.7	175.2	-162.7	-174.9	117.8	0	0	111.5	S843 V938	S843-E941 WeakPolarHBondContact CB-OE1 3.46Å; S843-E941 PolarHBondContact N-OE1 2.93Å; S843-E941 PolarHBondContact OG-OE1 3.13Å; S843-E941 PolarHBondContact OG-OE2 3.49Å; V938-E941 HydrophobicContact CB-CB 3.97Å; V938-E941 WeakPolarHBondContact CB-OE2 3.41Å; V938-E941 HydrophobicContact CG1-CB 4.34Å; V938-E941 PolarHBondContact O-N 2.8Å
942	P	97.3	Very high	94.7	Very high	16 Å²	16	28.3 Å²	28.3	10%	0.104	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	127.5	169.9	-8.8	26.4	0	0	0	112.2	K818 I820 L842	K818-P942 HydrophobicContact CB-CB 3.98Å; K818-P942 HydrophobicContact CB-CG 4.22Å; K818-P942 HydrophobicContact CD-CG 4.42Å; I820-P942 HydrophobicContact CD1-CB 4.17Å; I820-P942 HydrophobicContact CD1-CG 4.5Å; I820-P942 HydrophobicContact CG1-CB 3.92Å; L842-P942 HydrophobicContact CD2-CB 4.37Å; L842-P942 HydrophobicContact CD2-CG 4.23Å; L842-P942 WeakPolarHBondContact CD2-O 3.37Å
943	A	97.8	Very high	94.7	Very high	3 Å²	3	24.8 Å²	24.8	3%	0.025	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	129.5	162.9	0	0	0	0	0	109.5	K818 Y819 I820 L844 R937 V945	K818-A943 PolarHBondContact O-N 2.74Å; K818-A943 VanDerWaalsContact O-N 3.17Å; Y819-A943 CarbonylContact C-O 3.46Å; Y819-A943 VanDerWaalsContact CA-O 3.25Å; Y819-A943 WeakPolarHBondContact CA-O 3.15Å; I820-A943 PolarHBondContact N-O 2.84Å; L844-A943 HydrophobicContact CD2-CB 4.14Å; R937-A943 VanDerWaalsContact NH1-CB 3.27Å; A943-V945 HydrophobicContact CB-CG2 4.4Å; A943-V945 PolarHBondContact O-N 2.67Å
944	L	98.6	Very high	94.8	Very high	1 Å²	1	24.8 Å²	24.8	1%	0.005	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79	122.5	172.2	-170.5	153	0	0	0	108.5	I820 T822 F833 V836 V837 L842 L844 V845 V846	I820-L944 HydrophobicContact CB-CG 4.39Å; I820-L944 HydrophobicContact CG2-CG 4.39Å; T822-L944 HydrophobicContact CG2-CD1 4.48Å; T822-L944 HydrophobicContact CG2-CD2 3.73Å; T822-L944 HydrophobicContact CG2-CG 4.15Å; F833-L944 HydrophobicContact CE2-CD1 4.08Å; F833-L944 HydrophobicContact CE2-CD2 3.62Å; F833-L944 HydrophobicContact CZ-CD1 4.2Å; F833-L944 HydrophobicContact CZ-CD2 3.69Å; V836-L944 HydrophobicContact CG1-CD1 4.33Å; V837-L944 HydrophobicContact CG2-CD1 3.97Å; L842-L944 HydrophobicContact CD1-CB 4Å; L842-L944 HydrophobicContact CD1-CD1 3.98Å; L844-L944 PolarHBondContact O-N 2.69Å; V845-L944 HydrophobicContact CG1-CD2 4.04Å; V845-L944 HydrophobicContact CG2-CB 4.24Å; V845-L944 HydrophobicContact CG2-CD2 4.4Å; V846-L944 PolarHBondContact N-O 2.63Å
945	V	98.6	Very high	94.9	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	125.2	-179	-170.7	0	0	0	0	110.2	Y819 I820 A821 T822 V846 L848 A943 T954 L957	Y819-V945 HydrophobicContact CD1-CG2 3.93Å; I820-V945 PolarHBondContact O-N 2.73Å; A821-V945 WeakPolarHBondContact CA-O 3.45Å; T822-V945 PolarHBondContact N-O 3.3Å; T822-V945 VanDerWaalsContact N-O 3.16Å; V846-V945 HydrophobicContact CB-CG1 4.31Å; V846-V945 HydrophobicContact CB-CG2 4.23Å; V846-V945 HydrophobicContact CG1-CG1 4.49Å; V846-V945 WeakPolarHBondContact O-CA 3.23Å; L848-V945 HydrophobicContact CD1-CG1 3.93Å; L848-V945 HydrophobicContact CG-CG1 4.44Å; A943-V945 HydrophobicContact CB-CG2 4.4Å; A943-V945 PolarHBondContact O-N 2.67Å; V945-T954 HydrophobicContact CB-CG2 4.07Å; V945-T954 HydrophobicContact CG1-CG2 3.79Å; V945-L957 HydrophobicContact CG1-CD2 3.88Å; V945-L957 HydrophobicContact CG2-CD2 4.42Å
946	H	98.5	Very high	95	Very high	0 Å²	0	18.4 Å²	18.4	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	167.4	178.2	83.9	93.7	0	0	0	112.7	T822 G824 V846 M847 L848 C859 Y862	T822-H946 HydrophobicContact CG2-CB 3.68Å; T822-H946 WeakPolarHBondContact O-CA 3.29Å; T822-H946 WeakPolarHBondContact O-CB 3.42Å; G824-H946 WeakPolarHBondContact CA-ND1 3.43Å; V846-H946 PolarHBondContact O-N 3.02Å; M847-H946 WeakPolarHBondContact CB-NE2 3.33Å; M847-H946 WeakPolarHBondContact CG-CE1 3.47Å; M847-H946 WeakPolarHBondContact CG-NE2 3.49Å; L848-H946 WeakPolarHBondContact CB-O 3.25Å; L848-H946 PolarHBondContact N-O 2.88Å; C859-H946 VanDerWaalsContact SG-CE1 3.58Å; Y862-H946 AromaticContact CE1-CE1 3.86Å; Y862-H946 AromaticContact CE1-NE2 3.57Å; Y862-H946 AromaticContact CZ-NE2 3.57Å; Y862-H946 PolarHBondContact OH-NE2 3.06Å
947	C	94.7	Very high	95.2	Very high	1 Å²	1	16 Å²	16	1%	0.007	12%	0.116	C	C	.	.	S	Bend	trans	-139.8	-135.1	163.6	65.4	0	0	0	0	107.3	G824 L848 G950 R953	G824-C947 WeakPolarHBondContact CA-O 3.49Å; G824-C947 PolarHBondContact N-O 2.81Å; L848-C947 HydrophobicContact CB-CB 4.11Å; L848-C947 WeakPolarHBondContact O-CB 3.48Å; C947-G950 PolarHBondContact SG-N 3.22Å; C947-R953 HydrophobicContact CB-CB 4.1Å
948	S	95.4	Very high	95.4	Very high	0 Å²	0	13.5 Å²	13.5	0%	0	11%	0.107	C	C	.	.	S	Bend	trans	-69.3	-56.3	163.4	-168.2	0	0	0	0	111.3	R780 Y781 G824 K858	R780-S948 WeakPolarHBondContact CD-O 3.44Å; Y781-S948 WeakPolarHBondContact CE2-OG 3.41Å; Y781-S948 PolarHBondContact OH-OG 2.86Å; G824-S948 PolarHBondContact N-O 3.33Å; K858-S948 WeakPolarHBondContact CD-OG 3.45Å; K858-S948 PolarHBondContact O-OG 3.02Å
949	A	95.2	Very high	95.8	Very high	8 Å²	8	9.8 Å²	9.8	7%	0.066	8%	0.084	C	C	.	.	S	Bend	trans	-103.5	-11.7	-173.7	0	0	0	0	0	115	Y781 V784 I951 R986	Y781-A949 HydrophobicContact CD2-CB 3.79Å; Y781-A949 HydrophobicContact CE2-CB 3.7Å; V784-A949 HydrophobicContact CG1-CB 4.33Å; V784-A949 WeakPolarHBondContact CG1-O 3.45Å; V784-A949 HydrophobicContact CG2-CB 4.31Å; A949-I951 HydrophobicContact CB-CD1 4.39Å; A949-I951 HydrophobicContact CB-CG1 3.82Å; A949-R986 PolarHBondContact O-NH2 3.21Å
950	G	97	Very high	96.4	Very high	0 Å²	0	5.9 Å²	5.9	0%	0	4%	0.044	C	C	.	.	S	Bend	trans	72.7	29.2	-178.9	0	0	0	0	0	115	T822 C947 T954 R986	T822-G950 WeakPolarHBondContact O-CA 3.37Å; C947-G950 PolarHBondContact SG-N 3.22Å; G950-T954 WeakPolarHBondContact CA-OG1 3.27Å; G950-R986 WeakPolarHBondContact O-CD 3.45Å; G950-R986 PolarHBondContact O-NE 2.89Å
951	I	97.2	Very high	97	Very high	2 Å²	2	3.6 Å²	3.6	1%	0.01	2%	0.021	C	C	.	.	S	Bend	trans	-135.6	-56.9	-174.5	52	161.3	0	0	0	114.5	V784 A949 G955 R986 A987 M988 M989 V990	V784-I951 HydrophobicContact CB-CD1 4.5Å; V784-I951 HydrophobicContact CG1-CD1 3.83Å; V784-I951 HydrophobicContact CG1-CG1 4.04Å; V784-I951 HydrophobicContact CG1-CG2 3.72Å; V784-I951 HydrophobicContact CG2-CD1 3.8Å; A949-I951 HydrophobicContact CB-CD1 4.39Å; A949-I951 HydrophobicContact CB-CG1 3.82Å; I951-G955 WeakPolarHBondContact O-CA 3.29Å; I951-G955 PolarHBondContact O-N 2.78Å; I951-R986 HydrophobicContact CG2-CG 4.22Å; I951-A987 VanDerWaalsContact CG2-O 3.22Å; I951-A987 WeakPolarHBondContact CG2-O 3.37Å; I951-M988 HydrophobicContact CD1-CB 3.77Å; I951-M988 HydrophobicContact CD1-CE 4.43Å; I951-M989 HydrophobicContact CG2-CG 4.36Å; I951-M989 WeakPolarHBondContact O-CA 3.33Å; I951-V990 PolarHBondContact O-N 2.85Å; I951-V990 VanDerWaalsContact O-N 3.08Å
952	G	94.8	Very high	97.2	Very high	1 Å²	1	1.9 Å²	1.9	1%	0.01	1%	0.013	C	C	.	.	H	α-helix	trans	-69.1	-75.1	-173.8	0	0	0	0	0	112.8	T954 G955 V956 Q995	G952-T954 VanDerWaalsContact C-N 3.32Å; G952-T954 PolarHBondContact O-N 2.91Å; G952-G955 PolarHBondContact O-N 3.4Å; G952-G955 VanDerWaalsContact O-N 3.13Å; G952-V956 PolarHBondContact O-N 3.2Å; G952-Q995 VanDerWaalsContact CA-OE1 3.31Å
953	R	96.1	Very high	97.2	Very high	1 Å²	1	1.1 Å²	1.1	0%	0.004	1%	0.008	C	C	.	.	H	α-helix	trans	-56.4	-44.8	177.5	-58.8	-175.5	-98.5	179.8	5.5	111.6	L848 T849 E853 W914 D916 C947 G955 V956 L957	L848-R953 HydrophobicContact CB-CB 3.93Å; L848-R953 HydrophobicContact CD1-CB 4.25Å; L848-R953 WeakPolarHBondContact CD1-O 3.16Å; L848-R953 VanDerWaalsContact O-CD 3.3Å; L848-R953 WeakPolarHBondContact O-CD 3.14Å; L848-R953 VanDerWaalsContact O-CZ 3.26Å; L848-R953 PolarHBondContact O-NE 3.29Å; L848-R953 PolarHBondContact O-NH1 2.97Å; T849-R953 PolarHBondContact OG1-NH2 3.09Å; T849-R953 VanDerWaalsContact OG1-NH2 3.16Å; E853-R953 IonicContact OE1-CZ 2.71Å; E853-R953 VanDerWaalsContact OE1-CZ 3.3Å; E853-R953 IonicContact OE1-NH1 2.73Å; E853-R953 PolarHBondContact OE1-NH1 2.85Å; E853-R953 IonicContact OE1-NH2 2.73Å; E853-R953 PolarHBondContact OE1-NH2 2.97Å; W914-R953 HydrophobicContact CD2-CB 4.11Å; W914-R953 HydrophobicContact CD2-CG 3.88Å; W914-R953 HydrophobicContact CE3-CB 4.21Å; W914-R953 HydrophobicContact CE3-CG 4.47Å; W914-R953 HydrophobicContact CG-CG 4.26Å; W914-R953 HydrophobicContact CH2-CB 3.9Å; W914-R953 HydrophobicContact CH2-CG 4.48Å; W914-R953 VanDerWaalsContact CH2-O 3.23Å; W914-R953 WeakPolarHBondContact CH2-O 3.31Å; W914-R953 HydrophobicContact CZ2-CB 3.78Å; W914-R953 HydrophobicContact CZ2-CG 3.89Å; W914-R953 HydrophobicContact CZ3-CB 4.1Å; W914-R953 PolarHBondContact O-NH1 2.92Å; D916-R953 IonicContact OD1-CZ 2.61Å; D916-R953 VanDerWaalsContact OD1-CZ 3.25Å; D916-R953 IonicContact OD1-NE 2.68Å; D916-R953 PolarHBondContact OD1-NE 3.02Å; D916-R953 IonicContact OD1-NH2 3.41Å; D916-R953 PolarHBondContact OD1-NH2 2.9Å; D916-R953 IonicContact OD2-NH2 3.39Å; D916-R953 PolarHBondContact OD2-NH2 3.17Å; C947-R953 HydrophobicContact CB-CB 4.1Å; R953-G955 PolarHBondContact O-N 3.07Å; R953-V956 PolarHBondContact O-N 3.14Å; R953-V956 VanDerWaalsContact O-N 3.13Å; R953-L957 PolarHBondContact O-N 3.12Å
954	T	97.9	Very high	97.1	Very high	0 Å²	0	1 Å²	1	0%	0	1%	0.007	C	C	.	.	H	α-helix	trans	-51	-49.5	171.9	-51.7	0	0	0	0	113.2	A821 V945 G950 G952 V956 L957 V958 M989	A821-T954 HydrophobicContact CB-CG2 3.99Å; V945-T954 HydrophobicContact CB-CG2 4.07Å; V945-T954 HydrophobicContact CG1-CG2 3.79Å; G950-T954 WeakPolarHBondContact CA-OG1 3.27Å; G952-T954 VanDerWaalsContact C-N 3.32Å; G952-T954 PolarHBondContact O-N 2.91Å; T954-V956 VanDerWaalsContact C-N 3.32Å; T954-V956 PolarHBondContact O-N 2.92Å; T954-L957 PolarHBondContact O-N 3.34Å; T954-V958 VanDerWaalsContact O-CG2 3.23Å; T954-V958 WeakPolarHBondContact O-CG2 3.03Å; T954-V958 PolarHBondContact O-N 2.81Å; T954-V958 VanDerWaalsContact O-N 3.13Å; T954-M989 HydrophobicContact CG2-CE 4.1Å
955	G	97.9	Very high	96.8	Very high	0 Å²	0	1.1 Å²	1.1	0%	0	1%	0.008	C	C	.	.	H	α-helix	trans	-68.2	-28.7	-179.9	0	0	0	0	0	113.9	I951 G952 R953 T959 M982 V990	I951-G955 WeakPolarHBondContact O-CA 3.29Å; I951-G955 PolarHBondContact O-N 2.78Å; G952-G955 PolarHBondContact O-N 3.4Å; G952-G955 VanDerWaalsContact O-N 3.13Å; R953-G955 PolarHBondContact O-N 3.07Å; G955-T959 VanDerWaalsContact O-CB 3.29Å; G955-T959 WeakPolarHBondContact O-CB 3.33Å; G955-T959 PolarHBondContact O-N 2.8Å; G955-T959 PolarHBondContact O-OG1 2.72Å; G955-M982 WeakPolarHBondContact O-CE 3.39Å; G955-V990 VanDerWaalsContact C-CG2 3.45Å
956	V	97.8	Very high	96.7	Very high	0 Å²	0	2.2 Å²	2.2	0%	0	1%	0.013	C	C	.	.	H	α-helix	trans	-69.6	-43.5	175.4	165.3	0	0	0	0	110.9	W914 F926 G952 R953 T954 T959 M960 V990 Q995 F998 V999	W914-V956 HydrophobicContact CH2-CB 3.67Å; W914-V956 HydrophobicContact CH2-CG1 3.55Å; W914-V956 HydrophobicContact CZ2-CB 3.77Å; W914-V956 HydrophobicContact CZ2-CG1 3.7Å; W914-V956 HydrophobicContact CZ2-CG2 4.31Å; F926-V956 HydrophobicContact CE1-CG1 4.45Å; F926-V956 HydrophobicContact CE2-CG1 4.29Å; F926-V956 HydrophobicContact CZ-CG1 3.79Å; G952-V956 PolarHBondContact O-N 3.2Å; R953-V956 PolarHBondContact O-N 3.14Å; R953-V956 VanDerWaalsContact O-N 3.13Å; T954-V956 VanDerWaalsContact C-N 3.32Å; T954-V956 PolarHBondContact O-N 2.92Å; V956-T959 PolarHBondContact O-N 2.8Å; V956-M960 WeakPolarHBondContact O-CB 3.29Å; V956-M960 PolarHBondContact O-N 2.93Å; V956-V990 HydrophobicContact CG2-CG1 4.32Å; V956-V990 HydrophobicContact CG2-CG2 4.25Å; V956-Q995 HydrophobicContact CG2-CB 3.68Å; V956-Q995 HydrophobicContact CG2-CG 4.13Å; V956-F998 HydrophobicContact CG1-CD1 4.13Å; V956-F998 HydrophobicContact CG1-CE1 4.22Å; V956-V999 HydrophobicContact CG1-CB 4.13Å; V956-V999 HydrophobicContact CG1-CG2 4.25Å
957	L	98.1	Very high	96.5	Very high	0 Å²	0	2.6 Å²	2.6	0%	0	2%	0.015	C	C	.	.	H	α-helix	trans	-59.1	-52	173.8	177.3	63.2	0	0	0	111.4	V846 L848 V930 V945 R953 T954 T959 M960 E961	V846-L957 HydrophobicContact CG1-CD2 3.77Å; L848-L957 HydrophobicContact CD1-CB 3.86Å; L848-L957 HydrophobicContact CD1-CD2 4Å; L848-L957 HydrophobicContact CD2-CD2 4.4Å; V930-L957 HydrophobicContact CB-CD1 4.31Å; V930-L957 HydrophobicContact CG1-CD1 4.29Å; V930-L957 HydrophobicContact CG2-CD1 3.59Å; V945-L957 HydrophobicContact CG1-CD2 3.88Å; V945-L957 HydrophobicContact CG2-CD2 4.42Å; R953-L957 PolarHBondContact O-N 3.12Å; T954-L957 PolarHBondContact O-N 3.34Å; L957-T959 VanDerWaalsContact C-N 3.27Å; L957-T959 PolarHBondContact O-N 2.89Å; L957-M960 PolarHBondContact O-N 2.89Å; L957-E961 WeakPolarHBondContact O-CB 3.38Å; L957-E961 PolarHBondContact O-N 3.33Å
958	V	98.4	Very high	96.4	Very high	1 Å²	1	3.6 Å²	3.6	1%	0.006	2%	0.02	C	C	.	.	H	α-helix	trans	-59.4	-38.6	179.7	177.4	0	0	0	0	111.4	M808 Y819 T954 T962 M982 M989	M808-V958 HydrophobicContact CG-CG1 3.58Å; M808-V958 HydrophobicContact SD-CG1 4.1Å; Y819-V958 HydrophobicContact CD1-CG2 3.66Å; Y819-V958 HydrophobicContact CD2-CG1 4.33Å; Y819-V958 HydrophobicContact CE1-CB 4.15Å; Y819-V958 HydrophobicContact CE1-CG1 4.18Å; Y819-V958 HydrophobicContact CE1-CG2 3.56Å; Y819-V958 HydrophobicContact CE2-CG1 3.89Å; Y819-V958 HydrophobicContact CG-CG2 4.16Å; T954-V958 VanDerWaalsContact O-CG2 3.23Å; T954-V958 WeakPolarHBondContact O-CG2 3.03Å; T954-V958 PolarHBondContact O-N 2.81Å; T954-V958 VanDerWaalsContact O-N 3.13Å; V958-T962 VanDerWaalsContact O-CB 3.29Å; V958-T962 WeakPolarHBondContact O-CB 3.32Å; V958-T962 PolarHBondContact O-N 2.77Å; V958-T962 PolarHBondContact O-OG1 2.79Å; V958-M982 HydrophobicContact CB-SD 3.55Å; V958-M982 VanDerWaalsContact CB-SD 3.55Å; V958-M982 HydrophobicContact CG1-CG 3.95Å; V958-M982 HydrophobicContact CG1-SD 3.36Å; V958-M982 WeakPolarHBondContact CG1-SD 3.44Å; V958-M982 HydrophobicContact CG2-SD 4.43Å; V958-M989 HydrophobicContact CG2-CE 4.11Å
959	T	98.3	Very high	96.1	Very high	0 Å²	0	7.5 Å²	7.5	0%	0	4%	0.035	C	C	.	.	H	α-helix	trans	-65.2	-49.5	175.9	-59	0	0	0	0	111.8	G955 V956 L957 T962 A963 I978 M982 V999 I1003	G955-T959 VanDerWaalsContact O-CB 3.29Å; G955-T959 WeakPolarHBondContact O-CB 3.33Å; G955-T959 PolarHBondContact O-N 2.8Å; G955-T959 PolarHBondContact O-OG1 2.72Å; V956-T959 PolarHBondContact O-N 2.8Å; L957-T959 VanDerWaalsContact C-N 3.27Å; L957-T959 PolarHBondContact O-N 2.89Å; T959-T962 PolarHBondContact O-N 3.27Å; T959-A963 WeakPolarHBondContact O-CB 3.19Å; T959-A963 PolarHBondContact O-N 3.28Å; T959-I978 HydrophobicContact CG2-CG2 3.98Å; T959-M982 WeakPolarHBondContact OG1-CE 3.14Å; T959-V999 HydrophobicContact CG2-CB 4.46Å; T959-V999 HydrophobicContact CG2-CG1 3.8Å; T959-V999 HydrophobicContact CG2-CG2 3.78Å; T959-I1003 HydrophobicContact CG2-CD1 4.17Å
960	M	97.9	Very high	96	Very high	0 Å²	0	12.4 Å²	12.4	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-61.7	-46.6	-178.2	-172.2	67.8	-109.9	0	0	111.4	F926 L927 V930 V956 L957 A963 M964 V999 A1002 I1003 V1006	F926-M960 HydrophobicContact CE1-CB 3.92Å; F926-M960 HydrophobicContact CE1-CG 3.62Å; F926-M960 HydrophobicContact CE1-SD 4.15Å; F926-M960 HydrophobicContact CZ-CB 3.81Å; F926-M960 HydrophobicContact CZ-CG 3.99Å; L927-M960 HydrophobicContact CD2-CE 4.01Å; L927-M960 HydrophobicContact CD2-CG 4.01Å; L927-M960 HydrophobicContact CD2-SD 3.61Å; V930-M960 HydrophobicContact CB-CG 4.47Å; V930-M960 HydrophobicContact CG1-CG 4.19Å; V930-M960 HydrophobicContact CG2-CB 4.33Å; V930-M960 HydrophobicContact CG2-CG 3.95Å; V956-M960 WeakPolarHBondContact O-CB 3.29Å; V956-M960 PolarHBondContact O-N 2.93Å; L957-M960 PolarHBondContact O-N 2.89Å; M960-A963 PolarHBondContact O-N 2.93Å; M960-M964 HydrophobicContact CE-CE 4.21Å; M960-M964 HydrophobicContact CE-CG 3.95Å; M960-M964 HydrophobicContact CG-CE 4.32Å; M960-M964 WeakPolarHBondContact O-CG 3.47Å; M960-M964 PolarHBondContact O-N 2.96Å; M960-V999 HydrophobicContact CB-CG2 3.93Å; M960-V999 HydrophobicContact SD-CG2 4.24Å; M960-A1002 HydrophobicContact SD-CB 3.67Å; M960-I1003 HydrophobicContact CE-CG1 3.75Å; M960-I1003 HydrophobicContact SD-CG1 4.12Å; M960-V1006 HydrophobicContact CE-CB 4.23Å; M960-V1006 HydrophobicContact CE-CG2 3.76Å
961	E	96.9	Very high	95.8	Very high	1 Å²	1	14.2 Å²	14.2	1%	0.005	7%	0.069	C	C	.	.	H	α-helix	trans	-62.6	-46.5	177.7	172.5	169.6	179.9	0	0	112	N817 Y819 V930 R934 R937 L957 A963 M964 C965	N817-E961 PolarHBondContact ND2-OE1 2.97Å; Y819-E961 VanDerWaalsContact OH-CD 3.29Å; Y819-E961 WeakPolarHBondContact OH-CG 3.11Å; Y819-E961 PolarHBondContact OH-OE2 2.77Å; V930-E961 HydrophobicContact CG1-CB 4.14Å; R934-E961 HydrophobicContact CG-CG 3.82Å; R937-E961 VanDerWaalsContact CD-OE1 3.28Å; R937-E961 WeakPolarHBondContact CD-OE1 3.23Å; R937-E961 IonicContact CZ-OE1 3.69Å; R937-E961 IonicContact CZ-OE2 2.8Å; R937-E961 VanDerWaalsContact NE-CD 3.33Å; R937-E961 IonicContact NE-OE1 3.99Å; R937-E961 PolarHBondContact NE-OE1 3.36Å; R937-E961 IonicContact NE-OE2 3.6Å; R937-E961 PolarHBondContact NE-OE2 3.39Å; R937-E961 IonicContact NH2-OE1 2.75Å; R937-E961 PolarHBondContact NH2-OE1 2.74Å; R937-E961 IonicContact NH2-OE2 3.96Å; R937-E961 PolarHBondContact NH2-OE2 2.71Å; L957-E961 WeakPolarHBondContact O-CB 3.38Å; L957-E961 PolarHBondContact O-N 3.33Å; E961-A963 PolarHBondContact O-N 3.1Å; E961-M964 PolarHBondContact O-N 3.43Å; E961-C965 PolarHBondContact O-N 2.95Å; E961-C965 PolarHBondContact O-SG 2.61Å
962	T	96.8	Very high	95.7	Very high	5 Å²	5	15.9 Å²	15.9	3%	0.031	8%	0.08	C	C	.	.	H	α-helix	trans	-59.1	-40.1	177.6	-56.8	0	0	0	0	110.7	M808 V958 T959 C965 L966 I978	M808-T962 HydrophobicContact CB-CG2 4.42Å; M808-T962 HydrophobicContact CE-CG2 4.18Å; V958-T962 VanDerWaalsContact O-CB 3.29Å; V958-T962 WeakPolarHBondContact O-CB 3.32Å; V958-T962 PolarHBondContact O-N 2.77Å; V958-T962 PolarHBondContact O-OG1 2.79Å; T959-T962 PolarHBondContact O-N 3.27Å; T962-C965 PolarHBondContact O-N 2.68Å; T962-L966 HydrophobicContact CG2-CD1 4.33Å; T962-L966 WeakPolarHBondContact O-CG 3.49Å; T962-L966 PolarHBondContact O-N 2.7Å; T962-L966 VanDerWaalsContact O-N 3.16Å; T962-I978 HydrophobicContact CG2-CD1 4.12Å; T962-I978 HydrophobicContact CG2-CG1 4.21Å; T962-I978 HydrophobicContact CG2-CG2 4.2Å
963	A	96.9	Very high	95.8	Very high	0 Å²	0	15.9 Å²	15.9	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-67.4	-41.1	175.9	0	0	0	0	0	113.2	T959 M960 E961 C965 L966 I967 V973 I1003	T959-A963 WeakPolarHBondContact O-CB 3.19Å; T959-A963 PolarHBondContact O-N 3.28Å; M960-A963 PolarHBondContact O-N 2.93Å; E961-A963 PolarHBondContact O-N 3.1Å; A963-C965 VanDerWaalsContact C-N 3.33Å; A963-C965 PolarHBondContact O-N 3.09Å; A963-L966 PolarHBondContact O-N 2.75Å; A963-L966 VanDerWaalsContact O-N 3.16Å; A963-I967 VanDerWaalsContact O-CG1 3.31Å; A963-I967 WeakPolarHBondContact O-CG1 3.28Å; A963-I967 PolarHBondContact O-N 3.46Å; A963-V973 HydrophobicContact CB-CG1 3.69Å; A963-I1003 HydrophobicContact CB-CD1 3.45Å; A963-I1003 VanDerWaalsContact CB-CD1 3.45Å; A963-I1003 HydrophobicContact CB-CG1 3.5Å; A963-I1003 HydrophobicContact CB-CG2 4.36Å
964	M	95.5	Very high	95.8	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-57.2	-46.2	172.5	-71.5	-172.7	177.2	0	0	111.5	L927 V930 K931 M960 E961 L966 I967 E968 V1006 V1012	L927-M964 HydrophobicContact CD2-CE 3.68Å; V930-M964 HydrophobicContact CB-CE 3.97Å; V930-M964 HydrophobicContact CB-SD 4.41Å; V930-M964 HydrophobicContact CG1-CE 3.84Å; V930-M964 HydrophobicContact CG1-SD 3.7Å; K931-M964 HydrophobicContact CG-CE 4.38Å; M960-M964 HydrophobicContact CE-CE 4.21Å; M960-M964 HydrophobicContact CE-CG 3.95Å; M960-M964 HydrophobicContact CG-CE 4.32Å; M960-M964 WeakPolarHBondContact O-CG 3.47Å; M960-M964 PolarHBondContact O-N 2.96Å; E961-M964 PolarHBondContact O-N 3.43Å; M964-L966 PolarHBondContact O-N 3.39Å; M964-I967 PolarHBondContact O-N 2.87Å; M964-E968 WeakPolarHBondContact O-CG 3.49Å; M964-E968 PolarHBondContact O-N 2.91Å; M964-V1006 HydrophobicContact CE-CG2 4.06Å; M964-V1006 HydrophobicContact CG-CG1 4.38Å; M964-V1012 HydrophobicContact CG-CG2 4.19Å; M964-V1012 HydrophobicContact SD-CG2 4.17Å
965	C	93.9	Very high	95.8	Very high	3 Å²	3	19 Å²	19	2%	0.02	9%	0.093	C	C	.	.	H	α-helix	trans	-63.9	-26.6	178	-68.3	0	0	0	0	113.8	I810 R934 E961 T962 A963 R969	I810-C965 HydrophobicContact CD1-CB 3.38Å; R934-C965 PolarHBondContact NH2-SG 3.49Å; E961-C965 PolarHBondContact O-N 2.95Å; E961-C965 PolarHBondContact O-SG 2.61Å; T962-C965 PolarHBondContact O-N 2.68Å; A963-C965 VanDerWaalsContact C-N 3.33Å; A963-C965 PolarHBondContact O-N 3.09Å; C965-R969 WeakPolarHBondContact O-CD 3.16Å; C965-R969 PolarHBondContact O-NH1 3.18Å
966	L	94.8	Very high	95.6	Very high	23 Å²	23	20.6 Å²	20.6	12%	0.12	10%	0.101	C	C	.	.	H	α-helix	trans	-78.5	-45.6	174.1	-70.5	166.6	0	0	0	111.4	I810 T962 A963 M964 E968 R969 N970 L971 V973 I978	I810-L966 HydrophobicContact CD1-CD2 4.39Å; I810-L966 HydrophobicContact CD1-CG 4.34Å; I810-L966 HydrophobicContact CG1-CD2 4.33Å; I810-L966 HydrophobicContact CG2-CD2 3.85Å; T962-L966 HydrophobicContact CG2-CD1 4.33Å; T962-L966 WeakPolarHBondContact O-CG 3.49Å; T962-L966 PolarHBondContact O-N 2.7Å; T962-L966 VanDerWaalsContact O-N 3.16Å; A963-L966 PolarHBondContact O-N 2.75Å; A963-L966 VanDerWaalsContact O-N 3.16Å; M964-L966 PolarHBondContact O-N 3.39Å; L966-E968 PolarHBondContact O-N 3.35Å; L966-R969 CarbonylContact O-C 3.42Å; L966-R969 PolarHBondContact O-N 2.87Å; L966-N970 PolarHBondContact O-N 2.68Å; L966-L971 HydrophobicContact CB-CB 4.22Å; L966-L971 HydrophobicContact CD2-CB 3.72Å; L966-L971 HydrophobicContact CD2-CD1 3.85Å; L966-L971 HydrophobicContact CD2-CG 4.45Å; L966-L971 PolarHBondContact O-N 3.43Å; L966-V973 HydrophobicContact CB-CG2 3.83Å; L966-V973 HydrophobicContact CD1-CG1 4.33Å; L966-V973 HydrophobicContact CD1-CG2 4.3Å; L966-I978 HydrophobicContact CD1-CD1 4.02Å
967	I	94.5	Very high	95.6	Very high	8 Å²	8	23.4 Å²	23.4	4%	0.041	12%	0.116	C	C	.	.	H	α-helix	trans	-58.5	-45.6	177.8	-69.4	166	0	0	0	111	L735 A963 M964 R969 N970 V973 I1003 V1006	L735-I967 HydrophobicContact CD1-CG1 4Å; L735-I967 HydrophobicContact CD2-CG2 4.33Å; A963-I967 VanDerWaalsContact O-CG1 3.31Å; A963-I967 WeakPolarHBondContact O-CG1 3.28Å; A963-I967 PolarHBondContact O-N 3.46Å; M964-I967 PolarHBondContact O-N 2.87Å; I967-R969 PolarHBondContact O-N 2.92Å; I967-N970 PolarHBondContact O-N 2.84Å; I967-N970 VanDerWaalsContact O-N 3.12Å; I967-V973 HydrophobicContact CG1-CG2 3.92Å; I967-I1003 HydrophobicContact CD1-CG2 4.46Å; I967-V1006 HydrophobicContact CD1-CB 4.43Å; I967-V1006 HydrophobicContact CD1-CG1 3.88Å
968	E	92.2	Very high	95.6	Very high	23 Å²	23	23.9 Å²	23.9	11%	0.107	12%	0.119	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50.2	-29.5	173.8	-82.7	171.9	-179.3	0	0	114.4	R934 M964 L966 V1012 T1014 L1015	R934-E968 IonicContact CZ-OE1 3.87Å; R934-E968 IonicContact CZ-OE2 2.81Å; R934-E968 IonicContact NH1-OE1 2.97Å; R934-E968 PolarHBondContact NH1-OE1 2.89Å; R934-E968 IonicContact NH2-OE1 3.35Å; R934-E968 PolarHBondContact NH2-OE1 2.92Å; R934-E968 IonicContact NH2-OE2 3.34Å; R934-E968 PolarHBondContact NH2-OE2 2.79Å; M964-E968 WeakPolarHBondContact O-CG 3.49Å; M964-E968 PolarHBondContact O-N 2.91Å; L966-E968 PolarHBondContact O-N 3.35Å; E968-V1012 HydrophobicContact CG-CB 4.46Å; E968-V1012 HydrophobicContact CG-CG1 3.34Å; E968-V1012 WeakPolarHBondContact OE1-CG1 3.26Å; E968-T1014 WeakPolarHBondContact O-CA 3.09Å; E968-L1015 HydrophobicContact CB-CD1 4.38Å; E968-L1015 HydrophobicContact CB-CG 4.49Å; E968-L1015 PolarHBondContact O-N 2.73Å
969	R	91	Very high	95.5	Very high	81 Å²	81	23.9 Å²	23.9	31%	0.306	12%	0.118	S	C	.	.	T	Hydrogen-bonded Turn	trans	-112.2	13.7	-170.8	-65.6	170.8	-176.2	67	11.3	111.9	C965 L966 I967 L971 L1015	C965-R969 WeakPolarHBondContact O-CD 3.16Å; C965-R969 PolarHBondContact O-NH1 3.18Å; L966-R969 CarbonylContact O-C 3.42Å; L966-R969 PolarHBondContact O-N 2.87Å; I967-R969 PolarHBondContact O-N 2.92Å; R969-L971 HydrophobicContact CB-CD1 3.95Å; R969-L971 HydrophobicContact CB-CG 3.97Å; R969-L971 PolarHBondContact O-N 2.84Å; R969-L1015 HydrophobicContact CG-CD1 4.17Å
970	N	92.1	Very high	95.5	Very high	111 Å²	111	27.7 Å²	27.7	59%	0.594	13%	0.133	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.2	28.6	-176.7	-159.8	23.4	0	0	0	113.8	L735 L966 I967	L735-N970 WeakPolarHBondContact CB-OD1 3.37Å; L966-N970 PolarHBondContact O-N 2.68Å; I967-N970 PolarHBondContact O-N 2.84Å; I967-N970 VanDerWaalsContact O-N 3.12Å
971	L	93.2	Very high	95.5	Very high	39 Å²	39	31.3 Å²	31.3	20%	0.204	15%	0.149	C	C	.	.			trans	-92.7	143.3	-178.1	-63.3	174.3	0	0	0	111.1	I810 A812 L966 R969	I810-L971 HydrophobicContact CG2-CD1 3.72Å; A812-L971 HydrophobicContact CB-CD1 4.04Å; A812-L971 HydrophobicContact CB-CD2 3.99Å; L966-L971 HydrophobicContact CB-CB 4.22Å; L966-L971 HydrophobicContact CD2-CB 3.72Å; L966-L971 HydrophobicContact CD2-CD1 3.85Å; L966-L971 HydrophobicContact CD2-CG 4.45Å; L966-L971 PolarHBondContact O-N 3.43Å; R969-L971 HydrophobicContact CB-CD1 3.95Å; R969-L971 HydrophobicContact CB-CG 3.97Å; R969-L971 PolarHBondContact O-N 2.84Å
972	P	95	Very high	95.6	Very high	36 Å²	36	31.3 Å²	31.3	23%	0.234	15%	0.149	C	C	.	.			trans	-64.4	138.5	-179.7	27.2	-35.4	0	0	0	112.4	D733 S738 Y974	D733-P972 WeakPolarHBondContact O-CD 3.33Å; D733-P972 WeakPolarHBondContact O-CG 3.37Å; S738-P972 WeakPolarHBondContact OG-CA 3.46Å; P972-Y974 HydrophobicContact CB-CD2 4.43Å; P972-Y974 HydrophobicContact CB-CE2 3.83Å; P972-Y974 HydrophobicContact CG-CE2 4.31Å
973	V	96.3	Very high	95.7	Very high	1 Å²	1	31.4 Å²	31.4	1%	0.006	15%	0.148	C	C	.	.			trans	-108.1	118.3	-178.2	-170	0	0	0	0	110.2	L735 S738 M739 A963 L966 I967 P975 I978 I1003	L735-V973 HydrophobicContact CD1-CG2 3.96Å; S738-V973 PolarHBondContact OG-N 2.87Å; M739-V973 HydrophobicContact CE-CB 3.61Å; M739-V973 HydrophobicContact CE-CG1 4.46Å; M739-V973 HydrophobicContact CE-CG2 3.93Å; A963-V973 HydrophobicContact CB-CG1 3.69Å; L966-V973 HydrophobicContact CB-CG2 3.83Å; L966-V973 HydrophobicContact CD1-CG1 4.33Å; L966-V973 HydrophobicContact CD1-CG2 4.3Å; I967-V973 HydrophobicContact CG1-CG2 3.92Å; V973-P975 HydrophobicContact CG1-CG 4.44Å; V973-P975 WeakPolarHBondContact O-CD 3.36Å; V973-I978 HydrophobicContact CG1-CD1 3.85Å; V973-I1003 HydrophobicContact CG1-CD1 4.36Å; V973-I1003 HydrophobicContact CG1-CG2 4.14Å
974	Y	96.7	Very high	95.7	Very high	62 Å²	62	32.7 Å²	32.7	24%	0.243	16%	0.156	C	C	.	.			trans	-117.1	91.6	175.3	-68.3	-72.2	0	0	0	110.3	G732 L741 P972 L976 D977 I978	G732-Y974 PolarHBondContact O-OH 3.32Å; L741-Y974 HydrophobicContact CD2-CE1 4.03Å; P972-Y974 HydrophobicContact CB-CD2 4.43Å; P972-Y974 HydrophobicContact CB-CE2 3.83Å; P972-Y974 HydrophobicContact CG-CE2 4.31Å; Y974-L976 PolarHBondContact O-N 3.41Å; Y974-L976 VanDerWaalsContact O-N 3.13Å; Y974-D977 PolarHBondContact O-N 3.13Å; Y974-I978 WeakPolarHBondContact O-CG1 3.04Å; Y974-I978 PolarHBondContact O-N 2.82Å
975	P	97	Very high	95.9	Very high	5 Å²	5	34.4 Å²	34.4	3%	0.032	16%	0.163	C	C	.	.	H	α-helix	trans	-57.4	-31	-175.1	-27.5	36.3	0	0	0	113.9	L742 V973 I978 V979 Y996 I1003	L742-P975 HydrophobicContact CD1-CG 3.96Å; L742-P975 HydrophobicContact CD2-CG 3.99Å; V973-P975 HydrophobicContact CG1-CG 4.44Å; V973-P975 WeakPolarHBondContact O-CD 3.36Å; P975-I978 PolarHBondContact O-N 2.98Å; P975-V979 WeakPolarHBondContact O-CG2 3.31Å; P975-V979 PolarHBondContact O-N 3.25Å; P975-Y996 HydrophobicContact CB-CE2 3.96Å; P975-I1003 HydrophobicContact CB-CD1 4.47Å; P975-I1003 HydrophobicContact CG-CD1 3.96Å
976	L	95.5	Very high	96.1	Very high	33 Å²	33	34.3 Å²	34.3	17%	0.173	16%	0.163	C	C	.	.	H	α-helix	trans	-64.8	-42.6	177.2	-166.8	72.2	0	0	0	111.7	Q754 F755 L758 Y974 V979 R980 Y996	Q754-L976 HydrophobicContact CB-CD1 4.17Å; Q754-L976 HydrophobicContact CB-CD2 3.88Å; F755-L976 HydrophobicContact CB-CD1 4.17Å; L758-L976 HydrophobicContact CB-CD1 4.2Å; L758-L976 HydrophobicContact CD2-CD1 4Å; L758-L976 HydrophobicContact CD2-CG 4.46Å; Y974-L976 PolarHBondContact O-N 3.41Å; Y974-L976 VanDerWaalsContact O-N 3.13Å; L976-V979 PolarHBondContact O-N 3Å; L976-R980 WeakPolarHBondContact O-CB 3.36Å; L976-R980 PolarHBondContact O-N 2.62Å; L976-Y996 WeakPolarHBondContact CA-OH 3.14Å; L976-Y996 WeakPolarHBondContact CB-OH 3.3Å; L976-Y996 PolarHBondContact N-OH 3.36Å; L976-Y996 VanDerWaalsContact N-OH 3.08Å
977	D	96.1	Very high	96.1	Very high	60 Å²	60	33.7 Å²	33.7	32%	0.321	16%	0.161	S	C	.	.	H	α-helix	trans	-73.3	-31.9	177	-78.5	-66.7	0	0	0	112.8	Y974 R980 K981	Y974-D977 PolarHBondContact O-N 3.13Å; D977-R980 PolarHBondContact O-N 2.71Å; D977-R980 IonicContact OD1-CZ 2.88Å; D977-R980 IonicContact OD1-NE 3.14Å; D977-R980 PolarHBondContact OD1-NE 3.41Å; D977-R980 IonicContact OD1-NH2 3.95Å; D977-R980 PolarHBondContact OD1-NH2 3.12Å; D977-K981 WeakPolarHBondContact O-CB 3.26Å; D977-K981 WeakPolarHBondContact O-CG 3.32Å; D977-K981 PolarHBondContact O-N 3.37Å
978	I	98.1	Very high	96.1	Very high	10 Å²	10	35.1 Å²	35.1	5%	0.051	17%	0.168	C	C	.	.	H	α-helix	trans	-62.6	-47.7	170.9	-64.2	171.6	0	0	0	109.6	M808 T959 T962 L966 V973 Y974 P975 R980 K981 M982	M808-I978 HydrophobicContact CE-CG2 3.74Å; T959-I978 HydrophobicContact CG2-CG2 3.98Å; T962-I978 HydrophobicContact CG2-CD1 4.12Å; T962-I978 HydrophobicContact CG2-CG1 4.21Å; T962-I978 HydrophobicContact CG2-CG2 4.2Å; L966-I978 HydrophobicContact CD1-CD1 4.02Å; V973-I978 HydrophobicContact CG1-CD1 3.85Å; Y974-I978 WeakPolarHBondContact O-CG1 3.04Å; Y974-I978 PolarHBondContact O-N 2.82Å; P975-I978 PolarHBondContact O-N 2.98Å; I978-R980 VanDerWaalsContact C-N 3.34Å; I978-R980 PolarHBondContact O-N 3.46Å; I978-K981 PolarHBondContact O-N 3.16Å; I978-M982 WeakPolarHBondContact O-CG 3.41Å; I978-M982 PolarHBondContact O-N 2.86Å
979	V	98.1	Very high	96.4	Very high	0 Å²	0	34 Å²	34	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-64.1	-37.1	174.3	175.4	0	0	0	0	112	F755 L758 P975 L976 M982 R983 V990 Y996	F755-V979 HydrophobicContact CD2-CG1 4.42Å; F755-V979 HydrophobicContact CE2-CG1 4.21Å; L758-V979 HydrophobicContact CD2-CB 4.16Å; L758-V979 HydrophobicContact CD2-CG1 3.74Å; P975-V979 WeakPolarHBondContact O-CG2 3.31Å; P975-V979 PolarHBondContact O-N 3.25Å; L976-V979 PolarHBondContact O-N 3Å; V979-M982 HydrophobicContact CB-CE 4.28Å; V979-M982 HydrophobicContact CG2-CE 3.89Å; V979-M982 PolarHBondContact O-N 3.2Å; V979-R983 HydrophobicContact CG1-CG 4.21Å; V979-R983 WeakPolarHBondContact O-CB 3.3Å; V979-R983 WeakPolarHBondContact O-CG 3.38Å; V979-R983 PolarHBondContact O-N 3.24Å; V979-V990 HydrophobicContact CG1-CB 4.38Å; V979-V990 HydrophobicContact CG2-CB 4.19Å; V979-V990 HydrophobicContact CG2-CG2 3.83Å; V979-Y996 HydrophobicContact CG2-CD2 3.96Å; V979-Y996 HydrophobicContact CG2-CE2 3.86Å
980	R	97.6	Very high	96.6	Very high	80 Å²	80	30.1 Å²	30.1	30%	0.302	15%	0.148	S	C	.	.	H	α-helix	trans	-62.9	-50.7	175	-171.2	178.1	60.4	74.7	-7.3	112	L758 Y759 L976 D977 I978 M982 R983 D984	L758-R980 HydrophobicContact CD1-CB 4.14Å; L758-R980 HydrophobicContact CD1-CG 4.07Å; L758-R980 HydrophobicContact CD2-CB 4.34Å; Y759-R980 HydrophobicContact CE1-CG 4.5Å; Y759-R980 WeakPolarHBondContact OH-CG 3.21Å; L976-R980 WeakPolarHBondContact O-CB 3.36Å; L976-R980 PolarHBondContact O-N 2.62Å; D977-R980 PolarHBondContact O-N 2.71Å; D977-R980 IonicContact OD1-CZ 2.88Å; D977-R980 IonicContact OD1-NE 3.14Å; D977-R980 PolarHBondContact OD1-NE 3.41Å; D977-R980 IonicContact OD1-NH2 3.95Å; D977-R980 PolarHBondContact OD1-NH2 3.12Å; I978-R980 VanDerWaalsContact C-N 3.34Å; I978-R980 PolarHBondContact O-N 3.46Å; R980-M982 PolarHBondContact O-N 2.81Å; R980-R983 PolarHBondContact O-N 3.48Å; R980-R983 VanDerWaalsContact O-N 3.15Å; R980-D984 PolarHBondContact O-N 2.92Å
981	K	97.8	Very high	96.5	Very high	77 Å²	77	27.3 Å²	27.3	34%	0.335	13%	0.131	S	C	.	.	H	α-helix	trans	-56.8	-35.7	175.2	-78.3	-178.2	172.9	-172	0	112.5	M808 E809 D977 I978 Q985	M808-K981 HydrophobicContact CE-CB 4.14Å; E809-K981 PolarHBondContact O-NZ 3.05Å; E809-K981 VanDerWaalsContact O-NZ 3.11Å; D977-K981 WeakPolarHBondContact O-CB 3.26Å; D977-K981 WeakPolarHBondContact O-CG 3.32Å; D977-K981 PolarHBondContact O-N 3.37Å; I978-K981 PolarHBondContact O-N 3.16Å; K981-Q985 PolarHBondContact O-NE2 2.68Å
982	M	98.5	Very high	96.3	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-70.7	-48.7	172.6	-76.4	-166.8	-60.5	0	0	112.8	V806 M808 G955 V958 T959 I978 V979 R980 D984 Q985 R986 M989 V990	V806-M982 HydrophobicContact CG1-CG 4.19Å; M808-M982 HydrophobicContact CE-CG 3.85Å; M808-M982 HydrophobicContact SD-CG 3.61Å; G955-M982 WeakPolarHBondContact O-CE 3.39Å; V958-M982 HydrophobicContact CB-SD 3.55Å; V958-M982 VanDerWaalsContact CB-SD 3.55Å; V958-M982 HydrophobicContact CG1-CG 3.95Å; V958-M982 HydrophobicContact CG1-SD 3.36Å; V958-M982 WeakPolarHBondContact CG1-SD 3.44Å; V958-M982 HydrophobicContact CG2-SD 4.43Å; T959-M982 WeakPolarHBondContact OG1-CE 3.14Å; I978-M982 WeakPolarHBondContact O-CG 3.41Å; I978-M982 PolarHBondContact O-N 2.86Å; V979-M982 HydrophobicContact CB-CE 4.28Å; V979-M982 HydrophobicContact CG2-CE 3.89Å; V979-M982 PolarHBondContact O-N 3.2Å; R980-M982 PolarHBondContact O-N 2.81Å; M982-D984 PolarHBondContact O-N 3.24Å; M982-Q985 WeakPolarHBondContact O-CA 3.41Å; M982-Q985 PolarHBondContact O-N 2.97Å; M982-R986 PolarHBondContact O-N 2.72Å; M982-M989 HydrophobicContact CB-CB 3.98Å; M982-M989 HydrophobicContact CB-CE 4.38Å; M982-M989 HydrophobicContact CB-CG 4.49Å; M982-M989 HydrophobicContact CB-SD 3.76Å; M982-M989 HydrophobicContact CE-CB 4.32Å; M982-M989 HydrophobicContact CG-CE 4.21Å; M982-M989 HydrophobicContact CG-SD 4.19Å; M982-M989 HydrophobicContact SD-CB 4.32Å; M982-M989 HydrophobicContact SD-CE 3.57Å; M982-M989 VanDerWaalsContact SD-CE 3.57Å; M982-M989 HydrophobicContact SD-SD 4.18Å; M982-V990 HydrophobicContact CE-CG2 3.9Å
983	R	98.3	Very high	95.8	Very high	7 Å²	7	26.6 Å²	26.6	3%	0.026	13%	0.129	C	C	.	.	H	α-helix	trans	-65.7	-20.9	-178.1	-73.6	-173.2	-175.7	171.3	4.6	113.5	F755 L758 Y759 Y787 V979 R980 Q985 R986 M989 V990	F755-R983 VanDerWaalsContact CZ-NH2 3.31Å; L758-R983 PolarHBondContact O-NH1 2.9Å; Y759-R983 HydrophobicContact CE2-CB 4.48Å; Y759-R983 WeakPolarHBondContact O-CD 3.44Å; Y759-R983 PolarHBondContact O-NH1 2.93Å; Y787-R983 WeakPolarHBondContact CE2-O 3.36Å; Y787-R983 PolarHBondContact OH-O 3.46Å; V979-R983 HydrophobicContact CG1-CG 4.21Å; V979-R983 WeakPolarHBondContact O-CB 3.3Å; V979-R983 WeakPolarHBondContact O-CG 3.38Å; V979-R983 PolarHBondContact O-N 3.24Å; R980-R983 PolarHBondContact O-N 3.48Å; R980-R983 VanDerWaalsContact O-N 3.15Å; R983-Q985 VanDerWaalsContact C-N 3.26Å; R983-R986 WeakPolarHBondContact CA-O 3.45Å; R983-M989 HydrophobicContact CG-CB 4.45Å; R983-M989 PolarHBondContact NE-O 3Å; R983-V990 PolarHBondContact NH2-O 2.8Å
984	D	98.1	Very high	95.5	Very high	28 Å²	28	29 Å²	29	15%	0.15	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-20	167.6	-82.8	-1.7	0	0	0	114.1	Y759 K762 L765 R980 M982	Y759-D984 PolarHBondContact OH-OD1 3.12Å; K762-D984 HydrophobicContact CD-CB 4.22Å; K762-D984 WeakPolarHBondContact CD-OD1 3.42Å; K762-D984 WeakPolarHBondContact CE-OD1 3.31Å; K762-D984 WeakPolarHBondContact CE-OD2 3.24Å; K762-D984 VanDerWaalsContact CG-OD1 3.24Å; K762-D984 WeakPolarHBondContact CG-OD1 3.24Å; K762-D984 IonicContact NZ-OD1 2.78Å; K762-D984 PolarHBondContact NZ-OD1 3.05Å; K762-D984 IonicContact NZ-OD2 2.76Å; K762-D984 PolarHBondContact NZ-OD2 2.59Å; L765-D984 WeakPolarHBondContact CD1-O 3.42Å; R980-D984 PolarHBondContact O-N 2.92Å; M982-D984 PolarHBondContact O-N 3.24Å
985	Q	98.5	Very high	95.3	Very high	35 Å²	35	26 Å²	26	16%	0.164	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	-116	-31.1	-173.6	-64.8	179	84.3	0	0	113.4	Y787 T790 V806 N807 K981 M982 R983	Y787-Q985 WeakPolarHBondContact CD2-O 3.09Å; T790-Q985 WeakPolarHBondContact CB-O 3.42Å; T790-Q985 HydrophobicContact CG2-CB 4.47Å; T790-Q985 PolarHBondContact OG1-O 3.23Å; V806-Q985 HydrophobicContact CB-CB 4.47Å; V806-Q985 HydrophobicContact CG1-CB 4.36Å; V806-Q985 HydrophobicContact CG2-CB 4.17Å; N807-Q985 PolarHBondContact O-NE2 3.32Å; N807-Q985 PolarHBondContact O-OE1 3.26Å; K981-Q985 PolarHBondContact O-NE2 2.68Å; M982-Q985 WeakPolarHBondContact O-CA 3.41Å; M982-Q985 PolarHBondContact O-N 2.97Å; R983-Q985 VanDerWaalsContact C-N 3.26Å
986	R	98.4	Very high	95.2	Very high	1 Å²	1	25.9 Å²	25.9	0%	0.004	13%	0.133	C	C	.	.	S	Bend	trans	-143.8	124.1	163.3	-174.6	175.7	174.5	80.5	-1.1	109.3	N802 S804 V806 A821 A949 G950 I951 M982 R983 M989	N802-R986 PolarHBondContact OD1-NH1 3.4Å; N802-R986 VanDerWaalsContact OD1-NH1 3.08Å; N802-R986 PolarHBondContact OD1-NH2 3.26Å; S804-R986 PolarHBondContact OG-NH1 2.78Å; V806-R986 HydrophobicContact CG2-CB 3.96Å; A821-R986 WeakPolarHBondContact O-CD 3.13Å; A821-R986 PolarHBondContact O-NE 2.94Å; A821-R986 PolarHBondContact O-NH1 3.34Å; A949-R986 PolarHBondContact O-NH2 3.21Å; G950-R986 WeakPolarHBondContact O-CD 3.45Å; G950-R986 PolarHBondContact O-NE 2.89Å; I951-R986 HydrophobicContact CG2-CG 4.22Å; M982-R986 PolarHBondContact O-N 2.72Å; R983-R986 WeakPolarHBondContact CA-O 3.45Å; R986-M989 HydrophobicContact CB-CG 4.18Å; R986-M989 HydrophobicContact CB-SD 3.8Å; R986-M989 WeakPolarHBondContact O-CG 3.29Å
987	A	96.2	Very high	95.1	Very high	11 Å²	11	27.9 Å²	27.9	9%	0.091	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.4	149.7	-176.1	0	0	0	0	0	112.3	K761 Y787 I951 M989	K761-A987 HydrophobicContact CB-CB 4.17Å; K761-A987 HydrophobicContact CG-CB 4.07Å; Y787-A987 HydrophobicContact CE1-CB 4.43Å; Y787-A987 HydrophobicContact CE2-CB 4.4Å; I951-A987 VanDerWaalsContact CG2-O 3.22Å; I951-A987 WeakPolarHBondContact CG2-O 3.37Å; A987-M989 PolarHBondContact O-N 2.82Å; A987-M989 VanDerWaalsContact O-N 3.16Å
988	M	94.5	Very high	95	Very high	37 Å²	37	25.9 Å²	25.9	18%	0.182	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	63.1	15	171	-53.2	-170.9	-73.1	0	0	116.8	R760 D783 V784 I951 V990	R760-M988 HydrophobicContact CB-CG 4.03Å; R760-M988 WeakPolarHBondContact O-CA 3.16Å; R760-M988 WeakPolarHBondContact O-CG 3.28Å; R760-M988 PolarHBondContact O-N 3.45Å; D783-M988 WeakPolarHBondContact O-CE 3.29Å; V784-M988 HydrophobicContact CB-CE 4.4Å; V784-M988 HydrophobicContact CG2-CE 3.89Å; I951-M988 HydrophobicContact CD1-CB 3.77Å; I951-M988 HydrophobicContact CD1-CE 4.43Å; M988-V990 PolarHBondContact O-N 3.19Å
989	M	97.9	Very high	95	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	13%	0.127	C	C	.	.			trans	-57.1	136.3	169.9	-70.5	-178	84.7	0	0	111.4	V806 A821 I951 T954 V958 M982 R983 R986 A987	V806-M989 HydrophobicContact CG1-CE 4.27Å; V806-M989 HydrophobicContact CG1-SD 4.16Å; V806-M989 HydrophobicContact CG2-CE 4.31Å; V806-M989 HydrophobicContact CG2-SD 3.83Å; A821-M989 HydrophobicContact CB-CE 4.31Å; I951-M989 HydrophobicContact CG2-CG 4.36Å; I951-M989 WeakPolarHBondContact O-CA 3.33Å; T954-M989 HydrophobicContact CG2-CE 4.1Å; V958-M989 HydrophobicContact CG2-CE 4.11Å; M982-M989 HydrophobicContact CB-CB 3.98Å; M982-M989 HydrophobicContact CB-CE 4.38Å; M982-M989 HydrophobicContact CB-CG 4.49Å; M982-M989 HydrophobicContact CB-SD 3.76Å; M982-M989 HydrophobicContact CE-CB 4.32Å; M982-M989 HydrophobicContact CG-CE 4.21Å; M982-M989 HydrophobicContact CG-SD 4.19Å; M982-M989 HydrophobicContact SD-CB 4.32Å; M982-M989 HydrophobicContact SD-CE 3.57Å; M982-M989 VanDerWaalsContact SD-CE 3.57Å; M982-M989 HydrophobicContact SD-SD 4.18Å; R983-M989 HydrophobicContact CG-CB 4.45Å; R983-M989 PolarHBondContact NE-O 3Å; R986-M989 HydrophobicContact CB-CG 4.18Å; R986-M989 HydrophobicContact CB-SD 3.8Å; R986-M989 WeakPolarHBondContact O-CG 3.29Å; A987-M989 PolarHBondContact O-N 2.82Å; A987-M989 VanDerWaalsContact O-N 3.16Å
990	V	95.7	Very high	94.9	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	13%	0.127	C	C	.	.	S	Bend	trans	54.6	102.8	-159.5	-171.7	0	0	0	0	111.2	F755 I951 G955 V956 V979 M982 R983 M988 Q995 Y996	F755-V990 HydrophobicContact CE2-CB 4.05Å; F755-V990 HydrophobicContact CE2-CG1 3.69Å; F755-V990 HydrophobicContact CZ-CB 4.45Å; F755-V990 HydrophobicContact CZ-CG1 3.86Å; F755-V990 WeakPolarHBondContact CZ-O 3.47Å; I951-V990 PolarHBondContact O-N 2.85Å; I951-V990 VanDerWaalsContact O-N 3.08Å; G955-V990 VanDerWaalsContact C-CG2 3.45Å; V956-V990 HydrophobicContact CG2-CG1 4.32Å; V956-V990 HydrophobicContact CG2-CG2 4.25Å; V979-V990 HydrophobicContact CG1-CB 4.38Å; V979-V990 HydrophobicContact CG2-CB 4.19Å; V979-V990 HydrophobicContact CG2-CG2 3.83Å; M982-V990 HydrophobicContact CE-CG2 3.9Å; R983-V990 PolarHBondContact NH2-O 2.8Å; M988-V990 PolarHBondContact O-N 3.19Å; V990-Q995 HydrophobicContact CG1-CB 4Å; V990-Y996 HydrophobicContact CG1-CD2 4.33Å
991	Q	90	Very high	94.8	Very high	52 Å²	52	25.6 Å²	25.6	24%	0.243	13%	0.131	C	C	.	.			trans	-91	-34	-163.5	-169	-171.8	-1.9	0	0	113.4	H917 Q995	H917-Q991 PolarHBondContact ND1-OE1 2.96Å; Q991-Q995 VanDerWaalsContact N-OE1 3.12Å
992	T	87.7	Confident	94.7	Very high	25 Å²	25	22.1 Å²	22.1	15%	0.153	12%	0.117	C	C	.	.	S	Bend	trans	-124.6	152.6	-170.9	60.7	0	0	0	0	112.9	H917 S994 Q995 Y996	H917-T992 HydrophobicContact CB-CG2 4.18Å; H917-T992 PolarHBondContact O-OG1 2.9Å; T992-S994 PolarHBondContact O-N 3.01Å; T992-S994 PolarHBondContact OG1-OG 3.21Å; T992-Q995 WeakPolarHBondContact O-CB 3.46Å; T992-Q995 PolarHBondContact O-N 2.69Å; T992-Q995 VanDerWaalsContact O-N 3.16Å; T992-Q995 WeakPolarHBondContact OG1-CB 3.37Å; T992-Q995 VanDerWaalsContact OG1-CG 3.25Å; T992-Q995 WeakPolarHBondContact OG1-CG 3.5Å; T992-Q995 PolarHBondContact OG1-N 3.11Å; T992-Y996 PolarHBondContact O-N 3.43Å
993	S	86.1	Confident	94.6	Very high	34 Å²	34	22.1 Å²	22.1	24%	0.238	12%	0.117	C	C	.	.	H	α-helix	trans	-63.1	-25	175.8	-41.9	0	0	0	0	112.4	E756 K997	E756-S993 WeakPolarHBondContact CG-OG 3.48Å; E756-S993 PolarHBondContact OE1-OG 2.83Å; S993-K997 VanDerWaalsContact O-CB 3.22Å; S993-K997 WeakPolarHBondContact O-CB 3.28Å; S993-K997 PolarHBondContact O-N 2.72Å
994	S	89.6	Confident	94.5	Very high	51 Å²	51	22.6 Å²	22.6	36%	0.357	12%	0.119	S	C	.	.	H	α-helix	trans	-69.6	-45.1	171.7	49.4	0	0	0	0	112.6	T992 Y996 K997 F998	T992-S994 PolarHBondContact O-N 3.01Å; T992-S994 PolarHBondContact OG1-OG 3.21Å; S994-Y996 VanDerWaalsContact C-N 3.34Å; S994-Y996 PolarHBondContact O-N 2.91Å; S994-K997 PolarHBondContact O-N 3.04Å; S994-F998 WeakPolarHBondContact O-CB 3.4Å; S994-F998 PolarHBondContact O-N 3.41Å
995	Q	92.8	Very high	94.3	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-60.5	-43.3	174.1	-80.2	172.3	-1	0	0	111.9	G918 G952 V956 V990 Q991 T992 V999	G918-Q995 VanDerWaalsContact O-CG 3.26Å; G918-Q995 WeakPolarHBondContact O-CG 3.48Å; G918-Q995 PolarHBondContact O-NE2 3.02Å; G918-Q995 VanDerWaalsContact O-NE2 3.17Å; G952-Q995 VanDerWaalsContact CA-OE1 3.31Å; V956-Q995 HydrophobicContact CG2-CB 3.68Å; V956-Q995 HydrophobicContact CG2-CG 4.13Å; V990-Q995 HydrophobicContact CG1-CB 4Å; Q991-Q995 VanDerWaalsContact N-OE1 3.12Å; T992-Q995 WeakPolarHBondContact O-CB 3.46Å; T992-Q995 PolarHBondContact O-N 2.69Å; T992-Q995 VanDerWaalsContact O-N 3.16Å; T992-Q995 WeakPolarHBondContact OG1-CB 3.37Å; T992-Q995 VanDerWaalsContact OG1-CG 3.25Å; T992-Q995 WeakPolarHBondContact OG1-CG 3.5Å; T992-Q995 PolarHBondContact OG1-N 3.11Å; Q995-V999 PolarHBondContact O-N 3.43Å; Q995-V999 VanDerWaalsContact O-N 3.13Å
996	Y	94.3	Very high	94.1	Very high	3 Å²	3	22.9 Å²	22.9	1%	0.012	12%	0.117	C	C	.	.	H	α-helix	trans	-68.8	-42.6	178	-173.9	-109.7	0	0	0	112.7	V751 F755 P975 L976 V979 V990 T992 S994 V999 C1000	V751-Y996 HydrophobicContact CG1-CD1 4.37Å; V751-Y996 HydrophobicContact CG1-CE1 3.47Å; V751-Y996 VanDerWaalsContact CG1-CE1 3.47Å; V751-Y996 WeakPolarHBondContact O-CE1 3.47Å; F755-Y996 HydrophobicContact CB-CD1 3.36Å; F755-Y996 HydrophobicContact CB-CD2 4.48Å; F755-Y996 HydrophobicContact CB-CE1 3.38Å; F755-Y996 HydrophobicContact CB-CE2 4.5Å; F755-Y996 HydrophobicContact CB-CG 3.94Å; F755-Y996 HydrophobicContact CD1-CD1 4.09Å; F755-Y996 HydrophobicContact CD1-CG 4.11Å; F755-Y996 AromaticContact CD2-CD1 3.73Å; F755-Y996 HydrophobicContact CD2-CD1 3.73Å; F755-Y996 AromaticContact CD2-CD2 3.42Å; F755-Y996 HydrophobicContact CD2-CD2 3.42Å; F755-Y996 VanDerWaalsContact CD2-CD2 3.42Å; F755-Y996 HydrophobicContact CD2-CE1 4.16Å; F755-Y996 AromaticContact CD2-CE2 3.89Å; F755-Y996 HydrophobicContact CD2-CE2 3.89Å; F755-Y996 AromaticContact CD2-CG 3.31Å; F755-Y996 HydrophobicContact CD2-CG 3.31Å; F755-Y996 AromaticContact CE2-CD2 3.82Å; F755-Y996 HydrophobicContact CE2-CD2 3.82Å; F755-Y996 AromaticContact CE2-CG 3.76Å; F755-Y996 HydrophobicContact CE2-CG 3.76Å; F755-Y996 AromaticContact CG-CD1 3.45Å; F755-Y996 HydrophobicContact CG-CD1 3.45Å; F755-Y996 VanDerWaalsContact CG-CD1 3.45Å; F755-Y996 HydrophobicContact CG-CD2 4.07Å; F755-Y996 AromaticContact CG-CE1 3.94Å; F755-Y996 HydrophobicContact CG-CE1 3.94Å; F755-Y996 HydrophobicContact CG-CE2 4.5Å; F755-Y996 AromaticContact CG-CG 3.51Å; F755-Y996 HydrophobicContact CG-CG 3.51Å; F755-Y996 HydrophobicContact CZ-CG 4.34Å; P975-Y996 HydrophobicContact CB-CE2 3.96Å; L976-Y996 WeakPolarHBondContact CA-OH 3.14Å; L976-Y996 WeakPolarHBondContact CB-OH 3.3Å; L976-Y996 PolarHBondContact N-OH 3.36Å; L976-Y996 VanDerWaalsContact N-OH 3.08Å; V979-Y996 HydrophobicContact CG2-CD2 3.96Å; V979-Y996 HydrophobicContact CG2-CE2 3.86Å; V990-Y996 HydrophobicContact CG1-CD2 4.33Å; T992-Y996 PolarHBondContact O-N 3.43Å; S994-Y996 VanDerWaalsContact C-N 3.34Å; S994-Y996 PolarHBondContact O-N 2.91Å; Y996-V999 WeakPolarHBondContact O-CG1 2.98Å; Y996-V999 PolarHBondContact O-N 3.03Å; Y996-C1000 PolarHBondContact O-N 2.88Å; Y996-C1000 VanDerWaalsContact O-N 3.1Å; Y996-C1000 PolarHBondContact O-SG 2.81Å
997	K	92.2	Very high	93.9	Very high	75 Å²	75	26.5 Å²	26.5	33%	0.326	13%	0.131	S	C	.	.	H	α-helix	trans	-58.8	-49.3	174	-178	177.6	176.7	-74.6	0	111.4	L746 L752 S993 S994 V999 C1000 E1001	L746-K997 HydrophobicContact CD2-CG 4.1Å; L752-K997 HydrophobicContact CD1-CB 4.12Å; L752-K997 HydrophobicContact CD1-CG 4.26Å; L752-K997 HydrophobicContact CD2-CB 4.27Å; L752-K997 HydrophobicContact CD2-CD 4.25Å; L752-K997 HydrophobicContact CG-CB 4.41Å; S993-K997 VanDerWaalsContact O-CB 3.22Å; S993-K997 WeakPolarHBondContact O-CB 3.28Å; S993-K997 PolarHBondContact O-N 2.72Å; S994-K997 PolarHBondContact O-N 3.04Å; K997-V999 PolarHBondContact O-N 2.82Å; K997-C1000 WeakPolarHBondContact O-CB 3.07Å; K997-C1000 PolarHBondContact O-N 2.88Å; K997-E1001 WeakPolarHBondContact CE-OE1 3.46Å; K997-E1001 HydrophobicContact CG-CG 4.5Å; K997-E1001 WeakPolarHBondContact CG-OE2 3.47Å; K997-E1001 IonicContact NZ-OE1 2.62Å; K997-E1001 PolarHBondContact NZ-OE1 3.21Å; K997-E1001 IonicContact NZ-OE2 2.75Å; K997-E1001 PolarHBondContact NZ-OE2 3.16Å; K997-E1001 WeakPolarHBondContact O-CG 3.41Å; K997-E1001 PolarHBondContact O-N 3.3Å
998	F	95.4	Very high	93.7	Very high	18 Å²	18	31.4 Å²	31.4	8%	0.079	15%	0.152	C	C	.	.	H	α-helix	trans	-56.9	-47.2	179.2	168.1	-90.7	0	0	0	112.4	V919 P920 F926 V956 S994 C1000 E1001 A1002	V919-F998 HydrophobicContact CB-CB 4.1Å; V919-F998 HydrophobicContact CB-CD1 4.46Å; V919-F998 HydrophobicContact CB-CD2 3.88Å; V919-F998 HydrophobicContact CB-CE2 4.46Å; V919-F998 HydrophobicContact CB-CG 3.88Å; V919-F998 HydrophobicContact CG1-CB 3.52Å; V919-F998 HydrophobicContact CG1-CD2 4.26Å; V919-F998 HydrophobicContact CG1-CG 3.88Å; V919-F998 HydrophobicContact CG2-CD2 4.31Å; P920-F998 HydrophobicContact CB-CZ 4.11Å; P920-F998 VanDerWaalsContact CD-CE1 3.49Å; P920-F998 VanDerWaalsContact CD-CZ 3.47Å; P920-F998 HydrophobicContact CG-CE1 3.77Å; P920-F998 HydrophobicContact CG-CE2 4.38Å; P920-F998 HydrophobicContact CG-CZ 3.6Å; F926-F998 HydrophobicContact CB-CZ 4.32Å; F926-F998 AromaticContact CD1-CE1 3.61Å; F926-F998 HydrophobicContact CD1-CE1 3.61Å; F926-F998 AromaticContact CD1-CZ 3.64Å; F926-F998 HydrophobicContact CD1-CZ 3.64Å; F926-F998 AromaticContact CE1-CE1 3.67Å; F926-F998 HydrophobicContact CE1-CE1 3.67Å; F926-F998 HydrophobicContact CE1-CZ 4.18Å; F926-F998 HydrophobicContact CG-CE1 4.18Å; F926-F998 HydrophobicContact CG-CZ 4.06Å; F926-F998 HydrophobicContact CZ-CE1 4.3Å; V956-F998 HydrophobicContact CG1-CD1 4.13Å; V956-F998 HydrophobicContact CG1-CE1 4.22Å; S994-F998 WeakPolarHBondContact O-CB 3.4Å; S994-F998 PolarHBondContact O-N 3.41Å; F998-C1000 VanDerWaalsContact C-N 3.32Å; F998-C1000 PolarHBondContact O-N 3.27Å; F998-E1001 PolarHBondContact O-N 3.01Å; F998-A1002 WeakPolarHBondContact O-CB 3.28Å; F998-A1002 PolarHBondContact O-N 2.87Å
999	V	96.9	Very high	93.4	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-69.4	-31.9	-179.4	76.3	0	0	0	0	112.1	V956 T959 M960 Q995 Y996 K997 A1002 I1003	V956-V999 HydrophobicContact CG1-CB 4.13Å; V956-V999 HydrophobicContact CG1-CG2 4.25Å; T959-V999 HydrophobicContact CG2-CB 4.46Å; T959-V999 HydrophobicContact CG2-CG1 3.8Å; T959-V999 HydrophobicContact CG2-CG2 3.78Å; M960-V999 HydrophobicContact CB-CG2 3.93Å; M960-V999 HydrophobicContact SD-CG2 4.24Å; Q995-V999 PolarHBondContact O-N 3.43Å; Q995-V999 VanDerWaalsContact O-N 3.13Å; Y996-V999 WeakPolarHBondContact O-CG1 2.98Å; Y996-V999 PolarHBondContact O-N 3.03Å; K997-V999 PolarHBondContact O-N 2.82Å; V999-A1002 PolarHBondContact O-N 2.91Å; V999-I1003 HydrophobicContact CG2-CD1 4.29Å; V999-I1003 WeakPolarHBondContact O-CB 3.23Å; V999-I1003 WeakPolarHBondContact O-CD1 3.4Å; V999-I1003 WeakPolarHBondContact O-CG1 3.28Å; V999-I1003 PolarHBondContact O-N 2.95Å
1000	C	96.8	Very high	92.8	Very high	0 Å²	0	37 Å²	37	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-65.4	-40.7	171.8	-65.3	0	0	0	0	112.2	L742 L746 Y996 K997 F998 I1003 L1004	L742-C1000 HydrophobicContact CD1-CB 3.94Å; L746-C1000 HydrophobicContact CD1-CB 3.9Å; L746-C1000 HydrophobicContact CD2-CB 3.94Å; L746-C1000 HydrophobicContact CG-CB 4.25Å; Y996-C1000 PolarHBondContact O-N 2.88Å; Y996-C1000 VanDerWaalsContact O-N 3.1Å; Y996-C1000 PolarHBondContact O-SG 2.81Å; K997-C1000 WeakPolarHBondContact O-CB 3.07Å; K997-C1000 PolarHBondContact O-N 2.88Å; F998-C1000 VanDerWaalsContact C-N 3.32Å; F998-C1000 PolarHBondContact O-N 3.27Å; C1000-I1003 PolarHBondContact O-N 3.07Å; C1000-L1004 PolarHBondContact O-N 3.35Å; C1000-L1004 VanDerWaalsContact O-N 3.15Å
1001	E	95.4	Very high	92	Very high	84 Å²	84	39.4 Å²	39.4	39%	0.393	21%	0.205	S	C	.	.	H	α-helix	trans	-68	-38.5	175.3	-71	175.2	135.4	0	0	112	L746 K997 F998 L1004 R1005	L746-E1001 HydrophobicContact CD1-CG 3.9Å; K997-E1001 WeakPolarHBondContact CE-OE1 3.46Å; K997-E1001 HydrophobicContact CG-CG 4.5Å; K997-E1001 WeakPolarHBondContact CG-OE2 3.47Å; K997-E1001 IonicContact NZ-OE1 2.62Å; K997-E1001 PolarHBondContact NZ-OE1 3.21Å; K997-E1001 IonicContact NZ-OE2 2.75Å; K997-E1001 PolarHBondContact NZ-OE2 3.16Å; K997-E1001 WeakPolarHBondContact O-CG 3.41Å; K997-E1001 PolarHBondContact O-N 3.3Å; F998-E1001 PolarHBondContact O-N 3.01Å; E1001-L1004 PolarHBondContact O-N 2.72Å; E1001-R1005 WeakPolarHBondContact O-CB 3.37Å; E1001-R1005 PolarHBondContact O-N 2.68Å
1002	A	95.9	Very high	91.5	Very high	4 Å²	4	38 Å²	38	3%	0.033	20%	0.2	C	C	.	.	H	α-helix	trans	-67.8	-34	175.1	0	0	0	0	0	112.8	L927 M960 F998 V999 R1005 V1006	L927-A1002 HydrophobicContact CD2-CB 4.36Å; M960-A1002 HydrophobicContact SD-CB 3.67Å; F998-A1002 WeakPolarHBondContact O-CB 3.28Å; F998-A1002 PolarHBondContact O-N 2.87Å; V999-A1002 PolarHBondContact O-N 2.91Å; A1002-R1005 PolarHBondContact O-N 2.94Å; A1002-V1006 WeakPolarHBondContact O-CG2 3.41Å; A1002-V1006 PolarHBondContact O-N 2.87Å
1003	I	96.8	Very high	90.9	Very high	0 Å²	0	45 Å²	45	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-64.3	-47.6	173	-74.9	168.9	0	0	0	111	M739 L742 T959 M960 A963 I967 V973 P975 V999 C1000 R1005 V1006 Y1007	M739-I1003 HydrophobicContact CE-CG2 3.79Å; M739-I1003 HydrophobicContact SD-CG2 4.06Å; L742-I1003 HydrophobicContact CD2-CB 4.34Å; L742-I1003 HydrophobicContact CD2-CG2 3.79Å; T959-I1003 HydrophobicContact CG2-CD1 4.17Å; M960-I1003 HydrophobicContact CE-CG1 3.75Å; M960-I1003 HydrophobicContact SD-CG1 4.12Å; A963-I1003 HydrophobicContact CB-CD1 3.45Å; A963-I1003 VanDerWaalsContact CB-CD1 3.45Å; A963-I1003 HydrophobicContact CB-CG1 3.5Å; A963-I1003 HydrophobicContact CB-CG2 4.36Å; I967-I1003 HydrophobicContact CD1-CG2 4.46Å; V973-I1003 HydrophobicContact CG1-CD1 4.36Å; V973-I1003 HydrophobicContact CG1-CG2 4.14Å; P975-I1003 HydrophobicContact CB-CD1 4.47Å; P975-I1003 HydrophobicContact CG-CD1 3.96Å; V999-I1003 HydrophobicContact CG2-CD1 4.29Å; V999-I1003 WeakPolarHBondContact O-CB 3.23Å; V999-I1003 WeakPolarHBondContact O-CD1 3.4Å; V999-I1003 WeakPolarHBondContact O-CG1 3.28Å; V999-I1003 PolarHBondContact O-N 2.95Å; C1000-I1003 PolarHBondContact O-N 3.07Å; I1003-R1005 VanDerWaalsContact C-N 3.33Å; I1003-R1005 PolarHBondContact O-N 2.84Å; I1003-V1006 PolarHBondContact O-N 3.2Å; I1003-Y1007 PolarHBondContact O-N 3.02Å; I1003-Y1007 VanDerWaalsContact O-N 3.17Å
1004	L	95.2	Very high	90.3	Very high	16 Å²	16	48.1 Å²	48.1	8%	0.084	25%	0.249	C	C	.	.	H	α-helix	trans	-60.3	-44	173.5	-71.3	178.7	0	0	0	111.4	M739 L742 K743 L746 C1000 E1001 V1006 Y1007 E1008	M739-L1004 HydrophobicContact CB-CD2 4.17Å; M739-L1004 WeakPolarHBondContact O-CD2 3.21Å; M739-L1004 HydrophobicContact SD-CD2 3.96Å; L742-L1004 HydrophobicContact CB-CD2 4.22Å; L742-L1004 HydrophobicContact CD2-CD2 4.08Å; L742-L1004 HydrophobicContact CD2-CG 4.04Å; L742-L1004 HydrophobicContact CG-CD1 4.47Å; L742-L1004 HydrophobicContact CG-CD2 4.23Å; L742-L1004 HydrophobicContact CG-CG 4.21Å; K743-L1004 HydrophobicContact CB-CD1 3.97Å; K743-L1004 HydrophobicContact CB-CD2 4.29Å; K743-L1004 HydrophobicContact CG-CD1 4.27Å; L746-L1004 HydrophobicContact CD1-CD1 3.67Å; C1000-L1004 PolarHBondContact O-N 3.35Å; C1000-L1004 VanDerWaalsContact O-N 3.15Å; E1001-L1004 PolarHBondContact O-N 2.72Å; L1004-V1006 PolarHBondContact O-N 2.76Å; L1004-Y1007 PolarHBondContact O-N 2.96Å; L1004-E1008 WeakPolarHBondContact O-CB 3.42Å; L1004-E1008 WeakPolarHBondContact O-CG 3.15Å; L1004-E1008 PolarHBondContact O-N 3.11Å
1005	R	94.1	Very high	89.4	Confident	68 Å²	68	50.3 Å²	50.3	26%	0.257	26%	0.256	S	S	.	.	H	α-helix	trans	-57.8	-46.5	177.5	-172.4	178.2	177.6	-149.7	-21	112.1	S923 S924 E1001 A1002 I1003 Y1007 E1008 E1009	S923-R1005 PolarHBondContact OG-NH1 3.49Å; S924-R1005 PolarHBondContact OG-NH1 2.98Å; E1001-R1005 WeakPolarHBondContact O-CB 3.37Å; E1001-R1005 PolarHBondContact O-N 2.68Å; A1002-R1005 PolarHBondContact O-N 2.94Å; I1003-R1005 VanDerWaalsContact C-N 3.33Å; I1003-R1005 PolarHBondContact O-N 2.84Å; R1005-Y1007 VanDerWaalsContact C-N 3.29Å; R1005-Y1007 PolarHBondContact O-N 3.01Å; R1005-E1008 PolarHBondContact O-N 3.21Å; R1005-E1009 HydrophobicContact CG-CG 4.31Å; R1005-E1009 WeakPolarHBondContact CG-OE1 3.31Å; R1005-E1009 IonicContact CZ-OE1 2.73Å; R1005-E1009 IonicContact CZ-OE2 3.53Å; R1005-E1009 IonicContact NE-OE1 3.45Å; R1005-E1009 PolarHBondContact NE-OE1 2.71Å; R1005-E1009 IonicContact NE-OE2 2.71Å; R1005-E1009 PolarHBondContact NE-OE2 3.2Å; R1005-E1009 IonicContact NH2-OE1 3.92Å; R1005-E1009 PolarHBondContact NH2-OE1 2.79Å; R1005-E1009 IonicContact NH2-OE2 3.07Å; R1005-E1009 PolarHBondContact NH2-OE2 2.74Å; R1005-E1009 VanDerWaalsContact O-CB 3.32Å; R1005-E1009 WeakPolarHBondContact O-CB 3.18Å; R1005-E1009 PolarHBondContact O-N 2.84Å
1006	V	94.3	Very high	87.5	Confident	1 Å²	1	57.3 Å²	57.3	1%	0.006	29%	0.293	C	S	.	.	H	α-helix	trans	-60.4	-38.8	178.1	164.3	0	0	0	0	112.5	L927 M960 M964 I967 A1002 I1003 L1004 G1010 L1011 V1012	L927-V1006 HydrophobicContact CD1-CG2 3.94Å; L927-V1006 HydrophobicContact CD2-CG2 3.44Å; L927-V1006 VanDerWaalsContact CD2-CG2 3.44Å; L927-V1006 HydrophobicContact CG-CG2 4.3Å; M960-V1006 HydrophobicContact CE-CB 4.23Å; M960-V1006 HydrophobicContact CE-CG2 3.76Å; M964-V1006 HydrophobicContact CE-CG2 4.06Å; M964-V1006 HydrophobicContact CG-CG1 4.38Å; I967-V1006 HydrophobicContact CD1-CB 4.43Å; I967-V1006 HydrophobicContact CD1-CG1 3.88Å; A1002-V1006 WeakPolarHBondContact O-CG2 3.41Å; A1002-V1006 PolarHBondContact O-N 2.87Å; I1003-V1006 PolarHBondContact O-N 3.2Å; L1004-V1006 PolarHBondContact O-N 2.76Å; V1006-G1010 PolarHBondContact O-N 2.71Å; V1006-L1011 HydrophobicContact CG2-CB 4.48Å; V1006-L1011 HydrophobicContact CG2-CD1 4.17Å; V1006-L1011 PolarHBondContact O-N 3.27Å; V1006-V1012 HydrophobicContact CG1-CG2 3.82Å
1007	Y	94.1	Very high	85.4	Confident	77 Å²	77	63.3 Å²	63.3	30%	0.302	33%	0.333	S	S	.	.	H	α-helix	trans	-71	-51.9	176.1	175.3	-106	0	0	0	112.3	L735 M739 I1003 L1004 R1005 G1010	L735-Y1007 HydrophobicContact CD1-CD2 4.29Å; L735-Y1007 HydrophobicContact CD1-CE2 4.41Å; L735-Y1007 HydrophobicContact CD2-CD2 3.93Å; L735-Y1007 HydrophobicContact CD2-CE2 3.76Å; L735-Y1007 HydrophobicContact CG-CD2 4.04Å; L735-Y1007 HydrophobicContact CG-CE2 3.72Å; M739-Y1007 HydrophobicContact CB-CD1 3.76Å; M739-Y1007 HydrophobicContact CB-CE1 3.7Å; M739-Y1007 HydrophobicContact CB-CG 4.36Å; M739-Y1007 HydrophobicContact CG-CD1 3.5Å; M739-Y1007 VanDerWaalsContact CG-CD1 3.5Å; M739-Y1007 HydrophobicContact CG-CD2 3.88Å; M739-Y1007 HydrophobicContact CG-CE1 3.71Å; M739-Y1007 HydrophobicContact CG-CE2 4.1Å; M739-Y1007 HydrophobicContact CG-CG 3.58Å; M739-Y1007 HydrophobicContact SD-CD1 4.08Å; M739-Y1007 HydrophobicContact SD-CD2 4.44Å; M739-Y1007 HydrophobicContact SD-CG 3.84Å; I1003-Y1007 PolarHBondContact O-N 3.02Å; I1003-Y1007 VanDerWaalsContact O-N 3.17Å; L1004-Y1007 PolarHBondContact O-N 2.96Å; R1005-Y1007 VanDerWaalsContact C-N 3.29Å; R1005-Y1007 PolarHBondContact O-N 3.01Å; Y1007-G1010 PolarHBondContact O-N 3.23Å
1008	E	91.7	Very high	82.6	Confident	115 Å²	115	68.4 Å²	68.4	54%	0.537	38%	0.378	S	S	.	.	H	α-helix	trans	-68.9	-35.3	-175.6	-68.8	-172.8	166.6	0	0	113.5	K743 L1004 R1005 G1010	K743-E1008 IonicContact NZ-OE1 2.65Å; K743-E1008 PolarHBondContact NZ-OE1 2.82Å; L1004-E1008 WeakPolarHBondContact O-CB 3.42Å; L1004-E1008 WeakPolarHBondContact O-CG 3.15Å; L1004-E1008 PolarHBondContact O-N 3.11Å; R1005-E1008 PolarHBondContact O-N 3.21Å; E1008-G1010 VanDerWaalsContact C-N 3.33Å
1009	E	89.3	Confident	82	Confident	101 Å²	101	71 Å²	71	47%	0.472	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.7	-2.4	175.3	-72.3	175.4	-160.7	0	0	112.9	R1005 L1011	R1005-E1009 HydrophobicContact CG-CG 4.31Å; R1005-E1009 WeakPolarHBondContact CG-OE1 3.31Å; R1005-E1009 IonicContact CZ-OE1 2.73Å; R1005-E1009 IonicContact CZ-OE2 3.53Å; R1005-E1009 IonicContact NE-OE1 3.45Å; R1005-E1009 PolarHBondContact NE-OE1 2.71Å; R1005-E1009 IonicContact NE-OE2 2.71Å; R1005-E1009 PolarHBondContact NE-OE2 3.2Å; R1005-E1009 IonicContact NH2-OE1 3.92Å; R1005-E1009 PolarHBondContact NH2-OE1 2.79Å; R1005-E1009 IonicContact NH2-OE2 3.07Å; R1005-E1009 PolarHBondContact NH2-OE2 2.74Å; R1005-E1009 VanDerWaalsContact O-CB 3.32Å; R1005-E1009 WeakPolarHBondContact O-CB 3.18Å; R1005-E1009 PolarHBondContact O-N 2.84Å; E1009-L1011 HydrophobicContact CB-CD1 4.27Å; E1009-L1011 HydrophobicContact CB-CD2 3.82Å; E1009-L1011 HydrophobicContact CB-CG 3.66Å; E1009-L1011 PolarHBondContact O-N 2.93Å
1010	G	85.5	Confident	81.2	Confident	54 Å²	54	74.7 Å²	74.7	56%	0.557	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.5	31.5	-179.4	0	0	0	0	0	113.7	V1006 Y1007 E1008 V1012	V1006-G1010 PolarHBondContact O-N 2.71Å; Y1007-G1010 PolarHBondContact O-N 3.23Å; E1008-G1010 VanDerWaalsContact C-N 3.33Å; G1010-V1012 PolarHBondContact O-N 3.03Å
1011	L	78.2	Confident	80.4	Confident	50 Å²	50	78.8 Å²	78.8	26%	0.262	44%	0.436	S	S	.	.			trans	-67.2	-8.2	-167.2	-67.1	-178.5	0	0	0	114.8	L927 K931 V1006 E1009	L927-L1011 HydrophobicContact CD1-CD1 3.96Å; K931-L1011 WeakPolarHBondContact CE-O 3.37Å; K931-L1011 PolarHBondContact NZ-O 2.82Å; V1006-L1011 HydrophobicContact CG2-CB 4.48Å; V1006-L1011 HydrophobicContact CG2-CD1 4.17Å; V1006-L1011 PolarHBondContact O-N 3.27Å; E1009-L1011 HydrophobicContact CB-CD1 4.27Å; E1009-L1011 HydrophobicContact CB-CD2 3.82Å; E1009-L1011 HydrophobicContact CB-CG 3.66Å; E1009-L1011 PolarHBondContact O-N 2.93Å
1012	V	79.7	Confident	79.5	Confident	21 Å²	21	78.5 Å²	78.5	13%	0.127	44%	0.439	C	S	.	.	S	Bend	trans	-137.7	130.2	-179.6	-168.5	0	0	0	0	107.6	M964 E968 V1006 G1010	M964-V1012 HydrophobicContact CG-CG2 4.19Å; M964-V1012 HydrophobicContact SD-CG2 4.17Å; E968-V1012 HydrophobicContact CG-CB 4.46Å; E968-V1012 HydrophobicContact CG-CG1 3.34Å; E968-V1012 WeakPolarHBondContact OE1-CG1 3.26Å; V1006-V1012 HydrophobicContact CG1-CG2 3.82Å; G1010-V1012 PolarHBondContact O-N 3.03Å
1013	Q	74.7	Confident	78.4	Confident	173 Å²	173	83.2 Å²	83.2	81%	0.808	46%	0.464	S	S	*	.	P	Polyproline II helix	trans	-70.7	136.6	-174.4	-66.9	174.8	-6.3	0	0	111	L1015	Q1013-L1015 PolarHBondContact O-N 2.84Å
1014	T	72.7	Confident	77.2	Confident	100 Å²	100	88.7 Å²	88.7	61%	0.613	50%	0.495	S	S	*	.	P	Polyproline II helix	trans	-67.1	125.8	166.5	48	0	0	0	0	109.2	E968	E968-T1014 WeakPolarHBondContact O-CA 3.09Å
1015	L	71.9	Confident	75.9	Confident	97 Å²	97	93.9 Å²	93.9	51%	0.508	53%	0.525	S	S	.	.	P	Polyproline II helix	trans	-71.2	132.2	169.7	-62.3	170.7	0	0	0	108.4	E968 R969 Q1013	E968-L1015 HydrophobicContact CB-CD1 4.38Å; E968-L1015 HydrophobicContact CB-CG 4.49Å; E968-L1015 PolarHBondContact O-N 2.73Å; R969-L1015 HydrophobicContact CG-CD1 4.17Å; Q1013-L1015 PolarHBondContact O-N 2.84Å
1016	D	52.9	Low	74.5	Confident	146 Å²	146	95.9 Å²	95.9	78%	0.781	55%	0.545	S	S	*	.	P	Polyproline II helix	trans	-59.4	137.7	175.6	-91	-43	0	0	0	110.5	S1018	D1016-S1018 VanDerWaalsContact C-N 3.32Å; D1016-S1018 PolarHBondContact O-N 2.79Å
1017	P	50.6	Low	72.9	Confident	130 Å²	130	103.8 Å²	103.8	84%	0.844	59%	0.59	S	S	*	*			trans	-76.8	82.3	177.4	31.6	-34.4	0	0	0	110.8
1018	S	33.5	Very low	71	Confident	182 Å²	182	106.3 Å²	106.3	100%	1.273	62%	0.617	S	S	*	*			trans	-90.4	0	175.6	67.5	0	0	0	0	113.5	D1016	D1016-S1018 VanDerWaalsContact C-N 3.32Å; D1016-S1018 PolarHBondContact O-N 2.79Å

Retrieved 1,018 of 1,018 residues in 696.9 ms (Link to these results)

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