A0A087WVZ6_HUMAN Loading...

Zinc finger MYND-type containing 8

AlphaFold DB , UniProt , Accession A0A087WVZ6, Species HUMAN (Homo sapiens, Human), Gene ZMYND8, Length 1,136 aa.

						>A0A087WVZ6_HUMAN|A0A087WVZ6|ZMYND8
MHPQSLAEEEIKTEQEVVEGMDISTRSKDPGSAERTAQKRKFPSPPHSSNGHSPQDTSTSPIKKKKKPGLLNSNNKEQDGRNDFYCWVCHREGQVLCCELCPRVYHAKCLRLTSEPEGDWFCPECEKITVAECIETQSKAMTMLTIEQLSYLLKFAIQKMKQPGTDAFQKPVPLEQHPDYAEYIFHPMDLCTLEKNAKKKMYGCTEAFLADAKWILHNCIIYNGGNHKLTQIAKVVIKICEHEMNEIEVCPECYLAACQKRDNWFCEPCSNPHPLVWAKLKGFPFWPAKALRDKDGQVDARFFGQHDRAWVPINNCYLMSKEIPFSVKKTKSIFNSAMQEMEVYVENIRRKFGVFNYSPFRTPYTPNSQYQMLLDPTNPSAGTAKIDKQEKVKLNFDMTASPKILMSKPVLSGGTGRRISLSDMPRSPMSTNSSVHTGSDVEQDAEKKATSSHFSASEESMDFLDKSTASPASTKTGQAGSLSGSPKPFSPQLSAPITTKTDKTSTTGSILNLNLDRSKAEMDLKELSESVQQQSTPVPLISPKRQIRSRFQLNLDKTIESCKAQLGINEISEDVYTAVEHSDSEDSEKSDSSDSEYISDDEQKSKNEPEDTEDKEGCQMDKEPSAVKKKPKPTNPVEIKEELKSTSPASEKADPGAVKDKASPEPEKDFSEKAKPSPHPIKDKLKGKDETDSPTVHLGLDSDSESELVIDLGEDHSGREGRKNKKEPKEPSPKQDVVGKTPPSTTVGSHSPPETPVLTRSSAQTSAAGATATTSTSSTVTVTAPAPAATGSPVKKQRPLLPKETAPAVQRVVWNSSTVQQKEITQSPSTSTITLVTSTQSSPLVTSSGSMSTLVSSVNADLPIATASADVAADIAKYTSKIRRLRIEIEKLQWLHQQELSEMKHNLELTMAEMRQSLEQERDRLIAEVKKQLELEKQQAVDETKKKQWCANCKKEAIFYCCWNTSYCDYPCQQAHWPEHMKSCTQSATAPQQEADAEVNTETLNKSSQGSSSSTQSAPSETASASKEKETSAEKSKESGSTLDLSGSRETPSSILLGSNQGSVSKRCDKQPAYAPTTTDHQPHPNYPAQKYHSRSNKSSWSSSDEKRGSTRSDHNTSTSTKSLLPKESRLDTFWD
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	28.9	Very low	32.3	Very low	249 Å²	249	141.5 Å²	141.5	100%	1.227	74%	0.739	S	S	*	*				0	160.9	0	-80.8	177.5	159.8	0	0	108.8
2	H	28.2	Very low	32.1	Very low	147 Å²	147	141 Å²	141	68%	0.681	73%	0.726	S	S	*	*			trans	-65.8	174.4	171.1	-93.9	-30.2	0	0	0	112.7	Q4	H2-Q4 HydrophobicContact CB-CG 4.43Å
3	P	46.8	Very low	31.7	Very low	111 Å²	111	138.6 Å²	138.6	72%	0.721	72%	0.723	S	S	*	*			cis	-105.6	167.5	15.3	7	18.3	0	0	0	114.4
4	Q	31.3	Very low	31.5	Very low	147 Å²	147	137.2 Å²	137.2	69%	0.687	71%	0.711	S	S	*	*			cis	76.1	145.3	40.9	-52.1	170.1	-60.1	0	0	113.3	H2	H2-Q4 HydrophobicContact CB-CG 4.43Å
5	S	32	Very low	31.4	Very low	92 Å²	92	139.2 Å²	139.2	64%	0.643	72%	0.715	S	S	*	*			cis	-160.8	147	7.5	89.5	0	0	0	0	114
6	L	30	Very low	31.2	Very low	148 Å²	148	140 Å²	140	78%	0.775	72%	0.715	S	S	*	*			trans	60	160.5	134.6	-58.8	173.1	0	0	0	120.3
7	A	32.8	Very low	31	Very low	69 Å²	69	138.7 Å²	138.7	57%	0.57	72%	0.715	S	S	*	*			cis	-161.1	143.5	-4.6	0	0	0	0	0	108.6
8	E	31.3	Very low	30.9	Very low	163 Å²	163	137.2 Å²	137.2	76%	0.762	71%	0.713	S	S	*	*				72	152.1	90.8	-55.9	157.8	174.5	0	0	114
9	E	26.8	Very low	30.8	Very low	165 Å²	165	139.9 Å²	139.9	77%	0.771	72%	0.722	S	S	*	*			cis	-117.7	163.8	4	-61.7	172.3	96.8	0	0	110.3
10	E	33.1	Very low	30.6	Very low	152 Å²	152	136.5 Å²	136.5	71%	0.71	72%	0.722	S	S	*	*			cis	66.7	153.5	43.1	-102.1	-160.5	120.8	0	0	114.1
11	I	33.8	Very low	30.6	Very low	114 Å²	114	138.6 Å²	138.6	59%	0.585	73%	0.73	S	S	*	*			cis	-158.9	137.6	36.9	-137.5	147.5	0	0	0	113.1
12	K	29.9	Very low	30.5	Very low	135 Å²	135	132.7 Å²	132.7	59%	0.587	70%	0.704	S	S	*	*			trans	57.8	166.4	142.3	-71.4	-172.7	175.5	-144.3	0	123.4	E14	K12-E14 VanDerWaalsContact CE-OE1 3.3Å; K12-E14 WeakPolarHBondContact CE-OE1 3.43Å; K12-E14 IonicContact NZ-OE1 2.65Å; K12-E14 PolarHBondContact NZ-OE1 3.45Å
13	T	27.1	Very low	30.3	Very low	110 Å²	110	132.4 Å²	132.4	68%	0.675	71%	0.706	S	S	*	*			cis	-140.7	132.7	10.9	1.6	0	0	0	0	111
14	E	29.4	Very low	29.6	Very low	119 Å²	119	131.7 Å²	131.7	56%	0.556	70%	0.704	S	S	*	*				69.3	110.2	97.7	-68.2	174.2	-169.6	0	0	114.9	K12	K12-E14 VanDerWaalsContact CE-OE1 3.3Å; K12-E14 WeakPolarHBondContact CE-OE1 3.43Å; K12-E14 IonicContact NZ-OE1 2.65Å; K12-E14 PolarHBondContact NZ-OE1 3.45Å
15	Q	29.3	Very low	29.8	Very low	167 Å²	167	131 Å²	131	78%	0.78	71%	0.71	S	S	*	*				85.6	151.6	88.3	-83.8	175.3	-38.4	0	0	113.4
16	E	27.8	Very low	29.7	Very low	152 Å²	152	137.5 Å²	137.5	71%	0.71	72%	0.72	S	S	*	*			cis	-157.9	156.1	17.3	-133.5	-166.2	133.4	0	0	112.6
17	V	29.1	Very low	29.8	Very low	118 Å²	118	135.2 Å²	135.2	72%	0.715	72%	0.716	S	S	*	*				42	140.8	126.1	159.2	0	0	0	0	121.2
18	V	28.8	Very low	29.7	Very low	112 Å²	112	141.6 Å²	141.6	68%	0.679	73%	0.731	S	S	*	*			cis	-169.5	158.5	-4.9	117.1	0	0	0	0	113.1
19	E	28.5	Very low	29.7	Very low	189 Å²	189	140.5 Å²	140.5	88%	0.883	73%	0.731	S	S	*	*			trans	25.2	154.2	157.4	-56.5	177.3	122.9	0	0	127.1
20	G	26.8	Very low	30.4	Very low	71 Å²	71	138.7 Å²	138.7	73%	0.732	73%	0.733	S	S	*	*			trans	135.1	112.9	164.7	0	0	0	0	0	113.8
21	M	30.3	Very low	30.1	Very low	181 Å²	181	134.7 Å²	134.7	89%	0.892	73%	0.733	S	S	*	*			cis	77.7	121.2	26.7	-154.7	166.9	179.8	0	0	112.9
22	D	26.9	Very low	29.9	Very low	125 Å²	125	135 Å²	135	67%	0.668	75%	0.745	S	S	*	*			cis	-164.8	178.6	-0.7	-140.7	-27.5	0	0	0	114.1
23	I	24.9	Very low	29.8	Very low	141 Å²	141	132.6 Å²	132.6	72%	0.723	75%	0.75	S	S	*	*			trans	57.6	108.4	152.4	-58.7	155.6	0	0	0	123
24	S	31.8	Very low	29.7	Very low	96 Å²	96	134.2 Å²	134.2	67%	0.671	75%	0.75	S	S	*	*				33.9	128	123.9	-144.6	0	0	0	0	126.9
25	T	35.6	Very low	29.9	Very low	133 Å²	133	138.3 Å²	138.3	82%	0.816	76%	0.761	S	S	*	*			trans	68.6	137.9	144.1	53.9	0	0	0	0	124.7
26	R	29.9	Very low	29.8	Very low	228 Å²	228	136.5 Å²	136.5	86%	0.86	76%	0.761	S	S	*	*				172.3	130.6	109.9	179	166.7	-174.6	174.5	5.1	117.7
27	S	32.7	Very low	29.8	Very low	99 Å²	99	133.4 Å²	133.4	69%	0.692	76%	0.761	S	S	*	*			trans	66	162	157.9	-64.9	0	0	0	0	118.8
28	K	29.4	Very low	29.9	Very low	204 Å²	204	136 Å²	136	89%	0.887	77%	0.765	S	S	*	*			cis	-153.9	163.2	21.4	-149.7	170.4	-175.9	178.9	0	113.2
29	D	32.5	Very low	29.8	Very low	140 Å²	140	138 Å²	138	75%	0.749	77%	0.765	S	S	*	*			trans	-93.8	166.4	-177	-147.7	-24.2	0	0	0	112.6	G31	D29-G31 PolarHBondContact OD1-N 3.04Å; D29-G31 VanDerWaalsContact OD1-N 3.11Å
30	P	40.6	Very low	29.9	Very low	126 Å²	126	139.4 Å²	139.4	82%	0.818	76%	0.762	S	S	*	*				-157.6	127.7	82.5	38.3	-15.6	0	0	0	120.1
31	G	27.9	Very low	29.8	Very low	69 Å²	69	145.8 Å²	145.8	71%	0.711	77%	0.77	S	S	*	*			trans	76.2	164.9	138.7	0	0	0	0	0	120.7	D29	D29-G31 PolarHBondContact OD1-N 3.04Å; D29-G31 VanDerWaalsContact OD1-N 3.11Å
32	S	29.1	Very low	30	Very low	120 Å²	120	146.6 Å²	146.6	84%	0.839	77%	0.769	S	S	*	*			cis	-161.3	147.4	0.1	-171.9	0	0	0	0	113.6
33	A	26.9	Very low	30.5	Very low	84 Å²	84	146.3 Å²	146.3	69%	0.694	77%	0.774	S	S	*	*			trans	60.9	145.9	158.4	0	0	0	0	0	121.1
34	E	26.3	Very low	30.8	Very low	144 Å²	144	144.7 Å²	144.7	67%	0.673	78%	0.775	S	S	*	*			cis	-158.3	131.6	-15.4	-112	-166	119	0	0	109.2
35	R	32	Very low	31.4	Very low	206 Å²	206	145.7 Å²	145.7	78%	0.777	78%	0.78	S	S	*	*				69.8	145.2	98.1	-83.5	-162.1	-165.6	139.9	-8.2	117.3
36	T	27.2	Very low	32	Very low	129 Å²	129	145.1 Å²	145.1	79%	0.791	78%	0.778	S	S	*	*			cis	-160	171.9	-18.6	-2	0	0	0	0	110.3
37	A	29.6	Very low	31.9	Very low	87 Å²	87	143.3 Å²	143.3	72%	0.719	78%	0.779	S	S	*	*			trans	-91.1	163.6	176.6	0	0	0	0	0	114.9
38	Q	29.6	Very low	31.8	Very low	171 Å²	171	144.3 Å²	144.3	80%	0.799	79%	0.786	S	S	*	*			trans	-172.7	141.6	142.2	-110.4	176.3	89.2	0	0	118.5
39	K	27	Very low	32	Very low	155 Å²	155	139 Å²	139	67%	0.674	78%	0.775	S	S	*	*			trans	30.9	126.4	142.7	-75	174.9	-179.8	164.7	0	124.5
40	R	31.4	Very low	31.9	Very low	218 Å²	218	140.2 Å²	140.2	82%	0.823	78%	0.781	S	S	*	*				80.8	135.4	127.5	-70.8	176.7	174.5	179.4	-3.3	123.1
41	K	25.5	Very low	31.3	Very low	206 Å²	206	137.2 Å²	137.2	90%	0.896	77%	0.773	S	S	*	*			trans	82.3	137.9	150	-82.1	-169.7	172.2	-171.8	0	121.8
42	F	33.5	Very low	31.4	Very low	197 Å²	197	143.6 Å²	143.6	86%	0.864	78%	0.784	S	S	*	*			trans	-57.3	164	160	-83.5	-88.7	0	0	0	112.7
43	P	36.4	Very low	31.4	Very low	119 Å²	119	142.4 Å²	142.4	77%	0.773	78%	0.776	S	S	*	*			cis	-145	-169.9	38.1	43	-22	0	0	0	118.3
44	S	32	Very low	32.3	Very low	107 Å²	107	144.3 Å²	144.3	75%	0.748	78%	0.781	S	S	*	*			trans	-65.5	158.7	176.4	-32.3	0	0	0	0	114.7
45	P	43.6	Very low	32.5	Very low	118 Å²	118	145.9 Å²	145.9	77%	0.766	79%	0.788	S	S	*	*				-156.7	-157	106.2	42.1	-22.9	0	0	0	113
46	P	48.1	Very low	32.2	Very low	120 Å²	120	143 Å²	143	78%	0.779	79%	0.788	S	S	*	*			cis	-125.3	-173.1	-37.6	22.1	1.3	0	0	0	114.1
47	H	29.6	Very low	32.2	Very low	190 Å²	190	142.7 Å²	142.7	88%	0.88	79%	0.786	S	S	*	*			trans	-88.6	165	171.7	-60.1	-117.2	0	0	0	114.1
48	S	29.1	Very low	32.1	Very low	121 Å²	121	143.6 Å²	143.6	85%	0.846	79%	0.788	S	S	*	*			trans	-154.1	-179.7	145.5	-161	0	0	0	0	111.8
49	S	34.4	Very low	32.1	Very low	93 Å²	93	141.7 Å²	141.7	65%	0.65	79%	0.788	S	S	*	*			trans	-150.7	171	-150.8	61.6	0	0	0	0	117.2
50	N	30.3	Very low	32.1	Very low	164 Å²	164	139.8 Å²	139.8	88%	0.877	79%	0.794	S	S	*	*			trans	68.6	149.9	172.4	-61.9	-13.2	0	0	0	117.5
51	G	26.9	Very low	32.5	Very low	63 Å²	63	134.8 Å²	134.8	65%	0.649	79%	0.79	S	S	*	*			cis	173.4	174	-8	0	0	0	0	0	114.3
52	H	30.2	Very low	32.7	Very low	203 Å²	203	132.3 Å²	132.3	94%	0.94	79%	0.785	S	S	*	*			trans	72.4	158.4	170.7	-74.8	-84.3	0	0	0	121.3
53	S	30.3	Very low	32.6	Very low	96 Å²	96	132.1 Å²	132.1	67%	0.671	78%	0.784	S	S	*	*			trans	-148.1	157.2	-177.4	162.6	0	0	0	0	108.8
54	P	44.6	Very low	32.7	Very low	124 Å²	124	136.2 Å²	136.2	81%	0.805	79%	0.789	S	S	*	*				-129.8	-175.3	123.9	37.9	-30.4	0	0	0	112.9
55	Q	30.5	Very low	32.6	Very low	177 Å²	177	141 Å²	141	83%	0.827	80%	0.796	S	S	*	*			trans	-96.1	156.5	-176.2	-59.5	170.8	-29.4	0	0	111.4
56	D	25.5	Very low	32	Very low	144 Å²	144	144.9 Å²	144.9	77%	0.77	80%	0.801	S	S	*	*				-175.3	163.2	107	-126.9	-39.2	0	0	0	116.6
57	T	28.2	Very low	31.4	Very low	123 Å²	123	148.8 Å²	148.8	76%	0.755	81%	0.806	S	S	*	*			trans	58.7	101.8	157.8	54.3	0	0	0	0	122.8
58	S	27.9	Very low	31.5	Very low	107 Å²	107	145.6 Å²	145.6	75%	0.748	80%	0.802	S	S	*	*			trans	1.4	122.3	140.1	-171.1	0	0	0	0	121.3
59	T	28.5	Very low	31.4	Very low	131 Å²	131	143.4 Å²	143.4	80%	0.804	80%	0.799	S	S	*	*				-174.1	169	107.2	24.8	0	0	0	0	111.6
60	S	27.8	Very low	31.4	Very low	114 Å²	114	145.4 Å²	145.4	80%	0.797	80%	0.802	S	S	*	*			trans	-149.1	152.3	175.4	-70.3	0	0	0	0	110.5
61	P	38.7	Very low	31.4	Very low	114 Å²	114	145.2 Å²	145.2	74%	0.74	80%	0.799	S	S	*	*				-146.9	141.6	103.5	29.2	-9.5	0	0	0	117.5
62	I	30.6	Very low	31.3	Very low	153 Å²	153	149.6 Å²	149.6	79%	0.785	81%	0.808	S	S	*	*			trans	66.3	102.8	142.8	-55.4	164.2	0	0	0	118.9
63	K	30.8	Very low	31.4	Very low	194 Å²	194	143.7 Å²	143.7	84%	0.843	79%	0.79	S	S	*	*				-168.3	141.1	124.6	-103.3	152.4	-173.3	172	0	112.3
64	K	38.4	Very low	31.4	Very low	205 Å²	205	146.8 Å²	146.8	89%	0.891	80%	0.799	S	S	*	*			trans	59.2	100.9	165.7	-58.2	-178	179.6	-176.7	0	119.4
65	K	29.7	Very low	30.7	Very low	206 Å²	206	148.8 Å²	148.8	90%	0.896	80%	0.803	S	S	*	*			trans	-105.4	137.1	139	-67.7	-177.6	176.9	-178	0	106.1
66	K	30.9	Very low	30.9	Very low	201 Å²	201	149.1 Å²	149.1	87%	0.874	80%	0.801	S	S	*	*			cis	78.8	119.9	30.6	-155.9	174.1	-175.4	-179.7	0	114
67	K	37.2	Very low	31.5	Very low	201 Å²	201	151.1 Å²	151.1	87%	0.874	81%	0.806	S	S	*	*			trans	-58.4	143.5	-178.4	-69.8	-173.4	179.3	-174.1	0	113.3
68	P	30.6	Very low	32.3	Very low	124 Å²	124	153.5 Å²	153.5	81%	0.805	81%	0.808	S	S	*	*				-85.3	159.8	122.5	36.3	-29.1	0	0	0	109.8
69	G	27.3	Very low	33.2	Very low	75 Å²	75	153.3 Å²	153.3	77%	0.773	80%	0.799	S	S	*	*			cis	145.5	61.2	8.5	0	0	0	0	0	109.7
70	L	33.9	Very low	34.8	Very low	135 Å²	135	150.2 Å²	150.2	71%	0.707	79%	0.793	S	S	*	*			trans	-20.3	132.6	165.9	173	68.6	0	0	0	115.3
71	L	30.6	Very low	37.1	Very low	159 Å²	159	151.5 Å²	151.5	83%	0.832	78%	0.781	S	S	*	*				-174.1	101.8	129.1	-103	170.9	0	0	0	111.8
72	N	25.4	Very low	39.7	Very low	156 Å²	156	147.8 Å²	147.8	83%	0.834	75%	0.754	S	S	*	*				-161.2	113.4	114	-159.2	34.4	0	0	0	108.4
73	S	31.8	Very low	42.7	Very low	79 Å²	79	140.7 Å²	140.7	55%	0.552	72%	0.718	S	S	*	*			trans	-113.4	114.9	-177.9	-65.9	0	0	0	0	109.4
74	N	31.3	Very low	45.8	Very low	160 Å²	160	137.2 Å²	137.2	86%	0.856	70%	0.703	S	S	*	*			trans	-164.3	66.6	159.6	-103.4	-14.2	0	0	0	111.2
75	N	29.8	Very low	48.6	Very low	167 Å²	167	129.2 Å²	129.2	89%	0.893	67%	0.667	S	S	*	*	S	Bend	trans	-148.4	155.4	136.2	-114.9	-25.3	0	0	0	109.1
76	K	34.3	Very low	51.9	Low	184 Å²	184	119.4 Å²	119.4	80%	0.8	63%	0.625	S	S	*	*			trans	-70	161.1	-176.1	-63.9	175.5	-176.7	174.2	0	110.8	Q78	K76-Q78 PolarHBondContact O-N 3.22Å
77	E	38.4	Very low	55.1	Low	185 Å²	185	110.8 Å²	110.8	86%	0.864	59%	0.587	S	S	*	*			trans	0.6	102.5	165.1	-68.3	157.4	145.5	0	0	114.4	D79	E77-D79 PolarHBondContact O-N 2.64Å
78	Q	44	Very low	58	Low	173 Å²	173	104.7 Å²	104.7	81%	0.808	57%	0.567	S	S	*	*			trans	-65	101.8	170.1	-80.9	-172.1	-39	0	0	108.4	K76	K76-Q78 PolarHBondContact O-N 3.22Å
79	D	47.5	Very low	61.2	Low	104 Å²	104	100.7 Å²	100.7	56%	0.556	54%	0.541	S	S	*	.			trans	-49.3	136.7	175.2	-175.1	19.7	0	0	0	110.6	E77 R81	E77-D79 PolarHBondContact O-N 2.64Å; D79-R81 HydrophobicContact CB-CB 4.28Å; D79-R81 PolarHBondContact O-N 3.07Å; D79-R81 VanDerWaalsContact OD2-CB 3.25Å; D79-R81 WeakPolarHBondContact OD2-CB 3.35Å; D79-R81 WeakPolarHBondContact OD2-CD 3.39Å
80	G	61.7	Low	64.5	Low	65 Å²	65	99.2 Å²	99.2	67%	0.67	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.7	42.5	-175.8	0	0	0	0	0	112.8	F185	G80-F185 VanDerWaalsContact O-CE2 3.23Å; G80-F185 WeakPolarHBondContact O-CE2 3.49Å; G80-F185 WeakPolarHBondContact O-CZ 3.39Å
81	R	76.8	Confident	67.6	Low	142 Å²	142	101.2 Å²	101.2	54%	0.536	51%	0.512	S	S	.	.	T	Hydrogen-bonded Turn	trans	-122.2	-10.1	-164.3	-171.2	172.5	-173.3	-108.4	-0.1	112.7	D79 P102 F185	D79-R81 HydrophobicContact CB-CB 4.28Å; D79-R81 PolarHBondContact O-N 3.07Å; D79-R81 VanDerWaalsContact OD2-CB 3.25Å; D79-R81 WeakPolarHBondContact OD2-CB 3.35Å; D79-R81 WeakPolarHBondContact OD2-CD 3.39Å; R81-P102 VanDerWaalsContact O-CB 3.31Å; R81-P102 WeakPolarHBondContact O-CB 3.39Å; R81-F185 VanDerWaalsContact C-CZ 3.45Å
82	N	91.7	Very high	70.7	Confident	35 Å²	35	100.7 Å²	100.7	19%	0.187	51%	0.505	C	S	.	.	S	Bend	trans	-126.9	149.4	-174.7	-68.4	-60.1	0	0	0	111.9	V104	N82-V104 HydrophobicContact CB-CG1 4.05Å
83	D	94.9	Very high	73.9	Confident	5 Å²	5	95.5 Å²	95.5	3%	0.027	49%	0.489	C	S	.	.			trans	-69.6	158.9	172.6	-167	-8.1	0	0	0	111.7	Y85 P102 V104 F185 W214 H217	D83-Y85 WeakPolarHBondContact OD1-CD2 3.32Å; D83-Y85 PolarHBondContact OD1-N 3.23Å; D83-P102 WeakPolarHBondContact CB-O 3.23Å; D83-P102 PolarHBondContact N-O 3.39Å; D83-V104 HydrophobicContact CB-CG1 4.45Å; D83-V104 HydrophobicContact CB-CG2 4.22Å; D83-V104 WeakPolarHBondContact O-CG1 3.39Å; D83-V104 VanDerWaalsContact O-CG2 3.28Å; D83-V104 WeakPolarHBondContact O-CG2 3.23Å; D83-F185 HydrophobicContact CB-CB 4.48Å; D83-W214 HydrophobicContact CB-CH2 4.33Å; D83-W214 VanDerWaalsContact OD2-CZ3 3.3Å; D83-W214 WeakPolarHBondContact OD2-CZ3 3.43Å; D83-H217 IonicContact OD2-CD2 3.97Å; D83-H217 IonicContact OD2-NE2 3.17Å; D83-H217 PolarHBondContact OD2-NE2 2.71Å
84	F	95.9	Very high	76.8	Confident	121 Å²	121	99.1 Å²	99.1	53%	0.531	50%	0.497	S	S	.	.	S	Bend	trans	-99.2	-14.6	172.1	-55	-55.5	0	0	0	112.7
85	Y	97.7	Very high	79.8	Confident	36 Å²	36	92.7 Å²	92.7	14%	0.141	46%	0.464	C	S	.	.	S	Bend	trans	-102.9	125.1	-173.4	-62.7	-85.8	0	0	0	111.8	D83 W87 E92 V104 Y183 I221	D83-Y85 WeakPolarHBondContact OD1-CD2 3.32Å; D83-Y85 PolarHBondContact OD1-N 3.23Å; Y85-W87 PolarHBondContact O-N 3.37Å; Y85-E92 HydrophobicContact CE1-CB 4.4Å; Y85-V104 WeakPolarHBondContact O-CG2 3.19Å; Y85-Y183 VanDerWaalsContact CE2-O 3.22Å; Y85-Y183 WeakPolarHBondContact CE2-O 3.44Å; Y85-I221 HydrophobicContact CD1-CD1 4.22Å; Y85-I221 HydrophobicContact CD1-CG1 3.9Å; Y85-I221 HydrophobicContact CD1-CG2 4.05Å; Y85-I221 HydrophobicContact CD2-CD1 3.6Å; Y85-I221 HydrophobicContact CD2-CG1 4.16Å; Y85-I221 HydrophobicContact CD2-CG2 4.14Å; Y85-I221 HydrophobicContact CE1-CG2 3.82Å; Y85-I221 HydrophobicContact CE2-CD1 4.4Å; Y85-I221 HydrophobicContact CE2-CG2 3.93Å; Y85-I221 HydrophobicContact CG-CD1 3.51Å; Y85-I221 HydrophobicContact CG-CG1 3.71Å; Y85-I221 HydrophobicContact CG-CG2 4.22Å
86	C	98.1	Very high	82.9	Confident	0 Å²	0	85.9 Å²	85.9	0%	0	43%	0.427	C	S	.	.	B	Isolated β-bridge	trans	-63.1	124.2	-178.5	167.2	0	0	0	0	112.3	V88 C89 H90 R91 V95 V104 H106	C86-V88 PolarHBondContact O-N 3.18Å; C86-C89 PolarHBondContact O-N 2.67Å; C86-C89 VanDerWaalsContact O-N 3.11Å; C86-H90 WeakPolarHBondContact O-CA 3.45Å; C86-H90 PolarHBondContact O-N 3.28Å; C86-R91 PolarHBondContact N-O 3.24Å; C86-V95 HydrophobicContact CB-CG1 4.13Å; C86-V104 CarbonylContact C-O 3.59Å; C86-V104 VanDerWaalsContact CA-O 3.29Å; C86-V104 WeakPolarHBondContact CA-O 3.23Å; C86-H106 WeakPolarHBondContact CB-ND1 3.4Å; C86-H106 PolarHBondContact SG-N 3.1Å; C86-H106 PolarHBondContact SG-ND1 2.85Å
87	W	98.3	Very high	85.8	Confident	20 Å²	20	79.3 Å²	79.3	8%	0.076	40%	0.404	C	S	.	.	T	Hydrogen-bonded Turn	trans	-46.7	-37.6	-176.6	-169	-116.6	0	0	0	114.6	Y85 H90 R103 V104 Y105 E124 A210 K213 W214 H217	Y85-W87 PolarHBondContact O-N 3.37Å; W87-H90 PolarHBondContact O-CE1 3.03Å; W87-R103 HydrophobicContact CD2-CB 4.47Å; W87-R103 HydrophobicContact CD2-CG 4.16Å; W87-R103 HydrophobicContact CE3-CB 4.41Å; W87-R103 HydrophobicContact CE3-CG 3.88Å; W87-R103 HydrophobicContact CH2-CG 4.46Å; W87-R103 VanDerWaalsContact CH2-NE 3.34Å; W87-R103 HydrophobicContact CZ3-CG 4.07Å; W87-V104 PolarHBondContact N-O 3.41Å; W87-Y105 HydrophobicContact CB-CD1 4.11Å; W87-Y105 HydrophobicContact CB-CD2 4.49Å; W87-Y105 HydrophobicContact CB-CE1 3.63Å; W87-Y105 HydrophobicContact CB-CE2 4Å; W87-Y105 AromaticContact CD1-CE1 3.81Å; W87-Y105 AromaticContact CD1-CZ 3.66Å; W87-Y105 HydrophobicContact CG-CE1 4.07Å; W87-Y105 AromaticContact CG-CZ 3.81Å; W87-E124 PolarHBondContact NE1-OE1 3.03Å; W87-A210 WeakPolarHBondContact CH2-O 3.49Å; W87-A210 WeakPolarHBondContact CZ2-O 3.48Å; W87-K213 HydrophobicContact CH2-CB 3.79Å; W87-K213 HydrophobicContact CZ2-CB 3.51Å; W87-K213 HydrophobicContact CZ2-CD 4.01Å; W87-K213 HydrophobicContact CZ2-CG 4.42Å; W87-W214 HydrophobicContact CE3-CH2 4.32Å; W87-W214 HydrophobicContact CE3-CZ3 4.34Å; W87-W214 AromaticContact CH2-CD2 3.86Å; W87-W214 HydrophobicContact CH2-CD2 3.86Å; W87-W214 AromaticContact CH2-CE2 3.97Å; W87-W214 HydrophobicContact CH2-CE3 4.35Å; W87-W214 AromaticContact CH2-CG 3.99Å; W87-W214 HydrophobicContact CH2-CG 3.99Å; W87-W214 AromaticContact CZ3-CD2 3.52Å; W87-W214 HydrophobicContact CZ3-CD2 3.52Å; W87-W214 AromaticContact CZ3-CE2 3.69Å; W87-W214 AromaticContact CZ3-CE3 3.59Å; W87-W214 HydrophobicContact CZ3-CE3 3.59Å; W87-W214 HydrophobicContact CZ3-CG 4.12Å; W87-W214 AromaticContact CZ3-CH2 3.91Å; W87-W214 HydrophobicContact CZ3-CH2 3.91Å; W87-W214 AromaticContact CZ3-CZ2 3.88Å; W87-W214 HydrophobicContact CZ3-CZ2 3.88Å; W87-W214 AromaticContact CZ3-CZ3 3.78Å; W87-W214 HydrophobicContact CZ3-CZ3 3.78Å; W87-H217 VanDerWaalsContact CA-CE1 3.44Å; W87-H217 WeakPolarHBondContact CA-CE1 3.48Å; W87-H217 HydrophobicContact CE3-CB 4.32Å; W87-H217 AromaticContact CE3-CE1 3.93Å; W87-H217 AromaticContact CE3-CG 3.82Å; W87-H217 AromaticContact CE3-ND1 3.39Å; W87-H217 HydrophobicContact CZ3-CB 3.94Å; W87-H217 AromaticContact CZ3-CG 3.86Å; W87-H217 AromaticContact CZ3-ND1 3.91Å; W87-H217 PolarHBondContact O-ND1 3.45Å
88	V	97.9	Very high	88.5	Confident	74 Å²	74	70.6 Å²	70.6	45%	0.448	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-30	-173.1	179.4	0	0	0	0	113.7	C86 Y105 C109	C86-V88 PolarHBondContact O-N 3.18Å; V88-Y105 HydrophobicContact CG2-CD1 3.79Å; V88-Y105 HydrophobicContact CG2-CE1 3.87Å; V88-C109 HydrophobicContact CB-CB 3.92Å; V88-C109 HydrophobicContact CG1-CB 3.96Å; V88-C109 HydrophobicContact CG2-CB 4.41Å
89	C	97.6	Very high	90.9	Very high	39 Å²	39	67.2 Å²	67.2	26%	0.264	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-124.5	-6.5	-173.4	72.1	0	0	0	0	115	C86 R91 H106	C86-C89 PolarHBondContact O-N 2.67Å; C86-C89 VanDerWaalsContact O-N 3.11Å; C89-R91 PolarHBondContact O-N 2.79Å; C89-H106 PolarHBondContact SG-ND1 2.87Å; C89-H106 VanDerWaalsContact SG-ND1 3.41Å
90	H	97.8	Very high	93	Very high	45 Å²	45	67 Å²	67	21%	0.208	35%	0.346	C	S	.	.			trans	57.1	47.3	175.9	-39.8	-73.9	0	0	0	112.5	C86 W87 H217 I220	C86-H90 WeakPolarHBondContact O-CA 3.45Å; C86-H90 PolarHBondContact O-N 3.28Å; W87-H90 PolarHBondContact O-CE1 3.03Å; H90-H217 AromaticContact CE1-ND1 3.54Å; H90-H217 AromaticContact ND1-CE1 3.5Å; H90-H217 PolarHBondContact ND1-CE1 3.41Å; H90-H217 AromaticContact ND1-CG 3.55Å; H90-H217 AromaticContact ND1-ND1 2.99Å; H90-H217 PolarHBondContact ND1-ND1 3.35Å; H90-I220 HydrophobicContact CB-CB 3.88Å; H90-I220 HydrophobicContact CB-CG2 3.34Å; H90-I220 WeakPolarHBondContact CD2-CD1 3.44Å; H90-I220 WeakPolarHBondContact NE2-CD1 3.4Å
91	R	97.4	Very high	94.6	Very high	176 Å²	176	64.8 Å²	64.8	66%	0.664	32%	0.32	S	S	*	.			trans	-142.8	146.3	-178	-66.4	176.5	-170.2	-128.2	1.6	110.5	C86 C89	C86-R91 PolarHBondContact N-O 3.24Å; C89-R91 PolarHBondContact O-N 2.79Å
92	E	95.7	Very high	95.6	Very high	148 Å²	148	59.3 Å²	59.3	69%	0.692	30%	0.303	S	S	*	.			trans	-56.9	160.4	163.8	60.3	178.2	177.7	0	0	112.5	Y85	Y85-E92 HydrophobicContact CE1-CB 4.4Å
93	G	93.8	Very high	95.9	Very high	48 Å²	48	58.2 Å²	58.2	50%	0.495	30%	0.296	S	S	.	.	S	Bend	trans	153.7	-164.9	173.2	0	0	0	0	0	112	V95 H106	G93-V95 PolarHBondContact O-N 3.27Å; G93-H106 WeakPolarHBondContact CA-NE2 3.29Å
94	Q	92.9	Very high	96	Very high	154 Å²	154	58 Å²	58	72%	0.72	30%	0.295	S	S	*	.	S	Bend	trans	-76.2	114.6	171.6	-176.7	59.9	39.8	0	0	109.3	H106	Q94-H106 PolarHBondContact O-CD2 2.99Å
95	V	94.7	Very high	96.1	Very high	26 Å²	26	52.3 Å²	52.3	16%	0.158	27%	0.27	C	S	.	.			trans	-124.7	148.2	-172.1	-66.7	0	0	0	0	112	C86 G93 V104	C86-V95 HydrophobicContact CB-CG1 4.13Å; G93-V95 PolarHBondContact O-N 3.27Å; V95-V104 HydrophobicContact CB-CB 3.92Å; V95-V104 HydrophobicContact CB-CG2 3.96Å; V95-V104 HydrophobicContact CG1-CG2 4.11Å; V95-V104 HydrophobicContact CG2-CB 3.83Å; V95-V104 HydrophobicContact CG2-CG1 4.42Å; V95-V104 HydrophobicContact CG2-CG2 3.79Å
96	L	94.3	Very high	96	Very high	23 Å²	23	52.4 Å²	52.4	12%	0.12	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	130.5	168.4	-55.4	174.7	0	0	0	108.6	V104 Y105 A107 L110 L112 E115 P116 W120	L96-V104 CarbonylContact O-C 3.48Å; L96-V104 VanDerWaalsContact O-CA 3.26Å; L96-V104 WeakPolarHBondContact O-CA 3.3Å; L96-Y105 WeakPolarHBondContact CB-O 3.17Å; L96-Y105 PolarHBondContact N-O 3.09Å; L96-Y105 PolarHBondContact O-N 3.17Å; L96-A107 HydrophobicContact CD1-CB 4Å; L96-L110 HydrophobicContact CD1-CD1 4.39Å; L96-L112 HydrophobicContact CD1-CD1 3.94Å; L96-E115 HydrophobicContact CD2-CB 4.35Å; L96-E115 HydrophobicContact CD2-CG 4.23Å; L96-P116 HydrophobicContact CD1-CG 4.1Å; L96-W120 HydrophobicContact CB-CE3 4.33Å; L96-W120 HydrophobicContact CB-CZ3 4.19Å
97	C	94.3	Very high	95.8	Very high	47 Å²	47	53.3 Å²	53.3	32%	0.318	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	152	173.3	-59.9	0	0	0	0	110.8	V104 W120	C97-V104 HydrophobicContact CB-CG1 4.5Å; C97-W120 VanDerWaalsContact O-CE3 3.29Å
98	C	95.3	Very high	95.6	Very high	2 Å²	2	61.4 Å²	61.4	1%	0.014	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	128.2	177.2	173.7	0	0	0	0	109.8	L100 C101 R103 W120 C122	C98-L100 VanDerWaalsContact C-N 3.27Å; C98-L100 PolarHBondContact O-N 3.29Å; C98-C101 WeakPolarHBondContact CB-O 3.37Å; C98-C101 PolarHBondContact O-N 3.42Å; C98-R103 WeakPolarHBondContact CB-O 3.37Å; C98-W120 HydrophobicContact CB-CE3 4.48Å; C98-W120 HydrophobicContact CB-CZ3 4.21Å; C98-C122 HydrophobicContact CB-CB 3.86Å; C98-C122 PolarHBondContact SG-N 3.37Å; C98-C122 VanDerWaalsContact SG-SG 3.68Å
99	E	93.9	Very high	95.6	Very high	101 Å²	101	60 Å²	60	47%	0.472	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-33.8	-175.9	-65.1	-51.8	136.2	0	0	113.7	W120 F121	E99-W120 PolarHBondContact N-O 2.92Å; E99-F121 HydrophobicContact CB-CD1 4.35Å; E99-F121 HydrophobicContact CB-CE1 4.2Å
100	L	93.3	Very high	95.4	Very high	101 Å²	101	59.9 Å²	59.9	53%	0.529	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.5	-12.4	-173.9	-59.8	177.4	0	0	0	115.1	C98 F121 C125	C98-L100 VanDerWaalsContact C-N 3.27Å; C98-L100 PolarHBondContact O-N 3.29Å; L100-F121 HydrophobicContact CD1-CB 4.31Å; L100-F121 HydrophobicContact CD1-CD1 3.57Å; L100-F121 HydrophobicContact CD1-CD2 4.31Å; L100-F121 HydrophobicContact CD1-CE1 3.92Å; L100-F121 HydrophobicContact CD1-CG 3.8Å; L100-F121 HydrophobicContact CD1-CZ 4.43Å; L100-F121 HydrophobicContact CD2-CE1 4.25Å; L100-F121 HydrophobicContact CG-CD1 3.61Å; L100-F121 HydrophobicContact CG-CE1 3.82Å; L100-F121 HydrophobicContact CG-CG 4.33Å; L100-C125 HydrophobicContact CB-CB 4.47Å; L100-C125 HydrophobicContact CD1-CB 4.3Å
101	C	95.4	Very high	95.2	Very high	18 Å²	18	68.5 Å²	68.5	12%	0.122	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.7	156.3	-178.4	84.5	0	0	0	0	112.2	C98 R103 C125	C98-C101 WeakPolarHBondContact CB-O 3.37Å; C98-C101 PolarHBondContact O-N 3.42Å; C101-R103 PolarHBondContact O-N 3.12Å; C101-R103 PolarHBondContact SG-NH1 3.07Å; C101-C125 PolarHBondContact SG-SG 3.41Å
102	P	96.7	Very high	94.8	Very high	27 Å²	27	63.6 Å²	63.6	18%	0.175	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	3.3	-173.8	26.8	-36.5	0	0	0	115.9	R81 D83 F185 W214	R81-P102 VanDerWaalsContact O-CB 3.31Å; R81-P102 WeakPolarHBondContact O-CB 3.39Å; D83-P102 WeakPolarHBondContact CB-O 3.23Å; D83-P102 PolarHBondContact N-O 3.39Å; P102-F185 HydrophobicContact CB-CD1 4.03Å; P102-F185 HydrophobicContact CB-CE1 3.71Å; P102-W214 HydrophobicContact CG-CZ2 4.05Å
103	R	97.5	Very high	94	Very high	11 Å²	11	63.8 Å²	63.8	4%	0.042	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	123	-173.5	-61.6	174.4	179	90.8	-1.5	110.9	W87 C98 C101 Y105 A210 D211 W214	W87-R103 HydrophobicContact CD2-CB 4.47Å; W87-R103 HydrophobicContact CD2-CG 4.16Å; W87-R103 HydrophobicContact CE3-CB 4.41Å; W87-R103 HydrophobicContact CE3-CG 3.88Å; W87-R103 HydrophobicContact CH2-CG 4.46Å; W87-R103 VanDerWaalsContact CH2-NE 3.34Å; W87-R103 HydrophobicContact CZ3-CG 4.07Å; C98-R103 WeakPolarHBondContact CB-O 3.37Å; C101-R103 PolarHBondContact O-N 3.12Å; C101-R103 PolarHBondContact SG-NH1 3.07Å; R103-Y105 HydrophobicContact CB-CE2 3.85Å; R103-Y105 WeakPolarHBondContact O-CE2 3.13Å; R103-A210 PolarHBondContact NH2-O 3.33Å; R103-D211 IonicContact NH2-OD1 2.95Å; R103-D211 PolarHBondContact NH2-OD1 3.3Å; R103-W214 HydrophobicContact CG-CH2 4.01Å; R103-W214 HydrophobicContact CG-CZ2 3.48Å; R103-W214 VanDerWaalsContact CG-CZ2 3.48Å; R103-W214 VanDerWaalsContact NH2-NE1 3.11Å
104	V	97.1	Very high	93.5	Very high	0 Å²	0	65.2 Å²	65.2	0%	0	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	156.7	-178.1	-54.7	0	0	0	0	113.5	N82 D83 Y85 C86 W87 V95 L96 C97	N82-V104 HydrophobicContact CB-CG1 4.05Å; D83-V104 HydrophobicContact CB-CG1 4.45Å; D83-V104 HydrophobicContact CB-CG2 4.22Å; D83-V104 WeakPolarHBondContact O-CG1 3.39Å; D83-V104 VanDerWaalsContact O-CG2 3.28Å; D83-V104 WeakPolarHBondContact O-CG2 3.23Å; Y85-V104 WeakPolarHBondContact O-CG2 3.19Å; C86-V104 CarbonylContact C-O 3.59Å; C86-V104 VanDerWaalsContact CA-O 3.29Å; C86-V104 WeakPolarHBondContact CA-O 3.23Å; W87-V104 PolarHBondContact N-O 3.41Å; V95-V104 HydrophobicContact CB-CB 3.92Å; V95-V104 HydrophobicContact CB-CG2 3.96Å; V95-V104 HydrophobicContact CG1-CG2 4.11Å; V95-V104 HydrophobicContact CG2-CB 3.83Å; V95-V104 HydrophobicContact CG2-CG1 4.42Å; V95-V104 HydrophobicContact CG2-CG2 3.79Å; L96-V104 CarbonylContact O-C 3.48Å; L96-V104 VanDerWaalsContact O-CA 3.26Å; L96-V104 WeakPolarHBondContact O-CA 3.3Å; C97-V104 HydrophobicContact CB-CG1 4.5Å
105	Y	97.9	Very high	93.2	Very high	3 Å²	3	63.4 Å²	63.4	1%	0.012	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	130.8	-169.3	-66.5	-104.4	0	0	0	114.1	W87 V88 L96 R103 A107 L110 W120 C122 E124	W87-Y105 HydrophobicContact CB-CD1 4.11Å; W87-Y105 HydrophobicContact CB-CD2 4.49Å; W87-Y105 HydrophobicContact CB-CE1 3.63Å; W87-Y105 HydrophobicContact CB-CE2 4Å; W87-Y105 AromaticContact CD1-CE1 3.81Å; W87-Y105 AromaticContact CD1-CZ 3.66Å; W87-Y105 HydrophobicContact CG-CE1 4.07Å; W87-Y105 AromaticContact CG-CZ 3.81Å; V88-Y105 HydrophobicContact CG2-CD1 3.79Å; V88-Y105 HydrophobicContact CG2-CE1 3.87Å; L96-Y105 WeakPolarHBondContact CB-O 3.17Å; L96-Y105 PolarHBondContact N-O 3.09Å; L96-Y105 PolarHBondContact O-N 3.17Å; R103-Y105 HydrophobicContact CB-CE2 3.85Å; R103-Y105 WeakPolarHBondContact O-CE2 3.13Å; Y105-A107 PolarHBondContact O-N 3.06Å; Y105-L110 HydrophobicContact CD1-CD1 4.19Å; Y105-L110 HydrophobicContact CD1-CD2 3.55Å; Y105-L110 HydrophobicContact CD1-CG 3.93Å; Y105-L110 HydrophobicContact CE1-CD2 4.06Å; Y105-L110 HydrophobicContact CG-CD1 4.08Å; Y105-L110 HydrophobicContact CG-CD2 4.27Å; Y105-L110 HydrophobicContact CG-CG 4.29Å; Y105-W120 AromaticContact CD2-CH2 3.69Å; Y105-W120 HydrophobicContact CD2-CH2 3.69Å; Y105-W120 AromaticContact CD2-CZ3 3.98Å; Y105-W120 HydrophobicContact CD2-CZ3 3.98Å; Y105-W120 HydrophobicContact CE2-CH2 4.31Å; Y105-W120 AromaticContact CG-CH2 3.93Å; Y105-W120 HydrophobicContact CG-CH2 3.93Å; Y105-C122 HydrophobicContact CD2-CB 3.86Å; Y105-C122 HydrophobicContact CE2-CB 3.2Å; Y105-C122 PolarHBondContact OH-SG 3.28Å; Y105-E124 WeakPolarHBondContact OH-CG 3.39Å
106	H	95.8	Very high	92.9	Very high	37 Å²	37	64.5 Å²	64.5	17%	0.171	34%	0.335	C	S	.	.			trans	-65.2	128	162	-67.6	109.7	0	0	0	110	C86 C89 G93 Q94 K108 C109 L110	C86-H106 WeakPolarHBondContact CB-ND1 3.4Å; C86-H106 PolarHBondContact SG-N 3.1Å; C86-H106 PolarHBondContact SG-ND1 2.85Å; C89-H106 PolarHBondContact SG-ND1 2.87Å; C89-H106 VanDerWaalsContact SG-ND1 3.41Å; G93-H106 WeakPolarHBondContact CA-NE2 3.29Å; Q94-H106 PolarHBondContact O-CD2 2.99Å; H106-K108 PolarHBondContact O-N 3.41Å; H106-K108 VanDerWaalsContact O-N 3.13Å; H106-C109 HydrophobicContact CB-CB 3.99Å; H106-C109 WeakPolarHBondContact O-CB 3.37Å; H106-C109 PolarHBondContact O-N 3.01Å; H106-L110 PolarHBondContact O-N 3.23Å
107	A	94.4	Very high	92.5	Very high	20 Å²	20	72.8 Å²	72.8	17%	0.165	37%	0.373	C	S	.	.	H	α-helix	trans	-51.9	-37.9	173.5	0	0	0	0	0	112.5	L96 Y105 C109 L110 R111 L112 E115	L96-A107 HydrophobicContact CD1-CB 4Å; Y105-A107 PolarHBondContact O-N 3.06Å; A107-C109 PolarHBondContact O-N 2.92Å; A107-L110 PolarHBondContact O-N 3.33Å; A107-R111 PolarHBondContact O-N 3.11Å; A107-L112 PolarHBondContact O-N 3.48Å; A107-E115 HydrophobicContact CB-CG 4.34Å
108	K	94.9	Very high	92	Very high	189 Å²	189	73.7 Å²	73.7	82%	0.822	39%	0.39	S	S	*	.	H	α-helix	trans	-64.4	-33.9	174.7	-175.3	173.9	-179.5	176	0	114	H106 L110 R111	H106-K108 PolarHBondContact O-N 3.41Å; H106-K108 VanDerWaalsContact O-N 3.13Å; K108-L110 VanDerWaalsContact C-N 3.35Å; K108-R111 PolarHBondContact O-N 3.11Å
109	C	96.6	Very high	91.6	Very high	45 Å²	45	80.3 Å²	80.3	30%	0.304	43%	0.426	S	S	.	.	H	α-helix	trans	-73.3	-30.1	176.2	-73.4	0	0	0	0	112.1	V88 H106 A107 R111	V88-C109 HydrophobicContact CB-CB 3.92Å; V88-C109 HydrophobicContact CG1-CB 3.96Å; V88-C109 HydrophobicContact CG2-CB 4.41Å; H106-C109 HydrophobicContact CB-CB 3.99Å; H106-C109 WeakPolarHBondContact O-CB 3.37Å; H106-C109 PolarHBondContact O-N 3.01Å; A107-C109 PolarHBondContact O-N 2.92Å; C109-R111 VanDerWaalsContact C-N 3.32Å
110	L	94.9	Very high	91.5	Very high	37 Å²	37	77.3 Å²	77.3	19%	0.194	41%	0.41	C	S	.	.	H	α-helix	trans	-78.8	-14.2	172.2	-68.6	172.3	0	0	0	113.6	L96 Y105 H106 A107 K108 L112 W120 P123	L96-L110 HydrophobicContact CD1-CD1 4.39Å; Y105-L110 HydrophobicContact CD1-CD1 4.19Å; Y105-L110 HydrophobicContact CD1-CD2 3.55Å; Y105-L110 HydrophobicContact CD1-CG 3.93Å; Y105-L110 HydrophobicContact CE1-CD2 4.06Å; Y105-L110 HydrophobicContact CG-CD1 4.08Å; Y105-L110 HydrophobicContact CG-CD2 4.27Å; Y105-L110 HydrophobicContact CG-CG 4.29Å; H106-L110 PolarHBondContact O-N 3.23Å; A107-L110 PolarHBondContact O-N 3.33Å; K108-L110 VanDerWaalsContact C-N 3.35Å; L110-L112 VanDerWaalsContact C-N 3.29Å; L110-L112 HydrophobicContact CB-CD1 4.29Å; L110-L112 HydrophobicContact CB-CD2 4.28Å; L110-L112 HydrophobicContact CB-CG 3.78Å; L110-L112 HydrophobicContact CD1-CD1 3.99Å; L110-L112 HydrophobicContact CD1-CG 4.37Å; L110-L112 PolarHBondContact O-N 2.94Å; L110-W120 HydrophobicContact CD1-CH2 3.61Å; L110-W120 HydrophobicContact CD1-CZ2 3.44Å; L110-W120 VanDerWaalsContact CD1-CZ2 3.44Å; L110-P123 HydrophobicContact CD2-CG 3.57Å
111	R	93.5	Very high	91.5	Very high	226 Å²	226	77 Å²	77	85%	0.853	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.1	34.6	-172.5	-51.7	-177.4	178.6	119.7	-4.3	113.5	A107 K108 C109	A107-R111 PolarHBondContact O-N 3.11Å; K108-R111 PolarHBondContact O-N 3.11Å; C109-R111 VanDerWaalsContact C-N 3.32Å
112	L	89	Confident	91.6	Very high	73 Å²	73	76.2 Å²	76.2	38%	0.382	40%	0.399	S	S	.	.			trans	-69.3	146.9	173.2	-55.6	178.6	0	0	0	110.6	L96 A107 L110 S114	L96-L112 HydrophobicContact CD1-CD1 3.94Å; A107-L112 PolarHBondContact O-N 3.48Å; L110-L112 VanDerWaalsContact C-N 3.29Å; L110-L112 HydrophobicContact CB-CD1 4.29Å; L110-L112 HydrophobicContact CB-CD2 4.28Å; L110-L112 HydrophobicContact CB-CG 3.78Å; L110-L112 HydrophobicContact CD1-CD1 3.99Å; L110-L112 HydrophobicContact CD1-CG 4.37Å; L110-L112 PolarHBondContact O-N 2.94Å; L112-S114 WeakPolarHBondContact CB-O 3.4Å
113	T	79	Confident	91.6	Very high	151 Å²	151	76.7 Å²	76.7	93%	0.926	40%	0.402	S	S	*	.	S	Bend	trans	-79.7	-25.1	177.9	46	0	0	0	0	113.3
114	S	83	Confident	91.6	Very high	79 Å²	79	77 Å²	77	55%	0.552	40%	0.404	S	S	*	.	S	Bend	trans	-145.8	169.3	174.8	58.5	0	0	0	0	107.8	L112	L112-S114 WeakPolarHBondContact CB-O 3.4Å
115	E	85.2	Confident	91.6	Very high	116 Å²	116	77.5 Å²	77.5	54%	0.542	41%	0.407	S	S	.	.	P	Polyproline II helix	trans	-69.8	150.9	164.2	-63.2	-173.4	155.5	0	0	109.2	L96 A107	L96-E115 HydrophobicContact CD2-CB 4.35Å; L96-E115 HydrophobicContact CD2-CG 4.23Å; A107-E115 HydrophobicContact CB-CG 4.34Å
116	P	88.9	Confident	91.5	Very high	48 Å²	48	83.2 Å²	83.2	31%	0.312	43%	0.434	S	S	.	.	P	Polyproline II helix	trans	-72.4	140	177.2	30.3	-33.4	0	0	0	110.6	L96 W120	L96-P116 HydrophobicContact CD1-CG 4.1Å; P116-W120 HydrophobicContact CB-CB 4.13Å; P116-W120 HydrophobicContact CB-CG 3.92Å; P116-W120 HydrophobicContact CG-CB 3.89Å; P116-W120 HydrophobicContact CG-CD2 4.18Å; P116-W120 HydrophobicContact CG-CG 3.58Å
117	E	85.1	Confident	91.5	Very high	197 Å²	197	86.1 Å²	86.1	92%	0.921	45%	0.446	S	S	*	.	P	Polyproline II helix	trans	-99.4	127.5	174	-66.5	176.6	-171.1	0	0	109.5
118	G	84.8	Confident	91.7	Very high	67 Å²	67	86.6 Å²	86.6	69%	0.691	45%	0.446	S	S	*	.	S	Bend	trans	79.7	-164.8	-175.8	0	0	0	0	0	114	W120	G118-W120 PolarHBondContact O-N 2.98Å
119	D	86.4	Confident	91.7	Very high	141 Å²	141	81.6 Å²	81.6	75%	0.754	43%	0.432	S	S	*	.	S	Bend	trans	-52.6	122.2	-174.8	-56.9	2.1	0	0	0	112
120	W	92.9	Very high	91.7	Very high	38 Å²	38	83.3 Å²	83.3	14%	0.144	44%	0.44	C	S	.	.			trans	-123.3	127.4	-177.9	-174.7	72.4	0	0	0	113.2	L96 C97 C98 E99 Y105 L110 P116 G118 C122	L96-W120 HydrophobicContact CB-CE3 4.33Å; L96-W120 HydrophobicContact CB-CZ3 4.19Å; C97-W120 VanDerWaalsContact O-CE3 3.29Å; C98-W120 HydrophobicContact CB-CE3 4.48Å; C98-W120 HydrophobicContact CB-CZ3 4.21Å; E99-W120 PolarHBondContact N-O 2.92Å; Y105-W120 AromaticContact CD2-CH2 3.69Å; Y105-W120 HydrophobicContact CD2-CH2 3.69Å; Y105-W120 AromaticContact CD2-CZ3 3.98Å; Y105-W120 HydrophobicContact CD2-CZ3 3.98Å; Y105-W120 HydrophobicContact CE2-CH2 4.31Å; Y105-W120 AromaticContact CG-CH2 3.93Å; Y105-W120 HydrophobicContact CG-CH2 3.93Å; L110-W120 HydrophobicContact CD1-CH2 3.61Å; L110-W120 HydrophobicContact CD1-CZ2 3.44Å; L110-W120 VanDerWaalsContact CD1-CZ2 3.44Å; P116-W120 HydrophobicContact CB-CB 4.13Å; P116-W120 HydrophobicContact CB-CG 3.92Å; P116-W120 HydrophobicContact CG-CB 3.89Å; P116-W120 HydrophobicContact CG-CD2 4.18Å; P116-W120 HydrophobicContact CG-CG 3.58Å; G118-W120 PolarHBondContact O-N 2.98Å; W120-C122 HydrophobicContact CH2-CB 3.55Å; W120-C122 HydrophobicContact CZ2-CB 4.24Å; W120-C122 HydrophobicContact CZ3-CB 3.81Å
121	F	93.8	Very high	91.7	Very high	95 Å²	95	82 Å²	82	42%	0.417	44%	0.435	S	S	.	.			trans	-107.8	132.7	176.2	-48.3	-37.7	0	0	0	109.7	E99 L100	E99-F121 HydrophobicContact CB-CD1 4.35Å; E99-F121 HydrophobicContact CB-CE1 4.2Å; L100-F121 HydrophobicContact CD1-CB 4.31Å; L100-F121 HydrophobicContact CD1-CD1 3.57Å; L100-F121 HydrophobicContact CD1-CD2 4.31Å; L100-F121 HydrophobicContact CD1-CE1 3.92Å; L100-F121 HydrophobicContact CD1-CG 3.8Å; L100-F121 HydrophobicContact CD1-CZ 4.43Å; L100-F121 HydrophobicContact CD2-CE1 4.25Å; L100-F121 HydrophobicContact CG-CD1 3.61Å; L100-F121 HydrophobicContact CG-CE1 3.82Å; L100-F121 HydrophobicContact CG-CG 4.33Å
122	C	96.1	Very high	91.7	Very high	0 Å²	0	75.3 Å²	75.3	0%	0	41%	0.413	C	S	.	.			trans	-75.1	160.6	-177.9	78.8	0	0	0	0	113	C98 Y105 W120 E124 C125 E126	C98-C122 HydrophobicContact CB-CB 3.86Å; C98-C122 PolarHBondContact SG-N 3.37Å; C98-C122 VanDerWaalsContact SG-SG 3.68Å; Y105-C122 HydrophobicContact CD2-CB 3.86Å; Y105-C122 HydrophobicContact CE2-CB 3.2Å; Y105-C122 PolarHBondContact OH-SG 3.28Å; W120-C122 HydrophobicContact CH2-CB 3.55Å; W120-C122 HydrophobicContact CZ2-CB 4.24Å; W120-C122 HydrophobicContact CZ3-CB 3.81Å; C122-E124 PolarHBondContact O-N 2.88Å; C122-C125 PolarHBondContact O-N 3.08Å; C122-E126 PolarHBondContact O-N 3.01Å
123	P	96.8	Very high	91.9	Very high	38 Å²	38	73.9 Å²	73.9	25%	0.247	41%	0.409	C	S	.	.	H	α-helix	trans	-63.6	-12.6	-176.4	-24.1	34.6	0	0	0	115.5	L110 K127	L110-P123 HydrophobicContact CD2-CG 3.57Å; P123-K127 VanDerWaalsContact O-CG 3.29Å; P123-K127 WeakPolarHBondContact O-CG 3.38Å; P123-K127 PolarHBondContact O-NZ 2.89Å
124	E	97.8	Very high	92.5	Very high	17 Å²	17	72.8 Å²	72.8	8%	0.079	40%	0.396	C	S	.	.	H	α-helix	trans	-84	-41.7	171.6	-54.3	-75.4	-137.6	0	0	110.4	W87 Y105 C122 K127 I128 A210 K213	W87-E124 PolarHBondContact NE1-OE1 3.03Å; Y105-E124 WeakPolarHBondContact OH-CG 3.39Å; C122-E124 PolarHBondContact O-N 2.88Å; E124-K127 PolarHBondContact O-N 3.32Å; E124-K127 IonicContact OE2-NZ 2.94Å; E124-K127 PolarHBondContact OE2-NZ 3.48Å; E124-I128 WeakPolarHBondContact O-CD1 3.25Å; E124-I128 VanDerWaalsContact O-CG1 3.27Å; E124-I128 WeakPolarHBondContact O-CG1 3.41Å; E124-I128 PolarHBondContact O-N 3.3Å; E124-I128 VanDerWaalsContact O-N 3.09Å; E124-A210 HydrophobicContact CB-CB 4.38Å; E124-K213 WeakPolarHBondContact OE1-CD 3.4Å; E124-K213 IonicContact OE1-NZ 2.61Å; E124-K213 PolarHBondContact OE1-NZ 3.42Å; E124-K213 IonicContact OE2-NZ 3.33Å; E124-K213 PolarHBondContact OE2-NZ 2.98Å
125	C	97.2	Very high	92.9	Very high	10 Å²	10	76.6 Å²	76.6	7%	0.068	41%	0.405	C	S	.	.	H	α-helix	trans	-62.4	-44.7	171.7	-66.3	0	0	0	0	111.8	L100 C101 C122 K127 I128 T129	L100-C125 HydrophobicContact CB-CB 4.47Å; L100-C125 HydrophobicContact CD1-CB 4.3Å; C101-C125 PolarHBondContact SG-SG 3.41Å; C122-C125 PolarHBondContact O-N 3.08Å; C125-K127 VanDerWaalsContact C-N 3.27Å; C125-K127 PolarHBondContact O-N 3.29Å; C125-I128 PolarHBondContact O-N 2.87Å; C125-I128 VanDerWaalsContact O-N 3.1Å; C125-T129 PolarHBondContact O-N 3.27Å; C125-T129 PolarHBondContact O-OG1 2.95Å; C125-T129 VanDerWaalsContact O-OG1 3.12Å
126	E	95.9	Very high	93.3	Very high	124 Å²	124	74.8 Å²	74.8	58%	0.579	40%	0.402	S	S	*	.	H	α-helix	trans	-53.7	-43.9	176	-174.2	-175.5	-168.9	0	0	111.7	C122 V130	C122-E126 PolarHBondContact O-N 3.01Å; E126-V130 WeakPolarHBondContact O-CG2 3.38Å; E126-V130 PolarHBondContact O-N 3.28Å; E126-V130 VanDerWaalsContact O-N 3.15Å
127	K	96.6	Very high	93.4	Very high	97 Å²	97	74.8 Å²	74.8	42%	0.422	40%	0.398	S	S	.	.	H	α-helix	trans	-65.1	-45.6	175.6	-71.7	-178.1	-149.6	88.4	0	112.5	P123 E124 C125 V130 A131 E206	P123-K127 VanDerWaalsContact O-CG 3.29Å; P123-K127 WeakPolarHBondContact O-CG 3.38Å; P123-K127 PolarHBondContact O-NZ 2.89Å; E124-K127 PolarHBondContact O-N 3.32Å; E124-K127 IonicContact OE2-NZ 2.94Å; E124-K127 PolarHBondContact OE2-NZ 3.48Å; C125-K127 VanDerWaalsContact C-N 3.27Å; C125-K127 PolarHBondContact O-N 3.29Å; K127-V130 PolarHBondContact O-N 2.98Å; K127-A131 VanDerWaalsContact O-CB 3.27Å; K127-A131 WeakPolarHBondContact O-CB 3.27Å; K127-A131 PolarHBondContact O-N 3.46Å; K127-E206 HydrophobicContact CB-CG 4.31Å
128	I	97.3	Very high	93.8	Very high	30 Å²	30	67 Å²	67	15%	0.154	37%	0.365	C	S	.	.	H	α-helix	trans	-61.3	-47.8	-179.6	-67.3	163.5	0	0	0	110	E124 C125 V130 A131 E132 E206 A207 A210	E124-I128 WeakPolarHBondContact O-CD1 3.25Å; E124-I128 VanDerWaalsContact O-CG1 3.27Å; E124-I128 WeakPolarHBondContact O-CG1 3.41Å; E124-I128 PolarHBondContact O-N 3.3Å; E124-I128 VanDerWaalsContact O-N 3.09Å; C125-I128 PolarHBondContact O-N 2.87Å; C125-I128 VanDerWaalsContact O-N 3.1Å; I128-V130 VanDerWaalsContact C-N 3.31Å; I128-V130 PolarHBondContact O-N 3.17Å; I128-A131 PolarHBondContact O-N 2.83Å; I128-A131 VanDerWaalsContact O-N 3.14Å; I128-E132 HydrophobicContact CG2-CG 4.31Å; I128-E132 WeakPolarHBondContact O-CB 3.38Å; I128-E132 WeakPolarHBondContact O-CG 3.18Å; I128-E132 PolarHBondContact O-N 2.86Å; I128-E206 HydrophobicContact CG1-CB 4.25Å; I128-A207 HydrophobicContact CD1-CB 4.12Å; I128-A207 HydrophobicContact CG1-CB 4.04Å; I128-A207 HydrophobicContact CG2-CB 4.2Å; I128-A210 HydrophobicContact CD1-CB 4.01Å
129	T	95.3	Very high	94.1	Very high	85 Å²	85	71.6 Å²	71.6	52%	0.521	37%	0.366	S	S	.	.	H	α-helix	trans	-59.3	-39.7	177.1	-56.1	0	0	0	0	112.4	C125 C133	C125-T129 PolarHBondContact O-N 3.27Å; C125-T129 PolarHBondContact O-OG1 2.95Å; C125-T129 VanDerWaalsContact O-OG1 3.12Å; T129-C133 WeakPolarHBondContact O-CB 3.37Å; T129-C133 PolarHBondContact O-N 2.94Å; T129-C133 VanDerWaalsContact O-N 3.11Å
130	V	95.7	Very high	94.4	Very high	81 Å²	81	65 Å²	65	49%	0.491	33%	0.331	S	S	.	.	H	α-helix	trans	-71.7	-35	175.9	172	0	0	0	0	112.5	E126 K127 I128 T136	E126-V130 WeakPolarHBondContact O-CG2 3.38Å; E126-V130 PolarHBondContact O-N 3.28Å; E126-V130 VanDerWaalsContact O-N 3.15Å; K127-V130 PolarHBondContact O-N 2.98Å; I128-V130 VanDerWaalsContact C-N 3.31Å; I128-V130 PolarHBondContact O-N 3.17Å; V130-T136 CarbonylContact O-C 3.6Å; V130-T136 PolarHBondContact O-OG1 2.82Å
131	A	95.3	Very high	94.4	Very high	10 Å²	10	63.7 Å²	63.7	8%	0.083	33%	0.327	C	S	.	.	H	α-helix	trans	-78.5	-26.6	-178.8	0	0	0	0	0	113.9	K127 I128 Q137 C204 E206	K127-A131 VanDerWaalsContact O-CB 3.27Å; K127-A131 WeakPolarHBondContact O-CB 3.27Å; K127-A131 PolarHBondContact O-N 3.46Å; I128-A131 PolarHBondContact O-N 2.83Å; I128-A131 VanDerWaalsContact O-N 3.14Å; A131-Q137 WeakPolarHBondContact O-CA 3.48Å; A131-Q137 WeakPolarHBondContact O-CB 3.41Å; A131-C204 HydrophobicContact CB-CB 3.65Å; A131-E206 HydrophobicContact CB-CB 4.49Å; A131-E206 HydrophobicContact CB-CG 4.27Å; A131-E206 VanDerWaalsContact CB-OE2 3.3Å; A131-E206 WeakPolarHBondContact CB-OE2 3.42Å
132	E	94.8	Very high	94.3	Very high	85 Å²	85	63.5 Å²	63.5	40%	0.397	33%	0.334	S	S	.	.	H	α-helix	trans	-96.8	-15.1	178.4	-63.6	-179.2	173	0	0	113.1	I128 I134 G203 C204	I128-E132 HydrophobicContact CG2-CG 4.31Å; I128-E132 WeakPolarHBondContact O-CB 3.38Å; I128-E132 WeakPolarHBondContact O-CG 3.18Å; I128-E132 PolarHBondContact O-N 2.86Å; E132-I134 PolarHBondContact O-N 3.24Å; E132-G203 WeakPolarHBondContact OE1-CA 3.44Å; E132-G203 PolarHBondContact OE1-N 3.09Å; E132-C204 HydrophobicContact CG-CB 3.66Å; E132-C204 VanDerWaalsContact CG-SG 3.57Å; E132-C204 PolarHBondContact OE1-N 2.88Å; E132-C204 PolarHBondContact OE1-SG 2.97Å
133	C	92.6	Very high	93.8	Very high	42 Å²	42	66.5 Å²	66.5	28%	0.284	35%	0.348	S	S	.	.	S	Bend	trans	-61.7	123	169.7	166.4	0	0	0	0	111	T129 E135 T136 Q137	T129-C133 WeakPolarHBondContact O-CB 3.37Å; T129-C133 PolarHBondContact O-N 2.94Å; T129-C133 VanDerWaalsContact O-N 3.11Å; C133-E135 PolarHBondContact O-N 3.24Å; C133-E135 VanDerWaalsContact O-N 3.12Å; C133-E135 PolarHBondContact SG-OE2 2.88Å; C133-T136 VanDerWaalsContact CB-OG1 3.31Å; C133-T136 WeakPolarHBondContact CB-OG1 3.44Å; C133-T136 PolarHBondContact O-N 3.48Å; C133-T136 PolarHBondContact SG-OG1 2.93Å; C133-Q137 VanDerWaalsContact O-CB 3.32Å; C133-Q137 WeakPolarHBondContact O-CB 3.47Å; C133-Q137 PolarHBondContact O-N 3.1Å
134	I	90.7	Very high	93.6	Very high	128 Å²	128	65.7 Å²	65.7	66%	0.656	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-29.1	-169.2	-63.1	176	0	0	0	111.9	E132 Q137	E132-I134 PolarHBondContact O-N 3.24Å; I134-Q137 WeakPolarHBondContact O-CG 3.49Å; I134-Q137 PolarHBondContact O-NE2 2.94Å
135	E	92.6	Very high	93.4	Very high	159 Å²	159	67.4 Å²	67.4	74%	0.743	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.1	-24.3	-178.5	-61.7	68.2	-152	0	0	113.2	C133	C133-E135 PolarHBondContact O-N 3.24Å; C133-E135 VanDerWaalsContact O-N 3.12Å; C133-E135 PolarHBondContact SG-OE2 2.88Å
136	T	92.9	Very high	93.3	Very high	79 Å²	79	70.4 Å²	70.4	49%	0.485	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-123.4	-5.2	-173.8	58.9	0	0	0	0	115.1	V130 C133	V130-T136 CarbonylContact O-C 3.6Å; V130-T136 PolarHBondContact O-OG1 2.82Å; C133-T136 VanDerWaalsContact CB-OG1 3.31Å; C133-T136 WeakPolarHBondContact CB-OG1 3.44Å; C133-T136 PolarHBondContact O-N 3.48Å; C133-T136 PolarHBondContact SG-OG1 2.93Å
137	Q	91.8	Very high	93.2	Very high	48 Å²	48	68.8 Å²	68.8	22%	0.224	36%	0.36	C	S	.	.	S	Bend	trans	-51.3	156.2	172	66	178.1	-47.2	0	0	112.6	A131 C133 I134 M141	A131-Q137 WeakPolarHBondContact O-CA 3.48Å; A131-Q137 WeakPolarHBondContact O-CB 3.41Å; C133-Q137 VanDerWaalsContact O-CB 3.32Å; C133-Q137 WeakPolarHBondContact O-CB 3.47Å; C133-Q137 PolarHBondContact O-N 3.1Å; I134-Q137 WeakPolarHBondContact O-CG 3.49Å; I134-Q137 PolarHBondContact O-NE2 2.94Å; Q137-M141 HydrophobicContact CB-CB 4.1Å; Q137-M141 VanDerWaalsContact OE1-C 3.32Å
138	S	93.1	Very high	93.1	Very high	33 Å²	33	64.7 Å²	64.7	23%	0.231	34%	0.343	C	S	.	.			trans	-68.8	158.6	179.4	90.9	0	0	0	0	112.5	A140 M141 T142 E248	S138-A140 PolarHBondContact O-N 3.11Å; S138-A140 VanDerWaalsContact O-N 3.13Å; S138-A140 WeakPolarHBondContact OG-CB 3.41Å; S138-A140 PolarHBondContact OG-N 3.05Å; S138-A140 VanDerWaalsContact OG-N 3.09Å; S138-M141 PolarHBondContact O-N 3.39Å; S138-M141 PolarHBondContact OG-N 3.41Å; S138-M141 VanDerWaalsContact OG-N 3.1Å; S138-T142 PolarHBondContact O-N 2.84Å; S138-T142 PolarHBondContact O-OG1 3.07Å; S138-E248 WeakPolarHBondContact CB-OE2 3.08Å; S138-E248 PolarHBondContact OG-OE2 3.2Å
139	K	90.4	Very high	93.1	Very high	163 Å²	163	63.3 Å²	63.3	71%	0.709	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-27.1	171	-65.3	-177.6	-179.8	179.8	0	112.7	M143	K139-M143 VanDerWaalsContact O-CG 3.27Å; K139-M143 WeakPolarHBondContact O-CG 3.36Å
140	A	92.3	Very high	93.2	Very high	2 Å²	2	60 Å²	60	2%	0.017	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-41.9	176.1	0	0	0	0	0	111.4	S138 M143 L144 P251	S138-A140 PolarHBondContact O-N 3.11Å; S138-A140 VanDerWaalsContact O-N 3.13Å; S138-A140 WeakPolarHBondContact OG-CB 3.41Å; S138-A140 PolarHBondContact OG-N 3.05Å; S138-A140 VanDerWaalsContact OG-N 3.09Å; A140-M143 PolarHBondContact O-N 2.8Å; A140-L144 WeakPolarHBondContact O-CG 3.27Å; A140-L144 PolarHBondContact O-N 3.44Å; A140-P251 HydrophobicContact CB-CG 4.26Å
141	M	93.8	Very high	93.2	Very high	11 Å²	11	57.1 Å²	57.1	5%	0.054	30%	0.297	C	S	.	.	G	3₁₀ helix	trans	-66.3	-40.8	176.2	-63.8	-52.8	96.4	0	0	111.3	Q137 S138 M143 L144 L149 T205 I247 E248	Q137-M141 HydrophobicContact CB-CB 4.1Å; Q137-M141 VanDerWaalsContact OE1-C 3.32Å; S138-M141 PolarHBondContact O-N 3.39Å; S138-M141 PolarHBondContact OG-N 3.41Å; S138-M141 VanDerWaalsContact OG-N 3.1Å; M141-M143 PolarHBondContact O-N 2.91Å; M141-L144 HydrophobicContact CE-CD1 3.83Å; M141-L144 PolarHBondContact O-N 3.31Å; M141-L144 VanDerWaalsContact O-O 3.11Å; M141-L149 HydrophobicContact CE-CD1 4.22Å; M141-L149 HydrophobicContact SD-CD1 4.4Å; M141-L149 HydrophobicContact SD-CD2 3.99Å; M141-T205 HydrophobicContact CE-CG2 3.94Å; M141-I247 HydrophobicContact CE-CG2 4.22Å; M141-E248 WeakPolarHBondContact CE-OE1 3.43Å
142	T	91.7	Very high	93.2	Very high	92 Å²	92	56.7 Å²	56.7	56%	0.564	29%	0.293	S	S	*	.	G	3₁₀ helix	trans	-58.4	-25	173.7	-41.8	0	0	0	0	113.2	S138	S138-T142 PolarHBondContact O-N 2.84Å; S138-T142 PolarHBondContact O-OG1 3.07Å
143	M	85.3	Confident	93.4	Very high	63 Å²	63	52.7 Å²	52.7	31%	0.31	27%	0.274	S	S	.	.	G	3₁₀ helix	trans	-89.6	-5.1	178.4	-72.6	176.2	63.2	0	0	114	K139 A140 M141 P251 E252 L394	K139-M143 VanDerWaalsContact O-CG 3.27Å; K139-M143 WeakPolarHBondContact O-CG 3.36Å; A140-M143 PolarHBondContact O-N 2.8Å; M141-M143 PolarHBondContact O-N 2.91Å; M143-P251 HydrophobicContact CB-CG 4.47Å; M143-E252 HydrophobicContact CE-CG 4.34Å; M143-E252 VanDerWaalsContact CE-OE1 3.28Å; M143-E252 WeakPolarHBondContact CE-OE1 3.44Å; M143-L394 HydrophobicContact CB-CD1 4.42Å; M143-L394 HydrophobicContact CE-CD1 4.49Å; M143-L394 HydrophobicContact CE-CD2 4.27Å; M143-L394 WeakPolarHBondContact O-CD1 3.43Å
144	L	91.7	Very high	93.6	Very high	21 Å²	21	54.4 Å²	54.4	11%	0.11	28%	0.277	C	S	.	.			trans	-121.4	147.8	-172	-71.8	171.1	0	0	0	112.2	A140 M141 Q148 L149 L152 I247 P251 L394 F396	A140-L144 WeakPolarHBondContact O-CG 3.27Å; A140-L144 PolarHBondContact O-N 3.44Å; M141-L144 HydrophobicContact CE-CD1 3.83Å; M141-L144 PolarHBondContact O-N 3.31Å; M141-L144 VanDerWaalsContact O-O 3.11Å; L144-Q148 HydrophobicContact CD2-CB 3.58Å; L144-L149 HydrophobicContact CD1-CB 4.47Å; L144-L149 HydrophobicContact CD1-CD1 4.49Å; L144-L152 HydrophobicContact CD1-CD1 4.1Å; L144-L152 HydrophobicContact CD2-CD1 4.19Å; L144-I247 HydrophobicContact CD1-CG2 4.43Å; L144-P251 HydrophobicContact CD1-CB 3.87Å; L144-P251 HydrophobicContact CD1-CG 4.2Å; L144-P251 HydrophobicContact CD2-CB 4.08Å; L144-P251 HydrophobicContact CD2-CG 4.4Å; L144-P251 HydrophobicContact CG-CB 4.15Å; L144-P251 HydrophobicContact CG-CG 4.16Å; L144-L394 HydrophobicContact CD2-CD1 4.1Å; L144-F396 HydrophobicContact CD2-CE2 3.99Å; L144-F396 HydrophobicContact CD2-CZ 4.09Å
145	T	94.6	Very high	93.9	Very high	52 Å²	52	48.9 Å²	48.9	32%	0.319	25%	0.248	S	C	.	.			trans	-87.7	158.8	155.1	71.4	0	0	0	0	110.1	E147 Q148 L149	T145-E147 PolarHBondContact O-N 2.87Å; T145-E147 VanDerWaalsContact O-N 3.1Å; T145-E147 PolarHBondContact OG1-N 2.92Å; T145-Q148 PolarHBondContact O-N 3.42Å; T145-Q148 WeakPolarHBondContact OG1-CG 3.31Å; T145-Q148 PolarHBondContact OG1-N 3.32Å; T145-L149 PolarHBondContact O-N 2.87Å
146	I	95.4	Very high	94.2	Very high	74 Å²	74	41.3 Å²	41.3	38%	0.379	21%	0.213	S	C	.	.	H	α-helix	trans	-56.8	-28.5	175.4	-47.5	-45.2	0	0	0	112	S150 K200 Y202	I146-S150 VanDerWaalsContact O-CB 3.23Å; I146-S150 WeakPolarHBondContact O-CB 3.33Å; I146-S150 PolarHBondContact O-N 2.79Å; I146-K200 HydrophobicContact CG2-CB 4.02Å; I146-Y202 WeakPolarHBondContact CG2-O 3.41Å
147	E	94.5	Very high	94.4	Very high	89 Å²	89	37.5 Å²	37.5	42%	0.416	19%	0.19	S	C	.	.	H	α-helix	trans	-71.6	-39.3	173.3	175.9	166	-109	0	0	113.4	T145 S150 Y151 K200 M398	T145-E147 PolarHBondContact O-N 2.87Å; T145-E147 VanDerWaalsContact O-N 3.1Å; T145-E147 PolarHBondContact OG1-N 2.92Å; E147-S150 WeakPolarHBondContact O-CB 3.47Å; E147-Y151 PolarHBondContact O-N 3.19Å; E147-K200 HydrophobicContact CB-CD 4.34Å; E147-K200 WeakPolarHBondContact OE1-CE 3.4Å; E147-K200 IonicContact OE1-NZ 3.89Å; E147-K200 PolarHBondContact OE1-NZ 3.19Å; E147-M398 HydrophobicContact CG-SD 4.43Å
148	Q	94.3	Very high	94.7	Very high	12 Å²	12	38.5 Å²	38.5	6%	0.056	19%	0.194	C	C	.	.	H	α-helix	trans	-69.6	-41.1	173.6	-67.8	167.7	-35.7	0	0	110.6	L144 T145 Y151 L152 L394 F396	L144-Q148 HydrophobicContact CD2-CB 3.58Å; T145-Q148 PolarHBondContact O-N 3.42Å; T145-Q148 WeakPolarHBondContact OG1-CG 3.31Å; T145-Q148 PolarHBondContact OG1-N 3.32Å; Q148-Y151 PolarHBondContact O-N 3.44Å; Q148-L152 PolarHBondContact O-N 2.86Å; Q148-L152 VanDerWaalsContact O-N 3.09Å; Q148-L394 PolarHBondContact NE2-O 3.15Å; Q148-F396 HydrophobicContact CB-CD2 4.13Å; Q148-F396 HydrophobicContact CB-CE2 3.87Å; Q148-F396 HydrophobicContact CB-CZ 4.13Å; Q148-F396 HydrophobicContact CG-CD2 3.71Å; Q148-F396 HydrophobicContact CG-CE2 3.95Å; Q148-F396 HydrophobicContact CG-CG 4.17Å
149	L	96.6	Very high	94.8	Very high	1 Å²	1	41 Å²	41	1%	0.005	20%	0.201	C	C	.	.	H	α-helix	trans	-57.4	-52.1	171.9	176.8	60	0	0	0	111.1	M141 L144 T145 Y151 L152 L153 G203 T205	M141-L149 HydrophobicContact CE-CD1 4.22Å; M141-L149 HydrophobicContact SD-CD1 4.4Å; M141-L149 HydrophobicContact SD-CD2 3.99Å; L144-L149 HydrophobicContact CD1-CB 4.47Å; L144-L149 HydrophobicContact CD1-CD1 4.49Å; T145-L149 PolarHBondContact O-N 2.87Å; L149-Y151 PolarHBondContact O-N 2.86Å; L149-Y151 VanDerWaalsContact O-N 3.14Å; L149-L152 CarbonylContact O-C 3.59Å; L149-L152 WeakPolarHBondContact O-CA 3.29Å; L149-L152 WeakPolarHBondContact O-CB 3.49Å; L149-L152 PolarHBondContact O-N 2.91Å; L149-L153 HydrophobicContact CD1-CD1 4.39Å; L149-L153 HydrophobicContact CD1-CD2 4.12Å; L149-L153 HydrophobicContact CD1-CG 4.02Å; L149-L153 HydrophobicContact CG-CD1 4.09Å; L149-L153 HydrophobicContact CG-CG 4.16Å; L149-L153 WeakPolarHBondContact O-CG 3.37Å; L149-L153 PolarHBondContact O-N 3.25Å; L149-G203 VanDerWaalsContact CD2-O 3.24Å; L149-G203 WeakPolarHBondContact CD2-O 3.42Å; L149-T205 HydrophobicContact CD1-CG2 4.04Å
150	S	96.8	Very high	95.2	Very high	16 Å²	16	33.2 Å²	33.2	11%	0.112	17%	0.167	C	C	.	.	H	α-helix	trans	-46.7	-43.7	175.5	170.2	0	0	0	0	113.2	I146 E147 L153 K154 A197	I146-S150 VanDerWaalsContact O-CB 3.23Å; I146-S150 WeakPolarHBondContact O-CB 3.33Å; I146-S150 PolarHBondContact O-N 2.79Å; E147-S150 WeakPolarHBondContact O-CB 3.47Å; S150-L153 PolarHBondContact O-N 3.42Å; S150-K154 PolarHBondContact O-N 3.3Å; S150-A197 WeakPolarHBondContact CB-O 3.15Å; S150-A197 PolarHBondContact OG-O 3.32Å
151	Y	95.5	Very high	95.4	Very high	20 Å²	20	35.1 Å²	35.1	8%	0.078	18%	0.175	C	C	.	.	H	α-helix	trans	-75.4	-29.4	178.2	175.2	-93.8	0	0	0	113.7	E147 Q148 L149 K154 F155 L255 Q259 F396 M398 A400	E147-Y151 PolarHBondContact O-N 3.19Å; Q148-Y151 PolarHBondContact O-N 3.44Å; L149-Y151 PolarHBondContact O-N 2.86Å; L149-Y151 VanDerWaalsContact O-N 3.14Å; Y151-K154 WeakPolarHBondContact O-CB 3.44Å; Y151-K154 PolarHBondContact O-N 3.25Å; Y151-F155 HydrophobicContact CD1-CE2 4.16Å; Y151-F155 HydrophobicContact CE1-CD2 4.32Å; Y151-F155 AromaticContact CE1-CE2 3.51Å; Y151-F155 HydrophobicContact CE1-CE2 3.51Å; Y151-F155 HydrophobicContact CE1-CZ 4.39Å; Y151-F155 HydrophobicContact CE2-CE2 4.48Å; Y151-F155 AromaticContact CZ-CE2 3.68Å; Y151-F155 WeakPolarHBondContact O-CD2 3.48Å; Y151-L255 HydrophobicContact CE1-CD1 3.8Å; Y151-Q259 PolarHBondContact OH-NE2 3.24Å; Y151-F396 AromaticContact CD1-CD1 3.59Å; Y151-F396 HydrophobicContact CD1-CD1 3.59Å; Y151-F396 AromaticContact CD1-CE1 3.64Å; Y151-F396 HydrophobicContact CD1-CE1 3.64Å; Y151-F396 AromaticContact CE1-CD1 3.75Å; Y151-F396 HydrophobicContact CE1-CD1 3.75Å; Y151-F396 HydrophobicContact CE1-CE1 4Å; Y151-M398 VanDerWaalsContact CB-CE 3.44Å; Y151-M398 HydrophobicContact CD1-CE 3.4Å; Y151-M398 VanDerWaalsContact CD1-CE 3.4Å; Y151-M398 HydrophobicContact CD2-CE 3.51Å; Y151-M398 HydrophobicContact CE1-CE 3.91Å; Y151-M398 HydrophobicContact CE2-CE 4.03Å; Y151-M398 HydrophobicContact CG-CE 3.17Å; Y151-A400 PolarHBondContact OH-O 3.28Å
152	L	97.1	Very high	95.2	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-69.6	-41.6	168.2	-64	-171.5	0	0	0	111.9	L144 Q148 L149 K154 F155 A156 I247 P251 Y254 L255 F396	L144-L152 HydrophobicContact CD1-CD1 4.1Å; L144-L152 HydrophobicContact CD2-CD1 4.19Å; Q148-L152 PolarHBondContact O-N 2.86Å; Q148-L152 VanDerWaalsContact O-N 3.09Å; L149-L152 CarbonylContact O-C 3.59Å; L149-L152 WeakPolarHBondContact O-CA 3.29Å; L149-L152 WeakPolarHBondContact O-CB 3.49Å; L149-L152 PolarHBondContact O-N 2.91Å; L152-K154 PolarHBondContact O-N 2.88Å; L152-F155 WeakPolarHBondContact O-CB 3.45Å; L152-F155 PolarHBondContact O-N 3.03Å; L152-A156 PolarHBondContact O-N 3.12Å; L152-I247 HydrophobicContact CB-CD1 3.92Å; L152-I247 HydrophobicContact CB-CG1 4.31Å; L152-I247 HydrophobicContact CD1-CG1 4.31Å; L152-I247 HydrophobicContact CD1-CG2 4.1Å; L152-P251 HydrophobicContact CD1-CB 3.64Å; L152-Y254 HydrophobicContact CB-CD1 4.28Å; L152-Y254 HydrophobicContact CB-CE1 4.15Å; L152-Y254 HydrophobicContact CD1-CD1 4.29Å; L152-Y254 HydrophobicContact CD2-CD1 3.92Å; L152-Y254 HydrophobicContact CD2-CE1 4.28Å; L152-Y254 HydrophobicContact CG-CD1 4.38Å; L152-L255 HydrophobicContact CD2-CB 4.14Å; L152-L255 HydrophobicContact CD2-CD1 4.09Å; L152-F396 HydrophobicContact CD1-CZ 4.18Å; L152-F396 HydrophobicContact CD2-CE1 3.6Å; L152-F396 HydrophobicContact CD2-CZ 3.8Å; L152-F396 HydrophobicContact CG-CE1 4.07Å; L152-F396 HydrophobicContact CG-CZ 3.97Å
153	L	98.1	Very high	95.3	Very high	1 Å²	1	39.1 Å²	39.1	1%	0.005	20%	0.196	C	C	.	.	H	α-helix	trans	-58.8	-35.9	173.3	-63.2	-179	0	0	0	111.2	L149 S150 F155 A156 I157 A197 Y202 F208 M244 I247	L149-L153 HydrophobicContact CD1-CD1 4.39Å; L149-L153 HydrophobicContact CD1-CD2 4.12Å; L149-L153 HydrophobicContact CD1-CG 4.02Å; L149-L153 HydrophobicContact CG-CD1 4.09Å; L149-L153 HydrophobicContact CG-CG 4.16Å; L149-L153 WeakPolarHBondContact O-CG 3.37Å; L149-L153 PolarHBondContact O-N 3.25Å; S150-L153 PolarHBondContact O-N 3.42Å; L153-F155 VanDerWaalsContact C-N 3.33Å; L153-F155 PolarHBondContact O-N 3.28Å; L153-A156 WeakPolarHBondContact O-CB 3.47Å; L153-A156 PolarHBondContact O-N 2.86Å; L153-A156 VanDerWaalsContact O-N 3.17Å; L153-I157 VanDerWaalsContact O-CG1 3.32Å; L153-I157 WeakPolarHBondContact O-CG1 3.42Å; L153-I157 PolarHBondContact O-N 3.24Å; L153-A197 HydrophobicContact CB-CB 4.17Å; L153-A197 HydrophobicContact CD1-CB 4.45Å; L153-Y202 HydrophobicContact CD1-CD2 3.99Å; L153-Y202 HydrophobicContact CD1-CG 4.35Å; L153-F208 HydrophobicContact CB-CD2 4.33Å; L153-F208 HydrophobicContact CB-CE2 4.24Å; L153-F208 HydrophobicContact CD1-CB 4Å; L153-F208 HydrophobicContact CD1-CD2 3.8Å; L153-F208 HydrophobicContact CD1-CG 4Å; L153-F208 HydrophobicContact CD2-CB 3.97Å; L153-F208 HydrophobicContact CD2-CD1 3.73Å; L153-F208 HydrophobicContact CD2-CD2 4.01Å; L153-F208 HydrophobicContact CD2-CE1 4.18Å; L153-F208 HydrophobicContact CD2-CE2 4.43Å; L153-F208 HydrophobicContact CD2-CG 3.63Å; L153-F208 HydrophobicContact CG-CD2 4.26Å; L153-F208 HydrophobicContact CG-CG 4.32Å; L153-M244 HydrophobicContact CD2-CE 3.69Å; L153-M244 HydrophobicContact CD2-SD 3.49Å; L153-M244 WeakPolarHBondContact CD2-SD 3.24Å; L153-I247 HydrophobicContact CD2-CD1 4.47Å
154	K	96.7	Very high	95.6	Very high	78 Å²	78	38.3 Å²	38.3	34%	0.339	20%	0.204	S	C	.	.	H	α-helix	trans	-56.4	-43.2	171.9	-171.4	-178.8	179.9	-179.9	0	112.3	S150 Y151 L152 I157 Q158	S150-K154 PolarHBondContact O-N 3.3Å; Y151-K154 WeakPolarHBondContact O-CB 3.44Å; Y151-K154 PolarHBondContact O-N 3.25Å; L152-K154 PolarHBondContact O-N 2.88Å; K154-I157 PolarHBondContact O-N 2.88Å; K154-Q158 VanDerWaalsContact O-CG 3.31Å; K154-Q158 WeakPolarHBondContact O-CG 3.28Å; K154-Q158 PolarHBondContact O-N 2.89Å; K154-Q158 VanDerWaalsContact O-N 3.09Å
155	F	97.2	Very high	95.8	Very high	12 Å²	12	37.4 Å²	37.4	5%	0.053	20%	0.2	C	C	.	.	H	α-helix	trans	-65	-42	175.1	-77.2	-73.7	0	0	0	112.4	Y151 L152 L153 I157 Q158 K159 Y254 L255 C258 Q259 P402	Y151-F155 HydrophobicContact CD1-CE2 4.16Å; Y151-F155 HydrophobicContact CE1-CD2 4.32Å; Y151-F155 AromaticContact CE1-CE2 3.51Å; Y151-F155 HydrophobicContact CE1-CE2 3.51Å; Y151-F155 HydrophobicContact CE1-CZ 4.39Å; Y151-F155 HydrophobicContact CE2-CE2 4.48Å; Y151-F155 AromaticContact CZ-CE2 3.68Å; Y151-F155 WeakPolarHBondContact O-CD2 3.48Å; L152-F155 WeakPolarHBondContact O-CB 3.45Å; L152-F155 PolarHBondContact O-N 3.03Å; L153-F155 VanDerWaalsContact C-N 3.33Å; L153-F155 PolarHBondContact O-N 3.28Å; F155-I157 VanDerWaalsContact C-N 3.33Å; F155-I157 PolarHBondContact O-N 2.83Å; F155-Q158 PolarHBondContact O-N 3.43Å; F155-K159 WeakPolarHBondContact O-CG 3.2Å; F155-K159 PolarHBondContact O-N 3.34Å; F155-K159 VanDerWaalsContact O-N 3.09Å; F155-Y254 HydrophobicContact CB-CE1 4.21Å; F155-L255 HydrophobicContact CE2-CD1 4.26Å; F155-C258 HydrophobicContact CB-CB 4.28Å; F155-C258 HydrophobicContact CD1-CB 3.67Å; F155-C258 HydrophobicContact CD2-CB 4.15Å; F155-C258 HydrophobicContact CE1-CB 3.91Å; F155-C258 HydrophobicContact CE2-CB 4.36Å; F155-C258 HydrophobicContact CG-CB 3.8Å; F155-C258 HydrophobicContact CZ-CB 4.26Å; F155-Q259 HydrophobicContact CE2-CG 4.33Å; F155-Q259 HydrophobicContact CZ-CG 3.81Å; F155-P402 HydrophobicContact CD1-CB 4.07Å; F155-P402 HydrophobicContact CD1-CG 4.04Å; F155-P402 HydrophobicContact CE1-CB 3.62Å; F155-P402 HydrophobicContact CE1-CG 3.66Å; F155-P402 HydrophobicContact CZ-CB 4.39Å; F155-P402 HydrophobicContact CZ-CG 4.04Å
156	A	98.1	Very high	95.8	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-60.3	-42	176	0	0	0	0	0	111.7	L152 L153 Q158 K159 M160 E243 M244 Y254	L152-A156 PolarHBondContact O-N 3.12Å; L153-A156 WeakPolarHBondContact O-CB 3.47Å; L153-A156 PolarHBondContact O-N 2.86Å; L153-A156 VanDerWaalsContact O-N 3.17Å; A156-Q158 PolarHBondContact O-N 3.11Å; A156-K159 WeakPolarHBondContact O-CB 3.29Å; A156-K159 PolarHBondContact O-N 2.93Å; A156-K159 VanDerWaalsContact O-N 3.16Å; A156-M160 VanDerWaalsContact O-CG 3.27Å; A156-M160 WeakPolarHBondContact O-CG 3.16Å; A156-M160 PolarHBondContact O-N 2.91Å; A156-E243 HydrophobicContact CB-CB 3.77Å; A156-E243 HydrophobicContact CB-CG 4.36Å; A156-M244 HydrophobicContact CB-CE 3.38Å; A156-Y254 PolarHBondContact N-OH 3.28Å
157	I	98.1	Very high	95.8	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-62	-43.2	175	-66.9	162.7	0	0	0	111.5	L153 K154 F155 K159 M160 K161 E194 A197 F208	L153-I157 VanDerWaalsContact O-CG1 3.32Å; L153-I157 WeakPolarHBondContact O-CG1 3.42Å; L153-I157 PolarHBondContact O-N 3.24Å; K154-I157 PolarHBondContact O-N 2.88Å; F155-I157 VanDerWaalsContact C-N 3.33Å; F155-I157 PolarHBondContact O-N 2.83Å; I157-K159 PolarHBondContact O-N 3.05Å; I157-M160 CarbonylContact O-C 3.59Å; I157-M160 WeakPolarHBondContact O-CB 3.49Å; I157-M160 PolarHBondContact O-N 2.86Å; I157-M160 VanDerWaalsContact O-N 3.1Å; I157-K161 HydrophobicContact CG2-CD 3.95Å; I157-K161 HydrophobicContact CG2-CG 4.23Å; I157-K161 WeakPolarHBondContact O-CB 3.36Å; I157-K161 WeakPolarHBondContact O-CG 3.28Å; I157-K161 PolarHBondContact O-N 2.81Å; I157-E194 HydrophobicContact CD1-CB 3.92Å; I157-E194 HydrophobicContact CD1-CG 4.11Å; I157-E194 HydrophobicContact CG2-CB 4.17Å; I157-E194 HydrophobicContact CG2-CG 4.33Å; I157-A197 HydrophobicContact CD1-CB 3.95Å; I157-F208 HydrophobicContact CD1-CE2 3.91Å; I157-F208 HydrophobicContact CD1-CZ 4.19Å; I157-F208 HydrophobicContact CG1-CE2 3.9Å; I157-F208 HydrophobicContact CG1-CZ 3.65Å
158	Q	96.6	Very high	96	Very high	68 Å²	68	35.2 Å²	35.2	32%	0.318	20%	0.196	S	C	.	.	H	α-helix	trans	-64.6	-27.5	178	-64.2	-61.9	-39.8	0	0	112.1	K154 F155 A156 E194	K154-Q158 VanDerWaalsContact O-CG 3.31Å; K154-Q158 WeakPolarHBondContact O-CG 3.28Å; K154-Q158 PolarHBondContact O-N 2.89Å; K154-Q158 VanDerWaalsContact O-N 3.09Å; F155-Q158 PolarHBondContact O-N 3.43Å; A156-Q158 PolarHBondContact O-N 3.11Å; Q158-E194 PolarHBondContact NE2-OE1 2.94Å
159	K	96.5	Very high	96.1	Very high	85 Å²	85	37.3 Å²	37.3	37%	0.37	21%	0.206	S	C	.	.	H	α-helix	trans	-74.6	-40.2	170	-62.1	-98	-161.1	69	0	112.1	F155 A156 I157 K161 Q162 I239 E243	F155-K159 WeakPolarHBondContact O-CG 3.2Å; F155-K159 PolarHBondContact O-N 3.34Å; F155-K159 VanDerWaalsContact O-N 3.09Å; A156-K159 WeakPolarHBondContact O-CB 3.29Å; A156-K159 PolarHBondContact O-N 2.93Å; A156-K159 VanDerWaalsContact O-N 3.16Å; I157-K159 PolarHBondContact O-N 3.05Å; K159-K161 VanDerWaalsContact C-N 3.28Å; K159-K161 PolarHBondContact O-N 2.92Å; K159-Q162 PolarHBondContact O-N 3.16Å; K159-I239 HydrophobicContact CB-CG2 3.96Å; K159-E243 HydrophobicContact CB-CG 4.28Å; K159-E243 WeakPolarHBondContact CG-OE2 3.47Å; K159-E243 IonicContact NZ-OE1 2.94Å; K159-E243 PolarHBondContact NZ-OE1 3.07Å; K159-E243 IonicContact NZ-OE2 3.16Å; K159-E243 PolarHBondContact NZ-OE2 3.05Å
160	M	97.8	Very high	96.1	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-64.5	-31.3	174.8	-68.7	161.1	70.5	0	0	112	A156 I157 Q162 T165 L190 L193 F208 A212 V236 I239 C240	A156-M160 VanDerWaalsContact O-CG 3.27Å; A156-M160 WeakPolarHBondContact O-CG 3.16Å; A156-M160 PolarHBondContact O-N 2.91Å; I157-M160 CarbonylContact O-C 3.59Å; I157-M160 WeakPolarHBondContact O-CB 3.49Å; I157-M160 PolarHBondContact O-N 2.86Å; I157-M160 VanDerWaalsContact O-N 3.1Å; M160-Q162 PolarHBondContact O-N 2.94Å; M160-T165 WeakPolarHBondContact O-CG2 3.42Å; M160-L190 HydrophobicContact CB-CD2 4.1Å; M160-L190 HydrophobicContact CE-CD2 3.7Å; M160-L193 HydrophobicContact CE-CD2 3.79Å; M160-F208 HydrophobicContact CE-CZ 4.48Å; M160-F208 HydrophobicContact SD-CE1 4.09Å; M160-F208 HydrophobicContact SD-CZ 4.06Å; M160-A212 HydrophobicContact CE-CB 4.07Å; M160-V236 HydrophobicContact CB-CG1 4.31Å; M160-V236 HydrophobicContact CE-CG1 3.98Å; M160-I239 HydrophobicContact CG-CB 4.34Å; M160-I239 HydrophobicContact CG-CG2 3.86Å; M160-C240 HydrophobicContact CE-CB 3.75Å; M160-C240 HydrophobicContact CG-CB 4.45Å; M160-C240 HydrophobicContact SD-CB 3.79Å
161	K	96.3	Very high	96.1	Very high	43 Å²	43	47.7 Å²	47.7	19%	0.187	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.5	27.6	174.7	-69.4	-177	178.6	-178.3	0	114.3	I157 K159 Q169 L190 E194	I157-K161 HydrophobicContact CG2-CD 3.95Å; I157-K161 HydrophobicContact CG2-CG 4.23Å; I157-K161 WeakPolarHBondContact O-CB 3.36Å; I157-K161 WeakPolarHBondContact O-CG 3.28Å; I157-K161 PolarHBondContact O-N 2.81Å; K159-K161 VanDerWaalsContact C-N 3.28Å; K159-K161 PolarHBondContact O-N 2.92Å; K161-Q169 HydrophobicContact CG-CG 4.44Å; K161-L190 HydrophobicContact CD-CB 4.49Å; K161-L190 VanDerWaalsContact CE-CB 3.47Å; K161-L190 WeakPolarHBondContact CE-O 3.44Å; K161-L190 HydrophobicContact CG-CB 4.13Å; K161-L190 HydrophobicContact CG-CD1 3.94Å; K161-L190 PolarHBondContact NZ-O 3.39Å; K161-E194 IonicContact NZ-OE2 3.54Å; K161-E194 PolarHBondContact NZ-OE2 3.01Å
162	Q	90	Very high	96.2	Very high	80 Å²	80	48.9 Å²	48.9	37%	0.374	27%	0.266	S	S	.	.			trans	-58.2	155	172.7	61.9	169.6	-0.2	0	0	112.3	K159 M160 G164 T165 I239	K159-Q162 PolarHBondContact O-N 3.16Å; M160-Q162 PolarHBondContact O-N 2.94Å; Q162-G164 PolarHBondContact O-N 3.02Å; Q162-T165 HydrophobicContact CG-CG2 3.77Å; Q162-T165 WeakPolarHBondContact O-CB 3.36Å; Q162-T165 VanDerWaalsContact O-CG2 3.28Å; Q162-T165 WeakPolarHBondContact O-CG2 3.31Å; Q162-T165 PolarHBondContact O-N 2.92Å; Q162-T165 PolarHBondContact O-OG1 2.86Å; Q162-I239 HydrophobicContact CG-CD1 4.25Å; Q162-I239 VanDerWaalsContact NE2-CD1 3.27Å
163	P	93.8	Very high	96	Very high	107 Å²	107	51 Å²	51	70%	0.695	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	137.6	-178.5	-27.4	35.7	0	0	0	113.9
164	G	91.5	Very high	95.9	Very high	46 Å²	46	55.2 Å²	55.2	47%	0.474	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.8	4.8	-177.5	0	0	0	0	0	114.8	Q162 D166 I232	Q162-G164 PolarHBondContact O-N 3.02Å; G164-D166 VanDerWaalsContact C-OD2 3.3Å; G164-D166 WeakPolarHBondContact CA-OD2 3.42Å; G164-D166 PolarHBondContact N-OD2 3.34Å; G164-I232 WeakPolarHBondContact O-CG2 3.38Å
165	T	95.8	Very high	95.7	Very high	2 Å²	2	58.9 Å²	58.9	1%	0.012	32%	0.321	C	S	.	.			trans	-95.1	8.1	173.8	58.6	0	0	0	0	113.2	M160 Q162 A167 F168 Q169 I232 V236	M160-T165 WeakPolarHBondContact O-CG2 3.42Å; Q162-T165 HydrophobicContact CG-CG2 3.77Å; Q162-T165 WeakPolarHBondContact O-CB 3.36Å; Q162-T165 VanDerWaalsContact O-CG2 3.28Å; Q162-T165 WeakPolarHBondContact O-CG2 3.31Å; Q162-T165 PolarHBondContact O-N 2.92Å; Q162-T165 PolarHBondContact O-OG1 2.86Å; T165-A167 VanDerWaalsContact C-N 3.25Å; T165-A167 PolarHBondContact O-N 3.23Å; T165-A167 VanDerWaalsContact O-N 3.12Å; T165-F168 PolarHBondContact O-N 3.39Å; T165-Q169 PolarHBondContact OG1-NE2 3.23Å; T165-I232 HydrophobicContact CG2-CG2 4.27Å; T165-V236 HydrophobicContact CG2-CG2 3.7Å
166	D	95.5	Very high	95.5	Very high	97 Å²	97	65.1 Å²	65.1	52%	0.519	35%	0.35	S	S	.	.	G	3₁₀ helix	trans	-60.5	-31.1	-162.4	-46.4	-87.9	0	0	0	113.5	G164 F168 Q169	G164-D166 VanDerWaalsContact C-OD2 3.3Å; G164-D166 WeakPolarHBondContact CA-OD2 3.42Å; G164-D166 PolarHBondContact N-OD2 3.34Å; D166-F168 PolarHBondContact O-N 3.28Å; D166-F168 VanDerWaalsContact O-N 3.12Å; D166-Q169 PolarHBondContact O-N 3.35Å; D166-Q169 PolarHBondContact OD1-NE2 2.8Å
167	A	95.9	Very high	95.3	Very high	54 Å²	54	68.2 Å²	68.2	45%	0.446	36%	0.364	S	S	.	.	G	3₁₀ helix	trans	-64.7	-8.8	173.1	0	0	0	0	0	114.9	T165 L229	T165-A167 VanDerWaalsContact C-N 3.25Å; T165-A167 PolarHBondContact O-N 3.23Å; T165-A167 VanDerWaalsContact O-N 3.12Å; A167-L229 HydrophobicContact CB-CD1 4.45Å; A167-L229 HydrophobicContact CB-CD2 3.67Å
168	F	98	Very high	95.1	Very high	17 Å²	17	72.9 Å²	72.9	8%	0.075	39%	0.394	C	S	.	.	G	3₁₀ helix	trans	-121.6	5.1	176.8	-53.6	-66.4	0	0	0	112.7	T165 D166 K170 L190 I215 C219 L229 I232 A233	T165-F168 PolarHBondContact O-N 3.39Å; D166-F168 PolarHBondContact O-N 3.28Å; D166-F168 VanDerWaalsContact O-N 3.12Å; F168-K170 VanDerWaalsContact C-N 3.31Å; F168-L190 HydrophobicContact CB-CD1 4.37Å; F168-L190 WeakPolarHBondContact O-CB 3.44Å; F168-L190 VanDerWaalsContact O-CG 3.31Å; F168-L190 WeakPolarHBondContact O-CG 3.47Å; F168-L190 PolarHBondContact O-N 3.19Å; F168-I215 HydrophobicContact CB-CG2 3.9Å; F168-I215 HydrophobicContact CD1-CG2 3.49Å; F168-I215 VanDerWaalsContact CD1-CG2 3.49Å; F168-I215 HydrophobicContact CE1-CG2 4.19Å; F168-I215 HydrophobicContact CG-CG2 3.8Å; F168-C219 HydrophobicContact CE1-CB 3.99Å; F168-C219 HydrophobicContact CZ-CB 4.29Å; F168-L229 HydrophobicContact CZ-CB 3.96Å; F168-L229 WeakPolarHBondContact CZ-O 3.48Å; F168-I232 HydrophobicContact CD2-CG2 4.13Å; F168-I232 HydrophobicContact CE2-CB 4.03Å; F168-I232 HydrophobicContact CE2-CG2 3.83Å; F168-A233 HydrophobicContact CE1-CB 4.26Å; F168-A233 HydrophobicContact CE2-CB 3.95Å; F168-A233 HydrophobicContact CZ-CB 3.7Å
169	Q	96.7	Very high	95.1	Very high	57 Å²	57	72.2 Å²	72.2	27%	0.266	39%	0.393	S	S	.	.	S	Bend	trans	-79.9	-11.7	-177.9	-74.8	176.9	27.9	0	0	114.1	K161 T165 D166 C191	K161-Q169 HydrophobicContact CG-CG 4.44Å; T165-Q169 PolarHBondContact OG1-NE2 3.23Å; D166-Q169 PolarHBondContact O-N 3.35Å; D166-Q169 PolarHBondContact OD1-NE2 2.8Å; Q169-C191 VanDerWaalsContact O-CB 3.3Å; Q169-C191 WeakPolarHBondContact O-CB 3.16Å; Q169-C191 PolarHBondContact O-N 2.87Å
170	K	96.5	Very high	95	Very high	156 Å²	156	69 Å²	69	68%	0.678	38%	0.379	S	S	*	.	S	Bend	trans	-145.5	164.2	179.7	-71.5	-168.9	176.8	-172.7	0	109.8	F168 D189	F168-K170 VanDerWaalsContact C-N 3.31Å; K170-D189 VanDerWaalsContact C-CB 3.45Å; K170-D189 VanDerWaalsContact CA-OD1 3.3Å; K170-D189 WeakPolarHBondContact CA-OD1 3.28Å; K170-D189 WeakPolarHBondContact O-CB 3.34Å
171	P	97.3	Very high	94.8	Very high	78 Å²	78	72.4 Å²	72.4	51%	0.506	41%	0.407	S	S	.	.	P	Polyproline II helix	trans	-53.2	149.3	169.7	-25.1	33.2	0	0	0	112.3	P173 D189	P171-P173 WeakPolarHBondContact O-CD 3.47Å; P171-D189 WeakPolarHBondContact CD-OD2 3.39Å; P171-D189 WeakPolarHBondContact CG-OD2 3.48Å; P171-D189 VanDerWaalsContact N-CG 3.31Å
172	V	96.6	Very high	94.6	Very high	45 Å²	45	77.5 Å²	77.5	27%	0.273	43%	0.431	S	S	.	.	P	Polyproline II helix	trans	-71.8	121.7	175.4	-179.8	0	0	0	0	109	L174 H177 Y180	V172-L174 PolarHBondContact O-N 2.76Å; V172-H177 HydrophobicContact CG1-CB 4.03Å; V172-Y180 HydrophobicContact CB-CD1 4.27Å; V172-Y180 HydrophobicContact CB-CD2 4.27Å; V172-Y180 HydrophobicContact CB-CE1 4Å; V172-Y180 HydrophobicContact CB-CE2 4.01Å; V172-Y180 HydrophobicContact CB-CG 4.39Å; V172-Y180 HydrophobicContact CG1-CD1 4.47Å; V172-Y180 HydrophobicContact CG1-CD2 3.86Å; V172-Y180 HydrophobicContact CG1-CE2 3.98Å; V172-Y180 HydrophobicContact CG1-CG 4.12Å; V172-Y180 HydrophobicContact CG2-CE1 4.25Å; V172-Y180 HydrophobicContact CG2-CE2 3.81Å
173	P	93.8	Very high	94.8	Very high	45 Å²	45	78.5 Å²	78.5	29%	0.292	43%	0.432	S	S	.	.	P	Polyproline II helix	trans	-76	124.3	-176	28.4	-33	0	0	0	111.7	P171 E175 Q176 H177	P171-P173 WeakPolarHBondContact O-CD 3.47Å; P173-E175 WeakPolarHBondContact CB-OE2 3.26Å; P173-E175 PolarHBondContact O-N 3.21Å; P173-Q176 HydrophobicContact CB-CG 4.48Å; P173-Q176 HydrophobicContact CG-CB 4.11Å; P173-Q176 VanDerWaalsContact CG-CD 3.5Å; P173-Q176 HydrophobicContact CG-CG 3.89Å; P173-Q176 PolarHBondContact O-N 3.43Å; P173-H177 PolarHBondContact O-N 3.13Å; P173-H177 VanDerWaalsContact O-N 3.09Å
174	L	94.4	Very high	94.9	Very high	89 Å²	89	73.7 Å²	73.7	47%	0.466	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-20.5	-179.1	-61.4	179.3	0	0	0	112.6	V172 Q176 H177 P178 Y180 A181	V172-L174 PolarHBondContact O-N 2.76Å; L174-Q176 PolarHBondContact O-N 3.11Å; L174-H177 CarbonylContact O-C 3.3Å; L174-H177 VanDerWaalsContact O-C 3.3Å; L174-H177 PolarHBondContact O-N 3.33Å; L174-P178 WeakPolarHBondContact O-CA 3.41Å; L174-P178 WeakPolarHBondContact O-CD 3.25Å; L174-P178 WeakPolarHBondContact O-CG 3.42Å; L174-Y180 HydrophobicContact CD2-CD1 4.48Å; L174-A181 HydrophobicContact CD2-CB 4.39Å
175	E	93.7	Very high	94.9	Very high	156 Å²	156	75 Å²	75	73%	0.729	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-23.9	172.4	-58.3	82.2	178	0	0	112.9	P173	P173-E175 WeakPolarHBondContact CB-OE2 3.26Å; P173-E175 PolarHBondContact O-N 3.21Å
176	Q	93.1	Very high	94.9	Very high	143 Å²	143	77.7 Å²	77.7	67%	0.668	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.8	-26.6	177.4	-57.2	177.3	15.5	0	0	111.5	P173 L174	P173-Q176 HydrophobicContact CB-CG 4.48Å; P173-Q176 HydrophobicContact CG-CB 4.11Å; P173-Q176 VanDerWaalsContact CG-CD 3.5Å; P173-Q176 HydrophobicContact CG-CG 3.89Å; P173-Q176 PolarHBondContact O-N 3.43Å; L174-Q176 PolarHBondContact O-N 3.11Å
177	H	93.3	Very high	95	Very high	64 Å²	64	76.7 Å²	76.7	30%	0.296	41%	0.405	S	S	.	.			trans	-135.5	71.8	-177.3	-62.8	-70.4	0	0	0	111	V172 P173 L174 D179 Y180 Y222	V172-H177 HydrophobicContact CG1-CB 4.03Å; P173-H177 PolarHBondContact O-N 3.13Å; P173-H177 VanDerWaalsContact O-N 3.09Å; L174-H177 CarbonylContact O-C 3.3Å; L174-H177 VanDerWaalsContact O-C 3.3Å; L174-H177 PolarHBondContact O-N 3.33Å; H177-D179 PolarHBondContact O-N 3.44Å; H177-Y180 WeakPolarHBondContact O-CB 3.39Å; H177-Y180 PolarHBondContact O-N 3.02Å; H177-Y180 VanDerWaalsContact O-N 3.08Å; H177-Y222 HydrophobicContact CB-CE1 4.31Å; H177-Y222 WeakPolarHBondContact CB-OH 3.4Å; H177-Y222 AromaticContact CG-CE1 3.96Å; H177-Y222 AromaticContact ND1-CE1 3.41Å; H177-Y222 WeakPolarHBondContact ND1-CE1 3.44Å; H177-Y222 AromaticContact ND1-CZ 3.57Å; H177-Y222 PolarHBondContact ND1-OH 2.89Å
178	P	94.8	Very high	95	Very high	98 Å²	98	75 Å²	75	64%	0.636	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-28.4	-172.8	-21.5	33.4	0	0	0	113.6	L174 Y180	L174-P178 WeakPolarHBondContact O-CA 3.41Å; L174-P178 WeakPolarHBondContact O-CD 3.25Å; L174-P178 WeakPolarHBondContact O-CG 3.42Å; P178-Y180 VanDerWaalsContact C-N 3.33Å
179	D	94.9	Very high	95.1	Very high	55 Å²	55	74.4 Å²	74.4	29%	0.294	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.8	-7	178.3	64.5	-28.2	0	0	0	113.3	H177 A181 E182 Y183 Y222	H177-D179 PolarHBondContact O-N 3.44Å; D179-A181 VanDerWaalsContact C-N 3.25Å; D179-A181 PolarHBondContact O-N 2.99Å; D179-E182 WeakPolarHBondContact O-CB 3.37Å; D179-E182 PolarHBondContact O-N 2.86Å; D179-Y183 HydrophobicContact CB-CE2 4.11Å; D179-Y183 VanDerWaalsContact O-CD2 3.25Å; D179-Y183 WeakPolarHBondContact O-CD2 3.38Å; D179-Y222 WeakPolarHBondContact OD1-CE2 3.02Å; D179-Y222 PolarHBondContact OD1-OH 2.78Å
180	Y	94.9	Very high	95.1	Very high	18 Å²	18	71.7 Å²	71.7	7%	0.071	37%	0.372	C	S	.	.	H	α-helix	trans	-56.6	-39	-176	-171.2	-98	0	0	0	112.7	V172 L174 H177 P178 E182 Y183 I184 Y222	V172-Y180 HydrophobicContact CB-CD1 4.27Å; V172-Y180 HydrophobicContact CB-CD2 4.27Å; V172-Y180 HydrophobicContact CB-CE1 4Å; V172-Y180 HydrophobicContact CB-CE2 4.01Å; V172-Y180 HydrophobicContact CB-CG 4.39Å; V172-Y180 HydrophobicContact CG1-CD1 4.47Å; V172-Y180 HydrophobicContact CG1-CD2 3.86Å; V172-Y180 HydrophobicContact CG1-CE2 3.98Å; V172-Y180 HydrophobicContact CG1-CG 4.12Å; V172-Y180 HydrophobicContact CG2-CE1 4.25Å; V172-Y180 HydrophobicContact CG2-CE2 3.81Å; L174-Y180 HydrophobicContact CD2-CD1 4.48Å; H177-Y180 WeakPolarHBondContact O-CB 3.39Å; H177-Y180 PolarHBondContact O-N 3.02Å; H177-Y180 VanDerWaalsContact O-N 3.08Å; P178-Y180 VanDerWaalsContact C-N 3.33Å; Y180-E182 VanDerWaalsContact C-N 3.29Å; Y180-E182 PolarHBondContact O-N 3.26Å; Y180-Y183 PolarHBondContact O-N 3.46Å; Y180-I184 HydrophobicContact CD1-CB 4.04Å; Y180-I184 HydrophobicContact CD1-CG1 4.2Å; Y180-I184 HydrophobicContact CD1-CG2 4.48Å; Y180-I184 HydrophobicContact CD2-CG1 3.98Å; Y180-I184 HydrophobicContact CE1-CB 3.74Å; Y180-I184 HydrophobicContact CE1-CG1 3.91Å; Y180-I184 HydrophobicContact CE1-CG2 3.73Å; Y180-I184 HydrophobicContact CE2-CB 4.44Å; Y180-I184 HydrophobicContact CE2-CG1 3.68Å; Y180-I184 HydrophobicContact CG-CG1 4.23Å; Y180-I184 WeakPolarHBondContact O-CB 3.49Å; Y180-I184 PolarHBondContact O-N 3.49Å; Y180-Y222 AromaticContact CD2-CD1 3.87Å; Y180-Y222 HydrophobicContact CD2-CD1 3.87Å; Y180-Y222 AromaticContact CD2-CD2 3.77Å; Y180-Y222 HydrophobicContact CD2-CD2 3.77Å; Y180-Y222 HydrophobicContact CD2-CE1 4.17Å; Y180-Y222 HydrophobicContact CD2-CE2 4.08Å; Y180-Y222 AromaticContact CD2-CG 3.67Å; Y180-Y222 HydrophobicContact CD2-CG 3.67Å; Y180-Y222 HydrophobicContact CE2-CD1 4.22Å; Y180-Y222 HydrophobicContact CE2-CG 4.04Å
181	A	93.6	Very high	95.2	Very high	70 Å²	70	66.2 Å²	66.2	58%	0.579	35%	0.354	S	S	*	.	H	α-helix	trans	-72.2	-15.8	177.6	0	0	0	0	0	114.1	L174 D179	L174-A181 HydrophobicContact CD2-CB 4.39Å; D179-A181 VanDerWaalsContact C-N 3.25Å; D179-A181 PolarHBondContact O-N 2.99Å
182	E	93.3	Very high	95.2	Very high	151 Å²	151	64.1 Å²	64.1	71%	0.706	34%	0.339	S	S	*	.	H	α-helix	trans	-76.8	-26.8	172.9	-57	-173.7	175	0	0	111.8	D179 Y180	D179-E182 WeakPolarHBondContact O-CB 3.37Å; D179-E182 PolarHBondContact O-N 2.86Å; Y180-E182 VanDerWaalsContact C-N 3.29Å; Y180-E182 PolarHBondContact O-N 3.26Å
183	Y	93.7	Very high	95.3	Very high	101 Å²	101	62 Å²	62	40%	0.396	33%	0.326	S	S	.	.	H	α-helix	trans	-104.2	-31.6	-178.7	-61.4	-80.5	0	0	0	113.8	Y85 D179 Y180 Y222	Y85-Y183 VanDerWaalsContact CE2-O 3.22Å; Y85-Y183 WeakPolarHBondContact CE2-O 3.44Å; D179-Y183 HydrophobicContact CB-CE2 4.11Å; D179-Y183 VanDerWaalsContact O-CD2 3.25Å; D179-Y183 WeakPolarHBondContact O-CD2 3.38Å; Y180-Y183 PolarHBondContact O-N 3.46Å; Y183-Y222 HydrophobicContact CD2-CD2 4.08Å; Y183-Y222 HydrophobicContact CD2-CE2 4.23Å
184	I	95.8	Very high	95.5	Very high	5 Å²	5	62 Å²	62	3%	0.026	32%	0.323	C	S	.	.			trans	-111	97.5	-169.3	-56.4	-51.4	0	0	0	110.9	Y180 P187 N218 I221	Y180-I184 HydrophobicContact CD1-CB 4.04Å; Y180-I184 HydrophobicContact CD1-CG1 4.2Å; Y180-I184 HydrophobicContact CD1-CG2 4.48Å; Y180-I184 HydrophobicContact CD2-CG1 3.98Å; Y180-I184 HydrophobicContact CE1-CB 3.74Å; Y180-I184 HydrophobicContact CE1-CG1 3.91Å; Y180-I184 HydrophobicContact CE1-CG2 3.73Å; Y180-I184 HydrophobicContact CE2-CB 4.44Å; Y180-I184 HydrophobicContact CE2-CG1 3.68Å; Y180-I184 HydrophobicContact CG-CG1 4.23Å; Y180-I184 WeakPolarHBondContact O-CB 3.49Å; Y180-I184 PolarHBondContact O-N 3.49Å; I184-P187 HydrophobicContact CG2-CG 4.4Å; I184-N218 HydrophobicContact CD1-CB 3.87Å; I184-N218 HydrophobicContact CG1-CB 4.32Å; I184-N218 HydrophobicContact CG2-CB 3.86Å; I184-N218 WeakPolarHBondContact CG2-ND2 3.34Å; I184-I221 HydrophobicContact CD1-CB 3.79Å; I184-I221 HydrophobicContact CD1-CD1 3.88Å; I184-I221 HydrophobicContact CD1-CG1 4.48Å; I184-I221 HydrophobicContact CD1-CG2 3.92Å
185	F	92.5	Very high	95.7	Very high	74 Å²	74	63.3 Å²	63.3	33%	0.325	32%	0.324	S	S	.	.	S	Bend	trans	-67.3	-38.5	-179.3	-177.4	-102.4	0	0	0	113.7	G80 R81 D83 P102	G80-F185 VanDerWaalsContact O-CE2 3.23Å; G80-F185 WeakPolarHBondContact O-CE2 3.49Å; G80-F185 WeakPolarHBondContact O-CZ 3.39Å; R81-F185 VanDerWaalsContact C-CZ 3.45Å; D83-F185 HydrophobicContact CB-CB 4.48Å; P102-F185 HydrophobicContact CB-CD1 4.03Å; P102-F185 HydrophobicContact CB-CE1 3.71Å
186	H	94.9	Very high	95.9	Very high	58 Å²	58	57.6 Å²	57.6	27%	0.269	30%	0.299	S	S	.	.	S	Bend	trans	-125.2	86.8	-177.2	-169.2	89.1	0	0	0	111.8	W214 N218	H186-W214 HydrophobicContact CB-CD2 4.08Å; H186-W214 HydrophobicContact CB-CE3 4Å; H186-W214 HydrophobicContact CB-CH2 3.92Å; H186-W214 HydrophobicContact CB-CZ2 3.95Å; H186-W214 HydrophobicContact CB-CZ3 3.93Å; H186-W214 AromaticContact CD2-CD1 3.4Å; H186-W214 AromaticContact CD2-CD2 3.62Å; H186-W214 AromaticContact CD2-CE2 3.48Å; H186-W214 VanDerWaalsContact CD2-CE2 3.48Å; H186-W214 AromaticContact CD2-CG 3.64Å; H186-W214 AromaticContact CD2-NE1 3.29Å; H186-W214 PolarHBondContact CD2-NE1 2.8Å; H186-W214 VanDerWaalsContact CD2-NE1 3.29Å; H186-W214 AromaticContact CG-CE2 3.85Å; H186-W214 AromaticContact NE2-CD1 3.8Å; H186-W214 AromaticContact NE2-NE1 3.67Å; H186-N218 PolarHBondContact O-ND2 3.4Å
187	P	96.4	Very high	96.1	Very high	77 Å²	77	51 Å²	51	50%	0.5	27%	0.268	S	S	.	.			trans	-60.5	140.4	177.3	-23.9	34.7	0	0	0	112.9	I184	I184-P187 HydrophobicContact CG2-CG 4.4Å
188	M	97.9	Very high	96.2	Very high	17 Å²	17	56.2 Å²	56.2	8%	0.084	29%	0.29	C	S	.	.			trans	-152.4	146.1	176.4	-172.1	54.2	63	0	0	110.9	T192 L193 W214 I215	M188-T192 HydrophobicContact CE-CG2 4.14Å; M188-T192 HydrophobicContact SD-CG2 3.82Å; M188-L193 HydrophobicContact SD-CB 4.46Å; M188-L193 HydrophobicContact SD-CD1 4.14Å; M188-W214 HydrophobicContact CB-CB 3.49Å; M188-W214 VanDerWaalsContact CB-CB 3.49Å; M188-W214 HydrophobicContact CB-CG 4.4Å; M188-W214 HydrophobicContact CG-CB 4.04Å; M188-I215 HydrophobicContact CB-CG1 4.22Å; M188-I215 HydrophobicContact CG-CG1 3.9Å
189	D	98.3	Very high	96.3	Very high	5 Å²	5	55.9 Å²	55.9	3%	0.027	28%	0.279	C	S	.	.			trans	-156.2	168.1	-177.6	73.6	93.6	0	0	0	111.4	K170 P171 C191 T192 L193	K170-D189 VanDerWaalsContact C-CB 3.45Å; K170-D189 VanDerWaalsContact CA-OD1 3.3Å; K170-D189 WeakPolarHBondContact CA-OD1 3.28Å; K170-D189 WeakPolarHBondContact O-CB 3.34Å; P171-D189 WeakPolarHBondContact CD-OD2 3.39Å; P171-D189 WeakPolarHBondContact CG-OD2 3.48Å; P171-D189 VanDerWaalsContact N-CG 3.31Å; D189-C191 VanDerWaalsContact C-N 3.3Å; D189-C191 PolarHBondContact O-N 2.84Å; D189-C191 VanDerWaalsContact OD1-CA 3.3Å; D189-C191 WeakPolarHBondContact OD1-CA 3.43Å; D189-C191 WeakPolarHBondContact OD1-CB 3.41Å; D189-C191 PolarHBondContact OD1-N 3.31Å; D189-T192 PolarHBondContact O-N 2.77Å; D189-T192 PolarHBondContact OD1-N 3.25Å; D189-T192 VanDerWaalsContact OD1-N 3.11Å; D189-T192 WeakPolarHBondContact OD2-CB 3.46Å; D189-T192 PolarHBondContact OD2-OG1 2.87Å; D189-L193 WeakPolarHBondContact O-CB 3.17Å; D189-L193 PolarHBondContact O-N 3.2Å
190	L	98.3	Very high	96.5	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-12.2	-175.1	-57.9	171.2	0	0	0	114.7	M160 K161 F168 L193 I215 V236	M160-L190 HydrophobicContact CB-CD2 4.1Å; M160-L190 HydrophobicContact CE-CD2 3.7Å; K161-L190 HydrophobicContact CD-CB 4.49Å; K161-L190 VanDerWaalsContact CE-CB 3.47Å; K161-L190 WeakPolarHBondContact CE-O 3.44Å; K161-L190 HydrophobicContact CG-CB 4.13Å; K161-L190 HydrophobicContact CG-CD1 3.94Å; K161-L190 PolarHBondContact NZ-O 3.39Å; F168-L190 HydrophobicContact CB-CD1 4.37Å; F168-L190 WeakPolarHBondContact O-CB 3.44Å; F168-L190 VanDerWaalsContact O-CG 3.31Å; F168-L190 WeakPolarHBondContact O-CG 3.47Å; F168-L190 PolarHBondContact O-N 3.19Å; L190-L193 HydrophobicContact CD2-CD2 4.42Å; L190-I215 HydrophobicContact CD2-CD1 3.66Å; L190-I215 HydrophobicContact CG-CD1 4.06Å; L190-V236 HydrophobicContact CD1-CG1 4.45Å; L190-V236 HydrophobicContact CD2-CG1 3.96Å
191	C	97.8	Very high	96.6	Very high	42 Å²	42	62.8 Å²	62.8	28%	0.284	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-45.1	167.8	-175.4	0	0	0	0	110.6	Q169 D189 L193 E194 K195	Q169-C191 VanDerWaalsContact O-CB 3.3Å; Q169-C191 WeakPolarHBondContact O-CB 3.16Å; Q169-C191 PolarHBondContact O-N 2.87Å; D189-C191 VanDerWaalsContact C-N 3.3Å; D189-C191 PolarHBondContact O-N 2.84Å; D189-C191 VanDerWaalsContact OD1-CA 3.3Å; D189-C191 WeakPolarHBondContact OD1-CA 3.43Å; D189-C191 WeakPolarHBondContact OD1-CB 3.41Å; D189-C191 PolarHBondContact OD1-N 3.31Å; C191-L193 PolarHBondContact O-N 3.01Å; C191-E194 PolarHBondContact O-N 2.99Å; C191-E194 VanDerWaalsContact O-N 3.12Å; C191-K195 WeakPolarHBondContact O-CG 3.41Å; C191-K195 PolarHBondContact O-N 2.94Å
192	T	98.1	Very high	96.8	Very high	33 Å²	33	59.9 Å²	59.9	20%	0.202	28%	0.284	C	S	.	.	H	α-helix	trans	-61.5	-43.4	174.5	-59.8	0	0	0	0	111.5	M188 D189 E194 K195 N196	M188-T192 HydrophobicContact CE-CG2 4.14Å; M188-T192 HydrophobicContact SD-CG2 3.82Å; D189-T192 PolarHBondContact O-N 2.77Å; D189-T192 PolarHBondContact OD1-N 3.25Å; D189-T192 VanDerWaalsContact OD1-N 3.11Å; D189-T192 WeakPolarHBondContact OD2-CB 3.46Å; D189-T192 PolarHBondContact OD2-OG1 2.87Å; T192-E194 PolarHBondContact O-N 3.24Å; T192-K195 WeakPolarHBondContact O-CB 3.37Å; T192-K195 PolarHBondContact O-N 2.94Å; T192-K195 VanDerWaalsContact O-N 3.13Å; T192-N196 VanDerWaalsContact O-CG 3.28Å; T192-N196 PolarHBondContact O-N 3.47Å; T192-N196 PolarHBondContact O-OD1 3.31Å
193	L	98.2	Very high	96.9	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-59.5	-33.3	173.8	-155.2	77.7	0	0	0	112.7	M160 M188 D189 L190 C191 A197 F208 D211 A212	M160-L193 HydrophobicContact CE-CD2 3.79Å; M188-L193 HydrophobicContact SD-CB 4.46Å; M188-L193 HydrophobicContact SD-CD1 4.14Å; D189-L193 WeakPolarHBondContact O-CB 3.17Å; D189-L193 PolarHBondContact O-N 3.2Å; L190-L193 HydrophobicContact CD2-CD2 4.42Å; C191-L193 PolarHBondContact O-N 3.01Å; L193-A197 WeakPolarHBondContact O-CB 3.45Å; L193-A197 PolarHBondContact O-N 3.3Å; L193-F208 HydrophobicContact CD1-CD2 4.48Å; L193-F208 HydrophobicContact CD1-CE2 4.33Å; L193-F208 HydrophobicContact CD2-CD2 4.36Å; L193-F208 HydrophobicContact CD2-CE1 4.38Å; L193-F208 HydrophobicContact CD2-CE2 3.54Å; L193-F208 HydrophobicContact CD2-CZ 3.54Å; L193-F208 HydrophobicContact CG-CD2 4.2Å; L193-F208 HydrophobicContact CG-CE2 3.6Å; L193-F208 HydrophobicContact CG-CZ 4.16Å; L193-D211 HydrophobicContact CD1-CB 3.91Å; L193-A212 HydrophobicContact CD1-CB 4.44Å; L193-A212 HydrophobicContact CD2-CB 3.94Å
194	E	98.1	Very high	97.1	Very high	47 Å²	47	48.9 Å²	48.9	22%	0.22	24%	0.242	C	C	.	.	H	α-helix	trans	-76	-36.2	175	-164.6	167.2	-160.4	0	0	113.2	I157 Q158 K161 C191 T192 K198	I157-E194 HydrophobicContact CD1-CB 3.92Å; I157-E194 HydrophobicContact CD1-CG 4.11Å; I157-E194 HydrophobicContact CG2-CB 4.17Å; I157-E194 HydrophobicContact CG2-CG 4.33Å; Q158-E194 PolarHBondContact NE2-OE1 2.94Å; K161-E194 IonicContact NZ-OE2 3.54Å; K161-E194 PolarHBondContact NZ-OE2 3.01Å; C191-E194 PolarHBondContact O-N 2.99Å; C191-E194 VanDerWaalsContact O-N 3.12Å; T192-E194 PolarHBondContact O-N 3.24Å; E194-K198 VanDerWaalsContact O-CB 3.27Å; E194-K198 WeakPolarHBondContact O-CB 3.48Å; E194-K198 PolarHBondContact O-N 3.37Å
195	K	97.9	Very high	97.2	Very high	116 Å²	116	48.9 Å²	48.9	50%	0.504	24%	0.243	S	C	.	.	H	α-helix	trans	-61.6	-48.3	170.3	-67.9	173.8	-177.7	178.8	0	110.5	C191 T192 K198 K199	C191-K195 WeakPolarHBondContact O-CG 3.41Å; C191-K195 PolarHBondContact O-N 2.94Å; T192-K195 WeakPolarHBondContact O-CB 3.37Å; T192-K195 PolarHBondContact O-N 2.94Å; T192-K195 VanDerWaalsContact O-N 3.13Å; K195-K198 CarbonylContact O-C 3.57Å; K195-K198 PolarHBondContact O-N 3.46Å; K195-K199 WeakPolarHBondContact O-CB 3.32Å; K195-K199 PolarHBondContact O-N 2.78Å
196	N	98	Very high	97.5	Very high	36 Å²	36	48.3 Å²	48.3	19%	0.193	24%	0.241	C	C	.	.	H	α-helix	trans	-63.5	-44.8	-178.9	-67.7	5.3	0	0	0	111.4	T192 K198 K199 K200 M201 Y202	T192-N196 VanDerWaalsContact O-CG 3.28Å; T192-N196 PolarHBondContact O-N 3.47Å; T192-N196 PolarHBondContact O-OD1 3.31Å; N196-K198 PolarHBondContact O-N 2.99Å; N196-K199 CarbonylContact O-C 3.45Å; N196-K199 PolarHBondContact O-N 3.43Å; N196-K200 PolarHBondContact O-N 3.45Å; N196-M201 HydrophobicContact CB-CB 4.18Å; N196-M201 HydrophobicContact CB-CG 4.19Å; N196-M201 WeakPolarHBondContact O-CB 3.27Å; N196-M201 WeakPolarHBondContact O-CG 3.41Å; N196-M201 PolarHBondContact O-N 3.4Å; N196-Y202 HydrophobicContact CB-CE2 3.6Å; N196-Y202 WeakPolarHBondContact CB-OH 3.47Å; N196-Y202 PolarHBondContact ND2-OH 2.82Å
197	A	97.7	Very high	97.7	Very high	3 Å²	3	46 Å²	46	3%	0.025	23%	0.232	C	C	.	.	H	α-helix	trans	-59.7	-45.7	172.8	0	0	0	0	0	111.6	S150 L153 I157 L193 K199 K200 Y202	S150-A197 WeakPolarHBondContact CB-O 3.15Å; S150-A197 PolarHBondContact OG-O 3.32Å; L153-A197 HydrophobicContact CB-CB 4.17Å; L153-A197 HydrophobicContact CD1-CB 4.45Å; I157-A197 HydrophobicContact CD1-CB 3.95Å; L193-A197 WeakPolarHBondContact O-CB 3.45Å; L193-A197 PolarHBondContact O-N 3.3Å; A197-K199 PolarHBondContact O-N 3.28Å; A197-K200 PolarHBondContact O-N 2.95Å; A197-Y202 HydrophobicContact CB-CD2 4.3Å; A197-Y202 HydrophobicContact CB-CE2 4.4Å
198	K	96.1	Very high	97.8	Very high	174 Å²	174	42.3 Å²	42.3	76%	0.757	21%	0.208	S	C	*	.	H	α-helix	trans	-63.8	-36.3	176.5	-172.6	-170.8	174.4	-165.6	0	112.9	E194 K195 N196 K200	E194-K198 VanDerWaalsContact O-CB 3.27Å; E194-K198 WeakPolarHBondContact O-CB 3.48Å; E194-K198 PolarHBondContact O-N 3.37Å; K195-K198 CarbonylContact O-C 3.57Å; K195-K198 PolarHBondContact O-N 3.46Å; N196-K198 PolarHBondContact O-N 2.99Å; K198-K200 PolarHBondContact O-N 2.95Å
199	K	96.9	Very high	97.8	Very high	92 Å²	92	42.8 Å²	42.8	40%	0.4	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70	-5	172.2	-81.4	-159.8	177.3	-157.3	0	113.5	K195 N196 A197 M201 D440	K195-K199 WeakPolarHBondContact O-CB 3.32Å; K195-K199 PolarHBondContact O-N 2.78Å; N196-K199 CarbonylContact O-C 3.45Å; N196-K199 PolarHBondContact O-N 3.43Å; A197-K199 PolarHBondContact O-N 3.28Å; K199-M201 VanDerWaalsContact C-N 3.34Å; K199-M201 HydrophobicContact CB-CG 3.76Å; K199-M201 HydrophobicContact CB-SD 4.33Å; K199-D440 WeakPolarHBondContact CE-OD1 3.4Å; K199-D440 WeakPolarHBondContact CE-OD2 3.42Å; K199-D440 IonicContact NZ-OD1 2.64Å; K199-D440 PolarHBondContact NZ-OD1 3.19Å; K199-D440 IonicContact NZ-OD2 2.79Å; K199-D440 PolarHBondContact NZ-OD2 3.3Å
200	K	97.6	Very high	97.8	Very high	97 Å²	97	42.6 Å²	42.6	42%	0.422	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	65.7	31.9	-178.6	-54	170.7	-178.4	174.8	0	113.2	I146 E147 N196 A197 K198 Y202	I146-K200 HydrophobicContact CG2-CB 4.02Å; E147-K200 HydrophobicContact CB-CD 4.34Å; E147-K200 WeakPolarHBondContact OE1-CE 3.4Å; E147-K200 IonicContact OE1-NZ 3.89Å; E147-K200 PolarHBondContact OE1-NZ 3.19Å; N196-K200 PolarHBondContact O-N 3.45Å; A197-K200 PolarHBondContact O-N 2.95Å; K198-K200 PolarHBondContact O-N 2.95Å; K200-Y202 PolarHBondContact O-N 3.3Å
201	M	97	Very high	97.8	Very high	120 Å²	120	44.1 Å²	44.1	59%	0.591	22%	0.218	S	C	*	.			trans	-72.8	-3.1	-177.2	-63.1	-64.9	-64.1	0	0	115.5	N196 K199	N196-M201 HydrophobicContact CB-CB 4.18Å; N196-M201 HydrophobicContact CB-CG 4.19Å; N196-M201 WeakPolarHBondContact O-CB 3.27Å; N196-M201 WeakPolarHBondContact O-CG 3.41Å; N196-M201 PolarHBondContact O-N 3.4Å; K199-M201 VanDerWaalsContact C-N 3.34Å; K199-M201 HydrophobicContact CB-CG 3.76Å; K199-M201 HydrophobicContact CB-SD 4.33Å
202	Y	98.2	Very high	97.8	Very high	9 Å²	9	42.1 Å²	42.1	4%	0.035	20%	0.204	C	C	.	.			trans	-121.3	114	-173.1	-59.9	-57.5	0	0	0	109.9	I146 L153 N196 A197 K200 A207 F208 D211	I146-Y202 WeakPolarHBondContact CG2-O 3.41Å; L153-Y202 HydrophobicContact CD1-CD2 3.99Å; L153-Y202 HydrophobicContact CD1-CG 4.35Å; N196-Y202 HydrophobicContact CB-CE2 3.6Å; N196-Y202 WeakPolarHBondContact CB-OH 3.47Å; N196-Y202 PolarHBondContact ND2-OH 2.82Å; A197-Y202 HydrophobicContact CB-CD2 4.3Å; A197-Y202 HydrophobicContact CB-CE2 4.4Å; K200-Y202 PolarHBondContact O-N 3.3Å; Y202-A207 HydrophobicContact CD1-CB 3.96Å; Y202-F208 HydrophobicContact CD1-CB 4.33Å; Y202-F208 HydrophobicContact CD2-CB 4.19Å; Y202-F208 AromaticContact CD2-CD2 3.76Å; Y202-F208 HydrophobicContact CD2-CD2 3.76Å; Y202-F208 HydrophobicContact CD2-CG 4.48Å; Y202-F208 AromaticContact CE2-CD2 3.76Å; Y202-F208 HydrophobicContact CE2-CD2 3.76Å; Y202-F208 HydrophobicContact CG-CB 4.02Å; Y202-F208 HydrophobicContact CG-CD2 4.45Å; Y202-D211 HydrophobicContact CE1-CB 4.03Å; Y202-D211 VanDerWaalsContact CE1-OD2 3.31Å; Y202-D211 WeakPolarHBondContact CE1-OD2 3.25Å; Y202-D211 PolarHBondContact OH-OD2 3.24Å
203	G	95.8	Very high	97.9	Very high	22 Å²	22	42.7 Å²	42.7	23%	0.227	20%	0.204	C	C	.	.	S	Bend	trans	-78.4	-34.4	178.4	0	0	0	0	0	113.1	E132 L149	E132-G203 WeakPolarHBondContact OE1-CA 3.44Å; E132-G203 PolarHBondContact OE1-N 3.09Å; L149-G203 VanDerWaalsContact CD2-O 3.24Å; L149-G203 WeakPolarHBondContact CD2-O 3.42Å
204	C	97.7	Very high	97.9	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	20%	0.204	C	C	.	.	S	Bend	trans	-126.7	171.7	179.7	62	0	0	0	0	113.4	A131 E132 E206 A207	A131-C204 HydrophobicContact CB-CB 3.65Å; E132-C204 HydrophobicContact CG-CB 3.66Å; E132-C204 VanDerWaalsContact CG-SG 3.57Å; E132-C204 PolarHBondContact OE1-N 2.88Å; E132-C204 PolarHBondContact OE1-SG 2.97Å; C204-E206 VanDerWaalsContact C-N 3.33Å; C204-A207 VanDerWaalsContact SG-CB 3.59Å; C204-A207 PolarHBondContact SG-N 3.07Å
205	T	98.3	Very high	97.9	Very high	5 Å²	5	40.7 Å²	40.7	3%	0.031	20%	0.195	C	C	.	.	H	α-helix	trans	-72.9	-27.8	174.1	65.6	0	0	0	0	112.4	M141 L149 F208 L209 M244 I247 E248	M141-T205 HydrophobicContact CE-CG2 3.94Å; L149-T205 HydrophobicContact CD1-CG2 4.04Å; T205-F208 PolarHBondContact O-N 2.78Å; T205-L209 WeakPolarHBondContact O-CB 3.31Å; T205-L209 PolarHBondContact O-N 2.95Å; T205-M244 HydrophobicContact CG2-SD 3.82Å; T205-I247 HydrophobicContact CG2-CB 4.34Å; T205-I247 HydrophobicContact CG2-CG2 3.93Å; T205-E248 WeakPolarHBondContact CB-OE1 3.46Å; T205-E248 HydrophobicContact CG2-CG 4.42Å; T205-E248 WeakPolarHBondContact CG2-OE1 3.48Å; T205-E248 PolarHBondContact OG1-OE1 2.76Å
206	E	98.3	Very high	97.9	Very high	61 Å²	61	36.5 Å²	36.5	29%	0.285	18%	0.178	S	C	.	.	H	α-helix	trans	-62.6	-40.3	175.3	-70.8	78	-179.4	0	0	112.3	K127 I128 A131 C204 L209 A210	K127-E206 HydrophobicContact CB-CG 4.31Å; I128-E206 HydrophobicContact CG1-CB 4.25Å; A131-E206 HydrophobicContact CB-CB 4.49Å; A131-E206 HydrophobicContact CB-CG 4.27Å; A131-E206 VanDerWaalsContact CB-OE2 3.3Å; A131-E206 WeakPolarHBondContact CB-OE2 3.42Å; C204-E206 VanDerWaalsContact C-N 3.33Å; E206-L209 PolarHBondContact O-N 2.92Å; E206-A210 VanDerWaalsContact O-CB 3.26Å; E206-A210 WeakPolarHBondContact O-CB 3.34Å; E206-A210 PolarHBondContact O-N 3.29Å
207	A	98.4	Very high	98	Very high	10 Å²	10	34.9 Å²	34.9	8%	0.083	17%	0.169	C	C	.	.	H	α-helix	trans	-65.1	-47.1	178	0	0	0	0	0	111.4	I128 Y202 C204 L209 A210 D211	I128-A207 HydrophobicContact CD1-CB 4.12Å; I128-A207 HydrophobicContact CG1-CB 4.04Å; I128-A207 HydrophobicContact CG2-CB 4.2Å; Y202-A207 HydrophobicContact CD1-CB 3.96Å; C204-A207 VanDerWaalsContact SG-CB 3.59Å; C204-A207 PolarHBondContact SG-N 3.07Å; A207-L209 VanDerWaalsContact C-N 3.33Å; A207-L209 PolarHBondContact O-N 2.86Å; A207-A210 PolarHBondContact O-N 2.99Å; A207-D211 PolarHBondContact O-N 3.03Å; A207-D211 VanDerWaalsContact O-N 3.09Å
208	F	98.7	Very high	98	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-58.8	-43.8	174.7	176	-98.2	0	0	0	112.1	L153 I157 M160 L193 Y202 T205 D211 A212 C240 M244	L153-F208 HydrophobicContact CB-CD2 4.33Å; L153-F208 HydrophobicContact CB-CE2 4.24Å; L153-F208 HydrophobicContact CD1-CB 4Å; L153-F208 HydrophobicContact CD1-CD2 3.8Å; L153-F208 HydrophobicContact CD1-CG 4Å; L153-F208 HydrophobicContact CD2-CB 3.97Å; L153-F208 HydrophobicContact CD2-CD1 3.73Å; L153-F208 HydrophobicContact CD2-CD2 4.01Å; L153-F208 HydrophobicContact CD2-CE1 4.18Å; L153-F208 HydrophobicContact CD2-CE2 4.43Å; L153-F208 HydrophobicContact CD2-CG 3.63Å; L153-F208 HydrophobicContact CG-CD2 4.26Å; L153-F208 HydrophobicContact CG-CG 4.32Å; I157-F208 HydrophobicContact CD1-CE2 3.91Å; I157-F208 HydrophobicContact CD1-CZ 4.19Å; I157-F208 HydrophobicContact CG1-CE2 3.9Å; I157-F208 HydrophobicContact CG1-CZ 3.65Å; M160-F208 HydrophobicContact CE-CZ 4.48Å; M160-F208 HydrophobicContact SD-CE1 4.09Å; M160-F208 HydrophobicContact SD-CZ 4.06Å; L193-F208 HydrophobicContact CD1-CD2 4.48Å; L193-F208 HydrophobicContact CD1-CE2 4.33Å; L193-F208 HydrophobicContact CD2-CD2 4.36Å; L193-F208 HydrophobicContact CD2-CE1 4.38Å; L193-F208 HydrophobicContact CD2-CE2 3.54Å; L193-F208 HydrophobicContact CD2-CZ 3.54Å; L193-F208 HydrophobicContact CG-CD2 4.2Å; L193-F208 HydrophobicContact CG-CE2 3.6Å; L193-F208 HydrophobicContact CG-CZ 4.16Å; Y202-F208 HydrophobicContact CD1-CB 4.33Å; Y202-F208 HydrophobicContact CD2-CB 4.19Å; Y202-F208 AromaticContact CD2-CD2 3.76Å; Y202-F208 HydrophobicContact CD2-CD2 3.76Å; Y202-F208 HydrophobicContact CD2-CG 4.48Å; Y202-F208 AromaticContact CE2-CD2 3.76Å; Y202-F208 HydrophobicContact CE2-CD2 3.76Å; Y202-F208 HydrophobicContact CG-CB 4.02Å; Y202-F208 HydrophobicContact CG-CD2 4.45Å; T205-F208 PolarHBondContact O-N 2.78Å; F208-D211 PolarHBondContact O-N 3.39Å; F208-A212 WeakPolarHBondContact O-CB 3.06Å; F208-A212 PolarHBondContact O-N 2.78Å; F208-C240 WeakPolarHBondContact CE1-SG 3.47Å; F208-M244 HydrophobicContact CD1-CE 3.74Å; F208-M244 HydrophobicContact CD1-CG 4.23Å; F208-M244 HydrophobicContact CD1-SD 3.51Å; F208-M244 VanDerWaalsContact CD1-SD 3.51Å; F208-M244 HydrophobicContact CE1-CE 3.65Å; F208-M244 HydrophobicContact CE1-SD 4.08Å; F208-M244 HydrophobicContact CG-SD 4.37Å
209	L	98.6	Very high	98.1	Very high	27 Å²	27	26.7 Å²	26.7	14%	0.141	13%	0.133	C	C	.	.	H	α-helix	trans	-69.1	-35.9	177.4	176.7	60.8	0	0	0	112.5	T205 E206 A207 D211 A212 K213 I237 C240 E241 M244	T205-L209 WeakPolarHBondContact O-CB 3.31Å; T205-L209 PolarHBondContact O-N 2.95Å; E206-L209 PolarHBondContact O-N 2.92Å; A207-L209 VanDerWaalsContact C-N 3.33Å; A207-L209 PolarHBondContact O-N 2.86Å; L209-D211 VanDerWaalsContact C-N 3.29Å; L209-D211 PolarHBondContact O-N 2.94Å; L209-A212 PolarHBondContact O-N 3.35Å; L209-K213 WeakPolarHBondContact O-CD 3.27Å; L209-K213 VanDerWaalsContact O-CG 3.25Å; L209-K213 WeakPolarHBondContact O-CG 3.46Å; L209-K213 PolarHBondContact O-N 3.08Å; L209-K213 VanDerWaalsContact O-N 3.1Å; L209-I237 HydrophobicContact CD1-CG2 4.31Å; L209-C240 HydrophobicContact CD1-CB 4.07Å; L209-E241 HydrophobicContact CD1-CG 3.74Å; L209-E241 HydrophobicContact CD2-CG 4.09Å; L209-M244 HydrophobicContact CB-CG 4.42Å
210	A	98.3	Very high	98.2	Very high	1 Å²	1	23.3 Å²	23.3	1%	0.008	12%	0.119	C	C	.	.	H	α-helix	trans	-62.9	-35.9	175.8	0	0	0	0	0	112	W87 R103 E124 I128 E206 A207	W87-A210 WeakPolarHBondContact CH2-O 3.49Å; W87-A210 WeakPolarHBondContact CZ2-O 3.48Å; R103-A210 PolarHBondContact NH2-O 3.33Å; E124-A210 HydrophobicContact CB-CB 4.38Å; I128-A210 HydrophobicContact CD1-CB 4.01Å; E206-A210 VanDerWaalsContact O-CB 3.26Å; E206-A210 WeakPolarHBondContact O-CB 3.34Å; E206-A210 PolarHBondContact O-N 3.29Å; A207-A210 PolarHBondContact O-N 2.99Å
211	D	98.3	Very high	98.2	Very high	32 Å²	32	19.9 Å²	19.9	17%	0.171	11%	0.105	C	C	.	.	H	α-helix	trans	-79.5	-41.6	174.5	-86.7	11.3	0	0	0	112.9	R103 L193 Y202 A207 F208 L209 K213 W214	R103-D211 IonicContact NH2-OD1 2.95Å; R103-D211 PolarHBondContact NH2-OD1 3.3Å; L193-D211 HydrophobicContact CD1-CB 3.91Å; Y202-D211 HydrophobicContact CE1-CB 4.03Å; Y202-D211 VanDerWaalsContact CE1-OD2 3.31Å; Y202-D211 WeakPolarHBondContact CE1-OD2 3.25Å; Y202-D211 PolarHBondContact OH-OD2 3.24Å; A207-D211 PolarHBondContact O-N 3.03Å; A207-D211 VanDerWaalsContact O-N 3.09Å; F208-D211 PolarHBondContact O-N 3.39Å; L209-D211 VanDerWaalsContact C-N 3.29Å; L209-D211 PolarHBondContact O-N 2.94Å; D211-K213 PolarHBondContact O-N 2.99Å; D211-K213 VanDerWaalsContact O-N 3.14Å; D211-W214 WeakPolarHBondContact O-CB 3.36Å; D211-W214 PolarHBondContact O-N 3.19Å
212	A	98.7	Very high	98.3	Very high	0 Å²	0	16.7 Å²	16.7	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-53.1	-38.6	174.5	0	0	0	0	0	111.6	M160 L193 F208 L209 W214 I215 I237 C240	M160-A212 HydrophobicContact CE-CB 4.07Å; L193-A212 HydrophobicContact CD1-CB 4.44Å; L193-A212 HydrophobicContact CD2-CB 3.94Å; F208-A212 WeakPolarHBondContact O-CB 3.06Å; F208-A212 PolarHBondContact O-N 2.78Å; L209-A212 PolarHBondContact O-N 3.35Å; A212-W214 PolarHBondContact O-N 3.07Å; A212-I215 VanDerWaalsContact O-CB 3.31Å; A212-I215 WeakPolarHBondContact O-CB 3.37Å; A212-I215 WeakPolarHBondContact O-CG1 3.32Å; A212-I215 PolarHBondContact O-N 2.86Å; A212-I215 VanDerWaalsContact O-N 3.11Å; A212-I237 HydrophobicContact CB-CD1 4.27Å; A212-I237 WeakPolarHBondContact O-CD1 3.44Å; A212-C240 HydrophobicContact CB-CB 4.47Å
213	K	98.6	Very high	98.2	Very high	44 Å²	44	18.7 Å²	18.7	19%	0.191	10%	0.098	C	C	.	.	H	α-helix	trans	-58.1	-25.7	176	-77.5	164.3	-175.8	162.7	0	114.5	W87 E124 L209 D211 I215 L216 H217 I237	W87-K213 HydrophobicContact CH2-CB 3.79Å; W87-K213 HydrophobicContact CZ2-CB 3.51Å; W87-K213 HydrophobicContact CZ2-CD 4.01Å; W87-K213 HydrophobicContact CZ2-CG 4.42Å; E124-K213 WeakPolarHBondContact OE1-CD 3.4Å; E124-K213 IonicContact OE1-NZ 2.61Å; E124-K213 PolarHBondContact OE1-NZ 3.42Å; E124-K213 IonicContact OE2-NZ 3.33Å; E124-K213 PolarHBondContact OE2-NZ 2.98Å; L209-K213 WeakPolarHBondContact O-CD 3.27Å; L209-K213 VanDerWaalsContact O-CG 3.25Å; L209-K213 WeakPolarHBondContact O-CG 3.46Å; L209-K213 PolarHBondContact O-N 3.08Å; L209-K213 VanDerWaalsContact O-N 3.1Å; D211-K213 PolarHBondContact O-N 2.99Å; D211-K213 VanDerWaalsContact O-N 3.14Å; K213-I215 PolarHBondContact O-N 3.01Å; K213-L216 PolarHBondContact O-N 2.77Å; K213-L216 VanDerWaalsContact O-N 3.07Å; K213-H217 WeakPolarHBondContact O-CB 3.28Å; K213-H217 PolarHBondContact O-N 2.98Å; K213-I237 HydrophobicContact CG-CG2 4.27Å
214	W	98.6	Very high	98.3	Very high	1 Å²	1	19.2 Å²	19.2	0%	0.004	10%	0.104	C	C	.	.	H	α-helix	trans	-57.5	-37.7	174	-79.7	118.3	0	0	0	111.7	D83 W87 P102 R103 H186 M188 D211 A212 L216 H217 N218	D83-W214 HydrophobicContact CB-CH2 4.33Å; D83-W214 VanDerWaalsContact OD2-CZ3 3.3Å; D83-W214 WeakPolarHBondContact OD2-CZ3 3.43Å; W87-W214 HydrophobicContact CE3-CH2 4.32Å; W87-W214 HydrophobicContact CE3-CZ3 4.34Å; W87-W214 AromaticContact CH2-CD2 3.86Å; W87-W214 HydrophobicContact CH2-CD2 3.86Å; W87-W214 AromaticContact CH2-CE2 3.97Å; W87-W214 HydrophobicContact CH2-CE3 4.35Å; W87-W214 AromaticContact CH2-CG 3.99Å; W87-W214 HydrophobicContact CH2-CG 3.99Å; W87-W214 AromaticContact CZ3-CD2 3.52Å; W87-W214 HydrophobicContact CZ3-CD2 3.52Å; W87-W214 AromaticContact CZ3-CE2 3.69Å; W87-W214 AromaticContact CZ3-CE3 3.59Å; W87-W214 HydrophobicContact CZ3-CE3 3.59Å; W87-W214 HydrophobicContact CZ3-CG 4.12Å; W87-W214 AromaticContact CZ3-CH2 3.91Å; W87-W214 HydrophobicContact CZ3-CH2 3.91Å; W87-W214 AromaticContact CZ3-CZ2 3.88Å; W87-W214 HydrophobicContact CZ3-CZ2 3.88Å; W87-W214 AromaticContact CZ3-CZ3 3.78Å; W87-W214 HydrophobicContact CZ3-CZ3 3.78Å; P102-W214 HydrophobicContact CG-CZ2 4.05Å; R103-W214 HydrophobicContact CG-CH2 4.01Å; R103-W214 HydrophobicContact CG-CZ2 3.48Å; R103-W214 VanDerWaalsContact CG-CZ2 3.48Å; R103-W214 VanDerWaalsContact NH2-NE1 3.11Å; H186-W214 HydrophobicContact CB-CD2 4.08Å; H186-W214 HydrophobicContact CB-CE3 4Å; H186-W214 HydrophobicContact CB-CH2 3.92Å; H186-W214 HydrophobicContact CB-CZ2 3.95Å; H186-W214 HydrophobicContact CB-CZ3 3.93Å; H186-W214 AromaticContact CD2-CD1 3.4Å; H186-W214 AromaticContact CD2-CD2 3.62Å; H186-W214 AromaticContact CD2-CE2 3.48Å; H186-W214 VanDerWaalsContact CD2-CE2 3.48Å; H186-W214 AromaticContact CD2-CG 3.64Å; H186-W214 AromaticContact CD2-NE1 3.29Å; H186-W214 PolarHBondContact CD2-NE1 2.8Å; H186-W214 VanDerWaalsContact CD2-NE1 3.29Å; H186-W214 AromaticContact CG-CE2 3.85Å; H186-W214 AromaticContact NE2-CD1 3.8Å; H186-W214 AromaticContact NE2-NE1 3.67Å; M188-W214 HydrophobicContact CB-CB 3.49Å; M188-W214 VanDerWaalsContact CB-CB 3.49Å; M188-W214 HydrophobicContact CB-CG 4.4Å; M188-W214 HydrophobicContact CG-CB 4.04Å; D211-W214 WeakPolarHBondContact O-CB 3.36Å; D211-W214 PolarHBondContact O-N 3.19Å; A212-W214 PolarHBondContact O-N 3.07Å; W214-L216 PolarHBondContact O-N 3.05Å; W214-H217 HydrophobicContact CE3-CB 4.45Å; W214-H217 PolarHBondContact O-N 2.96Å; W214-N218 VanDerWaalsContact O-CB 3.25Å; W214-N218 WeakPolarHBondContact O-CB 3.41Å; W214-N218 PolarHBondContact O-N 3.21Å; W214-N218 PolarHBondContact O-ND2 2.78Å; W214-N218 PolarHBondContact O-OD1 3.41Å
215	I	98.6	Very high	98.2	Very high	4 Å²	4	20.4 Å²	20.4	2%	0.021	12%	0.117	C	C	.	.	H	α-helix	trans	-56.2	-42	177	-54	176.6	0	0	0	110.6	F168 M188 L190 A212 K213 C219	F168-I215 HydrophobicContact CB-CG2 3.9Å; F168-I215 HydrophobicContact CD1-CG2 3.49Å; F168-I215 VanDerWaalsContact CD1-CG2 3.49Å; F168-I215 HydrophobicContact CE1-CG2 4.19Å; F168-I215 HydrophobicContact CG-CG2 3.8Å; M188-I215 HydrophobicContact CB-CG1 4.22Å; M188-I215 HydrophobicContact CG-CG1 3.9Å; L190-I215 HydrophobicContact CD2-CD1 3.66Å; L190-I215 HydrophobicContact CG-CD1 4.06Å; A212-I215 VanDerWaalsContact O-CB 3.31Å; A212-I215 WeakPolarHBondContact O-CB 3.37Å; A212-I215 WeakPolarHBondContact O-CG1 3.32Å; A212-I215 PolarHBondContact O-N 2.86Å; A212-I215 VanDerWaalsContact O-N 3.11Å; K213-I215 PolarHBondContact O-N 3.01Å; I215-C219 WeakPolarHBondContact O-CB 3.29Å; I215-C219 PolarHBondContact O-N 3.28Å
216	L	98.6	Very high	98.1	Very high	28 Å²	28	27.6 Å²	27.6	15%	0.147	16%	0.155	C	C	.	.	H	α-helix	trans	-77	-43	177	175.1	59.2	0	0	0	112.4	K213 W214 C219 I220 T230 A233 K234 I237	K213-L216 PolarHBondContact O-N 2.77Å; K213-L216 VanDerWaalsContact O-N 3.07Å; W214-L216 PolarHBondContact O-N 3.05Å; L216-C219 PolarHBondContact O-N 3.12Å; L216-I220 HydrophobicContact CD1-CD1 3.72Å; L216-I220 HydrophobicContact CD1-CG1 3.96Å; L216-I220 HydrophobicContact CG-CD1 3.86Å; L216-I220 HydrophobicContact CG-CG1 4.49Å; L216-I220 VanDerWaalsContact O-CG1 3.3Å; L216-I220 WeakPolarHBondContact O-CG1 3.43Å; L216-I220 PolarHBondContact O-N 2.91Å; L216-T230 HydrophobicContact CD1-CG2 4.06Å; L216-A233 HydrophobicContact CB-CB 4.29Å; L216-A233 HydrophobicContact CD1-CB 3.72Å; L216-K234 HydrophobicContact CD1-CG 3.64Å; L216-K234 HydrophobicContact CD2-CG 4.1Å; L216-I237 HydrophobicContact CB-CD1 4.14Å; L216-I237 HydrophobicContact CB-CG1 3.57Å; L216-I237 HydrophobicContact CD2-CB 4.32Å; L216-I237 HydrophobicContact CD2-CG1 3.75Å; L216-I237 HydrophobicContact CG-CG1 4.28Å
217	H	98.6	Very high	98.1	Very high	2 Å²	2	28.6 Å²	28.6	1%	0.009	16%	0.159	C	C	.	.	H	α-helix	trans	-57.1	-54	179.7	-172.9	97.2	0	0	0	110.7	D83 W87 H90 K213 W214 C219 I220 I221	D83-H217 IonicContact OD2-CD2 3.97Å; D83-H217 IonicContact OD2-NE2 3.17Å; D83-H217 PolarHBondContact OD2-NE2 2.71Å; W87-H217 VanDerWaalsContact CA-CE1 3.44Å; W87-H217 WeakPolarHBondContact CA-CE1 3.48Å; W87-H217 HydrophobicContact CE3-CB 4.32Å; W87-H217 AromaticContact CE3-CE1 3.93Å; W87-H217 AromaticContact CE3-CG 3.82Å; W87-H217 AromaticContact CE3-ND1 3.39Å; W87-H217 HydrophobicContact CZ3-CB 3.94Å; W87-H217 AromaticContact CZ3-CG 3.86Å; W87-H217 AromaticContact CZ3-ND1 3.91Å; W87-H217 PolarHBondContact O-ND1 3.45Å; H90-H217 AromaticContact CE1-ND1 3.54Å; H90-H217 AromaticContact ND1-CE1 3.5Å; H90-H217 PolarHBondContact ND1-CE1 3.41Å; H90-H217 AromaticContact ND1-CG 3.55Å; H90-H217 AromaticContact ND1-ND1 2.99Å; H90-H217 PolarHBondContact ND1-ND1 3.35Å; K213-H217 WeakPolarHBondContact O-CB 3.28Å; K213-H217 PolarHBondContact O-N 2.98Å; W214-H217 HydrophobicContact CE3-CB 4.45Å; W214-H217 PolarHBondContact O-N 2.96Å; H217-C219 VanDerWaalsContact C-N 3.33Å; H217-C219 PolarHBondContact O-N 3.13Å; H217-I220 PolarHBondContact O-N 3.09Å; H217-I220 VanDerWaalsContact O-N 3.09Å; H217-I221 VanDerWaalsContact CD2-CD1 3.42Å; H217-I221 WeakPolarHBondContact CD2-CD1 3.32Å; H217-I221 WeakPolarHBondContact NE2-CD1 3.27Å; H217-I221 PolarHBondContact O-N 2.79Å; H217-I221 VanDerWaalsContact O-N 3.11Å
218	N	98.4	Very high	98	Very high	1 Å²	1	35.7 Å²	35.7	1%	0.005	19%	0.188	C	C	.	.	H	α-helix	trans	-61.6	-40.9	178.2	-60.8	-14.8	0	0	0	111.9	I184 H186 W214 I220 I221 Y222	I184-N218 HydrophobicContact CD1-CB 3.87Å; I184-N218 HydrophobicContact CG1-CB 4.32Å; I184-N218 HydrophobicContact CG2-CB 3.86Å; I184-N218 WeakPolarHBondContact CG2-ND2 3.34Å; H186-N218 PolarHBondContact O-ND2 3.4Å; W214-N218 VanDerWaalsContact O-CB 3.25Å; W214-N218 WeakPolarHBondContact O-CB 3.41Å; W214-N218 PolarHBondContact O-N 3.21Å; W214-N218 PolarHBondContact O-ND2 2.78Å; W214-N218 PolarHBondContact O-OD1 3.41Å; N218-I220 VanDerWaalsContact C-N 3.32Å; N218-I220 PolarHBondContact O-N 3.19Å; N218-I221 PolarHBondContact O-N 2.92Å; N218-Y222 PolarHBondContact O-N 2.65Å
219	C	98.4	Very high	97.9	Very high	4 Å²	4	38.1 Å²	38.1	3%	0.027	20%	0.201	C	C	.	.	H	α-helix	trans	-62.1	-38.9	175.6	-174.3	0	0	0	0	111.9	F168 I215 L216 H217 N223 L229 T230 A233	F168-C219 HydrophobicContact CE1-CB 3.99Å; F168-C219 HydrophobicContact CZ-CB 4.29Å; I215-C219 WeakPolarHBondContact O-CB 3.29Å; I215-C219 PolarHBondContact O-N 3.28Å; L216-C219 PolarHBondContact O-N 3.12Å; H217-C219 VanDerWaalsContact C-N 3.33Å; H217-C219 PolarHBondContact O-N 3.13Å; C219-N223 WeakPolarHBondContact O-CB 3.43Å; C219-N223 PolarHBondContact O-N 3.17Å; C219-N223 VanDerWaalsContact O-N 3.1Å; C219-N223 PolarHBondContact O-ND2 3.4Å; C219-N223 VanDerWaalsContact O-ND2 3.09Å; C219-L229 VanDerWaalsContact SG-C 3.58Å; C219-T230 VanDerWaalsContact SG-CA 3.55Å; C219-T230 PolarHBondContact SG-N 2.99Å; C219-T230 VanDerWaalsContact SG-N 3.38Å; C219-A233 HydrophobicContact CB-CB 4.21Å
220	I	98.4	Very high	97.9	Very high	21 Å²	21	36.9 Å²	36.9	11%	0.108	19%	0.194	C	C	.	.	H	α-helix	trans	-68.4	-39.7	178.1	-67.2	166	0	0	0	111.8	H90 L216 H217 N218 G224 T230	H90-I220 HydrophobicContact CB-CB 3.88Å; H90-I220 HydrophobicContact CB-CG2 3.34Å; H90-I220 WeakPolarHBondContact CD2-CD1 3.44Å; H90-I220 WeakPolarHBondContact NE2-CD1 3.4Å; L216-I220 HydrophobicContact CD1-CD1 3.72Å; L216-I220 HydrophobicContact CD1-CG1 3.96Å; L216-I220 HydrophobicContact CG-CD1 3.86Å; L216-I220 HydrophobicContact CG-CG1 4.49Å; L216-I220 VanDerWaalsContact O-CG1 3.3Å; L216-I220 WeakPolarHBondContact O-CG1 3.43Å; L216-I220 PolarHBondContact O-N 2.91Å; H217-I220 PolarHBondContact O-N 3.09Å; H217-I220 VanDerWaalsContact O-N 3.09Å; N218-I220 VanDerWaalsContact C-N 3.32Å; N218-I220 PolarHBondContact O-N 3.19Å; I220-G224 CarbonylContact O-C 3.49Å; I220-G224 WeakPolarHBondContact O-CA 3.29Å; I220-G224 PolarHBondContact O-N 3.07Å; I220-T230 HydrophobicContact CD1-CG2 4.29Å; I220-T230 HydrophobicContact CG1-CG2 3.45Å; I220-T230 VanDerWaalsContact CG1-CG2 3.45Å
221	I	98	Very high	97.9	Very high	25 Å²	25	41 Å²	41	13%	0.128	21%	0.213	C	C	.	.	H	α-helix	trans	-63.2	-65.9	176.2	-61.4	159.9	0	0	0	109.7	Y85 I184 H217 N218 N223	Y85-I221 HydrophobicContact CD1-CD1 4.22Å; Y85-I221 HydrophobicContact CD1-CG1 3.9Å; Y85-I221 HydrophobicContact CD1-CG2 4.05Å; Y85-I221 HydrophobicContact CD2-CD1 3.6Å; Y85-I221 HydrophobicContact CD2-CG1 4.16Å; Y85-I221 HydrophobicContact CD2-CG2 4.14Å; Y85-I221 HydrophobicContact CE1-CG2 3.82Å; Y85-I221 HydrophobicContact CE2-CD1 4.4Å; Y85-I221 HydrophobicContact CE2-CG2 3.93Å; Y85-I221 HydrophobicContact CG-CD1 3.51Å; Y85-I221 HydrophobicContact CG-CG1 3.71Å; Y85-I221 HydrophobicContact CG-CG2 4.22Å; I184-I221 HydrophobicContact CD1-CB 3.79Å; I184-I221 HydrophobicContact CD1-CD1 3.88Å; I184-I221 HydrophobicContact CD1-CG1 4.48Å; I184-I221 HydrophobicContact CD1-CG2 3.92Å; H217-I221 VanDerWaalsContact CD2-CD1 3.42Å; H217-I221 WeakPolarHBondContact CD2-CD1 3.32Å; H217-I221 WeakPolarHBondContact NE2-CD1 3.27Å; H217-I221 PolarHBondContact O-N 2.79Å; H217-I221 VanDerWaalsContact O-N 3.11Å; N218-I221 PolarHBondContact O-N 2.92Å; I221-N223 VanDerWaalsContact C-N 3.31Å; I221-N223 PolarHBondContact O-N 2.81Å
222	Y	98	Very high	97.9	Very high	53 Å²	53	41.6 Å²	41.6	21%	0.208	22%	0.216	C	C	.	.	H	α-helix	trans	-68.9	-27.7	-167.9	-172.2	-100	0	0	0	113.3	H177 D179 Y180 Y183 N218	H177-Y222 HydrophobicContact CB-CE1 4.31Å; H177-Y222 WeakPolarHBondContact CB-OH 3.4Å; H177-Y222 AromaticContact CG-CE1 3.96Å; H177-Y222 AromaticContact ND1-CE1 3.41Å; H177-Y222 WeakPolarHBondContact ND1-CE1 3.44Å; H177-Y222 AromaticContact ND1-CZ 3.57Å; H177-Y222 PolarHBondContact ND1-OH 2.89Å; D179-Y222 WeakPolarHBondContact OD1-CE2 3.02Å; D179-Y222 PolarHBondContact OD1-OH 2.78Å; Y180-Y222 AromaticContact CD2-CD1 3.87Å; Y180-Y222 HydrophobicContact CD2-CD1 3.87Å; Y180-Y222 AromaticContact CD2-CD2 3.77Å; Y180-Y222 HydrophobicContact CD2-CD2 3.77Å; Y180-Y222 HydrophobicContact CD2-CE1 4.17Å; Y180-Y222 HydrophobicContact CD2-CE2 4.08Å; Y180-Y222 AromaticContact CD2-CG 3.67Å; Y180-Y222 HydrophobicContact CD2-CG 3.67Å; Y180-Y222 HydrophobicContact CE2-CD1 4.22Å; Y180-Y222 HydrophobicContact CE2-CG 4.04Å; Y183-Y222 HydrophobicContact CD2-CD2 4.08Å; Y183-Y222 HydrophobicContact CD2-CE2 4.23Å; N218-Y222 PolarHBondContact O-N 2.65Å
223	N	97.2	Very high	97.9	Very high	51 Å²	51	41.6 Å²	41.6	27%	0.273	22%	0.216	S	C	.	.	H	α-helix	trans	-106.5	-15.8	-177.5	-58.1	-113.7	0	0	0	114.1	C219 I221 H227 L229	C219-N223 WeakPolarHBondContact O-CB 3.43Å; C219-N223 PolarHBondContact O-N 3.17Å; C219-N223 VanDerWaalsContact O-N 3.1Å; C219-N223 PolarHBondContact O-ND2 3.4Å; C219-N223 VanDerWaalsContact O-ND2 3.09Å; I221-N223 VanDerWaalsContact C-N 3.31Å; I221-N223 PolarHBondContact O-N 2.81Å; N223-H227 HydrophobicContact CB-CB 3.65Å; N223-H227 WeakPolarHBondContact CB-ND1 3.1Å; N223-H227 WeakPolarHBondContact O-CB 3.18Å; N223-H227 PolarHBondContact OD1-CE1 2.95Å; N223-H227 PolarHBondContact OD1-ND1 2.91Å; N223-L229 WeakPolarHBondContact OD1-CD1 3.35Å
224	G	96.8	Very high	97.8	Very high	33 Å²	33	42.9 Å²	42.9	34%	0.34	22%	0.222	S	C	.	.			trans	76.7	137.9	-166.7	0	0	0	0	0	113.3	I220 N226 H227 T230	I220-G224 CarbonylContact O-C 3.49Å; I220-G224 WeakPolarHBondContact O-CA 3.29Å; I220-G224 PolarHBondContact O-N 3.07Å; G224-N226 PolarHBondContact O-N 3.16Å; G224-H227 WeakPolarHBondContact O-CB 3.12Å; G224-H227 PolarHBondContact O-N 2.72Å; G224-T230 PolarHBondContact O-OG1 3.31Å
225	G	96.2	Very high	97.8	Very high	26 Å²	26	46 Å²	46	27%	0.268	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-7.3	-168.3	0	0	0	0	0	118.7	K234	G225-K234 PolarHBondContact O-NZ 3.36Å
226	N	96	Very high	97.8	Very high	156 Å²	156	45.8 Å²	45.8	83%	0.834	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-99.9	-6.7	177	-71.9	-24.4	0	0	0	113.6	G224	G224-N226 PolarHBondContact O-N 3.16Å
227	H	97.9	Very high	97.8	Very high	82 Å²	82	44.8 Å²	44.8	38%	0.38	23%	0.234	S	C	.	.	S	Bend	trans	-65.4	155.1	-175.8	-169.5	-134.7	0	0	0	112.8	N223 G224 L229 T230 Q231	N223-H227 HydrophobicContact CB-CB 3.65Å; N223-H227 WeakPolarHBondContact CB-ND1 3.1Å; N223-H227 WeakPolarHBondContact O-CB 3.18Å; N223-H227 PolarHBondContact OD1-CE1 2.95Å; N223-H227 PolarHBondContact OD1-ND1 2.91Å; G224-H227 WeakPolarHBondContact O-CB 3.12Å; G224-H227 PolarHBondContact O-N 2.72Å; H227-L229 VanDerWaalsContact C-N 3.3Å; H227-L229 PolarHBondContact O-N 2.94Å; H227-T230 WeakPolarHBondContact O-CB 3.39Å; H227-T230 PolarHBondContact O-N 2.87Å; H227-T230 VanDerWaalsContact O-N 3.1Å; H227-Q231 PolarHBondContact O-N 3.15Å
228	K	96.9	Very high	97.8	Very high	159 Å²	159	51.4 Å²	51.4	69%	0.691	26%	0.263	S	S	*	.	H	α-helix	trans	-60.9	-40	179.5	-172.3	-175.4	175.6	-168.6	0	111.6	T230 Q231 I232	K228-T230 VanDerWaalsContact C-N 3.3Å; K228-T230 PolarHBondContact O-N 3.29Å; K228-Q231 PolarHBondContact O-N 2.98Å; K228-Q231 VanDerWaalsContact O-N 3.17Å; K228-I232 PolarHBondContact O-N 3.42Å
229	L	97.3	Very high	97.8	Very high	51 Å²	51	52.8 Å²	52.8	27%	0.267	27%	0.27	S	S	.	.	H	α-helix	trans	-60.8	-40	175.3	-66.5	-176.4	0	0	0	111.2	A167 F168 C219 N223 H227 Q231 I232 A233	A167-L229 HydrophobicContact CB-CD1 4.45Å; A167-L229 HydrophobicContact CB-CD2 3.67Å; F168-L229 HydrophobicContact CZ-CB 3.96Å; F168-L229 WeakPolarHBondContact CZ-O 3.48Å; C219-L229 VanDerWaalsContact SG-C 3.58Å; N223-L229 WeakPolarHBondContact OD1-CD1 3.35Å; H227-L229 VanDerWaalsContact C-N 3.3Å; H227-L229 PolarHBondContact O-N 2.94Å; L229-Q231 VanDerWaalsContact C-N 3.29Å; L229-Q231 PolarHBondContact O-N 3.28Å; L229-I232 HydrophobicContact CD2-CD1 4.35Å; L229-I232 CarbonylContact O-C 3.36Å; L229-I232 WeakPolarHBondContact O-CA 3.43Å; L229-I232 WeakPolarHBondContact O-CB 3.31Å; L229-I232 PolarHBondContact O-N 2.92Å; L229-A233 PolarHBondContact O-N 3.13Å
230	T	98.2	Very high	97.8	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-61.8	-35.4	175.8	-47.6	0	0	0	0	112.9	L216 C219 I220 G224 H227 K228 I232 A233 K234	L216-T230 HydrophobicContact CD1-CG2 4.06Å; C219-T230 VanDerWaalsContact SG-CA 3.55Å; C219-T230 PolarHBondContact SG-N 2.99Å; C219-T230 VanDerWaalsContact SG-N 3.38Å; I220-T230 HydrophobicContact CD1-CG2 4.29Å; I220-T230 HydrophobicContact CG1-CG2 3.45Å; I220-T230 VanDerWaalsContact CG1-CG2 3.45Å; G224-T230 PolarHBondContact O-OG1 3.31Å; H227-T230 WeakPolarHBondContact O-CB 3.39Å; H227-T230 PolarHBondContact O-N 2.87Å; H227-T230 VanDerWaalsContact O-N 3.1Å; K228-T230 VanDerWaalsContact C-N 3.3Å; K228-T230 PolarHBondContact O-N 3.29Å; T230-I232 VanDerWaalsContact C-N 3.31Å; T230-A233 PolarHBondContact O-N 3.29Å; T230-K234 HydrophobicContact CG2-CD 4.2Å; T230-K234 WeakPolarHBondContact O-CB 3.38Å; T230-K234 VanDerWaalsContact O-CG 3.24Å; T230-K234 WeakPolarHBondContact O-CG 3.37Å; T230-K234 PolarHBondContact O-N 3.37Å
231	Q	98.1	Very high	97.8	Very high	88 Å²	88	55.9 Å²	55.9	41%	0.411	28%	0.284	S	S	.	.	H	α-helix	trans	-66.6	-35.2	174.8	-56.1	-59	-38.2	0	0	111.5	H227 K228 L229 V235	H227-Q231 PolarHBondContact O-N 3.15Å; K228-Q231 PolarHBondContact O-N 2.98Å; K228-Q231 VanDerWaalsContact O-N 3.17Å; L229-Q231 VanDerWaalsContact C-N 3.29Å; L229-Q231 PolarHBondContact O-N 3.28Å; Q231-V235 WeakPolarHBondContact O-CG2 3.46Å; Q231-V235 PolarHBondContact O-N 3.47Å
232	I	97.9	Very high	97.8	Very high	44 Å²	44	59.5 Å²	59.5	23%	0.226	30%	0.3	C	S	.	.	H	α-helix	trans	-70.5	-45.6	175.2	-62.6	164.4	0	0	0	110.2	G164 T165 F168 K228 L229 T230 K234 V235 V236	G164-I232 WeakPolarHBondContact O-CG2 3.38Å; T165-I232 HydrophobicContact CG2-CG2 4.27Å; F168-I232 HydrophobicContact CD2-CG2 4.13Å; F168-I232 HydrophobicContact CE2-CB 4.03Å; F168-I232 HydrophobicContact CE2-CG2 3.83Å; K228-I232 PolarHBondContact O-N 3.42Å; L229-I232 HydrophobicContact CD2-CD1 4.35Å; L229-I232 CarbonylContact O-C 3.36Å; L229-I232 WeakPolarHBondContact O-CA 3.43Å; L229-I232 WeakPolarHBondContact O-CB 3.31Å; L229-I232 PolarHBondContact O-N 2.92Å; T230-I232 VanDerWaalsContact C-N 3.31Å; I232-K234 VanDerWaalsContact C-N 3.31Å; I232-K234 PolarHBondContact O-N 3.25Å; I232-V235 WeakPolarHBondContact O-CA 3.46Å; I232-V235 WeakPolarHBondContact O-CB 3.21Å; I232-V235 PolarHBondContact O-N 2.77Å; I232-V236 PolarHBondContact O-N 3.22Å
233	A	98.3	Very high	97.8	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-58	-41.4	174.2	0	0	0	0	0	112	F168 L216 C219 L229 T230 V235 V236 I237	F168-A233 HydrophobicContact CE1-CB 4.26Å; F168-A233 HydrophobicContact CE2-CB 3.95Å; F168-A233 HydrophobicContact CZ-CB 3.7Å; L216-A233 HydrophobicContact CB-CB 4.29Å; L216-A233 HydrophobicContact CD1-CB 3.72Å; C219-A233 HydrophobicContact CB-CB 4.21Å; L229-A233 PolarHBondContact O-N 3.13Å; T230-A233 PolarHBondContact O-N 3.29Å; A233-V235 PolarHBondContact O-N 3.14Å; A233-V236 WeakPolarHBondContact O-CB 3.37Å; A233-V236 PolarHBondContact O-N 3.1Å; A233-V236 VanDerWaalsContact O-N 3.1Å; A233-I237 WeakPolarHBondContact O-CG1 3.42Å; A233-I237 PolarHBondContact O-N 3.3Å
234	K	98.2	Very high	97.8	Very high	72 Å²	72	55.3 Å²	55.3	31%	0.313	28%	0.281	S	S	.	.	H	α-helix	trans	-60.2	-30.7	173.9	-75.8	167.1	179	166	0	112.7	L216 G225 T230 I232 K238	L216-K234 HydrophobicContact CD1-CG 3.64Å; L216-K234 HydrophobicContact CD2-CG 4.1Å; G225-K234 PolarHBondContact O-NZ 3.36Å; T230-K234 HydrophobicContact CG2-CD 4.2Å; T230-K234 WeakPolarHBondContact O-CB 3.38Å; T230-K234 VanDerWaalsContact O-CG 3.24Å; T230-K234 WeakPolarHBondContact O-CG 3.37Å; T230-K234 PolarHBondContact O-N 3.37Å; I232-K234 VanDerWaalsContact C-N 3.31Å; I232-K234 PolarHBondContact O-N 3.25Å; K234-K238 WeakPolarHBondContact O-CB 3.45Å; K234-K238 VanDerWaalsContact O-CG 3.27Å; K234-K238 WeakPolarHBondContact O-CG 3.17Å; K234-K238 PolarHBondContact O-N 3.34Å
235	V	98	Very high	97.8	Very high	65 Å²	65	56.2 Å²	56.2	39%	0.394	28%	0.278	S	S	.	.	H	α-helix	trans	-76.1	-40.1	172.7	174.2	0	0	0	0	111.3	Q231 I232 A233 I237 K238 I239	Q231-V235 WeakPolarHBondContact O-CG2 3.46Å; Q231-V235 PolarHBondContact O-N 3.47Å; I232-V235 WeakPolarHBondContact O-CA 3.46Å; I232-V235 WeakPolarHBondContact O-CB 3.21Å; I232-V235 PolarHBondContact O-N 2.77Å; A233-V235 PolarHBondContact O-N 3.14Å; V235-I237 PolarHBondContact O-N 3.17Å; V235-K238 PolarHBondContact O-N 3.11Å; V235-I239 HydrophobicContact CG1-CD1 4.02Å; V235-I239 WeakPolarHBondContact O-CG1 3.27Å; V235-I239 PolarHBondContact O-N 3.35Å
236	V	98.3	Very high	97.9	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-58.3	-45.9	175.2	171.8	0	0	0	0	111.5	M160 T165 L190 I232 A233 I239 C240	M160-V236 HydrophobicContact CB-CG1 4.31Å; M160-V236 HydrophobicContact CE-CG1 3.98Å; T165-V236 HydrophobicContact CG2-CG2 3.7Å; L190-V236 HydrophobicContact CD1-CG1 4.45Å; L190-V236 HydrophobicContact CD2-CG1 3.96Å; I232-V236 PolarHBondContact O-N 3.22Å; A233-V236 WeakPolarHBondContact O-CB 3.37Å; A233-V236 PolarHBondContact O-N 3.1Å; A233-V236 VanDerWaalsContact O-N 3.1Å; V236-I239 PolarHBondContact O-N 2.53Å; V236-C240 PolarHBondContact O-N 3.1Å
237	I	98.4	Very high	97.9	Very high	7 Å²	7	48.2 Å²	48.2	4%	0.036	23%	0.228	C	C	.	.	H	α-helix	trans	-66.8	-41.5	176.9	-54.7	-48.9	0	0	0	111.6	L209 A212 K213 L216 A233 V235 I239 C240 E241	L209-I237 HydrophobicContact CD1-CG2 4.31Å; A212-I237 HydrophobicContact CB-CD1 4.27Å; A212-I237 WeakPolarHBondContact O-CD1 3.44Å; K213-I237 HydrophobicContact CG-CG2 4.27Å; L216-I237 HydrophobicContact CB-CD1 4.14Å; L216-I237 HydrophobicContact CB-CG1 3.57Å; L216-I237 HydrophobicContact CD2-CB 4.32Å; L216-I237 HydrophobicContact CD2-CG1 3.75Å; L216-I237 HydrophobicContact CG-CG1 4.28Å; A233-I237 WeakPolarHBondContact O-CG1 3.42Å; A233-I237 PolarHBondContact O-N 3.3Å; V235-I237 PolarHBondContact O-N 3.17Å; I237-I239 VanDerWaalsContact C-N 3.26Å; I237-I239 PolarHBondContact O-N 2.74Å; I237-C240 CarbonylContact O-C 3.54Å; I237-C240 WeakPolarHBondContact O-CA 3.3Å; I237-C240 VanDerWaalsContact O-CB 3.23Å; I237-C240 WeakPolarHBondContact O-CB 3.49Å; I237-C240 PolarHBondContact O-N 3.28Å; I237-E241 HydrophobicContact CG2-CG 4.16Å; I237-E241 WeakPolarHBondContact O-CG 3.1Å; I237-E241 PolarHBondContact O-N 3.14Å
238	K	98.3	Very high	97.8	Very high	141 Å²	141	46.3 Å²	46.3	61%	0.613	22%	0.219	S	C	*	.	H	α-helix	trans	-60.6	-34.2	175.7	-79	-179	172.8	-155.2	0	113.5	K234 V235 H242	K234-K238 WeakPolarHBondContact O-CB 3.45Å; K234-K238 VanDerWaalsContact O-CG 3.27Å; K234-K238 WeakPolarHBondContact O-CG 3.17Å; K234-K238 PolarHBondContact O-N 3.34Å; V235-K238 PolarHBondContact O-N 3.11Å; K238-H242 WeakPolarHBondContact O-CB 3.44Å; K238-H242 PolarHBondContact O-N 2.89Å
239	I	98.3	Very high	97.8	Very high	31 Å²	31	39.7 Å²	39.7	16%	0.159	19%	0.192	C	C	.	.	H	α-helix	trans	-68.9	-44.8	172.4	-68.3	168.6	0	0	0	109.8	K159 M160 Q162 V235 V236 I237 E241 H242 E243	K159-I239 HydrophobicContact CB-CG2 3.96Å; M160-I239 HydrophobicContact CG-CB 4.34Å; M160-I239 HydrophobicContact CG-CG2 3.86Å; Q162-I239 HydrophobicContact CG-CD1 4.25Å; Q162-I239 VanDerWaalsContact NE2-CD1 3.27Å; V235-I239 HydrophobicContact CG1-CD1 4.02Å; V235-I239 WeakPolarHBondContact O-CG1 3.27Å; V235-I239 PolarHBondContact O-N 3.35Å; V236-I239 PolarHBondContact O-N 2.53Å; I237-I239 VanDerWaalsContact C-N 3.26Å; I237-I239 PolarHBondContact O-N 2.74Å; I239-E241 PolarHBondContact O-N 3.02Å; I239-H242 PolarHBondContact O-N 3.35Å; I239-E243 HydrophobicContact CG2-CG 3.97Å; I239-E243 WeakPolarHBondContact O-CB 3.37Å; I239-E243 WeakPolarHBondContact O-CG 3.17Å; I239-E243 PolarHBondContact O-N 2.99Å
240	C	98.6	Very high	97.7	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-54.1	-52.3	174	-166.5	0	0	0	0	111.8	M160 F208 L209 A212 V236 I237 H242 E243 M244	M160-C240 HydrophobicContact CE-CB 3.75Å; M160-C240 HydrophobicContact CG-CB 4.45Å; M160-C240 HydrophobicContact SD-CB 3.79Å; F208-C240 WeakPolarHBondContact CE1-SG 3.47Å; L209-C240 HydrophobicContact CD1-CB 4.07Å; A212-C240 HydrophobicContact CB-CB 4.47Å; V236-C240 PolarHBondContact O-N 3.1Å; I237-C240 CarbonylContact O-C 3.54Å; I237-C240 WeakPolarHBondContact O-CA 3.3Å; I237-C240 VanDerWaalsContact O-CB 3.23Å; I237-C240 WeakPolarHBondContact O-CB 3.49Å; I237-C240 PolarHBondContact O-N 3.28Å; C240-H242 VanDerWaalsContact C-N 3.33Å; C240-H242 PolarHBondContact O-N 2.89Å; C240-E243 PolarHBondContact O-N 3.42Å; C240-M244 WeakPolarHBondContact O-CB 3.24Å; C240-M244 VanDerWaalsContact O-CG 3.28Å; C240-M244 WeakPolarHBondContact O-CG 3.45Å; C240-M244 PolarHBondContact O-N 3.48Å
241	E	98.3	Very high	97.6	Very high	90 Å²	90	37.7 Å²	37.7	42%	0.421	18%	0.183	S	C	.	.	H	α-helix	trans	-57.7	-42.1	177.6	-69.3	171.9	152.2	0	0	112.4	L209 I237 I239 N245	L209-E241 HydrophobicContact CD1-CG 3.74Å; L209-E241 HydrophobicContact CD2-CG 4.09Å; I237-E241 HydrophobicContact CG2-CG 4.16Å; I237-E241 WeakPolarHBondContact O-CG 3.1Å; I237-E241 PolarHBondContact O-N 3.14Å; I239-E241 PolarHBondContact O-N 3.02Å; E241-N245 WeakPolarHBondContact O-CB 3.47Å; E241-N245 PolarHBondContact O-N 3.48Å; E241-N245 VanDerWaalsContact O-N 3.1Å
242	H	97.6	Very high	97.5	Very high	101 Å²	101	35 Å²	35	47%	0.468	17%	0.17	S	C	.	.	H	α-helix	trans	-66.7	-49.5	178	178.8	51.2	0	0	0	112.4	K238 I239 C240 N245 E246	K238-H242 WeakPolarHBondContact O-CB 3.44Å; K238-H242 PolarHBondContact O-N 2.89Å; I239-H242 PolarHBondContact O-N 3.35Å; C240-H242 VanDerWaalsContact C-N 3.33Å; C240-H242 PolarHBondContact O-N 2.89Å; H242-N245 PolarHBondContact O-N 3.27Å; H242-E246 IonicContact CE1-OE1 3.42Å; H242-E246 PolarHBondContact O-N 3.03Å
243	E	98.1	Very high	97.3	Very high	11 Å²	11	33.1 Å²	33.1	5%	0.051	16%	0.161	C	C	.	.	H	α-helix	trans	-67.2	-37.4	-177.5	-60.7	-79.1	137.9	0	0	111.2	A156 K159 I239 C240 E246 I247 Y254	A156-E243 HydrophobicContact CB-CB 3.77Å; A156-E243 HydrophobicContact CB-CG 4.36Å; K159-E243 HydrophobicContact CB-CG 4.28Å; K159-E243 WeakPolarHBondContact CG-OE2 3.47Å; K159-E243 IonicContact NZ-OE1 2.94Å; K159-E243 PolarHBondContact NZ-OE1 3.07Å; K159-E243 IonicContact NZ-OE2 3.16Å; K159-E243 PolarHBondContact NZ-OE2 3.05Å; I239-E243 HydrophobicContact CG2-CG 3.97Å; I239-E243 WeakPolarHBondContact O-CB 3.37Å; I239-E243 WeakPolarHBondContact O-CG 3.17Å; I239-E243 PolarHBondContact O-N 2.99Å; C240-E243 PolarHBondContact O-N 3.42Å; E243-E246 PolarHBondContact O-N 3.31Å; E243-I247 WeakPolarHBondContact O-CG1 3.48Å; E243-I247 PolarHBondContact O-N 3Å; E243-I247 VanDerWaalsContact O-N 3.1Å; E243-Y254 HydrophobicContact CB-CE2 4.48Å; E243-Y254 WeakPolarHBondContact OE2-CE2 3.38Å; E243-Y254 VanDerWaalsContact OE2-CZ 3.31Å; E243-Y254 PolarHBondContact OE2-OH 3.2Å
244	M	98.3	Very high	97.2	Very high	5 Å²	5	33.4 Å²	33.4	3%	0.025	16%	0.162	C	C	.	.	H	α-helix	trans	-63.1	-46.3	172.3	-68.5	-43.8	94.8	0	0	111	L153 A156 T205 F208 L209 C240 E246 I247 E248	L153-M244 HydrophobicContact CD2-CE 3.69Å; L153-M244 HydrophobicContact CD2-SD 3.49Å; L153-M244 WeakPolarHBondContact CD2-SD 3.24Å; A156-M244 HydrophobicContact CB-CE 3.38Å; T205-M244 HydrophobicContact CG2-SD 3.82Å; F208-M244 HydrophobicContact CD1-CE 3.74Å; F208-M244 HydrophobicContact CD1-CG 4.23Å; F208-M244 HydrophobicContact CD1-SD 3.51Å; F208-M244 VanDerWaalsContact CD1-SD 3.51Å; F208-M244 HydrophobicContact CE1-CE 3.65Å; F208-M244 HydrophobicContact CE1-SD 4.08Å; F208-M244 HydrophobicContact CG-SD 4.37Å; L209-M244 HydrophobicContact CB-CG 4.42Å; C240-M244 WeakPolarHBondContact O-CB 3.24Å; C240-M244 VanDerWaalsContact O-CG 3.28Å; C240-M244 WeakPolarHBondContact O-CG 3.45Å; C240-M244 PolarHBondContact O-N 3.48Å; M244-E246 VanDerWaalsContact C-N 3.27Å; M244-E246 PolarHBondContact O-N 3.29Å; M244-I247 HydrophobicContact CE-CD1 3.81Å; M244-I247 WeakPolarHBondContact O-CB 3.37Å; M244-I247 PolarHBondContact O-N 2.98Å; M244-I247 VanDerWaalsContact O-N 3.14Å; M244-I247 HydrophobicContact SD-CD1 4.2Å; M244-E248 WeakPolarHBondContact O-CG 3.22Å; M244-E248 PolarHBondContact O-N 2.73Å
245	N	97	Very high	97.1	Very high	52 Å²	52	30.9 Å²	30.9	28%	0.278	15%	0.152	S	C	.	.	H	α-helix	trans	-58.9	-36.5	173.9	161.4	93.7	0	0	0	112.5	E241 H242 E248 V249 R292	E241-N245 WeakPolarHBondContact O-CB 3.47Å; E241-N245 PolarHBondContact O-N 3.48Å; E241-N245 VanDerWaalsContact O-N 3.1Å; H242-N245 PolarHBondContact O-N 3.27Å; N245-E248 PolarHBondContact O-N 3.21Å; N245-V249 WeakPolarHBondContact O-CG2 3.27Å; N245-V249 PolarHBondContact O-N 3.48Å; N245-R292 PolarHBondContact OD1-NH1 3.5Å; N245-R292 PolarHBondContact OD1-NH2 2.93Å
246	E	96.9	Very high	96.9	Very high	14 Å²	14	28.2 Å²	28.2	7%	0.065	14%	0.136	C	C	.	.	H	α-helix	trans	-65.6	-38.9	176.3	-71	-61.3	105.2	0	0	112.2	H242 E243 M244 V249 C250 Y254 R301 R308	H242-E246 IonicContact CE1-OE1 3.42Å; H242-E246 PolarHBondContact O-N 3.03Å; E243-E246 PolarHBondContact O-N 3.31Å; M244-E246 VanDerWaalsContact C-N 3.27Å; M244-E246 PolarHBondContact O-N 3.29Å; E246-V249 PolarHBondContact O-N 3.13Å; E246-C250 PolarHBondContact O-N 3.05Å; E246-Y254 HydrophobicContact CB-CD2 3.56Å; E246-Y254 HydrophobicContact CB-CE2 4.11Å; E246-Y254 HydrophobicContact CB-CG 4.42Å; E246-R301 IonicContact OE2-NH1 2.63Å; E246-R301 PolarHBondContact OE2-NH1 3.43Å; E246-R308 VanDerWaalsContact CD-NE 3.33Å; E246-R308 IonicContact OE1-CZ 3.83Å; E246-R308 IonicContact OE1-NE 2.99Å; E246-R308 PolarHBondContact OE1-NE 3.06Å; E246-R308 IonicContact OE1-NH1 2.76Å; E246-R308 IonicContact OE1-NH2 3.93Å; E246-R308 PolarHBondContact OE1-NH2 2.96Å; E246-R308 IonicContact OE2-CZ 3.8Å; E246-R308 VanDerWaalsContact OE2-CZ 3.24Å; E246-R308 IonicContact OE2-NE 3.64Å; E246-R308 PolarHBondContact OE2-NE 3.28Å; E246-R308 IonicContact OE2-NH2 3.01Å; E246-R308 PolarHBondContact OE2-NH2 2.89Å
247	I	97.3	Very high	96.6	Very high	0 Å²	0	29 Å²	29	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-61.1	-50.5	172.1	-66.1	166.3	0	0	0	110.1	M141 L144 L152 L153 T205 E243 M244 V249 C250 P251 Y254	M141-I247 HydrophobicContact CE-CG2 4.22Å; L144-I247 HydrophobicContact CD1-CG2 4.43Å; L152-I247 HydrophobicContact CB-CD1 3.92Å; L152-I247 HydrophobicContact CB-CG1 4.31Å; L152-I247 HydrophobicContact CD1-CG1 4.31Å; L152-I247 HydrophobicContact CD1-CG2 4.1Å; L153-I247 HydrophobicContact CD2-CD1 4.47Å; T205-I247 HydrophobicContact CG2-CB 4.34Å; T205-I247 HydrophobicContact CG2-CG2 3.93Å; E243-I247 WeakPolarHBondContact O-CG1 3.48Å; E243-I247 PolarHBondContact O-N 3Å; E243-I247 VanDerWaalsContact O-N 3.1Å; M244-I247 HydrophobicContact CE-CD1 3.81Å; M244-I247 WeakPolarHBondContact O-CB 3.37Å; M244-I247 PolarHBondContact O-N 2.98Å; M244-I247 VanDerWaalsContact O-N 3.14Å; M244-I247 HydrophobicContact SD-CD1 4.2Å; I247-V249 VanDerWaalsContact C-N 3.26Å; I247-V249 PolarHBondContact O-N 3.47Å; I247-C250 CarbonylContact O-C 3.57Å; I247-C250 PolarHBondContact O-N 3.27Å; I247-P251 HydrophobicContact CG2-CB 4.5Å; I247-P251 WeakPolarHBondContact O-CD 3.48Å; I247-Y254 HydrophobicContact CD1-CD1 4.16Å; I247-Y254 HydrophobicContact CD1-CE1 3.88Å; I247-Y254 HydrophobicContact CG1-CD1 3.4Å; I247-Y254 HydrophobicContact CG1-CD2 4.33Å; I247-Y254 HydrophobicContact CG1-CE1 3.61Å; I247-Y254 HydrophobicContact CG1-CE2 4.48Å; I247-Y254 HydrophobicContact CG1-CG 3.8Å
248	E	96.4	Very high	96.4	Very high	41 Å²	41	29.9 Å²	29.9	19%	0.192	15%	0.149	C	C	.	.	H	α-helix	trans	-62.9	-27.1	-179.6	-69.8	-54.3	146.2	0	0	114	S138 M141 T205 M244 N245	S138-E248 WeakPolarHBondContact CB-OE2 3.08Å; S138-E248 PolarHBondContact OG-OE2 3.2Å; M141-E248 WeakPolarHBondContact CE-OE1 3.43Å; T205-E248 WeakPolarHBondContact CB-OE1 3.46Å; T205-E248 HydrophobicContact CG2-CG 4.42Å; T205-E248 WeakPolarHBondContact CG2-OE1 3.48Å; T205-E248 PolarHBondContact OG1-OE1 2.76Å; M244-E248 WeakPolarHBondContact O-CG 3.22Å; M244-E248 PolarHBondContact O-N 2.73Å; N245-E248 PolarHBondContact O-N 3.21Å
249	V	95.8	Very high	96	Very high	20 Å²	20	24.7 Å²	24.7	12%	0.121	13%	0.127	C	C	.	.	H	α-helix	trans	-70.1	-50.8	173.6	179.9	0	0	0	0	110.9	N245 E246 I247 L291 R292	N245-V249 WeakPolarHBondContact O-CG2 3.27Å; N245-V249 PolarHBondContact O-N 3.48Å; E246-V249 PolarHBondContact O-N 3.13Å; I247-V249 VanDerWaalsContact C-N 3.26Å; I247-V249 PolarHBondContact O-N 3.47Å; V249-L291 HydrophobicContact CG1-CB 3.59Å; V249-L291 HydrophobicContact CG1-CD2 3.8Å; V249-L291 HydrophobicContact CG1-CG 4.16Å; V249-R292 HydrophobicContact CG1-CG 4.3Å
250	C	95.7	Very high	95.3	Very high	8 Å²	8	30.1 Å²	30.1	5%	0.054	15%	0.15	C	C	.	.			trans	-168.8	113	177	176.9	0	0	0	0	110.2	E246 I247 E252 C253 Y254 H273	E246-C250 PolarHBondContact O-N 3.05Å; I247-C250 CarbonylContact O-C 3.57Å; I247-C250 PolarHBondContact O-N 3.27Å; C250-E252 VanDerWaalsContact C-N 3.3Å; C250-E252 PolarHBondContact O-N 2.73Å; C250-C253 HydrophobicContact CB-CB 3.96Å; C250-C253 PolarHBondContact O-N 3.35Å; C250-C253 PolarHBondContact SG-N 3.21Å; C250-C253 VanDerWaalsContact SG-N 3.41Å; C250-Y254 PolarHBondContact O-N 2.96Å; C250-H273 PolarHBondContact SG-NE2 3.48Å; C250-H273 VanDerWaalsContact SG-NE2 3.45Å
251	P	96.1	Very high	94.8	Very high	2 Å²	2	34.6 Å²	34.6	1%	0.013	17%	0.167	C	C	.	.	H	α-helix	trans	-68.6	-28.7	-177.1	25.8	-32.9	0	0	0	112.8	A140 M143 L144 L152 I247 Y254 L255 L394	A140-P251 HydrophobicContact CB-CG 4.26Å; M143-P251 HydrophobicContact CB-CG 4.47Å; L144-P251 HydrophobicContact CD1-CB 3.87Å; L144-P251 HydrophobicContact CD1-CG 4.2Å; L144-P251 HydrophobicContact CD2-CB 4.08Å; L144-P251 HydrophobicContact CD2-CG 4.4Å; L144-P251 HydrophobicContact CG-CB 4.15Å; L144-P251 HydrophobicContact CG-CG 4.16Å; L152-P251 HydrophobicContact CD1-CB 3.64Å; I247-P251 HydrophobicContact CG2-CB 4.5Å; I247-P251 WeakPolarHBondContact O-CD 3.48Å; P251-Y254 PolarHBondContact O-N 3.39Å; P251-L255 VanDerWaalsContact O-CB 3.31Å; P251-L255 WeakPolarHBondContact O-CB 3.48Å; P251-L255 PolarHBondContact O-N 2.68Å; P251-L394 HydrophobicContact CG-CD1 4.45Å
252	E	94.8	Very high	94.2	Very high	31 Å²	31	37.7 Å²	37.7	15%	0.145	19%	0.186	C	C	.	.	H	α-helix	trans	-66.1	-46.2	173.5	-67.5	176.5	-75.8	0	0	111.8	M143 C250 Y254 L255 A256 C269 S270 L394	M143-E252 HydrophobicContact CE-CG 4.34Å; M143-E252 VanDerWaalsContact CE-OE1 3.28Å; M143-E252 WeakPolarHBondContact CE-OE1 3.44Å; C250-E252 VanDerWaalsContact C-N 3.3Å; C250-E252 PolarHBondContact O-N 2.73Å; E252-Y254 VanDerWaalsContact C-N 3.33Å; E252-Y254 PolarHBondContact O-N 3.24Å; E252-L255 PolarHBondContact O-N 3.31Å; E252-A256 WeakPolarHBondContact O-CB 3.26Å; E252-A256 PolarHBondContact O-N 3Å; E252-C269 HydrophobicContact CB-CB 4.3Å; E252-C269 WeakPolarHBondContact OE1-CA 3.45Å; E252-C269 WeakPolarHBondContact OE1-CB 3.45Å; E252-S270 PolarHBondContact OE1-N 3.38Å; E252-S270 WeakPolarHBondContact OE2-CB 3.18Å; E252-S270 PolarHBondContact OE2-N 3.32Å; E252-S270 PolarHBondContact OE2-OG 2.91Å; E252-L394 HydrophobicContact CG-CD1 4Å; E252-L394 HydrophobicContact CG-CD2 3.61Å; E252-L394 HydrophobicContact CG-CG 4.41Å
253	C	95.4	Very high	93.8	Very high	5 Å²	5	38 Å²	38	3%	0.034	19%	0.191	C	C	.	.	H	α-helix	trans	-64.5	-37.6	175.4	-86.1	0	0	0	0	112	C250 A257 H273	C250-C253 HydrophobicContact CB-CB 3.96Å; C250-C253 PolarHBondContact O-N 3.35Å; C250-C253 PolarHBondContact SG-N 3.21Å; C250-C253 VanDerWaalsContact SG-N 3.41Å; C253-A257 VanDerWaalsContact O-CB 3.24Å; C253-A257 WeakPolarHBondContact O-CB 3.42Å; C253-A257 PolarHBondContact O-N 3.28Å; C253-H273 PolarHBondContact SG-NE2 3.33Å
254	Y	96.3	Very high	93.6	Very high	6 Å²	6	39 Å²	39	2%	0.024	20%	0.195	C	C	.	.	H	α-helix	trans	-65.1	-47.5	175.6	-179.5	-105.8	0	0	0	111.7	L152 F155 A156 E243 E246 I247 C250 P251 E252 A256 A257 C258	L152-Y254 HydrophobicContact CB-CD1 4.28Å; L152-Y254 HydrophobicContact CB-CE1 4.15Å; L152-Y254 HydrophobicContact CD1-CD1 4.29Å; L152-Y254 HydrophobicContact CD2-CD1 3.92Å; L152-Y254 HydrophobicContact CD2-CE1 4.28Å; L152-Y254 HydrophobicContact CG-CD1 4.38Å; F155-Y254 HydrophobicContact CB-CE1 4.21Å; A156-Y254 PolarHBondContact N-OH 3.28Å; E243-Y254 HydrophobicContact CB-CE2 4.48Å; E243-Y254 WeakPolarHBondContact OE2-CE2 3.38Å; E243-Y254 VanDerWaalsContact OE2-CZ 3.31Å; E243-Y254 PolarHBondContact OE2-OH 3.2Å; E246-Y254 HydrophobicContact CB-CD2 3.56Å; E246-Y254 HydrophobicContact CB-CE2 4.11Å; E246-Y254 HydrophobicContact CB-CG 4.42Å; I247-Y254 HydrophobicContact CD1-CD1 4.16Å; I247-Y254 HydrophobicContact CD1-CE1 3.88Å; I247-Y254 HydrophobicContact CG1-CD1 3.4Å; I247-Y254 HydrophobicContact CG1-CD2 4.33Å; I247-Y254 HydrophobicContact CG1-CE1 3.61Å; I247-Y254 HydrophobicContact CG1-CE2 4.48Å; I247-Y254 HydrophobicContact CG1-CG 3.8Å; C250-Y254 PolarHBondContact O-N 2.96Å; P251-Y254 PolarHBondContact O-N 3.39Å; E252-Y254 VanDerWaalsContact C-N 3.33Å; E252-Y254 PolarHBondContact O-N 3.24Å; Y254-A256 PolarHBondContact O-N 2.91Å; Y254-A257 PolarHBondContact O-N 3Å; Y254-C258 WeakPolarHBondContact O-CB 3.27Å; Y254-C258 PolarHBondContact O-N 3.1Å; Y254-C258 PolarHBondContact O-SG 3.1Å
255	L	94.6	Very high	93.5	Very high	19 Å²	19	38.8 Å²	38.8	10%	0.099	19%	0.194	C	C	.	.	H	α-helix	trans	-55	-52	175.3	177.7	62.9	0	0	0	111.7	Y151 L152 F155 P251 E252 A257 C258 Q259 F396	Y151-L255 HydrophobicContact CE1-CD1 3.8Å; L152-L255 HydrophobicContact CD2-CB 4.14Å; L152-L255 HydrophobicContact CD2-CD1 4.09Å; F155-L255 HydrophobicContact CE2-CD1 4.26Å; P251-L255 VanDerWaalsContact O-CB 3.31Å; P251-L255 WeakPolarHBondContact O-CB 3.48Å; P251-L255 PolarHBondContact O-N 2.68Å; E252-L255 PolarHBondContact O-N 3.31Å; L255-A257 VanDerWaalsContact C-N 3.35Å; L255-A257 PolarHBondContact O-N 3.27Å; L255-C258 PolarHBondContact O-N 3.09Å; L255-C258 VanDerWaalsContact O-N 3.16Å; L255-Q259 VanDerWaalsContact CD1-CD 3.4Å; L255-Q259 HydrophobicContact CD1-CG 3.88Å; L255-Q259 WeakPolarHBondContact O-CB 3.49Å; L255-Q259 PolarHBondContact O-N 3.12Å; L255-F396 HydrophobicContact CD1-CD1 3.99Å; L255-F396 HydrophobicContact CD1-CE1 3.64Å; L255-F396 HydrophobicContact CD1-CZ 4.46Å; L255-F396 HydrophobicContact CD2-CD1 3.78Å; L255-F396 HydrophobicContact CD2-CD2 4.34Å; L255-F396 HydrophobicContact CD2-CE1 3.63Å; L255-F396 HydrophobicContact CD2-CE2 4.21Å; L255-F396 HydrophobicContact CD2-CG 4.15Å; L255-F396 HydrophobicContact CD2-CZ 3.86Å; L255-F396 HydrophobicContact CG-CE1 4.12Å
256	A	93.4	Very high	93.5	Very high	8 Å²	8	36.4 Å²	36.4	7%	0.066	18%	0.181	C	C	.	.	H	α-helix	trans	-63	-40.5	-178	0	0	0	0	0	111.7	E252 Y254 C258 K260 W264	E252-A256 WeakPolarHBondContact O-CB 3.26Å; E252-A256 PolarHBondContact O-N 3Å; Y254-A256 PolarHBondContact O-N 2.91Å; A256-C258 VanDerWaalsContact C-N 3.31Å; A256-C258 PolarHBondContact O-N 2.88Å; A256-K260 PolarHBondContact O-N 2.67Å; A256-W264 VanDerWaalsContact C-CE3 3.46Å; A256-W264 HydrophobicContact CB-CB 4.24Å; A256-W264 HydrophobicContact CB-CE3 3.72Å
257	A	93.6	Very high	93.3	Very high	17 Å²	17	39.1 Å²	39.1	14%	0.14	19%	0.194	C	C	.	.	H	α-helix	trans	-66.2	-29.6	175.5	0	0	0	0	0	113.6	C253 Y254 L255 K260 W264	C253-A257 VanDerWaalsContact O-CB 3.24Å; C253-A257 WeakPolarHBondContact O-CB 3.42Å; C253-A257 PolarHBondContact O-N 3.28Å; Y254-A257 PolarHBondContact O-N 3Å; L255-A257 VanDerWaalsContact C-N 3.35Å; L255-A257 PolarHBondContact O-N 3.27Å; A257-K260 WeakPolarHBondContact O-CE 3.39Å; A257-K260 WeakPolarHBondContact O-CG 3.43Å; A257-W264 HydrophobicContact CB-CE3 4.15Å; A257-W264 HydrophobicContact CB-CH2 3.68Å; A257-W264 HydrophobicContact CB-CZ2 4.38Å; A257-W264 HydrophobicContact CB-CZ3 3.54Å
258	C	92.9	Very high	93.2	Very high	25 Å²	25	40.1 Å²	40.1	17%	0.169	20%	0.2	C	C	.	.	H	α-helix	trans	-84.6	-38.1	178.1	-79	0	0	0	0	113.1	F155 Y254 L255 A256	F155-C258 HydrophobicContact CB-CB 4.28Å; F155-C258 HydrophobicContact CD1-CB 3.67Å; F155-C258 HydrophobicContact CD2-CB 4.15Å; F155-C258 HydrophobicContact CE1-CB 3.91Å; F155-C258 HydrophobicContact CE2-CB 4.36Å; F155-C258 HydrophobicContact CG-CB 3.8Å; F155-C258 HydrophobicContact CZ-CB 4.26Å; Y254-C258 WeakPolarHBondContact O-CB 3.27Å; Y254-C258 PolarHBondContact O-N 3.1Å; Y254-C258 PolarHBondContact O-SG 3.1Å; L255-C258 PolarHBondContact O-N 3.09Å; L255-C258 VanDerWaalsContact O-N 3.16Å; A256-C258 VanDerWaalsContact C-N 3.31Å; A256-C258 PolarHBondContact O-N 2.88Å
259	Q	90.1	Very high	93.1	Very high	32 Å²	32	38.4 Å²	38.4	15%	0.15	19%	0.192	C	C	.	.	H	α-helix	trans	-79.4	-25.5	177.5	-73	-177.8	-27.9	0	0	113.3	Y151 F155 L255 R261	Y151-Q259 PolarHBondContact OH-NE2 3.24Å; F155-Q259 HydrophobicContact CE2-CG 4.33Å; F155-Q259 HydrophobicContact CZ-CG 3.81Å; L255-Q259 VanDerWaalsContact CD1-CD 3.4Å; L255-Q259 HydrophobicContact CD1-CG 3.88Å; L255-Q259 WeakPolarHBondContact O-CB 3.49Å; L255-Q259 PolarHBondContact O-N 3.12Å; Q259-R261 PolarHBondContact O-N 3Å
260	K	84.6	Confident	92.8	Very high	146 Å²	146	39.2 Å²	39.2	64%	0.635	20%	0.199	S	C	*	.			trans	47.8	50.9	176.5	-60.7	-166.3	176.4	-169.8	0	114	A256 A257	A256-K260 PolarHBondContact O-N 2.67Å; A257-K260 WeakPolarHBondContact O-CE 3.39Å; A257-K260 WeakPolarHBondContact O-CG 3.43Å
261	R	87.3	Confident	92.5	Very high	93 Å²	93	44.3 Å²	44.3	35%	0.351	23%	0.226	S	C	.	.			trans	-62.3	159.7	167.6	-66.8	-166.6	-177.7	80.4	10.1	110.9	Q259 N263 W264 D397	Q259-R261 PolarHBondContact O-N 3Å; R261-N263 PolarHBondContact O-N 3.47Å; R261-W264 WeakPolarHBondContact O-CB 3.36Å; R261-W264 PolarHBondContact O-N 3.18Å; R261-D397 IonicContact NH2-OD2 2.91Å
262	D	86.3	Confident	92.4	Very high	156 Å²	156	44.9 Å²	44.9	83%	0.834	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.4	127.8	171.2	-70.9	-32	0	0	0	109.8	W264	D262-W264 VanDerWaalsContact C-N 3.26Å; D262-W264 PolarHBondContact O-N 3Å
263	N	89.6	Confident	92.4	Very high	106 Å²	106	44.3 Å²	44.3	57%	0.567	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.2	31.6	-174.6	-49.9	-51	0	0	0	114.6	R261 F265 C266	R261-N263 PolarHBondContact O-N 3.47Å; N263-F265 PolarHBondContact O-N 3.04Å; N263-C266 HydrophobicContact CB-CB 3.98Å; N263-C266 WeakPolarHBondContact O-CA 3.42Å; N263-C266 VanDerWaalsContact O-CB 3.25Å; N263-C266 WeakPolarHBondContact O-CB 3.28Å; N263-C266 PolarHBondContact O-N 2.84Å
264	W	93.6	Very high	92.5	Very high	33 Å²	33	45.3 Å²	45.3	13%	0.125	23%	0.233	C	C	.	.	G	3₁₀ helix	trans	-50.2	-34.8	178.1	72.8	-85.9	0	0	0	113.7	A256 A257 R261 D262 C266 E267 H306	A256-W264 VanDerWaalsContact C-CE3 3.46Å; A256-W264 HydrophobicContact CB-CB 4.24Å; A256-W264 HydrophobicContact CB-CE3 3.72Å; A257-W264 HydrophobicContact CB-CE3 4.15Å; A257-W264 HydrophobicContact CB-CH2 3.68Å; A257-W264 HydrophobicContact CB-CZ2 4.38Å; A257-W264 HydrophobicContact CB-CZ3 3.54Å; R261-W264 WeakPolarHBondContact O-CB 3.36Å; R261-W264 PolarHBondContact O-N 3.18Å; D262-W264 VanDerWaalsContact C-N 3.26Å; D262-W264 PolarHBondContact O-N 3Å; W264-C266 VanDerWaalsContact C-N 3.26Å; W264-C266 PolarHBondContact O-N 3.16Å; W264-E267 WeakPolarHBondContact O-CB 3.45Å; W264-E267 PolarHBondContact O-N 3.42Å; W264-H306 AromaticContact CE2-ND1 3.86Å; W264-H306 HydrophobicContact CH2-CB 4.23Å; W264-H306 HydrophobicContact CZ2-CB 3.94Å; W264-H306 AromaticContact CZ2-CG 3.71Å; W264-H306 AromaticContact CZ2-ND1 3.4Å; W264-H306 WeakPolarHBondContact CZ2-ND1 3.46Å; W264-H306 AromaticContact NE1-ND1 3.86Å
265	F	96.2	Very high	92.6	Very high	1 Å²	1	45 Å²	45	0%	0.004	23%	0.232	C	C	.	.	G	3₁₀ helix	trans	-75.4	-15.2	177.9	-160.2	-111.4	0	0	0	113.1	N263 E267 K289 R301 F303 H306	N263-F265 PolarHBondContact O-N 3.04Å; F265-E267 VanDerWaalsContact C-N 3.32Å; F265-K289 HydrophobicContact CE1-CD 4.22Å; F265-K289 HydrophobicContact CE1-CG 4.3Å; F265-K289 HydrophobicContact CE2-CD 3.94Å; F265-K289 HydrophobicContact CZ-CD 3.65Å; F265-K289 HydrophobicContact CZ-CG 3.9Å; F265-K289 VanDerWaalsContact O-CE 3.27Å; F265-K289 WeakPolarHBondContact O-CE 3.37Å; F265-K289 PolarHBondContact O-NZ 2.95Å; F265-R301 HydrophobicContact CE2-CB 4.41Å; F265-R301 HydrophobicContact CE2-CG 3.93Å; F265-R301 HydrophobicContact CZ-CB 4.21Å; F265-R301 HydrophobicContact CZ-CG 4.03Å; F265-F303 AromaticContact CD1-CD1 3.5Å; F265-F303 HydrophobicContact CD1-CD1 3.5Å; F265-F303 VanDerWaalsContact CD1-CD1 3.5Å; F265-F303 AromaticContact CD1-CE1 3.68Å; F265-F303 HydrophobicContact CD1-CE1 3.68Å; F265-F303 HydrophobicContact CD1-CG 4.09Å; F265-F303 HydrophobicContact CD1-CZ 4.41Å; F265-F303 HydrophobicContact CE1-CB 4.35Å; F265-F303 AromaticContact CE1-CD1 3.5Å; F265-F303 HydrophobicContact CE1-CD1 3.5Å; F265-F303 AromaticContact CE1-CD2 3.96Å; F265-F303 HydrophobicContact CE1-CD2 3.96Å; F265-F303 AromaticContact CE1-CE1 3.64Å; F265-F303 HydrophobicContact CE1-CE1 3.64Å; F265-F303 HydrophobicContact CE1-CE2 4.1Å; F265-F303 AromaticContact CE1-CG 3.67Å; F265-F303 HydrophobicContact CE1-CG 3.67Å; F265-F303 AromaticContact CE1-CZ 3.95Å; F265-F303 HydrophobicContact CE1-CZ 3.95Å; F265-H306 WeakPolarHBondContact CB-NE2 3.25Å; F265-H306 AromaticContact CD1-CD2 3.41Å; F265-H306 VanDerWaalsContact CD1-CD2 3.41Å; F265-H306 WeakPolarHBondContact CD1-CD2 3.23Å; F265-H306 AromaticContact CD1-NE2 3.68Å; F265-H306 AromaticContact CD2-CD2 3.96Å; F265-H306 AromaticContact CE1-CD2 3.97Å; F265-H306 AromaticContact CG-CD2 3.41Å; F265-H306 VanDerWaalsContact CG-CD2 3.41Å; F265-H306 WeakPolarHBondContact CG-CD2 3.36Å; F265-H306 AromaticContact CG-NE2 3.63Å
266	C	96.3	Very high	92.7	Very high	1 Å²	1	44.1 Å²	44.1	1%	0.007	23%	0.227	C	C	.	.	G	3₁₀ helix	trans	-82.5	-4.4	170	-56.5	0	0	0	0	113.5	N263 W264 P268 E340 V343 N347	N263-C266 HydrophobicContact CB-CB 3.98Å; N263-C266 WeakPolarHBondContact O-CA 3.42Å; N263-C266 VanDerWaalsContact O-CB 3.25Å; N263-C266 WeakPolarHBondContact O-CB 3.28Å; N263-C266 PolarHBondContact O-N 2.84Å; W264-C266 VanDerWaalsContact C-N 3.26Å; W264-C266 PolarHBondContact O-N 3.16Å; C266-P268 WeakPolarHBondContact O-CD 3.44Å; C266-E340 WeakPolarHBondContact SG-CG 3.47Å; C266-E340 PolarHBondContact SG-O 3.14Å; C266-E340 VanDerWaalsContact SG-O 3.4Å; C266-V343 HydrophobicContact CB-CB 4.45Å; C266-V343 HydrophobicContact CB-CG1 3.86Å; C266-N347 PolarHBondContact O-ND2 2.98Å
267	E	93.9	Very high	92.9	Very high	72 Å²	72	43.8 Å²	43.8	34%	0.336	22%	0.224	S	C	.	.	P	Polyproline II helix	trans	-74.9	125.2	176.7	-63.9	179	-175.4	0	0	110.4	W264 F265 Y344	W264-E267 WeakPolarHBondContact O-CB 3.45Å; W264-E267 PolarHBondContact O-N 3.42Å; F265-E267 VanDerWaalsContact C-N 3.32Å; E267-Y344 WeakPolarHBondContact O-CE2 3.46Å
268	P	94.5	Very high	93.1	Very high	20 Å²	20	43 Å²	43	13%	0.13	22%	0.217	C	C	.	.	P	Polyproline II helix	trans	-85.8	116.4	177.1	31.9	-32.3	0	0	0	111.7	C266 Y344 N347 I348 K351 F352	C266-P268 WeakPolarHBondContact O-CD 3.44Å; P268-Y344 HydrophobicContact CB-CE2 4.06Å; P268-N347 HydrophobicContact CG-CB 4.22Å; P268-I348 HydrophobicContact CB-CB 4Å; P268-I348 HydrophobicContact CB-CG1 4.14Å; P268-I348 HydrophobicContact CG-CB 4.5Å; P268-K351 HydrophobicContact CB-CD 4.45Å; P268-K351 HydrophobicContact CG-CB 4.18Å; P268-K351 HydrophobicContact CG-CD 3.85Å; P268-K351 PolarHBondContact O-NZ 3.44Å; P268-F352 HydrophobicContact CB-CE2 4.37Å
269	C	93.6	Very high	93.2	Very high	5 Å²	5	45.6 Å²	45.6	3%	0.034	23%	0.226	C	C	.	.	P	Polyproline II helix	trans	-52.4	158	170.7	-53.5	0	0	0	0	112	E252 F352	E252-C269 HydrophobicContact CB-CB 4.3Å; E252-C269 WeakPolarHBondContact OE1-CA 3.45Å; E252-C269 WeakPolarHBondContact OE1-CB 3.45Å; C269-F352 WeakPolarHBondContact O-CZ 3.49Å
270	S	90.9	Very high	93.4	Very high	37 Å²	37	46.3 Å²	46.3	26%	0.259	23%	0.231	S	C	.	.	S	Bend	trans	-74.8	-27.9	-172.7	-59.2	0	0	0	0	112.6	E252 K351	E252-S270 PolarHBondContact OE1-N 3.38Å; E252-S270 WeakPolarHBondContact OE2-CB 3.18Å; E252-S270 PolarHBondContact OE2-N 3.32Å; E252-S270 PolarHBondContact OE2-OG 2.91Å; S270-K351 PolarHBondContact OG-NZ 3.45Å; S270-K351 VanDerWaalsContact OG-NZ 3.16Å
271	N	89.6	Confident	93.6	Very high	116 Å²	116	49.3 Å²	49.3	62%	0.62	24%	0.244	S	C	*	.	S	Bend	trans	-104.9	103.7	149.5	-179.2	23.2	0	0	0	108
272	P	93.6	Very high	93.7	Very high	14 Å²	14	48.8 Å²	48.8	9%	0.091	27%	0.267	C	S	.	.	P	Polyproline II helix	trans	-74.5	131.4	-170.3	27.1	-32.9	0	0	0	112.7	I348 F352 M372	P272-I348 HydrophobicContact CB-CD1 3.45Å; P272-I348 VanDerWaalsContact CB-CD1 3.45Å; P272-I348 HydrophobicContact CB-CG1 4.18Å; P272-I348 HydrophobicContact CG-CD1 3.88Å; P272-I348 HydrophobicContact CG-CG1 4.48Å; P272-F352 HydrophobicContact CB-CE2 4.16Å; P272-F352 HydrophobicContact CG-CD2 4.38Å; P272-F352 HydrophobicContact CG-CE2 3.86Å; P272-F352 HydrophobicContact CG-CZ 4.09Å; P272-M372 HydrophobicContact CG-CG 4.14Å; P272-M372 HydrophobicContact CG-SD 3.54Å; P272-M372 VanDerWaalsContact CG-SD 3.54Å
273	H	95.3	Very high	93.9	Very high	18 Å²	18	47.9 Å²	47.9	8%	0.083	26%	0.256	C	S	.	.	P	Polyproline II helix	trans	-63.9	126.7	177.1	-59.9	-51.5	0	0	0	111.9	C250 C253 L275 K289 A290	C250-H273 PolarHBondContact SG-NE2 3.48Å; C250-H273 VanDerWaalsContact SG-NE2 3.45Å; C253-H273 PolarHBondContact SG-NE2 3.33Å; H273-L275 PolarHBondContact O-N 2.94Å; H273-K289 HydrophobicContact CB-CB 3.9Å; H273-K289 HydrophobicContact CB-CD 4.41Å; H273-K289 HydrophobicContact CB-CG 4.44Å; H273-A290 WeakPolarHBondContact CB-O 3.32Å
274	P	96.6	Very high	94	Very high	26 Å²	26	45.1 Å²	45.1	17%	0.169	24%	0.244	C	C	.	.	P	Polyproline II helix	trans	-56.4	135.2	176.1	-26.9	35.3	0	0	0	112.3	A290 Y364	P274-A290 PolarHBondContact O-N 3.18Å; P274-Y364 HydrophobicContact CB-CE2 3.83Å; P274-Y364 HydrophobicContact CG-CE2 4.2Å
275	L	97.9	Very high	94	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	132.4	175.9	-58.7	-167.7	0	0	0	110.4	H273 A288 K289 F303 M319 M341 Y344 V345 F355 Q371	H273-L275 PolarHBondContact O-N 2.94Å; L275-A288 WeakPolarHBondContact CA-O 3.44Å; L275-K289 HydrophobicContact CD2-CG 3.98Å; L275-F303 HydrophobicContact CD2-CE2 3.9Å; L275-F303 HydrophobicContact CD2-CZ 3.87Å; L275-M319 HydrophobicContact CB-CB 3.65Å; L275-M319 HydrophobicContact CB-CG 4.14Å; L275-M319 WeakPolarHBondContact O-CB 3.4Å; L275-M319 PolarHBondContact O-N 3.48Å; L275-M341 HydrophobicContact CD1-CG 4Å; L275-Y344 HydrophobicContact CD1-CD1 3.88Å; L275-Y344 HydrophobicContact CD1-CE1 4.18Å; L275-Y344 HydrophobicContact CD2-CD1 3.92Å; L275-Y344 HydrophobicContact CD2-CE1 3.7Å; L275-Y344 HydrophobicContact CG-CD1 4.31Å; L275-Y344 HydrophobicContact CG-CE1 4.15Å; L275-V345 HydrophobicContact CD1-CG2 3.54Å; L275-F355 HydrophobicContact CB-CE2 4.46Å; L275-F355 HydrophobicContact CB-CZ 4.2Å; L275-F355 HydrophobicContact CD1-CE2 3.89Å; L275-F355 HydrophobicContact CD1-CZ 3.73Å; L275-F355 HydrophobicContact CG-CE2 4.01Å; L275-F355 HydrophobicContact CG-CZ 4.11Å; L275-Q371 PolarHBondContact O-NE2 3.47Å
276	V	97.5	Very high	94	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	146.8	-178	-66.8	0	0	0	0	112.4	A278 A288 A290 Y317 Y364	V276-A278 HydrophobicContact CG2-CB 4.11Å; V276-A278 PolarHBondContact O-N 2.98Å; V276-A288 HydrophobicContact CG2-CB 4.14Å; V276-A288 PolarHBondContact N-O 2.89Å; V276-A288 PolarHBondContact O-N 3.09Å; V276-A290 HydrophobicContact CG1-CB 4.21Å; V276-A290 HydrophobicContact CG2-CB 4.22Å; V276-Y317 CarbonylContact C-O 3.49Å; V276-Y317 WeakPolarHBondContact CA-O 3.34Å; V276-Y317 VanDerWaalsContact CB-O 3.31Å; V276-Y317 WeakPolarHBondContact CB-O 3.26Å; V276-Y364 HydrophobicContact CG1-CD2 3.41Å; V276-Y364 VanDerWaalsContact CG1-CD2 3.41Å; V276-Y364 HydrophobicContact CG1-CE2 4.06Å; V276-Y364 HydrophobicContact CG1-CG 3.78Å
277	W	97.6	Very high	94.1	Very high	1 Å²	1	46 Å²	46	0%	0.004	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	98.5	156.4	-72.1	115.1	0	0	0	107.9	F285 C316 Y317 M319 S320 I323 P324 F334 M338	W277-F285 HydrophobicContact CB-CD1 4Å; W277-F285 HydrophobicContact CE3-CB 4.29Å; W277-F285 WeakPolarHBondContact O-CD1 3.49Å; W277-C316 WeakPolarHBondContact O-CA 3.46Å; W277-Y317 PolarHBondContact N-O 3.42Å; W277-Y317 PolarHBondContact O-N 3.23Å; W277-M319 HydrophobicContact CD2-CE 3.91Å; W277-M319 HydrophobicContact CD2-SD 4.23Å; W277-M319 VanDerWaalsContact CE2-SD 3.57Å; W277-M319 HydrophobicContact CE3-CE 4.45Å; W277-M319 HydrophobicContact CG-CE 4.08Å; W277-M319 HydrophobicContact CG-SD 4.48Å; W277-M319 HydrophobicContact CZ2-CE 4.41Å; W277-M319 HydrophobicContact CZ2-SD 3.88Å; W277-M319 PolarHBondContact NE1-SD 3.31Å; W277-M319 VanDerWaalsContact NE1-SD 3.44Å; W277-S320 PolarHBondContact NE1-O 3.09Å; W277-S320 VanDerWaalsContact NE1-O 3.11Å; W277-S320 PolarHBondContact NE1-OG 3.23Å; W277-I323 HydrophobicContact CH2-CB 4.19Å; W277-I323 HydrophobicContact CH2-CG1 3.84Å; W277-I323 HydrophobicContact CH2-CG2 3.79Å; W277-I323 HydrophobicContact CZ2-CB 4.22Å; W277-I323 HydrophobicContact CZ2-CG1 3.86Å; W277-I323 HydrophobicContact CZ2-CG2 4.26Å; W277-I323 HydrophobicContact CZ3-CG2 4.16Å; W277-P324 HydrophobicContact CB-CG 3.98Å; W277-P324 HydrophobicContact CD2-CG 3.93Å; W277-P324 HydrophobicContact CE3-CG 4.26Å; W277-P324 HydrophobicContact CG-CG 3.8Å; W277-F334 AromaticContact CH2-CZ 3.89Å; W277-F334 HydrophobicContact CH2-CZ 3.89Å; W277-F334 HydrophobicContact CZ3-CE2 4.03Å; W277-F334 AromaticContact CZ3-CZ 3.84Å; W277-F334 HydrophobicContact CZ3-CZ 3.84Å; W277-M338 HydrophobicContact CH2-CE 3.87Å; W277-M338 HydrophobicContact CH2-SD 3.44Å; W277-M338 WeakPolarHBondContact CH2-SD 3.45Å; W277-M338 HydrophobicContact CZ2-CE 4.18Å; W277-M338 HydrophobicContact CZ2-SD 4.28Å; W277-M338 HydrophobicContact CZ3-SD 4.08Å
278	A	97.1	Very high	94.3	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	143.2	-180	0	0	0	0	0	111.2	V276 F285 W286 A288 A300 F302 V311	V276-A278 HydrophobicContact CG2-CB 4.11Å; V276-A278 PolarHBondContact O-N 2.98Å; A278-F285 WeakPolarHBondContact O-CA 3.39Å; A278-W286 PolarHBondContact N-O 3.45Å; A278-W286 PolarHBondContact O-N 3.44Å; A278-A288 HydrophobicContact CB-CB 4.15Å; A278-A300 HydrophobicContact CB-CB 4.26Å; A278-F302 HydrophobicContact CB-CE1 3.85Å; A278-F302 HydrophobicContact CB-CZ 4.27Å; A278-V311 HydrophobicContact CB-CG1 4.3Å; A278-V311 HydrophobicContact CB-CG2 4.28Å
279	K	95.3	Very high	94.4	Very high	81 Å²	81	41.8 Å²	41.8	35%	0.352	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	113.5	178.9	177.4	-179.6	174.1	-171	0	113.4	F285 N315	K279-F285 HydrophobicContact CB-CD1 3.54Å; K279-F285 HydrophobicContact CB-CD2 4.3Å; K279-F285 HydrophobicContact CB-CE1 3.56Å; K279-F285 HydrophobicContact CB-CE2 4.32Å; K279-F285 HydrophobicContact CB-CG 3.92Å; K279-F285 HydrophobicContact CB-CZ 3.95Å; K279-F285 HydrophobicContact CD-CD2 3.95Å; K279-F285 HydrophobicContact CD-CE1 4.31Å; K279-F285 HydrophobicContact CD-CE2 3.64Å; K279-F285 HydrophobicContact CD-CG 4.4Å; K279-F285 HydrophobicContact CD-CZ 3.82Å; K279-N315 HydrophobicContact CB-CB 4.28Å; K279-N315 PolarHBondContact N-O 3Å; K279-N315 VanDerWaalsContact N-O 3.07Å; K279-N315 WeakPolarHBondContact O-CB 3.4Å; K279-N315 PolarHBondContact O-ND2 3.35Å
280	L	93.4	Very high	94.6	Very high	47 Å²	47	41.7 Å²	41.7	25%	0.246	23%	0.226	C	C	.	.			trans	-77.7	153.7	166.9	-72	169.3	0	0	0	112	G282 F283 F302 A309 V311	L280-G282 PolarHBondContact O-N 3.27Å; L280-F283 HydrophobicContact CB-CB 4.13Å; L280-F283 HydrophobicContact CB-CD2 3.81Å; L280-F283 HydrophobicContact CB-CG 4.27Å; L280-F283 PolarHBondContact O-N 3.15Å; L280-F283 VanDerWaalsContact O-N 3.12Å; L280-F302 HydrophobicContact CD1-CE2 3.98Å; L280-F302 HydrophobicContact CD1-CZ 3.98Å; L280-F302 HydrophobicContact CG-CZ 4.16Å; L280-A309 HydrophobicContact CD1-CB 3.74Å; L280-A309 HydrophobicContact CD2-CB 3.75Å; L280-A309 HydrophobicContact CG-CB 4.26Å; L280-V311 HydrophobicContact CD2-CG2 3.85Å; L280-V311 HydrophobicContact CG-CG2 4.18Å
281	K	90.6	Very high	94.8	Very high	208 Å²	208	40.7 Å²	40.7	90%	0.904	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.7	117.8	178.1	-175.3	177.4	-179.5	177.4	0	110.2
282	G	88.9	Confident	95	Very high	82 Å²	82	38.8 Å²	38.8	85%	0.845	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	95.7	-9.6	-176.8	0	0	0	0	0	114.6	L280	L280-G282 PolarHBondContact O-N 3.27Å
283	F	90.6	Very high	95	Very high	137 Å²	137	40.6 Å²	40.6	60%	0.601	21%	0.211	S	C	*	.	S	Bend	trans	-107.1	159.5	-180	-67.5	-92.4	0	0	0	111.4	L280	L280-F283 HydrophobicContact CB-CB 4.13Å; L280-F283 HydrophobicContact CB-CD2 3.81Å; L280-F283 HydrophobicContact CB-CG 4.27Å; L280-F283 PolarHBondContact O-N 3.15Å; L280-F283 VanDerWaalsContact O-N 3.12Å
284	P	91.4	Very high	94.9	Very high	49 Å²	49	45.5 Å²	45.5	32%	0.318	23%	0.232	S	C	.	.			trans	-65	173.9	165.3	30.5	-36.3	0	0	0	111.3	W286 F325	P284-W286 HydrophobicContact CG-CE3 4.04Å; P284-W286 HydrophobicContact CG-CZ3 4.26Å; P284-F325 HydrophobicContact CB-CD2 4.1Å; P284-F325 HydrophobicContact CB-CE1 4.34Å; P284-F325 HydrophobicContact CB-CE2 3.72Å; P284-F325 HydrophobicContact CB-CZ 3.85Å
285	F	94.3	Very high	94.8	Very high	15 Å²	15	50.8 Å²	50.8	7%	0.066	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	146	161.3	-77.9	-86.5	0	0	0	109.5	W277 A278 K279 N315 Y317 P324 F325	W277-F285 HydrophobicContact CB-CD1 4Å; W277-F285 HydrophobicContact CE3-CB 4.29Å; W277-F285 WeakPolarHBondContact O-CD1 3.49Å; A278-F285 WeakPolarHBondContact O-CA 3.39Å; K279-F285 HydrophobicContact CB-CD1 3.54Å; K279-F285 HydrophobicContact CB-CD2 4.3Å; K279-F285 HydrophobicContact CB-CE1 3.56Å; K279-F285 HydrophobicContact CB-CE2 4.32Å; K279-F285 HydrophobicContact CB-CG 3.92Å; K279-F285 HydrophobicContact CB-CZ 3.95Å; K279-F285 HydrophobicContact CD-CD2 3.95Å; K279-F285 HydrophobicContact CD-CE1 4.31Å; K279-F285 HydrophobicContact CD-CE2 3.64Å; K279-F285 HydrophobicContact CD-CG 4.4Å; K279-F285 HydrophobicContact CD-CZ 3.82Å; F285-N315 WeakPolarHBondContact CE1-O 3.48Å; F285-Y317 HydrophobicContact CD1-CD2 4.47Å; F285-Y317 AromaticContact CE1-CD2 3.71Å; F285-Y317 HydrophobicContact CE1-CD2 3.71Å; F285-Y317 AromaticContact CE1-CE2 3.62Å; F285-Y317 HydrophobicContact CE1-CE2 3.62Å; F285-Y317 HydrophobicContact CE2-CE2 4.16Å; F285-Y317 AromaticContact CZ-CD2 3.92Å; F285-Y317 HydrophobicContact CZ-CD2 3.92Å; F285-Y317 AromaticContact CZ-CE2 3.33Å; F285-Y317 HydrophobicContact CZ-CE2 3.33Å; F285-P324 HydrophobicContact CB-CG 3.7Å; F285-P324 HydrophobicContact CD1-CG 3.98Å; F285-P324 HydrophobicContact CD2-CB 3.88Å; F285-P324 HydrophobicContact CD2-CG 3.76Å; F285-P324 HydrophobicContact CE2-CB 4.13Å; F285-P324 HydrophobicContact CE2-CG 4.38Å; F285-P324 HydrophobicContact CG-CB 4.19Å; F285-P324 HydrophobicContact CG-CG 3.55Å; F285-F325 HydrophobicContact CB-CD1 3.88Å; F285-F325 HydrophobicContact CB-CE1 4.02Å; F285-F325 WeakPolarHBondContact O-CE1 3.38Å; F285-F325 WeakPolarHBondContact O-CZ 3.44Å
286	W	96.1	Very high	94.6	Very high	39 Å²	39	53.1 Å²	53.1	15%	0.148	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	145.5	179.6	-152.2	-90.4	0	0	0	109.6	A278 P284 F302 F303 I333 F334 A337	A278-W286 PolarHBondContact N-O 3.45Å; A278-W286 PolarHBondContact O-N 3.44Å; P284-W286 HydrophobicContact CG-CE3 4.04Å; P284-W286 HydrophobicContact CG-CZ3 4.26Å; W286-F302 HydrophobicContact CB-CD1 3.78Å; W286-F302 HydrophobicContact CB-CE1 4.07Å; W286-F302 AromaticContact CD1-CD1 3.89Å; W286-F302 HydrophobicContact CG-CD1 4.15Å; W286-F303 PolarHBondContact NE1-O 3.4Å; W286-I333 HydrophobicContact CH2-CB 4.45Å; W286-I333 HydrophobicContact CH2-CG2 4.24Å; W286-I333 HydrophobicContact CZ2-CG2 4.11Å; W286-F334 HydrophobicContact CD2-CD2 4.21Å; W286-F334 AromaticContact CE3-CD2 3.8Å; W286-F334 HydrophobicContact CE3-CD2 3.8Å; W286-F334 HydrophobicContact CE3-CE2 4.44Å; W286-F334 HydrophobicContact CH2-CB 3.87Å; W286-F334 HydrophobicContact CH2-CD2 4.11Å; W286-F334 HydrophobicContact CZ2-CB 4.47Å; W286-F334 HydrophobicContact CZ2-CD2 4.47Å; W286-F334 HydrophobicContact CZ3-CB 4.14Å; W286-F334 AromaticContact CZ3-CD2 3.76Å; W286-F334 HydrophobicContact CZ3-CD2 3.76Å; W286-F334 HydrophobicContact CZ3-CG 4.45Å; W286-A337 HydrophobicContact CZ2-CB 4.01Å
287	P	97.3	Very high	94.6	Very high	0 Å²	0	57 Å²	57	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	133.8	173.3	28	-35.8	0	0	0	110.5	F303 M319 A337 M338 M341	P287-F303 HydrophobicContact CB-CD2 4Å; P287-F303 HydrophobicContact CG-CB 4.18Å; P287-F303 PolarHBondContact O-N 3.48Å; P287-M319 HydrophobicContact CB-CE 4.08Å; P287-A337 HydrophobicContact CG-CB 4.08Å; P287-M338 HydrophobicContact CB-SD 4.33Å; P287-M338 HydrophobicContact CG-SD 3.92Å; P287-M341 HydrophobicContact CB-CB 4.33Å; P287-M341 HydrophobicContact CB-CG 4.2Å; P287-M341 HydrophobicContact CB-SD 3.64Å
288	A	97.9	Very high	94.6	Very high	0 Å²	0	57 Å²	57	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	159.5	176.7	0	0	0	0	0	111.9	L275 V276 A278 A300 R301 F302	L275-A288 WeakPolarHBondContact CA-O 3.44Å; V276-A288 HydrophobicContact CG2-CB 4.14Å; V276-A288 PolarHBondContact N-O 2.89Å; V276-A288 PolarHBondContact O-N 3.09Å; A278-A288 HydrophobicContact CB-CB 4.15Å; A288-A300 HydrophobicContact CB-CB 4.15Å; A288-R301 CarbonylContact C-O 3.59Å; A288-R301 VanDerWaalsContact CA-O 3.25Å; A288-R301 WeakPolarHBondContact CA-O 3.48Å; A288-R301 WeakPolarHBondContact CB-O 3.34Å; A288-F302 HydrophobicContact CB-CD1 3.72Å; A288-F302 HydrophobicContact CB-CE1 4.03Å; A288-F302 HydrophobicContact CB-CG 4.28Å
289	K	97.6	Very high	94.5	Very high	2 Å²	2	57.2 Å²	57.2	1%	0.009	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	133.8	161	-61.4	-176.9	-172.4	177.5	0	108.5	F265 H273 L275 L291 A300 R301 F303 Y344	F265-K289 HydrophobicContact CE1-CD 4.22Å; F265-K289 HydrophobicContact CE1-CG 4.3Å; F265-K289 HydrophobicContact CE2-CD 3.94Å; F265-K289 HydrophobicContact CZ-CD 3.65Å; F265-K289 HydrophobicContact CZ-CG 3.9Å; F265-K289 VanDerWaalsContact O-CE 3.27Å; F265-K289 WeakPolarHBondContact O-CE 3.37Å; F265-K289 PolarHBondContact O-NZ 2.95Å; H273-K289 HydrophobicContact CB-CB 3.9Å; H273-K289 HydrophobicContact CB-CD 4.41Å; H273-K289 HydrophobicContact CB-CG 4.44Å; L275-K289 HydrophobicContact CD2-CG 3.98Å; K289-L291 HydrophobicContact CB-CD1 3.56Å; K289-L291 VanDerWaalsContact O-CD1 3.26Å; K289-L291 WeakPolarHBondContact O-CD1 3.39Å; K289-A300 WeakPolarHBondContact O-CA 3.4Å; K289-R301 PolarHBondContact N-O 2.91Å; K289-R301 PolarHBondContact O-N 3.27Å; K289-F303 HydrophobicContact CD-CZ 4.48Å; K289-F303 HydrophobicContact CG-CE2 3.87Å; K289-F303 HydrophobicContact CG-CZ 3.85Å; K289-Y344 HydrophobicContact CD-CE2 4.38Å; K289-Y344 VanDerWaalsContact CE-CE2 3.42Å
290	A	96.9	Very high	94.6	Very high	3 Å²	3	53.3 Å²	53.3	3%	0.025	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	108.7	168.1	0	0	0	0	0	109.2	H273 P274 V276 V298 Y364	H273-A290 WeakPolarHBondContact CB-O 3.32Å; P274-A290 PolarHBondContact O-N 3.18Å; V276-A290 HydrophobicContact CG1-CB 4.21Å; V276-A290 HydrophobicContact CG2-CB 4.22Å; A290-V298 HydrophobicContact CB-CG1 3.56Å; A290-Y364 HydrophobicContact CB-CE2 4.08Å
291	L	95.3	Very high	94.8	Very high	17 Å²	17	52.6 Å²	52.6	9%	0.089	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	-43	-171.7	-83.5	62	0	0	0	112.4	V249 K289 D299 R301	V249-L291 HydrophobicContact CG1-CB 3.59Å; V249-L291 HydrophobicContact CG1-CD2 3.8Å; V249-L291 HydrophobicContact CG1-CG 4.16Å; K289-L291 HydrophobicContact CB-CD1 3.56Å; K289-L291 VanDerWaalsContact O-CD1 3.26Å; K289-L291 WeakPolarHBondContact O-CD1 3.39Å; L291-D299 PolarHBondContact N-O 3.45Å; L291-R301 HydrophobicContact CD1-CB 3.67Å; L291-R301 HydrophobicContact CD2-CB 4.19Å
292	R	93.9	Very high	95.1	Very high	76 Å²	76	43.5 Å²	43.5	29%	0.287	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-157	159.3	175.8	60.3	175.3	177.2	-169.5	-7.4	111.3	N245 V249 D299 W310	N245-R292 PolarHBondContact OD1-NH1 3.5Å; N245-R292 PolarHBondContact OD1-NH2 2.93Å; V249-R292 HydrophobicContact CG1-CG 4.3Å; R292-D299 HydrophobicContact CG-CB 3.54Å; R292-D299 IonicContact CZ-OD2 2.8Å; R292-D299 VanDerWaalsContact CZ-OD2 3.26Å; R292-D299 IonicContact NE-OD2 2.88Å; R292-D299 PolarHBondContact NE-OD2 3.1Å; R292-D299 IonicContact NH2-OD2 3.26Å; R292-D299 PolarHBondContact NH2-OD2 3.22Å; R292-D299 WeakPolarHBondContact O-CB 3.46Å; R292-D299 PolarHBondContact O-N 2.91Å; R292-W310 HydrophobicContact CG-CH2 4.25Å
293	D	94.3	Very high	95.5	Very high	52 Å²	52	39.7 Å²	39.7	28%	0.278	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	140.7	175.8	-60	-61.3	0	0	0	111	Y364 P366	D293-Y364 WeakPolarHBondContact OD1-CE1 3.28Å; D293-Y364 PolarHBondContact OD2-OH 2.88Å; D293-P366 HydrophobicContact CB-CB 4.24Å; D293-P366 HydrophobicContact CB-CG 4.49Å; D293-P366 VanDerWaalsContact OD2-CA 3.27Å; D293-P366 WeakPolarHBondContact OD2-CA 3.47Å; D293-P366 WeakPolarHBondContact OD2-CB 3.4Å
294	K	93.4	Very high	95.7	Very high	121 Å²	121	34.5 Å²	34.5	53%	0.526	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.6	133.4	172.2	-178.3	167.4	178.5	174.3	0	111.1	G296 Q297 W310	K294-G296 VanDerWaalsContact C-N 3.26Å; K294-G296 PolarHBondContact O-N 3.08Å; K294-G296 VanDerWaalsContact O-N 3.1Å; K294-Q297 PolarHBondContact N-O 2.97Å; K294-Q297 WeakPolarHBondContact O-CA 3.43Å; K294-Q297 WeakPolarHBondContact O-CB 3.47Å; K294-Q297 PolarHBondContact O-N 2.88Å; K294-Q297 VanDerWaalsContact O-O 3.06Å; K294-W310 HydrophobicContact CB-CH2 3.71Å; K294-W310 HydrophobicContact CB-CZ3 3.72Å
295	D	93.4	Very high	95.6	Very high	136 Å²	136	38.2 Å²	38.2	73%	0.727	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	50	39.9	169.6	-49.4	-26.4	0	0	0	114.6	Q297	D295-Q297 VanDerWaalsContact C-N 3.32Å; D295-Q297 PolarHBondContact O-N 3.48Å
296	G	94.3	Very high	95.7	Very high	50 Å²	50	39.2 Å²	39.2	52%	0.515	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.7	14.4	-177.6	0	0	0	0	0	115.1	K294 I313	K294-G296 VanDerWaalsContact C-N 3.26Å; K294-G296 PolarHBondContact O-N 3.08Å; K294-G296 VanDerWaalsContact O-N 3.1Å; G296-I313 WeakPolarHBondContact O-CB 3.42Å; G296-I313 WeakPolarHBondContact O-CG2 3.23Å; G296-I313 PolarHBondContact O-N 2.72Å
297	Q	96.7	Very high	95.5	Very high	82 Å²	82	41.5 Å²	41.5	38%	0.383	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	149.3	179.5	-56.8	179.3	61.4	0	0	110.8	K294 D295 W310 V311	K294-Q297 PolarHBondContact N-O 2.97Å; K294-Q297 WeakPolarHBondContact O-CA 3.43Å; K294-Q297 WeakPolarHBondContact O-CB 3.47Å; K294-Q297 PolarHBondContact O-N 2.88Å; K294-Q297 VanDerWaalsContact O-O 3.06Å; D295-Q297 VanDerWaalsContact C-N 3.32Å; D295-Q297 PolarHBondContact O-N 3.48Å; Q297-W310 HydrophobicContact CB-CE3 3.87Å; Q297-V311 CarbonylContact C-O 3.46Å; Q297-V311 WeakPolarHBondContact CA-O 3.47Å
298	V	97.2	Very high	95.4	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	128.1	-180	-173.1	0	0	0	0	108.6	A290 A300 W310 V311 I313 C316 Y364	A290-V298 HydrophobicContact CB-CG1 3.56Å; V298-A300 PolarHBondContact O-N 3.33Å; V298-A300 VanDerWaalsContact O-N 3.11Å; V298-W310 WeakPolarHBondContact O-CA 3.33Å; V298-V311 PolarHBondContact N-O 3.46Å; V298-V311 PolarHBondContact O-N 3.47Å; V298-I313 HydrophobicContact CG2-CB 4.21Å; V298-I313 HydrophobicContact CG2-CD1 4.49Å; V298-I313 HydrophobicContact CG2-CG1 3.98Å; V298-C316 HydrophobicContact CG2-CB 4.45Å; V298-Y364 HydrophobicContact CG1-CE1 4.33Å; V298-Y364 HydrophobicContact CG2-CD1 3.86Å; V298-Y364 HydrophobicContact CG2-CE1 3.83Å
299	D	96.5	Very high	95.4	Very high	4 Å²	4	45.6 Å²	45.6	2%	0.021	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	92	170.9	-161.8	-29.4	0	0	0	107.8	L291 R292 R308 W310	L291-D299 PolarHBondContact N-O 3.45Å; R292-D299 HydrophobicContact CG-CB 3.54Å; R292-D299 IonicContact CZ-OD2 2.8Å; R292-D299 VanDerWaalsContact CZ-OD2 3.26Å; R292-D299 IonicContact NE-OD2 2.88Å; R292-D299 PolarHBondContact NE-OD2 3.1Å; R292-D299 IonicContact NH2-OD2 3.26Å; R292-D299 PolarHBondContact NH2-OD2 3.22Å; R292-D299 WeakPolarHBondContact O-CB 3.46Å; R292-D299 PolarHBondContact O-N 2.91Å; D299-R308 IonicContact OD1-CZ 2.88Å; D299-R308 IonicContact OD1-NH1 2.95Å; D299-R308 PolarHBondContact OD1-NH1 3.25Å; D299-R308 IonicContact OD2-NH1 2.78Å; D299-R308 PolarHBondContact OD2-NH1 3.42Å; D299-W310 HydrophobicContact CB-CD2 4.4Å; D299-W310 HydrophobicContact CB-CE3 4.03Å; D299-W310 HydrophobicContact CB-CH2 3.81Å; D299-W310 HydrophobicContact CB-CZ2 4.17Å; D299-W310 HydrophobicContact CB-CZ3 3.72Å
300	A	97.1	Very high	95.3	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	129.1	-171.5	0	0	0	0	0	110.9	A278 A288 K289 V298 F302 R308 A309 V311	A278-A300 HydrophobicContact CB-CB 4.26Å; A288-A300 HydrophobicContact CB-CB 4.15Å; K289-A300 WeakPolarHBondContact O-CA 3.4Å; V298-A300 PolarHBondContact O-N 3.33Å; V298-A300 VanDerWaalsContact O-N 3.11Å; A300-F302 HydrophobicContact CB-CE2 4.46Å; A300-F302 HydrophobicContact CB-CZ 4.27Å; A300-R308 CarbonylContact O-C 3.45Å; A300-R308 WeakPolarHBondContact O-CA 3.43Å; A300-A309 PolarHBondContact N-O 3.1Å; A300-A309 PolarHBondContact O-N 2.71Å; A300-V311 HydrophobicContact CB-CB 4.48Å; A300-V311 HydrophobicContact CB-CG2 3.79Å
301	R	97.6	Very high	95.4	Very high	31 Å²	31	50 Å²	50	12%	0.117	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	117.6	174.8	-160.7	165.7	-172.5	160.7	4.5	110.8	E246 F265 A288 K289 L291 H306 D307 R308	E246-R301 IonicContact OE2-NH1 2.63Å; E246-R301 PolarHBondContact OE2-NH1 3.43Å; F265-R301 HydrophobicContact CE2-CB 4.41Å; F265-R301 HydrophobicContact CE2-CG 3.93Å; F265-R301 HydrophobicContact CZ-CB 4.21Å; F265-R301 HydrophobicContact CZ-CG 4.03Å; A288-R301 CarbonylContact C-O 3.59Å; A288-R301 VanDerWaalsContact CA-O 3.25Å; A288-R301 WeakPolarHBondContact CA-O 3.48Å; A288-R301 WeakPolarHBondContact CB-O 3.34Å; K289-R301 PolarHBondContact N-O 2.91Å; K289-R301 PolarHBondContact O-N 3.27Å; L291-R301 HydrophobicContact CD1-CB 3.67Å; L291-R301 HydrophobicContact CD2-CB 4.19Å; R301-H306 WeakPolarHBondContact CG-O 3.29Å; R301-H306 PolarHBondContact NE-O 2.79Å; R301-D307 WeakPolarHBondContact CA-O 3.44Å; R301-R308 HydrophobicContact CB-CG 4.2Å; R301-R308 HydrophobicContact CG-CG 3.94Å
302	F	97.5	Very high	95.5	Very high	18 Å²	18	52.1 Å²	52.1	8%	0.079	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	140.9	-165.7	-65.1	-81.2	0	0	0	113.1	A278 L280 W286 A288 A300 H306 D307 A309 V311	A278-F302 HydrophobicContact CB-CE1 3.85Å; A278-F302 HydrophobicContact CB-CZ 4.27Å; L280-F302 HydrophobicContact CD1-CE2 3.98Å; L280-F302 HydrophobicContact CD1-CZ 3.98Å; L280-F302 HydrophobicContact CG-CZ 4.16Å; W286-F302 HydrophobicContact CB-CD1 3.78Å; W286-F302 HydrophobicContact CB-CE1 4.07Å; W286-F302 AromaticContact CD1-CD1 3.89Å; W286-F302 HydrophobicContact CG-CD1 4.15Å; A288-F302 HydrophobicContact CB-CD1 3.72Å; A288-F302 HydrophobicContact CB-CE1 4.03Å; A288-F302 HydrophobicContact CB-CG 4.28Å; A300-F302 HydrophobicContact CB-CE2 4.46Å; A300-F302 HydrophobicContact CB-CZ 4.27Å; F302-H306 WeakPolarHBondContact O-CA 3.08Å; F302-H306 PolarHBondContact O-N 2.93Å; F302-H306 VanDerWaalsContact O-N 3.07Å; F302-D307 WeakPolarHBondContact CD2-O 3.42Å; F302-D307 PolarHBondContact N-O 2.99Å; F302-A309 HydrophobicContact CE2-CB 4.08Å; F302-V311 HydrophobicContact CZ-CG2 4.06Å
303	F	97.2	Very high	95.6	Very high	1 Å²	1	50.1 Å²	50.1	0%	0.004	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.7	153.5	171.9	-70.6	-95.4	0	0	0	111.4	F265 L275 W286 P287 K289 Q305 A337 E340 M341 Y344	F265-F303 AromaticContact CD1-CD1 3.5Å; F265-F303 HydrophobicContact CD1-CD1 3.5Å; F265-F303 VanDerWaalsContact CD1-CD1 3.5Å; F265-F303 AromaticContact CD1-CE1 3.68Å; F265-F303 HydrophobicContact CD1-CE1 3.68Å; F265-F303 HydrophobicContact CD1-CG 4.09Å; F265-F303 HydrophobicContact CD1-CZ 4.41Å; F265-F303 HydrophobicContact CE1-CB 4.35Å; F265-F303 AromaticContact CE1-CD1 3.5Å; F265-F303 HydrophobicContact CE1-CD1 3.5Å; F265-F303 AromaticContact CE1-CD2 3.96Å; F265-F303 HydrophobicContact CE1-CD2 3.96Å; F265-F303 AromaticContact CE1-CE1 3.64Å; F265-F303 HydrophobicContact CE1-CE1 3.64Å; F265-F303 HydrophobicContact CE1-CE2 4.1Å; F265-F303 AromaticContact CE1-CG 3.67Å; F265-F303 HydrophobicContact CE1-CG 3.67Å; F265-F303 AromaticContact CE1-CZ 3.95Å; F265-F303 HydrophobicContact CE1-CZ 3.95Å; L275-F303 HydrophobicContact CD2-CE2 3.9Å; L275-F303 HydrophobicContact CD2-CZ 3.87Å; W286-F303 PolarHBondContact NE1-O 3.4Å; P287-F303 HydrophobicContact CB-CD2 4Å; P287-F303 HydrophobicContact CG-CB 4.18Å; P287-F303 PolarHBondContact O-N 3.48Å; K289-F303 HydrophobicContact CD-CZ 4.48Å; K289-F303 HydrophobicContact CG-CE2 3.87Å; K289-F303 HydrophobicContact CG-CZ 3.85Å; F303-Q305 PolarHBondContact O-N 2.88Å; F303-A337 HydrophobicContact CB-CB 4.06Å; F303-A337 WeakPolarHBondContact CB-O 3.29Å; F303-A337 VanDerWaalsContact O-CB 3.32Å; F303-A337 WeakPolarHBondContact O-CB 3.37Å; F303-E340 WeakPolarHBondContact CA-OE2 3.38Å; F303-E340 HydrophobicContact CD1-CB 4.12Å; F303-E340 HydrophobicContact CD1-CG 3.91Å; F303-E340 WeakPolarHBondContact CD1-OE2 3.4Å; F303-M341 HydrophobicContact CD1-CB 3.92Å; F303-M341 HydrophobicContact CD2-CB 4.09Å; F303-M341 HydrophobicContact CD2-CG 4.2Å; F303-M341 HydrophobicContact CE1-CB 4.09Å; F303-M341 HydrophobicContact CE1-CG 4.45Å; F303-M341 HydrophobicContact CE2-CB 4.24Å; F303-M341 HydrophobicContact CE2-CG 3.98Å; F303-M341 HydrophobicContact CG-CB 3.94Å; F303-M341 HydrophobicContact CZ-CB 4.24Å; F303-M341 HydrophobicContact CZ-CG 4.11Å; F303-Y344 HydrophobicContact CE1-CG 4.18Å; F303-Y344 HydrophobicContact CZ-CD1 4.39Å; F303-Y344 HydrophobicContact CZ-CD2 4.5Å; F303-Y344 HydrophobicContact CZ-CG 4.08Å
304	G	93.3	Very high	95.7	Very high	28 Å²	28	54.2 Å²	54.2	29%	0.289	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.4	-63.9	-178	0	0	0	0	0	113.8	E340	G304-E340 PolarHBondContact N-OE2 3.27Å
305	Q	91	Very high	95.8	Very high	127 Å²	127	51.1 Å²	51.1	59%	0.593	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.8	-12.9	-178.3	-68.4	-172.7	-119.2	0	0	114.1	F303 D307	F303-Q305 PolarHBondContact O-N 2.88Å; Q305-D307 VanDerWaalsContact CB-OD2 3.29Å; Q305-D307 WeakPolarHBondContact CB-OD2 3.45Å; Q305-D307 PolarHBondContact O-N 2.89Å; Q305-D307 VanDerWaalsContact O-N 3.13Å
306	H	94.6	Very high	96	Very high	37 Å²	37	44.7 Å²	44.7	17%	0.171	24%	0.241	C	C	.	.			trans	62.9	12.6	178.2	-45.9	140	0	0	0	115.8	W264 F265 R301 F302 E340	W264-H306 AromaticContact CE2-ND1 3.86Å; W264-H306 HydrophobicContact CH2-CB 4.23Å; W264-H306 HydrophobicContact CZ2-CB 3.94Å; W264-H306 AromaticContact CZ2-CG 3.71Å; W264-H306 AromaticContact CZ2-ND1 3.4Å; W264-H306 WeakPolarHBondContact CZ2-ND1 3.46Å; W264-H306 AromaticContact NE1-ND1 3.86Å; F265-H306 WeakPolarHBondContact CB-NE2 3.25Å; F265-H306 AromaticContact CD1-CD2 3.41Å; F265-H306 VanDerWaalsContact CD1-CD2 3.41Å; F265-H306 WeakPolarHBondContact CD1-CD2 3.23Å; F265-H306 AromaticContact CD1-NE2 3.68Å; F265-H306 AromaticContact CD2-CD2 3.96Å; F265-H306 AromaticContact CE1-CD2 3.97Å; F265-H306 AromaticContact CG-CD2 3.41Å; F265-H306 VanDerWaalsContact CG-CD2 3.41Å; F265-H306 WeakPolarHBondContact CG-CD2 3.36Å; F265-H306 AromaticContact CG-NE2 3.63Å; R301-H306 WeakPolarHBondContact CG-O 3.29Å; R301-H306 PolarHBondContact NE-O 2.79Å; F302-H306 WeakPolarHBondContact O-CA 3.08Å; F302-H306 PolarHBondContact O-N 2.93Å; F302-H306 VanDerWaalsContact O-N 3.07Å; H306-E340 IonicContact CD2-OE1 3.24Å; H306-E340 IonicContact CD2-OE2 3.86Å; H306-E340 IonicContact CE1-OE1 2.83Å; H306-E340 PolarHBondContact CE1-OE1 3.29Å; H306-E340 VanDerWaalsContact CE1-OE1 3.28Å; H306-E340 IonicContact NE2-OE1 2.73Å; H306-E340 PolarHBondContact NE2-OE1 2.61Å; H306-E340 IonicContact NE2-OE2 2.71Å; H306-E340 PolarHBondContact NE2-OE2 2.65Å
307	D	93.7	Very high	96.2	Very high	87 Å²	87	44.6 Å²	44.6	47%	0.465	23%	0.225	S	C	.	.			trans	-55.9	147.9	170.7	-62.8	-43.7	0	0	0	111.5	R301 F302 Q305	R301-D307 WeakPolarHBondContact CA-O 3.44Å; F302-D307 WeakPolarHBondContact CD2-O 3.42Å; F302-D307 PolarHBondContact N-O 2.99Å; Q305-D307 VanDerWaalsContact CB-OD2 3.29Å; Q305-D307 WeakPolarHBondContact CB-OD2 3.45Å; Q305-D307 PolarHBondContact O-N 2.89Å; Q305-D307 VanDerWaalsContact O-N 3.13Å
308	R	94.5	Very high	96.2	Very high	61 Å²	61	40.9 Å²	40.9	23%	0.23	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	148.1	169.2	-80.2	-172.7	-176	-122.3	13.7	111.2	E246 D299 A300 R301	E246-R308 VanDerWaalsContact CD-NE 3.33Å; E246-R308 IonicContact OE1-CZ 3.83Å; E246-R308 IonicContact OE1-NE 2.99Å; E246-R308 PolarHBondContact OE1-NE 3.06Å; E246-R308 IonicContact OE1-NH1 2.76Å; E246-R308 IonicContact OE1-NH2 3.93Å; E246-R308 PolarHBondContact OE1-NH2 2.96Å; E246-R308 IonicContact OE2-CZ 3.8Å; E246-R308 VanDerWaalsContact OE2-CZ 3.24Å; E246-R308 IonicContact OE2-NE 3.64Å; E246-R308 PolarHBondContact OE2-NE 3.28Å; E246-R308 IonicContact OE2-NH2 3.01Å; E246-R308 PolarHBondContact OE2-NH2 2.89Å; D299-R308 IonicContact OD1-CZ 2.88Å; D299-R308 IonicContact OD1-NH1 2.95Å; D299-R308 PolarHBondContact OD1-NH1 3.25Å; D299-R308 IonicContact OD2-NH1 2.78Å; D299-R308 PolarHBondContact OD2-NH1 3.42Å; A300-R308 CarbonylContact O-C 3.45Å; A300-R308 WeakPolarHBondContact O-CA 3.43Å; R301-R308 HydrophobicContact CB-CG 4.2Å; R301-R308 HydrophobicContact CG-CG 3.94Å
309	A	96.8	Very high	96.2	Very high	25 Å²	25	40.9 Å²	40.9	21%	0.207	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	153.6	157.8	0	0	0	0	0	112	L280 A300 F302	L280-A309 HydrophobicContact CD1-CB 3.74Å; L280-A309 HydrophobicContact CD2-CB 3.75Å; L280-A309 HydrophobicContact CG-CB 4.26Å; A300-A309 PolarHBondContact N-O 3.1Å; A300-A309 PolarHBondContact O-N 2.71Å; F302-A309 HydrophobicContact CE2-CB 4.08Å
310	W	97.4	Very high	96.2	Very high	98 Å²	98	40.9 Å²	40.9	37%	0.371	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	125.7	164.2	-69.1	99.7	0	0	0	110	R292 K294 Q297 V298 D299	R292-W310 HydrophobicContact CG-CH2 4.25Å; K294-W310 HydrophobicContact CB-CH2 3.71Å; K294-W310 HydrophobicContact CB-CZ3 3.72Å; Q297-W310 HydrophobicContact CB-CE3 3.87Å; V298-W310 WeakPolarHBondContact O-CA 3.33Å; D299-W310 HydrophobicContact CB-CD2 4.4Å; D299-W310 HydrophobicContact CB-CE3 4.03Å; D299-W310 HydrophobicContact CB-CH2 3.81Å; D299-W310 HydrophobicContact CB-CZ2 4.17Å; D299-W310 HydrophobicContact CB-CZ3 3.72Å
311	V	97.7	Very high	96	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	128.5	-178.1	-176.5	0	0	0	0	108.9	A278 L280 Q297 V298 A300 F302 I313 N315 C316	A278-V311 HydrophobicContact CB-CG1 4.3Å; A278-V311 HydrophobicContact CB-CG2 4.28Å; L280-V311 HydrophobicContact CD2-CG2 3.85Å; L280-V311 HydrophobicContact CG-CG2 4.18Å; Q297-V311 CarbonylContact C-O 3.46Å; Q297-V311 WeakPolarHBondContact CA-O 3.47Å; V298-V311 PolarHBondContact N-O 3.46Å; V298-V311 PolarHBondContact O-N 3.47Å; A300-V311 HydrophobicContact CB-CB 4.48Å; A300-V311 HydrophobicContact CB-CG2 3.79Å; F302-V311 HydrophobicContact CZ-CG2 4.06Å; V311-I313 PolarHBondContact O-N 3.04Å; V311-N315 HydrophobicContact CG1-CB 4.01Å; V311-C316 VanDerWaalsContact CG1-SG 3.59Å
312	P	97.3	Very high	95.8	Very high	61 Å²	61	51.4 Å²	51.4	40%	0.396	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.2	134	175.6	-24.1	33.9	0	0	0	111	N314 N315	P312-N314 PolarHBondContact O-N 2.92Å; P312-N314 VanDerWaalsContact O-N 3.1Å; P312-N315 WeakPolarHBondContact O-CA 3.38Å; P312-N315 WeakPolarHBondContact O-CB 3.32Å; P312-N315 PolarHBondContact O-N 2.82Å
313	I	96.3	Very high	95.5	Very high	34 Å²	34	53.4 Å²	53.4	17%	0.174	27%	0.268	C	S	.	.	G	3₁₀ helix	trans	-58.4	-33.3	-169.7	-164.2	166.4	0	0	0	113.4	G296 V298 V311 N315 C316 Y364 P366	G296-I313 WeakPolarHBondContact O-CB 3.42Å; G296-I313 WeakPolarHBondContact O-CG2 3.23Å; G296-I313 PolarHBondContact O-N 2.72Å; V298-I313 HydrophobicContact CG2-CB 4.21Å; V298-I313 HydrophobicContact CG2-CD1 4.49Å; V298-I313 HydrophobicContact CG2-CG1 3.98Å; V311-I313 PolarHBondContact O-N 3.04Å; I313-N315 PolarHBondContact O-N 3.3Å; I313-N315 VanDerWaalsContact O-N 3.11Å; I313-C316 WeakPolarHBondContact O-CB 3.27Å; I313-C316 PolarHBondContact O-N 3.45Å; I313-Y364 HydrophobicContact CD1-CD1 4.07Å; I313-Y364 HydrophobicContact CD1-CE1 4.36Å; I313-Y364 HydrophobicContact CG1-CD1 3.96Å; I313-P366 HydrophobicContact CD1-CG 3.81Å
314	N	95.8	Very high	95	Very high	138 Å²	138	53.8 Å²	53.8	74%	0.738	27%	0.27	S	S	*	.	G	3₁₀ helix	trans	-64.8	-13.2	175.8	-60.6	-10.2	0	0	0	114.1	P312	P312-N314 PolarHBondContact O-N 2.92Å; P312-N314 VanDerWaalsContact O-N 3.1Å
315	N	96.7	Very high	94.5	Very high	56 Å²	56	55.2 Å²	55.2	30%	0.299	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	-100.4	9.2	173.7	-69.1	-11	0	0	0	112.8	K279 F285 V311 P312 I313	K279-N315 HydrophobicContact CB-CB 4.28Å; K279-N315 PolarHBondContact N-O 3Å; K279-N315 VanDerWaalsContact N-O 3.07Å; K279-N315 WeakPolarHBondContact O-CB 3.4Å; K279-N315 PolarHBondContact O-ND2 3.35Å; F285-N315 WeakPolarHBondContact CE1-O 3.48Å; V311-N315 HydrophobicContact CG1-CB 4.01Å; P312-N315 WeakPolarHBondContact O-CA 3.38Å; P312-N315 WeakPolarHBondContact O-CB 3.32Å; P312-N315 PolarHBondContact O-N 2.82Å; I313-N315 PolarHBondContact O-N 3.3Å; I313-N315 VanDerWaalsContact O-N 3.11Å
316	C	97.4	Very high	93.3	Very high	1 Å²	1	53.2 Å²	53.2	1%	0.007	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	122.3	175.4	-67	0	0	0	0	110.1	W277 V298 V311 I313 Y364	W277-C316 WeakPolarHBondContact O-CA 3.46Å; V298-C316 HydrophobicContact CG2-CB 4.45Å; V311-C316 VanDerWaalsContact CG1-SG 3.59Å; I313-C316 WeakPolarHBondContact O-CB 3.27Å; I313-C316 PolarHBondContact O-N 3.45Å; C316-Y364 HydrophobicContact CB-CD1 4.42Å; C316-Y364 HydrophobicContact CB-CG 4.35Å; C316-Y364 WeakPolarHBondContact O-CB 3.35Å; C316-Y364 PolarHBondContact O-N 2.68Å
317	Y	97.4	Very high	91.9	Very high	48 Å²	48	53.5 Å²	53.5	19%	0.188	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	148.8	167.1	-53.1	-48.1	0	0	0	109.5	V276 W277 F285 P324 R361 T362	V276-Y317 CarbonylContact C-O 3.49Å; V276-Y317 WeakPolarHBondContact CA-O 3.34Å; V276-Y317 VanDerWaalsContact CB-O 3.31Å; V276-Y317 WeakPolarHBondContact CB-O 3.26Å; W277-Y317 PolarHBondContact N-O 3.42Å; W277-Y317 PolarHBondContact O-N 3.23Å; F285-Y317 HydrophobicContact CD1-CD2 4.47Å; F285-Y317 AromaticContact CE1-CD2 3.71Å; F285-Y317 HydrophobicContact CE1-CD2 3.71Å; F285-Y317 AromaticContact CE1-CE2 3.62Å; F285-Y317 HydrophobicContact CE1-CE2 3.62Å; F285-Y317 HydrophobicContact CE2-CE2 4.16Å; F285-Y317 AromaticContact CZ-CD2 3.92Å; F285-Y317 HydrophobicContact CZ-CD2 3.92Å; F285-Y317 AromaticContact CZ-CE2 3.33Å; F285-Y317 HydrophobicContact CZ-CE2 3.33Å; Y317-P324 HydrophobicContact CD2-CB 4.39Å; Y317-P324 HydrophobicContact CE2-CB 4.47Å; Y317-R361 HydrophobicContact CD1-CB 4.38Å; Y317-R361 WeakPolarHBondContact CD1-O 3.27Å; Y317-R361 HydrophobicContact CD2-CB 4.25Å; Y317-R361 HydrophobicContact CD2-CG 4.12Å; Y317-R361 HydrophobicContact CE1-CB 4.37Å; Y317-R361 HydrophobicContact CE2-CB 4.21Å; Y317-R361 HydrophobicContact CE2-CG 3.91Å; Y317-R361 HydrophobicContact CG-CB 4.34Å; Y317-R361 PolarHBondContact OH-NH1 2.64Å; Y317-R361 VanDerWaalsContact OH-NH1 3.17Å; Y317-T362 CarbonylContact C-O 3.28Å; Y317-T362 VanDerWaalsContact CA-O 3.23Å; Y317-T362 WeakPolarHBondContact CA-O 3.3Å; Y317-T362 WeakPolarHBondContact CB-O 3.49Å
318	L	97.3	Very high	90.4	Very high	3 Å²	3	57.9 Å²	57.9	2%	0.016	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.8	151	168.6	-73.8	168.5	0	0	0	110.6	S320 S358 T362 Y364 Y370 Q371	L318-S320 PolarHBondContact O-N 3.46Å; L318-S358 WeakPolarHBondContact CB-OG 3.35Å; L318-T362 HydrophobicContact CD1-CG2 4.01Å; L318-T362 PolarHBondContact N-O 3.41Å; L318-Y364 HydrophobicContact CD2-CD2 3.78Å; L318-Y364 HydrophobicContact CD2-CE2 4.46Å; L318-Y364 HydrophobicContact CG-CD2 4.42Å; L318-Y370 HydrophobicContact CD1-CG 4.48Å; L318-Q371 HydrophobicContact CD2-CG 4.42Å
319	M	97.4	Very high	88.6	Confident	1 Å²	1	64.6 Å²	64.6	1%	0.005	32%	0.319	C	S	.	.			trans	-61.8	110.6	-176.7	-174.3	49.8	56.3	0	0	112.3	L275 W277 P287 M341 F355 Y357 S358	L275-M319 HydrophobicContact CB-CB 3.65Å; L275-M319 HydrophobicContact CB-CG 4.14Å; L275-M319 WeakPolarHBondContact O-CB 3.4Å; L275-M319 PolarHBondContact O-N 3.48Å; W277-M319 HydrophobicContact CD2-CE 3.91Å; W277-M319 HydrophobicContact CD2-SD 4.23Å; W277-M319 VanDerWaalsContact CE2-SD 3.57Å; W277-M319 HydrophobicContact CE3-CE 4.45Å; W277-M319 HydrophobicContact CG-CE 4.08Å; W277-M319 HydrophobicContact CG-SD 4.48Å; W277-M319 HydrophobicContact CZ2-CE 4.41Å; W277-M319 HydrophobicContact CZ2-SD 3.88Å; W277-M319 PolarHBondContact NE1-SD 3.31Å; W277-M319 VanDerWaalsContact NE1-SD 3.44Å; P287-M319 HydrophobicContact CB-CE 4.08Å; M319-M341 HydrophobicContact CE-SD 3.47Å; M319-M341 WeakPolarHBondContact CE-SD 3.1Å; M319-M341 HydrophobicContact CG-SD 4.06Å; M319-M341 HydrophobicContact SD-CE 4.09Å; M319-M341 HydrophobicContact SD-SD 3.5Å; M319-F355 HydrophobicContact CB-CZ 4.35Å; M319-F355 HydrophobicContact CG-CZ 4.47Å; M319-Y357 HydrophobicContact CG-CD1 3.93Å; M319-Y357 HydrophobicContact CG-CE1 3.79Å; M319-Y357 WeakPolarHBondContact O-CA 3.45Å; M319-S358 PolarHBondContact O-N 2.77Å
320	S	96.2	Very high	86.9	Confident	4 Å²	4	66.5 Å²	66.5	3%	0.028	33%	0.328	C	S	.	.	B	Isolated β-bridge	trans	-108.7	150	176.5	55.8	0	0	0	0	111.2	W277 L318 E322 S358	W277-S320 PolarHBondContact NE1-O 3.09Å; W277-S320 VanDerWaalsContact NE1-O 3.11Å; W277-S320 PolarHBondContact NE1-OG 3.23Å; L318-S320 PolarHBondContact O-N 3.46Å; S320-E322 VanDerWaalsContact C-N 3.28Å; S320-E322 PolarHBondContact O-N 3.43Å; S320-E322 PolarHBondContact OG-O 3.42Å; S320-S358 WeakPolarHBondContact CA-O 3.48Å; S320-S358 VanDerWaalsContact CB-O 3.23Å; S320-S358 WeakPolarHBondContact CB-O 3.39Å
321	K	93.9	Very high	86	Confident	138 Å²	138	68.6 Å²	68.6	60%	0.6	34%	0.34	S	S	*	.	S	Bend	trans	-64	-31.4	176.1	-78.5	-61.8	-164.4	-173.9	0	113.1	Y357	K321-Y357 HydrophobicContact CD-CD1 3.86Å; K321-Y357 HydrophobicContact CD-CD2 4.15Å; K321-Y357 HydrophobicContact CD-CE1 3.73Å; K321-Y357 HydrophobicContact CD-CE2 4.02Å; K321-Y357 HydrophobicContact CD-CG 4.06Å; K321-Y357 VanDerWaalsContact CE-CZ 3.47Å; K321-Y357 HydrophobicContact CG-CD1 3.92Å; K321-Y357 HydrophobicContact CG-CD2 4.24Å; K321-Y357 HydrophobicContact CG-CE1 4.32Å; K321-Y357 HydrophobicContact CG-CG 3.86Å; K321-Y357 PolarHBondContact NZ-OH 2.81Å
322	E	93	Very high	85.3	Confident	113 Å²	113	73.5 Å²	73.5	53%	0.528	37%	0.374	S	S	.	.	S	Bend	trans	-80.4	133.5	171.4	-174.3	-178.1	173	0	0	110.6	S320 F360	S320-E322 VanDerWaalsContact C-N 3.28Å; S320-E322 PolarHBondContact O-N 3.43Å; S320-E322 PolarHBondContact OG-O 3.42Å; E322-F360 HydrophobicContact CB-CB 4.41Å; E322-F360 HydrophobicContact CB-CD2 3.61Å; E322-F360 HydrophobicContact CB-CE2 4Å; E322-F360 HydrophobicContact CB-CG 4.15Å; E322-F360 HydrophobicContact CG-CD2 3.69Å; E322-F360 HydrophobicContact CG-CE2 3.61Å; E322-F360 HydrophobicContact CG-CG 4.18Å; E322-F360 HydrophobicContact CG-CZ 4.04Å; E322-F360 WeakPolarHBondContact OE1-CE1 3.38Å; E322-F360 WeakPolarHBondContact OE1-CZ 3.38Å; E322-F360 WeakPolarHBondContact OE2-CD1 3.31Å; E322-F360 VanDerWaalsContact OE2-CG 3.3Å; E322-F360 WeakPolarHBondContact OE2-CG 3.33Å
323	I	91.1	Very high	84.9	Confident	60 Å²	60	74.6 Å²	74.6	31%	0.308	38%	0.375	S	S	.	.			trans	-86.6	126.6	-177.4	-56.4	172.3	0	0	0	109.2	W277 F325 V327 F334	W277-I323 HydrophobicContact CH2-CB 4.19Å; W277-I323 HydrophobicContact CH2-CG1 3.84Å; W277-I323 HydrophobicContact CH2-CG2 3.79Å; W277-I323 HydrophobicContact CZ2-CB 4.22Å; W277-I323 HydrophobicContact CZ2-CG1 3.86Å; W277-I323 HydrophobicContact CZ2-CG2 4.26Å; W277-I323 HydrophobicContact CZ3-CG2 4.16Å; I323-F325 HydrophobicContact CG2-CD1 3.72Å; I323-F325 HydrophobicContact CG2-CE1 3.61Å; I323-F325 HydrophobicContact CG2-CZ 4.41Å; I323-F325 PolarHBondContact O-N 3.4Å; I323-V327 HydrophobicContact CG2-CG2 4.48Å; I323-F334 HydrophobicContact CD1-CE1 4.03Å; I323-F334 HydrophobicContact CD1-CZ 4.31Å; I323-F334 HydrophobicContact CG2-CZ 3.98Å
324	P	86.3	Confident	84.7	Confident	9 Å²	9	73.1 Å²	73.1	6%	0.058	37%	0.368	C	S	.	.	S	Bend	trans	-71.6	15.5	-172.1	27.2	-35.1	0	0	0	116.7	W277 F285 Y317 F360 R361	W277-P324 HydrophobicContact CB-CG 3.98Å; W277-P324 HydrophobicContact CD2-CG 3.93Å; W277-P324 HydrophobicContact CE3-CG 4.26Å; W277-P324 HydrophobicContact CG-CG 3.8Å; F285-P324 HydrophobicContact CB-CG 3.7Å; F285-P324 HydrophobicContact CD1-CG 3.98Å; F285-P324 HydrophobicContact CD2-CB 3.88Å; F285-P324 HydrophobicContact CD2-CG 3.76Å; F285-P324 HydrophobicContact CE2-CB 4.13Å; F285-P324 HydrophobicContact CE2-CG 4.38Å; F285-P324 HydrophobicContact CG-CB 4.19Å; F285-P324 HydrophobicContact CG-CG 3.55Å; Y317-P324 HydrophobicContact CD2-CB 4.39Å; Y317-P324 HydrophobicContact CE2-CB 4.47Å; P324-F360 HydrophobicContact CB-CE2 3.99Å; P324-F360 HydrophobicContact CB-CZ 4.37Å; P324-R361 PolarHBondContact O-NH2 3.16Å; P324-R361 VanDerWaalsContact O-NH2 3.09Å
325	F	82	Confident	84.5	Confident	59 Å²	59	70.3 Å²	70.3	26%	0.259	35%	0.353	S	S	.	.	S	Bend	trans	-161.8	157.8	175.3	71.7	-71.8	0	0	0	111.9	P284 F285 I323 V327 F334	P284-F325 HydrophobicContact CB-CD2 4.1Å; P284-F325 HydrophobicContact CB-CE1 4.34Å; P284-F325 HydrophobicContact CB-CE2 3.72Å; P284-F325 HydrophobicContact CB-CZ 3.85Å; F285-F325 HydrophobicContact CB-CD1 3.88Å; F285-F325 HydrophobicContact CB-CE1 4.02Å; F285-F325 WeakPolarHBondContact O-CE1 3.38Å; F285-F325 WeakPolarHBondContact O-CZ 3.44Å; I323-F325 HydrophobicContact CG2-CD1 3.72Å; I323-F325 HydrophobicContact CG2-CE1 3.61Å; I323-F325 HydrophobicContact CG2-CZ 4.41Å; I323-F325 PolarHBondContact O-N 3.4Å; F325-V327 HydrophobicContact CE2-CB 4.46Å; F325-V327 HydrophobicContact CE2-CG2 3.95Å; F325-V327 HydrophobicContact CZ-CG2 4Å; F325-F334 AromaticContact CE1-CE2 3.82Å; F325-F334 HydrophobicContact CE1-CE2 3.82Å; F325-F334 HydrophobicContact CE1-CZ 4.02Å; F325-F334 AromaticContact CZ-CD2 4Å; F325-F334 HydrophobicContact CZ-CD2 4Å; F325-F334 AromaticContact CZ-CE2 3.55Å; F325-F334 HydrophobicContact CZ-CE2 3.55Å; F325-F334 AromaticContact CZ-CZ 3.91Å; F325-F334 HydrophobicContact CZ-CZ 3.91Å
326	S	67.4	Low	84.3	Confident	84 Å²	84	71 Å²	71	59%	0.587	36%	0.362	S	S	*	.			trans	-79	121	172.5	-42.6	0	0	0	0	111.8	K328	S326-K328 VanDerWaalsContact C-N 3.34Å; S326-K328 PolarHBondContact O-N 2.91Å
327	V	64.3	Low	84.2	Confident	44 Å²	44	70.9 Å²	70.9	27%	0.267	36%	0.361	S	S	.	.			trans	-74.5	78.9	-179.2	-170.9	0	0	0	0	111.5	I323 F325 K331 F334	I323-V327 HydrophobicContact CG2-CG2 4.48Å; F325-V327 HydrophobicContact CE2-CB 4.46Å; F325-V327 HydrophobicContact CE2-CG2 3.95Å; F325-V327 HydrophobicContact CZ-CG2 4Å; V327-K331 HydrophobicContact CG1-CB 4.5Å; V327-F334 HydrophobicContact CG1-CB 4.37Å; V327-F334 HydrophobicContact CG1-CD1 3.9Å; V327-F334 HydrophobicContact CG1-CG 4.22Å; V327-F334 HydrophobicContact CG2-CD1 3.81Å; V327-F334 HydrophobicContact CG2-CE1 3.59Å; V327-F334 HydrophobicContact CG2-CZ 4.13Å
328	K	61.5	Low	84.1	Confident	179 Å²	179	69.8 Å²	69.8	78%	0.778	36%	0.358	S	S	*	.			trans	-95.2	-12.4	-171.2	-70.8	-177.4	177.5	-178.4	0	116.6	S326	S326-K328 VanDerWaalsContact C-N 3.34Å; S326-K328 PolarHBondContact O-N 2.91Å
329	K	57.9	Low	84	Confident	202 Å²	202	75.8 Å²	75.8	88%	0.878	39%	0.386	S	S	*	.	S	Bend	trans	-138.8	-15.2	-172.1	-66.3	-167.4	176.9	-173.1	0	118.1
330	T	61.5	Low	84	Confident	65 Å²	65	77.2 Å²	77.2	40%	0.399	39%	0.393	S	S	.	.			trans	-131.6	40.7	-171.6	-35.1	0	0	0	0	112.8	S332 I333 F334	T330-S332 PolarHBondContact O-N 2.6Å; T330-I333 HydrophobicContact CG2-CB 4.28Å; T330-I333 HydrophobicContact CG2-CD1 4.2Å; T330-I333 HydrophobicContact CG2-CG1 4.44Å; T330-F334 VanDerWaalsContact O-CB 3.31Å; T330-F334 WeakPolarHBondContact O-CB 3.41Å; T330-F334 PolarHBondContact O-N 3.09Å
331	K	77.2	Confident	84.1	Confident	142 Å²	142	77.1 Å²	77.1	62%	0.617	39%	0.392	S	S	*	.	H	α-helix	trans	-60.5	-40	-163.7	-163.9	166.5	-177.1	175.3	0	114.3	V327 N335	V327-K331 HydrophobicContact CG1-CB 4.5Å; K331-N335 WeakPolarHBondContact O-CB 3.24Å; K331-N335 PolarHBondContact O-N 3.23Å; K331-N335 PolarHBondContact O-OD1 2.66Å; K331-N335 VanDerWaalsContact O-OD1 3.05Å
332	S	83.8	Confident	84.2	Confident	103 Å²	103	75.4 Å²	75.4	72%	0.72	39%	0.386	S	S	*	.	H	α-helix	trans	-65.7	-56	-177.7	-172.2	0	0	0	0	113.2	T330 F334 N335 S336	T330-S332 PolarHBondContact O-N 2.6Å; S332-F334 VanDerWaalsContact C-N 3.33Å; S332-F334 PolarHBondContact O-N 3.21Å; S332-N335 PolarHBondContact O-N 3.49Å; S332-S336 PolarHBondContact O-N 3.17Å
333	I	88.7	Confident	84.4	Confident	83 Å²	83	72.6 Å²	72.6	43%	0.426	38%	0.376	S	S	.	.	H	α-helix	trans	-63.9	-40.8	-177.3	-48.4	176.5	0	0	0	110.7	W286 T330 S336 A337	W286-I333 HydrophobicContact CH2-CB 4.45Å; W286-I333 HydrophobicContact CH2-CG2 4.24Å; W286-I333 HydrophobicContact CZ2-CG2 4.11Å; T330-I333 HydrophobicContact CG2-CB 4.28Å; T330-I333 HydrophobicContact CG2-CD1 4.2Å; T330-I333 HydrophobicContact CG2-CG1 4.44Å; I333-S336 WeakPolarHBondContact O-CB 3.28Å; I333-S336 PolarHBondContact O-N 3.39Å; I333-A337 PolarHBondContact O-N 3.46Å; I333-A337 VanDerWaalsContact O-N 3.08Å
334	F	91.1	Very high	84.7	Confident	4 Å²	4	69.8 Å²	69.8	2%	0.018	36%	0.362	C	S	.	.	H	α-helix	trans	-64.7	-43.4	176.1	-177.8	-94	0	0	0	112.2	W277 W286 I323 F325 V327 T330 S332 S336 A337 M338	W277-F334 AromaticContact CH2-CZ 3.89Å; W277-F334 HydrophobicContact CH2-CZ 3.89Å; W277-F334 HydrophobicContact CZ3-CE2 4.03Å; W277-F334 AromaticContact CZ3-CZ 3.84Å; W277-F334 HydrophobicContact CZ3-CZ 3.84Å; W286-F334 HydrophobicContact CD2-CD2 4.21Å; W286-F334 AromaticContact CE3-CD2 3.8Å; W286-F334 HydrophobicContact CE3-CD2 3.8Å; W286-F334 HydrophobicContact CE3-CE2 4.44Å; W286-F334 HydrophobicContact CH2-CB 3.87Å; W286-F334 HydrophobicContact CH2-CD2 4.11Å; W286-F334 HydrophobicContact CZ2-CB 4.47Å; W286-F334 HydrophobicContact CZ2-CD2 4.47Å; W286-F334 HydrophobicContact CZ3-CB 4.14Å; W286-F334 AromaticContact CZ3-CD2 3.76Å; W286-F334 HydrophobicContact CZ3-CD2 3.76Å; W286-F334 HydrophobicContact CZ3-CG 4.45Å; I323-F334 HydrophobicContact CD1-CE1 4.03Å; I323-F334 HydrophobicContact CD1-CZ 4.31Å; I323-F334 HydrophobicContact CG2-CZ 3.98Å; F325-F334 AromaticContact CE1-CE2 3.82Å; F325-F334 HydrophobicContact CE1-CE2 3.82Å; F325-F334 HydrophobicContact CE1-CZ 4.02Å; F325-F334 AromaticContact CZ-CD2 4Å; F325-F334 HydrophobicContact CZ-CD2 4Å; F325-F334 AromaticContact CZ-CE2 3.55Å; F325-F334 HydrophobicContact CZ-CE2 3.55Å; F325-F334 AromaticContact CZ-CZ 3.91Å; F325-F334 HydrophobicContact CZ-CZ 3.91Å; V327-F334 HydrophobicContact CG1-CB 4.37Å; V327-F334 HydrophobicContact CG1-CD1 3.9Å; V327-F334 HydrophobicContact CG1-CG 4.22Å; V327-F334 HydrophobicContact CG2-CD1 3.81Å; V327-F334 HydrophobicContact CG2-CE1 3.59Å; V327-F334 HydrophobicContact CG2-CZ 4.13Å; T330-F334 VanDerWaalsContact O-CB 3.31Å; T330-F334 WeakPolarHBondContact O-CB 3.41Å; T330-F334 PolarHBondContact O-N 3.09Å; S332-F334 VanDerWaalsContact C-N 3.33Å; S332-F334 PolarHBondContact O-N 3.21Å; F334-S336 VanDerWaalsContact C-N 3.28Å; F334-S336 PolarHBondContact O-N 3.44Å; F334-A337 PolarHBondContact O-N 3.02Å; F334-M338 HydrophobicContact CD1-CG 3.95Å; F334-M338 HydrophobicContact CE1-CG 3.48Å; F334-M338 VanDerWaalsContact CE1-CG 3.48Å; F334-M338 HydrophobicContact CE1-SD 4.18Å; F334-M338 HydrophobicContact CE2-CG 4.45Å; F334-M338 HydrophobicContact CZ-CG 3.78Å; F334-M338 HydrophobicContact CZ-SD 3.91Å; F334-M338 WeakPolarHBondContact O-CG 3.44Å; F334-M338 PolarHBondContact O-N 2.82Å
335	N	91.6	Very high	85.2	Confident	79 Å²	79	69.5 Å²	69.5	42%	0.422	36%	0.36	S	S	.	.	H	α-helix	trans	-60.5	-38.2	174.6	-76.9	14.4	0	0	0	111.7	K331 S332 M338 Q339	K331-N335 WeakPolarHBondContact O-CB 3.24Å; K331-N335 PolarHBondContact O-N 3.23Å; K331-N335 PolarHBondContact O-OD1 2.66Å; K331-N335 VanDerWaalsContact O-OD1 3.05Å; S332-N335 PolarHBondContact O-N 3.49Å; N335-M338 PolarHBondContact O-N 3.18Å; N335-Q339 WeakPolarHBondContact O-CB 3.48Å; N335-Q339 PolarHBondContact O-N 3.31Å
336	S	94.1	Very high	85.9	Confident	69 Å²	69	71.4 Å²	71.4	48%	0.483	37%	0.37	S	S	.	.	H	α-helix	trans	-63.7	-42.3	176	-164.4	0	0	0	0	112.1	S332 I333 F334 Q339 E340	S332-S336 PolarHBondContact O-N 3.17Å; I333-S336 WeakPolarHBondContact O-CB 3.28Å; I333-S336 PolarHBondContact O-N 3.39Å; F334-S336 VanDerWaalsContact C-N 3.28Å; F334-S336 PolarHBondContact O-N 3.44Å; S336-Q339 PolarHBondContact O-N 2.88Å; S336-E340 WeakPolarHBondContact O-CB 3.46Å; S336-E340 PolarHBondContact O-N 2.91Å
337	A	95.4	Very high	87.3	Confident	0 Å²	0	68.9 Å²	68.9	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-66.1	-38	175.4	0	0	0	0	0	112.3	W286 P287 F303 I333 F334 M341	W286-A337 HydrophobicContact CZ2-CB 4.01Å; P287-A337 HydrophobicContact CG-CB 4.08Å; F303-A337 HydrophobicContact CB-CB 4.06Å; F303-A337 WeakPolarHBondContact CB-O 3.29Å; F303-A337 VanDerWaalsContact O-CB 3.32Å; F303-A337 WeakPolarHBondContact O-CB 3.37Å; I333-A337 PolarHBondContact O-N 3.46Å; I333-A337 VanDerWaalsContact O-N 3.08Å; F334-A337 PolarHBondContact O-N 3.02Å; A337-M341 WeakPolarHBondContact O-CB 3.44Å; A337-M341 PolarHBondContact O-N 2.85Å
338	M	94.7	Very high	88.7	Confident	25 Å²	25	66.9 Å²	66.9	12%	0.123	34%	0.338	C	S	.	.	H	α-helix	trans	-66.7	-43.5	174.3	-72.2	-58.8	-63.3	0	0	112.3	W277 P287 F334 N335 E340 M341 E342	W277-M338 HydrophobicContact CH2-CE 3.87Å; W277-M338 HydrophobicContact CH2-SD 3.44Å; W277-M338 WeakPolarHBondContact CH2-SD 3.45Å; W277-M338 HydrophobicContact CZ2-CE 4.18Å; W277-M338 HydrophobicContact CZ2-SD 4.28Å; W277-M338 HydrophobicContact CZ3-SD 4.08Å; P287-M338 HydrophobicContact CB-SD 4.33Å; P287-M338 HydrophobicContact CG-SD 3.92Å; F334-M338 HydrophobicContact CD1-CG 3.95Å; F334-M338 HydrophobicContact CE1-CG 3.48Å; F334-M338 VanDerWaalsContact CE1-CG 3.48Å; F334-M338 HydrophobicContact CE1-SD 4.18Å; F334-M338 HydrophobicContact CE2-CG 4.45Å; F334-M338 HydrophobicContact CZ-CG 3.78Å; F334-M338 HydrophobicContact CZ-SD 3.91Å; F334-M338 WeakPolarHBondContact O-CG 3.44Å; F334-M338 PolarHBondContact O-N 2.82Å; N335-M338 PolarHBondContact O-N 3.18Å; M338-E340 PolarHBondContact O-N 3.02Å; M338-M341 HydrophobicContact CE-CE 3.58Å; M338-M341 HydrophobicContact CE-SD 4.44Å; M338-M341 WeakPolarHBondContact O-CB 3.47Å; M338-M341 PolarHBondContact O-N 3.5Å; M338-M341 HydrophobicContact SD-CE 4.24Å; M338-M341 HydrophobicContact SD-SD 4.44Å; M338-E342 WeakPolarHBondContact O-CG 3.09Å; M338-E342 PolarHBondContact O-N 3.24Å
339	Q	95.9	Very high	90.3	Very high	128 Å²	128	63 Å²	63	60%	0.598	32%	0.318	S	S	*	.	H	α-helix	trans	-63.8	-40.6	177.4	-174.6	178.4	0.6	0	0	111.5	N335 S336 E342 V343	N335-Q339 WeakPolarHBondContact O-CB 3.48Å; N335-Q339 PolarHBondContact O-N 3.31Å; S336-Q339 PolarHBondContact O-N 2.88Å; Q339-E342 PolarHBondContact O-N 2.83Å; Q339-V343 WeakPolarHBondContact O-CG2 3.45Å; Q339-V343 PolarHBondContact O-N 3.39Å
340	E	97.3	Very high	92	Very high	32 Å²	32	61.3 Å²	61.3	15%	0.15	31%	0.306	C	S	.	.	H	α-helix	trans	-62.7	-43.8	174.1	-167.3	-176.4	-130.2	0	0	111.6	C266 F303 G304 H306 S336 M338 E342 V343 Y344	C266-E340 WeakPolarHBondContact SG-CG 3.47Å; C266-E340 PolarHBondContact SG-O 3.14Å; C266-E340 VanDerWaalsContact SG-O 3.4Å; F303-E340 WeakPolarHBondContact CA-OE2 3.38Å; F303-E340 HydrophobicContact CD1-CB 4.12Å; F303-E340 HydrophobicContact CD1-CG 3.91Å; F303-E340 WeakPolarHBondContact CD1-OE2 3.4Å; G304-E340 PolarHBondContact N-OE2 3.27Å; H306-E340 IonicContact CD2-OE1 3.24Å; H306-E340 IonicContact CD2-OE2 3.86Å; H306-E340 IonicContact CE1-OE1 2.83Å; H306-E340 PolarHBondContact CE1-OE1 3.29Å; H306-E340 VanDerWaalsContact CE1-OE1 3.28Å; H306-E340 IonicContact NE2-OE1 2.73Å; H306-E340 PolarHBondContact NE2-OE1 2.61Å; H306-E340 IonicContact NE2-OE2 2.71Å; H306-E340 PolarHBondContact NE2-OE2 2.65Å; S336-E340 WeakPolarHBondContact O-CB 3.46Å; S336-E340 PolarHBondContact O-N 2.91Å; M338-E340 PolarHBondContact O-N 3.02Å; E340-E342 VanDerWaalsContact C-N 3.34Å; E340-E342 PolarHBondContact O-N 2.71Å; E340-V343 PolarHBondContact O-N 3.16Å; E340-Y344 PolarHBondContact O-N 3.35Å
341	M	97.2	Very high	93.5	Very high	1 Å²	1	62.8 Å²	62.8	1%	0.005	31%	0.307	C	S	.	.	H	α-helix	trans	-63.1	-37.7	174.6	-174.3	-150.6	69.6	0	0	112.3	L275 P287 F303 M319 A337 M338 Y344 V345	L275-M341 HydrophobicContact CD1-CG 4Å; P287-M341 HydrophobicContact CB-CB 4.33Å; P287-M341 HydrophobicContact CB-CG 4.2Å; P287-M341 HydrophobicContact CB-SD 3.64Å; F303-M341 HydrophobicContact CD1-CB 3.92Å; F303-M341 HydrophobicContact CD2-CB 4.09Å; F303-M341 HydrophobicContact CD2-CG 4.2Å; F303-M341 HydrophobicContact CE1-CB 4.09Å; F303-M341 HydrophobicContact CE1-CG 4.45Å; F303-M341 HydrophobicContact CE2-CB 4.24Å; F303-M341 HydrophobicContact CE2-CG 3.98Å; F303-M341 HydrophobicContact CG-CB 3.94Å; F303-M341 HydrophobicContact CZ-CB 4.24Å; F303-M341 HydrophobicContact CZ-CG 4.11Å; M319-M341 HydrophobicContact CE-SD 3.47Å; M319-M341 WeakPolarHBondContact CE-SD 3.1Å; M319-M341 HydrophobicContact CG-SD 4.06Å; M319-M341 HydrophobicContact SD-CE 4.09Å; M319-M341 HydrophobicContact SD-SD 3.5Å; A337-M341 WeakPolarHBondContact O-CB 3.44Å; A337-M341 PolarHBondContact O-N 2.85Å; M338-M341 HydrophobicContact CE-CE 3.58Å; M338-M341 HydrophobicContact CE-SD 4.44Å; M338-M341 WeakPolarHBondContact O-CB 3.47Å; M338-M341 PolarHBondContact O-N 3.5Å; M338-M341 HydrophobicContact SD-CE 4.24Å; M338-M341 HydrophobicContact SD-SD 4.44Å; M341-Y344 WeakPolarHBondContact O-CB 3.22Å; M341-Y344 PolarHBondContact O-N 2.62Å; M341-V345 WeakPolarHBondContact O-CG2 3.13Å; M341-V345 PolarHBondContact O-N 3.35Å
342	E	96.4	Very high	94.2	Very high	102 Å²	102	57.6 Å²	57.6	48%	0.477	28%	0.284	S	S	.	.	H	α-helix	trans	-66.1	-39.6	175.4	-75.6	172.7	171.5	0	0	111.9	M338 Q339 E340 V345 E346	M338-E342 WeakPolarHBondContact O-CG 3.09Å; M338-E342 PolarHBondContact O-N 3.24Å; Q339-E342 PolarHBondContact O-N 2.83Å; E340-E342 VanDerWaalsContact C-N 3.34Å; E340-E342 PolarHBondContact O-N 2.71Å; E342-V345 PolarHBondContact O-N 3.37Å; E342-E346 PolarHBondContact O-N 3.18Å
343	V	97.1	Very high	94.6	Very high	55 Å²	55	55.9 Å²	55.9	33%	0.333	28%	0.283	S	S	.	.	H	α-helix	trans	-65.4	-38	172.3	175.8	0	0	0	0	111.4	C266 Q339 E340 E346 N347	C266-V343 HydrophobicContact CB-CB 4.45Å; C266-V343 HydrophobicContact CB-CG1 3.86Å; Q339-V343 WeakPolarHBondContact O-CG2 3.45Å; Q339-V343 PolarHBondContact O-N 3.39Å; E340-V343 PolarHBondContact O-N 3.16Å; V343-E346 PolarHBondContact O-N 2.93Å; V343-N347 WeakPolarHBondContact O-CB 3.35Å; V343-N347 PolarHBondContact O-N 3.36Å; V343-N347 PolarHBondContact O-ND2 3.01Å
344	Y	97.6	Very high	94.8	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-62.1	-44.3	170.9	-179	-83.2	0	0	0	112	E267 P268 L275 K289 F303 E340 M341 E346 N347 I348	E267-Y344 WeakPolarHBondContact O-CE2 3.46Å; P268-Y344 HydrophobicContact CB-CE2 4.06Å; L275-Y344 HydrophobicContact CD1-CD1 3.88Å; L275-Y344 HydrophobicContact CD1-CE1 4.18Å; L275-Y344 HydrophobicContact CD2-CD1 3.92Å; L275-Y344 HydrophobicContact CD2-CE1 3.7Å; L275-Y344 HydrophobicContact CG-CD1 4.31Å; L275-Y344 HydrophobicContact CG-CE1 4.15Å; K289-Y344 HydrophobicContact CD-CE2 4.38Å; K289-Y344 VanDerWaalsContact CE-CE2 3.42Å; F303-Y344 HydrophobicContact CE1-CG 4.18Å; F303-Y344 HydrophobicContact CZ-CD1 4.39Å; F303-Y344 HydrophobicContact CZ-CD2 4.5Å; F303-Y344 HydrophobicContact CZ-CG 4.08Å; E340-Y344 PolarHBondContact O-N 3.35Å; M341-Y344 WeakPolarHBondContact O-CB 3.22Å; M341-Y344 PolarHBondContact O-N 2.62Å; Y344-E346 VanDerWaalsContact C-N 3.27Å; Y344-E346 PolarHBondContact O-N 2.83Å; Y344-N347 PolarHBondContact O-N 3.47Å; Y344-I348 HydrophobicContact CE1-CB 4.28Å; Y344-I348 HydrophobicContact CE1-CD1 4.05Å; Y344-I348 HydrophobicContact CE1-CG2 4.42Å; Y344-I348 WeakPolarHBondContact O-CG2 3.44Å; Y344-I348 PolarHBondContact O-N 3.13Å
345	V	96.9	Very high	95	Very high	3 Å²	3	53 Å²	53	2%	0.018	27%	0.268	C	S	.	.	H	α-helix	trans	-63.5	-32.7	177.5	168.6	0	0	0	0	111.9	L275 M341 E342 I348 R349 F355 Y357	L275-V345 HydrophobicContact CD1-CG2 3.54Å; M341-V345 WeakPolarHBondContact O-CG2 3.13Å; M341-V345 PolarHBondContact O-N 3.35Å; E342-V345 PolarHBondContact O-N 3.37Å; V345-I348 VanDerWaalsContact O-CG2 3.28Å; V345-I348 WeakPolarHBondContact O-CG2 3.31Å; V345-R349 WeakPolarHBondContact O-CB 3.27Å; V345-R349 VanDerWaalsContact O-CD 3.29Å; V345-R349 WeakPolarHBondContact O-CD 3.36Å; V345-R349 WeakPolarHBondContact O-CG 3.31Å; V345-R349 PolarHBondContact O-N 3.12Å; V345-F355 HydrophobicContact CB-CD1 4.44Å; V345-F355 HydrophobicContact CG1-CB 4.3Å; V345-F355 HydrophobicContact CG1-CD1 3.58Å; V345-F355 HydrophobicContact CG1-CE1 4.16Å; V345-F355 HydrophobicContact CG1-CG 3.99Å; V345-F355 HydrophobicContact CG2-CD1 4.01Å; V345-F355 HydrophobicContact CG2-CE1 3.82Å; V345-F355 HydrophobicContact CG2-CE2 4.43Å; V345-F355 HydrophobicContact CG2-CG 4.42Å; V345-F355 HydrophobicContact CG2-CZ 4.05Å; V345-Y357 HydrophobicContact CG1-CE2 4.01Å
346	E	96.4	Very high	95.2	Very high	99 Å²	99	50.4 Å²	50.4	46%	0.463	26%	0.255	S	S	.	.	H	α-helix	trans	-75	-37	173.9	-167.2	55	-152.4	0	0	112.1	E342 V343 Y344 R350	E342-E346 PolarHBondContact O-N 3.18Å; V343-E346 PolarHBondContact O-N 2.93Å; Y344-E346 VanDerWaalsContact C-N 3.27Å; Y344-E346 PolarHBondContact O-N 2.83Å; E346-R350 PolarHBondContact O-N 3.43Å
347	N	95.8	Very high	95.3	Very high	31 Å²	31	49 Å²	49	17%	0.166	24%	0.239	C	C	.	.	H	α-helix	trans	-68.6	-41.2	176.3	-70.9	-14.8	0	0	0	113	C266 P268 V343 Y344 R349 R350 K351	C266-N347 PolarHBondContact O-ND2 2.98Å; P268-N347 HydrophobicContact CG-CB 4.22Å; V343-N347 WeakPolarHBondContact O-CB 3.35Å; V343-N347 PolarHBondContact O-N 3.36Å; V343-N347 PolarHBondContact O-ND2 3.01Å; Y344-N347 PolarHBondContact O-N 3.47Å; N347-R349 VanDerWaalsContact C-N 3.35Å; N347-R350 PolarHBondContact O-N 3.08Å; N347-R350 PolarHBondContact OD1-NH1 3.26Å; N347-R350 PolarHBondContact OD1-NH2 3.34Å; N347-K351 PolarHBondContact O-N 2.91Å
348	I	95.2	Very high	95.4	Very high	3 Å²	3	49.3 Å²	49.3	2%	0.015	24%	0.242	C	C	.	.	H	α-helix	trans	-66.6	-37.4	177.4	-165.1	177.3	0	0	0	111	P268 P272 Y344 V345 K351 F352 F355 M372	P268-I348 HydrophobicContact CB-CB 4Å; P268-I348 HydrophobicContact CB-CG1 4.14Å; P268-I348 HydrophobicContact CG-CB 4.5Å; P272-I348 HydrophobicContact CB-CD1 3.45Å; P272-I348 VanDerWaalsContact CB-CD1 3.45Å; P272-I348 HydrophobicContact CB-CG1 4.18Å; P272-I348 HydrophobicContact CG-CD1 3.88Å; P272-I348 HydrophobicContact CG-CG1 4.48Å; Y344-I348 HydrophobicContact CE1-CB 4.28Å; Y344-I348 HydrophobicContact CE1-CD1 4.05Å; Y344-I348 HydrophobicContact CE1-CG2 4.42Å; Y344-I348 WeakPolarHBondContact O-CG2 3.44Å; Y344-I348 PolarHBondContact O-N 3.13Å; V345-I348 VanDerWaalsContact O-CG2 3.28Å; V345-I348 WeakPolarHBondContact O-CG2 3.31Å; I348-K351 PolarHBondContact O-N 2.83Å; I348-F352 HydrophobicContact CG1-CD2 3.61Å; I348-F352 HydrophobicContact CG1-CE2 4.04Å; I348-F352 PolarHBondContact O-N 2.96Å; I348-F355 HydrophobicContact CD1-CD2 4.29Å; I348-F355 HydrophobicContact CG2-CB 4.03Å; I348-F355 HydrophobicContact CG2-CD2 3.88Å; I348-F355 HydrophobicContact CG2-CG 4.19Å; I348-M372 HydrophobicContact CD1-CE 3.48Å; I348-M372 VanDerWaalsContact CD1-CE 3.48Å; I348-M372 HydrophobicContact CD1-SD 3.9Å; I348-M372 HydrophobicContact CG1-CE 3.98Å; I348-M372 HydrophobicContact CG1-SD 4.34Å
349	R	94.9	Very high	95.4	Very high	97 Å²	97	52 Å²	52	37%	0.366	26%	0.261	S	S	.	.	H	α-helix	trans	-61.7	-42.1	170.2	-75.4	168.8	171.6	-166.7	-10.4	112.3	V345 N347 K351 G353 F355	V345-R349 WeakPolarHBondContact O-CB 3.27Å; V345-R349 VanDerWaalsContact O-CD 3.29Å; V345-R349 WeakPolarHBondContact O-CD 3.36Å; V345-R349 WeakPolarHBondContact O-CG 3.31Å; V345-R349 PolarHBondContact O-N 3.12Å; N347-R349 VanDerWaalsContact C-N 3.35Å; R349-K351 VanDerWaalsContact C-N 3.31Å; R349-K351 PolarHBondContact O-N 3.02Å; R349-G353 WeakPolarHBondContact O-CA 3.39Å; R349-G353 PolarHBondContact O-N 3.38Å; R349-F355 HydrophobicContact CG-CB 3.76Å; R349-F355 PolarHBondContact NH2-O 2.9Å
350	R	94.2	Very high	95.5	Very high	167 Å²	167	49.6 Å²	49.6	63%	0.63	25%	0.248	S	C	*	.	H	α-helix	trans	-65.8	-31	176	-158.2	-177	-49.7	107	15.7	113.1	E346 N347	E346-R350 PolarHBondContact O-N 3.43Å; N347-R350 PolarHBondContact O-N 3.08Å; N347-R350 PolarHBondContact OD1-NH1 3.26Å; N347-R350 PolarHBondContact OD1-NH2 3.34Å
351	K	91.7	Very high	95.3	Very high	96 Å²	96	52.9 Å²	52.9	42%	0.417	26%	0.259	S	S	.	.	H	α-helix	trans	-85.5	-35.9	-179.9	-175.1	173.7	174.1	178.2	0	113.9	P268 S270 N347 I348 R349	P268-K351 HydrophobicContact CB-CD 4.45Å; P268-K351 HydrophobicContact CG-CB 4.18Å; P268-K351 HydrophobicContact CG-CD 3.85Å; P268-K351 PolarHBondContact O-NZ 3.44Å; S270-K351 PolarHBondContact OG-NZ 3.45Å; S270-K351 VanDerWaalsContact OG-NZ 3.16Å; N347-K351 PolarHBondContact O-N 2.91Å; I348-K351 PolarHBondContact O-N 2.83Å; R349-K351 VanDerWaalsContact C-N 3.31Å; R349-K351 PolarHBondContact O-N 3.02Å
352	F	91.6	Very high	95.3	Very high	33 Å²	33	54.6 Å²	54.6	15%	0.145	27%	0.27	C	S	.	.	H	α-helix	trans	-124.7	1.7	-171.1	-58.6	-80.2	0	0	0	114.7	P268 C269 P272 I348 V354 I386	P268-F352 HydrophobicContact CB-CE2 4.37Å; C269-F352 WeakPolarHBondContact O-CZ 3.49Å; P272-F352 HydrophobicContact CB-CE2 4.16Å; P272-F352 HydrophobicContact CG-CD2 4.38Å; P272-F352 HydrophobicContact CG-CE2 3.86Å; P272-F352 HydrophobicContact CG-CZ 4.09Å; I348-F352 HydrophobicContact CG1-CD2 3.61Å; I348-F352 HydrophobicContact CG1-CE2 4.04Å; I348-F352 PolarHBondContact O-N 2.96Å; F352-V354 PolarHBondContact O-N 3.44Å; F352-I386 HydrophobicContact CD1-CG1 4.18Å; F352-I386 HydrophobicContact CE1-CD1 4.15Å; F352-I386 HydrophobicContact CE1-CG1 4Å
353	G	92.4	Very high	95.3	Very high	66 Å²	66	53.7 Å²	53.7	68%	0.68	27%	0.273	S	S	*	.	S	Bend	trans	75.2	-22.6	-177.5	0	0	0	0	0	115.4	R349	R349-G353 WeakPolarHBondContact O-CA 3.39Å; R349-G353 PolarHBondContact O-N 3.38Å
354	V	93.5	Very high	95.3	Very high	18 Å²	18	51.6 Å²	51.6	11%	0.109	26%	0.259	C	S	.	.			trans	-123.8	147.7	-170.8	-62.6	0	0	0	0	113.7	F352 M372 L374 A384	F352-V354 PolarHBondContact O-N 3.44Å; V354-M372 HydrophobicContact CG2-CE 4.11Å; V354-M372 HydrophobicContact CG2-SD 4.39Å; V354-M372 VanDerWaalsContact O-CE 3.28Å; V354-M372 WeakPolarHBondContact O-CE 3.35Å; V354-L374 HydrophobicContact CG1-CD2 4.28Å; V354-A384 HydrophobicContact CG1-CB 4.13Å; V354-A384 HydrophobicContact CG2-CB 3.54Å
355	F	95.8	Very high	95	Very high	8 Å²	8	54.9 Å²	54.9	4%	0.035	28%	0.28	C	S	.	.			trans	-159.7	112.9	154.4	-178	-91.7	0	0	0	110.1	L275 M319 V345 I348 R349 Y357 Q371 M372	L275-F355 HydrophobicContact CB-CE2 4.46Å; L275-F355 HydrophobicContact CB-CZ 4.2Å; L275-F355 HydrophobicContact CD1-CE2 3.89Å; L275-F355 HydrophobicContact CD1-CZ 3.73Å; L275-F355 HydrophobicContact CG-CE2 4.01Å; L275-F355 HydrophobicContact CG-CZ 4.11Å; M319-F355 HydrophobicContact CB-CZ 4.35Å; M319-F355 HydrophobicContact CG-CZ 4.47Å; V345-F355 HydrophobicContact CB-CD1 4.44Å; V345-F355 HydrophobicContact CG1-CB 4.3Å; V345-F355 HydrophobicContact CG1-CD1 3.58Å; V345-F355 HydrophobicContact CG1-CE1 4.16Å; V345-F355 HydrophobicContact CG1-CG 3.99Å; V345-F355 HydrophobicContact CG2-CD1 4.01Å; V345-F355 HydrophobicContact CG2-CE1 3.82Å; V345-F355 HydrophobicContact CG2-CE2 4.43Å; V345-F355 HydrophobicContact CG2-CG 4.42Å; V345-F355 HydrophobicContact CG2-CZ 4.05Å; I348-F355 HydrophobicContact CD1-CD2 4.29Å; I348-F355 HydrophobicContact CG2-CB 4.03Å; I348-F355 HydrophobicContact CG2-CD2 3.88Å; I348-F355 HydrophobicContact CG2-CG 4.19Å; R349-F355 HydrophobicContact CG-CB 3.76Å; R349-F355 PolarHBondContact NH2-O 2.9Å; F355-Y357 AromaticContact CD1-CD2 3.9Å; F355-Y357 HydrophobicContact CD1-CD2 3.9Å; F355-Y357 AromaticContact CD1-CE2 3.8Å; F355-Y357 HydrophobicContact CD1-CE2 3.8Å; F355-Y357 HydrophobicContact CD1-CG 4.48Å; F355-Y357 HydrophobicContact CE1-CD1 4.09Å; F355-Y357 AromaticContact CE1-CD2 3.84Å; F355-Y357 HydrophobicContact CE1-CD2 3.84Å; F355-Y357 HydrophobicContact CE1-CE1 4.05Å; F355-Y357 AromaticContact CE1-CE2 3.81Å; F355-Y357 HydrophobicContact CE1-CE2 3.81Å; F355-Y357 HydrophobicContact CE1-CG 4Å; F355-Y357 AromaticContact CE1-CZ 3.93Å; F355-Q371 WeakPolarHBondContact CA-O 3.24Å; F355-Q371 HydrophobicContact CD2-CB 4.3Å; F355-Q371 HydrophobicContact CE2-CB 3.96Å; F355-Q371 HydrophobicContact CE2-CG 4.24Å; F355-Q371 HydrophobicContact CZ-CG 4.37Å; F355-M372 HydrophobicContact CB-CE 4.47Å; F355-M372 HydrophobicContact CD2-CE 4Å
356	N	95.3	Very high	94.6	Very high	26 Å²	26	58 Å²	58	14%	0.139	30%	0.3	C	S	.	.	P	Polyproline II helix	trans	-94.8	117.8	-179	-52.9	-39.8	0	0	0	110.7	Y370 Q371 L373 P376	N356-Y370 HydrophobicContact CB-CD1 4.27Å; N356-Y370 HydrophobicContact CB-CE1 3.85Å; N356-Y370 PolarHBondContact ND2-O 3.28Å; N356-Q371 PolarHBondContact N-O 2.99Å; N356-L373 PolarHBondContact ND2-O 3.36Å; N356-P376 HydrophobicContact CB-CB 4.13Å; N356-P376 HydrophobicContact CB-CG 4.24Å
357	Y	96.7	Very high	93.8	Very high	38 Å²	38	59.2 Å²	59.2	15%	0.149	31%	0.309	C	S	.	.	P	Polyproline II helix	trans	-71.9	139.7	164.4	-73.2	-94.1	0	0	0	109.6	M319 K321 V345 F355 Y370	M319-Y357 HydrophobicContact CG-CD1 3.93Å; M319-Y357 HydrophobicContact CG-CE1 3.79Å; M319-Y357 WeakPolarHBondContact O-CA 3.45Å; K321-Y357 HydrophobicContact CD-CD1 3.86Å; K321-Y357 HydrophobicContact CD-CD2 4.15Å; K321-Y357 HydrophobicContact CD-CE1 3.73Å; K321-Y357 HydrophobicContact CD-CE2 4.02Å; K321-Y357 HydrophobicContact CD-CG 4.06Å; K321-Y357 VanDerWaalsContact CE-CZ 3.47Å; K321-Y357 HydrophobicContact CG-CD1 3.92Å; K321-Y357 HydrophobicContact CG-CD2 4.24Å; K321-Y357 HydrophobicContact CG-CE1 4.32Å; K321-Y357 HydrophobicContact CG-CG 3.86Å; K321-Y357 PolarHBondContact NZ-OH 2.81Å; V345-Y357 HydrophobicContact CG1-CE2 4.01Å; F355-Y357 AromaticContact CD1-CD2 3.9Å; F355-Y357 HydrophobicContact CD1-CD2 3.9Å; F355-Y357 AromaticContact CD1-CE2 3.8Å; F355-Y357 HydrophobicContact CD1-CE2 3.8Å; F355-Y357 HydrophobicContact CD1-CG 4.48Å; F355-Y357 HydrophobicContact CE1-CD1 4.09Å; F355-Y357 AromaticContact CE1-CD2 3.84Å; F355-Y357 HydrophobicContact CE1-CD2 3.84Å; F355-Y357 HydrophobicContact CE1-CE1 4.05Å; F355-Y357 AromaticContact CE1-CE2 3.81Å; F355-Y357 HydrophobicContact CE1-CE2 3.81Å; F355-Y357 HydrophobicContact CE1-CG 4Å; F355-Y357 AromaticContact CE1-CZ 3.93Å; Y357-Y370 PolarHBondContact O-OH 3.22Å
358	S	96.3	Very high	93.2	Very high	8 Å²	8	58.7 Å²	58.7	6%	0.056	31%	0.308	C	S	.	.	B	Isolated β-bridge	trans	-83.4	159.7	177.1	-58.8	0	0	0	0	111.8	L318 M319 S320 Y370	L318-S358 WeakPolarHBondContact CB-OG 3.35Å; M319-S358 PolarHBondContact O-N 2.77Å; S320-S358 WeakPolarHBondContact CA-O 3.48Å; S320-S358 VanDerWaalsContact CB-O 3.23Å; S320-S358 WeakPolarHBondContact CB-O 3.39Å; S358-Y370 WeakPolarHBondContact OG-CD1 3.31Å; S358-Y370 WeakPolarHBondContact OG-CE1 3.35Å
359	P	95.8	Very high	92.8	Very high	81 Å²	81	64.3 Å²	64.3	53%	0.526	34%	0.335	S	S	.	.	P	Polyproline II helix	trans	-51.5	158.6	163.8	-25.4	34.1	0	0	0	112.4	R361 T362	P359-R361 PolarHBondContact O-N 2.99Å; P359-T362 WeakPolarHBondContact CD-OG1 3.38Å; P359-T362 PolarHBondContact O-N 3.36Å; P359-T362 PolarHBondContact O-OG1 3.1Å
360	F	96.6	Very high	92.7	Very high	77 Å²	77	62.7 Å²	62.7	34%	0.338	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	129.7	-177.7	-176.7	-130.5	0	0	0	111.6	E322 P324 T362	E322-F360 HydrophobicContact CB-CB 4.41Å; E322-F360 HydrophobicContact CB-CD2 3.61Å; E322-F360 HydrophobicContact CB-CE2 4Å; E322-F360 HydrophobicContact CB-CG 4.15Å; E322-F360 HydrophobicContact CG-CD2 3.69Å; E322-F360 HydrophobicContact CG-CE2 3.61Å; E322-F360 HydrophobicContact CG-CG 4.18Å; E322-F360 HydrophobicContact CG-CZ 4.04Å; E322-F360 WeakPolarHBondContact OE1-CE1 3.38Å; E322-F360 WeakPolarHBondContact OE1-CZ 3.38Å; E322-F360 WeakPolarHBondContact OE2-CD1 3.31Å; E322-F360 VanDerWaalsContact OE2-CG 3.3Å; E322-F360 WeakPolarHBondContact OE2-CG 3.33Å; P324-F360 HydrophobicContact CB-CE2 3.99Å; P324-F360 HydrophobicContact CB-CZ 4.37Å; F360-T362 PolarHBondContact O-N 3.47Å
361	R	94.8	Very high	92.6	Very high	101 Å²	101	55 Å²	55	38%	0.381	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.8	21.5	179.8	-58.6	172.7	169.6	-85.3	-7.1	115.5	Y317 P324 P359	Y317-R361 HydrophobicContact CD1-CB 4.38Å; Y317-R361 WeakPolarHBondContact CD1-O 3.27Å; Y317-R361 HydrophobicContact CD2-CB 4.25Å; Y317-R361 HydrophobicContact CD2-CG 4.12Å; Y317-R361 HydrophobicContact CE1-CB 4.37Å; Y317-R361 HydrophobicContact CE2-CB 4.21Å; Y317-R361 HydrophobicContact CE2-CG 3.91Å; Y317-R361 HydrophobicContact CG-CB 4.34Å; Y317-R361 PolarHBondContact OH-NH1 2.64Å; Y317-R361 VanDerWaalsContact OH-NH1 3.17Å; P324-R361 PolarHBondContact O-NH2 3.16Å; P324-R361 VanDerWaalsContact O-NH2 3.09Å; P359-R361 PolarHBondContact O-N 2.99Å
362	T	96.1	Very high	92.7	Very high	37 Å²	37	51.8 Å²	51.8	23%	0.227	29%	0.287	C	S	.	.	P	Polyproline II helix	trans	-54.4	123.3	168	-58.7	0	0	0	0	109.6	Y317 L318 P359 F360	Y317-T362 CarbonylContact C-O 3.28Å; Y317-T362 VanDerWaalsContact CA-O 3.23Å; Y317-T362 WeakPolarHBondContact CA-O 3.3Å; Y317-T362 WeakPolarHBondContact CB-O 3.49Å; L318-T362 HydrophobicContact CD1-CG2 4.01Å; L318-T362 PolarHBondContact N-O 3.41Å; P359-T362 WeakPolarHBondContact CD-OG1 3.38Å; P359-T362 PolarHBondContact O-N 3.36Å; P359-T362 PolarHBondContact O-OG1 3.1Å; F360-T362 PolarHBondContact O-N 3.47Å
363	P	96.3	Very high	92.7	Very high	84 Å²	84	50.8 Å²	50.8	55%	0.545	28%	0.283	S	S	.	.	B	Isolated β-bridge	trans	-62.8	142.9	-178.5	26.4	-34.4	0	0	0	110.9
364	Y	96.4	Very high	92.5	Very high	11 Å²	11	52.3 Å²	52.3	4%	0.043	28%	0.275	C	S	.	.	P	Polyproline II helix	trans	-72.8	140.1	168.3	175.5	-98.2	0	0	0	110.3	P274 V276 A290 D293 V298 I313 C316 L318	P274-Y364 HydrophobicContact CB-CE2 3.83Å; P274-Y364 HydrophobicContact CG-CE2 4.2Å; V276-Y364 HydrophobicContact CG1-CD2 3.41Å; V276-Y364 VanDerWaalsContact CG1-CD2 3.41Å; V276-Y364 HydrophobicContact CG1-CE2 4.06Å; V276-Y364 HydrophobicContact CG1-CG 3.78Å; A290-Y364 HydrophobicContact CB-CE2 4.08Å; D293-Y364 WeakPolarHBondContact OD1-CE1 3.28Å; D293-Y364 PolarHBondContact OD2-OH 2.88Å; V298-Y364 HydrophobicContact CG1-CE1 4.33Å; V298-Y364 HydrophobicContact CG2-CD1 3.86Å; V298-Y364 HydrophobicContact CG2-CE1 3.83Å; I313-Y364 HydrophobicContact CD1-CD1 4.07Å; I313-Y364 HydrophobicContact CD1-CE1 4.36Å; I313-Y364 HydrophobicContact CG1-CD1 3.96Å; C316-Y364 HydrophobicContact CB-CD1 4.42Å; C316-Y364 HydrophobicContact CB-CG 4.35Å; C316-Y364 WeakPolarHBondContact O-CB 3.35Å; C316-Y364 PolarHBondContact O-N 2.68Å; L318-Y364 HydrophobicContact CD2-CD2 3.78Å; L318-Y364 HydrophobicContact CD2-CE2 4.46Å; L318-Y364 HydrophobicContact CG-CD2 4.42Å
365	T	92.3	Very high	92.2	Very high	69 Å²	69	54.2 Å²	54.2	42%	0.423	28%	0.284	S	S	.	.			trans	-125.8	147.6	174.6	55.2	0	0	0	0	110.4	N367 S368	T365-N367 PolarHBondContact O-N 3.36Å; T365-S368 VanDerWaalsContact O-CB 3.23Å; T365-S368 WeakPolarHBondContact O-CB 3.22Å; T365-S368 PolarHBondContact O-N 2.78Å; T365-S368 VanDerWaalsContact O-N 3.11Å; T365-S368 WeakPolarHBondContact OG1-CB 3.46Å
366	P	89.5	Confident	91.7	Very high	67 Å²	67	56 Å²	56	44%	0.435	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	139.4	178	-24.6	36.7	0	0	0	111.3	D293 I313 S368	D293-P366 HydrophobicContact CB-CB 4.24Å; D293-P366 HydrophobicContact CB-CG 4.49Å; D293-P366 VanDerWaalsContact OD2-CA 3.27Å; D293-P366 WeakPolarHBondContact OD2-CA 3.47Å; D293-P366 WeakPolarHBondContact OD2-CB 3.4Å; I313-P366 HydrophobicContact CD1-CG 3.81Å; P366-S368 PolarHBondContact O-N 2.91Å
367	N	78.6	Confident	91.3	Very high	125 Å²	125	60.5 Å²	60.5	67%	0.668	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	56	23.8	-174.1	-47.5	-78.7	0	0	0	115.1	T365 Q369	T365-N367 PolarHBondContact O-N 3.36Å; N367-Q369 PolarHBondContact O-N 3.49Å; N367-Q369 VanDerWaalsContact O-N 3.08Å
368	S	82.8	Confident	90.9	Very high	21 Å²	21	61.9 Å²	61.9	15%	0.147	34%	0.336	C	S	.	.			trans	-60	113.3	-179.2	-167.4	0	0	0	0	113	T365 P366	T365-S368 VanDerWaalsContact O-CB 3.23Å; T365-S368 WeakPolarHBondContact O-CB 3.22Å; T365-S368 PolarHBondContact O-N 2.78Å; T365-S368 VanDerWaalsContact O-N 3.11Å; T365-S368 WeakPolarHBondContact OG1-CB 3.46Å; P366-S368 PolarHBondContact O-N 2.91Å
369	Q	86.7	Confident	90.2	Very high	121 Å²	121	65.7 Å²	65.7	57%	0.565	36%	0.36	S	S	*	.			trans	-87.6	-2	179.4	-68.8	-172.5	-19.3	0	0	114.2	N367 Q371 M372 L373 T383	N367-Q369 PolarHBondContact O-N 3.49Å; N367-Q369 VanDerWaalsContact O-N 3.08Å; Q369-Q371 PolarHBondContact O-N 3.5Å; Q369-M372 PolarHBondContact O-N 3.18Å; Q369-L373 PolarHBondContact O-N 3.11Å; Q369-T383 HydrophobicContact CB-CG2 3.82Å; Q369-T383 HydrophobicContact CG-CG2 4.12Å
370	Y	92.3	Very high	89.6	Confident	62 Å²	62	66.9 Å²	66.9	24%	0.243	37%	0.37	C	S	.	.	G	3₁₀ helix	trans	-47.3	-42.7	-172.1	177.4	-84.5	0	0	0	113.8	L318 N356 Y357 S358 M372 L373 P376	L318-Y370 HydrophobicContact CD1-CG 4.48Å; N356-Y370 HydrophobicContact CB-CD1 4.27Å; N356-Y370 HydrophobicContact CB-CE1 3.85Å; N356-Y370 PolarHBondContact ND2-O 3.28Å; Y357-Y370 PolarHBondContact O-OH 3.22Å; S358-Y370 WeakPolarHBondContact OG-CD1 3.31Å; S358-Y370 WeakPolarHBondContact OG-CE1 3.35Å; Y370-M372 PolarHBondContact O-N 3.2Å; Y370-L373 HydrophobicContact CD2-CD1 4.41Å; Y370-L373 PolarHBondContact O-N 2.83Å; Y370-P376 HydrophobicContact CE1-CB 4.44Å; Y370-P376 HydrophobicContact CE2-CB 3.92Å
371	Q	93.3	Very high	88.8	Confident	6 Å²	6	65.7 Å²	65.7	3%	0.028	38%	0.375	C	S	.	.	G	3₁₀ helix	trans	-67.9	-22	-176.3	-62.8	-176.2	-12.8	0	0	113.3	L275 L318 F355 N356 Q369	L275-Q371 PolarHBondContact O-NE2 3.47Å; L318-Q371 HydrophobicContact CD2-CG 4.42Å; F355-Q371 WeakPolarHBondContact CA-O 3.24Å; F355-Q371 HydrophobicContact CD2-CB 4.3Å; F355-Q371 HydrophobicContact CE2-CB 3.96Å; F355-Q371 HydrophobicContact CE2-CG 4.24Å; F355-Q371 HydrophobicContact CZ-CG 4.37Å; N356-Q371 PolarHBondContact N-O 2.99Å; Q369-Q371 PolarHBondContact O-N 3.5Å
372	M	93.4	Very high	88.1	Confident	29 Å²	29	62.2 Å²	62.2	14%	0.143	37%	0.37	C	S	.	.	G	3₁₀ helix	trans	-110	5.2	-176.8	-62.6	-72.8	91.6	0	0	113.6	P272 I348 V354 F355 Q369 Y370 T383 A384	P272-M372 HydrophobicContact CG-CG 4.14Å; P272-M372 HydrophobicContact CG-SD 3.54Å; P272-M372 VanDerWaalsContact CG-SD 3.54Å; I348-M372 HydrophobicContact CD1-CE 3.48Å; I348-M372 VanDerWaalsContact CD1-CE 3.48Å; I348-M372 HydrophobicContact CD1-SD 3.9Å; I348-M372 HydrophobicContact CG1-CE 3.98Å; I348-M372 HydrophobicContact CG1-SD 4.34Å; V354-M372 HydrophobicContact CG2-CE 4.11Å; V354-M372 HydrophobicContact CG2-SD 4.39Å; V354-M372 VanDerWaalsContact O-CE 3.28Å; V354-M372 WeakPolarHBondContact O-CE 3.35Å; F355-M372 HydrophobicContact CB-CE 4.47Å; F355-M372 HydrophobicContact CD2-CE 4Å; Q369-M372 PolarHBondContact O-N 3.18Å; Y370-M372 PolarHBondContact O-N 3.2Å; M372-T383 HydrophobicContact CB-CG2 4.18Å; M372-T383 CarbonylContact O-C 3.49Å; M372-T383 WeakPolarHBondContact O-CA 3.28Å; M372-T383 WeakPolarHBondContact O-CB 3.44Å; M372-A384 PolarHBondContact O-N 2.86Å
373	L	91.6	Very high	87.3	Confident	12 Å²	12	62.8 Å²	62.8	6%	0.063	37%	0.374	C	S	.	.	B	Isolated β-bridge	trans	-60.6	141.4	170.3	-66.3	174.8	0	0	0	110.9	N356 Q369 Y370 D375 P379	N356-L373 PolarHBondContact ND2-O 3.36Å; Q369-L373 PolarHBondContact O-N 3.11Å; Y370-L373 HydrophobicContact CD2-CD1 4.41Å; Y370-L373 PolarHBondContact O-N 2.83Å; L373-D375 VanDerWaalsContact C-N 3.3Å; L373-P379 HydrophobicContact CD1-CB 3.93Å; L373-P379 HydrophobicContact CD2-CB 4.49Å
374	L	88.1	Confident	86.1	Confident	97 Å²	97	59.4 Å²	59.4	51%	0.508	35%	0.353	S	S	.	.	S	Bend	trans	-63.2	-41.5	170.6	-77.8	168.2	0	0	0	111.4	V354 G382 A384	V354-L374 HydrophobicContact CG1-CD2 4.28Å; L374-G382 PolarHBondContact N-O 3.11Å; L374-G382 VanDerWaalsContact N-O 3.12Å; L374-A384 HydrophobicContact CD2-CB 3.9Å; L374-A384 HydrophobicContact CG-CB 4.33Å
375	D	86.5	Confident	84.2	Confident	58 Å²	58	67.9 Å²	67.9	31%	0.31	39%	0.39	S	S	.	.			trans	-130.8	111.2	175.3	178.2	-2.7	0	0	0	108.3	L373 T377 N378	L373-D375 VanDerWaalsContact C-N 3.3Å; D375-T377 VanDerWaalsContact CG-OG1 3.28Å; D375-T377 PolarHBondContact O-N 3.1Å; D375-T377 WeakPolarHBondContact OD1-CA 3.49Å; D375-T377 WeakPolarHBondContact OD1-CB 3.5Å; D375-T377 PolarHBondContact OD1-N 3.28Å; D375-T377 PolarHBondContact OD1-OG1 3.47Å; D375-T377 PolarHBondContact OD2-OG1 2.95Å; D375-N378 HydrophobicContact CB-CB 4.28Å; D375-N378 CarbonylContact O-C 3.56Å; D375-N378 VanDerWaalsContact O-C 3.28Å; D375-N378 PolarHBondContact O-N 2.96Å; D375-N378 PolarHBondContact OD1-N 2.98Å; D375-N378 WeakPolarHBondContact OD2-CB 3.48Å
376	P	86.3	Confident	82.6	Confident	45 Å²	45	70 Å²	70	29%	0.292	40%	0.398	S	S	.	.	S	Bend	trans	-69.9	-12.5	177.8	29.2	-34.3	0	0	0	113.5	N356 Y370	N356-P376 HydrophobicContact CB-CB 4.13Å; N356-P376 HydrophobicContact CB-CG 4.24Å; Y370-P376 HydrophobicContact CE1-CB 4.44Å; Y370-P376 HydrophobicContact CE2-CB 3.92Å
377	T	87.8	Confident	80.5	Confident	122 Å²	122	73.8 Å²	73.8	75%	0.748	41%	0.414	S	S	*	.	S	Bend	trans	-85.8	-25	173.4	76.7	0	0	0	0	112.2	D375 P379	D375-T377 VanDerWaalsContact CG-OG1 3.28Å; D375-T377 PolarHBondContact O-N 3.1Å; D375-T377 WeakPolarHBondContact OD1-CA 3.49Å; D375-T377 WeakPolarHBondContact OD1-CB 3.5Å; D375-T377 PolarHBondContact OD1-N 3.28Å; D375-T377 PolarHBondContact OD1-OG1 3.47Å; D375-T377 PolarHBondContact OD2-OG1 2.95Å; T377-P379 WeakPolarHBondContact O-CD 3.39Å
378	N	86.9	Confident	78.7	Confident	67 Å²	67	77 Å²	77	36%	0.358	42%	0.422	S	S	.	.			trans	-119.9	80.6	174.2	-175.6	6.9	0	0	0	112	D375 S380 A381	D375-N378 HydrophobicContact CB-CB 4.28Å; D375-N378 CarbonylContact O-C 3.56Å; D375-N378 VanDerWaalsContact O-C 3.28Å; D375-N378 PolarHBondContact O-N 2.96Å; D375-N378 PolarHBondContact OD1-N 2.98Å; D375-N378 WeakPolarHBondContact OD2-CB 3.48Å; N378-S380 PolarHBondContact O-N 2.99Å; N378-S380 WeakPolarHBondContact OD1-CB 3.37Å; N378-S380 PolarHBondContact OD1-N 2.92Å; N378-S380 PolarHBondContact OD1-OG 2.94Å; N378-A381 WeakPolarHBondContact O-CB 3.49Å; N378-A381 PolarHBondContact O-N 3.22Å
379	P	81.9	Confident	76.7	Confident	87 Å²	87	85.1 Å²	85.1	57%	0.565	46%	0.458	S	S	*	.	G	3₁₀ helix	trans	-62.1	-17	178.2	25.7	-35	0	0	0	114.1	L373 T377 A381 G382	L373-P379 HydrophobicContact CD1-CB 3.93Å; L373-P379 HydrophobicContact CD2-CB 4.49Å; T377-P379 WeakPolarHBondContact O-CD 3.39Å; P379-A381 VanDerWaalsContact C-N 3.27Å; P379-A381 PolarHBondContact O-N 3.07Å; P379-G382 PolarHBondContact O-N 3.3Å
380	S	83.4	Confident	74.5	Confident	106 Å²	106	87.2 Å²	87.2	74%	0.741	47%	0.468	S	S	*	.	G	3₁₀ helix	trans	-72.9	-17.4	175.2	78.7	0	0	0	0	113.6	N378 G382	N378-S380 PolarHBondContact O-N 2.99Å; N378-S380 WeakPolarHBondContact OD1-CB 3.37Å; N378-S380 PolarHBondContact OD1-N 2.92Å; N378-S380 PolarHBondContact OD1-OG 2.94Å; S380-G382 PolarHBondContact O-N 3.14Å
381	A	79.3	Confident	72.1	Confident	53 Å²	53	93.2 Å²	93.2	44%	0.438	50%	0.495	S	S	.	.	G	3₁₀ helix	trans	-70	-12.8	173	0	0	0	0	0	113.3	N378 P379	N378-A381 WeakPolarHBondContact O-CB 3.49Å; N378-A381 PolarHBondContact O-N 3.22Å; P379-A381 VanDerWaalsContact C-N 3.27Å; P379-A381 PolarHBondContact O-N 3.07Å
382	G	80.1	Confident	69.9	Low	27 Å²	27	97.3 Å²	97.3	28%	0.278	52%	0.52	S	S	.	.			trans	79.8	-176.4	178.1	0	0	0	0	0	114.7	L374 P379 S380	L374-G382 PolarHBondContact N-O 3.11Å; L374-G382 VanDerWaalsContact N-O 3.12Å; P379-G382 PolarHBondContact O-N 3.3Å; S380-G382 PolarHBondContact O-N 3.14Å
383	T	81	Confident	67.7	Low	49 Å²	49	101.7 Å²	101.7	30%	0.301	54%	0.538	S	S	.	.	B	Isolated β-bridge	trans	-74.4	161.9	174.9	55.7	0	0	0	0	112	Q369 M372 K385	Q369-T383 HydrophobicContact CB-CG2 3.82Å; Q369-T383 HydrophobicContact CG-CG2 4.12Å; M372-T383 HydrophobicContact CB-CG2 4.18Å; M372-T383 CarbonylContact O-C 3.49Å; M372-T383 WeakPolarHBondContact O-CA 3.28Å; M372-T383 WeakPolarHBondContact O-CB 3.44Å; T383-K385 PolarHBondContact O-N 3.36Å
384	A	70.6	Confident	65.9	Low	14 Å²	14	102 Å²	102	12%	0.116	54%	0.54	C	S	.	.			trans	-51.7	129.2	163.2	0	0	0	0	0	109.4	V354 M372 L374 I386	V354-A384 HydrophobicContact CG1-CB 4.13Å; V354-A384 HydrophobicContact CG2-CB 3.54Å; M372-A384 PolarHBondContact O-N 2.86Å; L374-A384 HydrophobicContact CD2-CB 3.9Å; L374-A384 HydrophobicContact CG-CB 4.33Å; A384-I386 PolarHBondContact O-N 3.44Å; A384-I386 VanDerWaalsContact O-N 3.09Å
385	K	56.9	Low	64.2	Low	189 Å²	189	104.6 Å²	104.6	82%	0.822	55%	0.554	S	S	*	*			trans	-70.2	108.3	177	-69.9	175.9	-178.2	169.5	0	107.7	T383 D387	T383-K385 PolarHBondContact O-N 3.36Å; K385-D387 PolarHBondContact O-N 2.87Å
386	I	58.3	Low	62.9	Low	113 Å²	113	102.8 Å²	102.8	58%	0.579	54%	0.544	S	S	*	.			trans	-54.5	127.3	153.6	-53.2	177.4	0	0	0	105.4	F352 A384	F352-I386 HydrophobicContact CD1-CG1 4.18Å; F352-I386 HydrophobicContact CE1-CD1 4.15Å; F352-I386 HydrophobicContact CE1-CG1 4Å; A384-I386 PolarHBondContact O-N 3.44Å; A384-I386 VanDerWaalsContact O-N 3.09Å
387	D	44.3	Very low	61.6	Low	147 Å²	147	103.8 Å²	103.8	79%	0.786	55%	0.547	S	S	*	.			trans	-63.5	145.7	-166.6	-156.5	0.8	0	0	0	111.8	K385 Q389	K385-D387 PolarHBondContact O-N 2.87Å; D387-Q389 PolarHBondContact O-N 2.88Å
388	K	41.7	Very low	60.3	Low	192 Å²	192	101.6 Å²	101.6	84%	0.835	53%	0.529	S	S	*	.	S	Bend	trans	-72.6	101	-167.3	-86.8	-168	170.7	-168.7	0	111.2	E390	K388-E390 PolarHBondContact O-N 3.29Å
389	Q	39.5	Very low	59	Low	191 Å²	191	104.2 Å²	104.2	89%	0.893	55%	0.548	S	S	*	.			trans	54.3	43.4	162.4	-66.8	-175.3	-42.5	0	0	115.3	D387 K391	D387-Q389 PolarHBondContact O-N 2.88Å; Q389-K391 PolarHBondContact O-N 2.84Å
390	E	42.4	Very low	57.7	Low	165 Å²	165	101.4 Å²	101.4	77%	0.771	53%	0.531	S	S	*	.			trans	-64.1	127.8	130.1	-172.6	166.6	-124.6	0	0	106.2	K388 V392	K388-E390 PolarHBondContact O-N 3.29Å; E390-V392 HydrophobicContact CB-CG2 4.3Å; E390-V392 HydrophobicContact CG-CG2 4.29Å; E390-V392 PolarHBondContact O-N 2.88Å
391	K	41.3	Very low	56.1	Low	189 Å²	189	100.4 Å²	100.4	82%	0.822	52%	0.524	S	S	*	.			trans	-77	69.7	-178.1	-168.8	173.7	-175.9	171.2	0	109.1	Q389 K393	Q389-K391 PolarHBondContact O-N 2.84Å; K391-K393 PolarHBondContact O-N 3.42Å
392	V	45.8	Very low	54.7	Low	91 Å²	91	99.4 Å²	99.4	55%	0.552	51%	0.514	S	S	*	.			trans	-66.9	76.1	172	-171.9	0	0	0	0	108.1	E390 L394	E390-V392 HydrophobicContact CB-CG2 4.3Å; E390-V392 HydrophobicContact CG-CG2 4.29Å; E390-V392 PolarHBondContact O-N 2.88Å; V392-L394 PolarHBondContact O-N 3.1Å
393	K	48.4	Very low	52.9	Low	121 Å²	121	107.9 Å²	107.9	53%	0.526	54%	0.543	S	S	.	.			trans	-40.3	134.3	147.9	-79.3	-177	171.3	-175.1	0	106.1	K391 N395	K391-K393 PolarHBondContact O-N 3.42Å; K393-N395 PolarHBondContact O-N 3.3Å
394	L	53.7	Low	51	Low	18 Å²	18	111.3 Å²	111.3	9%	0.094	56%	0.558	C	S	.	*			trans	-46.6	119.8	165.8	-63.3	-179.3	0	0	0	107.6	M143 L144 Q148 P251 E252 V392 F396	M143-L394 HydrophobicContact CB-CD1 4.42Å; M143-L394 HydrophobicContact CE-CD1 4.49Å; M143-L394 HydrophobicContact CE-CD2 4.27Å; M143-L394 WeakPolarHBondContact O-CD1 3.43Å; L144-L394 HydrophobicContact CD2-CD1 4.1Å; Q148-L394 PolarHBondContact NE2-O 3.15Å; P251-L394 HydrophobicContact CG-CD1 4.45Å; E252-L394 HydrophobicContact CG-CD1 4Å; E252-L394 HydrophobicContact CG-CD2 3.61Å; E252-L394 HydrophobicContact CG-CG 4.41Å; V392-L394 PolarHBondContact O-N 3.1Å; L394-F396 HydrophobicContact CB-CD2 3.67Å; L394-F396 HydrophobicContact CB-CE2 3.71Å; L394-F396 HydrophobicContact CD1-CE2 3.99Å; L394-F396 WeakPolarHBondContact O-CD2 3.3Å; L394-F396 PolarHBondContact O-N 2.88Å
395	N	51.7	Low	49.2	Very low	152 Å²	152	117.6 Å²	117.6	81%	0.813	59%	0.589	S	S	*	*			trans	-76.1	68.1	-172.2	-89.7	-35.7	0	0	0	110	K393 D397	K393-N395 PolarHBondContact O-N 3.3Å; N395-D397 PolarHBondContact O-N 3.47Å; N395-D397 VanDerWaalsContact O-N 3.08Å
396	F	59.8	Low	48	Very low	21 Å²	21	115.2 Å²	115.2	9%	0.092	58%	0.582	C	S	.	*			trans	-64.8	102.1	169.5	-87.1	-97.8	0	0	0	108.4	L144 Q148 Y151 L152 L255 L394 M398	L144-F396 HydrophobicContact CD2-CE2 3.99Å; L144-F396 HydrophobicContact CD2-CZ 4.09Å; Q148-F396 HydrophobicContact CB-CD2 4.13Å; Q148-F396 HydrophobicContact CB-CE2 3.87Å; Q148-F396 HydrophobicContact CB-CZ 4.13Å; Q148-F396 HydrophobicContact CG-CD2 3.71Å; Q148-F396 HydrophobicContact CG-CE2 3.95Å; Q148-F396 HydrophobicContact CG-CG 4.17Å; Y151-F396 AromaticContact CD1-CD1 3.59Å; Y151-F396 HydrophobicContact CD1-CD1 3.59Å; Y151-F396 AromaticContact CD1-CE1 3.64Å; Y151-F396 HydrophobicContact CD1-CE1 3.64Å; Y151-F396 AromaticContact CE1-CD1 3.75Å; Y151-F396 HydrophobicContact CE1-CD1 3.75Å; Y151-F396 HydrophobicContact CE1-CE1 4Å; L152-F396 HydrophobicContact CD1-CZ 4.18Å; L152-F396 HydrophobicContact CD2-CE1 3.6Å; L152-F396 HydrophobicContact CD2-CZ 3.8Å; L152-F396 HydrophobicContact CG-CE1 4.07Å; L152-F396 HydrophobicContact CG-CZ 3.97Å; L255-F396 HydrophobicContact CD1-CD1 3.99Å; L255-F396 HydrophobicContact CD1-CE1 3.64Å; L255-F396 HydrophobicContact CD1-CZ 4.46Å; L255-F396 HydrophobicContact CD2-CD1 3.78Å; L255-F396 HydrophobicContact CD2-CD2 4.34Å; L255-F396 HydrophobicContact CD2-CE1 3.63Å; L255-F396 HydrophobicContact CD2-CE2 4.21Å; L255-F396 HydrophobicContact CD2-CG 4.15Å; L255-F396 HydrophobicContact CD2-CZ 3.86Å; L255-F396 HydrophobicContact CG-CE1 4.12Å; L394-F396 HydrophobicContact CB-CD2 3.67Å; L394-F396 HydrophobicContact CB-CE2 3.71Å; L394-F396 HydrophobicContact CD1-CE2 3.99Å; L394-F396 WeakPolarHBondContact O-CD2 3.3Å; L394-F396 PolarHBondContact O-N 2.88Å; F396-M398 HydrophobicContact CB-CE 3.91Å; F396-M398 HydrophobicContact CB-CG 4.36Å; F396-M398 HydrophobicContact CB-SD 4.33Å; F396-M398 HydrophobicContact CD1-CE 3.8Å; F396-M398 HydrophobicContact CG-CE 4.21Å; F396-M398 PolarHBondContact O-N 3.16Å
397	D	58	Low	46.6	Very low	66 Å²	66	115.4 Å²	115.4	35%	0.353	59%	0.594	S	S	.	*			trans	-61.8	90.8	152.3	171.2	13.9	0	0	0	108.4	R261 N395 T399 A400	R261-D397 IonicContact NH2-OD2 2.91Å; N395-D397 PolarHBondContact O-N 3.47Å; N395-D397 VanDerWaalsContact O-N 3.08Å; D397-T399 PolarHBondContact O-N 2.83Å; D397-T399 WeakPolarHBondContact OD1-CA 3.33Å; D397-T399 WeakPolarHBondContact OD1-CB 3.1Å; D397-T399 PolarHBondContact OD1-N 3.23Å; D397-T399 PolarHBondContact OD1-OG1 3.09Å; D397-A400 PolarHBondContact OD1-N 2.86Å; D397-A400 VanDerWaalsContact OD1-N 3.16Å; D397-A400 WeakPolarHBondContact OD2-CB 3.42Å
398	M	61.7	Low	46	Very low	76 Å²	76	117.1 Å²	117.1	37%	0.374	59%	0.594	S	S	.	*	T	Hydrogen-bonded Turn	trans	-67.1	-18.6	177.1	-55.1	-94	58.5	0	0	111.8	E147 Y151 F396	E147-M398 HydrophobicContact CG-SD 4.43Å; Y151-M398 VanDerWaalsContact CB-CE 3.44Å; Y151-M398 HydrophobicContact CD1-CE 3.4Å; Y151-M398 VanDerWaalsContact CD1-CE 3.4Å; Y151-M398 HydrophobicContact CD2-CE 3.51Å; Y151-M398 HydrophobicContact CE1-CE 3.91Å; Y151-M398 HydrophobicContact CE2-CE 4.03Å; Y151-M398 HydrophobicContact CG-CE 3.17Å; F396-M398 HydrophobicContact CB-CE 3.91Å; F396-M398 HydrophobicContact CB-CG 4.36Å; F396-M398 HydrophobicContact CB-SD 4.33Å; F396-M398 HydrophobicContact CD1-CE 3.8Å; F396-M398 HydrophobicContact CG-CE 4.21Å; F396-M398 PolarHBondContact O-N 3.16Å
399	T	58.4	Low	45.3	Very low	122 Å²	122	114.5 Å²	114.5	75%	0.748	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.5	-24.8	-177	80.5	0	0	0	0	112.1	D397 S401	D397-T399 PolarHBondContact O-N 2.83Å; D397-T399 WeakPolarHBondContact OD1-CA 3.33Å; D397-T399 WeakPolarHBondContact OD1-CB 3.1Å; D397-T399 PolarHBondContact OD1-N 3.23Å; D397-T399 PolarHBondContact OD1-OG1 3.09Å; T399-S401 PolarHBondContact O-N 3.02Å
400	A	55.7	Low	44.7	Very low	27 Å²	27	110.9 Å²	110.9	22%	0.223	59%	0.587	C	S	.	*			trans	-60.8	92.3	170.9	0	0	0	0	0	111.5	Y151 D397	Y151-A400 PolarHBondContact OH-O 3.28Å; D397-A400 PolarHBondContact OD1-N 2.86Å; D397-A400 VanDerWaalsContact OD1-N 3.16Å; D397-A400 WeakPolarHBondContact OD2-CB 3.42Å
401	S	48.8	Very low	43.9	Very low	85 Å²	85	111.6 Å²	111.6	59%	0.594	60%	0.596	S	S	*	*			trans	-67.9	145.9	173.5	-73.9	0	0	0	0	111.6	T399 K403	T399-S401 PolarHBondContact O-N 3.02Å; S401-K403 PolarHBondContact O-N 3.05Å
402	P	51.1	Low	43	Very low	33 Å²	33	108.2 Å²	108.2	21%	0.214	60%	0.596	C	S	.	*			trans	-56.5	111.3	178.5	-26.2	34.8	0	0	0	112.7	F155 I404	F155-P402 HydrophobicContact CD1-CB 4.07Å; F155-P402 HydrophobicContact CD1-CG 4.04Å; F155-P402 HydrophobicContact CE1-CB 3.62Å; F155-P402 HydrophobicContact CE1-CG 3.66Å; F155-P402 HydrophobicContact CZ-CB 4.39Å; F155-P402 HydrophobicContact CZ-CG 4.04Å; P402-I404 PolarHBondContact O-N 3.25Å
403	K	41.8	Very low	41.9	Very low	205 Å²	205	107.2 Å²	107.2	89%	0.891	60%	0.604	S	S	*	*			trans	-80.6	101.7	177.2	-69	-179.9	-178.7	174.5	0	109.9	S401 L405	S401-K403 PolarHBondContact O-N 3.05Å; K403-L405 PolarHBondContact O-N 3.06Å
404	I	41	Very low	40.8	Very low	121 Å²	121	105.1 Å²	105.1	62%	0.621	62%	0.616	S	S	*	*			trans	-70.4	111.9	179.8	-53.6	176.8	0	0	0	110.1	P402 M406	P402-I404 PolarHBondContact O-N 3.25Å; I404-M406 HydrophobicContact CG2-CE 3.75Å; I404-M406 HydrophobicContact CG2-CG 4.04Å; I404-M406 PolarHBondContact O-N 3.03Å
405	L	32.5	Very low	39.4	Very low	146 Å²	146	111.5 Å²	111.5	76%	0.764	66%	0.656	S	S	*	*			trans	-90	87.1	172.9	-174	67.8	0	0	0	110.8	K403	K403-L405 PolarHBondContact O-N 3.06Å
406	M	32.2	Very low	38.2	Very low	139 Å²	139	107.6 Å²	107.6	69%	0.685	65%	0.652	S	S	*	*			trans	-76.9	123.3	169.1	-79.1	-67.5	137	0	0	110.9	I404	I404-M406 HydrophobicContact CG2-CE 3.75Å; I404-M406 HydrophobicContact CG2-CG 4.04Å; I404-M406 PolarHBondContact O-N 3.03Å
407	S	28.5	Very low	37	Very low	117 Å²	117	117.4 Å²	117.4	82%	0.818	69%	0.689	S	S	*	*			trans	-76.5	126.1	-177.9	-49.6	0	0	0	0	112.5
408	K	31.9	Very low	35.7	Very low	182 Å²	182	123.9 Å²	123.9	79%	0.791	71%	0.708	S	S	*	*			trans	-114.5	155	159.1	-77.9	-178.7	176.9	175.7	0	109.4
409	P	26.9	Very low	33.9	Very low	138 Å²	138	127.3 Å²	127.3	90%	0.896	73%	0.727	S	S	*	*			trans	-62.7	140.2	178.5	-20.3	33	0	0	0	111.8
410	V	27.4	Very low	32.4	Very low	114 Å²	114	126.4 Å²	126.4	69%	0.691	73%	0.725	S	S	*	*			trans	-112.6	130.7	-177	179.9	0	0	0	0	109.7
411	L	24.3	Very low	31	Very low	181 Å²	181	132.6 Å²	132.6	95%	0.948	75%	0.754	S	S	*	*			trans	-98.6	139.7	148.7	-72.1	178.4	0	0	0	107.7
412	S	23.9	Very low	29.9	Very low	118 Å²	118	133 Å²	133	83%	0.825	76%	0.756	S	S	*	*			trans	-127.3	160.9	-148.3	-167.4	0	0	0	0	114
413	G	23.1	Very low	28.7	Very low	69 Å²	69	138.2 Å²	138.2	71%	0.711	78%	0.782	S	S	*	*			trans	111.1	118	-168.9	0	0	0	0	0	109.4
414	G	25	Very low	27.6	Very low	77 Å²	77	135.7 Å²	135.7	79%	0.794	78%	0.776	S	S	*	*			cis	94.9	122	26.6	0	0	0	0	0	108
415	T	24.5	Very low	27.7	Very low	152 Å²	152	134.8 Å²	134.8	93%	0.933	78%	0.777	S	S	*	*			cis	-138	170	47.3	52.7	0	0	0	0	114.3
416	G	26.1	Very low	27.5	Very low	71 Å²	71	138.5 Å²	138.5	73%	0.732	78%	0.781	S	S	*	*			trans	-129.7	165.6	168.5	0	0	0	0	0	113.8
417	R	33.8	Very low	27.3	Very low	226 Å²	226	137.1 Å²	137.1	85%	0.853	79%	0.785	S	S	*	*			trans	-159.8	124.2	162.9	-99.1	159.9	-174.4	-114.4	2.2	106.1
418	R	31.6	Very low	28.3	Very low	203 Å²	203	136.9 Å²	136.9	77%	0.766	78%	0.781	S	S	*	*				92.1	133.9	62.4	-172.6	-145.1	-87.4	-134.4	-1.7	110.8
419	I	24.2	Very low	27.9	Very low	148 Å²	148	136.5 Å²	136.5	76%	0.759	78%	0.784	S	S	*	*			trans	136.1	119.8	156	-72.7	155.7	0	0	0	107.3
420	S	26.2	Very low	28.2	Very low	103 Å²	103	134.7 Å²	134.7	72%	0.72	78%	0.775	S	S	*	*			cis	89.1	121.6	24.9	-171.8	0	0	0	0	115.1
421	L	26.6	Very low	28.2	Very low	157 Å²	157	134.8 Å²	134.8	82%	0.822	78%	0.776	S	S	*	*			trans	176	129.3	140.5	-97.5	163.7	0	0	0	115.6
422	S	25.2	Very low	28.3	Very low	92 Å²	92	132.8 Å²	132.8	64%	0.643	77%	0.766	S	S	*	*			trans	30	115.4	144.1	59.4	0	0	0	0	125.9
423	D	25.2	Very low	28.5	Very low	143 Å²	143	132.2 Å²	132.2	77%	0.765	76%	0.762	S	S	*	*				46.6	126.8	117.1	-78.1	-72.5	0	0	0	127.4
424	M	19.3	Very low	29	Very low	153 Å²	153	134.2 Å²	134.2	75%	0.754	77%	0.765	S	S	*	*			trans	78.9	150.3	133.7	-149	56.7	60.6	0	0	120.2
425	P	44.1	Very low	29.2	Very low	101 Å²	101	136.4 Å²	136.4	66%	0.656	76%	0.763	S	S	*	*			cis	-127.4	165.8	-6.8	16.1	9.8	0	0	0	118.5
426	R	27.8	Very low	29.4	Very low	225 Å²	225	137.7 Å²	137.7	85%	0.849	76%	0.758	S	S	*	*			trans	35.3	117.8	142.6	-66.6	179.5	175.5	145.4	-0.3	121.5
427	S	27	Very low	29.6	Very low	109 Å²	109	139.8 Å²	139.8	76%	0.762	76%	0.757	S	S	*	*				102.6	162.8	74.8	-68	0	0	0	0	112.9
428	P	50.1	Low	29.4	Very low	112 Å²	112	131.7 Å²	131.7	73%	0.727	74%	0.743	S	S	*	*			cis	-133.2	-163.2	-13.9	38.9	-18.6	0	0	0	114.9
429	M	23.9	Very low	29.4	Very low	174 Å²	174	127.5 Å²	127.5	86%	0.857	75%	0.745	S	S	*	*			trans	74.8	149.2	160	-70.1	176.1	72.5	0	0	118.9
430	S	31.9	Very low	29.6	Very low	101 Å²	101	125.3 Å²	125.3	71%	0.706	74%	0.735	S	S	*	*			cis	-146.1	-175.5	-5.2	-149.8	0	0	0	0	113.3
431	T	27.7	Very low	29.9	Very low	116 Å²	116	125.4 Å²	125.4	71%	0.712	73%	0.731	S	S	*	*			trans	-93	-176.3	-165.2	60.5	0	0	0	0	116.7
432	N	26.1	Very low	30.2	Very low	138 Å²	138	124.8 Å²	124.8	74%	0.738	72%	0.724	S	S	*	*			trans	91.3	108.3	165.5	-60	8.2	0	0	0	114.6
433	S	30.1	Very low	30.6	Very low	107 Å²	107	127.5 Å²	127.5	75%	0.748	73%	0.726	S	S	*	*				68.2	135.4	74.4	76	0	0	0	0	112.8
434	S	32.1	Very low	30.9	Very low	111 Å²	111	126.9 Å²	126.9	78%	0.776	72%	0.723	S	S	*	*			cis	-155.7	178.3	48.5	-151.8	0	0	0	0	115.9
435	V	30	Very low	31.7	Very low	123 Å²	123	123.1 Å²	123.1	75%	0.745	72%	0.716	S	S	*	*			trans	-55.7	138.6	178.2	-78.7	0	0	0	0	114.3
436	H	29.1	Very low	31.2	Very low	179 Å²	179	125.7 Å²	125.7	83%	0.829	72%	0.72	S	S	*	*				83.5	149.6	107.5	-166.5	73.8	0	0	0	113.3
437	T	29.7	Very low	31.6	Very low	114 Å²	114	122.4 Å²	122.4	70%	0.699	71%	0.712	S	S	*	*			cis	-104	-175.8	5.9	55.9	0	0	0	0	111.2
438	G	29.1	Very low	31.9	Very low	56 Å²	56	126.8 Å²	126.8	58%	0.577	72%	0.717	S	S	*	*			cis	82.2	132.1	23.2	0	0	0	0	0	111.3
439	S	32.6	Very low	31.1	Very low	115 Å²	115	125.9 Å²	125.9	80%	0.804	72%	0.719	S	S	*	*			cis	-153.8	139.8	-3.3	-63.8	0	0	0	0	107.3
440	D	28.1	Very low	31.1	Very low	102 Å²	102	123.9 Å²	123.9	55%	0.545	72%	0.717	S	S	.	*				72.2	167.9	103.4	-160.5	24	0	0	0	115.1	K199	K199-D440 WeakPolarHBondContact CE-OD1 3.4Å; K199-D440 WeakPolarHBondContact CE-OD2 3.42Å; K199-D440 IonicContact NZ-OD1 2.64Å; K199-D440 PolarHBondContact NZ-OD1 3.19Å; K199-D440 IonicContact NZ-OD2 2.79Å; K199-D440 PolarHBondContact NZ-OD2 3.3Å
441	V	32.7	Very low	31.1	Very low	105 Å²	105	124 Å²	124	64%	0.636	72%	0.718	S	S	*	*			trans	74.7	134.2	170.1	178	0	0	0	0	114.9
442	E	32.8	Very low	31.6	Very low	145 Å²	145	123.2 Å²	123.2	68%	0.678	72%	0.717	S	S	*	*			cis	-147.4	-179.9	-15.3	-114.7	169.5	-173.9	0	0	109.3
443	Q	32.6	Very low	32.2	Very low	148 Å²	148	123.2 Å²	123.2	69%	0.692	71%	0.712	S	S	*	*				42.3	143.5	72.7	-59.2	-168.8	-116.5	0	0	115
444	D	32.1	Very low	32.2	Very low	130 Å²	130	126.8 Å²	126.8	70%	0.695	71%	0.714	S	S	*	*			cis	-150.4	148.8	4.5	-130.1	-140.4	0	0	0	108.9
445	A	35.6	Very low	32.3	Very low	74 Å²	74	125.9 Å²	125.9	61%	0.612	71%	0.708	S	S	*	*				76.2	138.4	98.2	0	0	0	0	0	119.7
446	E	33.9	Very low	32.4	Very low	155 Å²	155	124.3 Å²	124.3	72%	0.724	71%	0.708	S	S	*	*			trans	64.1	167.3	158.2	-56.8	-148.5	149.8	0	0	121.5
447	K	37.4	Very low	32.5	Very low	157 Å²	157	120.8 Å²	120.8	68%	0.683	70%	0.704	S	S	*	*			cis	-156.8	148.4	-47.3	-103.8	172	-170.6	160.3	0	110.4
448	K	32	Very low	32.6	Very low	200 Å²	200	124.2 Å²	124.2	87%	0.87	71%	0.712	S	S	*	*			trans	59.3	103.5	154.9	-88.6	-168.3	168.9	-173.6	0	123.3
449	A	34.1	Very low	32.7	Very low	93 Å²	93	130.4 Å²	130.4	77%	0.769	73%	0.725	S	S	*	*				60.9	129.8	99.9	0	0	0	0	0	125
450	T	24	Very low	32.8	Very low	133 Å²	133	130 Å²	130	82%	0.816	72%	0.723	S	S	*	*			trans	-138.2	146.2	140.6	52.2	0	0	0	0	107.5
451	S	32.3	Very low	32.9	Very low	103 Å²	103	133.8 Å²	133.8	72%	0.72	74%	0.739	S	S	*	*			cis	70.3	145.2	40	-153.2	0	0	0	0	112.6
452	S	37.7	Very low	32.8	Very low	99 Å²	99	136 Å²	136	69%	0.692	75%	0.748	S	S	*	*			cis	-126.3	-160.7	10.4	-56.6	0	0	0	0	110.4
453	H	39.1	Very low	32.4	Very low	139 Å²	139	138 Å²	138	64%	0.644	76%	0.755	S	S	*	*			cis	-152.4	-154.1	10.7	-145.7	-153.9	0	0	0	108.3
454	F	28.6	Very low	32.2	Very low	181 Å²	181	137.7 Å²	137.7	79%	0.794	76%	0.757	S	S	*	*			cis	-138.5	-126.8	14.7	-134.7	-60.9	0	0	0	113.5
455	S	34.9	Very low	31.9	Very low	93 Å²	93	137.2 Å²	137.2	65%	0.65	75%	0.754	S	S	*	*			trans	-158.3	170	-163.9	-46.7	0	0	0	0	111.5
456	A	31.7	Very low	31.4	Very low	89 Å²	89	141.6 Å²	141.6	74%	0.736	76%	0.76	S	S	*	*			cis	-123.5	-96.4	4	0	0	0	0	0	113.8
457	S	32.5	Very low	31.1	Very low	106 Å²	106	138.7 Å²	138.7	74%	0.741	76%	0.756	S	S	*	*			cis	-173.1	131.3	2.4	48.3	0	0	0	0	109.4
458	E	30.3	Very low	30.5	Very low	186 Å²	186	137.4 Å²	137.4	87%	0.869	76%	0.762	S	S	*	*			cis	-141.4	-68.2	-7.6	-54	-168.9	103.3	0	0	112.6
459	E	31.6	Very low	30.2	Very low	185 Å²	185	132.4 Å²	132.4	86%	0.864	76%	0.757	S	S	*	*			trans	-143.4	161.4	-164.7	-75.7	-163.9	127.7	0	0	112.8
460	S	34.4	Very low	29.8	Very low	107 Å²	107	133.4 Å²	133.4	75%	0.748	76%	0.759	S	S	*	*			cis	-171.6	-179.9	-17	-177.1	0	0	0	0	110.4
461	M	30.6	Very low	30.8	Very low	182 Å²	182	133.4 Å²	133.4	90%	0.897	76%	0.761	S	S	*	*			trans	83	152.4	173.5	-83.7	-169	164.4	0	0	121.6
462	D	31.6	Very low	30.4	Very low	152 Å²	152	133.1 Å²	133.1	81%	0.813	77%	0.765	S	S	*	*			trans	-123.6	178.5	-159.7	-71.1	-85.6	0	0	0	115.8
463	F	23.2	Very low	30	Very low	187 Å²	187	133.4 Å²	133.4	82%	0.82	77%	0.767	S	S	*	*			trans	119	117.8	134.4	-117.5	-104.8	0	0	0	120.7
464	L	29.2	Very low	29.5	Very low	141 Å²	141	133 Å²	133	74%	0.738	77%	0.774	S	S	*	*			trans	74.9	133.4	151.3	-86.1	178.2	0	0	0	126.3
465	D	25.2	Very low	29.6	Very low	120 Å²	120	133.4 Å²	133.4	64%	0.642	78%	0.776	S	S	*	*			trans	59.5	109.1	140.5	-113.8	23.1	0	0	0	124.5
466	K	26.1	Very low	29.2	Very low	166 Å²	166	135.3 Å²	135.3	72%	0.722	78%	0.784	S	S	*	*				69.5	131	106.5	-173.3	-176.9	178.9	-175.7	0	123.5
467	S	26.6	Very low	28.9	Very low	94 Å²	94	134 Å²	134	66%	0.657	78%	0.779	S	S	*	*			trans	77.8	114	146.6	-79.9	0	0	0	0	123.6
468	T	25	Very low	28.8	Very low	130 Å²	130	138.3 Å²	138.3	80%	0.798	79%	0.787	S	S	*	*				74.5	141.9	119.7	-41.2	0	0	0	0	121.3
469	A	24.9	Very low	28.8	Very low	94 Å²	94	134.3 Å²	134.3	78%	0.777	79%	0.787	S	S	*	*			trans	97.8	143.5	154.5	0	0	0	0	0	120.1
470	S	26.8	Very low	28.5	Very low	114 Å²	114	128.8 Å²	128.8	80%	0.797	78%	0.779	S	S	*	*			trans	-84.2	173.7	168.5	-35.8	0	0	0	0	110.5
471	P	44.8	Very low	28.2	Very low	134 Å²	134	129.2 Å²	129.2	87%	0.87	78%	0.782	S	S	*	*				-144.4	-151.7	69.1	38.7	-17.6	0	0	0	113.4
472	A	24.6	Very low	28.1	Very low	97 Å²	97	128 Å²	128	80%	0.802	78%	0.779	S	S	*	*			trans	-144.3	168.7	-164.4	0	0	0	0	0	114.9
473	S	27.9	Very low	28	Very low	105 Å²	105	126.7 Å²	126.7	73%	0.734	78%	0.781	S	S	*	*			trans	119.7	148.1	138.5	-157.1	0	0	0	0	119
474	T	28.7	Very low	28.1	Very low	129 Å²	129	121.2 Å²	121.2	79%	0.791	78%	0.777	S	S	*	*			trans	74.6	149.5	171	80.2	0	0	0	0	116.7
475	K	30.7	Very low	28	Very low	190 Å²	190	119.5 Å²	119.5	83%	0.826	78%	0.777	S	S	*	*			cis	-153	155.2	9.1	-155.7	178.1	177	179.3	0	114.1
476	T	27.4	Very low	28.7	Very low	133 Å²	133	119 Å²	119	82%	0.816	78%	0.78	S	S	*	*			trans	73.9	149.9	168.9	-50.9	0	0	0	0	114.7
477	G	24.4	Very low	28.8	Very low	62 Å²	62	119.2 Å²	119.2	64%	0.639	78%	0.781	S	S	*	*			cis	-148.7	163.7	-7.5	0	0	0	0	0	108.7
478	Q	31.7	Very low	29.4	Very low	196 Å²	196	117.4 Å²	117.4	92%	0.916	77%	0.768	S	S	*	*			cis	87.6	118.2	44.8	-78.7	-160.4	-31.3	0	0	115.3
479	A	28.7	Very low	29.3	Very low	103 Å²	103	119.3 Å²	119.3	85%	0.851	77%	0.765	S	S	*	*			cis	-155.7	147	-2.1	0	0	0	0	0	116.5
480	G	26.7	Very low	29.4	Very low	69 Å²	69	116.7 Å²	116.7	71%	0.711	74%	0.741	S	S	*	*			trans	140.6	178.3	172.7	0	0	0	0	0	112.4
481	S	28.3	Very low	29.8	Very low	115 Å²	115	114.7 Å²	114.7	80%	0.804	73%	0.725	S	S	*	*			cis	179	146.8	-31.2	-92.3	0	0	0	0	109.7
482	L	28.7	Very low	28.8	Very low	158 Å²	158	112 Å²	112	83%	0.827	70%	0.701	S	S	*	*			cis	-167.8	128.6	-26.5	-132.7	176.2	0	0	0	110.7
483	S	29.5	Very low	28.7	Very low	124 Å²	124	113.3 Å²	113.3	87%	0.867	69%	0.694	S	S	*	*			trans	67.8	151.2	172.7	-149.6	0	0	0	0	117.6
484	G	23.6	Very low	28.4	Very low	71 Å²	71	113.7 Å²	113.7	73%	0.732	70%	0.696	S	S	*	*			cis	-169.3	-172.2	2.9	0	0	0	0	0	114
485	S	27.4	Very low	28.3	Very low	106 Å²	106	111.7 Å²	111.7	74%	0.741	69%	0.693	S	S	*	*			trans	-163.3	153.7	-174.8	-172.9	0	0	0	0	114.5
486	P	40.3	Very low	28	Very low	109 Å²	109	108.7 Å²	108.7	71%	0.708	69%	0.693	S	S	*	*				-160.4	-156	122.4	40.4	-17.4	0	0	0	119.3
487	K	27.3	Very low	27.7	Very low	170 Å²	170	109.4 Å²	109.4	74%	0.739	69%	0.69	S	S	*	*			trans	-150.2	0	-164.9	-49	174.5	-172.1	170.1	0	112.3
488	P	40.2	Very low	27.5	Very low	57 Å²	57	112.6 Å²	112.6	37%	0.37	70%	0.698	S	S	.	*				0	-159.4	0	39.2	-13.3	0	0	0	118	P799 L800	P488-P799 CarbonylContact C-O 3.53Å; P488-P799 WeakPolarHBondContact CA-O 3.16Å; P488-L800 WeakPolarHBondContact O-CD1 3.35Å
489	F	21.8	Very low	27.1	Very low	170 Å²	170	109 Å²	109	75%	0.746	69%	0.69	S	S	*	*			trans	98.5	143.8	153.1	-58.9	-33.4	0	0	0	127.9	P799	F489-P799 PolarHBondContact N-O 3.46Å; F489-P799 WeakPolarHBondContact O-CD 3.44Å
490	S	27.8	Very low	26.9	Very low	39 Å²	39	112.7 Å²	112.7	27%	0.273	69%	0.686	S	S	.	*			trans	-76.5	-177.1	179.9	151.1	0	0	0	0	121.3	Q797 R798	S490-Q797 WeakPolarHBondContact CA-O 3.45Å; S490-Q797 PolarHBondContact N-O 3.09Å; S490-R798 VanDerWaalsContact OG-CD 3.3Å; S490-R798 WeakPolarHBondContact OG-CD 3.5Å; S490-R798 VanDerWaalsContact OG-CG 3.23Å; S490-R798 WeakPolarHBondContact OG-CG 3.48Å; S490-R798 PolarHBondContact OG-N 3.27Å
491	P	36	Very low	26.8	Very low	72 Å²	72	114.2 Å²	114.2	47%	0.468	68%	0.682	S	S	.	*			cis	-155.5	151.9	49	39.4	-16.8	0	0	0	123.2	K796	P491-K796 HydrophobicContact CB-CB 3.59Å; P491-K796 HydrophobicContact CB-CD 3.52Å; P491-K796 HydrophobicContact CB-CG 4.06Å
492	Q	23.9	Very low	26.4	Very low	77 Å²	77	114.1 Å²	114.1	36%	0.36	67%	0.672	S	S	.	*			trans	60.1	-169.8	152.7	-88.7	-162	-63.1	0	0	120.5	K796	Q492-K796 HydrophobicContact CG-CB 4.01Å; Q492-K796 HydrophobicContact CG-CG 4.34Å
493	L	21.3	Very low	26.3	Very low	125 Å²	125	114.3 Å²	114.3	65%	0.654	67%	0.666	S	S	*	*				177.2	162.4	-55.3	-171.1	138.4	0	0	0	110
494	S	21.1	Very low	26	Very low	112 Å²	112	114.6 Å²	114.6	78%	0.783	66%	0.663	S	S	*	*			trans	94.6	160.2	171.4	-31.9	0	0	0	0	116.8
495	A	26.8	Very low	26	Very low	88 Å²	88	116.2 Å²	116.2	73%	0.727	66%	0.663	S	S	*	*			trans	-104.9	171.4	-177.9	0	0	0	0	0	112.7
496	P	24	Very low	26	Very low	127 Å²	127	117 Å²	117	83%	0.825	66%	0.664	S	S	*	*				-131.2	-177.8	129.9	39	-30.6	0	0	0	113.3
497	I	21.3	Very low	25.4	Very low	147 Å²	147	118.8 Å²	118.8	75%	0.754	67%	0.673	S	S	*	*			trans	-126.9	152.9	-177.5	-40.1	175.8	0	0	0	108.9
498	T	22	Very low	25.5	Very low	129 Å²	129	114.2 Å²	114.2	79%	0.791	67%	0.674	S	S	*	*			trans	71.9	156.2	171.3	81.9	0	0	0	0	115.5
499	T	22.9	Very low	24.8	Very low	122 Å²	122	117 Å²	117	75%	0.748	70%	0.695	S	S	*	*			cis	-112	-155.2	-7.7	52.5	0	0	0	0	108.8
500	K	23.7	Very low	25.2	Very low	179 Å²	179	116 Å²	116	78%	0.778	70%	0.695	S	S	*	*			cis	-163.9	164.9	-4.9	-135.2	180	-178	175.6	0	104.9
501	T	23.8	Very low	25.3	Very low	101 Å²	101	122.1 Å²	122.1	62%	0.62	72%	0.724	S	S	*	*			cis	-153.8	-179.3	2.1	-29	0	0	0	0	107.7
502	D	20.8	Very low	24.9	Very low	113 Å²	113	124.4 Å²	124.4	60%	0.604	73%	0.733	S	S	*	*			trans	22.3	141	138.3	-69.5	-0.9	0	0	0	122.3
503	K	26.8	Very low	25.2	Very low	162 Å²	162	127.9 Å²	127.9	70%	0.704	75%	0.753	S	S	*	*			cis	-163.7	153	5.2	-120.3	160	-171.4	141.6	0	111.8
504	T	23.4	Very low	25.6	Very low	130 Å²	130	128.7 Å²	128.7	80%	0.798	76%	0.758	S	S	*	*			trans	22.2	146.5	147.1	52.6	0	0	0	0	122
505	S	23.8	Very low	26.2	Very low	105 Å²	105	130.6 Å²	130.6	73%	0.734	76%	0.759	S	S	*	*			cis	-167.5	149.2	0.8	175.7	0	0	0	0	112
506	T	27.1	Very low	26.5	Very low	123 Å²	123	134 Å²	134	76%	0.755	77%	0.765	S	S	*	*			trans	1.1	128	155.8	-50.8	0	0	0	0	121.4
507	T	28.2	Very low	27	Very low	147 Å²	147	138.7 Å²	138.7	90%	0.902	77%	0.766	S	S	*	*			trans	-152.7	135.6	134	-72.1	0	0	0	0	108.6
508	G	28.5	Very low	27.3	Very low	74 Å²	74	137.5 Å²	137.5	76%	0.763	77%	0.771	S	S	*	*			trans	-126	140.3	-174.4	0	0	0	0	0	113.4
509	S	26.2	Very low	27.7	Very low	115 Å²	115	141.6 Å²	141.6	80%	0.804	78%	0.777	S	S	*	*			trans	-143.1	113	174.5	-178.4	0	0	0	0	110.2
510	I	29.8	Very low	27.8	Very low	148 Å²	148	140.2 Å²	140.2	76%	0.759	78%	0.778	S	S	*	*			trans	-154.7	127.1	163.1	-81	114.3	0	0	0	107.3	N512	I510-N512 HydrophobicContact CG2-CB 4.2Å
511	L	29.1	Very low	28	Very low	168 Å²	168	140.6 Å²	140.6	88%	0.88	78%	0.783	S	S	*	*			trans	-134.5	102.1	140.7	-81.1	-176	0	0	0	107.8
512	N	28.3	Very low	28.3	Very low	120 Å²	120	144.6 Å²	144.6	64%	0.642	80%	0.797	S	S	*	*			trans	-96.9	101.7	179.4	175.6	-7.8	0	0	0	108.1	I510 N514	I510-N512 HydrophobicContact CG2-CB 4.2Å; N512-N514 PolarHBondContact O-N 2.8Å; N512-N514 PolarHBondContact OD1-ND2 3.48Å
513	L	30.1	Very low	28.5	Very low	151 Å²	151	145.9 Å²	145.9	79%	0.791	80%	0.804	S	S	*	*			trans	-80.7	66	-175.8	-71.8	177.1	0	0	0	112.8	L515	L513-L515 VanDerWaalsContact C-N 3.33Å; L513-L515 PolarHBondContact O-N 3.21Å
514	N	29.3	Very low	28.8	Very low	141 Å²	141	146.2 Å²	146.2	75%	0.754	81%	0.812	S	S	*	*			trans	-77.9	85.6	153.9	-88.5	-95.5	0	0	0	108.9	N512	N512-N514 PolarHBondContact O-N 2.8Å; N512-N514 PolarHBondContact OD1-ND2 3.48Å
515	L	35.3	Very low	29.2	Very low	153 Å²	153	147.9 Å²	147.9	80%	0.801	81%	0.808	S	S	*	*			trans	-132.3	55.6	178.5	-163.9	71.2	0	0	0	112.8	L513	L513-L515 VanDerWaalsContact C-N 3.33Å; L513-L515 PolarHBondContact O-N 3.21Å
516	D	33	Very low	29.4	Very low	159 Å²	159	151.9 Å²	151.9	85%	0.85	82%	0.815	S	S	*	*			trans	-147.6	68.1	160.1	-147.1	-15	0	0	0	113.6
517	R	33	Very low	29.5	Very low	226 Å²	226	154.7 Å²	154.7	85%	0.853	83%	0.825	S	S	*	*	S	Bend	trans	-154.4	54.3	170	-157.8	-171.9	-178.4	107.5	3.9	113.7
518	S	28.7	Very low	29.6	Very low	122 Å²	122	151.9 Å²	151.9	85%	0.853	81%	0.812	S	S	*	*			trans	-175.3	74.6	158.9	-82.1	0	0	0	0	113.3
519	K	29.6	Very low	29.4	Very low	214 Å²	214	157.4 Å²	157.4	93%	0.93	82%	0.817	S	S	*	*			trans	-154.6	57.5	153.2	-145.1	-177.6	-180	-172.5	0	116.6
520	A	26.4	Very low	29.5	Very low	93 Å²	93	157.9 Å²	157.9	77%	0.769	82%	0.821	S	S	*	*			trans	-145.3	140.4	150.4	0	0	0	0	0	105.6
521	E	27.6	Very low	29.3	Very low	188 Å²	188	157.4 Å²	157.4	88%	0.879	82%	0.824	S	S	*	*			cis	-131.3	-160.4	12.1	-63.7	173.3	100.9	0	0	111.9
522	M	28.8	Very low	29.2	Very low	184 Å²	184	157.8 Å²	157.8	91%	0.906	82%	0.822	S	S	*	*			trans	74.8	138	-172.6	-48.4	-156.5	-48.5	0	0	115.6
523	D	26.6	Very low	29.2	Very low	140 Å²	140	159.3 Å²	159.3	75%	0.749	83%	0.825	S	S	*	*			cis	-133.3	158	5.9	-166.7	22.4	0	0	0	113.8	K525	D523-K525 PolarHBondContact O-N 2.94Å
524	L	33.1	Very low	29.1	Very low	169 Å²	169	160.6 Å²	160.6	89%	0.885	83%	0.827	S	S	*	*			trans	-97	59.5	-176.5	-174	74.9	0	0	0	111.1
525	K	31	Very low	28.9	Very low	165 Å²	165	159.1 Å²	159.1	72%	0.717	83%	0.827	S	S	*	*			trans	-151.3	36	-173.9	-148.3	66.9	-176.3	177.1	0	118.8	D523	D523-K525 PolarHBondContact O-N 2.94Å
526	E	28.8	Very low	28.2	Very low	189 Å²	189	158.1 Å²	158.1	88%	0.883	83%	0.828	S	S	*	*			trans	-146.4	56.2	168.9	-146.9	165	-153	0	0	114.7
527	L	28.3	Very low	28.1	Very low	182 Å²	182	155.8 Å²	155.8	95%	0.953	82%	0.822	S	S	*	*			trans	-132.2	57.9	160.2	-78.4	180	0	0	0	109.9
528	S	30.2	Very low	27.7	Very low	89 Å²	89	151 Å²	151	62%	0.622	82%	0.817	S	S	*	*			trans	-156.8	61.7	179	63.1	0	0	0	0	112.8
529	E	25.4	Very low	28	Very low	189 Å²	189	150.7 Å²	150.7	88%	0.883	81%	0.812	S	S	*	*			trans	175.2	104.4	151.4	-103.4	166.1	-157.2	0	0	110.7
530	S	26.5	Very low	28	Very low	125 Å²	125	148 Å²	148	87%	0.874	81%	0.807	S	S	*	*	S	Bend	trans	174.2	56.1	153.3	-81.5	0	0	0	0	113.9
531	V	25.9	Very low	28	Very low	138 Å²	138	151.6 Å²	151.6	84%	0.836	81%	0.812	S	S	*	*			trans	-152.5	122	136.2	177.3	0	0	0	0	106.9
532	Q	27.5	Very low	28	Very low	176 Å²	176	147.8 Å²	147.8	82%	0.822	81%	0.806	S	S	*	*			trans	-142	149.1	166.7	-178.8	64.1	24.9	0	0	107
533	Q	28.4	Very low	28.1	Very low	153 Å²	153	144.7 Å²	144.7	72%	0.715	80%	0.799	S	S	*	*			trans	75	132.7	-165.9	-46.9	171	30.3	0	0	112.3
534	Q	28.6	Very low	28.4	Very low	178 Å²	178	148 Å²	148	83%	0.832	81%	0.807	S	S	*	*			cis	-154.5	152.4	-10.1	-104.8	164.5	-3.5	0	0	104.2
535	S	24.7	Very low	28.4	Very low	109 Å²	109	151.6 Å²	151.6	76%	0.762	81%	0.809	S	S	*	*			cis	-164.6	-177.3	25.8	51.2	0	0	0	0	111
536	T	20	Very low	28.4	Very low	132 Å²	132	153 Å²	153	81%	0.81	82%	0.818	S	S	*	*			trans	-135.2	163	171	41.4	0	0	0	0	108.8
537	P	30.9	Very low	28.7	Very low	111 Å²	111	152.2 Å²	152.2	72%	0.721	82%	0.818	S	S	*	*			cis	-142.4	156.5	27.6	43	-23.9	0	0	0	119.7
538	V	25.5	Very low	29.4	Very low	126 Å²	126	150.9 Å²	150.9	76%	0.764	80%	0.8	S	S	*	*				34.5	132.8	125.2	-177.3	0	0	0	0	118.7
539	P	33.4	Very low	30.4	Very low	114 Å²	114	150.3 Å²	150.3	74%	0.74	80%	0.796	S	S	*	*			cis	-138.6	154	41	24.5	-0	0	0	0	120.8
540	L	31.2	Very low	31.5	Very low	159 Å²	159	151.6 Å²	151.6	83%	0.832	79%	0.793	S	S	*	*			trans	13	131.2	138.4	-51.8	174.9	0	0	0	121.1
541	I	25.7	Very low	32.7	Very low	168 Å²	168	152.7 Å²	152.7	86%	0.862	78%	0.782	S	S	*	*				-170.8	148.1	106.2	-90.9	153.2	0	0	0	108.8
542	S	28.3	Very low	34	Very low	107 Å²	107	149.1 Å²	149.1	75%	0.748	76%	0.756	S	S	*	*			trans	-101.1	157.9	176.7	-52.7	0	0	0	0	111.8
543	P	31	Very low	35.4	Very low	119 Å²	119	145.1 Å²	145.1	77%	0.773	74%	0.74	S	S	*	*				-141.3	155.1	98.9	37.5	-24.8	0	0	0	116.3
544	K	31.5	Very low	36.8	Very low	210 Å²	210	142.7 Å²	142.7	91%	0.913	73%	0.732	S	S	*	*			trans	5	119.9	158.5	-58.2	175.3	-179	178	0	118
545	R	33.5	Very low	38.3	Very low	245 Å²	245	137.4 Å²	137.4	93%	0.925	71%	0.709	S	S	*	*			trans	-115.6	142.2	150.2	-81.7	-175	168.2	179.5	-4.6	109.7
546	Q	31.5	Very low	40.3	Very low	194 Å²	194	134.4 Å²	134.4	91%	0.907	69%	0.685	S	S	*	*			trans	-69	146.5	174.9	-69.9	160.5	-61.3	0	0	110.7	R548	Q546-R548 PolarHBondContact O-N 2.84Å; Q546-R548 VanDerWaalsContact O-N 3.16Å
547	I	35.7	Very low	42.7	Very low	173 Å²	173	134.1 Å²	134.1	89%	0.887	67%	0.672	S	S	*	*			trans	-81.7	94.9	174.8	-59.3	175	0	0	0	107.8
548	R	43.1	Very low	44.5	Very low	154 Å²	154	132.8 Å²	132.8	58%	0.581	66%	0.662	S	S	*	*			trans	-70.5	130.5	176.2	-155.8	170.7	174.6	95	-3.3	108.9	Q546 Q552 D556	Q546-R548 PolarHBondContact O-N 2.84Å; Q546-R548 VanDerWaalsContact O-N 3.16Å; R548-Q552 HydrophobicContact CG-CB 4.01Å; R548-Q552 HydrophobicContact CG-CG 3.71Å; R548-Q552 VanDerWaalsContact NE-CG 3.31Å; R548-D556 IonicContact CZ-OD2 3.51Å; R548-D556 IonicContact NE-OD2 2.64Å; R548-D556 PolarHBondContact NE-OD2 2.7Å; R548-D556 IonicContact NH2-OD1 3.28Å; R548-D556 PolarHBondContact NH2-OD1 3.4Å; R548-D556 IonicContact NH2-OD2 3.35Å; R548-D556 PolarHBondContact NH2-OD2 3.46Å
549	S	50.8	Low	46.9	Very low	77 Å²	77	130.2 Å²	130.2	54%	0.538	64%	0.643	S	S	.	*			trans	-57.1	147.9	-175.6	176.3	0	0	0	0	112.4	F551 Q552 L553	S549-F551 PolarHBondContact O-N 2.99Å; S549-F551 PolarHBondContact OG-N 3.49Å; S549-Q552 WeakPolarHBondContact O-CB 3.3Å; S549-Q552 PolarHBondContact O-N 3.44Å; S549-L553 PolarHBondContact O-N 3.45Å
550	R	48.4	Very low	48.7	Very low	216 Å²	216	131 Å²	131	82%	0.815	64%	0.637	S	S	*	*	H	α-helix	trans	-60.7	-29.4	177.1	-161.2	-179.6	-164.1	167.5	4.7	112.4	L553 N554	R550-L553 PolarHBondContact O-N 2.95Å; R550-N554 PolarHBondContact O-N 3.46Å; R550-N554 VanDerWaalsContact O-N 3.13Å
551	F	52.1	Low	50.2	Low	148 Å²	148	126.3 Å²	126.3	65%	0.649	62%	0.618	S	S	*	*	H	α-helix	trans	-63.6	-49.4	171.5	-179.8	-100.3	0	0	0	111.1	S549 L553 N554 L555	S549-F551 PolarHBondContact O-N 2.99Å; S549-F551 PolarHBondContact OG-N 3.49Å; F551-L553 VanDerWaalsContact C-N 3.28Å; F551-L553 PolarHBondContact O-N 2.9Å; F551-N554 PolarHBondContact O-N 3.09Å; F551-N554 VanDerWaalsContact O-N 3.11Å; F551-L555 HydrophobicContact CE1-CD2 4.43Å; F551-L555 PolarHBondContact O-N 2.91Å
552	Q	52.2	Low	51.5	Low	62 Å²	62	121.1 Å²	121.1	29%	0.29	60%	0.596	S	S	.	*	H	α-helix	trans	-60.1	-37.7	175.8	-170.7	67.3	53.2	0	0	111.7	R548 S549 N554 L555 D556	R548-Q552 HydrophobicContact CG-CB 4.01Å; R548-Q552 HydrophobicContact CG-CG 3.71Å; R548-Q552 VanDerWaalsContact NE-CG 3.31Å; S549-Q552 WeakPolarHBondContact O-CB 3.3Å; S549-Q552 PolarHBondContact O-N 3.44Å; Q552-N554 VanDerWaalsContact C-N 3.31Å; Q552-N554 PolarHBondContact O-N 2.84Å; Q552-L555 PolarHBondContact O-N 2.96Å; Q552-D556 PolarHBondContact NE2-OD1 2.71Å; Q552-D556 VanDerWaalsContact O-CB 3.29Å; Q552-D556 WeakPolarHBondContact O-CB 3.25Å; Q552-D556 PolarHBondContact O-N 3.27Å
553	L	57.1	Low	53.3	Low	93 Å²	93	121.8 Å²	121.8	49%	0.487	59%	0.585	S	S	.	*	H	α-helix	trans	-70.9	-24.3	178.4	-142.8	159.4	0	0	0	113	S549 R550 F551 K557	S549-L553 PolarHBondContact O-N 3.45Å; R550-L553 PolarHBondContact O-N 2.95Å; F551-L553 VanDerWaalsContact C-N 3.28Å; F551-L553 PolarHBondContact O-N 2.9Å; L553-K557 WeakPolarHBondContact O-CG 3.28Å
554	N	57	Low	55	Low	101 Å²	101	119.6 Å²	119.6	54%	0.54	58%	0.577	S	S	.	*	H	α-helix	trans	-78.7	-41.5	166.5	-82.1	-13.5	0	0	0	111.6	R550 F551 Q552 K557 T558	R550-N554 PolarHBondContact O-N 3.46Å; R550-N554 VanDerWaalsContact O-N 3.13Å; F551-N554 PolarHBondContact O-N 3.09Å; F551-N554 VanDerWaalsContact O-N 3.11Å; Q552-N554 VanDerWaalsContact C-N 3.31Å; Q552-N554 PolarHBondContact O-N 2.84Å; N554-K557 WeakPolarHBondContact O-CB 3.33Å; N554-K557 PolarHBondContact O-N 3.07Å; N554-T558 PolarHBondContact O-N 3Å; N554-T558 PolarHBondContact O-OG1 3.41Å
555	L	61.3	Low	56.2	Low	67 Å²	67	116.7 Å²	116.7	35%	0.351	57%	0.567	S	S	.	*	H	α-helix	trans	-62.6	-44.9	177.9	-178.3	59.5	0	0	0	111.8	F551 Q552 K557 T558 I559	F551-L555 HydrophobicContact CE1-CD2 4.43Å; F551-L555 PolarHBondContact O-N 2.91Å; Q552-L555 PolarHBondContact O-N 2.96Å; L555-K557 PolarHBondContact O-N 3.47Å; L555-T558 PolarHBondContact O-N 3.02Å; L555-T558 VanDerWaalsContact O-N 3.15Å; L555-I559 HydrophobicContact CD1-CD1 4.25Å; L555-I559 HydrophobicContact CG-CD1 4Å; L555-I559 WeakPolarHBondContact O-CB 3.45Å; L555-I559 VanDerWaalsContact O-CG1 3.28Å; L555-I559 WeakPolarHBondContact O-CG1 3.49Å; L555-I559 PolarHBondContact O-N 2.89Å
556	D	65.5	Low	57.4	Low	47 Å²	47	111.1 Å²	111.1	25%	0.251	56%	0.555	S	S	.	*	H	α-helix	trans	-57.5	-38.5	174.7	-66.2	-20.3	0	0	0	110.3	R548 Q552 I559 E560	R548-D556 IonicContact CZ-OD2 3.51Å; R548-D556 IonicContact NE-OD2 2.64Å; R548-D556 PolarHBondContact NE-OD2 2.7Å; R548-D556 IonicContact NH2-OD1 3.28Å; R548-D556 PolarHBondContact NH2-OD1 3.4Å; R548-D556 IonicContact NH2-OD2 3.35Å; R548-D556 PolarHBondContact NH2-OD2 3.46Å; Q552-D556 PolarHBondContact NE2-OD1 2.71Å; Q552-D556 VanDerWaalsContact O-CB 3.29Å; Q552-D556 WeakPolarHBondContact O-CB 3.25Å; Q552-D556 PolarHBondContact O-N 3.27Å; D556-I559 PolarHBondContact O-N 3.12Å; D556-E560 PolarHBondContact O-N 3.44Å
557	K	70.6	Confident	58.1	Low	125 Å²	125	104.7 Å²	104.7	54%	0.543	54%	0.541	S	S	.	.	H	α-helix	trans	-71.9	-37.9	173.8	-82.5	-175.5	172.1	-171.5	0	114.6	L553 N554 L555 I559 E560 S561	L553-K557 WeakPolarHBondContact O-CG 3.28Å; N554-K557 WeakPolarHBondContact O-CB 3.33Å; N554-K557 PolarHBondContact O-N 3.07Å; L555-K557 PolarHBondContact O-N 3.47Å; K557-I559 VanDerWaalsContact C-N 3.26Å; K557-E560 PolarHBondContact O-N 2.93Å; K557-S561 PolarHBondContact O-N 2.93Å
558	T	69.8	Low	59.2	Low	83 Å²	83	101.7 Å²	101.7	51%	0.509	53%	0.525	S	S	.	.	H	α-helix	trans	-63.2	-39.7	172.5	-60	0	0	0	0	109.7	N554 L555 S561 C562	N554-T558 PolarHBondContact O-N 3Å; N554-T558 PolarHBondContact O-OG1 3.41Å; L555-T558 PolarHBondContact O-N 3.02Å; L555-T558 VanDerWaalsContact O-N 3.15Å; T558-S561 WeakPolarHBondContact O-CB 3.25Å; T558-S561 PolarHBondContact O-N 2.83Å; T558-C562 PolarHBondContact O-N 3.23Å; T558-C562 PolarHBondContact O-SG 3.22Å
559	I	75.2	Confident	59.2	Low	72 Å²	72	100.7 Å²	100.7	37%	0.369	53%	0.532	S	S	.	.	H	α-helix	trans	-64.8	-41.5	174.1	-68.5	164.7	0	0	0	111.3	L555 D556 K557 C562 K563	L555-I559 HydrophobicContact CD1-CD1 4.25Å; L555-I559 HydrophobicContact CG-CD1 4Å; L555-I559 WeakPolarHBondContact O-CB 3.45Å; L555-I559 VanDerWaalsContact O-CG1 3.28Å; L555-I559 WeakPolarHBondContact O-CG1 3.49Å; L555-I559 PolarHBondContact O-N 2.89Å; D556-I559 PolarHBondContact O-N 3.12Å; K557-I559 VanDerWaalsContact C-N 3.26Å; I559-C562 PolarHBondContact O-N 3.28Å; I559-K563 HydrophobicContact CG2-CD 4.13Å; I559-K563 HydrophobicContact CG2-CG 4.48Å; I559-K563 WeakPolarHBondContact O-CB 3.39Å; I559-K563 VanDerWaalsContact O-CG 3.29Å; I559-K563 WeakPolarHBondContact O-CG 2.99Å; I559-K563 PolarHBondContact O-N 3.32Å
560	E	70.7	Confident	58.7	Low	131 Å²	131	105.4 Å²	105.4	61%	0.612	55%	0.545	S	S	*	.	H	α-helix	trans	-59.1	-44.9	170.4	-77	-174.8	125.2	0	0	112	D556 K557 K563 A564	D556-E560 PolarHBondContact O-N 3.44Å; K557-E560 PolarHBondContact O-N 2.93Å; E560-K563 PolarHBondContact O-N 3.36Å; E560-A564 WeakPolarHBondContact O-CB 3.41Å; E560-A564 PolarHBondContact O-N 2.89Å
561	S	63.2	Low	58	Low	60 Å²	60	103 Å²	103	42%	0.42	55%	0.547	S	S	.	.	H	α-helix	trans	-60.6	-47.8	176.6	-168	0	0	0	0	111.5	K557 T558 K563 A564 Q565	K557-S561 PolarHBondContact O-N 2.93Å; T558-S561 WeakPolarHBondContact O-CB 3.25Å; T558-S561 PolarHBondContact O-N 2.83Å; S561-K563 PolarHBondContact O-N 3.17Å; S561-A564 PolarHBondContact O-N 3.43Å; S561-Q565 WeakPolarHBondContact O-CB 3.1Å; S561-Q565 VanDerWaalsContact O-CG 3.25Å; S561-Q565 WeakPolarHBondContact O-CG 3.46Å; S561-Q565 PolarHBondContact O-N 3.39Å; S561-Q565 PolarHBondContact O-OE1 3.04Å; S561-Q565 PolarHBondContact OG-OE1 2.93Å
562	C	54.1	Low	57.1	Low	59 Å²	59	100.3 Å²	100.3	40%	0.399	55%	0.546	S	S	.	.	H	α-helix	trans	-63.3	-41	178	-67.5	0	0	0	0	112.1	T558 I559 Q565 L566	T558-C562 PolarHBondContact O-N 3.23Å; T558-C562 PolarHBondContact O-SG 3.22Å; I559-C562 PolarHBondContact O-N 3.28Å; C562-Q565 PolarHBondContact O-N 3.25Å; C562-L566 WeakPolarHBondContact O-CB 3.21Å; C562-L566 VanDerWaalsContact O-CG 3.27Å; C562-L566 WeakPolarHBondContact O-CG 3.31Å; C562-L566 PolarHBondContact O-N 2.96Å
563	K	65.2	Low	56.4	Low	121 Å²	121	107 Å²	107	53%	0.526	58%	0.577	S	S	.	*	H	α-helix	trans	-61.3	-45.1	174.1	-75.5	175.8	177.3	-174.9	0	111.7	I559 E560 S561 Q565 L566 G567 I568	I559-K563 HydrophobicContact CG2-CD 4.13Å; I559-K563 HydrophobicContact CG2-CG 4.48Å; I559-K563 WeakPolarHBondContact O-CB 3.39Å; I559-K563 VanDerWaalsContact O-CG 3.29Å; I559-K563 WeakPolarHBondContact O-CG 2.99Å; I559-K563 PolarHBondContact O-N 3.32Å; E560-K563 PolarHBondContact O-N 3.36Å; S561-K563 PolarHBondContact O-N 3.17Å; K563-Q565 VanDerWaalsContact C-N 3.33Å; K563-Q565 PolarHBondContact O-N 2.91Å; K563-L566 PolarHBondContact O-N 3.46Å; K563-G567 PolarHBondContact O-N 3.1Å; K563-I568 PolarHBondContact O-N 3.38Å
564	A	66.8	Low	55.2	Low	74 Å²	74	109.6 Å²	109.6	61%	0.612	59%	0.592	S	S	*	*	H	α-helix	trans	-65.4	-33.3	176.6	0	0	0	0	0	113.2	E560 S561	E560-A564 WeakPolarHBondContact O-CB 3.41Å; E560-A564 PolarHBondContact O-N 2.89Å; S561-A564 PolarHBondContact O-N 3.43Å
565	Q	55.9	Low	53.9	Low	148 Å²	148	111.6 Å²	111.6	69%	0.692	61%	0.607	S	S	*	*	H	α-helix	trans	-78.3	-23.5	176.4	-71.1	170.9	-88.7	0	0	113.4	S561 C562 K563	S561-Q565 WeakPolarHBondContact O-CB 3.1Å; S561-Q565 VanDerWaalsContact O-CG 3.25Å; S561-Q565 WeakPolarHBondContact O-CG 3.46Å; S561-Q565 PolarHBondContact O-N 3.39Å; S561-Q565 PolarHBondContact O-OE1 3.04Å; S561-Q565 PolarHBondContact OG-OE1 2.93Å; C562-Q565 PolarHBondContact O-N 3.25Å; K563-Q565 VanDerWaalsContact C-N 3.33Å; K563-Q565 PolarHBondContact O-N 2.91Å
566	L	59.8	Low	52.3	Low	129 Å²	129	118.5 Å²	118.5	68%	0.675	63%	0.63	S	S	*	*	H	α-helix	trans	-93.6	-8.1	175.1	-66.7	171.6	0	0	0	113.4	C562 K563 I568	C562-L566 WeakPolarHBondContact O-CB 3.21Å; C562-L566 VanDerWaalsContact O-CG 3.27Å; C562-L566 WeakPolarHBondContact O-CG 3.31Å; C562-L566 PolarHBondContact O-N 2.96Å; K563-L566 PolarHBondContact O-N 3.46Å; L566-I568 VanDerWaalsContact C-N 3.3Å; L566-I568 HydrophobicContact CB-CD1 4.16Å; L566-I568 HydrophobicContact CB-CG1 4.09Å; L566-I568 PolarHBondContact O-N 3.03Å
567	G	46.5	Very low	50.6	Low	59 Å²	59	122.3 Å²	122.3	61%	0.608	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	71.4	19	176.9	0	0	0	0	0	114.9	K563 N569	K563-G567 PolarHBondContact O-N 3.1Å; G567-N569 PolarHBondContact O-N 2.94Å
568	I	58.2	Low	48.6	Very low	110 Å²	110	121 Å²	121	56%	0.564	67%	0.668	S	S	*	*			trans	-95.4	89.7	-175.9	-48.1	176.8	0	0	0	109.4	K563 L566	K563-I568 PolarHBondContact O-N 3.38Å; L566-I568 VanDerWaalsContact C-N 3.3Å; L566-I568 HydrophobicContact CB-CD1 4.16Å; L566-I568 HydrophobicContact CB-CG1 4.09Å; L566-I568 PolarHBondContact O-N 3.03Å
569	N	42.8	Very low	46.7	Very low	133 Å²	133	123.9 Å²	123.9	71%	0.711	69%	0.685	S	S	*	*			trans	-99.5	133.1	173.1	-73.8	32	0	0	0	110.2	G567	G567-N569 PolarHBondContact O-N 2.94Å
570	E	40.8	Very low	44.6	Very low	175 Å²	175	128 Å²	128	82%	0.818	70%	0.703	S	S	*	*			trans	63.1	104.3	172.7	-59	-174.9	165.2	0	0	117.4
571	I	32.9	Very low	42.6	Very low	166 Å²	166	129.8 Å²	129.8	85%	0.851	71%	0.711	S	S	*	*			trans	-120.9	118.3	136.1	-57.4	176.4	0	0	0	104.8
572	S	33.7	Very low	41	Very low	91 Å²	91	132.5 Å²	132.5	64%	0.636	73%	0.73	S	S	*	*			trans	-84.4	127.4	-173.9	-56.4	0	0	0	0	111.9	D574	S572-D574 PolarHBondContact O-N 3.11Å
573	E	38.2	Very low	39.9	Very low	202 Å²	202	136.7 Å²	136.7	94%	0.944	75%	0.748	S	S	*	*			trans	-77.3	81.8	169.8	-67.8	-176.7	123.9	0	0	110.1
574	D	31.4	Very low	38.3	Very low	149 Å²	149	136.7 Å²	136.7	80%	0.797	76%	0.764	S	S	*	*			trans	-141.4	45.5	-176.2	-124.7	-20.8	0	0	0	114.3	S572	S572-D574 PolarHBondContact O-N 3.11Å
575	V	29.5	Very low	36.7	Very low	143 Å²	143	142.2 Å²	142.2	87%	0.867	78%	0.777	S	S	*	*			trans	-139.5	125.5	154.5	-179	0	0	0	0	109.4
576	Y	28.2	Very low	35.6	Very low	211 Å²	211	141.6 Å²	141.6	83%	0.827	78%	0.778	S	S	*	*			trans	-122.2	143.6	171.9	-138.2	-107.5	0	0	0	109.7
577	T	30.2	Very low	34.6	Very low	127 Å²	127	140.5 Å²	140.5	78%	0.779	78%	0.781	S	S	*	*			trans	58.4	89.9	165.2	45.7	0	0	0	0	120
578	A	27.7	Very low	34.1	Very low	99 Å²	99	143.8 Å²	143.8	82%	0.818	78%	0.781	S	S	*	*			trans	-174.9	140.4	146	0	0	0	0	0	107.2
579	V	30.7	Very low	32.9	Very low	142 Å²	142	145.6 Å²	145.6	86%	0.861	78%	0.784	S	S	*	*			cis	-135.6	165.4	4.6	-178.9	0	0	0	0	108.3
580	E	30	Very low	32.5	Very low	159 Å²	159	144 Å²	144	74%	0.743	78%	0.784	S	S	*	*			trans	-80	164.1	175.4	-54.4	-179.4	131.3	0	0	114.3
581	H	29.5	Very low	31.8	Very low	168 Å²	168	142.5 Å²	142.5	78%	0.778	78%	0.782	S	S	*	*			trans	52.3	116	156.6	-64.1	-65.3	0	0	0	121.1
582	S	29.9	Very low	31.5	Very low	118 Å²	118	139.4 Å²	139.4	83%	0.825	78%	0.775	S	S	*	*				-162.8	144.3	123.1	-163.8	0	0	0	0	111.4
583	D	30.6	Very low	31.4	Very low	147 Å²	147	139.7 Å²	139.7	79%	0.786	78%	0.776	S	S	*	*			trans	-86.3	155.4	175.2	-44.8	-91.9	0	0	0	112.6
584	S	30.5	Very low	30.9	Very low	121 Å²	121	136.4 Å²	136.4	85%	0.846	77%	0.766	S	S	*	*			trans	-168.1	152.2	143.6	61.6	0	0	0	0	110.9
585	E	34.7	Very low	30.9	Very low	189 Å²	189	134.6 Å²	134.6	88%	0.883	77%	0.765	S	S	*	*			trans	-113.3	172.1	-163.9	-55.8	172.4	102.9	0	0	114.5
586	D	32.5	Very low	31.1	Very low	136 Å²	136	137 Å²	137	73%	0.727	77%	0.766	S	S	*	*			trans	82.8	165.8	139.4	-160.5	40	0	0	0	121.4
587	S	38.5	Very low	31	Very low	105 Å²	105	137.8 Å²	137.8	73%	0.734	77%	0.769	S	S	*	*			trans	79.4	131.1	172.6	-65.4	0	0	0	0	118.5
588	E	36.2	Very low	30.7	Very low	129 Å²	129	138.5 Å²	138.5	60%	0.603	77%	0.767	S	S	*	*			cis	179.9	149.7	-40.1	-100.5	-97	93	0	0	107.5
589	K	32.8	Very low	30.7	Very low	147 Å²	147	139 Å²	139	64%	0.639	77%	0.765	S	S	*	*			trans	27.7	122.5	150.5	-65.7	-174.2	-174.8	73.7	0	121.4
590	S	33.5	Very low	30.7	Very low	99 Å²	99	139.4 Å²	139.4	69%	0.692	76%	0.762	S	S	*	*				84.2	161.3	99.3	-54.8	0	0	0	0	114.1
591	D	26.6	Very low	30.6	Very low	145 Å²	145	139.2 Å²	139.2	78%	0.775	77%	0.766	S	S	*	*			cis	-134	162.3	7.7	-98.7	-57.2	0	0	0	108.9
592	S	27.4	Very low	30.7	Very low	101 Å²	101	139.7 Å²	139.7	71%	0.706	77%	0.768	S	S	*	*				53.9	128.8	69	-144	0	0	0	0	113.2
593	S	31.8	Very low	30.9	Very low	96 Å²	96	142.7 Å²	142.7	67%	0.671	77%	0.769	S	S	*	*			cis	-150.9	-153	-3.2	-158.6	0	0	0	0	106.7
594	D	25.8	Very low	30.6	Very low	134 Å²	134	145.2 Å²	145.2	72%	0.717	77%	0.773	S	S	*	*			cis	-163.2	-179.9	4.3	-146.9	93.6	0	0	0	111
595	S	32.4	Very low	30.4	Very low	111 Å²	111	144.1 Å²	144.1	78%	0.776	77%	0.766	S	S	*	*			trans	74.3	136.6	156.3	72.3	0	0	0	0	121.5
596	E	33.5	Very low	30.1	Very low	192 Å²	192	143.8 Å²	143.8	90%	0.897	76%	0.761	S	S	*	*			trans	-99.7	147.4	173.5	-50.1	176.8	139.6	0	0	111.3
597	Y	25.3	Very low	29.6	Very low	228 Å²	228	144.5 Å²	144.5	89%	0.894	77%	0.765	S	S	*	*			trans	-155.9	162.1	140	-152.1	-109.7	0	0	0	113.4
598	I	25.6	Very low	28.8	Very low	143 Å²	143	148.1 Å²	148.1	73%	0.733	77%	0.77	S	S	*	*			trans	-100.3	137	-177.2	-69.6	171.5	0	0	0	110.4
599	S	27.7	Very low	29.1	Very low	110 Å²	110	146.7 Å²	146.7	77%	0.769	77%	0.772	S	S	*	*				173.9	142.9	121.6	-157.5	0	0	0	0	112.8
600	D	30.8	Very low	28.9	Very low	150 Å²	150	148.1 Å²	148.1	80%	0.802	78%	0.781	S	S	*	*			trans	-66.5	155	149.9	-83.5	-84.9	0	0	0	110.4
601	D	27.6	Very low	28.6	Very low	154 Å²	154	149.6 Å²	149.6	82%	0.824	78%	0.781	S	S	*	*			trans	-162	-179.5	137.1	-139.6	-77.8	0	0	0	112
602	E	31.3	Very low	28.8	Very low	178 Å²	178	148 Å²	148	83%	0.832	78%	0.777	S	S	*	*			trans	-85.1	172	-151.6	-72.5	-160.7	87.5	0	0	119.5
603	Q	34.3	Very low	29.1	Very low	182 Å²	182	151.5 Å²	151.5	85%	0.85	78%	0.783	S	S	*	*			trans	-69.9	143.5	179.4	-51.7	168.8	-2.8	0	0	114.5
604	K	24.6	Very low	29.3	Very low	200 Å²	200	151.9 Å²	151.9	87%	0.87	78%	0.777	S	S	*	*			trans	-162.8	145.3	142.3	-130.5	167.4	-174.6	163.6	0	119.2
605	S	25.4	Very low	29.6	Very low	98 Å²	98	152.6 Å²	152.6	69%	0.685	77%	0.774	S	S	*	*			trans	53.6	91.5	146.4	53.8	0	0	0	0	122.1
606	K	27.8	Very low	29.8	Very low	181 Å²	181	154.8 Å²	154.8	79%	0.787	77%	0.772	S	S	*	*				34.5	123.1	105	-173.8	-172	176.5	-179.4	0	119.4
607	N	21.8	Very low	29.4	Very low	152 Å²	152	148.5 Å²	148.5	81%	0.813	76%	0.758	S	S	*	*				-170.6	164.4	123.5	-93.7	-19.3	0	0	0	113.3
608	E	22.6	Very low	29.6	Very low	180 Å²	180	143.6 Å²	143.6	84%	0.841	76%	0.756	S	S	*	*			trans	-95.5	-170.8	-179.2	-68.9	-172.3	117.4	0	0	111.4
609	P	43.1	Very low	29.9	Very low	99 Å²	99	144.7 Å²	144.7	64%	0.643	76%	0.758	S	S	*	*			cis	-141.4	176.3	5.6	42.2	-22	0	0	0	118.8
610	E	28.2	Very low	30	Very low	177 Å²	177	146.1 Å²	146.1	83%	0.827	75%	0.754	S	S	*	*			trans	48.1	160.6	141.8	-65.8	169.6	145.2	0	0	121
611	D	28.3	Very low	29.9	Very low	130 Å²	130	145.6 Å²	145.6	70%	0.695	75%	0.751	S	S	*	*			cis	-159.5	171.8	18	-155.4	-5.9	0	0	0	114
612	T	30.3	Very low	30.1	Very low	113 Å²	113	145.5 Å²	145.5	69%	0.693	74%	0.744	S	S	*	*			trans	64.7	150.7	161.1	62.4	0	0	0	0	119.7
613	E	32.9	Very low	29.8	Very low	174 Å²	174	143.9 Å²	143.9	81%	0.813	74%	0.736	S	S	*	*			cis	-168.9	171.9	-14.3	-104.5	-162.4	126.7	0	0	105.7
614	D	37	Very low	30.6	Very low	104 Å²	104	139.6 Å²	139.6	56%	0.556	72%	0.724	S	S	*	*			cis	-169	178.1	-30.5	179.4	31.7	0	0	0	107.2
615	K	32.3	Very low	30.8	Very low	149 Å²	149	135.8 Å²	135.8	65%	0.648	72%	0.722	S	S	*	*			trans	80.3	145.7	158.4	-55.1	-154.1	175.4	-51.1	0	120.7
616	E	35.3	Very low	31.2	Very low	157 Å²	157	135 Å²	135	73%	0.734	72%	0.722	S	S	*	*			cis	-171.8	166.3	-29.7	-114.7	178.4	90.4	0	0	106.7
617	G	26	Very low	31.1	Very low	60 Å²	60	132.4 Å²	132.4	62%	0.619	72%	0.721	S	S	*	*			cis	164.9	140.6	-6.5	0	0	0	0	0	113.2
618	C	28.9	Very low	31.2	Very low	125 Å²	125	134 Å²	134	85%	0.845	72%	0.721	S	S	*	*			trans	69.3	165.5	159.1	-69	0	0	0	0	119.6
619	Q	32	Very low	31.6	Very low	166 Å²	166	134.8 Å²	134.8	78%	0.776	72%	0.722	S	S	*	*			cis	-150.7	146.9	11.1	-148.6	173.2	-10.3	0	0	116.6
620	M	30.7	Very low	30.8	Very low	139 Å²	139	139.4 Å²	139.4	69%	0.685	73%	0.731	S	S	*	*			trans	7.7	149	153.2	-61.7	173.9	57.1	0	0	124.8
621	D	27.6	Very low	31.1	Very low	139 Å²	139	136.3 Å²	136.3	74%	0.743	73%	0.727	S	S	*	*				-160.5	166.6	97.6	-129.4	-30.8	0	0	0	117.4
622	K	31.4	Very low	30.9	Very low	153 Å²	153	139.7 Å²	139.7	67%	0.665	74%	0.735	S	S	*	*			trans	-58.8	178.3	-170.3	-76	167.6	156.8	-133.9	0	120
623	E	24.8	Very low	31.7	Very low	143 Å²	143	139.6 Å²	139.6	67%	0.668	74%	0.736	S	S	*	*			cis	-166.3	-170	-2.6	-117.9	-175.4	73.8	0	0	108.6
624	P	51.6	Low	31.5	Very low	93 Å²	93	138.2 Å²	138.2	60%	0.604	74%	0.74	S	S	*	*			cis	-137.7	172.8	-42.5	38.1	-20.9	0	0	0	116.7
625	S	29.6	Very low	31.4	Very low	119 Å²	119	140.6 Å²	140.6	83%	0.832	75%	0.753	S	S	*	*			trans	71.9	147.6	145.1	-74.7	0	0	0	0	122.4
626	A	33	Very low	31.3	Very low	83 Å²	83	138.4 Å²	138.4	69%	0.686	75%	0.754	S	S	*	*			cis	-168.2	175.9	-14	0	0	0	0	0	112.2
627	V	26	Very low	30.7	Very low	125 Å²	125	137 Å²	137	76%	0.758	76%	0.756	S	S	*	*			trans	85.5	139.7	170.3	176.5	0	0	0	0	115.4
628	K	23.9	Very low	30.4	Very low	186 Å²	186	141.9 Å²	141.9	81%	0.809	76%	0.762	S	S	*	*			cis	-166.5	149.8	-23.8	-96	173.4	-154.1	163.8	0	105.6
629	K	31.6	Very low	30.2	Very low	197 Å²	197	141.7 Å²	141.7	86%	0.857	75%	0.752	S	S	*	*			cis	-149.4	-95.7	-19.4	-168.5	-179.1	-178.1	-178.2	0	111.2
630	K	25.3	Very low	29.8	Very low	195 Å²	195	141.3 Å²	141.3	85%	0.848	75%	0.748	S	S	*	*			trans	174.7	-179.4	-172.6	-111.4	173.7	-178.6	177.2	0	109
631	P	34.5	Very low	29.6	Very low	112 Å²	112	141.7 Å²	141.7	73%	0.727	75%	0.748	S	S	*	*			cis	-152.1	173.8	27.8	45.1	-24.3	0	0	0	121.4
632	K	25.1	Very low	29.6	Very low	202 Å²	202	142.6 Å²	142.6	88%	0.878	75%	0.748	S	S	*	*			trans	64.2	155	144.6	-93.4	-161	170.7	-169.2	0	123.8
633	P	46.4	Very low	29.5	Very low	110 Å²	110	141.6 Å²	141.6	71%	0.714	75%	0.749	S	S	*	*			trans	-118.5	160.5	178.3	42.6	-31.6	0	0	0	115.8
634	T	27.7	Very low	29.5	Very low	146 Å²	146	143 Å²	143	90%	0.896	75%	0.753	S	S	*	*			trans	-173	161.7	155.7	18.6	0	0	0	0	110.6
635	N	35.5	Very low	28.2	Very low	153 Å²	153	143.1 Å²	143.1	82%	0.818	76%	0.756	S	S	*	*			trans	-154.9	120.8	155.5	-166.2	-4.6	0	0	0	108.7
636	P	31.5	Very low	27.8	Very low	104 Å²	104	143.9 Å²	143.9	68%	0.675	76%	0.756	S	S	*	*				-151.1	149.5	117.3	38.6	-22	0	0	0	116.7
637	V	20.7	Very low	27.3	Very low	126 Å²	126	144.6 Å²	144.6	76%	0.764	76%	0.756	S	S	*	*			trans	52.2	109.4	131.7	-178.4	0	0	0	0	119.9
638	E	21.1	Very low	28.3	Very low	163 Å²	163	144.4 Å²	144.4	76%	0.762	76%	0.757	S	S	*	*				-178.1	142	109.9	-93.1	-146.8	132.1	0	0	114.9
639	I	23.8	Very low	28.2	Very low	122 Å²	122	139.5 Å²	139.5	63%	0.626	75%	0.751	S	S	*	*			trans	64.8	117.5	140.8	-66.9	176.4	0	0	0	122.1
640	K	24.9	Very low	27.9	Very low	158 Å²	158	135.1 Å²	135.1	69%	0.687	75%	0.745	S	S	*	*			trans	46.8	144.2	141.2	-63.6	179.4	158.5	-78.4	0	120.3
641	E	26.7	Very low	27.8	Very low	147 Å²	147	133 Å²	133	69%	0.687	74%	0.738	S	S	*	*			cis	-168	178.7	-9	-114.4	152.6	-170.4	0	0	105.3
642	E	27	Very low	27.2	Very low	158 Å²	158	135.6 Å²	135.6	74%	0.738	74%	0.738	S	S	*	*			cis	-140.9	172.4	14.7	-89.7	-154.1	132.5	0	0	107.7
643	L	29.4	Very low	27	Very low	132 Å²	132	130.3 Å²	130.3	69%	0.691	73%	0.732	S	S	*	*			cis	-157.5	175.7	-3.6	-125.9	-179.7	0	0	0	110.9
644	K	23.4	Very low	26.1	Very low	172 Å²	172	131.7 Å²	131.7	75%	0.748	73%	0.733	S	S	*	*			trans	53.4	84.8	146.2	-149.7	158.2	-169.4	172.9	0	121.1
645	S	24.6	Very low	26.2	Very low	96 Å²	96	130.7 Å²	130.7	67%	0.671	73%	0.729	S	S	*	*				71.4	110.9	116.1	-56.8	0	0	0	0	122.5
646	T	22.4	Very low	25.6	Very low	135 Å²	135	125.9 Å²	125.9	83%	0.828	72%	0.716	S	S	*	*				59.5	135.6	118.8	-14.5	0	0	0	0	122.4
647	S	21.4	Very low	25.4	Very low	98 Å²	98	125.7 Å²	125.7	69%	0.685	72%	0.723	S	S	*	*			trans	-81.7	-168.8	159.8	59.5	0	0	0	0	111.6
648	P	47.8	Very low	25.6	Very low	120 Å²	120	125.4 Å²	125.4	78%	0.779	72%	0.722	S	S	*	*			cis	-130.1	-162.9	-16.2	36	-15.8	0	0	0	113.1
649	A	22.7	Very low	25.7	Very low	83 Å²	83	126 Å²	126	69%	0.686	72%	0.722	S	S	*	*			trans	111.6	146.9	140	0	0	0	0	0	122
650	S	23.9	Very low	25.8	Very low	105 Å²	105	126.7 Å²	126.7	73%	0.734	73%	0.726	S	S	*	*			trans	60.1	128.7	143	60.6	0	0	0	0	124.3
651	E	22.7	Very low	25.9	Very low	150 Å²	150	128.2 Å²	128.2	70%	0.701	73%	0.733	S	S	*	*			trans	61	134.8	133.3	-68.3	-143.6	95.9	0	0	124.4
652	K	22.3	Very low	25.7	Very low	167 Å²	167	125.7 Å²	125.7	73%	0.726	74%	0.737	S	S	*	*			trans	68.5	137.5	137.9	-75.5	177.7	177.8	121.2	0	122.6
653	A	22	Very low	25.6	Very low	91 Å²	91	123.2 Å²	123.2	75%	0.752	74%	0.738	S	S	*	*			trans	70.3	112.2	138.4	0	0	0	0	0	121.4
654	D	26	Very low	25.6	Very low	139 Å²	139	122.8 Å²	122.8	74%	0.743	74%	0.743	S	S	*	*			trans	-11	135.7	134.3	179.8	55.2	0	0	0	118.6	G656	D654-G656 PolarHBondContact OD1-N 3.35Å; D654-G656 PolarHBondContact OD2-N 3.42Å
655	P	30.7	Very low	25.7	Very low	125 Å²	125	122.9 Å²	122.9	81%	0.812	75%	0.746	S	S	*	*			trans	-114.4	97.7	152	35.1	-21.9	0	0	0	111.7
656	G	23	Very low	26.5	Very low	52 Å²	52	122.6 Å²	122.6	54%	0.536	74%	0.742	S	S	.	*			trans	-81.4	-169.1	179.2	0	0	0	0	0	117	D654	D654-G656 PolarHBondContact OD1-N 3.35Å; D654-G656 PolarHBondContact OD2-N 3.42Å
657	A	26.1	Very low	26.5	Very low	100 Å²	100	123.1 Å²	123.1	83%	0.826	74%	0.735	S	S	*	*			trans	75.8	157.4	-179.3	0	0	0	0	0	114.9
658	V	24.9	Very low	26.7	Very low	121 Å²	121	126.7 Å²	126.7	73%	0.733	74%	0.738	S	S	*	*			cis	-146.6	137.2	28	-179.9	0	0	0	0	113.6
659	K	25	Very low	25.5	Very low	176 Å²	176	127.1 Å²	127.1	77%	0.765	73%	0.733	S	S	*	*			trans	82	133.4	152.6	-87.3	173	-176.9	178.3	0	124.5
660	D	25.4	Very low	25.5	Very low	135 Å²	135	131.1 Å²	131.1	72%	0.722	74%	0.736	S	S	*	*			trans	64.7	136.9	140.4	-60	-34.9	0	0	0	119.7
661	K	25.6	Very low	25.5	Very low	191 Å²	191	131.1 Å²	131.1	83%	0.83	74%	0.736	S	S	*	*			cis	-154.3	139.4	19.8	-148.4	177.2	-175.3	-179.3	0	114.3
662	A	24.1	Very low	25.5	Very low	93 Å²	93	131.1 Å²	131.1	77%	0.769	74%	0.736	S	S	*	*			trans	43.6	119.8	148.8	0	0	0	0	0	121.9
663	S	23.4	Very low	25.6	Very low	107 Å²	107	131.6 Å²	131.6	75%	0.748	74%	0.738	S	S	*	*			trans	-73	163.8	141.7	-158	0	0	0	0	109.5
664	P	30	Very low	25.6	Very low	123 Å²	123	131.9 Å²	131.9	80%	0.799	74%	0.74	S	S	*	*				-150.5	163.2	84.4	43.9	-26.9	0	0	0	116.9
665	E	25.7	Very low	25.7	Very low	173 Å²	173	134.9 Å²	134.9	81%	0.808	75%	0.747	S	S	*	*			trans	-74.8	-170.6	153.5	-120.2	-176.6	-179.5	0	0	110.1
666	P	42	Very low	25.5	Very low	91 Å²	91	135 Å²	135	59%	0.591	75%	0.748	S	S	*	*			cis	-136.6	-162.8	-11	26.9	-1.1	0	0	0	113.9
667	E	22.7	Very low	25.4	Very low	145 Å²	145	137.2 Å²	137.2	68%	0.678	76%	0.755	S	S	*	*				104.8	144.7	122.1	-115	179.5	-141.4	0	0	123
668	K	25.1	Very low	25.9	Very low	173 Å²	173	138 Å²	138	75%	0.752	75%	0.751	S	S	*	*			trans	75	133.1	161.8	-64	-174.3	174	79.6	0	119.3
669	D	22.9	Very low	25.8	Very low	129 Å²	129	140.1 Å²	140.1	69%	0.69	75%	0.753	S	S	*	*			cis	147	166.7	-20.9	-177.6	24.3	0	0	0	109
670	F	22.9	Very low	26.3	Very low	168 Å²	168	137 Å²	137	74%	0.737	75%	0.751	S	S	*	*			trans	74.5	119.5	-177.5	-64.7	-88.1	0	0	0	115.4
671	S	22.1	Very low	26.2	Very low	105 Å²	105	137.7 Å²	137.7	73%	0.734	75%	0.753	S	S	*	*				75.4	146.6	73.3	-67	0	0	0	0	113.5
672	E	24.1	Very low	26.1	Very low	150 Å²	150	136.9 Å²	136.9	70%	0.701	75%	0.749	S	S	*	*			cis	-150.7	144.9	18.2	-139.5	-162	133.3	0	0	113.6
673	K	23.4	Very low	26.1	Very low	177 Å²	177	137.5 Å²	137.5	77%	0.77	74%	0.74	S	S	*	*			trans	14	127	134	-172.7	-164	-163.9	176.7	0	120.5
674	A	23.6	Very low	26.2	Very low	97 Å²	97	139.1 Å²	139.1	80%	0.802	73%	0.733	S	S	*	*			trans	-179.9	149.8	130.8	0	0	0	0	0	115.9
675	K	26.3	Very low	26.1	Very low	201 Å²	201	140 Å²	140	87%	0.874	73%	0.73	S	S	*	*			trans	-107.9	153	152	-101.8	-176.9	176.3	177.2	0	107.7
676	P	26.5	Very low	26	Very low	129 Å²	129	140.7 Å²	140.7	84%	0.838	73%	0.731	S	S	*	*				-147.7	-179.5	112.3	34.6	-16.1	0	0	0	116.5
677	S	21.4	Very low	25.2	Very low	97 Å²	97	139.4 Å²	139.4	68%	0.678	73%	0.734	S	S	*	*			trans	-82.8	-172.4	175.8	-130.6	0	0	0	0	111.7
678	P	37.2	Very low	25.4	Very low	116 Å²	116	140.5 Å²	140.5	75%	0.753	74%	0.736	S	S	*	*			cis	-144.3	-170.1	17.8	41.6	-18.5	0	0	0	119.2
679	H	22.6	Very low	25.3	Very low	166 Å²	166	137.6 Å²	137.6	77%	0.769	73%	0.729	S	S	*	*			trans	-52	-174.4	168.2	-52.5	-77.2	0	0	0	116
680	P	34.3	Very low	25.4	Very low	111 Å²	111	139.1 Å²	139.1	72%	0.721	73%	0.732	S	S	*	*			cis	-151.8	-159.8	20.8	34.6	-6	0	0	0	119.3
681	I	24.6	Very low	25.6	Very low	149 Å²	149	136.2 Å²	136.2	76%	0.764	73%	0.728	S	S	*	*			trans	86	125.2	163.8	-49.3	179.5	0	0	0	114.2
682	K	24.1	Very low	25.7	Very low	175 Å²	175	137.7 Å²	137.7	76%	0.761	73%	0.728	S	S	*	*			cis	78.8	161.1	45.3	-76.9	-175	167.5	-172.7	0	114.2
683	D	22.9	Very low	25.7	Very low	106 Å²	106	135.5 Å²	135.5	57%	0.567	73%	0.729	S	S	*	*			cis	-136.7	-154.6	-11.6	-122.8	-13.6	0	0	0	110.7
684	K	25.5	Very low	27.3	Very low	140 Å²	140	132.4 Å²	132.4	61%	0.609	73%	0.727	S	S	*	*			trans	-158.5	-176.7	-139.6	75.5	-30.7	-160.2	163.2	0	115.9
685	L	27.3	Very low	27.3	Very low	141 Å²	141	133.8 Å²	133.8	74%	0.738	73%	0.726	S	S	*	*			trans	83.2	164.1	-178.5	-53.3	162.7	0	0	0	113.4
686	K	24.5	Very low	27.2	Very low	189 Å²	189	130.4 Å²	130.4	82%	0.822	72%	0.722	S	S	*	*			cis	-158.5	157.3	1.9	-140	164.6	178.8	-176.8	0	107
687	G	25.1	Very low	26.9	Very low	64 Å²	64	132 Å²	132	66%	0.66	72%	0.718	S	S	*	*			cis	149.3	172.9	-3.6	0	0	0	0	0	110.8
688	K	26.4	Very low	27.2	Very low	167 Å²	167	134.9 Å²	134.9	73%	0.726	73%	0.725	S	S	*	*			trans	66.6	156.9	168.7	-90	175.3	148.4	-73.4	0	117.1
689	D	24.3	Very low	26.5	Very low	113 Å²	113	132.4 Å²	132.4	60%	0.604	72%	0.721	S	S	*	*			cis	-138.8	-167.1	13.5	-134.3	-53.5	0	0	0	114.8
690	E	24.5	Very low	26.7	Very low	161 Å²	161	132.1 Å²	132.1	75%	0.752	72%	0.724	S	S	*	*			trans	-76.1	-170.9	-170.8	-71.8	-170.9	108.4	0	0	116.8
691	T	27.4	Very low	26.1	Very low	106 Å²	106	133.7 Å²	133.7	65%	0.65	73%	0.726	S	S	*	*			cis	-179.7	152.2	-46.4	-65.9	0	0	0	0	107
692	D	23.8	Very low	26.3	Very low	136 Å²	136	131 Å²	131	73%	0.727	72%	0.721	S	S	*	*			trans	64.8	111.2	161.7	-99	-47.4	0	0	0	124.1
693	S	23.4	Very low	26.2	Very low	104 Å²	104	129.2 Å²	129.2	73%	0.727	72%	0.72	S	S	*	*				79.6	154.2	120.3	-78.3	0	0	0	0	124.9
694	P	57.6	Low	26.7	Very low	113 Å²	113	129.5 Å²	129.5	73%	0.734	73%	0.73	S	S	*	*			trans	-128	179.1	-161.9	43.4	-27.6	0	0	0	115.3
695	T	24.2	Very low	26.7	Very low	125 Å²	125	131.4 Å²	131.4	77%	0.767	74%	0.741	S	S	*	*			trans	-178.2	124.4	150.6	-90.2	0	0	0	0	114.4
696	V	23.1	Very low	26.8	Very low	131 Å²	131	130.2 Å²	130.2	79%	0.794	75%	0.745	S	S	*	*			trans	53.2	173.9	170.2	-57.9	0	0	0	0	117.5
697	H	21.3	Very low	26.9	Very low	163 Å²	163	129.3 Å²	129.3	76%	0.755	74%	0.743	S	S	*	*			cis	-146.9	-179.7	8.5	-161.3	-98.4	0	0	0	113.3
698	L	27.2	Very low	27.1	Very low	156 Å²	156	134.9 Å²	134.9	82%	0.817	76%	0.757	S	S	*	*			trans	-77.1	147.4	-179	-60.9	161.2	0	0	0	115
699	G	23.2	Very low	27	Very low	65 Å²	65	132.2 Å²	132.2	67%	0.67	75%	0.754	S	S	*	*			trans	-174.6	137.5	165	0	0	0	0	0	108.5
700	L	25.1	Very low	27.2	Very low	159 Å²	159	133.9 Å²	133.9	83%	0.832	76%	0.762	S	S	*	*			cis	83.1	122.2	41.9	-62.9	171.7	0	0	0	113.9
701	D	21.7	Very low	27.2	Very low	144 Å²	144	132.1 Å²	132.1	77%	0.77	76%	0.757	S	S	*	*			cis	-166.9	167.8	-17.4	-139.3	-19.2	0	0	0	114.2
702	S	29.6	Very low	27.3	Very low	94 Å²	94	134.3 Å²	134.3	66%	0.657	76%	0.764	S	S	*	*			trans	81.5	161.9	145.6	-144.3	0	0	0	0	124.7
703	D	23.2	Very low	27.5	Very low	137 Å²	137	131.1 Å²	131.1	73%	0.733	76%	0.764	S	S	*	*			trans	76.1	119.7	166	-61.7	-1.2	0	0	0	117.3
704	S	31.3	Very low	27.7	Very low	112 Å²	112	134.4 Å²	134.4	78%	0.783	77%	0.768	S	S	*	*				73.7	133.4	66.9	-58.8	0	0	0	0	111.1
705	E	26.6	Very low	26.3	Very low	179 Å²	179	135.2 Å²	135.2	84%	0.836	77%	0.766	S	S	*	*			cis	-147.3	159.5	26.6	58.8	-157.6	102.4	0	0	111.1
706	S	28.6	Very low	26.8	Very low	117 Å²	117	137.5 Å²	137.5	82%	0.818	77%	0.767	S	S	*	*				174.6	164.8	81.1	37	0	0	0	0	111.3
707	E	28.3	Very low	26.8	Very low	169 Å²	169	137.1 Å²	137.1	79%	0.79	77%	0.77	S	S	*	*			trans	-94.8	156.1	-169.1	-54.8	171.5	108.8	0	0	115.4
708	L	27.9	Very low	27.2	Very low	182 Å²	182	132.7 Å²	132.7	95%	0.953	77%	0.768	S	S	*	*			trans	-146.4	147.6	131.3	-79.9	-170.5	0	0	0	109.8
709	V	25.4	Very low	27.3	Very low	111 Å²	111	136.2 Å²	136.2	67%	0.673	77%	0.771	S	S	*	*			trans	-136.7	-175.2	-168.6	-170.3	0	0	0	0	109
710	I	27.6	Very low	27.4	Very low	147 Å²	147	140.6 Å²	140.6	75%	0.754	77%	0.774	S	S	*	*			trans	81.8	133.3	163.6	-58.8	169.6	0	0	0	114.9
711	D	25.6	Very low	27.6	Very low	124 Å²	124	136 Å²	136	66%	0.663	77%	0.765	S	S	*	*			cis	-167.5	165.7	-16.7	-112.3	-20.5	0	0	0	114.5
712	L	28.9	Very low	28.2	Very low	153 Å²	153	139.3 Å²	139.3	80%	0.801	77%	0.766	S	S	*	*			trans	51.8	154.8	140.4	-63.1	166.9	0	0	0	125.7
713	G	27.3	Very low	28.2	Very low	69 Å²	69	142.2 Å²	142.2	71%	0.711	77%	0.767	S	S	*	*			trans	107.1	116.6	165	0	0	0	0	0	115
714	E	27.3	Very low	28.4	Very low	173 Å²	173	142.4 Å²	142.4	81%	0.808	77%	0.768	S	S	*	*			cis	68.4	128	16.8	-142.9	148.6	-142.1	0	0	112.7
715	D	29.4	Very low	28.4	Very low	129 Å²	129	145.7 Å²	145.7	69%	0.69	77%	0.768	S	S	*	*			cis	-152.5	-164.4	38.1	-155.8	-16.2	0	0	0	114.7
716	H	33.6	Very low	28.5	Very low	174 Å²	174	144.1 Å²	144.1	81%	0.806	76%	0.759	S	S	*	*			trans	-71	171.6	-167.4	-64.5	-21.5	0	0	0	117.2
717	S	23.8	Very low	28.3	Very low	123 Å²	123	145.4 Å²	145.4	86%	0.86	75%	0.752	S	S	*	*			cis	-165.1	168.1	35.1	55.2	0	0	0	0	112.9
718	G	28.9	Very low	29.5	Very low	69 Å²	69	142.6 Å²	142.6	71%	0.711	75%	0.748	S	S	*	*			cis	167.2	155.8	-10.5	0	0	0	0	0	114.4
719	R	29.1	Very low	29.2	Very low	231 Å²	231	143.6 Å²	143.6	87%	0.872	75%	0.745	S	S	*	*			trans	62.7	155.3	168.5	-80.3	-171.6	131.8	151.6	2.6	119.9
720	E	26.4	Very low	29.2	Very low	156 Å²	156	146.9 Å²	146.9	73%	0.729	75%	0.753	S	S	*	*			cis	-170.3	163.5	-31.5	-114.7	-168.1	-66	0	0	107.4
721	G	30	Very low	29.6	Very low	62 Å²	62	145.2 Å²	145.2	64%	0.639	75%	0.752	S	S	*	*			cis	171.6	122.9	-9.5	0	0	0	0	0	115.6
722	R	32.8	Very low	29.4	Very low	214 Å²	214	144.6 Å²	144.6	81%	0.808	76%	0.757	S	S	*	*			trans	73.8	125.2	148.2	-75.3	176.8	164.2	-179.9	-0.2	124.9
723	K	30	Very low	29.9	Very low	155 Å²	155	143.4 Å²	143.4	67%	0.674	76%	0.759	S	S	*	*				92.7	112.6	125.2	-74.1	175.2	179.9	-176.8	0	124.9
724	N	28.3	Very low	29.9	Very low	142 Å²	142	149.3 Å²	149.3	76%	0.759	77%	0.765	S	S	*	*				74.1	106.7	118.1	-64.1	6.3	0	0	0	126
725	K	31	Very low	29.9	Very low	180 Å²	180	149 Å²	149	78%	0.783	76%	0.763	S	S	*	*				93.3	116.6	104.6	-166.4	178.7	179.4	-178.2	0	123.6
726	K	28.9	Very low	29.6	Very low	146 Å²	146	148.6 Å²	148.6	64%	0.635	76%	0.761	S	S	*	*			trans	84.1	114.5	148.4	-93.8	-167.5	176.4	-85.8	0	123.4
727	E	24.6	Very low	29.3	Very low	145 Å²	145	146.2 Å²	146.2	68%	0.678	76%	0.759	S	S	*	*				59.1	162.5	121	-76.7	175.7	-172.7	0	0	123.6
728	P	51.8	Low	29.4	Very low	109 Å²	109	147.3 Å²	147.3	71%	0.708	76%	0.76	S	S	*	*			cis	-142.2	-174.5	-31.2	39	-20.2	0	0	0	116.1
729	K	23.2	Very low	29.4	Very low	203 Å²	203	147.2 Å²	147.2	88%	0.883	76%	0.759	S	S	*	*			trans	112.3	153.9	157.8	-76.7	-169	169.6	-172.2	0	121.3
730	E	24.3	Very low	29.3	Very low	180 Å²	180	146.6 Å²	146.6	84%	0.841	76%	0.763	S	S	*	*			trans	-82.8	-177.8	-173.4	-60.7	171.9	88.6	0	0	114.3
731	P	36	Very low	29.4	Very low	112 Å²	112	145.6 Å²	145.6	73%	0.727	77%	0.767	S	S	*	*			cis	-141.1	-171.2	10.6	40.9	-18.6	0	0	0	118.4
732	S	21.9	Very low	30.3	Very low	111 Å²	111	148.1 Å²	148.1	78%	0.776	77%	0.772	S	S	*	*			trans	7.7	161.5	149.1	-55.1	0	0	0	0	122.7
733	P	40.3	Very low	30.8	Very low	129 Å²	129	143.2 Å²	143.2	84%	0.838	77%	0.768	S	S	*	*			cis	-142.2	-126.4	28.1	42.6	-19.3	0	0	0	117.4
734	K	25.7	Very low	30.6	Very low	192 Å²	192	140.3 Å²	140.3	84%	0.835	77%	0.768	S	S	*	*			trans	-125.2	171	-157.1	-56.5	177.8	-179.1	177.1	0	115.3
735	Q	26.8	Very low	30.5	Very low	167 Å²	167	139.4 Å²	139.4	78%	0.78	77%	0.767	S	S	*	*			trans	114.9	124.6	144.5	-75	-175.6	-100.8	0	0	121.4
736	D	25	Very low	30.3	Very low	121 Å²	121	136.2 Å²	136.2	65%	0.647	76%	0.763	S	S	*	*			trans	67.7	122.3	132.4	-61.7	-37.2	0	0	0	126.9
737	V	26.2	Very low	30.2	Very low	124 Å²	124	136 Å²	136	75%	0.752	77%	0.773	S	S	*	*				71.1	108.3	126	178.5	0	0	0	0	121.4
738	V	27.1	Very low	30.1	Very low	145 Å²	145	132 Å²	132	88%	0.879	77%	0.772	S	S	*	*			trans	56.6	116.4	141.4	179.6	0	0	0	0	120.4
739	G	27.5	Very low	28.9	Very low	68 Å²	68	131.8 Å²	131.8	70%	0.701	77%	0.772	S	S	*	*				130.1	125.9	118.7	0	0	0	0	0	119.8
740	K	27	Very low	28.9	Very low	218 Å²	218	130.4 Å²	130.4	95%	0.948	77%	0.769	S	S	*	*			trans	71.2	165.1	161.7	-79.6	-180	175.8	176.2	0	119.2
741	T	28.4	Very low	29.1	Very low	135 Å²	135	127 Å²	127	83%	0.828	77%	0.765	S	S	*	*			trans	-105.6	168.2	-158.8	22.5	0	0	0	0	113.2
742	P	49.9	Very low	30.2	Very low	114 Å²	114	127 Å²	127	74%	0.74	77%	0.765	S	S	*	*			trans	-99.1	-170.6	-154.3	44	-40.8	0	0	0	113.1
743	P	42.8	Very low	31.6	Very low	112 Å²	112	127.2 Å²	127.2	73%	0.727	76%	0.764	S	S	*	*				-146.1	154.1	80.8	40	-22.8	0	0	0	117.4
744	S	26	Very low	30.8	Very low	94 Å²	94	128.9 Å²	128.9	66%	0.657	76%	0.76	S	S	*	*			trans	60.8	129.7	133.4	-63.8	0	0	0	0	124.4
745	T	26.1	Very low	30.9	Very low	122 Å²	122	125.8 Å²	125.8	75%	0.748	76%	0.757	S	S	*	*			trans	71.5	148.5	130.2	60.6	0	0	0	0	119.9
746	T	26.3	Very low	31.8	Very low	114 Å²	114	123.1 Å²	123.1	70%	0.699	76%	0.755	S	S	*	*			cis	-169.9	154.1	-10	21.3	0	0	0	0	109.8
747	V	26.3	Very low	31.9	Very low	140 Å²	140	122.8 Å²	122.8	85%	0.848	76%	0.757	S	S	*	*			trans	62.7	138.7	152	171.5	0	0	0	0	116.1
748	G	24.5	Very low	32	Very low	62 Å²	62	124 Å²	124	64%	0.639	76%	0.758	S	S	*	*			cis	156.5	-171.8	-0.8	0	0	0	0	0	109.7
749	S	25	Very low	31.8	Very low	104 Å²	104	122.6 Å²	122.6	73%	0.727	75%	0.75	S	S	*	*			trans	66.5	120	161.6	-63.8	0	0	0	0	120.7
750	H	23.3	Very low	31.8	Very low	175 Å²	175	130 Å²	130	81%	0.81	76%	0.757	S	S	*	*			trans	65.6	124.9	131.8	-73.8	-85.2	0	0	0	123.5
751	S	29.6	Very low	31.7	Very low	107 Å²	107	124.5 Å²	124.5	75%	0.748	75%	0.746	S	S	*	*				105.2	151.8	129.7	-69.4	0	0	0	0	121.8
752	P	59.3	Low	31.7	Very low	114 Å²	114	123.6 Å²	123.6	74%	0.74	75%	0.745	S	S	*	*			trans	-98.8	-164.6	-173.7	45.9	-38.8	0	0	0	110.7
753	P	50.2	Low	30.6	Very low	114 Å²	114	122 Å²	122	74%	0.74	74%	0.742	S	S	*	*			cis	-132.3	-156.9	12.1	33.2	-5.3	0	0	0	112.7
754	E	24.3	Very low	29.9	Very low	165 Å²	165	125 Å²	125	77%	0.771	75%	0.746	S	S	*	*			cis	-145.5	173.2	16.3	-70.7	-166.8	153.7	0	0	113.9
755	T	28.3	Very low	29.8	Very low	126 Å²	126	126.1 Å²	126.1	77%	0.773	75%	0.749	S	S	*	*			trans	-128.7	147.4	144.1	60.7	0	0	0	0	108
756	P	45.4	Very low	29.8	Very low	111 Å²	111	126 Å²	126	72%	0.721	75%	0.753	S	S	*	*				-147.7	179.6	109.5	34.1	-17.5	0	0	0	114.5
757	V	26.3	Very low	30	Very low	115 Å²	115	125 Å²	125	70%	0.697	76%	0.756	S	S	*	*			cis	-175.5	-174.4	-42.5	161.9	0	0	0	0	104.6
758	L	28.1	Very low	30.2	Very low	148 Å²	148	123.2 Å²	123.2	78%	0.775	76%	0.757	S	S	*	*			trans	78.8	138.2	163.4	-59.7	-174.7	0	0	0	118.2
759	T	24	Very low	30.3	Very low	117 Å²	117	123.7 Å²	123.7	72%	0.718	76%	0.761	S	S	*	*			cis	-163.4	157	-24.9	-0.6	0	0	0	0	113.6
760	R	26.8	Very low	30.4	Very low	224 Å²	224	123.2 Å²	123.2	85%	0.845	76%	0.764	S	S	*	*			trans	65.6	103.7	131.6	-164.5	176.8	-175.6	177.5	0.8	122.3
761	S	24.6	Very low	30.6	Very low	101 Å²	101	121 Å²	121	71%	0.706	76%	0.763	S	S	*	*				73.8	139.9	129.5	-56.1	0	0	0	0	124.3
762	S	28	Very low	30.7	Very low	117 Å²	117	120.1 Å²	120.1	82%	0.818	76%	0.762	S	S	*	*			trans	97.2	138.9	135.9	-70.8	0	0	0	0	122.3
763	A	26.5	Very low	29.2	Very low	80 Å²	80	121.2 Å²	121.2	66%	0.661	77%	0.766	S	S	*	*			trans	84.5	133.6	146.5	0	0	0	0	0	121.8
764	Q	28.7	Very low	28.2	Very low	174 Å²	174	122.1 Å²	122.1	81%	0.813	77%	0.77	S	S	*	*			trans	49.9	113.5	131.6	-68.6	169.6	-44.1	0	0	119.3
765	T	23.5	Very low	28.5	Very low	118 Å²	118	119.4 Å²	119.4	72%	0.724	77%	0.769	S	S	*	*				87.8	123.7	55.3	60.5	0	0	0	0	116.1
766	S	27	Very low	28.5	Very low	120 Å²	120	119.4 Å²	119.4	84%	0.839	77%	0.769	S	S	*	*			trans	61.2	173.5	153.9	74.3	0	0	0	0	117.4
767	A	30.9	Very low	27.7	Very low	92 Å²	92	119.2 Å²	119.2	76%	0.76	77%	0.771	S	S	*	*			cis	-142.4	-179.1	-1.3	0	0	0	0	0	108.8
768	A	29.3	Very low	27.7	Very low	104 Å²	104	118.5 Å²	118.5	86%	0.86	77%	0.771	S	S	*	*			cis	-147.3	-157.3	2.4	0	0	0	0	0	107.6
769	G	27	Very low	27.7	Very low	72 Å²	72	117.9 Å²	117.9	74%	0.742	77%	0.773	S	S	*	*			cis	167.7	154.2	-5.1	0	0	0	0	0	109.8
770	A	27.5	Very low	27.9	Very low	94 Å²	94	117.9 Å²	117.9	78%	0.777	77%	0.773	S	S	*	*			cis	-160.7	-161	-7.8	0	0	0	0	0	106.7
771	T	27.1	Very low	28	Very low	129 Å²	129	112.3 Å²	112.3	79%	0.791	76%	0.764	S	S	*	*			cis	-162.8	149.3	11.5	-27.9	0	0	0	0	110.3
772	A	32.2	Very low	28.2	Very low	88 Å²	88	113 Å²	113	73%	0.727	76%	0.764	S	S	*	*			trans	66.1	154.1	156.1	0	0	0	0	0	118.6
773	T	28.4	Very low	28	Very low	136 Å²	136	113.1 Å²	113.1	83%	0.834	76%	0.76	S	S	*	*			cis	-146.7	172.9	-0.1	-19.6	0	0	0	0	111.3
774	T	28.3	Very low	28	Very low	134 Å²	134	113.4 Å²	113.4	82%	0.822	76%	0.762	S	S	*	*			trans	-102.4	146.7	-172.1	50.4	0	0	0	0	115.6
775	S	30.8	Very low	28.3	Very low	107 Å²	107	111.1 Å²	111.1	75%	0.748	76%	0.762	S	S	*	*			trans	-162.5	117.4	152.1	58.3	0	0	0	0	116
776	T	27.1	Very low	28.7	Very low	126 Å²	126	109.5 Å²	109.5	77%	0.773	76%	0.761	S	S	*	*			trans	53.1	130.4	138.1	57.8	0	0	0	0	124.4
777	S	28.8	Very low	29.5	Very low	108 Å²	108	109.3 Å²	109.3	76%	0.755	76%	0.757	S	S	*	*			trans	73.3	129.2	141.7	-59.9	0	0	0	0	119.2
778	S	27.1	Very low	29.1	Very low	100 Å²	100	109.6 Å²	109.6	70%	0.699	76%	0.759	S	S	*	*			cis	100.8	98	29.4	-67.7	0	0	0	0	114.3
779	T	28.4	Very low	28.9	Very low	134 Å²	134	108.3 Å²	108.3	82%	0.822	75%	0.749	S	S	*	*			trans	64.5	174.1	142.8	36.7	0	0	0	0	117.9
780	V	28.9	Very low	28.7	Very low	118 Å²	118	112.2 Å²	112.2	72%	0.715	76%	0.758	S	S	*	*			cis	-149	162.2	7.7	94.1	0	0	0	0	107.6
781	T	29	Very low	28.6	Very low	107 Å²	107	111.3 Å²	111.3	66%	0.656	76%	0.758	S	S	*	*			cis	-143.3	146.4	1.4	21.9	0	0	0	0	106.3
782	V	26.9	Very low	28.4	Very low	115 Å²	115	110.8 Å²	110.8	70%	0.697	76%	0.76	S	S	*	*			cis	71.6	138.8	48.8	-177.5	0	0	0	0	110.3
783	T	25.3	Very low	28.6	Very low	120 Å²	120	112 Å²	112	74%	0.736	76%	0.76	S	S	*	*			cis	-145.8	152.2	33.1	-19.3	0	0	0	0	108
784	A	26.6	Very low	28.4	Very low	86 Å²	86	110.7 Å²	110.7	71%	0.711	75%	0.752	S	S	*	*			cis	61.8	154.7	41.2	0	0	0	0	0	114.2
785	P	34.8	Very low	28.2	Very low	125 Å²	125	111 Å²	111	81%	0.812	74%	0.742	S	S	*	*			cis	-131.4	-166.1	1.3	43.4	-25.9	0	0	0	114.8
786	A	32.2	Very low	27.9	Very low	84 Å²	84	111.3 Å²	111.3	69%	0.694	73%	0.73	S	S	*	*			trans	-101.2	-168.5	159	0	0	0	0	0	109
787	P	43.7	Very low	27.8	Very low	117 Å²	117	111.8 Å²	111.8	76%	0.76	72%	0.723	S	S	*	*			cis	-139	-157.5	1.6	44.6	-24.5	0	0	0	114.5
788	A	22.5	Very low	27.6	Very low	97 Å²	97	115.6 Å²	115.6	80%	0.802	72%	0.721	S	S	*	*			trans	67.6	167.1	163.2	0	0	0	0	0	117.4
789	A	24.9	Very low	27.9	Very low	78 Å²	78	113.1 Å²	113.1	65%	0.645	70%	0.702	S	S	*	*			cis	-165.6	168.4	-38.7	0	0	0	0	0	109.6
790	T	22.6	Very low	27.6	Very low	153 Å²	153	112 Å²	112	94%	0.939	69%	0.691	S	S	*	*			trans	67.2	167.2	170.2	77	0	0	0	0	117.4
791	G	24.8	Very low	27.7	Very low	76 Å²	76	113.5 Å²	113.5	78%	0.784	69%	0.694	S	S	*	*			trans	112.5	82.5	161.6	0	0	0	0	0	118.7
792	S	23.9	Very low	27.9	Very low	118 Å²	118	113.1 Å²	113.1	83%	0.825	69%	0.693	S	S	*	*			trans	-94	170.7	140.2	-61.7	0	0	0	0	108
793	P	35.3	Very low	27.8	Very low	112 Å²	112	114.8 Å²	114.8	73%	0.727	69%	0.691	S	S	*	*			cis	-143.9	-157	12.6	32.7	-6.4	0	0	0	115.3
794	V	23.9	Very low	27.8	Very low	109 Å²	109	116 Å²	116	66%	0.661	69%	0.688	S	S	*	*				100.2	123.8	129.6	126	0	0	0	0	123.3
795	K	25.5	Very low	27.6	Very low	142 Å²	142	118 Å²	118	62%	0.617	69%	0.692	S	S	*	*			trans	80	123.2	142.9	-73.5	173.2	-161.2	172.3	0	125.8
796	K	24.2	Very low	27.1	Very low	113 Å²	113	116 Å²	116	49%	0.491	69%	0.686	S	S	.	*			trans	32.8	126.8	139.7	39.7	-176.1	88.3	-167	0	121.1	P491 Q492	P491-K796 HydrophobicContact CB-CB 3.59Å; P491-K796 HydrophobicContact CB-CD 3.52Å; P491-K796 HydrophobicContact CB-CG 4.06Å; Q492-K796 HydrophobicContact CG-CB 4.01Å; Q492-K796 HydrophobicContact CG-CG 4.34Å
797	Q	23.9	Very low	27.3	Very low	135 Å²	135	117.7 Å²	117.7	63%	0.631	69%	0.69	S	S	*	*			cis	80.3	153.7	24.8	-122.1	-170.4	-6	0	0	115	S490	S490-Q797 WeakPolarHBondContact CA-O 3.45Å; S490-Q797 PolarHBondContact N-O 3.09Å
798	R	25.5	Very low	26.3	Very low	188 Å²	188	116.5 Å²	116.5	71%	0.709	69%	0.69	S	S	*	*			cis	-139.3	-76.1	0.8	-64.8	159	51.3	-152.1	-2.6	117.3	S490	S490-R798 VanDerWaalsContact OG-CD 3.3Å; S490-R798 WeakPolarHBondContact OG-CD 3.5Å; S490-R798 VanDerWaalsContact OG-CG 3.23Å; S490-R798 WeakPolarHBondContact OG-CG 3.48Å; S490-R798 PolarHBondContact OG-N 3.27Å
799	P	33.9	Very low	26.4	Very low	49 Å²	49	118.7 Å²	118.7	32%	0.318	69%	0.693	S	S	.	*			trans	-128.4	-142.6	-141.9	45.5	-20.8	0	0	0	113.3	P488 F489	P488-P799 CarbonylContact C-O 3.53Å; P488-P799 WeakPolarHBondContact CA-O 3.16Å; F489-P799 PolarHBondContact N-O 3.46Å; F489-P799 WeakPolarHBondContact O-CD 3.44Å
800	L	22.3	Very low	26.4	Very low	110 Å²	110	122.6 Å²	122.6	58%	0.576	70%	0.698	S	S	*	*			cis	-124.4	162.3	31.8	-108.2	-178.4	0	0	0	113.3	P488	P488-L800 WeakPolarHBondContact O-CD1 3.35Å
801	L	30.7	Very low	26.5	Very low	150 Å²	150	127.2 Å²	127.2	79%	0.785	70%	0.698	S	S	*	*			trans	-79.7	147.7	157.6	-78.8	158.3	0	0	0	109.6
802	P	31.6	Very low	26.4	Very low	98 Å²	98	129.2 Å²	129.2	64%	0.636	70%	0.695	S	S	*	*				-132.9	169.9	96.4	13.4	8.7	0	0	0	112.5
803	K	25.2	Very low	26.4	Very low	151 Å²	151	129 Å²	129	66%	0.657	69%	0.688	S	S	*	*			cis	121.9	117.4	-0.8	-172.3	174.4	-170.2	-84.6	0	112.5
804	E	25.1	Very low	25.9	Very low	144 Å²	144	133.8 Å²	133.8	67%	0.673	69%	0.692	S	S	*	*			trans	67.8	165.9	161.2	-77.2	158.4	-157.6	0	0	117.7
805	T	23.8	Very low	26	Very low	129 Å²	129	135.3 Å²	135.3	79%	0.791	70%	0.697	S	S	*	*			cis	-146.4	163.3	22	-34.9	0	0	0	0	113.9
806	A	24.6	Very low	26	Very low	83 Å²	83	132 Å²	132	69%	0.686	69%	0.691	S	S	*	*			trans	-83.7	-160.1	161.1	0	0	0	0	0	110.8
807	P	34.6	Very low	26	Very low	120 Å²	120	131.1 Å²	131.1	78%	0.779	70%	0.699	S	S	*	*			cis	-155.5	-171.8	47.9	44.3	-21.5	0	0	0	118.7
808	A	23.5	Very low	26	Very low	92 Å²	92	130.6 Å²	130.6	76%	0.76	71%	0.705	S	S	*	*			trans	70.9	154.2	156	0	0	0	0	0	118.4
809	V	25.5	Very low	26	Very low	142 Å²	142	127.1 Å²	127.1	86%	0.861	71%	0.705	S	S	*	*			cis	-130.2	161.3	21.7	177	0	0	0	0	112.5
810	Q	24.1	Very low	25.5	Very low	161 Å²	161	132.5 Å²	132.5	75%	0.752	73%	0.726	S	S	*	*			trans	-105	159.1	-169.6	-52.4	160.6	-66.1	0	0	115.4
811	R	24.5	Very low	25.6	Very low	249 Å²	249	134 Å²	134	94%	0.94	73%	0.73	S	S	*	*			trans	-153.6	88.7	136.6	-76.3	-156.2	-179.4	141.7	2.8	114
812	V	23.6	Very low	25.4	Very low	118 Å²	118	134.2 Å²	134.2	72%	0.715	72%	0.724	S	S	*	*				20.7	133.7	114.7	172.1	0	0	0	0	116.9
813	V	23.7	Very low	25.1	Very low	113 Å²	113	135.5 Å²	135.5	69%	0.685	72%	0.722	S	S	*	*			cis	-165.3	139.2	-4.3	102.6	0	0	0	0	109.5
814	W	24.7	Very low	25	Very low	214 Å²	214	136.3 Å²	136.3	81%	0.811	73%	0.732	S	S	*	*				56.7	143.6	105.6	-69.3	48.6	0	0	0	117.4
815	N	25.2	Very low	25	Very low	141 Å²	141	134.6 Å²	134.6	75%	0.754	73%	0.731	S	S	*	*			cis	-142.5	149.7	49.9	-102.6	-25.7	0	0	0	112.3
816	S	25.5	Very low	25	Very low	73 Å²	73	137.5 Å²	137.5	51%	0.51	74%	0.736	S	S	.	*				72.4	143	68.6	-46.4	0	0	0	0	113.5
817	S	25.7	Very low	25	Very low	93 Å²	93	138.8 Å²	138.8	65%	0.65	74%	0.74	S	S	*	*			cis	-152.9	159.1	14.3	-110.5	0	0	0	0	109.7
818	T	23.7	Very low	25.4	Very low	124 Å²	124	138.2 Å²	138.2	76%	0.761	74%	0.736	S	S	*	*				55.7	144.2	63.7	89.2	0	0	0	0	113.6
819	V	24.8	Very low	25.3	Very low	116 Å²	116	138.9 Å²	138.9	70%	0.703	74%	0.735	S	S	*	*			cis	-167.5	-174	-2.3	106.8	0	0	0	0	109.8
820	Q	23.8	Very low	25.3	Very low	162 Å²	162	138.6 Å²	138.6	76%	0.757	73%	0.734	S	S	*	*			trans	94.3	154.8	148.2	-106	148.3	0.8	0	0	121.1
821	Q	23.8	Very low	25.3	Very low	142 Å²	142	135.6 Å²	135.6	66%	0.664	73%	0.731	S	S	*	*			cis	179.2	151.5	-44.9	-160.2	172.3	13.8	0	0	110.4
822	K	25.8	Very low	25.4	Very low	153 Å²	153	130.2 Å²	130.2	67%	0.665	73%	0.726	S	S	*	*			trans	63.3	167.2	152.4	-99.2	-175.4	173.8	-131.9	0	117
823	E	25.5	Very low	25.5	Very low	125 Å²	125	131.8 Å²	131.8	58%	0.584	73%	0.729	S	S	*	*			cis	-161	168.3	-22.4	-154.6	159.2	-142.3	0	0	108.2
824	I	23.5	Very low	25.6	Very low	168 Å²	168	131.6 Å²	131.6	86%	0.862	73%	0.728	S	S	*	*				170.6	159.4	129.2	-88.4	160.6	0	0	0	109.6
825	T	24.6	Very low	25.7	Very low	109 Å²	109	129.7 Å²	129.7	67%	0.669	73%	0.733	S	S	*	*			trans	-139.7	164.1	-152.4	-46.8	0	0	0	0	111.8
826	Q	25.1	Very low	25.7	Very low	190 Å²	190	128.6 Å²	128.6	89%	0.888	73%	0.731	S	S	*	*			trans	114.3	154	155.2	-58	-174.3	11.6	0	0	118
827	S	24.6	Very low	25.8	Very low	110 Å²	110	131.1 Å²	131.1	77%	0.769	74%	0.743	S	S	*	*			trans	-110.8	-164.1	-172.5	56.9	0	0	0	0	109.3
828	P	41.3	Very low	26	Very low	107 Å²	107	131.7 Å²	131.7	70%	0.695	75%	0.747	S	S	*	*			cis	-138.2	-156.3	2.1	43.3	-22.4	0	0	0	114.8
829	S	22.6	Very low	26.3	Very low	106 Å²	106	130.7 Å²	130.7	74%	0.741	74%	0.741	S	S	*	*			trans	78	166.5	172.5	-52.5	0	0	0	0	115.1
830	T	24.9	Very low	26.5	Very low	137 Å²	137	133.5 Å²	133.5	84%	0.84	75%	0.747	S	S	*	*			cis	-139.8	-154.9	9.1	-32.3	0	0	0	0	111.3
831	S	25	Very low	26.7	Very low	98 Å²	98	131 Å²	131	69%	0.685	75%	0.746	S	S	*	*			trans	-136.7	153.3	-169.6	-47	0	0	0	0	113.1
832	T	26.1	Very low	27	Very low	136 Å²	136	129.4 Å²	129.4	83%	0.834	75%	0.752	S	S	*	*			trans	64.4	162.4	158.3	18.6	0	0	0	0	116.8
833	I	25.9	Very low	27.9	Very low	151 Å²	151	127.8 Å²	127.8	77%	0.774	76%	0.756	S	S	*	*			cis	-143.3	176.9	16.6	-132	162.4	0	0	0	112.3
834	T	25.3	Very low	28.1	Very low	109 Å²	109	129.4 Å²	129.4	67%	0.669	77%	0.768	S	S	*	*			trans	-32.7	158.7	-176.2	57.5	0	0	0	0	122.6
835	L	26.4	Very low	28.4	Very low	174 Å²	174	126.7 Å²	126.7	91%	0.911	76%	0.759	S	S	*	*				-142.4	166.2	116.7	-113.4	171.4	0	0	0	111.4
836	V	26.3	Very low	28.6	Very low	118 Å²	118	127 Å²	127	72%	0.715	76%	0.762	S	S	*	*			trans	-112.5	161.8	-152.5	179.6	0	0	0	0	114.2
837	T	27.9	Very low	28.8	Very low	125 Å²	125	123.3 Å²	123.3	77%	0.767	76%	0.757	S	S	*	*			trans	-73.2	-173.9	177.6	40.1	0	0	0	0	115.5
838	S	29	Very low	29.1	Very low	105 Å²	105	124.2 Å²	124.2	73%	0.734	76%	0.763	S	S	*	*			trans	90	143.4	163.7	-87.8	0	0	0	0	118.1
839	T	30	Very low	28.5	Very low	103 Å²	103	122.2 Å²	122.2	63%	0.632	76%	0.762	S	S	*	*			cis	-167.6	152.1	-19.3	11.1	0	0	0	0	110.2
840	Q	29.6	Very low	29	Very low	176 Å²	176	122.5 Å²	122.5	82%	0.822	76%	0.764	S	S	*	*			trans	62.6	166.8	154	-68.2	173.6	86.5	0	0	116.4
841	S	27.7	Very low	29.4	Very low	108 Å²	108	124 Å²	124	76%	0.755	76%	0.763	S	S	*	*			cis	-158	158.8	-29.1	48	0	0	0	0	109.7
842	S	28.9	Very low	29.7	Very low	110 Å²	110	123.9 Å²	123.9	77%	0.769	76%	0.762	S	S	*	*			trans	-67.6	172	170.5	-49.6	0	0	0	0	112.2
843	P	46.1	Very low	29.9	Very low	118 Å²	118	124.6 Å²	124.6	77%	0.766	77%	0.766	S	S	*	*			cis	-151.5	160.5	24.9	44.2	-23	0	0	0	121.6
844	L	29.3	Very low	30.3	Very low	159 Å²	159	124.6 Å²	124.6	83%	0.832	77%	0.768	S	S	*	*			trans	64.5	160.9	136.5	-152.7	64.9	0	0	0	123.6
845	V	29.2	Very low	30.6	Very low	111 Å²	111	125.6 Å²	125.6	67%	0.673	77%	0.773	S	S	*	*			trans	70.3	95.7	163.4	-89.6	0	0	0	0	122.4
846	T	28.3	Very low	31	Very low	117 Å²	117	122.8 Å²	122.8	72%	0.718	77%	0.768	S	S	*	*				42.7	113.4	122.5	59	0	0	0	0	122.3
847	S	29.7	Very low	31.5	Very low	112 Å²	112	122 Å²	122	78%	0.783	77%	0.768	S	S	*	*			trans	40.9	124.3	131.3	64.6	0	0	0	0	121.8
848	S	30.6	Very low	31.9	Very low	129 Å²	129	123 Å²	123	90%	0.902	77%	0.774	S	S	*	*				-179.1	172.4	101.6	-164.3	0	0	0	0	111.5
849	G	29.1	Very low	32.4	Very low	65 Å²	65	125 Å²	125	67%	0.67	78%	0.776	S	S	*	*			trans	95.6	68.1	142.7	0	0	0	0	0	120.4
850	S	33	Very low	32.6	Very low	112 Å²	112	125 Å²	125	78%	0.783	79%	0.786	S	S	*	*			trans	30.4	117.4	135.4	-54	0	0	0	0	123.2
851	M	33.8	Very low	33.3	Very low	168 Å²	168	123.7 Å²	123.7	83%	0.828	79%	0.785	S	S	*	*				69.8	121.4	126.2	-60.9	-169.1	74.7	0	0	123.3
852	S	32.7	Very low	33.6	Very low	96 Å²	96	126.5 Å²	126.5	67%	0.671	79%	0.791	S	S	*	*			trans	67	110.4	132.8	-58.8	0	0	0	0	121.6
853	T	29.4	Very low	35.1	Very low	150 Å²	150	126.8 Å²	126.8	92%	0.92	79%	0.79	S	S	*	*				-155.3	175	119.1	-2	0	0	0	0	113.1
854	L	34	Very low	34.8	Very low	152 Å²	152	129.4 Å²	129.4	80%	0.796	80%	0.796	S	S	*	*			trans	-99.8	165.5	-156.6	-67.5	160.9	0	0	0	115
855	V	32.5	Very low	35.5	Very low	129 Å²	129	126.3 Å²	126.3	78%	0.782	79%	0.793	S	S	*	*			trans	50.9	127	151.9	-66.3	0	0	0	0	120.9
856	S	33.3	Very low	36.7	Very low	115 Å²	115	127.9 Å²	127.9	80%	0.804	80%	0.803	S	S	*	*				-178.3	148.6	94.6	-75.9	0	0	0	0	115
857	S	37.7	Very low	37.9	Very low	102 Å²	102	126 Å²	126	71%	0.713	80%	0.799	S	S	*	*			trans	-46.9	156.5	175.8	-36.2	0	0	0	0	118.1
858	V	35.2	Very low	39.5	Very low	147 Å²	147	123.8 Å²	123.8	89%	0.891	78%	0.784	S	S	*	*				-159.3	157.7	98.8	-89.8	0	0	0	0	111.2
859	N	40.6	Very low	41.2	Very low	145 Å²	145	121.4 Å²	121.4	78%	0.775	77%	0.772	S	S	*	*			trans	-99.1	156.5	-169	-56.3	0.7	0	0	0	113.5
860	A	33.7	Very low	42.9	Very low	104 Å²	104	124.1 Å²	124.1	86%	0.86	77%	0.771	S	S	*	*			trans	-155.8	121.3	138.9	0	0	0	0	0	109.7
861	D	45.6	Very low	44.9	Very low	148 Å²	148	122.3 Å²	122.3	79%	0.791	76%	0.755	S	S	*	*			trans	-85	150.5	178.9	-72.6	-72.9	0	0	0	112.9
862	L	33.4	Very low	46.9	Very low	167 Å²	167	117.1 Å²	117.1	87%	0.874	74%	0.739	S	S	*	*			trans	-149.1	125.3	147.9	-147.1	73.1	0	0	0	110.2
863	P	61.2	Low	49.1	Very low	117 Å²	117	115.4 Å²	115.4	76%	0.76	73%	0.73	S	S	*	*			trans	-85.7	145.4	-171.6	33.2	-35.5	0	0	0	113
864	I	38.6	Very low	51.6	Low	172 Å²	172	111.3 Å²	111.3	88%	0.882	70%	0.703	S	S	*	*			trans	-126.3	141.6	164.3	-63.3	-176.9	0	0	0	108.8
865	A	43.9	Very low	54	Low	94 Å²	94	108.9 Å²	108.9	78%	0.777	69%	0.69	S	S	*	*	P	Polyproline II helix	trans	-69.7	150.5	-159.7	0	0	0	0	0	115.6	A867	A865-A867 PolarHBondContact O-N 3.4Å
866	T	54.8	Low	56.5	Low	145 Å²	145	105.1 Å²	105.1	89%	0.89	67%	0.673	S	S	*	*	P	Polyproline II helix	trans	-59.6	118.3	168.5	-32.3	0	0	0	0	110.6
867	A	53.3	Low	59.2	Low	76 Å²	76	106 Å²	106	63%	0.628	66%	0.662	S	S	*	*	P	Polyproline II helix	trans	-68.3	149.5	168.2	0	0	0	0	0	110.6	A865	A865-A867 PolarHBondContact O-N 3.4Å
868	S	63.5	Low	61.6	Low	66 Å²	66	108 Å²	108	46%	0.462	65%	0.654	S	S	.	*	P	Polyproline II helix	trans	-67.8	151.6	179.6	67.6	0	0	0	0	112.2	D870 V871 A872	S868-D870 PolarHBondContact O-N 2.93Å; S868-V871 PolarHBondContact O-N 3.25Å; S868-V871 VanDerWaalsContact O-N 3.15Å; S868-A872 PolarHBondContact O-N 2.85Å
869	A	65.8	Low	64.1	Low	79 Å²	79	104.9 Å²	104.9	65%	0.653	64%	0.636	S	S	*	*	H	α-helix	trans	-58.4	-31.8	-176.6	0	0	0	0	0	113	V871 A872 A873	A869-V871 PolarHBondContact O-N 2.85Å; A869-A872 PolarHBondContact O-N 3.49Å; A869-A873 WeakPolarHBondContact O-CB 3.44Å; A869-A873 PolarHBondContact O-N 3.24Å
870	D	65.3	Low	66.5	Low	123 Å²	123	101.6 Å²	101.6	66%	0.658	63%	0.625	S	S	*	*	H	α-helix	trans	-64.4	-39.3	179.6	-47.6	-69.2	0	0	0	112.2	S868 A873 D874	S868-D870 PolarHBondContact O-N 2.93Å; D870-A873 PolarHBondContact O-N 3.42Å; D870-D874 PolarHBondContact O-N 3.31Å
871	V	75.7	Confident	69.4	Low	74 Å²	74	102.9 Å²	102.9	45%	0.448	61%	0.611	S	S	.	*	H	α-helix	trans	-66.7	-40.3	177	179	0	0	0	0	110.3	S868 A869 I875	S868-V871 PolarHBondContact O-N 3.25Å; S868-V871 VanDerWaalsContact O-N 3.15Å; A869-V871 PolarHBondContact O-N 2.85Å; V871-I875 HydrophobicContact CG1-CD1 3.91Å; V871-I875 WeakPolarHBondContact O-CB 3.27Å; V871-I875 WeakPolarHBondContact O-CD1 3.25Å; V871-I875 WeakPolarHBondContact O-CG1 3.47Å; V871-I875 PolarHBondContact O-N 3.34Å
872	A	75.1	Confident	71.6	Confident	59 Å²	59	100 Å²	100	49%	0.488	60%	0.595	S	S	.	*	H	α-helix	trans	-64.7	-39.1	174.1	0	0	0	0	0	112.2	S868 A869 I875 A876	S868-A872 PolarHBondContact O-N 2.85Å; A869-A872 PolarHBondContact O-N 3.49Å; A872-I875 PolarHBondContact O-N 3.34Å; A872-A876 WeakPolarHBondContact O-CB 3.35Å; A872-A876 PolarHBondContact O-N 2.91Å
873	A	77.8	Confident	74.5	Confident	59 Å²	59	101.1 Å²	101.1	49%	0.488	59%	0.587	S	S	.	*	H	α-helix	trans	-65.3	-44.5	177.3	0	0	0	0	0	112.3	A869 D870 A876 K877	A869-A873 WeakPolarHBondContact O-CB 3.44Å; A869-A873 PolarHBondContact O-N 3.24Å; D870-A873 PolarHBondContact O-N 3.42Å; A873-A876 PolarHBondContact O-N 2.77Å; A873-K877 WeakPolarHBondContact O-CB 3.29Å; A873-K877 PolarHBondContact O-N 2.88Å
874	D	82.9	Confident	76	Confident	65 Å²	65	104.7 Å²	104.7	35%	0.348	59%	0.585	S	S	.	*	H	α-helix	trans	-68.1	-38.5	175.4	-100.7	-16.9	0	0	0	111.9	D870 A876 K877 Y878	D870-D874 PolarHBondContact O-N 3.31Å; D874-A876 VanDerWaalsContact C-N 3.32Å; D874-A876 PolarHBondContact O-N 2.8Å; D874-K877 WeakPolarHBondContact O-CB 3.42Å; D874-K877 PolarHBondContact O-N 3.26Å; D874-K877 WeakPolarHBondContact OD1-CD 3.02Å; D874-K877 WeakPolarHBondContact OD1-CE 3.31Å; D874-K877 IonicContact OD1-NZ 2.83Å; D874-K877 PolarHBondContact OD1-NZ 2.65Å; D874-Y878 HydrophobicContact CB-CD2 4.35Å; D874-Y878 HydrophobicContact CB-CE2 4.22Å; D874-Y878 WeakPolarHBondContact O-CD2 3.45Å; D874-Y878 PolarHBondContact O-N 3.27Å
875	I	84.4	Confident	78.7	Confident	100 Å²	100	101.1 Å²	101.1	51%	0.513	57%	0.568	S	S	.	*	H	α-helix	trans	-58	-43.7	171.9	-72.1	166.9	0	0	0	111.1	V871 A872 K877 Y878 T879	V871-I875 HydrophobicContact CG1-CD1 3.91Å; V871-I875 WeakPolarHBondContact O-CB 3.27Å; V871-I875 WeakPolarHBondContact O-CD1 3.25Å; V871-I875 WeakPolarHBondContact O-CG1 3.47Å; V871-I875 PolarHBondContact O-N 3.34Å; A872-I875 PolarHBondContact O-N 3.34Å; I875-K877 PolarHBondContact O-N 3.19Å; I875-Y878 PolarHBondContact O-N 3.3Å; I875-T879 VanDerWaalsContact O-CB 3.27Å; I875-T879 WeakPolarHBondContact O-CB 3.47Å; I875-T879 PolarHBondContact O-N 3.28Å; I875-T879 PolarHBondContact O-OG1 3.48Å
876	A	84.8	Confident	81	Confident	51 Å²	51	104.3 Å²	104.3	42%	0.421	56%	0.559	S	S	.	*	H	α-helix	trans	-64.4	-38.4	176.7	0	0	0	0	0	112.6	A872 A873 D874 S880	A872-A876 WeakPolarHBondContact O-CB 3.35Å; A872-A876 PolarHBondContact O-N 2.91Å; A873-A876 PolarHBondContact O-N 2.77Å; D874-A876 VanDerWaalsContact C-N 3.32Å; D874-A876 PolarHBondContact O-N 2.8Å; A876-S880 WeakPolarHBondContact O-CB 3.49Å; A876-S880 PolarHBondContact O-N 2.75Å; A876-S880 PolarHBondContact O-OG 2.86Å
877	K	89.8	Confident	82.9	Confident	132 Å²	132	102 Å²	102	57%	0.574	54%	0.541	S	S	*	.	H	α-helix	trans	-67.6	-44.4	176.8	175.8	172.6	149.7	-149.6	0	112.3	A873 D874 I875 S880 K881	A873-K877 WeakPolarHBondContact O-CB 3.29Å; A873-K877 PolarHBondContact O-N 2.88Å; D874-K877 WeakPolarHBondContact O-CB 3.42Å; D874-K877 PolarHBondContact O-N 3.26Å; D874-K877 WeakPolarHBondContact OD1-CD 3.02Å; D874-K877 WeakPolarHBondContact OD1-CE 3.31Å; D874-K877 IonicContact OD1-NZ 2.83Å; D874-K877 PolarHBondContact OD1-NZ 2.65Å; I875-K877 PolarHBondContact O-N 3.19Å; K877-S880 PolarHBondContact O-N 3.35Å; K877-K881 PolarHBondContact O-N 3.12Å
878	Y	88.3	Confident	84.9	Confident	144 Å²	144	102.2 Å²	102.2	57%	0.565	53%	0.529	S	S	*	.	H	α-helix	trans	-65.6	-43.5	172.5	-74.6	-65.7	0	0	0	111.9	D874 I875 S880 K881 I882	D874-Y878 HydrophobicContact CB-CD2 4.35Å; D874-Y878 HydrophobicContact CB-CE2 4.22Å; D874-Y878 WeakPolarHBondContact O-CD2 3.45Å; D874-Y878 PolarHBondContact O-N 3.27Å; I875-Y878 PolarHBondContact O-N 3.3Å; Y878-S880 VanDerWaalsContact C-N 3.31Å; Y878-S880 PolarHBondContact O-N 3.25Å; Y878-K881 PolarHBondContact O-N 3.5Å; Y878-K881 VanDerWaalsContact O-N 3.12Å; Y878-I882 VanDerWaalsContact O-CG1 3.29Å; Y878-I882 WeakPolarHBondContact O-CG1 3.32Å; Y878-I882 PolarHBondContact O-N 3.13Å
879	T	88.8	Confident	86.4	Confident	83 Å²	83	103.4 Å²	103.4	51%	0.509	53%	0.529	S	S	.	.	H	α-helix	trans	-58.6	-42.5	175.4	-59.1	0	0	0	0	111.6	I875 I882 R883	I875-T879 VanDerWaalsContact O-CB 3.27Å; I875-T879 WeakPolarHBondContact O-CB 3.47Å; I875-T879 PolarHBondContact O-N 3.28Å; I875-T879 PolarHBondContact O-OG1 3.48Å; T879-I882 PolarHBondContact O-N 3.27Å; T879-R883 PolarHBondContact O-N 2.63Å
880	S	90.8	Very high	87.7	Confident	76 Å²	76	105 Å²	105	53%	0.531	52%	0.523	S	S	.	.	H	α-helix	trans	-64.8	-38.8	175.6	-61	0	0	0	0	112.5	A876 K877 Y878 R884	A876-S880 WeakPolarHBondContact O-CB 3.49Å; A876-S880 PolarHBondContact O-N 2.75Å; A876-S880 PolarHBondContact O-OG 2.86Å; K877-S880 PolarHBondContact O-N 3.35Å; Y878-S880 VanDerWaalsContact C-N 3.31Å; Y878-S880 PolarHBondContact O-N 3.25Å; S880-R884 PolarHBondContact O-N 2.91Å; S880-R884 VanDerWaalsContact O-N 3.08Å
881	K	93	Very high	89.2	Confident	131 Å²	131	103.9 Å²	103.9	57%	0.57	51%	0.512	S	S	*	.	H	α-helix	trans	-67.5	-40.2	174.5	-168.2	175.4	-178.5	-179.4	0	111.9	K877 Y878 R884 L885	K877-K881 PolarHBondContact O-N 3.12Å; Y878-K881 PolarHBondContact O-N 3.5Å; Y878-K881 VanDerWaalsContact O-N 3.12Å; K881-R884 PolarHBondContact O-N 3.02Å; K881-L885 HydrophobicContact CG-CD1 4.28Å; K881-L885 WeakPolarHBondContact O-CG 3.33Å; K881-L885 PolarHBondContact O-N 2.88Å
882	I	92.6	Very high	90.1	Very high	88 Å²	88	105 Å²	105	45%	0.451	52%	0.515	S	S	.	.	H	α-helix	trans	-63.6	-45.6	175.3	-69.2	162.7	0	0	0	110.6	Y878 T879 R884 L885 R886	Y878-I882 VanDerWaalsContact O-CG1 3.29Å; Y878-I882 WeakPolarHBondContact O-CG1 3.32Å; Y878-I882 PolarHBondContact O-N 3.13Å; T879-I882 PolarHBondContact O-N 3.27Å; I882-R884 VanDerWaalsContact C-N 3.34Å; I882-R884 PolarHBondContact O-N 2.73Å; I882-L885 PolarHBondContact O-N 2.91Å; I882-R886 WeakPolarHBondContact O-CG 3.33Å; I882-R886 PolarHBondContact O-N 2.82Å
883	R	93.4	Very high	91	Very high	189 Å²	189	108.2 Å²	108.2	71%	0.713	52%	0.52	S	S	*	.	H	α-helix	trans	-58.1	-44.7	174.8	177.3	178.1	-95.2	168.5	-7.5	111.6	T879 R886 I887	T879-R883 PolarHBondContact O-N 2.63Å; R883-R886 PolarHBondContact O-N 2.86Å; R883-I887 HydrophobicContact CG-CD1 4.09Å; R883-I887 WeakPolarHBondContact O-CG1 3.38Å; R883-I887 PolarHBondContact O-N 2.92Å; R883-I887 VanDerWaalsContact O-N 3.16Å
884	R	94.3	Very high	91.8	Very high	192 Å²	192	113.3 Å²	113.3	73%	0.725	53%	0.527	S	S	*	.	H	α-helix	trans	-62.3	-43.1	176.9	-168.6	-175.2	-60.4	-179.5	0.4	112.4	S880 K881 I882 I887 E888	S880-R884 PolarHBondContact O-N 2.91Å; S880-R884 VanDerWaalsContact O-N 3.08Å; K881-R884 PolarHBondContact O-N 3.02Å; I882-R884 VanDerWaalsContact C-N 3.34Å; I882-R884 PolarHBondContact O-N 2.73Å; R884-I887 PolarHBondContact O-N 2.83Å; R884-E888 PolarHBondContact O-N 3.33Å; R884-E888 VanDerWaalsContact O-N 3.09Å
885	L	94.3	Very high	92.4	Very high	97 Å²	97	113.5 Å²	113.5	51%	0.508	53%	0.527	S	S	.	.	H	α-helix	trans	-67.4	-34.9	178.4	-72.4	169.8	0	0	0	112.4	K881 I882 E888 I889	K881-L885 HydrophobicContact CG-CD1 4.28Å; K881-L885 WeakPolarHBondContact O-CG 3.33Å; K881-L885 PolarHBondContact O-N 2.88Å; I882-L885 PolarHBondContact O-N 2.91Å; L885-E888 PolarHBondContact O-N 3.42Å; L885-I889 WeakPolarHBondContact O-CB 3.41Å; L885-I889 WeakPolarHBondContact O-CD1 3.44Å; L885-I889 VanDerWaalsContact O-CG1 3.22Å; L885-I889 WeakPolarHBondContact O-CG1 3.46Å; L885-I889 PolarHBondContact O-N 3.46Å
886	R	92.9	Very high	92.8	Very high	161 Å²	161	113.5 Å²	113.5	61%	0.608	53%	0.525	S	S	*	.	H	α-helix	trans	-62.1	-48.3	172.5	-73.1	-177.6	-176.3	-165.7	1	111.9	I882 R883 E888 I889 E890	I882-R886 WeakPolarHBondContact O-CG 3.33Å; I882-R886 PolarHBondContact O-N 2.82Å; R883-R886 PolarHBondContact O-N 2.86Å; R886-E888 VanDerWaalsContact C-N 3.3Å; R886-E888 PolarHBondContact O-N 3.01Å; R886-I889 PolarHBondContact O-N 3.25Å; R886-I889 VanDerWaalsContact O-N 3.13Å; R886-E890 WeakPolarHBondContact O-CB 3.18Å; R886-E890 VanDerWaalsContact O-CG 3.32Å; R886-E890 WeakPolarHBondContact O-CG 3.43Å; R886-E890 PolarHBondContact O-N 3.33Å
887	I	94.9	Very high	93.2	Very high	98 Å²	98	117 Å²	117	50%	0.503	53%	0.533	S	S	.	.	H	α-helix	trans	-59.9	-40.5	178.2	-65.9	164.3	0	0	0	111.3	R883 R884 E890 K891	R883-I887 HydrophobicContact CG-CD1 4.09Å; R883-I887 WeakPolarHBondContact O-CG1 3.38Å; R883-I887 PolarHBondContact O-N 2.92Å; R883-I887 VanDerWaalsContact O-N 3.16Å; R884-I887 PolarHBondContact O-N 2.83Å; I887-E890 PolarHBondContact O-N 3.49Å; I887-K891 VanDerWaalsContact O-CB 3.28Å; I887-K891 WeakPolarHBondContact O-CB 3.43Å; I887-K891 PolarHBondContact O-N 3.09Å
888	E	94.3	Very high	93.5	Very high	80 Å²	80	114.8 Å²	114.8	37%	0.374	52%	0.524	S	S	.	.	H	α-helix	trans	-71.9	-33.1	177.4	-165	60.9	-148.7	0	0	112.3	R884 L885 R886 K891 L892	R884-E888 PolarHBondContact O-N 3.33Å; R884-E888 VanDerWaalsContact O-N 3.09Å; L885-E888 PolarHBondContact O-N 3.42Å; R886-E888 VanDerWaalsContact C-N 3.3Å; R886-E888 PolarHBondContact O-N 3.01Å; E888-K891 IonicContact OE1-NZ 2.74Å; E888-K891 PolarHBondContact OE1-NZ 2.93Å; E888-K891 IonicContact OE2-NZ 3.28Å; E888-K891 PolarHBondContact OE2-NZ 3.21Å; E888-L892 HydrophobicContact CG-CD1 4.42Å; E888-L892 WeakPolarHBondContact O-CB 3.12Å; E888-L892 VanDerWaalsContact O-CG 3.24Å; E888-L892 WeakPolarHBondContact O-CG 3.48Å; E888-L892 PolarHBondContact O-N 2.89Å
889	I	94.7	Very high	93.8	Very high	90 Å²	90	113.6 Å²	113.6	46%	0.462	52%	0.524	S	S	.	.	H	α-helix	trans	-66	-45.3	171.3	-71.8	164	0	0	0	111	L885 R886 K891 L892 Q893	L885-I889 WeakPolarHBondContact O-CB 3.41Å; L885-I889 WeakPolarHBondContact O-CD1 3.44Å; L885-I889 VanDerWaalsContact O-CG1 3.22Å; L885-I889 WeakPolarHBondContact O-CG1 3.46Å; L885-I889 PolarHBondContact O-N 3.46Å; R886-I889 PolarHBondContact O-N 3.25Å; R886-I889 VanDerWaalsContact O-N 3.13Å; I889-K891 VanDerWaalsContact C-N 3.31Å; I889-K891 PolarHBondContact O-N 3.23Å; I889-L892 PolarHBondContact O-N 3.47Å; I889-Q893 HydrophobicContact CG2-CG 4.4Å; I889-Q893 WeakPolarHBondContact O-CB 3.35Å; I889-Q893 VanDerWaalsContact O-CG 3.27Å; I889-Q893 WeakPolarHBondContact O-CG 3.46Å; I889-Q893 PolarHBondContact O-N 3.43Å
890	E	94.4	Very high	93.8	Very high	112 Å²	112	113.2 Å²	113.2	52%	0.523	52%	0.519	S	S	.	.	H	α-helix	trans	-60.5	-41.5	176.4	-72.5	158.6	-162.4	0	0	110.9	R886 I887 Q893 W894	R886-E890 WeakPolarHBondContact O-CB 3.18Å; R886-E890 VanDerWaalsContact O-CG 3.32Å; R886-E890 WeakPolarHBondContact O-CG 3.43Å; R886-E890 PolarHBondContact O-N 3.33Å; I887-E890 PolarHBondContact O-N 3.49Å; E890-Q893 PolarHBondContact O-N 3.44Å; E890-W894 WeakPolarHBondContact O-CB 3.17Å; E890-W894 PolarHBondContact O-N 3.39Å
891	K	96.4	Very high	93.8	Very high	100 Å²	100	112.8 Å²	112.8	44%	0.435	52%	0.515	S	S	.	.	H	α-helix	trans	-65.4	-42.3	173.8	169.9	166.9	159	-99.9	0	113.2	I887 E888 I889 W894 L895	I887-K891 VanDerWaalsContact O-CB 3.28Å; I887-K891 WeakPolarHBondContact O-CB 3.43Å; I887-K891 PolarHBondContact O-N 3.09Å; E888-K891 IonicContact OE1-NZ 2.74Å; E888-K891 PolarHBondContact OE1-NZ 2.93Å; E888-K891 IonicContact OE2-NZ 3.28Å; E888-K891 PolarHBondContact OE2-NZ 3.21Å; I889-K891 VanDerWaalsContact C-N 3.31Å; I889-K891 PolarHBondContact O-N 3.23Å; K891-W894 PolarHBondContact O-N 2.91Å; K891-L895 HydrophobicContact CG-CD1 4.29Å; K891-L895 WeakPolarHBondContact O-CG 3.5Å; K891-L895 PolarHBondContact O-N 3.32Å
892	L	94.9	Very high	93.9	Very high	99 Å²	99	112 Å²	112	52%	0.518	51%	0.514	S	S	.	.	H	α-helix	trans	-67.7	-37	175.4	-74.2	167.8	0	0	0	112	E888 I889 H896	E888-L892 HydrophobicContact CG-CD1 4.42Å; E888-L892 WeakPolarHBondContact O-CB 3.12Å; E888-L892 VanDerWaalsContact O-CG 3.24Å; E888-L892 WeakPolarHBondContact O-CG 3.48Å; E888-L892 PolarHBondContact O-N 2.89Å; I889-L892 PolarHBondContact O-N 3.47Å; L892-H896 WeakPolarHBondContact O-CB 3.48Å; L892-H896 PolarHBondContact O-N 2.93Å
893	Q	92.9	Very high	93.9	Very high	126 Å²	126	114 Å²	114	59%	0.589	52%	0.523	S	S	*	.	H	α-helix	trans	-64.7	-41.3	172.3	-74.6	172.3	-10	0	0	111.5	I889 E890 H896 Q897	I889-Q893 HydrophobicContact CG2-CG 4.4Å; I889-Q893 WeakPolarHBondContact O-CB 3.35Å; I889-Q893 VanDerWaalsContact O-CG 3.27Å; I889-Q893 WeakPolarHBondContact O-CG 3.46Å; I889-Q893 PolarHBondContact O-N 3.43Å; E890-Q893 PolarHBondContact O-N 3.44Å; Q893-H896 PolarHBondContact O-N 2.87Å; Q893-Q897 VanDerWaalsContact O-CB 3.28Å; Q893-Q897 WeakPolarHBondContact O-CB 3.17Å; Q893-Q897 PolarHBondContact O-N 2.83Å
894	W	96.2	Very high	93.9	Very high	166 Å²	166	111 Å²	111	63%	0.629	52%	0.515	S	S	*	.	H	α-helix	trans	-64.4	-45.4	175.6	-176.4	87.4	0	0	0	112.3	E890 K891 Q897 Q898	E890-W894 WeakPolarHBondContact O-CB 3.17Å; E890-W894 PolarHBondContact O-N 3.39Å; K891-W894 PolarHBondContact O-N 2.91Å; W894-Q897 PolarHBondContact O-N 3.23Å; W894-Q898 VanDerWaalsContact CH2-OE1 3.3Å; W894-Q898 PolarHBondContact O-N 3.41Å
895	L	95.1	Very high	93.9	Very high	68 Å²	68	107.7 Å²	107.7	36%	0.356	51%	0.507	S	S	.	.	H	α-helix	trans	-61.1	-45.3	175.2	-74.4	168.4	0	0	0	111.7	K891 Q897 Q898 E899	K891-L895 HydrophobicContact CG-CD1 4.29Å; K891-L895 WeakPolarHBondContact O-CG 3.5Å; K891-L895 PolarHBondContact O-N 3.32Å; L895-Q897 VanDerWaalsContact C-N 3.33Å; L895-Q897 PolarHBondContact O-N 2.78Å; L895-Q898 WeakPolarHBondContact O-CA 3.5Å; L895-Q898 WeakPolarHBondContact O-CB 3.22Å; L895-Q898 PolarHBondContact O-N 3.38Å; L895-Q898 VanDerWaalsContact O-N 3.12Å; L895-E899 WeakPolarHBondContact O-CG 3.1Å; L895-E899 PolarHBondContact O-N 3.1Å
896	H	93.2	Very high	93.8	Very high	100 Å²	100	107 Å²	107	46%	0.463	50%	0.504	S	S	.	.	H	α-helix	trans	-65	-37.5	177	-173.8	49.6	0	0	0	112.4	L892 Q893 Q898 E899 L900	L892-H896 WeakPolarHBondContact O-CB 3.48Å; L892-H896 PolarHBondContact O-N 2.93Å; Q893-H896 PolarHBondContact O-N 2.87Å; H896-Q898 VanDerWaalsContact C-N 3.29Å; H896-Q898 PolarHBondContact O-N 2.93Å; H896-E899 IonicContact ND1-OE2 3.52Å; H896-E899 PolarHBondContact ND1-OE2 3.45Å; H896-E899 PolarHBondContact O-N 2.61Å; H896-L900 WeakPolarHBondContact O-CB 3.33Å; H896-L900 VanDerWaalsContact O-CG 3.3Å; H896-L900 WeakPolarHBondContact O-CG 3.23Å; H896-L900 PolarHBondContact O-N 2.94Å
897	Q	92.4	Very high	93.8	Very high	125 Å²	125	104.5 Å²	104.5	58%	0.584	50%	0.502	S	S	*	.	H	α-helix	trans	-64.7	-34.1	173.1	-172.7	64.7	30.4	0	0	111.8	Q893 W894 L895 S901	Q893-Q897 VanDerWaalsContact O-CB 3.28Å; Q893-Q897 WeakPolarHBondContact O-CB 3.17Å; Q893-Q897 PolarHBondContact O-N 2.83Å; W894-Q897 PolarHBondContact O-N 3.23Å; L895-Q897 VanDerWaalsContact C-N 3.33Å; L895-Q897 PolarHBondContact O-N 2.78Å; Q897-S901 WeakPolarHBondContact O-CB 3.38Å; Q897-S901 PolarHBondContact O-N 2.91Å
898	Q	95.1	Very high	93.8	Very high	85 Å²	85	104.9 Å²	104.9	40%	0.397	50%	0.502	S	S	.	.	H	α-helix	trans	-65.9	-51.3	172.9	-172.3	-179.1	2.9	0	0	111.1	W894 L895 H896 L900 S901 E902	W894-Q898 VanDerWaalsContact CH2-OE1 3.3Å; W894-Q898 PolarHBondContact O-N 3.41Å; L895-Q898 WeakPolarHBondContact O-CA 3.5Å; L895-Q898 WeakPolarHBondContact O-CB 3.22Å; L895-Q898 PolarHBondContact O-N 3.38Å; L895-Q898 VanDerWaalsContact O-N 3.12Å; H896-Q898 VanDerWaalsContact C-N 3.29Å; H896-Q898 PolarHBondContact O-N 2.93Å; Q898-L900 VanDerWaalsContact C-N 3.3Å; Q898-L900 PolarHBondContact O-N 2.83Å; Q898-S901 WeakPolarHBondContact O-CA 3.43Å; Q898-S901 WeakPolarHBondContact O-CB 3.18Å; Q898-S901 PolarHBondContact O-N 3.43Å; Q898-S901 PolarHBondContact O-OG 2.9Å; Q898-E902 PolarHBondContact O-N 3.38Å
899	E	94.4	Very high	93.8	Very high	120 Å²	120	105 Å²	105	56%	0.561	51%	0.505	S	S	*	.	H	α-helix	trans	-54	-44.2	175.5	-69.4	175.2	155.4	0	0	112.1	L895 H896 S901 E902 M903	L895-E899 WeakPolarHBondContact O-CG 3.1Å; L895-E899 PolarHBondContact O-N 3.1Å; H896-E899 IonicContact ND1-OE2 3.52Å; H896-E899 PolarHBondContact ND1-OE2 3.45Å; H896-E899 PolarHBondContact O-N 2.61Å; E899-S901 VanDerWaalsContact C-N 3.33Å; E899-S901 PolarHBondContact O-N 2.92Å; E899-E902 PolarHBondContact O-N 2.89Å; E899-M903 VanDerWaalsContact O-CB 3.31Å; E899-M903 WeakPolarHBondContact O-CB 3.16Å; E899-M903 PolarHBondContact O-N 3.5Å
900	L	89.5	Confident	93.7	Very high	75 Å²	75	104.6 Å²	104.6	39%	0.393	51%	0.507	S	S	.	.	H	α-helix	trans	-64.8	-36	176.5	-71.8	174	0	0	0	112.4	H896 Q898 K904	H896-L900 WeakPolarHBondContact O-CB 3.33Å; H896-L900 VanDerWaalsContact O-CG 3.3Å; H896-L900 WeakPolarHBondContact O-CG 3.23Å; H896-L900 PolarHBondContact O-N 2.94Å; Q898-L900 VanDerWaalsContact C-N 3.3Å; Q898-L900 PolarHBondContact O-N 2.83Å; L900-K904 WeakPolarHBondContact O-CB 3.3Å; L900-K904 PolarHBondContact O-N 2.68Å
901	S	90.4	Very high	93.6	Very high	66 Å²	66	103.1 Å²	103.1	46%	0.462	50%	0.501	S	S	.	.	H	α-helix	trans	-70.7	-38.3	176.4	76.1	0	0	0	0	112.5	Q897 Q898 E899 K904 H905	Q897-S901 WeakPolarHBondContact O-CB 3.38Å; Q897-S901 PolarHBondContact O-N 2.91Å; Q898-S901 WeakPolarHBondContact O-CA 3.43Å; Q898-S901 WeakPolarHBondContact O-CB 3.18Å; Q898-S901 PolarHBondContact O-N 3.43Å; Q898-S901 PolarHBondContact O-OG 2.9Å; E899-S901 VanDerWaalsContact C-N 3.33Å; E899-S901 PolarHBondContact O-N 2.92Å; S901-K904 PolarHBondContact O-N 3.23Å; S901-H905 WeakPolarHBondContact O-CB 3.3Å; S901-H905 PolarHBondContact O-N 3.26Å
902	E	95.5	Very high	93.3	Very high	115 Å²	115	100.5 Å²	100.5	54%	0.537	50%	0.498	S	S	.	.	H	α-helix	trans	-69.9	-43.9	176.6	-177.4	172.6	-175.3	0	0	111.2	Q898 E899 K904 H905 N906	Q898-E902 PolarHBondContact O-N 3.38Å; E899-E902 PolarHBondContact O-N 2.89Å; E902-K904 VanDerWaalsContact C-N 3.32Å; E902-K904 PolarHBondContact O-N 3.5Å; E902-H905 PolarHBondContact O-N 2.96Å; E902-N906 PolarHBondContact O-N 2.92Å; E902-N906 PolarHBondContact O-ND2 3.41Å
903	M	93.4	Very high	93.3	Very high	130 Å²	130	100.9 Å²	100.9	64%	0.64	50%	0.497	S	S	*	.	H	α-helix	trans	-60.6	-41	173.5	-171	-170.7	-58.8	0	0	111.6	E899 L907	E899-M903 VanDerWaalsContact O-CB 3.31Å; E899-M903 WeakPolarHBondContact O-CB 3.16Å; E899-M903 PolarHBondContact O-N 3.5Å; M903-L907 WeakPolarHBondContact O-CB 3.3Å; M903-L907 PolarHBondContact O-N 3.2Å; M903-L907 VanDerWaalsContact O-N 3.09Å
904	K	92.3	Very high	93.3	Very high	127 Å²	127	100.2 Å²	100.2	55%	0.552	50%	0.495	S	S	*	.	H	α-helix	trans	-61.8	-47.2	173.3	-179.9	-175.8	177.1	-77.9	0	111.4	L900 S901 E902 L907 E908	L900-K904 WeakPolarHBondContact O-CB 3.3Å; L900-K904 PolarHBondContact O-N 2.68Å; S901-K904 PolarHBondContact O-N 3.23Å; E902-K904 VanDerWaalsContact C-N 3.32Å; E902-K904 PolarHBondContact O-N 3.5Å; K904-L907 PolarHBondContact O-N 3.33Å; K904-E908 IonicContact NZ-OE1 2.77Å; K904-E908 IonicContact NZ-OE2 2.68Å; K904-E908 PolarHBondContact NZ-OE2 3.1Å; K904-E908 VanDerWaalsContact O-CB 3.29Å; K904-E908 WeakPolarHBondContact O-CB 3.45Å; K904-E908 PolarHBondContact O-N 3.44Å
905	H	94.4	Very high	93.1	Very high	121 Å²	121	99.2 Å²	99.2	56%	0.56	49%	0.491	S	S	*	.	H	α-helix	trans	-63.2	-43.9	-178.3	-179.2	52.3	0	0	0	112.2	S901 E902 L907 E908 L909	S901-H905 WeakPolarHBondContact O-CB 3.3Å; S901-H905 PolarHBondContact O-N 3.26Å; E902-H905 PolarHBondContact O-N 2.96Å; H905-L907 PolarHBondContact O-N 2.9Å; H905-E908 PolarHBondContact O-N 3.22Å; H905-L909 WeakPolarHBondContact O-CB 3.35Å; H905-L909 PolarHBondContact O-N 3.09Å
906	N	93.3	Very high	93	Very high	84 Å²	84	101.5 Å²	101.5	45%	0.449	50%	0.5	S	S	.	.	H	α-helix	trans	-60.3	-45.2	174.7	-79.7	-81.7	0	0	0	111.8	E902 E908 L909 T910	E902-N906 PolarHBondContact O-N 2.92Å; E902-N906 PolarHBondContact O-ND2 3.41Å; N906-E908 VanDerWaalsContact C-N 3.33Å; N906-E908 PolarHBondContact O-N 3.27Å; N906-L909 PolarHBondContact O-N 2.85Å; N906-T910 PolarHBondContact O-N 3.47Å; N906-T910 PolarHBondContact O-OG1 2.91Å
907	L	92.8	Very high	93	Very high	108 Å²	108	100.1 Å²	100.1	57%	0.565	50%	0.502	S	S	*	.	H	α-helix	trans	-62.5	-40.5	175.4	178.2	61.7	0	0	0	112.1	M903 K904 H905 L909 T910 M911	M903-L907 WeakPolarHBondContact O-CB 3.3Å; M903-L907 PolarHBondContact O-N 3.2Å; M903-L907 VanDerWaalsContact O-N 3.09Å; K904-L907 PolarHBondContact O-N 3.33Å; H905-L907 PolarHBondContact O-N 2.9Å; L907-L909 VanDerWaalsContact C-N 3.35Å; L907-T910 PolarHBondContact O-N 3.27Å; L907-M911 HydrophobicContact CD1-CG 4.25Å; L907-M911 HydrophobicContact CD1-SD 4.35Å; L907-M911 HydrophobicContact CG-SD 4.29Å; L907-M911 WeakPolarHBondContact O-CB 3.3Å; L907-M911 VanDerWaalsContact O-CG 3.25Å; L907-M911 WeakPolarHBondContact O-CG 3.37Å; L907-M911 PolarHBondContact O-N 3.01Å
908	E	93.8	Very high	93	Very high	106 Å²	106	99.7 Å²	99.7	50%	0.495	50%	0.503	S	S	.	.	H	α-helix	trans	-64.9	-38.5	178.3	-170.6	153.7	-150.1	0	0	111.7	K904 H905 N906 A912	K904-E908 IonicContact NZ-OE1 2.77Å; K904-E908 IonicContact NZ-OE2 2.68Å; K904-E908 PolarHBondContact NZ-OE2 3.1Å; K904-E908 VanDerWaalsContact O-CB 3.29Å; K904-E908 WeakPolarHBondContact O-CB 3.45Å; K904-E908 PolarHBondContact O-N 3.44Å; H905-E908 PolarHBondContact O-N 3.22Å; N906-E908 VanDerWaalsContact C-N 3.33Å; N906-E908 PolarHBondContact O-N 3.27Å; E908-A912 PolarHBondContact O-N 3.17Å
909	L	95.1	Very high	92.8	Very high	82 Å²	82	100.2 Å²	100.2	43%	0.429	51%	0.505	S	S	.	.	H	α-helix	trans	-65	-52.3	172.3	-177.6	62.9	0	0	0	112	H905 N906 L907 M911 A912 E913	H905-L909 WeakPolarHBondContact O-CB 3.35Å; H905-L909 PolarHBondContact O-N 3.09Å; N906-L909 PolarHBondContact O-N 2.85Å; L907-L909 VanDerWaalsContact C-N 3.35Å; L909-M911 PolarHBondContact O-N 3.04Å; L909-A912 WeakPolarHBondContact O-CA 3.49Å; L909-A912 WeakPolarHBondContact O-CB 3.37Å; L909-A912 PolarHBondContact O-N 3.12Å; L909-E913 WeakPolarHBondContact O-CG 3.14Å; L909-E913 PolarHBondContact O-N 3.12Å
910	T	93.4	Very high	92.8	Very high	82 Å²	82	100.2 Å²	100.2	50%	0.503	51%	0.505	S	S	.	.	H	α-helix	trans	-59.7	-35.1	176.8	-56.6	0	0	0	0	112.2	N906 L907 A912 E913 M914	N906-T910 PolarHBondContact O-N 3.47Å; N906-T910 PolarHBondContact O-OG1 2.91Å; L907-T910 PolarHBondContact O-N 3.27Å; T910-A912 VanDerWaalsContact C-N 3.33Å; T910-E913 WeakPolarHBondContact CA-OE2 3.41Å; T910-M914 WeakPolarHBondContact O-CB 3.42Å; T910-M914 PolarHBondContact O-N 2.91Å
911	M	90.4	Very high	92.9	Very high	80 Å²	80	100.6 Å²	100.6	39%	0.394	51%	0.505	S	S	.	.	H	α-helix	trans	-71.3	-24.5	172.5	-72.7	-174.1	74.1	0	0	113.2	L907 L909 R915	L907-M911 HydrophobicContact CD1-CG 4.25Å; L907-M911 HydrophobicContact CD1-SD 4.35Å; L907-M911 HydrophobicContact CG-SD 4.29Å; L907-M911 WeakPolarHBondContact O-CB 3.3Å; L907-M911 VanDerWaalsContact O-CG 3.25Å; L907-M911 WeakPolarHBondContact O-CG 3.37Å; L907-M911 PolarHBondContact O-N 3.01Å; L909-M911 PolarHBondContact O-N 3.04Å; M911-R915 VanDerWaalsContact O-CG 3.27Å; M911-R915 WeakPolarHBondContact O-CG 3.45Å; M911-R915 PolarHBondContact O-N 3.48Å; M911-R915 PolarHBondContact O-NH1 2.87Å
912	A	91.9	Very high	93	Very high	46 Å²	46	102.9 Å²	102.9	38%	0.38	50%	0.504	S	S	.	.	H	α-helix	trans	-75.8	-47.9	172.2	0	0	0	0	0	111	E908 L909 T910 M914 R915 Q916	E908-A912 PolarHBondContact O-N 3.17Å; L909-A912 WeakPolarHBondContact O-CA 3.49Å; L909-A912 WeakPolarHBondContact O-CB 3.37Å; L909-A912 PolarHBondContact O-N 3.12Å; T910-A912 VanDerWaalsContact C-N 3.33Å; A912-M914 VanDerWaalsContact C-N 3.33Å; A912-M914 PolarHBondContact O-N 2.6Å; A912-R915 WeakPolarHBondContact O-CB 3.06Å; A912-R915 PolarHBondContact O-N 3.11Å; A912-R915 VanDerWaalsContact O-N 3.09Å; A912-Q916 PolarHBondContact O-N 2.87Å
913	E	94.4	Very high	92.9	Very high	106 Å²	106	100.9 Å²	100.9	50%	0.495	50%	0.496	S	S	.	.	H	α-helix	trans	-55.2	-46.3	175.1	-66.3	171.4	150.7	0	0	111.7	L909 T910 R915 Q916 S917	L909-E913 WeakPolarHBondContact O-CG 3.14Å; L909-E913 PolarHBondContact O-N 3.12Å; T910-E913 WeakPolarHBondContact CA-OE2 3.41Å; E913-R915 VanDerWaalsContact C-N 3.33Å; E913-R915 PolarHBondContact O-N 3Å; E913-Q916 PolarHBondContact O-N 3.4Å; E913-S917 WeakPolarHBondContact O-CB 3.46Å; E913-S917 PolarHBondContact O-N 3.09Å
914	M	92.1	Very high	93	Very high	112 Å²	112	102.5 Å²	102.5	55%	0.552	50%	0.496	S	S	*	.	H	α-helix	trans	-64	-35.1	177.6	-170.9	-177.3	70.3	0	0	112.6	T910 A912 L918	T910-M914 WeakPolarHBondContact O-CB 3.42Å; T910-M914 PolarHBondContact O-N 2.91Å; A912-M914 VanDerWaalsContact C-N 3.33Å; A912-M914 PolarHBondContact O-N 2.6Å; M914-L918 HydrophobicContact CG-CD1 4.46Å; M914-L918 VanDerWaalsContact O-CG 3.3Å; M914-L918 WeakPolarHBondContact O-CG 3.29Å; M914-L918 PolarHBondContact O-N 3.38Å; M914-L918 VanDerWaalsContact O-N 3.17Å
915	R	91.5	Very high	93.1	Very high	145 Å²	145	101.4 Å²	101.4	55%	0.547	50%	0.495	S	S	.	.	H	α-helix	trans	-67.8	-45.8	173.6	-73.7	174.8	-168.2	108.5	-16.2	111	M911 A912 E913 S917 L918 E919	M911-R915 VanDerWaalsContact O-CG 3.27Å; M911-R915 WeakPolarHBondContact O-CG 3.45Å; M911-R915 PolarHBondContact O-N 3.48Å; M911-R915 PolarHBondContact O-NH1 2.87Å; A912-R915 WeakPolarHBondContact O-CB 3.06Å; A912-R915 PolarHBondContact O-N 3.11Å; A912-R915 VanDerWaalsContact O-N 3.09Å; E913-R915 VanDerWaalsContact C-N 3.33Å; E913-R915 PolarHBondContact O-N 3Å; R915-S917 VanDerWaalsContact C-N 3.32Å; R915-S917 PolarHBondContact O-N 3.22Å; R915-L918 PolarHBondContact O-N 3.02Å; R915-E919 WeakPolarHBondContact O-CB 3.43Å; R915-E919 PolarHBondContact O-N 3.17Å
916	Q	94.9	Very high	93	Very high	117 Å²	117	100.4 Å²	100.4	55%	0.547	49%	0.493	S	S	.	.	H	α-helix	trans	-61.4	-40.4	179	-170.2	178.7	18.4	0	0	111.7	A912 E913 E919 Q920	A912-Q916 PolarHBondContact O-N 2.87Å; E913-Q916 PolarHBondContact O-N 3.4Å; Q916-E919 PolarHBondContact O-N 2.96Å; Q916-Q920 WeakPolarHBondContact O-CB 3.34Å; Q916-Q920 VanDerWaalsContact O-CG 3.3Å; Q916-Q920 WeakPolarHBondContact O-CG 3.34Å; Q916-Q920 PolarHBondContact O-N 2.89Å
917	S	92.9	Very high	93.1	Very high	70 Å²	70	99.2 Å²	99.2	49%	0.49	50%	0.495	S	S	.	.	H	α-helix	trans	-63.3	-43.2	174.7	176.6	0	0	0	0	112.6	E913 R915 E919 Q920 E921	E913-S917 WeakPolarHBondContact O-CB 3.46Å; E913-S917 PolarHBondContact O-N 3.09Å; R915-S917 VanDerWaalsContact C-N 3.32Å; R915-S917 PolarHBondContact O-N 3.22Å; S917-E919 VanDerWaalsContact C-N 3.33Å; S917-E919 PolarHBondContact O-N 3.33Å; S917-Q920 PolarHBondContact O-N 3.13Å; S917-E921 PolarHBondContact O-N 3.1Å
918	L	91.1	Very high	93.2	Very high	117 Å²	117	98.8 Å²	98.8	61%	0.613	49%	0.49	S	S	*	.	H	α-helix	trans	-67.2	-33.1	175.9	-71.4	170.3	0	0	0	112.6	M914 R915 R922	M914-L918 HydrophobicContact CG-CD1 4.46Å; M914-L918 VanDerWaalsContact O-CG 3.3Å; M914-L918 WeakPolarHBondContact O-CG 3.29Å; M914-L918 PolarHBondContact O-N 3.38Å; M914-L918 VanDerWaalsContact O-N 3.17Å; R915-L918 PolarHBondContact O-N 3.02Å; L918-R922 WeakPolarHBondContact O-CB 3.46Å; L918-R922 PolarHBondContact O-N 3.19Å
919	E	91.3	Very high	93.3	Very high	96 Å²	96	97.9 Å²	97.9	45%	0.449	49%	0.491	S	S	.	.	H	α-helix	trans	-72	-42	175.3	-178.2	141	-130.8	0	0	111.9	R915 Q916 S917 E921 R922 D923	R915-E919 WeakPolarHBondContact O-CB 3.43Å; R915-E919 PolarHBondContact O-N 3.17Å; Q916-E919 PolarHBondContact O-N 2.96Å; S917-E919 VanDerWaalsContact C-N 3.33Å; S917-E919 PolarHBondContact O-N 3.33Å; E919-E921 PolarHBondContact O-N 2.04Å; E919-R922 WeakPolarHBondContact O-CB 3.39Å; E919-R922 PolarHBondContact O-N 2.93Å; E919-R922 IonicContact OE1-CZ 2.68Å; E919-R922 IonicContact OE1-NH1 3.77Å; E919-R922 PolarHBondContact OE1-NH1 2.94Å; E919-R922 IonicContact OE1-NH2 3.31Å; E919-R922 PolarHBondContact OE1-NH2 3.42Å; E919-D923 PolarHBondContact O-N 2.98Å
920	Q	94.3	Very high	93.3	Very high	119 Å²	119	101.5 Å²	101.5	56%	0.556	50%	0.503	S	S	*	.	H	α-helix	trans	-60.6	-43.7	172.6	-75.6	172.8	-6	0	0	112.2	Q916 S917 D923 R924	Q916-Q920 WeakPolarHBondContact O-CB 3.34Å; Q916-Q920 VanDerWaalsContact O-CG 3.3Å; Q916-Q920 WeakPolarHBondContact O-CG 3.34Å; Q916-Q920 PolarHBondContact O-N 2.89Å; S917-Q920 PolarHBondContact O-N 3.13Å; Q920-D923 PolarHBondContact O-N 3.5Å; Q920-R924 VanDerWaalsContact O-CB 3.3Å; Q920-R924 WeakPolarHBondContact O-CB 3.37Å; Q920-R924 PolarHBondContact O-N 3.21Å
921	E	91.9	Very high	93.5	Very high	83 Å²	83	103.5 Å²	103.5	39%	0.388	51%	0.505	S	S	.	.	H	α-helix	trans	-72.5	-31.4	178.7	-163	62.3	-152	0	0	111.8	S917 E919 R924 L925	S917-E921 PolarHBondContact O-N 3.1Å; E919-E921 PolarHBondContact O-N 2.04Å; E921-R924 IonicContact OE1-NH1 2.69Å; E921-R924 WeakPolarHBondContact OE2-CD 3.44Å; E921-R924 IonicContact OE2-NH1 2.93Å; E921-R924 PolarHBondContact OE2-NH1 3.39Å; E921-R924 VanDerWaalsContact OE2-NH1 3.16Å; E921-L925 WeakPolarHBondContact O-CB 3.3Å; E921-L925 VanDerWaalsContact O-CG 3.24Å; E921-L925 WeakPolarHBondContact O-CG 3.46Å; E921-L925 PolarHBondContact O-N 3.36Å
922	R	93.1	Very high	93.7	Very high	115 Å²	115	103.6 Å²	103.6	43%	0.434	51%	0.505	S	S	.	.	H	α-helix	trans	-57.3	-52.6	167.3	179.5	-159.5	73	-151.6	-3.3	110.8	L918 E919 R924 L925 I926	L918-R922 WeakPolarHBondContact O-CB 3.46Å; L918-R922 PolarHBondContact O-N 3.19Å; E919-R922 WeakPolarHBondContact O-CB 3.39Å; E919-R922 PolarHBondContact O-N 2.93Å; E919-R922 IonicContact OE1-CZ 2.68Å; E919-R922 IonicContact OE1-NH1 3.77Å; E919-R922 PolarHBondContact OE1-NH1 2.94Å; E919-R922 IonicContact OE1-NH2 3.31Å; E919-R922 PolarHBondContact OE1-NH2 3.42Å; R922-R924 VanDerWaalsContact C-N 3.34Å; R922-R924 PolarHBondContact O-N 3.48Å; R922-L925 PolarHBondContact O-N 3.43Å; R922-I926 HydrophobicContact CG-CD1 3.88Å; R922-I926 WeakPolarHBondContact O-CG1 3.27Å; R922-I926 PolarHBondContact O-N 2.96Å
923	D	92.2	Very high	93.9	Very high	72 Å²	72	106.3 Å²	106.3	39%	0.385	51%	0.512	S	S	.	.	H	α-helix	trans	-71.3	-32.2	-173.7	-68.9	-18	0	0	0	112.1	E919 Q920 I926 A927	E919-D923 PolarHBondContact O-N 2.98Å; Q920-D923 PolarHBondContact O-N 3.5Å; D923-I926 PolarHBondContact O-N 3.3Å; D923-A927 WeakPolarHBondContact O-CB 3.3Å; D923-A927 PolarHBondContact O-N 3.02Å
924	R	96.8	Very high	93.9	Very high	165 Å²	165	106 Å²	106	62%	0.623	51%	0.511	S	S	*	.	H	α-helix	trans	-60.1	-47.2	168	-174.2	-171.5	-174.6	-179.3	3.3	112.3	Q920 E921 R922 A927 E928	Q920-R924 VanDerWaalsContact O-CB 3.3Å; Q920-R924 WeakPolarHBondContact O-CB 3.37Å; Q920-R924 PolarHBondContact O-N 3.21Å; E921-R924 IonicContact OE1-NH1 2.69Å; E921-R924 WeakPolarHBondContact OE2-CD 3.44Å; E921-R924 IonicContact OE2-NH1 2.93Å; E921-R924 PolarHBondContact OE2-NH1 3.39Å; E921-R924 VanDerWaalsContact OE2-NH1 3.16Å; R922-R924 VanDerWaalsContact C-N 3.34Å; R922-R924 PolarHBondContact O-N 3.48Å; R924-A927 PolarHBondContact O-N 3.49Å; R924-E928 PolarHBondContact O-N 3.48Å
925	L	93.4	Very high	94.1	Very high	104 Å²	104	105 Å²	105	55%	0.545	51%	0.507	S	S	.	.	H	α-helix	trans	-65.2	-38.5	177.8	-72.4	168.6	0	0	0	111.7	E921 R922 E928 V929	E921-L925 WeakPolarHBondContact O-CB 3.3Å; E921-L925 VanDerWaalsContact O-CG 3.24Å; E921-L925 WeakPolarHBondContact O-CG 3.46Å; E921-L925 PolarHBondContact O-N 3.36Å; R922-L925 PolarHBondContact O-N 3.43Å; L925-E928 PolarHBondContact O-N 2.9Å; L925-V929 WeakPolarHBondContact O-CB 3.3Å; L925-V929 VanDerWaalsContact O-CG2 3.29Å; L925-V929 WeakPolarHBondContact O-CG2 3.4Å; L925-V929 PolarHBondContact O-N 3.35Å
926	I	92.6	Very high	94.2	Very high	100 Å²	100	102.1 Å²	102.1	51%	0.513	50%	0.5	S	S	.	.	H	α-helix	trans	-63.1	-43.4	173.4	-68.8	168.1	0	0	0	110.9	R922 D923 K930	R922-I926 HydrophobicContact CG-CD1 3.88Å; R922-I926 WeakPolarHBondContact O-CG1 3.27Å; R922-I926 PolarHBondContact O-N 2.96Å; D923-I926 PolarHBondContact O-N 3.3Å; I926-K930 WeakPolarHBondContact O-CB 3.46Å; I926-K930 PolarHBondContact O-N 3.34Å
927	A	94.9	Very high	94.3	Very high	59 Å²	59	102 Å²	102	49%	0.488	50%	0.498	S	S	.	.	H	α-helix	trans	-63.9	-42.7	178.4	0	0	0	0	0	112.4	D923 R924 K930 K931	D923-A927 WeakPolarHBondContact O-CB 3.3Å; D923-A927 PolarHBondContact O-N 3.02Å; R924-A927 PolarHBondContact O-N 3.49Å; A927-K930 PolarHBondContact O-N 2.88Å; A927-K931 WeakPolarHBondContact O-CB 3.38Å; A927-K931 PolarHBondContact O-N 2.91Å
928	E	95.9	Very high	94.4	Very high	98 Å²	98	102.8 Å²	102.8	46%	0.458	49%	0.493	S	S	.	.	H	α-helix	trans	-70.2	-40.2	178.8	-165.7	59	-141.1	0	0	111.7	R924 L925 K930 K931 Q932	R924-E928 PolarHBondContact O-N 3.48Å; L925-E928 PolarHBondContact O-N 2.9Å; E928-K930 PolarHBondContact O-N 3.25Å; E928-K931 PolarHBondContact O-N 3.02Å; E928-K931 IonicContact OE1-NZ 2.69Å; E928-K931 PolarHBondContact OE1-NZ 3.46Å; E928-K931 IonicContact OE2-NZ 2.59Å; E928-K931 PolarHBondContact OE2-NZ 2.87Å; E928-Q932 WeakPolarHBondContact O-CB 3.48Å; E928-Q932 PolarHBondContact O-N 2.89Å
929	V	96.3	Very high	94.6	Very high	87 Å²	87	102.3 Å²	102.3	53%	0.527	49%	0.488	S	S	.	.	H	α-helix	trans	-62.6	-40.8	172.7	169.5	0	0	0	0	111.6	L925 K931 Q932 L933	L925-V929 WeakPolarHBondContact O-CB 3.3Å; L925-V929 VanDerWaalsContact O-CG2 3.29Å; L925-V929 WeakPolarHBondContact O-CG2 3.4Å; L925-V929 PolarHBondContact O-N 3.35Å; V929-K931 VanDerWaalsContact C-N 3.33Å; V929-K931 PolarHBondContact O-N 3.49Å; V929-Q932 PolarHBondContact O-N 3.37Å; V929-L933 HydrophobicContact CG1-CD1 4.12Å; V929-L933 WeakPolarHBondContact O-CG 3.44Å; V929-L933 PolarHBondContact O-N 2.89Å
930	K	95	Very high	94.6	Very high	158 Å²	158	100.3 Å²	100.3	69%	0.687	49%	0.488	S	S	*	.	H	α-helix	trans	-62.9	-39.8	175.1	-176.7	178.6	178.4	-178.7	0	111.9	I926 A927 E928 E934	I926-K930 WeakPolarHBondContact O-CB 3.46Å; I926-K930 PolarHBondContact O-N 3.34Å; A927-K930 PolarHBondContact O-N 2.88Å; E928-K930 PolarHBondContact O-N 3.25Å; K930-E934 PolarHBondContact O-N 3.34Å; K930-E934 VanDerWaalsContact O-N 3.11Å
931	K	96.9	Very high	94.5	Very high	124 Å²	124	97.5 Å²	97.5	54%	0.539	48%	0.479	S	S	.	.	H	α-helix	trans	-67.5	-38.8	176.4	168.4	166.9	154.1	-93.6	0	112.1	A927 E928 V929 L935	A927-K931 WeakPolarHBondContact O-CB 3.38Å; A927-K931 PolarHBondContact O-N 2.91Å; E928-K931 PolarHBondContact O-N 3.02Å; E928-K931 IonicContact OE1-NZ 2.69Å; E928-K931 PolarHBondContact OE1-NZ 3.46Å; E928-K931 IonicContact OE2-NZ 2.59Å; E928-K931 PolarHBondContact OE2-NZ 2.87Å; V929-K931 VanDerWaalsContact C-N 3.33Å; V929-K931 PolarHBondContact O-N 3.49Å; K931-L935 PolarHBondContact O-N 3.43Å; K931-L935 VanDerWaalsContact O-N 3.1Å
932	Q	94.4	Very high	94.6	Very high	83 Å²	83	96.2 Å²	96.2	39%	0.388	47%	0.474	S	S	.	.	H	α-helix	trans	-64.2	-46.7	173.8	-177.1	61.7	22.7	0	0	111.6	E928 V929 E934 L935 E936	E928-Q932 WeakPolarHBondContact O-CB 3.48Å; E928-Q932 PolarHBondContact O-N 2.89Å; V929-Q932 PolarHBondContact O-N 3.37Å; Q932-E934 VanDerWaalsContact C-N 3.34Å; Q932-E934 PolarHBondContact O-N 3.07Å; Q932-L935 WeakPolarHBondContact O-CB 3.35Å; Q932-L935 PolarHBondContact O-N 2.86Å; Q932-L935 VanDerWaalsContact O-N 3.12Å; Q932-E936 WeakPolarHBondContact CG-OE1 3.29Å; Q932-E936 PolarHBondContact NE2-OE1 3.05Å; Q932-E936 WeakPolarHBondContact O-CG 3.5Å; Q932-E936 PolarHBondContact O-N 3.29Å
933	L	95.3	Very high	94.7	Very high	102 Å²	102	96.6 Å²	96.6	53%	0.534	48%	0.481	S	S	.	.	H	α-helix	trans	-61.7	-37.7	177.3	-76.3	167.9	0	0	0	113	V929 K937	V929-L933 HydrophobicContact CG1-CD1 4.12Å; V929-L933 WeakPolarHBondContact O-CG 3.44Å; V929-L933 PolarHBondContact O-N 2.89Å; L933-K937 WeakPolarHBondContact O-CB 3.48Å; L933-K937 PolarHBondContact O-N 3.34Å
934	E	94.6	Very high	94.5	Very high	101 Å²	101	96.5 Å²	96.5	47%	0.472	48%	0.483	S	S	.	.	H	α-helix	trans	-69.9	-33	175.5	-169.8	62.6	-146	0	0	111.7	K930 Q932 K937 Q938	K930-E934 PolarHBondContact O-N 3.34Å; K930-E934 VanDerWaalsContact O-N 3.11Å; Q932-E934 VanDerWaalsContact C-N 3.34Å; Q932-E934 PolarHBondContact O-N 3.07Å; E934-K937 IonicContact OE1-NZ 2.66Å; E934-K937 PolarHBondContact OE1-NZ 3.16Å; E934-K937 WeakPolarHBondContact OE2-CD 3.25Å; E934-K937 IonicContact OE2-NZ 2.68Å; E934-K937 PolarHBondContact OE2-NZ 3Å; E934-Q938 WeakPolarHBondContact O-CB 3.44Å; E934-Q938 PolarHBondContact O-N 2.84Å
935	L	96.1	Very high	94.3	Very high	89 Å²	89	95.3 Å²	95.3	47%	0.466	48%	0.483	S	S	.	.	H	α-helix	trans	-66.8	-47.3	172.2	-172.3	77.5	0	0	0	111.8	K931 Q932 Q938 Q939	K931-L935 PolarHBondContact O-N 3.43Å; K931-L935 VanDerWaalsContact O-N 3.1Å; Q932-L935 WeakPolarHBondContact O-CB 3.35Å; Q932-L935 PolarHBondContact O-N 2.86Å; Q932-L935 VanDerWaalsContact O-N 3.12Å; L935-Q938 PolarHBondContact O-N 2.98Å; L935-Q939 WeakPolarHBondContact O-CG 3.41Å; L935-Q939 PolarHBondContact O-N 3.34Å
936	E	94.5	Very high	94.2	Very high	85 Å²	85	97.7 Å²	97.7	40%	0.397	49%	0.489	S	S	.	.	H	α-helix	trans	-63.8	-43.1	178.7	-73.4	165.7	178.2	0	0	111.4	Q932 Q938 Q939 A940	Q932-E936 WeakPolarHBondContact CG-OE1 3.29Å; Q932-E936 PolarHBondContact NE2-OE1 3.05Å; Q932-E936 WeakPolarHBondContact O-CG 3.5Å; Q932-E936 PolarHBondContact O-N 3.29Å; E936-Q938 PolarHBondContact O-N 2.89Å; E936-Q939 PolarHBondContact O-N 2.79Å; E936-A940 WeakPolarHBondContact O-CB 3.19Å; E936-A940 PolarHBondContact O-N 2.64Å
937	K	96.3	Very high	94.1	Very high	116 Å²	116	96.9 Å²	96.9	50%	0.504	48%	0.481	S	S	.	.	H	α-helix	trans	-56.4	-46.4	170.3	171.6	-169.6	166.8	-145.6	0	111.8	L933 E934 A940 V941	L933-K937 WeakPolarHBondContact O-CB 3.48Å; L933-K937 PolarHBondContact O-N 3.34Å; E934-K937 IonicContact OE1-NZ 2.66Å; E934-K937 PolarHBondContact OE1-NZ 3.16Å; E934-K937 WeakPolarHBondContact OE2-CD 3.25Å; E934-K937 IonicContact OE2-NZ 2.68Å; E934-K937 PolarHBondContact OE2-NZ 3Å; K937-A940 PolarHBondContact O-N 3.29Å; K937-V941 WeakPolarHBondContact O-CB 3.36Å; K937-V941 VanDerWaalsContact O-CG2 3.3Å; K937-V941 WeakPolarHBondContact O-CG2 3.38Å; K937-V941 PolarHBondContact O-N 3.19Å
938	Q	95.1	Very high	93.9	Very high	85 Å²	85	98.6 Å²	98.6	40%	0.397	48%	0.479	S	S	.	.	H	α-helix	trans	-65.1	-40.8	177.8	-176.6	59.6	44.6	0	0	111.6	E934 L935 E936 V941 D942	E934-Q938 WeakPolarHBondContact O-CB 3.44Å; E934-Q938 PolarHBondContact O-N 2.84Å; L935-Q938 PolarHBondContact O-N 2.98Å; E936-Q938 PolarHBondContact O-N 2.89Å; Q938-V941 PolarHBondContact O-N 2.92Å; Q938-D942 VanDerWaalsContact NE2-CG 3.26Å; Q938-D942 PolarHBondContact NE2-OD1 3.08Å; Q938-D942 PolarHBondContact NE2-OD2 3.47Å; Q938-D942 WeakPolarHBondContact O-CB 3.37Å; Q938-D942 PolarHBondContact O-N 2.62Å
939	Q	95.4	Very high	93.8	Very high	108 Å²	108	98.5 Å²	98.5	51%	0.505	48%	0.475	S	S	.	.	H	α-helix	trans	-61.3	-48.7	174.2	-72.6	173.5	5.5	0	0	111.5	L935 E936 V941 D942 E943	L935-Q939 WeakPolarHBondContact O-CG 3.41Å; L935-Q939 PolarHBondContact O-N 3.34Å; E936-Q939 PolarHBondContact O-N 2.79Å; Q939-V941 VanDerWaalsContact C-N 3.31Å; Q939-V941 PolarHBondContact O-N 2.94Å; Q939-D942 CarbonylContact O-C 3.55Å; Q939-D942 PolarHBondContact O-N 3.41Å; Q939-D942 VanDerWaalsContact O-N 3.1Å; Q939-E943 WeakPolarHBondContact O-CG 3.35Å; Q939-E943 PolarHBondContact O-N 3.04Å
940	A	91.9	Very high	93.6	Very high	53 Å²	53	94.5 Å²	94.5	44%	0.438	45%	0.451	S	S	.	.	H	α-helix	trans	-60.7	-38.9	177.2	0	0	0	0	0	112.4	E936 K937 T944	E936-A940 WeakPolarHBondContact O-CB 3.19Å; E936-A940 PolarHBondContact O-N 2.64Å; K937-A940 PolarHBondContact O-N 3.29Å; A940-T944 VanDerWaalsContact O-CB 3.29Å; A940-T944 WeakPolarHBondContact O-CB 3.05Å; A940-T944 PolarHBondContact O-N 2.95Å; A940-T944 PolarHBondContact O-OG1 3Å
941	V	92.5	Very high	93.4	Very high	60 Å²	60	89.1 Å²	89.1	36%	0.364	44%	0.436	S	S	.	.	H	α-helix	trans	-63.1	-43.2	172.5	163.2	0	0	0	0	111.5	K937 Q938 Q939 T944 K945	K937-V941 WeakPolarHBondContact O-CB 3.36Å; K937-V941 VanDerWaalsContact O-CG2 3.3Å; K937-V941 WeakPolarHBondContact O-CG2 3.38Å; K937-V941 PolarHBondContact O-N 3.19Å; Q938-V941 PolarHBondContact O-N 2.92Å; Q939-V941 VanDerWaalsContact C-N 3.31Å; Q939-V941 PolarHBondContact O-N 2.94Å; V941-T944 WeakPolarHBondContact O-CB 3.48Å; V941-T944 PolarHBondContact O-N 2.85Å; V941-K945 HydrophobicContact CG1-CD 4.44Å; V941-K945 VanDerWaalsContact CG1-CE 3.47Å; V941-K945 WeakPolarHBondContact O-CG 3.46Å; V941-K945 PolarHBondContact O-N 3.26Å
942	D	94.4	Very high	93.2	Very high	56 Å²	56	86.8 Å²	86.8	30%	0.299	43%	0.429	S	S	.	.	H	α-helix	trans	-78.6	-22.2	-179.1	-68.6	-26.1	0	0	0	113.5	Q938 Q939 K945 K946	Q938-D942 VanDerWaalsContact NE2-CG 3.26Å; Q938-D942 PolarHBondContact NE2-OD1 3.08Å; Q938-D942 PolarHBondContact NE2-OD2 3.47Å; Q938-D942 WeakPolarHBondContact O-CB 3.37Å; Q938-D942 PolarHBondContact O-N 2.62Å; Q939-D942 CarbonylContact O-C 3.55Å; Q939-D942 PolarHBondContact O-N 3.41Å; Q939-D942 VanDerWaalsContact O-N 3.1Å; D942-K945 WeakPolarHBondContact OD1-CD 3.17Å; D942-K945 IonicContact OD1-NZ 2.71Å; D942-K945 PolarHBondContact OD1-NZ 3.47Å; D942-K946 WeakPolarHBondContact O-CD 3.24Å; D942-K946 WeakPolarHBondContact O-CE 3.47Å; D942-K946 VanDerWaalsContact O-CG 3.28Å; D942-K946 WeakPolarHBondContact O-CG 3.42Å
943	E	93.5	Very high	93.1	Very high	123 Å²	123	84.4 Å²	84.4	58%	0.575	42%	0.422	S	S	*	.	H	α-helix	trans	-72.1	-40.8	163.3	-68.9	-159.9	147.7	0	0	112	Q939 K945 K946 K947	Q939-E943 WeakPolarHBondContact O-CG 3.35Å; Q939-E943 PolarHBondContact O-N 3.04Å; E943-K945 VanDerWaalsContact C-N 3.29Å; E943-K945 PolarHBondContact O-N 2.84Å; E943-K946 PolarHBondContact O-N 2.74Å; E943-K947 PolarHBondContact O-N 2.97Å
944	T	89.4	Confident	93	Very high	70 Å²	70	87.9 Å²	87.9	43%	0.429	43%	0.432	S	S	.	.	H	α-helix	trans	-58.1	-42.5	174.9	-61.4	0	0	0	0	110.9	A940 V941 K946 K947 W949	A940-T944 VanDerWaalsContact O-CB 3.29Å; A940-T944 WeakPolarHBondContact O-CB 3.05Å; A940-T944 PolarHBondContact O-N 2.95Å; A940-T944 PolarHBondContact O-OG1 3Å; V941-T944 WeakPolarHBondContact O-CB 3.48Å; V941-T944 PolarHBondContact O-N 2.85Å; T944-K946 VanDerWaalsContact C-N 3.3Å; T944-K946 PolarHBondContact O-N 3.46Å; T944-K947 PolarHBondContact O-N 2.69Å; T944-W949 HydrophobicContact CG2-CH2 4.28Å; T944-W949 HydrophobicContact CG2-CZ2 3.55Å; T944-W949 WeakPolarHBondContact O-CZ2 3.35Å; T944-W949 PolarHBondContact O-NE1 3.12Å
945	K	91.3	Very high	92.9	Very high	140 Å²	140	89.6 Å²	89.6	61%	0.609	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-23.2	175.6	-70.7	170.2	-165.4	160	0	115.1	V941 D942 E943	V941-K945 HydrophobicContact CG1-CD 4.44Å; V941-K945 VanDerWaalsContact CG1-CE 3.47Å; V941-K945 WeakPolarHBondContact O-CG 3.46Å; V941-K945 PolarHBondContact O-N 3.26Å; D942-K945 WeakPolarHBondContact OD1-CD 3.17Å; D942-K945 IonicContact OD1-NZ 2.71Å; D942-K945 PolarHBondContact OD1-NZ 3.47Å; E943-K945 VanDerWaalsContact C-N 3.29Å; E943-K945 PolarHBondContact O-N 2.84Å
946	K	91.4	Very high	92.7	Very high	155 Å²	155	89.7 Å²	89.7	67%	0.674	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.2	-22.1	178.4	-68.7	161.4	-159.2	154.4	0	112.4	D942 E943 T944	D942-K946 WeakPolarHBondContact O-CD 3.24Å; D942-K946 WeakPolarHBondContact O-CE 3.47Å; D942-K946 VanDerWaalsContact O-CG 3.28Å; D942-K946 WeakPolarHBondContact O-CG 3.42Å; E943-K946 PolarHBondContact O-N 2.74Å; T944-K946 VanDerWaalsContact C-N 3.3Å; T944-K946 PolarHBondContact O-N 3.46Å
947	K	91.1	Very high	92.6	Very high	82 Å²	82	85.9 Å²	85.9	36%	0.357	42%	0.419	S	S	.	.	S	Bend	trans	-86.4	153.7	-178.2	-68.9	179.7	167.2	-150.3	0	111.4	E943 T944 W949 E956	E943-K947 PolarHBondContact O-N 2.97Å; T944-K947 PolarHBondContact O-N 2.69Å; K947-W949 HydrophobicContact CB-CH2 4.44Å; K947-W949 HydrophobicContact CB-CZ2 3.62Å; K947-W949 HydrophobicContact CD-CH2 4.3Å; K947-W949 HydrophobicContact CD-CZ2 4.11Å; K947-W949 HydrophobicContact CG-CZ2 4.44Å; K947-W949 VanDerWaalsContact O-CD1 3.25Å; K947-W949 PolarHBondContact O-NE1 3.39Å; K947-W949 VanDerWaalsContact O-NE1 3.09Å; K947-E956 HydrophobicContact CD-CG 4.33Å; K947-E956 WeakPolarHBondContact CD-OE1 3.28Å; K947-E956 WeakPolarHBondContact CE-OE1 3.43Å; K947-E956 WeakPolarHBondContact CG-OE1 3.43Å; K947-E956 IonicContact NZ-OE1 3.16Å; K947-E956 PolarHBondContact NZ-OE1 3.16Å; K947-E956 IonicContact NZ-OE2 3Å; K947-E956 PolarHBondContact NZ-OE2 2.79Å
948	Q	90.1	Very high	92.3	Very high	95 Å²	95	85.4 Å²	85.4	44%	0.444	42%	0.421	S	S	.	.			trans	-94.8	144.2	169.9	-72.4	-63.5	-39.1	0	0	109.5	A957 Y960	Q948-A957 HydrophobicContact CB-CB 4.45Å; Q948-A957 PolarHBondContact O-N 3.39Å; Q948-Y960 HydrophobicContact CB-CE1 3.82Å; Q948-Y960 HydrophobicContact CG-CE1 3.94Å
949	W	93.4	Very high	92	Very high	96 Å²	96	86.1 Å²	86.1	36%	0.364	42%	0.423	S	S	.	.	B	Isolated β-bridge	trans	-121.1	143.6	-167.5	-62.3	96.5	0	0	0	111.4	T944 K947 A951 K954 E956	T944-W949 HydrophobicContact CG2-CH2 4.28Å; T944-W949 HydrophobicContact CG2-CZ2 3.55Å; T944-W949 WeakPolarHBondContact O-CZ2 3.35Å; T944-W949 PolarHBondContact O-NE1 3.12Å; K947-W949 HydrophobicContact CB-CH2 4.44Å; K947-W949 HydrophobicContact CB-CZ2 3.62Å; K947-W949 HydrophobicContact CD-CH2 4.3Å; K947-W949 HydrophobicContact CD-CZ2 4.11Å; K947-W949 HydrophobicContact CG-CZ2 4.44Å; K947-W949 VanDerWaalsContact O-CD1 3.25Å; K947-W949 PolarHBondContact O-NE1 3.39Å; K947-W949 VanDerWaalsContact O-NE1 3.09Å; W949-A951 PolarHBondContact O-N 2.89Å; W949-K954 VanDerWaalsContact CE3-O 3.26Å; W949-E956 HydrophobicContact CZ3-CB 4.31Å
950	C	93.5	Very high	91.7	Very high	3 Å²	3	88.2 Å²	88.2	2%	0.02	43%	0.427	C	S	.	.	B	Isolated β-bridge	trans	-71.7	123.5	178.1	179.5	0	0	0	0	110.5	N952 C953 K954 K955 S966 C968	C950-N952 VanDerWaalsContact C-N 3.29Å; C950-N952 PolarHBondContact O-N 3.34Å; C950-C953 HydrophobicContact CB-CB 4.31Å; C950-C953 WeakPolarHBondContact CB-SG 3.37Å; C950-C953 PolarHBondContact SG-N 2.87Å; C950-K954 WeakPolarHBondContact O-CA 3.42Å; C950-K954 PolarHBondContact O-N 2.97Å; C950-K955 WeakPolarHBondContact CB-O 3.43Å; C950-K955 PolarHBondContact N-O 3.29Å; C950-S966 VanDerWaalsContact CA-O 3.3Å; C950-S966 WeakPolarHBondContact CA-O 3.14Å; C950-C968 HydrophobicContact CB-CB 3.71Å; C950-C968 PolarHBondContact SG-N 3.38Å; C950-C968 VanDerWaalsContact SG-N 3.36Å
951	A	90.6	Very high	91.5	Very high	46 Å²	46	86.1 Å²	86.1	38%	0.38	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-42.7	178.9	0	0	0	0	0	112.6	W949 T965 S966 Y967 H976	W949-A951 PolarHBondContact O-N 2.89Å; A951-T965 HydrophobicContact CB-CG2 4.02Å; A951-S966 PolarHBondContact N-O 3.31Å; A951-S966 VanDerWaalsContact N-O 3.07Å; A951-Y967 HydrophobicContact CB-CE1 4.32Å; A951-H976 VanDerWaalsContact CB-CE1 3.44Å; A951-H976 WeakPolarHBondContact CB-CE1 3.16Å
952	N	92.1	Very high	91.3	Very high	74 Å²	74	84.2 Å²	84.2	40%	0.396	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-62.5	175.4	-170.6	56.4	0	0	0	113.4	C950 C972 H976	C950-N952 VanDerWaalsContact C-N 3.29Å; C950-N952 PolarHBondContact O-N 3.34Å; N952-C972 HydrophobicContact CB-CB 4.07Å; N952-C972 WeakPolarHBondContact CB-O 3.28Å; N952-C972 PolarHBondContact ND2-SG 2.94Å; N952-H976 HydrophobicContact CB-CB 3.99Å
953	C	92.9	Very high	90.8	Very high	34 Å²	34	93.2 Å²	93.2	23%	0.23	43%	0.428	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.5	-7.8	-163.1	88.5	0	0	0	0	115.3	C950 K955 C968 C972	C950-C953 HydrophobicContact CB-CB 4.31Å; C950-C953 WeakPolarHBondContact CB-SG 3.37Å; C950-C953 PolarHBondContact SG-N 2.87Å; C953-K955 PolarHBondContact O-N 3.47Å; C953-K955 WeakPolarHBondContact SG-CB 3.48Å; C953-K955 VanDerWaalsContact SG-CG 3.54Å; C953-K955 PolarHBondContact SG-N 3.24Å; C953-K955 VanDerWaalsContact SG-N 3.39Å; C953-C968 WeakPolarHBondContact CB-SG 3.39Å; C953-C968 WeakPolarHBondContact SG-CB 3.41Å; C953-C968 CovalentContact SG-SG 2.04Å; C953-C968 PolarHBondContact SG-SG 3.38Å; C953-C972 HydrophobicContact CB-CB 4.43Å
954	K	92.5	Very high	90.4	Very high	174 Å²	174	94 Å²	94	76%	0.757	44%	0.436	S	S	*	.			trans	53.4	9.6	-174.8	-59.6	-179.6	-177.2	174.6	0	116.6	W949 C950	W949-K954 VanDerWaalsContact CE3-O 3.26Å; C950-K954 WeakPolarHBondContact O-CA 3.42Å; C950-K954 PolarHBondContact O-N 2.97Å
955	K	92.3	Very high	90.5	Very high	138 Å²	138	91.3 Å²	91.3	60%	0.6	42%	0.42	S	S	*	.	S	Bend	trans	-77.5	166.4	164.3	-51.5	172	-173.1	170.7	0	110	C950 C953 A957 C968	C950-K955 WeakPolarHBondContact CB-O 3.43Å; C950-K955 PolarHBondContact N-O 3.29Å; C953-K955 PolarHBondContact O-N 3.47Å; C953-K955 WeakPolarHBondContact SG-CB 3.48Å; C953-K955 VanDerWaalsContact SG-CG 3.54Å; C953-K955 PolarHBondContact SG-N 3.24Å; C953-K955 VanDerWaalsContact SG-N 3.39Å; K955-A957 PolarHBondContact O-N 3.09Å; K955-C968 HydrophobicContact CB-CB 4.08Å
956	E	93.1	Very high	90.6	Very high	91 Å²	91	84.9 Å²	84.9	43%	0.425	39%	0.393	S	S	.	.	B	Isolated β-bridge	trans	-54.6	134.3	172.1	-175.8	164.4	-157.4	0	0	110.8	K947 W949 C968	K947-E956 HydrophobicContact CD-CG 4.33Å; K947-E956 WeakPolarHBondContact CD-OE1 3.28Å; K947-E956 WeakPolarHBondContact CE-OE1 3.43Å; K947-E956 WeakPolarHBondContact CG-OE1 3.43Å; K947-E956 IonicContact NZ-OE1 3.16Å; K947-E956 PolarHBondContact NZ-OE1 3.16Å; K947-E956 IonicContact NZ-OE2 3Å; K947-E956 PolarHBondContact NZ-OE2 2.79Å; W949-E956 HydrophobicContact CZ3-CB 4.31Å; E956-C968 WeakPolarHBondContact O-CB 3.48Å
957	A	91.9	Very high	90.7	Very high	4 Å²	4	77.6 Å²	77.6	3%	0.033	36%	0.361	C	S	.	.	P	Polyproline II helix	trans	-93.7	136.6	-176.6	0	0	0	0	0	111.9	Q948 K955 Y967	Q948-A957 HydrophobicContact CB-CB 4.45Å; Q948-A957 PolarHBondContact O-N 3.39Å; K955-A957 PolarHBondContact O-N 3.09Å; A957-Y967 CarbonylContact C-O 3.53Å; A957-Y967 WeakPolarHBondContact CA-O 3.38Å; A957-Y967 WeakPolarHBondContact CB-O 3.44Å
958	I	90.3	Very high	90.8	Very high	106 Å²	106	74.3 Å²	74.3	54%	0.544	35%	0.348	S	S	.	.			trans	-113.3	-14.5	178	66.2	-179.9	0	0	0	112.4	Y967 C968	I958-Y967 PolarHBondContact N-O 2.89Å; I958-C968 WeakPolarHBondContact CD1-O 3.42Å; I958-C968 WeakPolarHBondContact CG1-O 3.19Å
959	F	87.6	Confident	91	Very high	100 Å²	100	72.4 Å²	72.4	44%	0.439	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	134.2	176	-58.3	-63.1	0	0	0	110.4	S966 Y967	F959-S966 CarbonylContact O-C 3.53Å; F959-S966 VanDerWaalsContact O-CA 3.28Å; F959-S966 WeakPolarHBondContact O-CA 3.29Å; F959-S966 WeakPolarHBondContact O-CB 3.34Å; F959-Y967 PolarHBondContact N-O 2.95Å; F959-Y967 PolarHBondContact O-N 2.86Å
960	Y	90	Very high	91	Very high	153 Å²	153	74.4 Å²	74.4	60%	0.6	35%	0.349	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.1	122.5	-177.3	-53.8	-74	0	0	0	109.6	Q948 S966	Q948-Y960 HydrophobicContact CB-CE1 3.82Å; Q948-Y960 HydrophobicContact CG-CE1 3.94Å; Y960-S966 WeakPolarHBondContact CD1-OG 3.3Å
961	C	88.6	Confident	91	Very high	9 Å²	9	78.2 Å²	78.2	6%	0.061	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	-33.1	-173.1	-166.4	0	0	0	0	113	T965 Y967 Q986	C961-T965 WeakPolarHBondContact CB-O 3.37Å; C961-T965 PolarHBondContact N-O 3.36Å; C961-Y967 HydrophobicContact CB-CD2 3.94Å; C961-Y967 HydrophobicContact CB-CE2 3.54Å; C961-Q986 WeakPolarHBondContact O-CG 3.45Å; C961-Q986 PolarHBondContact O-NE2 3.32Å; C961-Q986 VanDerWaalsContact O-NE2 3.16Å; C961-Q986 PolarHBondContact O-OE1 3.47Å
962	C	88.2	Confident	91.2	Very high	19 Å²	19	76.8 Å²	76.8	13%	0.128	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.7	179.2	164.8	79.8	0	0	0	0	109.6	N964 T965	C962-N964 PolarHBondContact O-N 3.3Å; C962-N964 PolarHBondContact SG-N 3.34Å; C962-T965 PolarHBondContact N-O 2.7Å; C962-T965 PolarHBondContact O-N 2.98Å
963	W	83.1	Confident	91.1	Very high	245 Å²	245	75.5 Å²	75.5	93%	0.928	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51	-32.6	179.1	178.6	-95.2	0	0	0	114.3
964	N	85.4	Confident	91.1	Very high	139 Å²	139	79 Å²	79	74%	0.743	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.4	14.3	-175	-155.6	57.7	0	0	0	113.3	C962	C962-N964 PolarHBondContact O-N 3.3Å; C962-N964 PolarHBondContact SG-N 3.34Å
965	T	90.8	Very high	91	Very high	15 Å²	15	73.7 Å²	73.7	9%	0.092	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	125	-177.1	-55.5	0	0	0	0	112.8	A951 C961 C962 Y967 H980	A951-T965 HydrophobicContact CB-CG2 4.02Å; C961-T965 WeakPolarHBondContact CB-O 3.37Å; C961-T965 PolarHBondContact N-O 3.36Å; C962-T965 PolarHBondContact N-O 2.7Å; C962-T965 PolarHBondContact O-N 2.98Å; T965-Y967 HydrophobicContact CG2-CE1 4.2Å; T965-Y967 HydrophobicContact CG2-CE2 3.9Å; T965-Y967 VanDerWaalsContact CG2-OH 3.29Å; T965-Y967 WeakPolarHBondContact CG2-OH 3.31Å; T965-H980 WeakPolarHBondContact CB-CE1 3.42Å; T965-H980 PolarHBondContact OG1-CE1 3.4Å; T965-H980 PolarHBondContact OG1-ND1 2.87Å
966	S	93.4	Very high	91	Very high	5 Å²	5	68.8 Å²	68.8	4%	0.035	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	163.3	-177.2	-49.7	0	0	0	0	110	C950 A951 F959 Y960	C950-S966 VanDerWaalsContact CA-O 3.3Å; C950-S966 WeakPolarHBondContact CA-O 3.14Å; A951-S966 PolarHBondContact N-O 3.31Å; A951-S966 VanDerWaalsContact N-O 3.07Å; F959-S966 CarbonylContact O-C 3.53Å; F959-S966 VanDerWaalsContact O-CA 3.28Å; F959-S966 WeakPolarHBondContact O-CA 3.29Å; F959-S966 WeakPolarHBondContact O-CB 3.34Å; Y960-S966 WeakPolarHBondContact CD1-OG 3.3Å
967	Y	94.2	Very high	90.8	Very high	1 Å²	1	68.4 Å²	68.4	0%	0.004	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	145.7	-174.8	-60.3	-70.6	0	0	0	113.8	A951 A957 I958 F959 C961 T965 C972 Q973 H976 H980	A951-Y967 HydrophobicContact CB-CE1 4.32Å; A957-Y967 CarbonylContact C-O 3.53Å; A957-Y967 WeakPolarHBondContact CA-O 3.38Å; A957-Y967 WeakPolarHBondContact CB-O 3.44Å; I958-Y967 PolarHBondContact N-O 2.89Å; F959-Y967 PolarHBondContact N-O 2.95Å; F959-Y967 PolarHBondContact O-N 2.86Å; C961-Y967 HydrophobicContact CB-CD2 3.94Å; C961-Y967 HydrophobicContact CB-CE2 3.54Å; T965-Y967 HydrophobicContact CG2-CE1 4.2Å; T965-Y967 HydrophobicContact CG2-CE2 3.9Å; T965-Y967 VanDerWaalsContact CG2-OH 3.29Å; T965-Y967 WeakPolarHBondContact CG2-OH 3.31Å; Y967-C972 WeakPolarHBondContact CD1-O 3.16Å; Y967-Q973 HydrophobicContact CD1-CB 4.13Å; Y967-Q973 HydrophobicContact CD2-CB 3.65Å; Y967-Q973 HydrophobicContact CD2-CG 3.67Å; Y967-Q973 HydrophobicContact CE1-CB 4.48Å; Y967-Q973 HydrophobicContact CE2-CB 4.03Å; Y967-Q973 HydrophobicContact CE2-CG 3.65Å; Y967-Q973 HydrophobicContact CG-CB 3.7Å; Y967-Q973 HydrophobicContact CG-CG 4.25Å; Y967-H976 HydrophobicContact CE1-CB 4.03Å; Y967-H976 AromaticContact CE1-ND1 3.5Å; Y967-H976 WeakPolarHBondContact CE1-ND1 3.47Å; Y967-H976 AromaticContact CZ-ND1 3.63Å; Y967-H976 PolarHBondContact OH-ND1 3.09Å; Y967-H980 PolarHBondContact OH-CD2 2.92Å
968	C	93.6	Very high	90.7	Very high	13 Å²	13	71.7 Å²	71.7	9%	0.088	35%	0.35	C	S	.	.	S	Bend	trans	-81.4	-29.9	177.5	58.4	0	0	0	0	112.7	C950 C953 K955 E956 I958	C950-C968 HydrophobicContact CB-CB 3.71Å; C950-C968 PolarHBondContact SG-N 3.38Å; C950-C968 VanDerWaalsContact SG-N 3.36Å; C953-C968 WeakPolarHBondContact CB-SG 3.39Å; C953-C968 WeakPolarHBondContact SG-CB 3.41Å; C953-C968 CovalentContact SG-SG 2.04Å; C953-C968 PolarHBondContact SG-SG 3.38Å; K955-C968 HydrophobicContact CB-CB 4.08Å; E956-C968 WeakPolarHBondContact O-CB 3.48Å; I958-C968 WeakPolarHBondContact CD1-O 3.42Å; I958-C968 WeakPolarHBondContact CG1-O 3.19Å
969	D	93.5	Very high	90.6	Very high	55 Å²	55	73 Å²	73	29%	0.294	35%	0.353	S	S	.	.	S	Bend	trans	-155.9	172	173.7	57.4	45.7	0	0	0	110.9	P971 C972 Q973	D969-P971 VanDerWaalsContact OD1-CD 3.32Å; D969-P971 WeakPolarHBondContact OD1-CD 3.44Å; D969-C972 PolarHBondContact O-N 3.11Å; D969-C972 WeakPolarHBondContact OD1-CB 3.48Å; D969-C972 PolarHBondContact OD1-N 2.99Å; D969-C972 PolarHBondContact OD1-SG 3.01Å; D969-Q973 PolarHBondContact O-N 3.44Å; D969-Q973 VanDerWaalsContact O-N 3.1Å
970	Y	92.9	Very high	90.7	Very high	138 Å²	138	68.5 Å²	68.5	54%	0.541	33%	0.333	S	S	.	.	H	α-helix	trans	-68.6	-38.5	-179.9	-176	-115	0	0	0	113.9	C972 Q973 Q974	Y970-C972 VanDerWaalsContact C-N 3.3Å; Y970-C972 PolarHBondContact O-N 3.27Å; Y970-Q973 WeakPolarHBondContact O-CB 3.45Å; Y970-Q973 PolarHBondContact O-N 3.22Å; Y970-Q973 VanDerWaalsContact O-N 3.13Å; Y970-Q974 HydrophobicContact CD1-CG 4.42Å; Y970-Q974 HydrophobicContact CE1-CG 4.05Å; Y970-Q974 HydrophobicContact CE2-CG 4.31Å; Y970-Q974 PolarHBondContact O-N 2.93Å; Y970-Q974 PolarHBondContact OH-NE2 3.16Å
971	P	95	Very high	90.6	Very high	83 Å²	83	65.5 Å²	65.5	54%	0.539	33%	0.326	S	S	.	.	H	α-helix	trans	-54.9	-41.6	168.7	-28.9	36.4	0	0	0	113.8	D969 Q973 Q974 A975	D969-P971 VanDerWaalsContact OD1-CD 3.32Å; D969-P971 WeakPolarHBondContact OD1-CD 3.44Å; P971-Q973 VanDerWaalsContact C-N 3.33Å; P971-Q973 PolarHBondContact O-N 3.1Å; P971-Q974 PolarHBondContact O-N 3.45Å; P971-A975 WeakPolarHBondContact O-CB 3.34Å; P971-A975 PolarHBondContact O-N 3.06Å
972	C	92.9	Very high	90.5	Very high	17 Å²	17	73.5 Å²	73.5	12%	0.115	36%	0.36	C	S	.	.	H	α-helix	trans	-71.4	-26.6	176.7	-70.1	0	0	0	0	113.3	N952 C953 Y967 D969 Y970	N952-C972 HydrophobicContact CB-CB 4.07Å; N952-C972 WeakPolarHBondContact CB-O 3.28Å; N952-C972 PolarHBondContact ND2-SG 2.94Å; C953-C972 HydrophobicContact CB-CB 4.43Å; Y967-C972 WeakPolarHBondContact CD1-O 3.16Å; D969-C972 PolarHBondContact O-N 3.11Å; D969-C972 WeakPolarHBondContact OD1-CB 3.48Å; D969-C972 PolarHBondContact OD1-N 2.99Å; D969-C972 PolarHBondContact OD1-SG 3.01Å; Y970-C972 VanDerWaalsContact C-N 3.3Å; Y970-C972 PolarHBondContact O-N 3.27Å
973	Q	91.8	Very high	90.3	Very high	47 Å²	47	76.6 Å²	76.6	22%	0.22	38%	0.382	C	S	.	.	H	α-helix	trans	-65.7	-52.3	165	-179.4	173	19.2	0	0	110.4	Y967 D969 Y970 P971 A975 H976 W977	Y967-Q973 HydrophobicContact CD1-CB 4.13Å; Y967-Q973 HydrophobicContact CD2-CB 3.65Å; Y967-Q973 HydrophobicContact CD2-CG 3.67Å; Y967-Q973 HydrophobicContact CE1-CB 4.48Å; Y967-Q973 HydrophobicContact CE2-CB 4.03Å; Y967-Q973 HydrophobicContact CE2-CG 3.65Å; Y967-Q973 HydrophobicContact CG-CB 3.7Å; Y967-Q973 HydrophobicContact CG-CG 4.25Å; D969-Q973 PolarHBondContact O-N 3.44Å; D969-Q973 VanDerWaalsContact O-N 3.1Å; Y970-Q973 WeakPolarHBondContact O-CB 3.45Å; Y970-Q973 PolarHBondContact O-N 3.22Å; Y970-Q973 VanDerWaalsContact O-N 3.13Å; P971-Q973 VanDerWaalsContact C-N 3.33Å; P971-Q973 PolarHBondContact O-N 3.1Å; Q973-A975 VanDerWaalsContact C-N 3.35Å; Q973-A975 PolarHBondContact O-N 3.46Å; Q973-H976 PolarHBondContact O-N 3.05Å; Q973-W977 VanDerWaalsContact O-CB 3.27Å; Q973-W977 WeakPolarHBondContact O-CB 3.41Å; Q973-W977 PolarHBondContact O-N 3.19Å
974	Q	91.4	Very high	90.5	Very high	108 Å²	108	65.3 Å²	65.3	51%	0.505	34%	0.34	S	S	.	.	H	α-helix	trans	-59.1	-41.2	-178.7	-72.6	-173.3	-26.8	0	0	113.1	Y970 P971 H976 W977 P978	Y970-Q974 HydrophobicContact CD1-CG 4.42Å; Y970-Q974 HydrophobicContact CE1-CG 4.05Å; Y970-Q974 HydrophobicContact CE2-CG 4.31Å; Y970-Q974 PolarHBondContact O-N 2.93Å; Y970-Q974 PolarHBondContact OH-NE2 3.16Å; P971-Q974 PolarHBondContact O-N 3.45Å; Q974-H976 PolarHBondContact O-N 3.02Å; Q974-W977 PolarHBondContact O-N 3.26Å; Q974-P978 WeakPolarHBondContact O-CD 3.49Å
975	A	91.9	Very high	90.3	Very high	62 Å²	62	63.3 Å²	63.3	51%	0.512	33%	0.333	S	S	.	.	H	α-helix	trans	-62	-43.5	-179.8	0	0	0	0	0	113.1	P971 Q973 P978	P971-A975 WeakPolarHBondContact O-CB 3.34Å; P971-A975 PolarHBondContact O-N 3.06Å; Q973-A975 VanDerWaalsContact C-N 3.35Å; Q973-A975 PolarHBondContact O-N 3.46Å; A975-P978 WeakPolarHBondContact O-CD 2.92Å
976	H	90.7	Very high	89.7	Confident	35 Å²	35	68.5 Å²	68.5	16%	0.162	36%	0.356	C	S	.	.	H	α-helix	trans	-91.8	-6.7	-179	176.6	-107.9	0	0	0	113	A951 N952 Y967 Q973 Q974 E979 H980	A951-H976 VanDerWaalsContact CB-CE1 3.44Å; A951-H976 WeakPolarHBondContact CB-CE1 3.16Å; N952-H976 HydrophobicContact CB-CB 3.99Å; Y967-H976 HydrophobicContact CE1-CB 4.03Å; Y967-H976 AromaticContact CE1-ND1 3.5Å; Y967-H976 WeakPolarHBondContact CE1-ND1 3.47Å; Y967-H976 AromaticContact CZ-ND1 3.63Å; Y967-H976 PolarHBondContact OH-ND1 3.09Å; Q973-H976 PolarHBondContact O-N 3.05Å; Q974-H976 PolarHBondContact O-N 3.02Å; H976-E979 IonicContact CD2-OE2 2.71Å; H976-E979 PolarHBondContact O-N 3.25Å; H976-H980 WeakPolarHBondContact O-CB 3.35Å; H976-H980 PolarHBondContact O-N 3.42Å
977	W	90.1	Very high	88.3	Confident	82 Å²	82	71 Å²	71	31%	0.311	37%	0.374	S	S	.	.	H	α-helix	trans	-58.8	-41.3	-179.8	-173.2	-111	0	0	0	114.7	Q973 Q974 E979 H980 M981 C984	Q973-W977 VanDerWaalsContact O-CB 3.27Å; Q973-W977 WeakPolarHBondContact O-CB 3.41Å; Q973-W977 PolarHBondContact O-N 3.19Å; Q974-W977 PolarHBondContact O-N 3.26Å; W977-E979 PolarHBondContact O-N 3.33Å; W977-H980 AromaticContact CZ3-CD2 3.8Å; W977-H980 PolarHBondContact O-N 3.03Å; W977-M981 HydrophobicContact CD2-CB 4.05Å; W977-M981 HydrophobicContact CG-CB 4.48Å; W977-M981 HydrophobicContact CH2-CB 4.36Å; W977-M981 HydrophobicContact CH2-CG 4.36Å; W977-M981 HydrophobicContact CZ2-CB 3.89Å; W977-M981 HydrophobicContact CZ2-CG 3.67Å; W977-M981 HydrophobicContact CZ2-SD 3.92Å; W977-M981 PolarHBondContact NE1-SD 2.93Å; W977-M981 WeakPolarHBondContact O-CB 3.3Å; W977-M981 PolarHBondContact O-N 3.24Å; W977-C984 HydrophobicContact CH2-CB 4.34Å; W977-C984 HydrophobicContact CZ3-CB 4.36Å
978	P	89.5	Confident	86.6	Confident	74 Å²	74	75.3 Å²	75.3	48%	0.481	41%	0.409	S	S	.	.	H	α-helix	trans	-62.4	-24.5	179.1	-23.9	35.4	0	0	0	114.4	Q974 A975 K982	Q974-P978 WeakPolarHBondContact O-CD 3.49Å; A975-P978 WeakPolarHBondContact O-CD 2.92Å; P978-K982 WeakPolarHBondContact O-CE 3.23Å; P978-K982 PolarHBondContact O-NZ 2.59Å
979	E	87.1	Confident	84.7	Confident	132 Å²	132	80.1 Å²	80.1	62%	0.617	44%	0.439	S	S	*	.	H	α-helix	trans	-87.2	-53.2	173.8	-62.3	177.4	166.1	0	0	109.9	H976 W977 M981	H976-E979 IonicContact CD2-OE2 2.71Å; H976-E979 PolarHBondContact O-N 3.25Å; W977-E979 PolarHBondContact O-N 3.33Å; E979-M981 PolarHBondContact O-N 3.49Å
980	H	89.9	Confident	82.2	Confident	6 Å²	6	81.4 Å²	81.4	3%	0.028	46%	0.457	C	S	.	.	H	α-helix	trans	-62.9	-42.2	-175.1	-177.2	53.3	0	0	0	114.1	T965 Y967 H976 W977 K982 S983 C984	T965-H980 WeakPolarHBondContact CB-CE1 3.42Å; T965-H980 PolarHBondContact OG1-CE1 3.4Å; T965-H980 PolarHBondContact OG1-ND1 2.87Å; Y967-H980 PolarHBondContact OH-CD2 2.92Å; H976-H980 WeakPolarHBondContact O-CB 3.35Å; H976-H980 PolarHBondContact O-N 3.42Å; W977-H980 AromaticContact CZ3-CD2 3.8Å; W977-H980 PolarHBondContact O-N 3.03Å; H980-K982 PolarHBondContact O-N 2.78Å; H980-S983 CarbonylContact O-C 3.57Å; H980-S983 WeakPolarHBondContact O-CA 3.37Å; H980-S983 PolarHBondContact O-N 3.06Å; H980-S983 PolarHBondContact O-OG 2.8Å; H980-C984 PolarHBondContact NE2-SG 3.16Å; H980-C984 PolarHBondContact O-N 3.1Å
981	M	88.1	Confident	79.9	Confident	91 Å²	91	80.8 Å²	80.8	45%	0.448	47%	0.47	S	S	.	.	G	3₁₀ helix	trans	-52.8	-34.5	-174.2	-179.1	175.1	62.2	0	0	112.7	W977 E979 S983 C984	W977-M981 HydrophobicContact CD2-CB 4.05Å; W977-M981 HydrophobicContact CG-CB 4.48Å; W977-M981 HydrophobicContact CH2-CB 4.36Å; W977-M981 HydrophobicContact CH2-CG 4.36Å; W977-M981 HydrophobicContact CZ2-CB 3.89Å; W977-M981 HydrophobicContact CZ2-CG 3.67Å; W977-M981 HydrophobicContact CZ2-SD 3.92Å; W977-M981 PolarHBondContact NE1-SD 2.93Å; W977-M981 WeakPolarHBondContact O-CB 3.3Å; W977-M981 PolarHBondContact O-N 3.24Å; E979-M981 PolarHBondContact O-N 3.49Å; M981-S983 PolarHBondContact O-N 3.06Å; M981-S983 VanDerWaalsContact O-N 3.16Å; M981-C984 PolarHBondContact O-N 2.69Å
982	K	86.5	Confident	77.3	Confident	177 Å²	177	86.3 Å²	86.3	77%	0.77	49%	0.488	S	S	*	.	G	3₁₀ helix	trans	-63.1	-17.8	177.6	-61.4	164.7	-177.9	159	0	113.7	P978 H980	P978-K982 WeakPolarHBondContact O-CE 3.23Å; P978-K982 PolarHBondContact O-NZ 2.59Å; H980-K982 PolarHBondContact O-N 2.78Å
983	S	84.3	Confident	74.5	Confident	84 Å²	84	94.6 Å²	94.6	59%	0.587	53%	0.525	S	S	*	.	G	3₁₀ helix	trans	-127.5	3.4	-178.3	65	0	0	0	0	113.4	H980 M981 T985	H980-S983 CarbonylContact O-C 3.57Å; H980-S983 WeakPolarHBondContact O-CA 3.37Å; H980-S983 PolarHBondContact O-N 3.06Å; H980-S983 PolarHBondContact O-OG 2.8Å; M981-S983 PolarHBondContact O-N 3.06Å; M981-S983 VanDerWaalsContact O-N 3.16Å; S983-T985 PolarHBondContact O-N 3.38Å
984	C	87.8	Confident	72	Confident	7 Å²	7	101 Å²	101	5%	0.047	56%	0.555	C	S	.	*			trans	-76	113	-173.4	-171.2	0	0	0	0	111.1	W977 H980 M981 Q986 S987	W977-C984 HydrophobicContact CH2-CB 4.34Å; W977-C984 HydrophobicContact CZ3-CB 4.36Å; H980-C984 PolarHBondContact NE2-SG 3.16Å; H980-C984 PolarHBondContact O-N 3.1Å; M981-C984 PolarHBondContact O-N 2.69Å; C984-Q986 PolarHBondContact O-N 3.21Å; C984-Q986 VanDerWaalsContact O-N 3.16Å; C984-S987 WeakPolarHBondContact O-CB 3.3Å; C984-S987 PolarHBondContact O-N 3.37Å
985	T	81	Confident	69.3	Low	98 Å²	98	100.5 Å²	100.5	60%	0.601	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.7	-14.2	-177.4	52.7	0	0	0	0	114.4	S983	S983-T985 PolarHBondContact O-N 3.38Å
986	Q	77.2	Confident	66.5	Low	124 Å²	124	105.2 Å²	105.2	58%	0.579	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.1	-22.8	171.1	-64.3	-166.6	5.2	0	0	113.1	C961 C984 A988 T989	C961-Q986 WeakPolarHBondContact O-CG 3.45Å; C961-Q986 PolarHBondContact O-NE2 3.32Å; C961-Q986 VanDerWaalsContact O-NE2 3.16Å; C961-Q986 PolarHBondContact O-OE1 3.47Å; C984-Q986 PolarHBondContact O-N 3.21Å; C984-Q986 VanDerWaalsContact O-N 3.16Å; Q986-A988 PolarHBondContact O-N 3.03Å; Q986-T989 PolarHBondContact O-OG1 2.65Å
987	S	64.9	Low	63.7	Low	58 Å²	58	108.3 Å²	108.3	41%	0.406	62%	0.618	S	S	.	*	G	3₁₀ helix	trans	-69.8	-19.2	177	-60.7	0	0	0	0	113.1	C984 T989	C984-S987 WeakPolarHBondContact O-CB 3.3Å; C984-S987 PolarHBondContact O-N 3.37Å; S987-T989 VanDerWaalsContact C-N 3.33Å; S987-T989 PolarHBondContact O-N 3.36Å
988	A	58.6	Low	61	Low	90 Å²	90	113.2 Å²	113.2	74%	0.744	64%	0.644	S	S	*	*	G	3₁₀ helix	trans	-82.5	-0.6	-178	0	0	0	0	0	114.8	Q986	Q986-A988 PolarHBondContact O-N 3.03Å
989	T	53.7	Low	58.2	Low	115 Å²	115	115.4 Å²	115.4	71%	0.706	66%	0.656	S	S	*	*	G	3₁₀ helix	trans	-122.6	7.7	-168	7.7	0	0	0	0	115.6	Q986 S987	Q986-T989 PolarHBondContact O-OG1 2.65Å; S987-T989 VanDerWaalsContact C-N 3.33Å; S987-T989 PolarHBondContact O-N 3.36Å
990	A	41.2	Very low	55.4	Low	82 Å²	82	115.8 Å²	115.8	68%	0.678	66%	0.662	S	S	*	*	P	Polyproline II helix	trans	-94.4	122.6	178.1	0	0	0	0	0	112.1
991	P	45	Very low	52.6	Low	125 Å²	125	120.4 Å²	120.4	81%	0.812	69%	0.691	S	S	*	*	P	Polyproline II helix	trans	-75.8	148.4	171.2	32	-33.9	0	0	0	111.3
992	Q	40.4	Very low	50	Low	198 Å²	198	124.2 Å²	124.2	93%	0.925	71%	0.708	S	S	*	*	P	Polyproline II helix	trans	-71	143.6	176.7	-62.6	173.8	-83	0	0	111.7
993	Q	33.1	Very low	47.3	Very low	191 Å²	191	120.7 Å²	120.7	89%	0.893	70%	0.701	S	S	*	*			trans	-147.3	153.1	156	-118.5	174.7	-3.7	0	0	110.1
994	E	40.2	Very low	44.9	Very low	182 Å²	182	123.5 Å²	123.5	85%	0.85	71%	0.709	S	S	*	*			trans	-92.3	161.1	-156.5	-62.9	142.5	135.3	0	0	114.3
995	A	34.2	Very low	42.1	Very low	98 Å²	98	129 Å²	129	81%	0.81	74%	0.738	S	S	*	*			trans	-150.5	120.9	158.3	0	0	0	0	0	108.9
996	D	32.3	Very low	39.7	Very low	160 Å²	160	133.1 Å²	133.1	86%	0.856	75%	0.747	S	S	*	*			trans	-76.3	153.4	-172.3	-58.5	-83.1	0	0	0	114.7
997	A	33.3	Very low	37.3	Very low	100 Å²	100	131.1 Å²	131.1	83%	0.826	75%	0.747	S	S	*	*			trans	-149.1	106.7	154.8	0	0	0	0	0	109.6
998	E	31.8	Very low	35.7	Very low	186 Å²	186	132.7 Å²	132.7	87%	0.869	76%	0.758	S	S	*	*			trans	-73.6	150.8	170.7	-63	-176.5	118.2	0	0	111.4
999	V	31.8	Very low	34.5	Very low	120 Å²	120	137.6 Å²	137.6	73%	0.727	77%	0.766	S	S	*	*				166.6	117	119.4	155.4	0	0	0	0	110.6
1000	N	29.2	Very low	33.4	Very low	139 Å²	139	135 Å²	135	74%	0.743	76%	0.762	S	S	*	*			trans	50.8	144.8	145.9	-63.3	-1.1	0	0	0	122.3
1001	T	30.5	Very low	33	Very low	103 Å²	103	137 Å²	137	63%	0.632	77%	0.771	S	S	*	*			cis	-170.8	143.6	-18.2	21.3	0	0	0	0	107.8
1002	E	33.3	Very low	32.4	Very low	171 Å²	171	135.8 Å²	135.8	80%	0.799	77%	0.766	S	S	*	*			trans	61.4	150.1	147.9	-62.5	-168.8	141.4	0	0	119.6
1003	T	30.6	Very low	32.1	Very low	103 Å²	103	131.4 Å²	131.4	63%	0.632	76%	0.757	S	S	*	*			cis	-159.2	155.5	-12	18.2	0	0	0	0	110.3
1004	L	32.6	Very low	32.1	Very low	144 Å²	144	127.1 Å²	127.1	75%	0.754	75%	0.748	S	S	*	*			trans	56	142.9	145.6	-61.2	163.6	0	0	0	119.3
1005	N	28.7	Very low	31.5	Very low	123 Å²	123	124.1 Å²	124.1	66%	0.658	74%	0.742	S	S	*	*			cis	-142.2	150.6	1.1	-100.1	-51.9	0	0	0	107.1
1006	K	30.7	Very low	31.4	Very low	183 Å²	183	128.1 Å²	128.1	80%	0.796	74%	0.744	S	S	*	*				55	137	73.9	-116.5	-160.2	173	179.7	0	113
1007	S	28.1	Very low	31.2	Very low	82 Å²	82	125.1 Å²	125.1	57%	0.573	74%	0.736	S	S	*	*			cis	-169.4	152.6	14.2	-167.8	0	0	0	0	112.3
1008	S	31.2	Very low	30.8	Very low	91 Å²	91	125 Å²	125	64%	0.636	74%	0.735	S	S	*	*			trans	57	157.1	143.7	47.5	0	0	0	0	120.7
1009	Q	33.1	Very low	32	Very low	193 Å²	193	121.7 Å²	121.7	90%	0.902	73%	0.729	S	S	*	*			cis	-167.5	162.8	-14.1	-104.8	162.4	-36.3	0	0	105.7
1010	G	29.6	Very low	31.8	Very low	61 Å²	61	122 Å²	122	63%	0.629	74%	0.737	S	S	*	*			cis	159.1	-172.6	1.4	0	0	0	0	0	110.4
1011	S	32.5	Very low	31.8	Very low	124 Å²	124	124.1 Å²	124.1	87%	0.867	74%	0.742	S	S	*	*			trans	72.1	143.8	164.5	-56.3	0	0	0	0	118.3
1012	S	33.7	Very low	31.6	Very low	100 Å²	100	126.5 Å²	126.5	70%	0.699	76%	0.757	S	S	*	*			cis	-168.7	168.7	-7.5	46.7	0	0	0	0	113
1013	S	33.7	Very low	31.4	Very low	106 Å²	106	123.1 Å²	123.1	74%	0.741	76%	0.758	S	S	*	*			trans	67.9	144	156.2	46.7	0	0	0	0	120.2
1014	S	32.3	Very low	31.3	Very low	101 Å²	101	124 Å²	124	71%	0.706	77%	0.768	S	S	*	*			cis	-168.4	161.6	-9.6	-94.1	0	0	0	0	112.8
1015	T	28.6	Very low	31.1	Very low	119 Å²	119	121.4 Å²	121.4	73%	0.73	77%	0.768	S	S	*	*			trans	61.7	117.9	157.8	38.7	0	0	0	0	119.4
1016	Q	31.1	Very low	31	Very low	181 Å²	181	120.8 Å²	120.8	85%	0.846	77%	0.773	S	S	*	*				74.6	140.1	79.3	-77.7	-176.1	-9.7	0	0	116
1017	S	28.2	Very low	30.8	Very low	98 Å²	98	120.4 Å²	120.4	69%	0.685	77%	0.772	S	S	*	*			cis	-177.4	134.1	-27.1	44.9	0	0	0	0	113.3
1018	A	25.6	Very low	30.7	Very low	97 Å²	97	123.6 Å²	123.6	80%	0.802	78%	0.777	S	S	*	*			trans	68.4	-177.6	154.1	0	0	0	0	0	118.6
1019	P	57.9	Low	30.5	Very low	117 Å²	117	126.6 Å²	126.6	76%	0.76	78%	0.779	S	S	*	*				-134.9	179	-88.1	42	-25.9	0	0	0	115.1
1020	S	26.7	Very low	30.1	Very low	126 Å²	126	124.3 Å²	124.3	88%	0.881	77%	0.768	S	S	*	*			trans	178.5	168.2	144.6	-84.2	0	0	0	0	115.2
1021	E	29.2	Very low	29.8	Very low	184 Å²	184	127.2 Å²	127.2	86%	0.86	77%	0.774	S	S	*	*			trans	-80.1	174.4	-172.8	-46.6	171	136.4	0	0	115.6
1022	T	27.2	Very low	29.4	Very low	152 Å²	152	126.7 Å²	126.7	93%	0.933	77%	0.77	S	S	*	*			trans	-162.1	165.2	133.9	2.1	0	0	0	0	112.8
1023	A	28.3	Very low	29.2	Very low	100 Å²	100	126.7 Å²	126.7	83%	0.826	78%	0.776	S	S	*	*			trans	-135.2	-172	-169.8	0	0	0	0	0	113.6
1024	S	28.7	Very low	28.9	Very low	121 Å²	121	128.5 Å²	128.5	85%	0.846	77%	0.773	S	S	*	*			trans	-68	155.4	-174.6	-44.2	0	0	0	0	116.2
1025	A	28.1	Very low	28.7	Very low	91 Å²	91	130.8 Å²	130.8	75%	0.752	77%	0.77	S	S	*	*				136.2	151.9	123.5	0	0	0	0	0	119.1
1026	S	26.2	Very low	28.7	Very low	110 Å²	110	130 Å²	130	77%	0.769	77%	0.77	S	S	*	*			trans	73.5	108.8	146.9	38.2	0	0	0	0	124.8
1027	K	26.1	Very low	28.6	Very low	175 Å²	175	130.4 Å²	130.4	76%	0.761	77%	0.768	S	S	*	*				56.6	132.8	120.4	-89	-168.1	163.3	-145.4	0	125.2
1028	E	27.5	Very low	28.5	Very low	148 Å²	148	133.9 Å²	133.9	69%	0.692	77%	0.774	S	S	*	*			trans	68.3	151.1	143.8	-63.1	172.3	-160	0	0	118
1029	K	25.7	Very low	28.7	Very low	155 Å²	155	134.6 Å²	134.6	67%	0.674	77%	0.773	S	S	*	*			cis	-164.8	153.2	30.6	-173.4	170.4	167.4	174.3	0	113.9
1030	E	25.5	Very low	27.3	Very low	144 Å²	144	132.3 Å²	132.3	67%	0.673	77%	0.771	S	S	*	*			trans	35.2	141.2	157.8	-65.7	168	-170.2	0	0	122.7
1031	T	22.6	Very low	27.4	Very low	123 Å²	123	131.6 Å²	131.6	76%	0.755	77%	0.766	S	S	*	*				-174.6	143.4	74	27.7	0	0	0	0	116.2
1032	S	24.9	Very low	27.4	Very low	112 Å²	112	127.9 Å²	127.9	78%	0.783	76%	0.756	S	S	*	*			trans	27.4	127.9	140.6	-49.7	0	0	0	0	127.1
1033	A	28.4	Very low	27.5	Very low	100 Å²	100	127.6 Å²	127.6	83%	0.826	75%	0.748	S	S	*	*			trans	71.2	157.6	136.6	0	0	0	0	0	120.5
1034	E	28.4	Very low	27.4	Very low	145 Å²	145	128.7 Å²	128.7	68%	0.678	74%	0.74	S	S	*	*			cis	-157.9	167.7	4.5	-149.6	-140.6	139.5	0	0	113.6
1035	K	27	Very low	27.5	Very low	149 Å²	149	129.9 Å²	129.9	65%	0.648	74%	0.736	S	S	*	*			trans	95.7	88.1	138.5	-135	169.4	-149.9	75.2	0	125.1
1036	S	30.5	Very low	27.4	Very low	102 Å²	102	131.5 Å²	131.5	71%	0.713	74%	0.742	S	S	*	*				84	148.7	118.7	-58.2	0	0	0	0	126.6
1037	K	27.3	Very low	27.4	Very low	189 Å²	189	129.5 Å²	129.5	82%	0.822	74%	0.738	S	S	*	*			trans	81.6	124	164.7	-70.3	-170.7	173.2	-174.6	0	118.6
1038	E	26.8	Very low	27.4	Very low	172 Å²	172	126.6 Å²	126.6	80%	0.804	74%	0.74	S	S	*	*			cis	79.9	136.2	25.6	-154.4	-176.5	-148.5	0	0	113
1039	S	30.9	Very low	27.2	Very low	111 Å²	111	130.5 Å²	130.5	78%	0.776	75%	0.749	S	S	*	*			cis	-142.7	173.4	30.1	-37.8	0	0	0	0	112.5
1040	G	27.5	Very low	27.1	Very low	70 Å²	70	131.9 Å²	131.9	72%	0.722	76%	0.757	S	S	*	*			cis	-143.5	-122.9	2.3	0	0	0	0	0	110.3
1041	S	28.6	Very low	27.3	Very low	110 Å²	110	131.3 Å²	131.3	77%	0.769	76%	0.764	S	S	*	*			cis	177.3	157.6	-12.3	-119.7	0	0	0	0	109.8
1042	T	29.1	Very low	28.6	Very low	107 Å²	107	130.7 Å²	130.7	66%	0.656	76%	0.762	S	S	*	*			cis	-173.4	126.5	-26.8	19.4	0	0	0	0	111.3
1043	L	28.8	Very low	28.5	Very low	146 Å²	146	130.3 Å²	130.3	76%	0.764	76%	0.759	S	S	*	*			trans	71.1	152.6	143.2	-51.4	179.5	0	0	0	121
1044	D	26.7	Very low	28.2	Very low	123 Å²	123	131 Å²	131	66%	0.658	76%	0.758	S	S	*	*			cis	-156.7	169.7	-6.1	-126.5	-18.3	0	0	0	120.2
1045	L	31.3	Very low	28.2	Very low	146 Å²	146	131.1 Å²	131.1	76%	0.764	76%	0.762	S	S	*	*			trans	-38.4	153.5	173	-67.4	157.3	0	0	0	122.9
1046	S	26.6	Very low	28	Very low	125 Å²	125	131 Å²	131	87%	0.874	77%	0.767	S	S	*	*				164.6	150.6	104.4	50.7	0	0	0	0	113.2
1047	G	24.6	Very low	27.7	Very low	67 Å²	67	134.2 Å²	134.2	69%	0.691	78%	0.776	S	S	*	*			cis	174.1	166.2	-10	0	0	0	0	0	113
1048	S	26.1	Very low	27.5	Very low	114 Å²	114	128.6 Å²	128.6	80%	0.797	77%	0.771	S	S	*	*			trans	61.2	117.4	166.8	-73.3	0	0	0	0	119.1
1049	R	25.1	Very low	27.5	Very low	231 Å²	231	125.5 Å²	125.5	87%	0.872	77%	0.769	S	S	*	*				94.7	133.4	66.5	-89.9	-177	167.4	-144.8	-0.9	113.1
1050	E	22.6	Very low	27.3	Very low	183 Å²	183	126.3 Å²	126.3	86%	0.855	76%	0.764	S	S	*	*			trans	160.5	129.6	139.2	-85	-80.7	117.7	0	0	111.2
1051	T	29.7	Very low	27.2	Very low	133 Å²	133	130.7 Å²	130.7	82%	0.816	77%	0.766	S	S	*	*			trans	-168	161	174.3	55.4	0	0	0	0	108.6
1052	P	50.2	Low	27	Very low	109 Å²	109	128.4 Å²	128.4	71%	0.708	76%	0.76	S	S	*	*			cis	-135.9	-170.8	1.7	42.2	-24.3	0	0	0	115.3
1053	S	23.3	Very low	26.8	Very low	105 Å²	105	128.9 Å²	128.9	73%	0.734	77%	0.767	S	S	*	*			trans	68.3	120.2	148.3	-61.5	0	0	0	0	121.8
1054	S	22.3	Very low	26.6	Very low	113 Å²	113	128.1 Å²	128.1	79%	0.79	77%	0.768	S	S	*	*				148.7	167.1	121.9	-65.7	0	0	0	0	114.2
1055	I	27.3	Very low	26.6	Very low	149 Å²	149	126.1 Å²	126.1	76%	0.764	76%	0.764	S	S	*	*			trans	76.2	92.2	162.9	-50.1	-172.4	0	0	0	118
1056	L	23.2	Very low	26.4	Very low	145 Å²	145	127.5 Å²	127.5	76%	0.759	76%	0.764	S	S	*	*				43.6	120.2	122.9	-63.1	164.7	0	0	0	121.7
1057	L	23.9	Very low	26.4	Very low	170 Å²	170	131.7 Å²	131.7	89%	0.89	76%	0.761	S	S	*	*				21.4	118.8	118.4	-69	165.9	0	0	0	118.3
1058	G	23.8	Very low	26.5	Very low	71 Å²	71	133.2 Å²	133.2	73%	0.732	76%	0.759	S	S	*	*			trans	-170.9	80.3	169.1	0	0	0	0	0	117.9
1059	S	26.8	Very low	26.4	Very low	108 Å²	108	134.2 Å²	134.2	76%	0.755	76%	0.756	S	S	*	*			trans	63	146.1	153.9	-63.1	0	0	0	0	119.3
1060	N	26.1	Very low	26.6	Very low	127 Å²	127	132.4 Å²	132.4	68%	0.679	75%	0.754	S	S	*	*			cis	-122.2	131.9	16	-86.5	-56	0	0	0	114.3
1061	Q	26.4	Very low	26.6	Very low	163 Å²	163	132.2 Å²	132.2	76%	0.762	75%	0.754	S	S	*	*				30.1	119.3	119.7	-55.2	178.4	84.2	0	0	117.7
1062	G	23.7	Very low	27.2	Very low	61 Å²	61	131 Å²	131	63%	0.629	75%	0.748	S	S	*	*			cis	79.4	129.6	-1	0	0	0	0	0	115.1
1063	S	24.5	Very low	26	Very low	117 Å²	117	129.5 Å²	129.5	82%	0.818	75%	0.745	S	S	*	*			trans	70.8	161.3	-176	-47.4	0	0	0	0	114
1064	V	25.3	Very low	26.1	Very low	130 Å²	130	135.9 Å²	135.9	79%	0.788	75%	0.754	S	S	*	*			cis	-127.9	124.6	13.1	175.3	0	0	0	0	107.2
1065	S	26.2	Very low	26.2	Very low	81 Å²	81	134.9 Å²	134.9	57%	0.566	75%	0.753	S	S	*	*				60.9	153.5	79.6	-91.5	0	0	0	0	113.6
1066	K	26.6	Very low	27	Very low	175 Å²	175	132.9 Å²	132.9	76%	0.761	75%	0.749	S	S	*	*			cis	-150.5	-177.9	8.3	-121.7	148.4	-161.1	169.5	0	106.6
1067	R	26	Very low	27.1	Very low	214 Å²	214	131.7 Å²	131.7	81%	0.808	75%	0.748	S	S	*	*			cis	-171.4	137.1	38.5	-150.8	153.2	-175.3	-179.8	3	110.9
1068	C	26.7	Very low	27.2	Very low	98 Å²	98	129.4 Å²	129.4	66%	0.662	74%	0.742	S	S	*	*			trans	55.2	148.1	134.8	-63.9	0	0	0	0	120.8
1069	D	25.6	Very low	27.4	Very low	136 Å²	136	132 Å²	132	73%	0.727	74%	0.744	S	S	*	*			cis	-167.5	-178.5	-6.4	-129.1	-55.7	0	0	0	112.4
1070	K	27.5	Very low	27.5	Very low	192 Å²	192	133.2 Å²	133.2	84%	0.835	74%	0.741	S	S	*	*			trans	74	101.2	156.7	-75.6	173.1	-179.2	-174.1	0	120.9
1071	Q	22.6	Very low	27.6	Very low	180 Å²	180	135.2 Å²	135.2	84%	0.841	75%	0.746	S	S	*	*			trans	-38.8	177.5	132.2	-103.1	-169.3	-3.6	0	0	116.3
1072	P	43.8	Very low	27.8	Very low	108 Å²	108	134.5 Å²	134.5	70%	0.701	74%	0.743	S	S	*	*			cis	-143.1	-175.8	-15	35.5	-14.4	0	0	0	116.8
1073	A	23.7	Very low	28.4	Very low	77 Å²	77	137.5 Å²	137.5	64%	0.636	75%	0.752	S	S	*	*				103.6	151.9	129.7	0	0	0	0	0	123.5
1074	Y	25.6	Very low	28.8	Very low	239 Å²	239	139.1 Å²	139.1	94%	0.937	75%	0.746	S	S	*	*			trans	80.3	156.2	164.4	-66.1	-71.9	0	0	0	121.1
1075	A	25.4	Very low	29.7	Very low	91 Å²	91	137.8 Å²	137.8	75%	0.752	74%	0.74	S	S	*	*			trans	-138.8	-157.9	-166.8	0	0	0	0	0	108.1
1076	P	43.3	Very low	29.5	Very low	107 Å²	107	140.5 Å²	140.5	70%	0.695	75%	0.748	S	S	*	*			cis	-131.5	-136.3	-11.8	33.7	-8.8	0	0	0	111.3
1077	T	25.6	Very low	29.6	Very low	120 Å²	120	142.6 Å²	142.6	74%	0.736	75%	0.752	S	S	*	*			trans	70.1	155.7	164.8	54.3	0	0	0	0	119.5
1078	T	26.1	Very low	30	Very low	123 Å²	123	137.9 Å²	137.9	76%	0.755	75%	0.75	S	S	*	*				-170.1	158.6	-54.9	25.2	0	0	0	0	110.3
1079	T	28.5	Very low	29.8	Very low	126 Å²	126	136.9 Å²	136.9	77%	0.773	75%	0.749	S	S	*	*			trans	67.4	90.1	156.6	-45.2	0	0	0	0	120.2
1080	D	27.6	Very low	29.8	Very low	132 Å²	132	137.7 Å²	137.7	71%	0.706	75%	0.748	S	S	*	*				56.6	157	108	-130.3	-20.3	0	0	0	125
1081	H	28.1	Very low	29.5	Very low	170 Å²	170	135.6 Å²	135.6	79%	0.787	74%	0.739	S	S	*	*			trans	79.7	127.2	156.5	-74.2	3.8	0	0	0	122.3
1082	Q	31.7	Very low	29.6	Very low	148 Å²	148	135.9 Å²	135.9	69%	0.692	73%	0.734	S	S	*	*			trans	-85.3	168.3	175.2	-152.5	-178.8	-3.3	0	0	110.2	H1084	Q1082-H1084 PolarHBondContact NE2-CD2 3.11Å
1083	P	35.9	Very low	28.6	Very low	124 Å²	124	137.4 Å²	137.4	81%	0.805	73%	0.731	S	S	*	*				-149.2	165	98.5	37.7	-20.7	0	0	0	117.1
1084	H	32.3	Very low	28.6	Very low	151 Å²	151	138.3 Å²	138.3	70%	0.699	73%	0.733	S	S	*	*			trans	-75.5	173.2	164.5	-100.7	-58.2	0	0	0	111.2	Q1082	Q1082-H1084 PolarHBondContact NE2-CD2 3.11Å
1085	P	44.7	Very low	28.5	Very low	102 Å²	102	139.1 Å²	139.1	66%	0.662	73%	0.734	S	S	*	*				-161.1	-174.8	53.9	44.9	-21.4	0	0	0	121
1086	N	22.7	Very low	28.5	Very low	138 Å²	138	139.1 Å²	139.1	74%	0.738	73%	0.729	S	S	*	*			trans	75	107.3	150.7	-68.4	-19.9	0	0	0	123.3
1087	Y	28.6	Very low	27.6	Very low	218 Å²	218	139.9 Å²	139.9	86%	0.855	73%	0.727	S	S	*	*				18.7	151.1	111.3	-74.9	-78.8	0	0	0	120
1088	P	33.5	Very low	27.5	Very low	115 Å²	115	142.9 Å²	142.9	75%	0.747	73%	0.73	S	S	*	*			cis	-151.9	-177.7	38.6	44.5	-24.1	0	0	0	120
1089	A	23.7	Very low	27.4	Very low	78 Å²	78	142.3 Å²	142.3	65%	0.645	73%	0.731	S	S	*	*			trans	85	115.7	137.4	0	0	0	0	0	124.3
1090	Q	24.1	Very low	27.1	Very low	152 Å²	152	141.8 Å²	141.8	71%	0.71	73%	0.732	S	S	*	*				89.7	124.8	122.5	-75.6	-173.4	24.9	0	0	124.5
1091	K	22.5	Very low	26.9	Very low	148 Å²	148	147.3 Å²	147.3	64%	0.643	74%	0.743	S	S	*	*				79.5	120.3	129.7	-74.4	174.1	-179.4	156.8	0	122.5
1092	Y	23.6	Very low	26.7	Very low	187 Å²	187	144 Å²	144	73%	0.733	74%	0.739	S	S	*	*				66	157.6	129.7	-67.1	-38.3	0	0	0	119.9
1093	H	23.9	Very low	26.5	Very low	139 Å²	139	142.1 Å²	142.1	64%	0.644	74%	0.743	S	S	*	*			cis	-150.8	151.7	-6.7	-123.6	-49.9	0	0	0	111
1094	S	23.4	Very low	26	Very low	96 Å²	96	142.1 Å²	142.1	67%	0.671	75%	0.745	S	S	*	*			trans	28.1	136.7	140.8	-55.1	0	0	0	0	122.1
1095	R	22.7	Very low	25.8	Very low	256 Å²	256	142.4 Å²	142.4	97%	0.966	75%	0.752	S	S	*	*				-142.1	116.7	128.3	-121.3	177.4	-171.5	-160.5	1.1	113.3
1096	S	26	Very low	25	Very low	92 Å²	92	146.9 Å²	146.9	64%	0.643	76%	0.764	S	S	*	*			trans	-90.4	161	165.5	56	0	0	0	0	110.4
1097	N	24.5	Very low	25.3	Very low	123 Å²	123	149.8 Å²	149.8	66%	0.658	77%	0.77	S	S	*	*				176.8	135.3	114.3	-93.3	-11.2	0	0	0	114.1
1098	K	24.3	Very low	25.4	Very low	183 Å²	183	150.8 Å²	150.8	80%	0.796	77%	0.772	S	S	*	*			trans	66.7	146.2	140.2	-64.8	174.9	-175.4	-174.7	0	117.3
1099	S	24.2	Very low	25	Very low	111 Å²	111	148.9 Å²	148.9	78%	0.776	77%	0.774	S	S	*	*			cis	-171.5	149.2	-7.2	41.2	0	0	0	0	110.4
1100	S	22.2	Very low	25.6	Very low	114 Å²	114	150.7 Å²	150.7	80%	0.797	78%	0.782	S	S	*	*			trans	-162.2	133	139.1	-155.3	0	0	0	0	113.5
1101	W	22.7	Very low	25.7	Very low	248 Å²	248	150.2 Å²	150.2	94%	0.939	79%	0.79	S	S	*	*			trans	-140.6	145.5	159.3	-85.8	5.3	0	0	0	103.3
1102	S	24.8	Very low	26	Very low	100 Å²	100	153.9 Å²	153.9	70%	0.699	80%	0.799	S	S	*	*			cis	-132.4	151.4	9.7	-67.7	0	0	0	0	108.5
1103	S	26.8	Very low	26.1	Very low	110 Å²	110	149.9 Å²	149.9	77%	0.769	80%	0.799	S	S	*	*				51.6	117.3	74.1	-151.5	0	0	0	0	114.3
1104	S	25	Very low	26.3	Very low	123 Å²	123	149.3 Å²	149.3	86%	0.86	80%	0.8	S	S	*	*			trans	-96	142.6	164.8	-53.8	0	0	0	0	109.5
1105	D	28.1	Very low	26.6	Very low	158 Å²	158	152.5 Å²	152.5	85%	0.845	80%	0.804	S	S	*	*			trans	-108.3	135.2	169.6	-106.8	-59	0	0	0	109.9
1106	E	28.2	Very low	26.7	Very low	195 Å²	195	146.6 Å²	146.6	91%	0.911	79%	0.792	S	S	*	*			trans	-159.7	136.9	159.6	-124.1	-160.2	111.2	0	0	111.7
1107	K	28.9	Very low	26.8	Very low	199 Å²	199	148.1 Å²	148.1	87%	0.865	80%	0.798	S	S	*	*			trans	-153.4	86.9	179.7	-159.2	177.6	-176.4	-178.2	0	114.9
1108	R	30.4	Very low	26.9	Very low	239 Å²	239	147.3 Å²	147.3	90%	0.902	80%	0.802	S	S	*	*			trans	59.7	117.2	143.3	-176	-170.5	-70.2	-152	-3.9	118.9
1109	G	25.3	Very low	27.2	Very low	75 Å²	75	144.8 Å²	144.8	77%	0.773	80%	0.802	S	S	*	*			trans	-149	156.8	153.3	0	0	0	0	0	110.5
1110	S	37.1	Very low	27.4	Very low	117 Å²	117	144.4 Å²	144.4	82%	0.818	80%	0.799	S	S	*	*			trans	-161	138.3	-178.7	-177.4	0	0	0	0	113.2
1111	T	25.7	Very low	27.8	Very low	142 Å²	142	144.3 Å²	144.3	87%	0.871	79%	0.794	S	S	*	*			trans	-144.4	170.4	173	42	0	0	0	0	110.6
1112	R	29.2	Very low	28.1	Very low	224 Å²	224	141.7 Å²	141.7	85%	0.845	79%	0.789	S	S	*	*			trans	-119.9	-177.7	-165	-67.9	174.6	62.6	-175.3	-1.3	113.4
1113	S	25.6	Very low	28.4	Very low	104 Å²	104	142.1 Å²	142.1	73%	0.727	79%	0.792	S	S	*	*			trans	87	146.4	163	75.6	0	0	0	0	117.8
1114	D	27.7	Very low	28.4	Very low	126 Å²	126	144.7 Å²	144.7	67%	0.674	80%	0.796	S	S	*	*			cis	-166.4	175.8	-26.4	-104.1	-51.3	0	0	0	109.9
1115	H	28.7	Very low	28.7	Very low	163 Å²	163	146.3 Å²	146.3	76%	0.755	79%	0.794	S	S	*	*			trans	71.9	153.6	167.6	-66.5	-69.4	0	0	0	118
1116	N	25.3	Very low	29.8	Very low	132 Å²	132	143.8 Å²	143.8	71%	0.706	79%	0.787	S	S	*	*			cis	-154.5	-175.5	0.5	-125.8	-9.3	0	0	0	113.4
1117	T	28.2	Very low	29.8	Very low	124 Å²	124	143.6 Å²	143.6	76%	0.761	78%	0.783	S	S	*	*			trans	76.3	117.4	178.3	68.9	0	0	0	0	114.7
1118	S	27.1	Very low	29.9	Very low	106 Å²	106	142.6 Å²	142.6	74%	0.741	78%	0.781	S	S	*	*				80.3	129.4	50.1	77.9	0	0	0	0	113.1
1119	T	30.2	Very low	29.8	Very low	131 Å²	131	137 Å²	137	80%	0.804	78%	0.779	S	S	*	*			cis	-148.3	167.7	32	50	0	0	0	0	116.3
1120	S	28.6	Very low	30.1	Very low	102 Å²	102	144.8 Å²	144.8	71%	0.713	79%	0.785	S	S	*	*			trans	-26.8	162.3	149.3	-57.9	0	0	0	0	117.9
1121	T	30.2	Very low	29.7	Very low	113 Å²	113	147 Å²	147	69%	0.693	79%	0.787	S	S	*	*			cis	-169.4	162.8	4.9	9.8	0	0	0	0	112.1
1122	K	29.4	Very low	29.9	Very low	192 Å²	192	146.9 Å²	146.9	84%	0.835	78%	0.781	S	S	*	*			trans	62	122.9	154.4	-68.3	168.7	-178	178.8	0	116.6
1123	S	30.6	Very low	30	Very low	109 Å²	109	141.4 Å²	141.4	76%	0.762	77%	0.772	S	S	*	*				69.8	107.9	64.1	-172.6	0	0	0	0	114.3
1124	L	27.8	Very low	30.1	Very low	164 Å²	164	144.6 Å²	144.6	86%	0.859	77%	0.773	S	S	*	*			trans	-173.9	151.7	134.5	-100.9	167.2	0	0	0	112.4
1125	L	31.4	Very low	30.2	Very low	157 Å²	157	148.8 Å²	148.8	82%	0.822	78%	0.78	S	S	*	*			trans	-139.2	171.5	166.8	-81.2	175	0	0	0	106
1126	P	50.5	Low	30.4	Very low	105 Å²	105	151.8 Å²	151.8	68%	0.682	80%	0.802	S	S	*	*			cis	-127.3	-177.2	-17.3	30.8	-10.9	0	0	0	112.2
1127	K	28	Very low	30.7	Very low	191 Å²	191	152.8 Å²	152.8	83%	0.83	81%	0.807	S	S	*	*				168.3	170	119.3	-93	-172.2	176.1	-170.6	0	114.5
1128	E	30.2	Very low	30.8	Very low	178 Å²	178	154.3 Å²	154.3	83%	0.832	81%	0.809	S	S	*	*			trans	-84.3	153.2	-171.1	-50.1	139.7	112	0	0	113.9
1129	S	28.6	Very low	31	Very low	122 Å²	122	157 Å²	157	85%	0.853	81%	0.813	S	S	*	*			trans	-157.9	145.8	139.4	58	0	0	0	0	111.1
1130	R	31.3	Very low	31	Very low	238 Å²	238	158.5 Å²	158.5	90%	0.898	81%	0.813	S	S	*	*			trans	-90	147.6	172	-63.8	161.7	77.8	175.8	5.4	109.4
1131	L	29.9	Very low	31.2	Very low	163 Å²	163	162.1 Å²	162.1	85%	0.853	82%	0.819	S	S	*	*			trans	160.8	101.9	144.8	-87.1	160.6	0	0	0	105.7
1132	D	29.1	Very low	31.3	Very low	140 Å²	140	165.3 Å²	165.3	75%	0.749	83%	0.828	S	S	*	*				86.3	149.3	60.9	-157.9	1.7	0	0	0	112.8
1133	T	31.8	Very low	31.4	Very low	109 Å²	109	163.4 Å²	163.4	67%	0.669	83%	0.827	S	S	*	*			trans	73.2	118.6	175.6	60.3	0	0	0	0	121.7
1134	F	27.7	Very low	31.5	Very low	171 Å²	171	167.6 Å²	167.6	75%	0.75	83%	0.832	S	S	*	*			trans	53.3	117.3	138.1	-76.3	-96.5	0	0	0	120.3
1135	W	30.5	Very low	31.8	Very low	214 Å²	214	167.9 Å²	167.9	81%	0.811	83%	0.83	S	S	*	*				-164.8	159.3	56.3	-94.4	93.2	0	0	0	112.4
1136	D	32.1	Very low	31.8	Very low	227 Å²	227	168.9 Å²	168.9	100%	1.214	83%	0.831	S	S	*	*			trans	41.8	0	171.5	-76.2	-17.3	0	0	0	119.1

Retrieved 1,136 of 1,136 residues in 433.5 ms (Link to these results)

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