A0A087YN81_POEFO Loading...

Zinc finger CCCH-type containing 12B

AlphaFold DB , UniProt , Accession A0A087YN81, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 854 aa.

						>A0A087YN81_POEFO|A0A087YN81
MTAWSMVEKLKMEKRPCREQNIDSREAHHATDESEDGSSSESESEEHQWRRQPHRAQLGNSSCRKREPLAVTKPHRQLCRSPCLDRPSFSQSSTLQDFRDDDSGGGSAGAASGLKPASGREYQTKMEFALKLGYSGDQVETVLNKLGATALINDVLAELVRLGNKVEHETQPCSAAAPSTSRPPCVKETVSPEVSVEEESVDTYDNLRPIVIDGSNVAMSHGNKEVFSCRGIQLAVEWFREKGHKDITVFVPAWRKEQSRPDALITDQEILRKLEKEKILVFTPSRRVQGRRVVCYDDRFILKLAYDSDGIIVSNDNYRDLQNEKPEWKKFIEERLLMYSFVNDKFMPPDDPLGRHGPSLENFLRKRPVVPEHKKQPCPYGKKCTYGHKCKYYHPERVNQPQRSVADELRAFAKLSAVKTMSEGALAKCGTGPAAVKGDVGSEAKRVAPKRQSDPSIRSVACEPVEALSVARKSETNSVPSLVSALSVPTMQPAKSHAAGALNTRSASSPVPGSLQFAHNSLEHMSSIQYPPILVTNSHGASVTYSEQFPKYDSVSDHGYYSLHSDFSNMSMSSMHNVDSFCSMEHEHVYQRTPSHCPESCLSHSNSDSFSSYGELYPSSVDSSLEESIKVQQQAPAQARMQAFSHGFRHDALTRVQSYGQEEPKQGPRKQSGAHLAPHIQHATVGARSSCPGDYPLAQNVLPPLSSQPTRSLGMTRMDSISDSRLYDSNPMRQRRPPLCREQHASWDPLPCGNESYGYHSYPLSNSLMPCCERVMVRSMPDKMEQIWNSPWENPSAAEHQERYVIPDHQYQTYRNLCNIFPAYIVHSVMEKNPHLTDPQQLAAVIVTKLRSCH
					

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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	34.5	Very low	34.2	Very low	244 Å²	244	167.6 Å²	167.6	100%	1.202	86%	0.855	S	S	*	*				0	133.2	0	-61.4	173.4	-174.6	0	0	107.1
2	T	31.4	Very low	33.7	Very low	151 Å²	151	166 Å²	166	93%	0.926	84%	0.844	S	S	*	*			trans	-146.7	146.4	-176.4	19.7	0	0	0	0	109
3	A	37.6	Very low	33.4	Very low	82 Å²	82	164.1 Å²	164.1	68%	0.678	83%	0.83	S	S	*	*			trans	-150.2	140.1	-155.7	0	0	0	0	0	114
4	W	34.7	Very low	33	Very low	252 Å²	252	165.5 Å²	165.5	96%	0.955	83%	0.828	S	S	*	*			trans	77.7	144.2	145.6	-74.5	37.5	0	0	0	122
5	S	35.9	Very low	33	Very low	103 Å²	103	170.1 Å²	170.1	72%	0.72	83%	0.832	S	S	*	*			trans	78.7	104.4	144.4	-156.3	0	0	0	0	122.3
6	M	34.5	Very low	33.6	Very low	175 Å²	175	167.4 Å²	167.4	86%	0.862	83%	0.832	S	S	*	*				30.7	141.6	122.5	-61	-167.5	179.1	0	0	123.4
7	V	32.8	Very low	33.1	Very low	126 Å²	126	164.8 Å²	164.8	76%	0.764	83%	0.831	S	S	*	*				98.4	142.4	129.3	148.6	0	0	0	0	122.2
8	E	29.3	Very low	32.9	Very low	181 Å²	181	167.8 Å²	167.8	85%	0.846	83%	0.831	S	S	*	*			trans	86.2	159.3	156	-102.8	173.8	173.4	0	0	125.7
9	K	43.6	Very low	32.6	Very low	192 Å²	192	166.1 Å²	166.1	84%	0.835	82%	0.821	S	S	*	*			trans	-129.8	129.7	-179.2	-75.1	177.3	174.7	176.1	0	109.8
10	L	30.7	Very low	32.4	Very low	164 Å²	164	167.6 Å²	167.6	86%	0.859	83%	0.825	S	S	*	*			trans	-141.8	137.9	157.1	-65.8	173.4	0	0	0	107.5
11	K	31	Very low	32.3	Very low	174 Å²	174	167.1 Å²	167.1	76%	0.757	83%	0.826	S	S	*	*			cis	99.2	100.8	11.7	-158.9	-169.5	174.4	-170.9	0	116.3
12	M	28.4	Very low	32.1	Very low	148 Å²	148	163.3 Å²	163.3	73%	0.729	81%	0.809	S	S	*	*			trans	77.4	118.2	148.1	-81.2	172.8	151.1	0	0	122.9
13	E	29.6	Very low	31.9	Very low	141 Å²	141	162.9 Å²	162.9	66%	0.659	80%	0.801	S	S	*	*				75.9	116.6	114.3	-156.4	-149.8	132.8	0	0	121.2
14	K	28.3	Very low	31.7	Very low	184 Å²	184	162.8 Å²	162.8	80%	0.8	80%	0.795	S	S	*	*				177.3	163.1	112.1	-94.4	169.2	-172.5	173.9	0	114.9
15	R	32.9	Very low	31.4	Very low	234 Å²	234	160 Å²	160	88%	0.883	79%	0.785	S	S	*	*			trans	-100	168.1	168.6	-59.8	179	175.3	178.3	-3.1	110.2
16	P	42.5	Very low	31.1	Very low	128 Å²	128	161.8 Å²	161.8	83%	0.831	78%	0.782	S	S	*	*				-147.6	-174.6	94.9	38.9	-21.4	0	0	0	115.4
17	C	25.4	Very low	30.9	Very low	122 Å²	122	157 Å²	157	82%	0.824	77%	0.77	S	S	*	*			trans	-86.2	165.9	179.7	-53.5	0	0	0	0	113.7
18	R	28.7	Very low	30.7	Very low	220 Å²	220	159.2 Å²	159.2	83%	0.83	77%	0.772	S	S	*	*				-170.1	164.8	106.1	-162.6	151.6	-171.3	-166.8	-6	113.6
19	E	28.3	Very low	30.7	Very low	135 Å²	135	158.7 Å²	158.7	63%	0.631	77%	0.769	S	S	*	*			trans	-68.1	163.2	-177.1	-47.8	140	111.5	0	0	115.6
20	Q	28.3	Very low	29.9	Very low	196 Å²	196	153.5 Å²	153.5	92%	0.916	76%	0.762	S	S	*	*				-165.9	155.4	115.2	-106.5	168.2	50.4	0	0	114.3
21	N	28.9	Very low	29.7	Very low	158 Å²	158	152.1 Å²	152.1	85%	0.845	76%	0.761	S	S	*	*			trans	-103.5	152.1	178.1	-81.5	-21.1	0	0	0	111.8
22	I	30.8	Very low	29.6	Very low	164 Å²	164	150.1 Å²	150.1	84%	0.841	76%	0.758	S	S	*	*			trans	-144.1	108.2	146.3	-61.1	-172.2	0	0	0	104.3
23	D	28.8	Very low	29.7	Very low	142 Å²	142	151 Å²	151	76%	0.759	76%	0.76	S	S	*	*				76	128.4	70.8	-157.8	20.2	0	0	0	111.6
24	S	31.8	Very low	29.9	Very low	80 Å²	80	148.4 Å²	148.4	56%	0.559	76%	0.758	S	S	*	*			cis	-126.1	-144	4.6	-47.4	0	0	0	0	111.3
25	R	29.1	Very low	30.2	Very low	193 Å²	193	147.1 Å²	147.1	73%	0.728	76%	0.755	S	S	*	*			cis	-156.4	-159.5	1.7	-140.3	172.8	168.9	69	26.1	114.7
26	E	28.4	Very low	30.3	Very low	141 Å²	141	143.6 Å²	143.6	66%	0.659	75%	0.753	S	S	*	*			trans	-82.8	172.9	-172.8	-74.6	151	178	0	0	114.9
27	A	30.7	Very low	29.8	Very low	75 Å²	75	140.6 Å²	140.6	62%	0.62	75%	0.746	S	S	*	*			cis	-174.7	137.4	-22.6	0	0	0	0	0	113.5
28	H	29.9	Very low	30	Very low	172 Å²	172	140.7 Å²	140.7	80%	0.796	75%	0.748	S	S	*	*			trans	62	153.2	137.9	-74.3	-99.8	0	0	0	125.4
29	H	27.9	Very low	30.3	Very low	169 Å²	169	135.3 Å²	135.3	78%	0.782	74%	0.744	S	S	*	*			trans	70.1	128.2	173.2	-66.5	-77.1	0	0	0	116.8
30	A	27.6	Very low	30.5	Very low	83 Å²	83	133 Å²	133	69%	0.686	74%	0.743	S	S	*	*				70	130.1	51.3	0	0	0	0	0	111.1
31	T	27.4	Very low	30.9	Very low	136 Å²	136	131.9 Å²	131.9	83%	0.834	74%	0.737	S	S	*	*			cis	-148.8	-179.1	40.6	37.8	0	0	0	0	110
32	D	27.9	Very low	31.1	Very low	131 Å²	131	128.3 Å²	128.3	70%	0.701	73%	0.725	S	S	*	*			cis	154.7	146.6	-13.5	-161.4	27	0	0	0	104.8
33	E	30.1	Very low	31.4	Very low	166 Å²	166	129.1 Å²	129.1	78%	0.776	73%	0.725	S	S	*	*			trans	60.5	159.5	178.3	-46.7	-62.4	53.2	0	0	117.7
34	S	33.5	Very low	31.6	Very low	87 Å²	87	126.9 Å²	126.9	61%	0.608	72%	0.72	S	S	*	*			cis	-161.5	-174.1	-30.7	64.1	0	0	0	0	106.9
35	E	35.7	Very low	31.6	Very low	158 Å²	158	131.7 Å²	131.7	74%	0.738	73%	0.734	S	S	*	*			cis	-162.7	-173.5	1.1	-135	151	146.2	0	0	109.7
36	D	35.7	Very low	31.7	Very low	159 Å²	159	128.1 Å²	128.1	85%	0.85	73%	0.726	S	S	*	*			trans	58.3	140.3	161.8	-66.5	-25.2	0	0	0	122.9
37	G	31.4	Very low	31.6	Very low	66 Å²	66	129.3 Å²	129.3	68%	0.68	73%	0.731	S	S	*	*			cis	176.8	169.5	-4.1	0	0	0	0	0	115.2
38	S	29.5	Very low	31.6	Very low	123 Å²	123	131.2 Å²	131.2	86%	0.86	73%	0.727	S	S	*	*			trans	66.1	121.8	178.2	-62.6	0	0	0	0	117.6
39	S	34	Very low	31.3	Very low	108 Å²	108	132 Å²	132	76%	0.755	72%	0.723	S	S	*	*			cis	74	134.3	49.7	-147.5	0	0	0	0	112.1
40	S	32.9	Very low	31.2	Very low	86 Å²	86	134 Å²	134	60%	0.601	72%	0.724	S	S	*	*				-176.8	153.9	52.7	-109.7	0	0	0	0	107.7
41	E	36.6	Very low	31.1	Very low	172 Å²	172	141.4 Å²	141.4	80%	0.804	73%	0.734	S	S	*	*			cis	-163.1	-179.9	-3.5	-36.1	-168.7	153.8	0	0	106.4
42	S	33.3	Very low	31	Very low	83 Å²	83	143.4 Å²	143.4	58%	0.58	73%	0.734	S	S	*	*			cis	-161.2	174	-9.5	-145.1	0	0	0	0	111.8
43	E	37.5	Very low	32.2	Very low	181 Å²	181	141.3 Å²	141.3	85%	0.846	73%	0.728	S	S	*	*			trans	28.6	145.7	143	-69.4	155	138.1	0	0	123.8
44	S	32.7	Very low	32	Very low	95 Å²	95	141.2 Å²	141.2	66%	0.664	73%	0.727	S	S	*	*			cis	-140.3	-175.9	3.6	68.3	0	0	0	0	110.3
45	E	31.9	Very low	31.7	Very low	181 Å²	181	146.7 Å²	146.7	85%	0.846	73%	0.734	S	S	*	*			cis	-146.9	-139	11.3	-149	144.9	113	0	0	112.1
46	E	30.6	Very low	31.3	Very low	119 Å²	119	143.2 Å²	143.2	56%	0.556	73%	0.732	S	S	*	*			trans	-144.2	174.3	-160.9	-135.5	-76.6	103.4	0	0	115.3	Q48	E46-Q48 VanDerWaalsContact OE2-CD 3.27Å; E46-Q48 WeakPolarHBondContact OE2-CG 3.44Å; E46-Q48 PolarHBondContact OE2-NE2 2.7Å
47	H	28	Very low	30.9	Very low	165 Å²	165	142.8 Å²	142.8	76%	0.764	73%	0.725	S	S	*	*			trans	101.6	134.6	164	-59.7	-20.3	0	0	0	118
48	Q	30.1	Very low	30.7	Very low	116 Å²	116	147.6 Å²	147.6	54%	0.542	73%	0.734	S	S	.	*			cis	-163.4	161.2	-42.4	-130.1	174.5	34.6	0	0	111.1	E46	E46-Q48 VanDerWaalsContact OE2-CD 3.27Å; E46-Q48 WeakPolarHBondContact OE2-CG 3.44Å; E46-Q48 PolarHBondContact OE2-NE2 2.7Å
49	W	24.3	Very low	30.5	Very low	189 Å²	189	145 Å²	145	72%	0.716	73%	0.727	S	S	*	*			trans	71.8	109.8	162	-60.9	115.4	0	0	0	123.3
50	R	25.6	Very low	30.2	Very low	210 Å²	210	147.2 Å²	147.2	79%	0.792	73%	0.73	S	S	*	*			trans	-0.2	152.5	133	-46.1	-179.3	-177.2	-143.6	3.9	118.1
51	R	24.6	Very low	29.9	Very low	238 Å²	238	147.3 Å²	147.3	90%	0.898	73%	0.731	S	S	*	*			cis	-154.1	157.6	41.2	-61.5	178.1	174.6	-158.9	-1.2	114.4
52	Q	26.1	Very low	29.5	Very low	179 Å²	179	144.3 Å²	144.3	84%	0.836	73%	0.729	S	S	*	*			trans	-88.5	-160.4	156	-43.9	176.8	-17.9	0	0	109.8
53	P	51.6	Low	29.2	Very low	87 Å²	87	144.9 Å²	144.9	57%	0.565	73%	0.732	S	S	*	*			cis	-134.6	-153.6	-17	27.5	-1.7	0	0	0	112.4
54	H	26.6	Very low	28.8	Very low	163 Å²	163	146 Å²	146	76%	0.755	73%	0.728	S	S	*	*			trans	91	151.8	157	-63.1	-37.6	0	0	0	119.4
55	R	27.7	Very low	28.5	Very low	203 Å²	203	150 Å²	150	77%	0.766	73%	0.734	S	S	*	*			cis	-173.8	162.7	-21.9	178.3	178.9	168.6	176.2	-2.4	109.1
56	A	26.8	Very low	28.3	Very low	84 Å²	84	151.7 Å²	151.7	69%	0.694	73%	0.732	S	S	*	*			trans	77.6	164.6	153.6	0	0	0	0	0	119.8
57	Q	28	Very low	28.3	Very low	150 Å²	150	153.2 Å²	153.2	70%	0.701	74%	0.74	S	S	*	*			cis	-175.5	165.2	-35.9	-170.9	168	0.2	0	0	108.2
58	L	27.4	Very low	28.9	Very low	167 Å²	167	150.4 Å²	150.4	87%	0.874	74%	0.736	S	S	*	*			trans	70.4	153	175.7	-64.3	104	0	0	0	116.2
59	G	25.1	Very low	28.9	Very low	68 Å²	68	152.1 Å²	152.1	70%	0.701	75%	0.748	S	S	*	*			trans	-159.3	178.2	169.3	0	0	0	0	0	108
60	N	26.1	Very low	29.2	Very low	156 Å²	156	147.2 Å²	147.2	83%	0.834	75%	0.748	S	S	*	*			trans	-158.3	155	172.1	-139.4	-14.1	0	0	0	115.5
61	S	27.4	Very low	29.3	Very low	88 Å²	88	143.4 Å²	143.4	62%	0.615	75%	0.747	S	S	*	*			trans	34	108.7	148.2	64.6	0	0	0	0	122.2
62	S	27.5	Very low	29.6	Very low	108 Å²	108	138.6 Å²	138.6	76%	0.755	75%	0.745	S	S	*	*				74.3	145.8	106.1	-154.2	0	0	0	0	122.4
63	C	27.8	Very low	30.1	Very low	96 Å²	96	139.2 Å²	139.2	65%	0.649	75%	0.745	S	S	*	*			trans	73.8	149.1	154.4	-76.9	0	0	0	0	119.8
64	R	29.5	Very low	30	Very low	204 Å²	204	140.4 Å²	140.4	77%	0.77	75%	0.753	S	S	*	*			cis	-173.5	153.8	-22	-122.9	179	-171	171.2	0.7	109.5
65	K	26.6	Very low	30.1	Very low	178 Å²	178	139.6 Å²	139.6	77%	0.774	75%	0.749	S	S	*	*			trans	64	164.3	154.5	-74.5	-176.8	176.3	-179.3	0	116.5
66	R	26.8	Very low	30.5	Very low	217 Å²	217	139.5 Å²	139.5	82%	0.819	75%	0.748	S	S	*	*			cis	-164.4	147.3	-32.7	-170.2	-172.2	-163.5	-177.2	5	108.1
67	E	29.9	Very low	30.9	Very low	152 Å²	152	143.7 Å²	143.7	71%	0.71	75%	0.753	S	S	*	*			trans	-29	156	148.7	-108.1	-176.7	158.5	0	0	115.8
68	P	42.3	Very low	31.1	Very low	106 Å²	106	144.2 Å²	144.2	69%	0.688	76%	0.76	S	S	*	*				-157.3	145.3	72.7	40.5	-19.3	0	0	0	121.5
69	L	29.7	Very low	31.3	Very low	151 Å²	151	141 Å²	141	79%	0.791	75%	0.75	S	S	*	*				67.9	159.7	127.2	-65.3	172.5	0	0	0	124.4
70	A	30.9	Very low	31.5	Very low	86 Å²	86	149.5 Å²	149.5	71%	0.711	76%	0.762	S	S	*	*			trans	72	120	162.3	0	0	0	0	0	117.3
71	V	27.8	Very low	31.8	Very low	130 Å²	130	147.1 Å²	147.1	79%	0.788	76%	0.757	S	S	*	*			cis	78.5	99.5	43.6	-178.9	0	0	0	0	113.8
72	T	30.9	Very low	32.7	Very low	137 Å²	137	148.4 Å²	148.4	84%	0.84	76%	0.763	S	S	*	*				-171.9	137.5	121.4	28.2	0	0	0	0	112.5
73	K	35.3	Very low	32.8	Very low	192 Å²	192	148.7 Å²	148.7	84%	0.835	76%	0.764	S	S	*	*			trans	-87.4	170	148.5	-63.7	-178.5	179.1	178.8	0	106.9
74	P	49	Very low	33	Very low	113 Å²	113	151.3 Å²	151.3	73%	0.734	77%	0.771	S	S	*	*			cis	-159.6	-174.6	33	40.4	-14.9	0	0	0	120.3
75	H	30.7	Very low	33	Very low	146 Å²	146	148.6 Å²	148.6	68%	0.676	77%	0.772	S	S	*	*			trans	91.1	129.8	131.3	-118.3	-49.2	0	0	0	125.7
76	R	34.2	Very low	33.4	Very low	201 Å²	201	151.3 Å²	151.3	76%	0.758	78%	0.777	S	S	*	*			trans	63.1	132.3	148.7	-100	161.7	-172.2	169.9	3.8	117.8
77	Q	36.9	Very low	34	Very low	171 Å²	171	147 Å²	147	80%	0.799	78%	0.777	S	S	*	*			cis	64.1	114.4	38.2	-68.5	-171	-22	0	0	116.3
78	L	31.9	Very low	34	Very low	161 Å²	161	144.2 Å²	144.2	84%	0.843	78%	0.775	S	S	*	*			trans	-165.1	116.1	136.7	-90.9	172.9	0	0	0	104.6
79	C	31.8	Very low	33.2	Very low	99 Å²	99	148.5 Å²	148.5	67%	0.669	78%	0.783	S	S	*	*				67.3	98.7	69.8	-61.2	0	0	0	0	115.1
80	R	28.8	Very low	33	Very low	248 Å²	248	145 Å²	145	94%	0.936	77%	0.771	S	S	*	*				177	154.3	114	-94.4	168.8	-171.6	-142.7	0.8	114.4
81	S	32	Very low	32.8	Very low	106 Å²	106	149.1 Å²	149.1	74%	0.741	78%	0.775	S	S	*	*			trans	-75.2	171.1	164.6	34.5	0	0	0	0	111.1
82	P	46.4	Very low	32.7	Very low	114 Å²	114	148.4 Å²	148.4	74%	0.74	78%	0.776	S	S	*	*			cis	-148.2	159.7	34.6	42.1	-20.9	0	0	0	121.3
83	C	29.4	Very low	32.4	Very low	115 Å²	115	147.9 Å²	147.9	78%	0.777	78%	0.778	S	S	*	*			trans	38.4	144.5	134.9	-48.5	0	0	0	0	124.8
84	L	32.5	Very low	32.1	Very low	151 Å²	151	144.4 Å²	144.4	79%	0.791	77%	0.773	S	S	*	*			trans	104.6	132	148.2	-65.5	-172.8	0	0	0	120.9
85	D	29.1	Very low	31.3	Very low	147 Å²	147	146.7 Å²	146.7	79%	0.786	78%	0.778	S	S	*	*			trans	67.2	130.7	149.8	-59.6	-34	0	0	0	124.6
86	R	34.1	Very low	31.1	Very low	234 Å²	234	147.6 Å²	147.6	88%	0.883	78%	0.783	S	S	*	*			trans	-84.9	156.5	168.5	-126.6	175.9	-177	-173.5	1	108
87	P	40	Very low	30.8	Very low	128 Å²	128	145.7 Å²	145.7	83%	0.831	79%	0.787	S	S	*	*				-141.2	172.1	89.4	35.1	-19.6	0	0	0	115.6
88	S	29.8	Very low	30.5	Very low	93 Å²	93	144.2 Å²	144.2	65%	0.65	78%	0.779	S	S	*	*			trans	-58.1	149.3	176	-170.4	0	0	0	0	113.7
89	F	25.2	Very low	30.6	Very low	196 Å²	196	146 Å²	146	86%	0.86	77%	0.774	S	S	*	*				-161.6	174.6	112.8	-115.7	-81.1	0	0	0	113.5
90	S	27.2	Very low	30.6	Very low	77 Å²	77	148 Å²	148	54%	0.538	78%	0.779	S	S	.	*			trans	-69.7	143.6	-159.1	-62.4	0	0	0	0	119.6
91	Q	26.9	Very low	30.9	Very low	173 Å²	173	142.8 Å²	142.8	81%	0.808	77%	0.769	S	S	*	*				68.9	155.3	129.3	-67.1	176.1	40.2	0	0	122.5
92	S	24.9	Very low	31.2	Very low	115 Å²	115	144.2 Å²	144.2	80%	0.804	77%	0.769	S	S	*	*			trans	57.4	107.5	157.8	54.9	0	0	0	0	119.6
93	S	25.3	Very low	30.5	Very low	125 Å²	125	143.9 Å²	143.9	87%	0.874	77%	0.769	S	S	*	*				-156.6	170.2	91.1	-160.4	0	0	0	0	111.1
94	T	28.7	Very low	30.5	Very low	120 Å²	120	142 Å²	142	74%	0.736	77%	0.769	S	S	*	*			trans	-119	163	-171	-32.9	0	0	0	0	111.2
95	L	31.3	Very low	30.2	Very low	160 Å²	160	139 Å²	139	84%	0.838	77%	0.774	S	S	*	*			trans	72.1	112.9	164.6	-55.8	175.3	0	0	0	117.9
96	Q	26.5	Very low	30.2	Very low	166 Å²	166	135.8 Å²	135.8	78%	0.776	78%	0.776	S	S	*	*				-151.4	131.8	111.2	-110.8	175.2	18	0	0	109.8	F98	Q96-F98 HydrophobicContact CG-CE2 4.47Å
97	D	28.7	Very low	29.9	Very low	160 Å²	160	131 Å²	131	86%	0.856	78%	0.779	S	S	*	*			trans	-151.6	160.5	146.3	-134.5	-28.8	0	0	0	108.9
98	F	30.5	Very low	29.5	Very low	141 Å²	141	129.8 Å²	129.8	62%	0.618	78%	0.779	S	S	*	*			trans	-108.2	142	-160.2	-77.1	-107.4	0	0	0	114.9	Q96	Q96-F98 HydrophobicContact CG-CE2 4.47Å
99	R	34.1	Very low	29.3	Very low	198 Å²	198	129.2 Å²	129.2	75%	0.747	79%	0.788	S	S	*	*			trans	34.2	139.4	136.3	-53.4	-175.7	177.9	-160.5	-3.4	119.8
100	D	31.1	Very low	29.6	Very low	142 Å²	142	125 Å²	125	76%	0.759	79%	0.79	S	S	*	*				-147.2	147.8	64.5	-69.7	-38.5	0	0	0	110.4
101	D	35.2	Very low	29.8	Very low	137 Å²	137	126.1 Å²	126.1	73%	0.733	80%	0.803	S	S	*	*				56.4	131.2	74	-79	-36.2	0	0	0	114.3
102	D	37.4	Very low	30.2	Very low	137 Å²	137	123.7 Å²	123.7	73%	0.733	81%	0.805	S	S	*	*			cis	-159.2	176.3	2.2	171.6	48.9	0	0	0	111.4
103	S	31.8	Very low	30.6	Very low	106 Å²	106	121.7 Å²	121.7	74%	0.741	80%	0.803	S	S	*	*			trans	78.7	135.4	162.6	-72.9	0	0	0	0	118.9
104	G	29.7	Very low	31.2	Very low	77 Å²	77	123.9 Å²	123.9	79%	0.794	80%	0.804	S	S	*	*			cis	169.4	97.3	-8.2	0	0	0	0	0	115.5
105	G	27.4	Very low	31.5	Very low	87 Å²	87	127.2 Å²	127.2	90%	0.897	81%	0.808	S	S	*	*			trans	76.4	155.7	169.1	0	0	0	0	0	117.1
106	G	27.4	Very low	32.2	Very low	80 Å²	80	125.3 Å²	125.3	83%	0.825	81%	0.805	S	S	*	*			cis	157.2	121.1	-14.5	0	0	0	0	0	114.5
107	S	29.2	Very low	33.2	Very low	133 Å²	133	120.7 Å²	120.7	93%	0.93	80%	0.796	S	S	*	*			trans	177.8	156.9	143.5	-166.6	0	0	0	0	111.8
108	A	30.6	Very low	34.5	Very low	103 Å²	103	116.3 Å²	116.3	85%	0.851	78%	0.778	S	S	*	*			trans	-78.9	152	-167.1	0	0	0	0	0	116.4
109	G	26.8	Very low	36.2	Very low	80 Å²	80	111.7 Å²	111.7	83%	0.825	77%	0.77	S	S	*	*			trans	-168.7	125.1	164.3	0	0	0	0	0	110.2
110	A	30.6	Very low	38	Very low	109 Å²	109	112.3 Å²	112.3	90%	0.901	77%	0.772	S	S	*	*			trans	-106.2	136.7	-166.1	0	0	0	0	0	114.1
111	A	32.4	Very low	40.1	Very low	99 Å²	99	110.6 Å²	110.6	82%	0.818	76%	0.76	S	S	*	*			trans	-161.9	144.4	149.8	0	0	0	0	0	112.4
112	S	34.4	Very low	42.3	Very low	122 Å²	122	106.6 Å²	106.6	85%	0.853	74%	0.735	S	S	*	*			trans	-45	135.1	172.1	49.6	0	0	0	0	116
113	G	33.8	Very low	44.5	Very low	74 Å²	74	104.8 Å²	104.8	76%	0.763	72%	0.722	S	S	*	*			trans	-96.8	166.5	174.8	0	0	0	0	0	115.2
114	L	38.6	Very low	47	Very low	171 Å²	171	104.1 Å²	104.1	90%	0.895	71%	0.713	S	S	*	*			trans	-165.1	110.9	171	-115.2	168	0	0	0	111.9
115	K	34	Very low	49.6	Very low	190 Å²	190	101.5 Å²	101.5	83%	0.826	68%	0.68	S	S	*	*			trans	144.5	114	152.3	-84.4	168.2	-179.9	177.9	0	113.5
116	P	45.7	Very low	52.2	Low	119 Å²	119	98.2 Å²	98.2	77%	0.773	64%	0.642	S	S	*	*			trans	-119.8	15.2	166.3	39.9	-30.3	0	0	0	114.2
117	A	46.9	Very low	54.9	Low	70 Å²	70	98.6 Å²	98.6	58%	0.579	62%	0.622	S	S	*	*	S	Bend	trans	-80	-42.6	-169.4	0	0	0	0	0	114.7	G119	A117-G119 VanDerWaalsContact C-N 3.33Å; A117-G119 PolarHBondContact O-N 2.68Å
118	S	57.7	Low	57.5	Low	67 Å²	67	96.4 Å²	96.4	47%	0.469	60%	0.596	S	S	.	*	H	α-helix	trans	-63.7	-32.7	-171.3	44.5	0	0	0	0	114.2	R120 E121 Y122	S118-R120 PolarHBondContact O-N 3.37Å; S118-E121 PolarHBondContact O-N 2.95Å; S118-Y122 WeakPolarHBondContact O-CB 3.48Å; S118-Y122 PolarHBondContact O-N 3.48Å
119	G	65.2	Low	60.1	Low	44 Å²	44	91.6 Å²	91.6	45%	0.454	56%	0.556	S	S	.	*	H	α-helix	trans	-63.6	-34.9	-174.4	0	0	0	0	0	114.3	A117 Q123	A117-G119 VanDerWaalsContact C-N 3.33Å; A117-G119 PolarHBondContact O-N 2.68Å; G119-Q123 WeakPolarHBondContact O-CB 3.32Å; G119-Q123 PolarHBondContact O-N 3.17Å
120	R	72.3	Confident	62.9	Low	211 Å²	211	91.5 Å²	91.5	80%	0.796	54%	0.536	S	S	*	.	H	α-helix	trans	-72.1	-39.2	179.2	-64.3	-169.8	-173.9	-151.8	1.8	112.3	S118 T124	S118-R120 PolarHBondContact O-N 3.37Å; R120-T124 WeakPolarHBondContact O-CB 3.25Å; R120-T124 PolarHBondContact O-N 3.42Å; R120-T124 PolarHBondContact O-OG1 3.47Å
121	E	74.4	Confident	65.4	Low	107 Å²	107	93.6 Å²	93.6	50%	0.5	53%	0.525	S	S	.	.	H	α-helix	trans	-68.6	-40.8	175.3	-70.8	-174.6	-154.2	0	0	111.6	S118 T124 K125	S118-E121 PolarHBondContact O-N 2.95Å; E121-T124 PolarHBondContact O-N 3.29Å; E121-K125 WeakPolarHBondContact O-CB 3.38Å; E121-K125 WeakPolarHBondContact O-CD 3.36Å; E121-K125 WeakPolarHBondContact O-CG 3.35Å; E121-K125 PolarHBondContact O-N 3.3Å; E121-K125 IonicContact OE2-NZ 3.47Å
122	Y	82.6	Confident	67.7	Low	52 Å²	52	93.4 Å²	93.4	20%	0.204	51%	0.51	C	S	.	.	H	α-helix	trans	-56.1	-52.6	171.6	-175.7	-84	0	0	0	110.9	S118 T124 K125 M126 E140 L143 N144	S118-Y122 WeakPolarHBondContact O-CB 3.48Å; S118-Y122 PolarHBondContact O-N 3.48Å; Y122-T124 VanDerWaalsContact C-N 3.31Å; Y122-T124 PolarHBondContact O-N 3.48Å; Y122-K125 PolarHBondContact O-N 3.33Å; Y122-M126 HydrophobicContact CE1-CE 4.23Å; Y122-M126 WeakPolarHBondContact O-CB 3.28Å; Y122-M126 PolarHBondContact O-N 2.97Å; Y122-E140 WeakPolarHBondContact OH-CG 3.4Å; Y122-L143 HydrophobicContact CD2-CB 4Å; Y122-L143 HydrophobicContact CD2-CD1 4.18Å; Y122-L143 HydrophobicContact CE1-CD1 4.45Å; Y122-L143 HydrophobicContact CE2-CB 3.46Å; Y122-L143 VanDerWaalsContact CE2-CB 3.46Å; Y122-L143 HydrophobicContact CE2-CD1 3.99Å; Y122-L143 HydrophobicContact CE2-CG 4.34Å; Y122-L143 HydrophobicContact CG-CD1 4.49Å; Y122-N144 PolarHBondContact OH-OD1 2.8Å
123	Q	82.1	Confident	69.6	Low	99 Å²	99	91 Å²	91	46%	0.463	50%	0.503	S	S	.	.	H	α-helix	trans	-60.8	-38.6	179.2	-165.5	64.8	27.6	0	0	112.6	G119 M126 E127	G119-Q123 WeakPolarHBondContact O-CB 3.32Å; G119-Q123 PolarHBondContact O-N 3.17Å; Q123-M126 PolarHBondContact O-N 2.98Å; Q123-E127 WeakPolarHBondContact O-CB 3.3Å; Q123-E127 PolarHBondContact O-N 3.2Å
124	T	86	Confident	72	Confident	92 Å²	92	90.6 Å²	90.6	56%	0.564	48%	0.479	S	S	*	.	H	α-helix	trans	-67.2	-40.7	177.7	-54.4	0	0	0	0	111.6	R120 E121 Y122 F128	R120-T124 WeakPolarHBondContact O-CB 3.25Å; R120-T124 PolarHBondContact O-N 3.42Å; R120-T124 PolarHBondContact O-OG1 3.47Å; E121-T124 PolarHBondContact O-N 3.29Å; Y122-T124 VanDerWaalsContact C-N 3.31Å; Y122-T124 PolarHBondContact O-N 3.48Å; T124-F128 VanDerWaalsContact O-CB 3.25Å; T124-F128 WeakPolarHBondContact O-CB 3.45Å; T124-F128 PolarHBondContact O-N 2.79Å
125	K	82.6	Confident	74.3	Confident	23 Å²	23	84.7 Å²	84.7	10%	0.1	45%	0.453	C	S	.	.	H	α-helix	trans	-68	-40.5	175.9	-66	165.3	-163.5	-175.9	0	111.1	E121 Y122 F128 A129 L143 A148 A150 I152	E121-K125 WeakPolarHBondContact O-CB 3.38Å; E121-K125 WeakPolarHBondContact O-CD 3.36Å; E121-K125 WeakPolarHBondContact O-CG 3.35Å; E121-K125 PolarHBondContact O-N 3.3Å; E121-K125 IonicContact OE2-NZ 3.47Å; Y122-K125 PolarHBondContact O-N 3.33Å; K125-F128 PolarHBondContact O-N 2.83Å; K125-A129 PolarHBondContact O-N 2.7Å; K125-A129 VanDerWaalsContact O-N 3.1Å; K125-L143 HydrophobicContact CB-CD1 4.31Å; K125-L143 HydrophobicContact CB-CD2 3.82Å; K125-L143 HydrophobicContact CD-CD2 4.17Å; K125-A148 PolarHBondContact NZ-O 3.49Å; K125-A150 WeakPolarHBondContact CE-O 3.21Å; K125-A150 PolarHBondContact NZ-O 3.23Å; K125-I152 HydrophobicContact CG-CG1 4.18Å
126	M	84	Confident	76.6	Confident	18 Å²	18	76.9 Å²	76.9	9%	0.089	43%	0.426	C	S	.	.	H	α-helix	trans	-58.7	-57.6	174.1	176.2	60.3	77.3	0	0	111.6	Y122 Q123 F128 A129 L130 V139 E140 L143	Y122-M126 HydrophobicContact CE1-CE 4.23Å; Y122-M126 WeakPolarHBondContact O-CB 3.28Å; Y122-M126 PolarHBondContact O-N 2.97Å; Q123-M126 PolarHBondContact O-N 2.98Å; M126-F128 PolarHBondContact O-N 3.44Å; M126-A129 PolarHBondContact O-N 3.41Å; M126-L130 HydrophobicContact CG-CD1 3.93Å; M126-L130 WeakPolarHBondContact O-CB 3.27Å; M126-L130 WeakPolarHBondContact O-CG 3.17Å; M126-L130 PolarHBondContact O-N 3.26Å; M126-L130 HydrophobicContact SD-CD1 3.93Å; M126-L130 HydrophobicContact SD-CG 4.13Å; M126-V139 HydrophobicContact CE-CB 4.23Å; M126-V139 HydrophobicContact CE-CG1 3.97Å; M126-V139 HydrophobicContact SD-CB 3.82Å; M126-V139 HydrophobicContact SD-CG1 3.52Å; M126-V139 VanDerWaalsContact SD-CG1 3.52Å; M126-E140 HydrophobicContact CE-CB 3.84Å; M126-L143 HydrophobicContact CB-CD1 4.14Å; M126-L143 HydrophobicContact CE-CD1 4.25Å
127	E	82.6	Confident	78.4	Confident	88 Å²	88	77 Å²	77	41%	0.411	42%	0.42	S	S	.	.	H	α-helix	trans	-58.7	-35.1	177.8	-83.6	-170	-136	0	0	113.3	Q123 K131	Q123-E127 WeakPolarHBondContact O-CB 3.3Å; Q123-E127 PolarHBondContact O-N 3.2Å; E127-K131 WeakPolarHBondContact O-CB 3.38Å; E127-K131 VanDerWaalsContact O-CD 3.27Å; E127-K131 WeakPolarHBondContact O-CD 3.28Å; E127-K131 WeakPolarHBondContact O-CG 3.47Å; E127-K131 PolarHBondContact O-N 3.35Å; E127-K131 IonicContact OE2-NZ 2.99Å; E127-K131 PolarHBondContact OE2-NZ 3.02Å
128	F	83.5	Confident	80.2	Confident	87 Å²	87	77.3 Å²	77.3	38%	0.382	41%	0.41	S	S	.	.	H	α-helix	trans	-67.6	-44.8	179.3	-179.8	-95.4	0	0	0	111.9	T124 K125 M126 K131 L132 I152 L156	T124-F128 VanDerWaalsContact O-CB 3.25Å; T124-F128 WeakPolarHBondContact O-CB 3.45Å; T124-F128 PolarHBondContact O-N 2.79Å; K125-F128 PolarHBondContact O-N 2.83Å; M126-F128 PolarHBondContact O-N 3.44Å; F128-K131 PolarHBondContact O-N 3.44Å; F128-L132 HydrophobicContact CD1-CD1 4.04Å; F128-L132 HydrophobicContact CE1-CD1 3.54Å; F128-L132 HydrophobicContact CZ-CD1 3.99Å; F128-L132 PolarHBondContact O-N 2.69Å; F128-I152 HydrophobicContact CD1-CG2 3.54Å; F128-I152 HydrophobicContact CE1-CG2 3.34Å; F128-I152 HydrophobicContact CZ-CG2 4.18Å; F128-L156 HydrophobicContact CE1-CD1 4.26Å
129	A	85.3	Confident	81.5	Confident	1 Å²	1	74.1 Å²	74.1	1%	0.008	39%	0.387	C	S	.	.	H	α-helix	trans	-71.7	-35.9	177.6	0	0	0	0	0	112.6	K125 M126 K131 L132 G133 Y134 V139 L159	K125-A129 PolarHBondContact O-N 2.7Å; K125-A129 VanDerWaalsContact O-N 3.1Å; M126-A129 PolarHBondContact O-N 3.41Å; A129-K131 VanDerWaalsContact C-N 3.32Å; A129-K131 PolarHBondContact O-N 3.05Å; A129-L132 WeakPolarHBondContact O-CA 3.41Å; A129-L132 WeakPolarHBondContact O-CB 3.19Å; A129-L132 PolarHBondContact O-N 3.37Å; A129-G133 PolarHBondContact O-N 3.2Å; A129-Y134 HydrophobicContact CB-CD2 4.46Å; A129-Y134 PolarHBondContact O-N 3.06Å; A129-V139 HydrophobicContact CB-CB 4.34Å; A129-V139 HydrophobicContact CB-CG1 3.76Å; A129-V139 HydrophobicContact CB-CG2 3.51Å; A129-L159 HydrophobicContact CB-CD1 3.86Å
130	L	85.4	Confident	82.4	Confident	79 Å²	79	76.5 Å²	76.5	41%	0.414	39%	0.387	S	S	.	.	H	α-helix	trans	-59.1	-41	170.1	-73	170.9	0	0	0	111.9	M126 L132 G133	M126-L130 HydrophobicContact CG-CD1 3.93Å; M126-L130 WeakPolarHBondContact O-CB 3.27Å; M126-L130 WeakPolarHBondContact O-CG 3.17Å; M126-L130 PolarHBondContact O-N 3.26Å; M126-L130 HydrophobicContact SD-CD1 3.93Å; M126-L130 HydrophobicContact SD-CG 4.13Å; L130-L132 PolarHBondContact O-N 3.02Å; L130-G133 PolarHBondContact O-N 2.72Å
131	K	84.4	Confident	83.1	Confident	152 Å²	152	70.3 Å²	70.3	66%	0.661	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-12.2	174.9	-74.4	162.1	-167.1	157.4	0	113.8	E127 F128 A129	E127-K131 WeakPolarHBondContact O-CB 3.38Å; E127-K131 VanDerWaalsContact O-CD 3.27Å; E127-K131 WeakPolarHBondContact O-CD 3.28Å; E127-K131 WeakPolarHBondContact O-CG 3.47Å; E127-K131 PolarHBondContact O-N 3.35Å; E127-K131 IonicContact OE2-NZ 2.99Å; E127-K131 PolarHBondContact OE2-NZ 3.02Å; F128-K131 PolarHBondContact O-N 3.44Å; A129-K131 VanDerWaalsContact C-N 3.32Å; A129-K131 PolarHBondContact O-N 3.05Å
132	L	79.9	Confident	83.6	Confident	96 Å²	96	65.2 Å²	65.2	50%	0.503	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.9	-1.2	172.8	-66.8	170.5	0	0	0	113.3	F128 A129 L130 Y134 L156	F128-L132 HydrophobicContact CD1-CD1 4.04Å; F128-L132 HydrophobicContact CE1-CD1 3.54Å; F128-L132 HydrophobicContact CZ-CD1 3.99Å; F128-L132 PolarHBondContact O-N 2.69Å; A129-L132 WeakPolarHBondContact O-CA 3.41Å; A129-L132 WeakPolarHBondContact O-CB 3.19Å; A129-L132 PolarHBondContact O-N 3.37Å; L130-L132 PolarHBondContact O-N 3.02Å; L132-Y134 HydrophobicContact CB-CD2 4.08Å; L132-Y134 HydrophobicContact CB-CE2 4.1Å; L132-L156 HydrophobicContact CD1-CD1 4.46Å; L132-L156 HydrophobicContact CD1-CD2 3.74Å
133	G	75.1	Confident	83.8	Confident	70 Å²	70	63 Å²	63	72%	0.722	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	94.2	7	173.1	0	0	0	0	0	116.2	A129 L130	A129-G133 PolarHBondContact O-N 3.2Å; L130-G133 PolarHBondContact O-N 2.72Å
134	Y	84.3	Confident	83.8	Confident	66 Å²	66	63 Å²	63	26%	0.259	34%	0.344	S	S	.	.			trans	-73.9	151.3	170.3	-62.5	-78.5	0	0	0	111.1	A129 L132 L156 L159	A129-Y134 HydrophobicContact CB-CD2 4.46Å; A129-Y134 PolarHBondContact O-N 3.06Å; L132-Y134 HydrophobicContact CB-CD2 4.08Å; L132-Y134 HydrophobicContact CB-CE2 4.1Å; Y134-L156 HydrophobicContact CE2-CD2 4.03Å; Y134-L159 HydrophobicContact CD1-CB 4.05Å; Y134-L159 HydrophobicContact CD1-CD2 4.21Å; Y134-L159 HydrophobicContact CD1-CG 4.5Å; Y134-L159 HydrophobicContact CD2-CD1 4.06Å; Y134-L159 HydrophobicContact CE1-CB 3.9Å; Y134-L159 HydrophobicContact CE2-CD1 4.44Å; Y134-L159 HydrophobicContact CG-CB 4.46Å; Y134-L159 HydrophobicContact CG-CD1 4.1Å; Y134-L159 HydrophobicContact CG-CD2 4.31Å
135	S	85.4	Confident	83.8	Confident	48 Å²	48	64.6 Å²	64.6	34%	0.336	34%	0.343	S	S	.	.			trans	-75.8	150.6	176.7	79.8	0	0	0	0	111.8	D137 Q138 V139	S135-D137 VanDerWaalsContact C-N 3.27Å; S135-D137 PolarHBondContact O-N 3.37Å; S135-Q138 PolarHBondContact O-N 2.85Å; S135-Q138 VanDerWaalsContact OG-CG 3.32Å; S135-Q138 WeakPolarHBondContact OG-CG 3.47Å; S135-Q138 PolarHBondContact OG-N 3.34Å; S135-V139 WeakPolarHBondContact O-CG2 3.29Å; S135-V139 PolarHBondContact O-N 3.1Å; S135-V139 VanDerWaalsContact O-N 3.11Å
136	G	82.3	Confident	83.8	Confident	26 Å²	26	66.1 Å²	66.1	27%	0.268	35%	0.352	S	S	.	.	H	α-helix	trans	-55.4	-43.2	-179.6	0	0	0	0	0	112.6	Q138 V139 E140	G136-Q138 PolarHBondContact O-N 2.96Å; G136-V139 PolarHBondContact O-N 3.34Å; G136-E140 WeakPolarHBondContact O-CB 3.47Å; G136-E140 PolarHBondContact O-N 2.95Å
137	D	84.6	Confident	83.1	Confident	121 Å²	121	66.5 Å²	66.5	65%	0.647	36%	0.361	S	S	*	.	H	α-helix	trans	-65.6	-37	-177.5	-29.3	-59.3	0	0	0	112.2	S135 T141	S135-D137 VanDerWaalsContact C-N 3.27Å; S135-D137 PolarHBondContact O-N 3.37Å; D137-T141 VanDerWaalsContact O-CB 3.28Å; D137-T141 WeakPolarHBondContact O-CB 3.5Å; D137-T141 PolarHBondContact O-N 2.9Å; D137-T141 PolarHBondContact O-OG1 3.44Å
138	Q	84.4	Confident	82.2	Confident	76 Å²	76	64.4 Å²	64.4	36%	0.355	36%	0.358	S	S	.	.	H	α-helix	trans	-65.8	-44.9	173.5	-72.1	172.3	-6.8	0	0	110.9	S135 G136 T141 V142 L159	S135-Q138 PolarHBondContact O-N 2.85Å; S135-Q138 VanDerWaalsContact OG-CG 3.32Å; S135-Q138 WeakPolarHBondContact OG-CG 3.47Å; S135-Q138 PolarHBondContact OG-N 3.34Å; G136-Q138 PolarHBondContact O-N 2.96Å; Q138-T141 PolarHBondContact O-N 3.44Å; Q138-V142 WeakPolarHBondContact O-CG2 3.28Å; Q138-V142 PolarHBondContact O-N 2.75Å; Q138-L159 HydrophobicContact CB-CD2 3.93Å
139	V	84.3	Confident	81.5	Confident	0 Å²	0	66.5 Å²	66.5	0%	0	38%	0.378	C	S	.	.	H	α-helix	trans	-67.4	-41.8	-179.5	179.3	0	0	0	0	111.3	M126 A129 S135 G136 V142 L143 L159	M126-V139 HydrophobicContact CE-CB 4.23Å; M126-V139 HydrophobicContact CE-CG1 3.97Å; M126-V139 HydrophobicContact SD-CB 3.82Å; M126-V139 HydrophobicContact SD-CG1 3.52Å; M126-V139 VanDerWaalsContact SD-CG1 3.52Å; A129-V139 HydrophobicContact CB-CB 4.34Å; A129-V139 HydrophobicContact CB-CG1 3.76Å; A129-V139 HydrophobicContact CB-CG2 3.51Å; S135-V139 WeakPolarHBondContact O-CG2 3.29Å; S135-V139 PolarHBondContact O-N 3.1Å; S135-V139 VanDerWaalsContact O-N 3.11Å; G136-V139 PolarHBondContact O-N 3.34Å; V139-V142 PolarHBondContact O-N 3.2Å; V139-L143 HydrophobicContact CG1-CD1 3.82Å; V139-L143 HydrophobicContact CG1-CG 4.34Å; V139-L143 WeakPolarHBondContact O-CB 3.3Å; V139-L143 VanDerWaalsContact O-CG 3.3Å; V139-L143 WeakPolarHBondContact O-CG 3.43Å; V139-L143 PolarHBondContact O-N 2.98Å; V139-L159 HydrophobicContact CG2-CD1 4.01Å; V139-L159 HydrophobicContact CG2-CD2 4.02Å
140	E	85.1	Confident	81.2	Confident	94 Å²	94	66.9 Å²	66.9	44%	0.439	38%	0.382	S	S	.	.	H	α-helix	trans	-61.7	-47.9	173.5	173.6	150	-159.6	0	0	111.1	Y122 M126 G136 V142 L143 N144	Y122-E140 WeakPolarHBondContact OH-CG 3.4Å; M126-E140 HydrophobicContact CE-CB 3.84Å; G136-E140 WeakPolarHBondContact O-CB 3.47Å; G136-E140 PolarHBondContact O-N 2.95Å; E140-V142 VanDerWaalsContact C-N 3.26Å; E140-V142 PolarHBondContact O-N 2.66Å; E140-L143 PolarHBondContact O-N 2.89Å; E140-N144 WeakPolarHBondContact CG-ND2 3.45Å; E140-N144 VanDerWaalsContact O-CB 3.27Å; E140-N144 WeakPolarHBondContact O-CB 3.33Å; E140-N144 VanDerWaalsContact O-CG 3.26Å; E140-N144 PolarHBondContact O-N 3.11Å; E140-N144 PolarHBondContact O-ND2 3.3Å; E140-N144 PolarHBondContact OE1-ND2 3.15Å
141	T	86	Confident	81.1	Confident	82 Å²	82	68.5 Å²	68.5	50%	0.503	39%	0.39	S	S	.	.	H	α-helix	trans	-56.1	-41.9	176.9	-60.9	0	0	0	0	111.6	D137 Q138 K145	D137-T141 VanDerWaalsContact O-CB 3.28Å; D137-T141 WeakPolarHBondContact O-CB 3.5Å; D137-T141 PolarHBondContact O-N 2.9Å; D137-T141 PolarHBondContact O-OG1 3.44Å; Q138-T141 PolarHBondContact O-N 3.44Å; T141-K145 WeakPolarHBondContact O-CB 3.43Å; T141-K145 PolarHBondContact O-N 3.27Å; T141-K145 VanDerWaalsContact O-N 3.09Å
142	V	86.6	Confident	81	Confident	0 Å²	0	64.5 Å²	64.5	0%	0	38%	0.375	C	S	.	.	H	α-helix	trans	-71.5	-44.1	177.7	171.9	0	0	0	0	112.6	Q138 V139 E140 N144 K145 L146 V155 E158 L159 L162	Q138-V142 WeakPolarHBondContact O-CG2 3.28Å; Q138-V142 PolarHBondContact O-N 2.75Å; V139-V142 PolarHBondContact O-N 3.2Å; E140-V142 VanDerWaalsContact C-N 3.26Å; E140-V142 PolarHBondContact O-N 2.66Å; V142-N144 VanDerWaalsContact C-N 3.34Å; V142-N144 PolarHBondContact O-N 3.22Å; V142-K145 PolarHBondContact O-N 2.98Å; V142-L146 HydrophobicContact CG1-CD1 3.74Å; V142-L146 HydrophobicContact CG1-CG 4.23Å; V142-L146 WeakPolarHBondContact O-CB 3.48Å; V142-L146 PolarHBondContact O-N 3.1Å; V142-V155 HydrophobicContact CG1-CB 4.29Å; V142-V155 HydrophobicContact CG1-CG1 3.91Å; V142-E158 HydrophobicContact CB-CB 4.32Å; V142-E158 HydrophobicContact CG1-CB 3.47Å; V142-E158 VanDerWaalsContact CG1-CB 3.47Å; V142-E158 HydrophobicContact CG1-CG 4.21Å; V142-E158 HydrophobicContact CG2-CB 3.83Å; V142-L159 HydrophobicContact CB-CD2 4.4Å; V142-L159 HydrophobicContact CB-CG 4.37Å; V142-L159 HydrophobicContact CG1-CG 4.5Å; V142-L159 HydrophobicContact CG2-CD2 3.86Å; V142-L159 HydrophobicContact CG2-CG 4Å; V142-L162 HydrophobicContact CG2-CD1 3.43Å; V142-L162 VanDerWaalsContact CG2-CD1 3.43Å; V142-L162 HydrophobicContact CG2-CG 4.44Å
143	L	85.4	Confident	81.1	Confident	4 Å²	4	65.7 Å²	65.7	2%	0.021	38%	0.382	C	S	.	.	H	α-helix	trans	-66.7	-36.5	179.6	-71.4	171.6	0	0	0	112	Y122 K125 M126 V139 E140 G147 V155	Y122-L143 HydrophobicContact CD2-CB 4Å; Y122-L143 HydrophobicContact CD2-CD1 4.18Å; Y122-L143 HydrophobicContact CE1-CD1 4.45Å; Y122-L143 HydrophobicContact CE2-CB 3.46Å; Y122-L143 VanDerWaalsContact CE2-CB 3.46Å; Y122-L143 HydrophobicContact CE2-CD1 3.99Å; Y122-L143 HydrophobicContact CE2-CG 4.34Å; Y122-L143 HydrophobicContact CG-CD1 4.49Å; K125-L143 HydrophobicContact CB-CD1 4.31Å; K125-L143 HydrophobicContact CB-CD2 3.82Å; K125-L143 HydrophobicContact CD-CD2 4.17Å; M126-L143 HydrophobicContact CB-CD1 4.14Å; M126-L143 HydrophobicContact CE-CD1 4.25Å; V139-L143 HydrophobicContact CG1-CD1 3.82Å; V139-L143 HydrophobicContact CG1-CG 4.34Å; V139-L143 WeakPolarHBondContact O-CB 3.3Å; V139-L143 VanDerWaalsContact O-CG 3.3Å; V139-L143 WeakPolarHBondContact O-CG 3.43Å; V139-L143 PolarHBondContact O-N 2.98Å; E140-L143 PolarHBondContact O-N 2.89Å; L143-G147 WeakPolarHBondContact O-CA 3.36Å; L143-G147 PolarHBondContact O-N 3.35Å; L143-V155 HydrophobicContact CD2-CG1 4.11Å; L143-V155 HydrophobicContact CD2-CG2 3.66Å; L143-V155 HydrophobicContact CG-CG1 4.48Å
144	N	83.5	Confident	81.6	Confident	101 Å²	101	65.9 Å²	65.9	54%	0.54	37%	0.366	S	S	.	.	H	α-helix	trans	-69.8	-32.6	174.3	-69.9	-16.3	0	0	0	111.8	Y122 E140 V142	Y122-N144 PolarHBondContact OH-OD1 2.8Å; E140-N144 WeakPolarHBondContact CG-ND2 3.45Å; E140-N144 VanDerWaalsContact O-CB 3.27Å; E140-N144 WeakPolarHBondContact O-CB 3.33Å; E140-N144 VanDerWaalsContact O-CG 3.26Å; E140-N144 PolarHBondContact O-N 3.11Å; E140-N144 PolarHBondContact O-ND2 3.3Å; E140-N144 PolarHBondContact OE1-ND2 3.15Å; V142-N144 VanDerWaalsContact C-N 3.34Å; V142-N144 PolarHBondContact O-N 3.22Å
145	K	85.1	Confident	81.5	Confident	124 Å²	124	62.9 Å²	62.9	54%	0.539	36%	0.355	S	S	.	.	H	α-helix	trans	-75.4	-41.5	176.5	-175	-169.9	-177.5	-165	0	113.7	T141 V142 E158	T141-K145 WeakPolarHBondContact O-CB 3.43Å; T141-K145 PolarHBondContact O-N 3.27Å; T141-K145 VanDerWaalsContact O-N 3.09Å; V142-K145 PolarHBondContact O-N 2.98Å; K145-E158 IonicContact NZ-OE1 2.75Å; K145-E158 PolarHBondContact NZ-OE1 3.1Å; K145-E158 IonicContact NZ-OE2 3.87Å; K145-E158 PolarHBondContact NZ-OE2 2.89Å
146	L	81.9	Confident	81.4	Confident	55 Å²	55	62.6 Å²	62.6	29%	0.288	35%	0.35	S	S	.	.	H	α-helix	trans	-89.6	-20	-177.9	-64	179.1	0	0	0	113.5	V142 A150 D154 V155 E158	V142-L146 HydrophobicContact CG1-CD1 3.74Å; V142-L146 HydrophobicContact CG1-CG 4.23Å; V142-L146 WeakPolarHBondContact O-CB 3.48Å; V142-L146 PolarHBondContact O-N 3.1Å; L146-A150 HydrophobicContact CB-CB 3.61Å; L146-A150 HydrophobicContact CD1-CB 4.21Å; L146-D154 HydrophobicContact CD1-CB 4.19Å; L146-V155 HydrophobicContact CD1-CG2 4.07Å; L146-E158 HydrophobicContact CD1-CB 4.22Å; L146-E158 HydrophobicContact CD1-CG 3.83Å; L146-E158 HydrophobicContact CD2-CG 3.9Å; L146-E158 HydrophobicContact CG-CG 4.02Å
147	G	69.4	Low	81.5	Confident	27 Å²	27	64.2 Å²	64.2	28%	0.278	36%	0.36	S	S	.	.			trans	77.4	166.9	179.5	0	0	0	0	0	114.4	L143 T149 A150	L143-G147 WeakPolarHBondContact O-CA 3.36Å; L143-G147 PolarHBondContact O-N 3.35Å; G147-T149 PolarHBondContact O-N 2.85Å; G147-A150 WeakPolarHBondContact O-CB 3.27Å; G147-A150 PolarHBondContact O-N 2.89Å; G147-A150 VanDerWaalsContact O-N 3.12Å
148	A	64.1	Low	81.5	Confident	43 Å²	43	59.1 Å²	59.1	36%	0.355	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-26.8	-171.1	0	0	0	0	0	114.7	K125 A150	K125-A148 PolarHBondContact NZ-O 3.49Å; A148-A150 VanDerWaalsContact C-N 3.35Å
149	T	69.1	Low	81.4	Confident	132 Å²	132	55.6 Å²	55.6	81%	0.81	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.2	-9.1	-178.7	45.7	0	0	0	0	114.8	G147	G147-T149 PolarHBondContact O-N 2.85Å
150	A	79.4	Confident	81.4	Confident	9 Å²	9	59.2 Å²	59.2	7%	0.074	34%	0.338	C	S	.	.			trans	-60.9	142.1	-179.5	0	0	0	0	0	112.4	K125 L146 G147 A148 V155	K125-A150 WeakPolarHBondContact CE-O 3.21Å; K125-A150 PolarHBondContact NZ-O 3.23Å; L146-A150 HydrophobicContact CB-CB 3.61Å; L146-A150 HydrophobicContact CD1-CB 4.21Å; G147-A150 WeakPolarHBondContact O-CB 3.27Å; G147-A150 PolarHBondContact O-N 2.89Å; G147-A150 VanDerWaalsContact O-N 3.12Å; A148-A150 VanDerWaalsContact C-N 3.35Å; A150-V155 HydrophobicContact CB-CG2 4.1Å
151	L	83.4	Confident	81.3	Confident	113 Å²	113	60.8 Å²	60.8	59%	0.592	34%	0.34	S	S	*	.			trans	-79.1	156.4	173.5	-54.7	177.7	0	0	0	110	N153 D154 V155	L151-N153 PolarHBondContact O-N 3.09Å; L151-D154 WeakPolarHBondContact CA-OD2 3.39Å; L151-D154 VanDerWaalsContact CB-OD2 3.24Å; L151-D154 WeakPolarHBondContact CB-OD2 3.44Å; L151-D154 PolarHBondContact N-OD2 3.27Å; L151-D154 WeakPolarHBondContact O-CB 3.31Å; L151-D154 PolarHBondContact O-N 3.42Å; L151-V155 PolarHBondContact O-N 3.35Å; L151-V155 VanDerWaalsContact O-N 3.16Å
152	I	81.4	Confident	80.7	Confident	68 Å²	68	59.1 Å²	59.1	35%	0.349	33%	0.328	S	S	.	.	H	α-helix	trans	-56.4	-36.7	179.4	-65.1	170.3	0	0	0	111.1	K125 F128 D154 V155 L156	K125-I152 HydrophobicContact CG-CG1 4.18Å; F128-I152 HydrophobicContact CD1-CG2 3.54Å; F128-I152 HydrophobicContact CE1-CG2 3.34Å; F128-I152 HydrophobicContact CZ-CG2 4.18Å; I152-D154 VanDerWaalsContact C-N 3.35Å; I152-D154 PolarHBondContact O-N 3.05Å; I152-V155 PolarHBondContact O-N 2.96Å; I152-L156 HydrophobicContact CG2-CD1 4.36Å; I152-L156 WeakPolarHBondContact O-CG 3.25Å; I152-L156 PolarHBondContact O-N 3.04Å
153	N	82.1	Confident	79.6	Confident	120 Å²	120	61.5 Å²	61.5	64%	0.642	35%	0.352	S	S	*	.	H	α-helix	trans	-65.6	-35.8	177.7	-61.7	-11.9	0	0	0	112.6	L151 L156 A157	L151-N153 PolarHBondContact O-N 3.09Å; N153-L156 PolarHBondContact O-N 3.36Å; N153-A157 WeakPolarHBondContact O-CB 3.48Å; N153-A157 PolarHBondContact O-N 3.33Å
154	D	85.1	Confident	78.2	Confident	74 Å²	74	68.1 Å²	68.1	40%	0.396	39%	0.388	S	S	.	.	H	α-helix	trans	-71	-40.8	179.8	-45.8	-35.1	0	0	0	110.3	L146 L151 I152 A157 E158	L146-D154 HydrophobicContact CD1-CB 4.19Å; L151-D154 WeakPolarHBondContact CA-OD2 3.39Å; L151-D154 VanDerWaalsContact CB-OD2 3.24Å; L151-D154 WeakPolarHBondContact CB-OD2 3.44Å; L151-D154 PolarHBondContact N-OD2 3.27Å; L151-D154 WeakPolarHBondContact O-CB 3.31Å; L151-D154 PolarHBondContact O-N 3.42Å; I152-D154 VanDerWaalsContact C-N 3.35Å; I152-D154 PolarHBondContact O-N 3.05Å; D154-A157 PolarHBondContact O-N 2.89Å; D154-E158 PolarHBondContact O-N 2.89Å
155	V	83.6	Confident	76.6	Confident	4 Å²	4	71.6 Å²	71.6	2%	0.024	40%	0.398	C	S	.	.	H	α-helix	trans	-61	-45.4	173.9	175.3	0	0	0	0	110.6	V142 L143 L146 A150 L151 I152 E158 L159	V142-V155 HydrophobicContact CG1-CB 4.29Å; V142-V155 HydrophobicContact CG1-CG1 3.91Å; L143-V155 HydrophobicContact CD2-CG1 4.11Å; L143-V155 HydrophobicContact CD2-CG2 3.66Å; L143-V155 HydrophobicContact CG-CG1 4.48Å; L146-V155 HydrophobicContact CD1-CG2 4.07Å; A150-V155 HydrophobicContact CB-CG2 4.1Å; L151-V155 PolarHBondContact O-N 3.35Å; L151-V155 VanDerWaalsContact O-N 3.16Å; I152-V155 PolarHBondContact O-N 2.96Å; V155-E158 PolarHBondContact O-N 3.03Å; V155-L159 HydrophobicContact CG1-CD1 3.97Å; V155-L159 WeakPolarHBondContact O-CB 3.26Å; V155-L159 WeakPolarHBondContact O-CG 3.48Å; V155-L159 PolarHBondContact O-N 2.74Å
156	L	82.8	Confident	74.5	Confident	42 Å²	42	71.1 Å²	71.1	22%	0.22	41%	0.405	C	S	.	.	H	α-helix	trans	-63.8	-39.6	174.4	-70.9	177.1	0	0	0	112.6	F128 L132 Y134 I152 N153 E158 L159 V160	F128-L156 HydrophobicContact CE1-CD1 4.26Å; L132-L156 HydrophobicContact CD1-CD1 4.46Å; L132-L156 HydrophobicContact CD1-CD2 3.74Å; Y134-L156 HydrophobicContact CE2-CD2 4.03Å; I152-L156 HydrophobicContact CG2-CD1 4.36Å; I152-L156 WeakPolarHBondContact O-CG 3.25Å; I152-L156 PolarHBondContact O-N 3.04Å; N153-L156 PolarHBondContact O-N 3.36Å; L156-E158 PolarHBondContact O-N 3.04Å; L156-L159 PolarHBondContact O-N 3.03Å; L156-V160 WeakPolarHBondContact O-CG2 3.39Å; L156-V160 PolarHBondContact O-N 3.01Å
157	A	83.7	Confident	72.4	Confident	60 Å²	60	77.7 Å²	77.7	50%	0.496	44%	0.435	S	S	.	.	H	α-helix	trans	-66.5	-35.2	178.9	0	0	0	0	0	113	N153 D154 R161	N153-A157 WeakPolarHBondContact O-CB 3.48Å; N153-A157 PolarHBondContact O-N 3.33Å; D154-A157 PolarHBondContact O-N 2.89Å; A157-R161 VanDerWaalsContact O-CB 3.29Å; A157-R161 WeakPolarHBondContact O-CB 3.19Å; A157-R161 PolarHBondContact O-N 2.76Å
158	E	84.6	Confident	70.7	Confident	13 Å²	13	84.9 Å²	84.9	6%	0.061	46%	0.46	C	S	.	.	H	α-helix	trans	-69.4	-44.5	168.3	-87.4	-72.3	170.9	0	0	112.2	V142 K145 L146 D154 V155 L156 V160 R161 L162	V142-E158 HydrophobicContact CB-CB 4.32Å; V142-E158 HydrophobicContact CG1-CB 3.47Å; V142-E158 VanDerWaalsContact CG1-CB 3.47Å; V142-E158 HydrophobicContact CG1-CG 4.21Å; V142-E158 HydrophobicContact CG2-CB 3.83Å; K145-E158 IonicContact NZ-OE1 2.75Å; K145-E158 PolarHBondContact NZ-OE1 3.1Å; K145-E158 IonicContact NZ-OE2 3.87Å; K145-E158 PolarHBondContact NZ-OE2 2.89Å; L146-E158 HydrophobicContact CD1-CB 4.22Å; L146-E158 HydrophobicContact CD1-CG 3.83Å; L146-E158 HydrophobicContact CD2-CG 3.9Å; L146-E158 HydrophobicContact CG-CG 4.02Å; D154-E158 PolarHBondContact O-N 2.89Å; V155-E158 PolarHBondContact O-N 3.03Å; L156-E158 PolarHBondContact O-N 3.04Å; E158-V160 PolarHBondContact O-N 2.79Å; E158-R161 VanDerWaalsContact CD-CZ 3.5Å; E158-R161 CarbonylContact O-C 3.5Å; E158-R161 WeakPolarHBondContact O-CA 3.5Å; E158-R161 PolarHBondContact O-N 3.44Å; E158-R161 IonicContact OE1-CZ 3.39Å; E158-R161 IonicContact OE1-NH1 2.92Å; E158-R161 PolarHBondContact OE1-NH1 3.22Å; E158-R161 IonicContact OE1-NH2 3.94Å; E158-R161 PolarHBondContact OE1-NH2 3.45Å; E158-R161 IonicContact OE2-CZ 3.57Å; E158-R161 IonicContact OE2-NH1 3.73Å; E158-R161 PolarHBondContact OE2-NH1 3.01Å; E158-R161 IonicContact OE2-NH2 2.59Å; E158-L162 PolarHBondContact O-N 2.96Å
159	L	83.9	Confident	69.2	Low	2 Å²	2	90.3 Å²	90.3	1%	0.01	48%	0.478	C	S	.	.	H	α-helix	trans	-59.8	-44.4	180	-77.8	167.1	0	0	0	112.4	A129 Y134 Q138 V139 V142 V155 L156 R161 L162 G163	A129-L159 HydrophobicContact CB-CD1 3.86Å; Y134-L159 HydrophobicContact CD1-CB 4.05Å; Y134-L159 HydrophobicContact CD1-CD2 4.21Å; Y134-L159 HydrophobicContact CD1-CG 4.5Å; Y134-L159 HydrophobicContact CD2-CD1 4.06Å; Y134-L159 HydrophobicContact CE1-CB 3.9Å; Y134-L159 HydrophobicContact CE2-CD1 4.44Å; Y134-L159 HydrophobicContact CG-CB 4.46Å; Y134-L159 HydrophobicContact CG-CD1 4.1Å; Y134-L159 HydrophobicContact CG-CD2 4.31Å; Q138-L159 HydrophobicContact CB-CD2 3.93Å; V139-L159 HydrophobicContact CG2-CD1 4.01Å; V139-L159 HydrophobicContact CG2-CD2 4.02Å; V142-L159 HydrophobicContact CB-CD2 4.4Å; V142-L159 HydrophobicContact CB-CG 4.37Å; V142-L159 HydrophobicContact CG1-CG 4.5Å; V142-L159 HydrophobicContact CG2-CD2 3.86Å; V142-L159 HydrophobicContact CG2-CG 4Å; V155-L159 HydrophobicContact CG1-CD1 3.97Å; V155-L159 WeakPolarHBondContact O-CB 3.26Å; V155-L159 WeakPolarHBondContact O-CG 3.48Å; V155-L159 PolarHBondContact O-N 2.74Å; L156-L159 PolarHBondContact O-N 3.03Å; L159-R161 VanDerWaalsContact C-N 3.32Å; L159-R161 PolarHBondContact O-N 2.94Å; L159-L162 PolarHBondContact O-N 3.17Å; L159-G163 PolarHBondContact O-N 2.82Å
160	V	83.6	Confident	67.3	Low	76 Å²	76	90 Å²	90	46%	0.461	48%	0.476	S	S	.	.	H	α-helix	trans	-61.9	-40.3	172.6	172.1	0	0	0	0	111	L156 E158 L162 G163 N164	L156-V160 WeakPolarHBondContact O-CG2 3.39Å; L156-V160 PolarHBondContact O-N 3.01Å; E158-V160 PolarHBondContact O-N 2.79Å; V160-L162 PolarHBondContact O-N 2.82Å; V160-G163 PolarHBondContact O-N 3.45Å; V160-N164 PolarHBondContact O-N 2.81Å; V160-N164 PolarHBondContact O-OD1 2.94Å
161	R	81.8	Confident	65.2	Low	128 Å²	128	98.2 Å²	98.2	48%	0.483	51%	0.513	S	S	.	.	H	α-helix	trans	-74	-22.2	179.4	-176	159.2	44.3	60.6	-6.5	114	A157 E158 L159	A157-R161 VanDerWaalsContact O-CB 3.29Å; A157-R161 WeakPolarHBondContact O-CB 3.19Å; A157-R161 PolarHBondContact O-N 2.76Å; E158-R161 VanDerWaalsContact CD-CZ 3.5Å; E158-R161 CarbonylContact O-C 3.5Å; E158-R161 WeakPolarHBondContact O-CA 3.5Å; E158-R161 PolarHBondContact O-N 3.44Å; E158-R161 IonicContact OE1-CZ 3.39Å; E158-R161 IonicContact OE1-NH1 2.92Å; E158-R161 PolarHBondContact OE1-NH1 3.22Å; E158-R161 IonicContact OE1-NH2 3.94Å; E158-R161 PolarHBondContact OE1-NH2 3.45Å; E158-R161 IonicContact OE2-CZ 3.57Å; E158-R161 IonicContact OE2-NH1 3.73Å; E158-R161 PolarHBondContact OE2-NH1 3.01Å; E158-R161 IonicContact OE2-NH2 2.59Å; L159-R161 VanDerWaalsContact C-N 3.32Å; L159-R161 PolarHBondContact O-N 2.94Å
162	L	73.7	Confident	63.1	Low	46 Å²	46	98 Å²	98	24%	0.241	52%	0.519	C	S	.	.	H	α-helix	trans	-80.3	-36.7	168.7	-71.2	-178	0	0	0	112	V142 E158 L159 V160 N164 K165	V142-L162 HydrophobicContact CG2-CD1 3.43Å; V142-L162 VanDerWaalsContact CG2-CD1 3.43Å; V142-L162 HydrophobicContact CG2-CG 4.44Å; E158-L162 PolarHBondContact O-N 2.96Å; L159-L162 PolarHBondContact O-N 3.17Å; V160-L162 PolarHBondContact O-N 2.82Å; L162-N164 PolarHBondContact O-N 3.47Å; L162-K165 PolarHBondContact O-N 3.27Å
163	G	64.4	Low	60.4	Low	50 Å²	50	100.3 Å²	100.3	52%	0.515	54%	0.54	S	S	.	.	H	α-helix	trans	-55.3	-33.8	173.2	0	0	0	0	0	113	L159 V160 K165	L159-G163 PolarHBondContact O-N 2.82Å; V160-G163 PolarHBondContact O-N 3.45Å; G163-K165 VanDerWaalsContact C-N 3.29Å; G163-K165 PolarHBondContact O-N 3.34Å
164	N	55.6	Low	57.7	Low	143 Å²	143	100.3 Å²	100.3	77%	0.765	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.7	14.6	175.9	-67.3	25.8	0	0	0	114.2	V160 L162	V160-N164 PolarHBondContact O-N 2.81Å; V160-N164 PolarHBondContact O-OD1 2.94Å; L162-N164 PolarHBondContact O-N 3.47Å
165	K	50.1	Low	55	Low	174 Å²	174	101.6 Å²	101.6	76%	0.757	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-134	8	-174.7	-91.4	-151.2	168.7	-155.6	0	116.5	L162 G163	L162-K165 PolarHBondContact O-N 3.27Å; G163-K165 VanDerWaalsContact C-N 3.29Å; G163-K165 PolarHBondContact O-N 3.34Å
166	V	41.4	Very low	52.2	Low	115 Å²	115	106.5 Å²	106.5	70%	0.697	61%	0.611	S	S	*	*			trans	-123.8	74.8	179.7	-171.4	0	0	0	0	111.2
167	E	37.4	Very low	49.6	Very low	193 Å²	193	109 Å²	109	90%	0.902	64%	0.637	S	S	*	*			trans	-165.1	85.9	146.1	-121.7	179.9	-168.9	0	0	111.4
168	H	34.3	Very low	47.8	Very low	177 Å²	177	111.4 Å²	111.4	82%	0.819	65%	0.648	S	S	*	*			trans	-161	92.9	155	-151.4	-72.6	0	0	0	111.8
169	E	32.4	Very low	45.2	Very low	157 Å²	157	115.9 Å²	115.9	73%	0.734	68%	0.681	S	S	*	*			trans	176.7	152.9	136.5	-98.9	-73.2	69.9	0	0	112.5
170	T	29.1	Very low	42.6	Very low	125 Å²	125	121.7 Å²	121.7	77%	0.767	72%	0.717	S	S	*	*			trans	63.8	125.1	166	56.9	0	0	0	0	122.4
171	Q	35.5	Very low	40	Very low	182 Å²	182	123.7 Å²	123.7	85%	0.85	73%	0.734	S	S	*	*			trans	-89.9	178.2	163.7	-76	-171.7	-7.7	0	0	110.7
172	P	37.9	Very low	37.6	Very low	110 Å²	110	129 Å²	129	71%	0.714	75%	0.754	S	S	*	*			cis	-143.8	164.3	17.2	41.8	-21.4	0	0	0	120.4
173	C	24.9	Very low	36.6	Very low	116 Å²	116	132.1 Å²	132.1	78%	0.784	78%	0.777	S	S	*	*			trans	34.2	118.2	146.7	-60.2	0	0	0	0	122.7
174	S	26.8	Very low	35.6	Very low	120 Å²	120	135.4 Å²	135.4	84%	0.839	79%	0.789	S	S	*	*				173.1	136.7	105.1	-76.9	0	0	0	0	117.2
175	A	26.7	Very low	34.2	Very low	101 Å²	101	134 Å²	134	84%	0.835	79%	0.79	S	S	*	*			trans	68.5	140.6	144.4	0	0	0	0	0	124.6
176	A	25.8	Very low	33.5	Very low	107 Å²	107	131.7 Å²	131.7	88%	0.884	79%	0.79	S	S	*	*			trans	79.9	144	154.4	0	0	0	0	0	121.8
177	A	28.9	Very low	32.9	Very low	93 Å²	93	134.8 Å²	134.8	77%	0.769	79%	0.794	S	S	*	*			trans	-140	176.2	173.9	0	0	0	0	0	107.6
178	P	45.7	Very low	32.5	Very low	111 Å²	111	132.6 Å²	132.6	72%	0.721	78%	0.784	S	S	*	*				-156.8	159.6	53.1	41.4	-19.1	0	0	0	120.2
179	S	30.2	Very low	32.4	Very low	107 Å²	107	130.2 Å²	130.2	75%	0.748	78%	0.781	S	S	*	*			trans	68.8	159.3	145.8	75.6	0	0	0	0	119.6
180	T	29.4	Very low	32.4	Very low	125 Å²	125	129.4 Å²	129.4	77%	0.767	79%	0.787	S	S	*	*			cis	-154.7	160.9	6.8	-30.8	0	0	0	0	113.8
181	S	28.6	Very low	32.5	Very low	118 Å²	118	128.2 Å²	128.2	83%	0.825	78%	0.784	S	S	*	*			trans	96	171.9	151.3	82	0	0	0	0	121.1
182	R	31.8	Very low	32.8	Very low	239 Å²	239	125.1 Å²	125.1	90%	0.902	78%	0.779	S	S	*	*			trans	-134.7	-163.7	-151.1	-59.9	173.3	161.1	-180	-7	113.5
183	P	52	Low	32.5	Very low	112 Å²	112	128.7 Å²	128.7	73%	0.727	79%	0.786	S	S	*	*				-117.2	-174.4	-93.5	44.9	-27.7	0	0	0	112.5
184	P	42.5	Very low	33.2	Very low	119 Å²	119	129.3 Å²	129.3	77%	0.773	79%	0.787	S	S	*	*				-160.6	140.6	78.1	39.6	-16.2	0	0	0	120.3
185	C	26.4	Very low	33.5	Very low	114 Å²	114	129.2 Å²	129.2	77%	0.77	79%	0.786	S	S	*	*				63	134.1	129.7	-132.3	0	0	0	0	126.1
186	V	35.2	Very low	34.4	Very low	125 Å²	125	130.2 Å²	130.2	76%	0.758	78%	0.781	S	S	*	*			trans	70.5	142.2	149.6	-75.8	0	0	0	0	125.5
187	K	29.5	Very low	35.4	Very low	180 Å²	180	133.9 Å²	133.9	78%	0.783	78%	0.78	S	S	*	*			trans	87.9	145.8	162.1	-61.5	-163.5	175.3	-168.7	0	119
188	E	29.2	Very low	35.9	Very low	147 Å²	147	137.7 Å²	137.7	69%	0.687	78%	0.782	S	S	*	*			cis	-162.5	142.9	-29.7	-121.9	177.1	114.2	0	0	110.3
189	T	31.4	Very low	35.9	Very low	126 Å²	126	141.5 Å²	141.5	77%	0.773	79%	0.79	S	S	*	*			trans	31	102	148.5	-44.1	0	0	0	0	121.1
190	V	32.3	Very low	36.8	Very low	141 Å²	141	139.7 Å²	139.7	86%	0.855	78%	0.777	S	S	*	*			trans	-135.4	142.3	146.4	177.7	0	0	0	0	108.7
191	S	31.7	Very low	37.8	Very low	100 Å²	100	138.4 Å²	138.4	70%	0.699	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-85.4	140.7	176.5	-173.1	0	0	0	0	110.7
192	P	42.6	Very low	39	Very low	116 Å²	116	137.7 Å²	137.7	75%	0.753	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-65.8	140	163.7	30	-33.4	0	0	0	109.6
193	E	30.9	Very low	40.2	Very low	185 Å²	185	129.5 Å²	129.5	86%	0.864	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-93.5	146.1	165.4	-170.9	163.7	-154.7	0	0	108.4	S195	E193-S195 PolarHBondContact O-N 3.39Å; E193-S195 VanDerWaalsContact O-N 3.07Å
194	V	40.7	Very low	40.8	Very low	130 Å²	130	129 Å²	129	79%	0.788	72%	0.717	S	S	*	*			trans	-77	101.6	-167.5	179.8	0	0	0	0	111.1	V196	V194-V196 HydrophobicContact CG1-CG2 3.82Å
195	S	31.3	Very low	42.4	Very low	117 Å²	117	128.5 Å²	128.5	82%	0.818	71%	0.708	S	S	*	*			trans	-93.6	111.6	160.7	-61.8	0	0	0	0	108.8	E193 E197	E193-S195 PolarHBondContact O-N 3.39Å; E193-S195 VanDerWaalsContact O-N 3.07Å; S195-E197 PolarHBondContact O-N 3.24Å
196	V	46	Very low	45.4	Very low	122 Å²	122	124.3 Å²	124.3	74%	0.739	68%	0.678	S	S	*	*			trans	-85.5	102.6	175	-179.3	0	0	0	0	108.6	V194	V194-V196 HydrophobicContact CG1-CG2 3.82Å
197	E	47.1	Very low	48.3	Very low	185 Å²	185	119.4 Å²	119.4	86%	0.864	65%	0.647	S	S	*	*			trans	170.4	80.3	153.2	-97.2	161.6	-137.7	0	0	110.3	S195	S195-E197 PolarHBondContact O-N 3.24Å
198	E	39.9	Very low	51.5	Low	172 Å²	172	112.1 Å²	112.1	80%	0.804	62%	0.615	S	S	*	*			trans	179.3	83	146.9	-105.4	-172	173.1	0	0	112.4	S200	E198-S200 PolarHBondContact O-N 2.95Å
199	E	44.4	Very low	54.7	Low	192 Å²	192	105.6 Å²	105.6	90%	0.897	59%	0.585	S	S	*	*			trans	-82.9	95.1	162	-85.6	-163	99.8	0	0	110.3
200	S	49.7	Very low	57.9	Low	68 Å²	68	99.6 Å²	99.6	48%	0.476	55%	0.548	S	S	.	.	S	Bend	trans	-165.6	-43.9	156.1	55.1	0	0	0	0	115.3	E198 Y204	E198-S200 PolarHBondContact O-N 2.95Å; S200-Y204 VanDerWaalsContact O-CE2 3.3Å; S200-Y204 WeakPolarHBondContact O-CE2 3.4Å
201	V	50.5	Low	61.1	Low	98 Å²	98	93 Å²	93	59%	0.594	51%	0.508	S	S	*	.	S	Bend	trans	-84.9	-53.4	-167	-173	0	0	0	0	112.6	T203 Y204	V201-T203 PolarHBondContact O-N 3.2Å; V201-T203 VanDerWaalsContact O-N 3.14Å; V201-Y204 PolarHBondContact O-N 3.41Å
202	D	53.8	Low	64.2	Low	103 Å²	103	88.2 Å²	88.2	55%	0.551	48%	0.475	S	S	*	.	H	α-helix	trans	-66.1	-21.5	-166.9	-135	14.3	0	0	0	113.8	Y204 N206	D202-Y204 VanDerWaalsContact C-N 3.3Å; D202-Y204 PolarHBondContact O-N 2.9Å; D202-N206 PolarHBondContact O-ND2 2.92Å
203	T	57.3	Low	66.9	Low	67 Å²	67	82.9 Å²	82.9	41%	0.411	44%	0.44	S	S	.	.	H	α-helix	trans	-63.7	-32.3	-176.1	-53.6	0	0	0	0	113.2	V201	V201-T203 PolarHBondContact O-N 3.2Å; V201-T203 VanDerWaalsContact O-N 3.14Å
204	Y	64.9	Low	70.1	Confident	103 Å²	103	74.1 Å²	74.1	40%	0.404	40%	0.399	S	S	.	.	H	α-helix	trans	-78.3	-41	-175.2	-64.1	-73.4	0	0	0	113.1	S200 V201 D202 N206 L207 G243	S200-Y204 VanDerWaalsContact O-CE2 3.3Å; S200-Y204 WeakPolarHBondContact O-CE2 3.4Å; V201-Y204 PolarHBondContact O-N 3.41Å; D202-Y204 VanDerWaalsContact C-N 3.3Å; D202-Y204 PolarHBondContact O-N 2.9Å; Y204-N206 PolarHBondContact O-N 3.46Å; Y204-L207 WeakPolarHBondContact O-CB 3.33Å; Y204-L207 PolarHBondContact O-N 3.03Å; Y204-G243 WeakPolarHBondContact CD1-O 3.42Å
205	D	76.4	Confident	72.8	Confident	107 Å²	107	68.9 Å²	68.9	57%	0.572	37%	0.368	S	S	*	.	H	α-helix	trans	-71.1	-18	-177.7	-69.2	-7	0	0	0	112.2	L207 K366	D205-L207 VanDerWaalsContact C-N 3.29Å; D205-L207 PolarHBondContact O-N 2.89Å; D205-K366 WeakPolarHBondContact O-CD 3.38Å; D205-K366 PolarHBondContact O-NZ 3.2Å
206	N	89.5	Confident	75.9	Confident	27 Å²	27	65 Å²	65	14%	0.144	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-12.8	171.2	-81.1	-58.1	0	0	0	114.7	D202 Y204 R365 K366 R367	D202-N206 PolarHBondContact O-ND2 2.92Å; Y204-N206 PolarHBondContact O-N 3.46Å; N206-R365 CarbonylContact O-C 3.56Å; N206-R365 WeakPolarHBondContact O-CA 3.09Å; N206-K366 PolarHBondContact O-N 3.35Å; N206-R367 PolarHBondContact ND2-NH2 3.17Å; N206-R367 PolarHBondContact OD1-NE 3.28Å; N206-R367 PolarHBondContact OD1-NH2 3.41Å
207	L	95	Very high	78.4	Confident	21 Å²	21	59.2 Å²	59.2	11%	0.11	30%	0.303	C	S	.	.	B	Isolated β-bridge	trans	-78.5	149.3	177.7	-61.3	176.7	0	0	0	112	Y204 D205 G243 R365 K366	Y204-L207 WeakPolarHBondContact O-CB 3.33Å; Y204-L207 PolarHBondContact O-N 3.03Å; D205-L207 VanDerWaalsContact C-N 3.29Å; D205-L207 PolarHBondContact O-N 2.89Å; L207-G243 WeakPolarHBondContact CD1-O 3.48Å; L207-R365 HydrophobicContact CD2-CG 4.11Å; L207-K366 WeakPolarHBondContact O-CE 3.42Å; L207-K366 PolarHBondContact O-NZ 3.36Å
208	R	96.1	Very high	80.8	Confident	27 Å²	27	50.4 Å²	50.4	10%	0.102	26%	0.262	C	S	.	.	P	Polyproline II helix	trans	-79.2	148.2	172.2	-70.4	-178.6	-177.3	-80.6	-7.5	111.5	H244 D309 I311 F363 L364 R365 K366	R208-H244 PolarHBondContact O-ND1 3.39Å; R208-H244 VanDerWaalsContact O-ND1 3.13Å; R208-D309 IonicContact CZ-OD2 2.92Å; R208-D309 PolarHBondContact NH1-O 3.27Å; R208-D309 IonicContact NH1-OD1 3.66Å; R208-D309 PolarHBondContact NH1-OD1 3.32Å; R208-D309 VanDerWaalsContact NH1-OD1 3.14Å; R208-D309 IonicContact NH1-OD2 3.13Å; R208-D309 PolarHBondContact NH1-OD2 2.9Å; R208-D309 IonicContact NH2-OD2 3.24Å; R208-I311 HydrophobicContact CB-CG1 4.12Å; R208-F363 WeakPolarHBondContact CD-O 3.42Å; R208-F363 PolarHBondContact NE-O 3.12Å; R208-L364 PolarHBondContact N-O 3.28Å; R208-R365 PolarHBondContact NE-O 3.31Å; R208-R365 PolarHBondContact NH2-O 3.22Å; R208-K366 HydrophobicContact CG-CG 3.95Å; R208-K366 PolarHBondContact NH2-O 3.4Å
209	P	97.4	Very high	83.6	Confident	11 Å²	11	44.7 Å²	44.7	7%	0.071	24%	0.236	C	C	.	.	P	Polyproline II helix	trans	-55.1	139.3	162.6	-23.6	34.7	0	0	0	110.7	D246 G310 I311	P209-D246 HydrophobicContact CB-CB 4.48Å; P209-D246 WeakPolarHBondContact CB-OD2 3.38Å; P209-D246 WeakPolarHBondContact CG-OD2 3.5Å; P209-G310 CarbonylContact O-C 3.48Å; P209-G310 WeakPolarHBondContact O-CA 3.39Å; P209-I311 PolarHBondContact O-N 2.9Å
210	I	98.4	Very high	86.1	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	119.7	178.7	-54.9	-57.5	0	0	0	109.1	I212 F239 H244 D246 I247 T248 I311 V313 L364	I210-I212 HydrophobicContact CG2-CD1 4.22Å; I210-I212 HydrophobicContact CG2-CG1 3.78Å; I210-F239 HydrophobicContact CD1-CD1 4.2Å; I210-F239 HydrophobicContact CD1-CE1 4.21Å; I210-F239 HydrophobicContact CG1-CD1 3.97Å; I210-F239 HydrophobicContact CG1-CE1 4.39Å; I210-F239 HydrophobicContact CG1-CG 4.34Å; I210-F239 HydrophobicContact CG2-CD1 4.2Å; I210-F239 HydrophobicContact CG2-CD2 4Å; I210-F239 HydrophobicContact CG2-CE1 4.19Å; I210-F239 HydrophobicContact CG2-CE2 4.03Å; I210-F239 HydrophobicContact CG2-CG 4.13Å; I210-F239 HydrophobicContact CG2-CZ 4.13Å; I210-H244 HydrophobicContact CG1-CB 4.32Å; I210-H244 VanDerWaalsContact CG1-ND1 3.34Å; I210-H244 WeakPolarHBondContact CG1-ND1 3.32Å; I210-D246 PolarHBondContact N-O 2.85Å; I210-I247 HydrophobicContact CB-CG1 4.4Å; I210-I247 HydrophobicContact CB-CG2 4.49Å; I210-I247 CarbonylContact O-C 3.59Å; I210-I247 WeakPolarHBondContact O-CA 3.2Å; I210-T248 PolarHBondContact O-N 2.84Å; I210-I311 HydrophobicContact CD1-CB 3.94Å; I210-I311 HydrophobicContact CD1-CG1 4.26Å; I210-V313 HydrophobicContact CG2-CG2 3.61Å; I210-L364 HydrophobicContact CD1-CD2 3.75Å
211	V	98.6	Very high	88.3	Confident	2 Å²	2	35.9 Å²	35.9	1%	0.012	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	113.3	175.3	-170.2	0	0	0	0	109.1	T248 F250 I301 L304 A305 I311 I312 V313	V211-T248 CarbonylContact C-O 3.56Å; V211-T248 VanDerWaalsContact CA-O 3.3Å; V211-T248 WeakPolarHBondContact CA-O 3.47Å; V211-F250 HydrophobicContact CG1-CD2 3.83Å; V211-F250 HydrophobicContact CG1-CE2 3.89Å; V211-I301 HydrophobicContact CG1-CB 4.43Å; V211-I301 HydrophobicContact CG1-CG2 4.1Å; V211-L304 HydrophobicContact CG1-CB 4.46Å; V211-L304 HydrophobicContact CG1-CD2 4.22Å; V211-L304 HydrophobicContact CG2-CB 4.31Å; V211-L304 HydrophobicContact CG2-CD2 3.96Å; V211-L304 HydrophobicContact CG2-CG 3.95Å; V211-A305 HydrophobicContact CB-CB 4.14Å; V211-A305 HydrophobicContact CG2-CB 3.89Å; V211-I311 PolarHBondContact N-O 3.1Å; V211-I312 CarbonylContact O-C 3.12Å; V211-I312 WeakPolarHBondContact O-CA 3.47Å; V211-V313 PolarHBondContact O-N 3.12Å
212	I	98.7	Very high	90.4	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	129.3	-173.6	-51.9	-174.4	0	0	0	110.3	I210 G214 V217 V236 F239 I247 T248 V249 F250 V313	I210-I212 HydrophobicContact CG2-CD1 4.22Å; I210-I212 HydrophobicContact CG2-CG1 3.78Å; I212-G214 PolarHBondContact O-N 2.88Å; I212-G214 VanDerWaalsContact O-N 3.09Å; I212-V217 HydrophobicContact CG2-CB 4.48Å; I212-V217 HydrophobicContact CG2-CG2 3.7Å; I212-V236 HydrophobicContact CD1-CG2 4.05Å; I212-F239 HydrophobicContact CD1-CD2 3.94Å; I212-F239 HydrophobicContact CD1-CE2 4.12Å; I212-I247 HydrophobicContact CD1-CG2 3.79Å; I212-I247 HydrophobicContact CG1-CG2 4.29Å; I212-T248 PolarHBondContact N-O 3.06Å; I212-V249 HydrophobicContact CB-CB 4.42Å; I212-V249 HydrophobicContact CB-CG1 4.34Å; I212-V249 HydrophobicContact CB-CG2 4.08Å; I212-V249 HydrophobicContact CD1-CG2 4.25Å; I212-V249 HydrophobicContact CG1-CG2 4.48Å; I212-V249 HydrophobicContact CG2-CG1 4.47Å; I212-V249 WeakPolarHBondContact O-CA 3.43Å; I212-F250 PolarHBondContact O-N 2.99Å; I212-V313 HydrophobicContact CB-CB 4.42Å; I212-V313 HydrophobicContact CG1-CB 4.14Å; I212-V313 HydrophobicContact CG1-CG2 4.22Å; I212-V313 HydrophobicContact CG2-CB 4.33Å
213	D	98.4	Very high	92.2	Very high	4 Å²	4	32.7 Å²	32.7	2%	0.021	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	88.6	166.8	-173.2	-22.6	0	0	0	109.4	S215 N216 V217 I301 V313 S314 Y318	D213-S215 PolarHBondContact O-N 3.04Å; D213-S215 WeakPolarHBondContact OD1-CB 3.08Å; D213-S215 PolarHBondContact OD1-N 2.93Å; D213-N216 HydrophobicContact CB-CB 3.96Å; D213-N216 PolarHBondContact O-N 2.75Å; D213-N216 WeakPolarHBondContact OD1-CB 2.89Å; D213-N216 PolarHBondContact OD1-N 3.36Å; D213-N216 WeakPolarHBondContact OD2-CB 3.29Å; D213-V217 WeakPolarHBondContact O-CB 3.49Å; D213-V217 WeakPolarHBondContact O-CG2 3.48Å; D213-V217 PolarHBondContact O-N 2.95Å; D213-I301 HydrophobicContact CB-CD1 3.85Å; D213-V313 WeakPolarHBondContact CB-O 3.39Å; D213-V313 PolarHBondContact N-O 3.23Å; D213-S314 PolarHBondContact OD2-OG 2.75Å; D213-Y318 WeakPolarHBondContact CB-OH 3.31Å; D213-Y318 PolarHBondContact OD2-OH 3.5Å
214	G	97.9	Very high	93.8	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-63.9	-24.8	-179.6	0	0	0	0	0	112.6	I212 A218 I232 F250	I212-G214 PolarHBondContact O-N 2.88Å; I212-G214 VanDerWaalsContact O-N 3.09Å; G214-A218 VanDerWaalsContact O-CB 3.25Å; G214-A218 WeakPolarHBondContact O-CB 2.93Å; G214-A218 PolarHBondContact O-N 2.8Å; G214-A218 VanDerWaalsContact O-N 3.09Å; G214-I232 WeakPolarHBondContact O-CD1 3.48Å; G214-F250 WeakPolarHBondContact CA-O 3.49Å; G214-F250 PolarHBondContact N-O 3.09Å
215	S	96.8	Very high	95.1	Very high	21 Å²	21	40.2 Å²	40.2	15%	0.147	21%	0.206	C	C	.	.	H	α-helix	trans	-66	-52.3	172.9	-73.3	0	0	0	0	111.4	D213 M219 P252 D297	D213-S215 PolarHBondContact O-N 3.04Å; D213-S215 WeakPolarHBondContact OD1-CB 3.08Å; D213-S215 PolarHBondContact OD1-N 2.93Å; S215-M219 WeakPolarHBondContact O-CB 3.37Å; S215-M219 VanDerWaalsContact O-CG 3.26Å; S215-M219 WeakPolarHBondContact O-CG 3.45Å; S215-M219 PolarHBondContact O-N 3.22Å; S215-P252 VanDerWaalsContact OG-CD 3.25Å; S215-P252 WeakPolarHBondContact OG-CD 3.34Å; S215-D297 WeakPolarHBondContact CB-OD2 3.41Å; S215-D297 PolarHBondContact OG-OD2 3.35Å
216	N	97.9	Very high	95.9	Very high	35 Å²	35	36.8 Å²	36.8	19%	0.187	19%	0.189	C	C	.	.	H	α-helix	trans	-67.4	-40.1	179.5	-156.9	-74.3	0	0	0	112	D213 S220 S314 N315 D316 Y339	D213-N216 HydrophobicContact CB-CB 3.96Å; D213-N216 PolarHBondContact O-N 2.75Å; D213-N216 WeakPolarHBondContact OD1-CB 2.89Å; D213-N216 PolarHBondContact OD1-N 3.36Å; D213-N216 WeakPolarHBondContact OD2-CB 3.29Å; N216-S220 WeakPolarHBondContact O-CB 3.3Å; N216-S220 PolarHBondContact O-N 3.43Å; N216-S314 VanDerWaalsContact CB-OG 3.31Å; N216-S314 WeakPolarHBondContact CB-OG 3.04Å; N216-S314 PolarHBondContact ND2-OG 2.73Å; N216-N315 WeakPolarHBondContact OD1-CB 3.31Å; N216-N315 PolarHBondContact OD1-N 2.85Å; N216-N315 VanDerWaalsContact OD1-N 3.13Å; N216-D316 PolarHBondContact ND2-N 3.02Å; N216-Y339 PolarHBondContact O-OH 3.13Å; N216-Y339 PolarHBondContact OD1-OH 3.37Å
217	V	98.4	Very high	96.3	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-64.8	-50	178.9	169	0	0	0	0	112	I212 D213 M219 S220 H221 G231 I232 A235 Y339 F341	I212-V217 HydrophobicContact CG2-CB 4.48Å; I212-V217 HydrophobicContact CG2-CG2 3.7Å; D213-V217 WeakPolarHBondContact O-CB 3.49Å; D213-V217 WeakPolarHBondContact O-CG2 3.48Å; D213-V217 PolarHBondContact O-N 2.95Å; V217-M219 PolarHBondContact O-N 3.4Å; V217-S220 PolarHBondContact O-N 2.86Å; V217-H221 PolarHBondContact O-N 2.69Å; V217-G231 VanDerWaalsContact CG1-C 3.49Å; V217-G231 WeakPolarHBondContact CG1-O 3.39Å; V217-I232 HydrophobicContact CG1-CG1 4.17Å; V217-A235 HydrophobicContact CG1-CB 4.02Å; V217-Y339 VanDerWaalsContact CA-OH 3.25Å; V217-Y339 WeakPolarHBondContact CA-OH 3.46Å; V217-Y339 HydrophobicContact CG2-CE1 3.82Å; V217-Y339 HydrophobicContact CG2-CE2 4.43Å; V217-Y339 WeakPolarHBondContact CG2-OH 3.31Å; V217-Y339 PolarHBondContact N-OH 3.08Å; V217-F341 HydrophobicContact CG1-CE2 4.03Å; V217-F341 HydrophobicContact CG1-CZ 4.01Å
218	A	97.8	Very high	96.4	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-66.3	-39.8	-178.5	0	0	0	0	0	113	G214 G222 F227 S228 I232	G214-A218 VanDerWaalsContact O-CB 3.25Å; G214-A218 WeakPolarHBondContact O-CB 2.93Å; G214-A218 PolarHBondContact O-N 2.8Å; G214-A218 VanDerWaalsContact O-N 3.09Å; A218-G222 PolarHBondContact O-N 2.94Å; A218-G222 VanDerWaalsContact O-N 3.11Å; A218-F227 HydrophobicContact CB-CD1 3.71Å; A218-F227 HydrophobicContact CB-CD2 3.55Å; A218-F227 HydrophobicContact CB-CE1 3.64Å; A218-F227 HydrophobicContact CB-CE2 3.54Å; A218-F227 HydrophobicContact CB-CG 3.69Å; A218-F227 HydrophobicContact CB-CZ 3.57Å; A218-S228 WeakPolarHBondContact CA-O 3.46Å; A218-S228 WeakPolarHBondContact CB-O 3.46Å; A218-S228 PolarHBondContact O-N 3.41Å; A218-I232 HydrophobicContact CB-CD1 4.01Å; A218-I232 HydrophobicContact CB-CG1 3.97Å
219	M	96.9	Very high	96.5	Very high	53 Å²	53	33.7 Å²	33.7	26%	0.261	18%	0.175	S	C	.	.	H	α-helix	trans	-69.8	-35.4	175.4	-64.8	-56.9	-50.4	0	0	111.7	S215 V217 K224 F227	S215-M219 WeakPolarHBondContact O-CB 3.37Å; S215-M219 VanDerWaalsContact O-CG 3.26Å; S215-M219 WeakPolarHBondContact O-CG 3.45Å; S215-M219 PolarHBondContact O-N 3.22Å; V217-M219 PolarHBondContact O-N 3.4Å; M219-K224 WeakPolarHBondContact CE-O 3.25Å; M219-K224 VanDerWaalsContact O-CA 3.31Å; M219-K224 WeakPolarHBondContact O-CA 3.47Å; M219-K224 PolarHBondContact O-N 2.98Å; M219-F227 HydrophobicContact CG-CD2 4.2Å; M219-F227 HydrophobicContact SD-CB 3.84Å; M219-F227 HydrophobicContact SD-CD2 3.87Å; M219-F227 HydrophobicContact SD-CG 4.35Å
220	S	97.1	Very high	96.5	Very high	37 Å²	37	37.2 Å²	37.2	26%	0.259	19%	0.187	S	C	.	.	H	α-helix	trans	-69.9	-30.2	176.6	-173.3	0	0	0	0	113.1	N216 V217	N216-S220 WeakPolarHBondContact O-CB 3.3Å; N216-S220 PolarHBondContact O-N 3.43Å; V217-S220 PolarHBondContact O-N 2.86Å
221	H	97.6	Very high	96.5	Very high	37 Å²	37	37.2 Å²	37.2	17%	0.171	19%	0.187	C	C	.	.	H	α-helix	trans	-74.7	-46	174.6	-172.8	-106.9	0	0	0	111.4	V217 N223 S228 F341	V217-H221 PolarHBondContact O-N 2.69Å; H221-N223 PolarHBondContact O-N 2.98Å; H221-S228 WeakPolarHBondContact ND1-CB 3.25Å; H221-S228 PolarHBondContact ND1-OG 3.43Å; H221-F341 HydrophobicContact CB-CD2 4.16Å; H221-F341 HydrophobicContact CB-CE2 4.09Å; H221-F341 HydrophobicContact CB-CG 4.44Å; H221-F341 HydrophobicContact CB-CZ 4.3Å; H221-F341 AromaticContact CD2-CD1 3.58Å; H221-F341 AromaticContact CD2-CE1 3.74Å; H221-F341 AromaticContact CD2-CG 3.98Å
222	G	94.1	Very high	96.4	Very high	14 Å²	14	37.1 Å²	37.1	14%	0.144	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.1	35.8	176.4	0	0	0	0	0	114.8	A218 K224 E225 V226	A218-G222 PolarHBondContact O-N 2.94Å; A218-G222 VanDerWaalsContact O-N 3.11Å; G222-K224 PolarHBondContact O-N 3.01Å; G222-E225 PolarHBondContact O-N 2.98Å; G222-V226 WeakPolarHBondContact CA-O 3.2Å; G222-V226 PolarHBondContact O-N 2.83Å
223	N	91.4	Very high	96.4	Very high	121 Å²	121	38.7 Å²	38.7	65%	0.647	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	48.7	31	175.3	-164.4	41.2	0	0	0	115.8	H221 E225	H221-N223 PolarHBondContact O-N 2.98Å; N223-E225 PolarHBondContact O-N 3.29Å; N223-E225 VanDerWaalsContact O-N 3.14Å
224	K	91	Very high	96.4	Very high	175 Å²	175	39.8 Å²	39.8	76%	0.761	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	65.6	-3.1	-174.1	-51.7	175.3	-176.7	174.5	0	116	M219 G222	M219-K224 WeakPolarHBondContact CE-O 3.25Å; M219-K224 VanDerWaalsContact O-CA 3.31Å; M219-K224 WeakPolarHBondContact O-CA 3.47Å; M219-K224 PolarHBondContact O-N 2.98Å; G222-K224 PolarHBondContact O-N 3.01Å
225	E	91.3	Very high	96.4	Very high	152 Å²	152	39.8 Å²	39.8	71%	0.71	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.9	-34	178.8	-64.7	174.9	149.4	0	0	112	G222 N223	G222-E225 PolarHBondContact O-N 2.98Å; N223-E225 PolarHBondContact O-N 3.29Å; N223-E225 VanDerWaalsContact O-N 3.14Å
226	V	94.3	Very high	96.5	Very high	35 Å²	35	38.9 Å²	38.9	21%	0.212	19%	0.193	C	C	.	.	S	Bend	trans	-127.2	143	-173.9	-178.6	0	0	0	0	110.3	G222 S228 L264 T266	G222-V226 WeakPolarHBondContact CA-O 3.2Å; G222-V226 PolarHBondContact O-N 2.83Å; V226-S228 PolarHBondContact O-N 2.87Å; V226-L264 HydrophobicContact CG1-CB 4.23Å; V226-L264 HydrophobicContact CG2-CB 4.17Å; V226-L264 HydrophobicContact CG2-CD1 4.27Å; V226-T266 HydrophobicContact CG1-CG2 3.9Å
227	F	96.9	Very high	96.5	Very high	1 Å²	1	40 Å²	40	0%	0.004	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	97.4	168.6	-172	-85.4	0	0	0	109.5	A218 M219 C229 I232 V251 R255 L264 I265 T266 L271	A218-F227 HydrophobicContact CB-CD1 3.71Å; A218-F227 HydrophobicContact CB-CD2 3.55Å; A218-F227 HydrophobicContact CB-CE1 3.64Å; A218-F227 HydrophobicContact CB-CE2 3.54Å; A218-F227 HydrophobicContact CB-CG 3.69Å; A218-F227 HydrophobicContact CB-CZ 3.57Å; M219-F227 HydrophobicContact CG-CD2 4.2Å; M219-F227 HydrophobicContact SD-CB 3.84Å; M219-F227 HydrophobicContact SD-CD2 3.87Å; M219-F227 HydrophobicContact SD-CG 4.35Å; F227-C229 VanDerWaalsContact CE1-SG 3.6Å; F227-I232 HydrophobicContact CE1-CD1 4.3Å; F227-I232 HydrophobicContact CZ-CD1 4.16Å; F227-V251 HydrophobicContact CZ-CG1 3.9Å; F227-V251 HydrophobicContact CZ-CG2 4.45Å; F227-R255 VanDerWaalsContact CB-NH1 3.31Å; F227-R255 VanDerWaalsContact CD2-NH2 3.25Å; F227-R255 HydrophobicContact CE2-CG 4.3Å; F227-R255 HydrophobicContact CZ-CG 4.12Å; F227-L264 PolarHBondContact N-O 2.98Å; F227-I265 HydrophobicContact CB-CB 4.3Å; F227-I265 HydrophobicContact CB-CG1 4.46Å; F227-I265 HydrophobicContact CD1-CD1 3.58Å; F227-I265 HydrophobicContact CD1-CG1 3.85Å; F227-I265 HydrophobicContact CE1-CD1 4.01Å; F227-I265 HydrophobicContact CG-CD1 4.44Å; F227-I265 VanDerWaalsContact O-CA 3.3Å; F227-I265 WeakPolarHBondContact O-CA 3.37Å; F227-T266 PolarHBondContact O-N 2.77Å; F227-T266 VanDerWaalsContact O-N 3.07Å; F227-L271 HydrophobicContact CE1-CD1 4.2Å; F227-L271 HydrophobicContact CE1-CD2 4.29Å
228	S	97.2	Very high	96.5	Very high	10 Å²	10	42.2 Å²	42.2	7%	0.07	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	104.7	-178.1	-176.7	0	0	0	0	111.2	A218 H221 V226 R230 G231 T266	A218-S228 WeakPolarHBondContact CA-O 3.46Å; A218-S228 WeakPolarHBondContact CB-O 3.46Å; A218-S228 PolarHBondContact O-N 3.41Å; H221-S228 WeakPolarHBondContact ND1-CB 3.25Å; H221-S228 PolarHBondContact ND1-OG 3.43Å; V226-S228 PolarHBondContact O-N 2.87Å; S228-R230 PolarHBondContact O-N 3Å; S228-G231 PolarHBondContact O-N 3.26Å; S228-G231 VanDerWaalsContact O-N 3.09Å; S228-T266 WeakPolarHBondContact CA-OG1 3.33Å; S228-T266 PolarHBondContact OG-OG1 3.16Å
229	C	97.6	Very high	96.5	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-65.5	-24	-179.1	-55	0	0	0	0	112.1	F227 G231 I232 Q233 T266 D267 I270 L271	F227-C229 VanDerWaalsContact CE1-SG 3.6Å; C229-G231 PolarHBondContact O-N 2.94Å; C229-I232 WeakPolarHBondContact O-CB 3.24Å; C229-I232 PolarHBondContact O-N 3.46Å; C229-Q233 PolarHBondContact O-N 3.43Å; C229-T266 WeakPolarHBondContact CB-O 3.35Å; C229-T266 PolarHBondContact N-O 3.3Å; C229-T266 PolarHBondContact SG-O 3.48Å; C229-D267 HydrophobicContact CB-CB 4.17Å; C229-D267 VanDerWaalsContact CB-O 3.26Å; C229-D267 WeakPolarHBondContact CB-O 3.36Å; C229-I270 HydrophobicContact CB-CB 4.03Å; C229-I270 HydrophobicContact CB-CG2 4.43Å; C229-L271 HydrophobicContact CB-CD2 3.96Å; C229-L271 HydrophobicContact CB-CG 4.22Å; C229-L271 VanDerWaalsContact SG-CG 3.58Å
230	R	97.8	Very high	96.5	Very high	85 Å²	85	44.4 Å²	44.4	32%	0.321	21%	0.211	S	C	.	.	H	α-helix	trans	-52	-40.4	169.6	178.1	58	174.7	-179.5	-1.5	112.9	S228 I232 Q233 L234 D267 I270 D344	S228-R230 PolarHBondContact O-N 3Å; R230-I232 VanDerWaalsContact C-N 3.29Å; R230-I232 PolarHBondContact O-N 3Å; R230-Q233 WeakPolarHBondContact O-CB 3.38Å; R230-Q233 PolarHBondContact O-N 3.5Å; R230-Q233 VanDerWaalsContact O-N 3.14Å; R230-L234 HydrophobicContact CG-CD1 3.86Å; R230-L234 HydrophobicContact CG-CG 4.47Å; R230-L234 WeakPolarHBondContact O-CD1 3.3Å; R230-L234 VanDerWaalsContact O-CG 3.31Å; R230-L234 WeakPolarHBondContact O-CG 3.34Å; R230-L234 PolarHBondContact O-N 3.39Å; R230-D267 WeakPolarHBondContact CB-OD2 3.38Å; R230-D267 PolarHBondContact N-OD2 3.19Å; R230-I270 HydrophobicContact CB-CD1 4.43Å; R230-D344 IonicContact CZ-OD2 3.59Å; R230-D344 IonicContact NE-OD2 3.54Å; R230-D344 PolarHBondContact NE-OD2 3Å; R230-D344 IonicContact NH2-OD2 2.68Å; R230-D344 PolarHBondContact NH2-OD2 3.18Å
231	G	98	Very high	96.4	Very high	0 Å²	0	50 Å²	50	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-59.3	-37.9	176.1	0	0	0	0	0	113.3	V217 S228 C229 L234 A235	V217-G231 VanDerWaalsContact CG1-C 3.49Å; V217-G231 WeakPolarHBondContact CG1-O 3.39Å; S228-G231 PolarHBondContact O-N 3.26Å; S228-G231 VanDerWaalsContact O-N 3.09Å; C229-G231 PolarHBondContact O-N 2.94Å; G231-L234 PolarHBondContact O-N 3.32Å; G231-A235 PolarHBondContact O-N 3.49Å; G231-A235 VanDerWaalsContact O-N 3.08Å
232	I	98.4	Very high	96.2	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-66	-44.6	175.8	-56.4	177.6	0	0	0	110.3	G214 V217 A218 F227 C229 R230 L234 A235 V236 V249 V251 L271 L274	G214-I232 WeakPolarHBondContact O-CD1 3.48Å; V217-I232 HydrophobicContact CG1-CG1 4.17Å; A218-I232 HydrophobicContact CB-CD1 4.01Å; A218-I232 HydrophobicContact CB-CG1 3.97Å; F227-I232 HydrophobicContact CE1-CD1 4.3Å; F227-I232 HydrophobicContact CZ-CD1 4.16Å; C229-I232 WeakPolarHBondContact O-CB 3.24Å; C229-I232 PolarHBondContact O-N 3.46Å; R230-I232 VanDerWaalsContact C-N 3.29Å; R230-I232 PolarHBondContact O-N 3Å; I232-L234 VanDerWaalsContact C-N 3.33Å; I232-L234 PolarHBondContact O-N 3.35Å; I232-A235 PolarHBondContact O-N 2.93Å; I232-V236 HydrophobicContact CG2-CG2 4.43Å; I232-V236 WeakPolarHBondContact O-CG2 3.39Å; I232-V236 PolarHBondContact O-N 2.74Å; I232-V249 HydrophobicContact CG2-CB 4.44Å; I232-V249 HydrophobicContact CG2-CG1 3.72Å; I232-V249 HydrophobicContact CG2-CG2 4.03Å; I232-V251 HydrophobicContact CD1-CG2 3.87Å; I232-L271 HydrophobicContact CD1-CD2 3.75Å; I232-L274 HydrophobicContact CG2-CD1 3.69Å
233	Q	98.2	Very high	96.2	Very high	33 Å²	33	54.3 Å²	54.3	15%	0.154	25%	0.252	C	S	.	.	H	α-helix	trans	-56.8	-49.7	176.2	-173.9	-169.4	-8.5	0	0	110.5	C229 R230 A235 V236 E237 I270	C229-Q233 PolarHBondContact O-N 3.43Å; R230-Q233 WeakPolarHBondContact O-CB 3.38Å; R230-Q233 PolarHBondContact O-N 3.5Å; R230-Q233 VanDerWaalsContact O-N 3.14Å; Q233-A235 PolarHBondContact O-N 3.07Å; Q233-V236 PolarHBondContact O-N 3.24Å; Q233-E237 PolarHBondContact NE2-OE2 3.42Å; Q233-E237 WeakPolarHBondContact O-CB 3.37Å; Q233-E237 PolarHBondContact O-N 2.75Å; Q233-I270 HydrophobicContact CB-CD1 4.31Å; Q233-I270 HydrophobicContact CB-CG2 4.03Å
234	L	98.3	Very high	96.5	Very high	27 Å²	27	49 Å²	49	14%	0.141	22%	0.223	C	C	.	.	H	α-helix	trans	-61.7	-40.4	-176.9	-67.7	160.4	0	0	0	112.7	R230 G231 I232 E237 W238 F341 D344	R230-L234 HydrophobicContact CG-CD1 3.86Å; R230-L234 HydrophobicContact CG-CG 4.47Å; R230-L234 WeakPolarHBondContact O-CD1 3.3Å; R230-L234 VanDerWaalsContact O-CG 3.31Å; R230-L234 WeakPolarHBondContact O-CG 3.34Å; R230-L234 PolarHBondContact O-N 3.39Å; G231-L234 PolarHBondContact O-N 3.32Å; I232-L234 VanDerWaalsContact C-N 3.33Å; I232-L234 PolarHBondContact O-N 3.35Å; L234-E237 PolarHBondContact O-N 2.59Å; L234-W238 PolarHBondContact O-N 3.11Å; L234-W238 VanDerWaalsContact O-N 3.08Å; L234-F341 HydrophobicContact CB-CE1 4.35Å; L234-D344 HydrophobicContact CD1-CB 3.81Å; L234-D344 WeakPolarHBondContact CD1-O 3.3Å; L234-D344 HydrophobicContact CD2-CB 4.24Å; L234-D344 WeakPolarHBondContact CD2-O 3.31Å
235	A	98.4	Very high	96.6	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-64.6	-46.2	174.2	0	0	0	0	0	111.7	V217 G231 I232 Q233 E237 W238 F239 F346	V217-A235 HydrophobicContact CG1-CB 4.02Å; G231-A235 PolarHBondContact O-N 3.49Å; G231-A235 VanDerWaalsContact O-N 3.08Å; I232-A235 PolarHBondContact O-N 2.93Å; Q233-A235 PolarHBondContact O-N 3.07Å; A235-E237 PolarHBondContact O-N 3.19Å; A235-W238 PolarHBondContact O-N 3.31Å; A235-F239 WeakPolarHBondContact O-CD2 3.26Å; A235-F239 PolarHBondContact O-N 3.41Å; A235-F346 HydrophobicContact CB-CD2 4.02Å; A235-F346 HydrophobicContact CB-CE1 4.48Å; A235-F346 HydrophobicContact CB-CE2 3.91Å; A235-F346 HydrophobicContact CB-CG 4.35Å; A235-F346 HydrophobicContact CB-CZ 4.16Å
236	V	98.2	Very high	96.9	Very high	1 Å²	1	45 Å²	45	1%	0.006	21%	0.207	C	C	.	.	H	α-helix	trans	-61	-43.3	175.9	168.5	0	0	0	0	111.6	I212 I232 Q233 W238 F239 R240 I247 V249 L274 I279	I212-V236 HydrophobicContact CD1-CG2 4.05Å; I232-V236 HydrophobicContact CG2-CG2 4.43Å; I232-V236 WeakPolarHBondContact O-CG2 3.39Å; I232-V236 PolarHBondContact O-N 2.74Å; Q233-V236 PolarHBondContact O-N 3.24Å; V236-W238 VanDerWaalsContact C-N 3.35Å; V236-W238 PolarHBondContact O-N 2.99Å; V236-F239 PolarHBondContact O-N 2.7Å; V236-R240 WeakPolarHBondContact O-CB 3.48Å; V236-R240 PolarHBondContact O-N 3.06Å; V236-I247 HydrophobicContact CG2-CG2 4.3Å; V236-V249 HydrophobicContact CG2-CG2 3.58Å; V236-L274 HydrophobicContact CG1-CD2 4.33Å; V236-I279 HydrophobicContact CG1-CD1 4.01Å; V236-I279 HydrophobicContact CG1-CG2 3.94Å; V236-I279 HydrophobicContact CG2-CG2 3.91Å
237	E	97.8	Very high	97	Very high	58 Å²	58	44 Å²	44	27%	0.271	20%	0.2	S	C	.	.	H	α-helix	trans	-57.5	-47.6	177.8	-149.7	95.4	-97.8	0	0	110.2	Q233 L234 A235 F239 R240 E241	Q233-E237 PolarHBondContact NE2-OE2 3.42Å; Q233-E237 WeakPolarHBondContact O-CB 3.37Å; Q233-E237 PolarHBondContact O-N 2.75Å; L234-E237 PolarHBondContact O-N 2.59Å; A235-E237 PolarHBondContact O-N 3.19Å; E237-F239 PolarHBondContact O-N 3.47Å; E237-R240 CarbonylContact O-C 3.5Å; E237-R240 WeakPolarHBondContact O-CB 3.37Å; E237-R240 PolarHBondContact O-N 3.01Å; E237-R240 VanDerWaalsContact O-N 3.11Å; E237-R240 IonicContact OE1-CZ 3.7Å; E237-R240 IonicContact OE1-NE 3.77Å; E237-R240 IonicContact OE1-NH2 3.84Å; E237-R240 PolarHBondContact OE1-NH2 2.9Å; E237-E241 WeakPolarHBondContact O-CG 3.23Å; E237-E241 PolarHBondContact O-N 2.91Å
238	W	98.1	Very high	97.1	Very high	47 Å²	47	45 Å²	45	18%	0.178	21%	0.207	C	C	.	.	H	α-helix	trans	-58	-45.2	178.7	-170.9	100.7	0	0	0	112.8	L234 A235 V236 K242 F346 P348 L360 L364	L234-W238 PolarHBondContact O-N 3.11Å; L234-W238 VanDerWaalsContact O-N 3.08Å; A235-W238 PolarHBondContact O-N 3.31Å; V236-W238 VanDerWaalsContact C-N 3.35Å; V236-W238 PolarHBondContact O-N 2.99Å; W238-K242 HydrophobicContact CD2-CG 4.42Å; W238-K242 HydrophobicContact CE3-CG 4.05Å; W238-K242 HydrophobicContact CH2-CD 4.48Å; W238-K242 HydrophobicContact CH2-CG 4Å; W238-K242 HydrophobicContact CZ2-CG 4.4Å; W238-K242 HydrophobicContact CZ3-CG 3.82Å; W238-K242 WeakPolarHBondContact O-CG 3.36Å; W238-K242 PolarHBondContact O-N 3.26Å; W238-F346 HydrophobicContact CB-CD1 3.83Å; W238-F346 HydrophobicContact CB-CE1 4.48Å; W238-F346 AromaticContact CD1-CD1 4Å; W238-F346 HydrophobicContact CD2-CD1 4.07Å; W238-F346 HydrophobicContact CD2-CE1 4.27Å; W238-F346 HydrophobicContact CE3-CE1 4.38Å; W238-F346 AromaticContact CG-CD1 3.69Å; W238-F346 HydrophobicContact CG-CD1 3.69Å; W238-F346 HydrophobicContact CG-CE1 4.31Å; W238-P348 HydrophobicContact CD2-CG 4.4Å; W238-P348 HydrophobicContact CH2-CG 3.76Å; W238-P348 HydrophobicContact CZ2-CG 3.48Å; W238-P348 VanDerWaalsContact CZ2-CG 3.48Å; W238-P348 HydrophobicContact CZ3-CG 4.29Å; W238-L360 HydrophobicContact CH2-CD2 3.85Å; W238-L360 HydrophobicContact CH2-CG 4.45Å; W238-L360 HydrophobicContact CZ2-CD2 4.13Å; W238-L364 HydrophobicContact CH2-CD1 4.16Å; W238-L364 HydrophobicContact CZ3-CD1 4.09Å
239	F	97.9	Very high	97.2	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-69.8	-34	176.7	-70.2	-71	0	0	0	112.2	I210 I212 A235 V236 E237 K242 G243 H244 I247 V313 L337 F346 L364	I210-F239 HydrophobicContact CD1-CD1 4.2Å; I210-F239 HydrophobicContact CD1-CE1 4.21Å; I210-F239 HydrophobicContact CG1-CD1 3.97Å; I210-F239 HydrophobicContact CG1-CE1 4.39Å; I210-F239 HydrophobicContact CG1-CG 4.34Å; I210-F239 HydrophobicContact CG2-CD1 4.2Å; I210-F239 HydrophobicContact CG2-CD2 4Å; I210-F239 HydrophobicContact CG2-CE1 4.19Å; I210-F239 HydrophobicContact CG2-CE2 4.03Å; I210-F239 HydrophobicContact CG2-CG 4.13Å; I210-F239 HydrophobicContact CG2-CZ 4.13Å; I212-F239 HydrophobicContact CD1-CD2 3.94Å; I212-F239 HydrophobicContact CD1-CE2 4.12Å; A235-F239 WeakPolarHBondContact O-CD2 3.26Å; A235-F239 PolarHBondContact O-N 3.41Å; V236-F239 PolarHBondContact O-N 2.7Å; E237-F239 PolarHBondContact O-N 3.47Å; F239-K242 CarbonylContact O-C 3.49Å; F239-K242 PolarHBondContact O-N 2.87Å; F239-G243 PolarHBondContact O-N 3.36Å; F239-H244 HydrophobicContact CB-CB 4.17Å; F239-H244 WeakPolarHBondContact O-CB 3.29Å; F239-H244 PolarHBondContact O-CD2 3.29Å; F239-H244 PolarHBondContact O-N 3.07Å; F239-I247 HydrophobicContact CB-CD1 3.67Å; F239-I247 HydrophobicContact CB-CG1 4.26Å; F239-V313 HydrophobicContact CE2-CG1 4.23Å; F239-V313 HydrophobicContact CE2-CG2 3.83Å; F239-V313 HydrophobicContact CZ-CG1 4.34Å; F239-V313 HydrophobicContact CZ-CG2 3.59Å; F239-L337 HydrophobicContact CE1-CD2 4.14Å; F239-L337 HydrophobicContact CZ-CD2 3.94Å; F239-F346 AromaticContact CE2-CE1 3.94Å; F239-F346 HydrophobicContact CE2-CE1 3.94Å; F239-F346 HydrophobicContact CE2-CZ 4.16Å; F239-F346 HydrophobicContact CZ-CE1 4.16Å; F239-F346 HydrophobicContact CZ-CZ 4.45Å; F239-L364 HydrophobicContact CD1-CD2 4.49Å; F239-L364 HydrophobicContact CE1-CD2 3.89Å
240	R	96.1	Very high	97.2	Very high	99 Å²	99	45.3 Å²	45.3	37%	0.374	21%	0.207	S	C	.	.	H	α-helix	trans	-68	-39.6	176.5	-175.2	159.3	64.6	-168.7	2	112	V236 E237 K242 G243 I247 E277	V236-R240 WeakPolarHBondContact O-CB 3.48Å; V236-R240 PolarHBondContact O-N 3.06Å; E237-R240 CarbonylContact O-C 3.5Å; E237-R240 WeakPolarHBondContact O-CB 3.37Å; E237-R240 PolarHBondContact O-N 3.01Å; E237-R240 VanDerWaalsContact O-N 3.11Å; E237-R240 IonicContact OE1-CZ 3.7Å; E237-R240 IonicContact OE1-NE 3.77Å; E237-R240 IonicContact OE1-NH2 3.84Å; E237-R240 PolarHBondContact OE1-NH2 2.9Å; R240-K242 VanDerWaalsContact C-N 3.28Å; R240-K242 PolarHBondContact O-N 3.12Å; R240-G243 WeakPolarHBondContact O-CA 3.21Å; R240-G243 PolarHBondContact O-N 3.37Å; R240-I247 HydrophobicContact CB-CD1 4.43Å; R240-E277 IonicContact NH1-OE2 2.74Å; R240-E277 PolarHBondContact NH1-OE2 3.21Å
241	E	96.3	Very high	97.2	Very high	154 Å²	154	41.2 Å²	41.2	72%	0.72	19%	0.192	S	C	*	.	H	α-helix	trans	-61.8	-33.4	170.1	-73.5	177.8	177	0	0	112.5	E237 G243	E237-E241 WeakPolarHBondContact O-CG 3.23Å; E237-E241 PolarHBondContact O-N 2.91Å; E241-G243 PolarHBondContact O-N 2.66Å
242	K	93.8	Very high	97.1	Very high	127 Å²	127	41.4 Å²	41.4	55%	0.552	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.6	1.9	171.5	-64	-65.3	-178.8	-177.9	0	113.9	W238 F239 R240	W238-K242 HydrophobicContact CD2-CG 4.42Å; W238-K242 HydrophobicContact CE3-CG 4.05Å; W238-K242 HydrophobicContact CH2-CD 4.48Å; W238-K242 HydrophobicContact CH2-CG 4Å; W238-K242 HydrophobicContact CZ2-CG 4.4Å; W238-K242 HydrophobicContact CZ3-CG 3.82Å; W238-K242 WeakPolarHBondContact O-CG 3.36Å; W238-K242 PolarHBondContact O-N 3.26Å; F239-K242 CarbonylContact O-C 3.49Å; F239-K242 PolarHBondContact O-N 2.87Å; R240-K242 VanDerWaalsContact C-N 3.28Å; R240-K242 PolarHBondContact O-N 3.12Å
243	G	94.1	Very high	96.9	Very high	16 Å²	16	42.7 Å²	42.7	17%	0.165	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	85	7.1	176.7	0	0	0	0	0	115.5	Y204 L207 F239 R240 E241 K245	Y204-G243 WeakPolarHBondContact CD1-O 3.42Å; L207-G243 WeakPolarHBondContact CD1-O 3.48Å; F239-G243 PolarHBondContact O-N 3.36Å; R240-G243 WeakPolarHBondContact O-CA 3.21Å; R240-G243 PolarHBondContact O-N 3.37Å; E241-G243 PolarHBondContact O-N 2.66Å; G243-K245 PolarHBondContact O-N 2.88Å
244	H	96.1	Very high	96.5	Very high	8 Å²	8	43.3 Å²	43.3	4%	0.037	20%	0.204	C	C	.	.			trans	-67.6	121.9	175.2	-69.6	-101.6	0	0	0	110.2	R208 I210 F239 I247	R208-H244 PolarHBondContact O-ND1 3.39Å; R208-H244 VanDerWaalsContact O-ND1 3.13Å; I210-H244 HydrophobicContact CG1-CB 4.32Å; I210-H244 VanDerWaalsContact CG1-ND1 3.34Å; I210-H244 WeakPolarHBondContact CG1-ND1 3.32Å; F239-H244 HydrophobicContact CB-CB 4.17Å; F239-H244 WeakPolarHBondContact O-CB 3.29Å; F239-H244 PolarHBondContact O-CD2 3.29Å; F239-H244 PolarHBondContact O-N 3.07Å; H244-I247 HydrophobicContact CB-CD1 4.09Å; H244-I247 HydrophobicContact CB-CG1 3.94Å; H244-I247 WeakPolarHBondContact O-CD1 3.4Å
245	K	94.1	Very high	96.3	Very high	160 Å²	160	43.4 Å²	43.4	70%	0.696	20%	0.203	S	C	*	.			trans	-94.3	-29.5	175.5	-59.4	173.4	-172.3	169.1	0	112.1	G243	G243-K245 PolarHBondContact O-N 2.88Å
246	D	96.4	Very high	95.9	Very high	85 Å²	85	47.5 Å²	47.5	46%	0.455	22%	0.221	S	C	.	.			trans	-98.4	94.1	179.1	-171	-3.7	0	0	0	109.8	P209 I210	P209-D246 HydrophobicContact CB-CB 4.48Å; P209-D246 WeakPolarHBondContact CB-OD2 3.38Å; P209-D246 WeakPolarHBondContact CG-OD2 3.5Å; I210-D246 PolarHBondContact N-O 2.85Å
247	I	98.2	Very high	95.4	Very high	12 Å²	12	49.9 Å²	49.9	6%	0.062	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	118.9	179.3	-53.9	168.4	0	0	0	107.5	I210 I212 V236 F239 R240 H244 I279	I210-I247 HydrophobicContact CB-CG1 4.4Å; I210-I247 HydrophobicContact CB-CG2 4.49Å; I210-I247 CarbonylContact O-C 3.59Å; I210-I247 WeakPolarHBondContact O-CA 3.2Å; I212-I247 HydrophobicContact CD1-CG2 3.79Å; I212-I247 HydrophobicContact CG1-CG2 4.29Å; V236-I247 HydrophobicContact CG2-CG2 4.3Å; F239-I247 HydrophobicContact CB-CD1 3.67Å; F239-I247 HydrophobicContact CB-CG1 4.26Å; R240-I247 HydrophobicContact CB-CD1 4.43Å; H244-I247 HydrophobicContact CB-CD1 4.09Å; H244-I247 HydrophobicContact CB-CG1 3.94Å; H244-I247 WeakPolarHBondContact O-CD1 3.4Å; I247-I279 HydrophobicContact CB-CG2 4.46Å; I247-I279 HydrophobicContact CG2-CG2 4.18Å
248	T	98.4	Very high	94.6	Very high	24 Å²	24	54.6 Å²	54.6	15%	0.147	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	121.4	173.7	-60.8	0	0	0	0	110.4	I210 V211 I212 F250 I279 V281 L304	I210-T248 PolarHBondContact O-N 2.84Å; V211-T248 CarbonylContact C-O 3.56Å; V211-T248 VanDerWaalsContact CA-O 3.3Å; V211-T248 WeakPolarHBondContact CA-O 3.47Å; I212-T248 PolarHBondContact N-O 3.06Å; T248-F250 HydrophobicContact CG2-CD2 4.5Å; T248-F250 HydrophobicContact CG2-CE2 4.16Å; T248-F250 HydrophobicContact CG2-CZ 4.23Å; T248-I279 CarbonylContact C-O 3.52Å; T248-I279 WeakPolarHBondContact CA-O 3.26Å; T248-V281 HydrophobicContact CG2-CB 4.42Å; T248-V281 HydrophobicContact CG2-CG2 3.95Å; T248-L304 HydrophobicContact CG2-CD2 3.54Å
249	V	98.6	Very high	93.7	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	130.6	171.9	-172.6	0	0	0	0	109.2	I212 I232 V236 V251 I279 L280 V281	I212-V249 HydrophobicContact CB-CB 4.42Å; I212-V249 HydrophobicContact CB-CG1 4.34Å; I212-V249 HydrophobicContact CB-CG2 4.08Å; I212-V249 HydrophobicContact CD1-CG2 4.25Å; I212-V249 HydrophobicContact CG1-CG2 4.48Å; I212-V249 HydrophobicContact CG2-CG1 4.47Å; I212-V249 WeakPolarHBondContact O-CA 3.43Å; I232-V249 HydrophobicContact CG2-CB 4.44Å; I232-V249 HydrophobicContact CG2-CG1 3.72Å; I232-V249 HydrophobicContact CG2-CG2 4.03Å; V236-V249 HydrophobicContact CG2-CG2 3.58Å; V249-V251 HydrophobicContact CG1-CG2 4.14Å; V249-I279 HydrophobicContact CG2-CG2 3.96Å; V249-I279 PolarHBondContact N-O 2.9Å; V249-L280 HydrophobicContact CB-CB 4.22Å; V249-L280 HydrophobicContact CB-CD1 4.44Å; V249-L280 HydrophobicContact CB-CG 4.23Å; V249-L280 HydrophobicContact CG1-CD1 4.26Å; V249-L280 HydrophobicContact CG1-CG 4.45Å; V249-L280 WeakPolarHBondContact O-CA 3.41Å; V249-V281 PolarHBondContact O-N 3.14Å
250	F	98.5	Very high	92.9	Very high	15 Å²	15	60.4 Å²	60.4	7%	0.066	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	135	167.7	-75.5	-68	0	0	0	112	V211 I212 G214 T248 V281 T283 F300 I301 L304	V211-F250 HydrophobicContact CG1-CD2 3.83Å; V211-F250 HydrophobicContact CG1-CE2 3.89Å; I212-F250 PolarHBondContact O-N 2.99Å; G214-F250 WeakPolarHBondContact CA-O 3.49Å; G214-F250 PolarHBondContact N-O 3.09Å; T248-F250 HydrophobicContact CG2-CD2 4.5Å; T248-F250 HydrophobicContact CG2-CE2 4.16Å; T248-F250 HydrophobicContact CG2-CZ 4.23Å; F250-V281 WeakPolarHBondContact CA-O 3.32Å; F250-V281 HydrophobicContact CD1-CB 4.01Å; F250-V281 HydrophobicContact CD1-CG1 4.16Å; F250-V281 HydrophobicContact CE1-CB 3.85Å; F250-V281 HydrophobicContact CE1-CG1 3.72Å; F250-T283 HydrophobicContact CB-CG2 3.95Å; F250-T283 HydrophobicContact CD1-CG2 3.47Å; F250-T283 VanDerWaalsContact CD1-CG2 3.47Å; F250-T283 HydrophobicContact CE1-CG2 4.27Å; F250-T283 HydrophobicContact CG-CG2 4Å; F250-F300 HydrophobicContact CD1-CB 4.13Å; F250-F300 HydrophobicContact CD2-CB 4.32Å; F250-F300 HydrophobicContact CE1-CB 3.91Å; F250-F300 HydrophobicContact CE2-CB 4.1Å; F250-F300 WeakPolarHBondContact CE2-O 3.48Å; F250-F300 HydrophobicContact CG-CB 4.33Å; F250-F300 HydrophobicContact CZ-CB 3.88Å; F250-I301 HydrophobicContact CB-CD1 4.29Å; F250-I301 HydrophobicContact CB-CG1 3.73Å; F250-I301 HydrophobicContact CD2-CB 4.29Å; F250-I301 HydrophobicContact CD2-CG1 3.64Å; F250-I301 HydrophobicContact CG-CG1 4.06Å; F250-L304 HydrophobicContact CE2-CB 3.88Å; F250-L304 HydrophobicContact CE2-CD2 3.58Å; F250-L304 HydrophobicContact CE2-CG 4.38Å; F250-L304 HydrophobicContact CZ-CB 4.24Å; F250-L304 HydrophobicContact CZ-CD2 3.78Å
251	V	97.4	Very high	91.9	Very high	0 Å²	0	61.5 Å²	61.5	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	138.6	173.1	175.6	0	0	0	0	109.5	F227 I232 V249 A253 R255 L271 L280 V281 F282 T283	F227-V251 HydrophobicContact CZ-CG1 3.9Å; F227-V251 HydrophobicContact CZ-CG2 4.45Å; I232-V251 HydrophobicContact CD1-CG2 3.87Å; V249-V251 HydrophobicContact CG1-CG2 4.14Å; V251-A253 PolarHBondContact O-N 2.81Å; V251-R255 HydrophobicContact CG1-CB 3.7Å; V251-R255 HydrophobicContact CG1-CG 3.67Å; V251-L271 HydrophobicContact CG1-CD1 4.48Å; V251-L280 HydrophobicContact CB-CD1 4.29Å; V251-L280 HydrophobicContact CB-CD2 4.47Å; V251-L280 HydrophobicContact CG2-CD1 3.74Å; V251-L280 HydrophobicContact CG2-CG 4.32Å; V251-V281 PolarHBondContact N-O 2.98Å; V251-F282 HydrophobicContact CB-CD1 4.3Å; V251-F282 HydrophobicContact CB-CE1 4.31Å; V251-F282 HydrophobicContact CG1-CD1 4.35Å; V251-F282 HydrophobicContact CG1-CE1 4.1Å; V251-F282 CarbonylContact O-C 3.49Å; V251-F282 WeakPolarHBondContact O-CA 3.37Å; V251-F282 WeakPolarHBondContact O-CD1 3.46Å; V251-T283 PolarHBondContact O-N 3.43Å
252	P	95.4	Very high	91	Very high	3 Å²	3	59.9 Å²	59.9	2%	0.019	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.5	132.6	175.6	-29.2	37.8	0	0	0	114	S215 W254 R255 T283 V294 D297	S215-P252 VanDerWaalsContact OG-CD 3.25Å; S215-P252 WeakPolarHBondContact OG-CD 3.34Å; P252-W254 HydrophobicContact CB-CG 4.25Å; P252-W254 VanDerWaalsContact CB-NE1 3.27Å; P252-W254 PolarHBondContact O-N 3.26Å; P252-R255 WeakPolarHBondContact O-CB 3.24Å; P252-R255 PolarHBondContact O-N 3.26Å; P252-T283 WeakPolarHBondContact CA-OG1 3.34Å; P252-V294 HydrophobicContact CB-CG1 4.17Å; P252-D297 VanDerWaalsContact CD-OD2 3.25Å; P252-D297 WeakPolarHBondContact CD-OD2 3.4Å; P252-D297 HydrophobicContact CG-CB 4.38Å; P252-D297 WeakPolarHBondContact CG-OD2 3.38Å
253	A	93.6	Very high	90.3	Very high	28 Å²	28	54.9 Å²	54.9	23%	0.231	28%	0.284	C	S	.	.	G	3₁₀ helix	trans	-54.7	-28.2	-177.2	0	0	0	0	0	114.2	V251 R255 K256 F282 T283	V251-A253 PolarHBondContact O-N 2.81Å; A253-R255 PolarHBondContact O-N 2.94Å; A253-K256 WeakPolarHBondContact O-CB 3.49Å; A253-K256 PolarHBondContact O-N 2.83Å; A253-F282 HydrophobicContact CB-CB 4.05Å; A253-T283 VanDerWaalsContact CB-O 3.26Å; A253-T283 WeakPolarHBondContact CB-O 3.4Å; A253-T283 PolarHBondContact N-O 3.11Å
254	W	91.3	Very high	90.1	Very high	45 Å²	45	58.7 Å²	58.7	17%	0.17	30%	0.3	C	S	.	.	G	3₁₀ helix	trans	-64.3	-18.1	175.7	70.5	-98.6	0	0	0	114.3	P252 K256 E257 A263 S285 R292	P252-W254 HydrophobicContact CB-CG 4.25Å; P252-W254 VanDerWaalsContact CB-NE1 3.27Å; P252-W254 PolarHBondContact O-N 3.26Å; W254-K256 PolarHBondContact O-N 3.23Å; W254-E257 VanDerWaalsContact O-CB 3.28Å; W254-E257 WeakPolarHBondContact O-CB 3.42Å; W254-E257 WeakPolarHBondContact O-CG 3.13Å; W254-E257 PolarHBondContact O-N 3.47Å; W254-A263 HydrophobicContact CZ3-CB 4.29Å; W254-S285 PolarHBondContact N-OG 2.8Å; W254-R292 VanDerWaalsContact CD2-NH1 3.33Å
255	R	93.1	Very high	90	Very high	29 Å²	29	59.6 Å²	59.6	11%	0.109	31%	0.305	C	S	.	.	G	3₁₀ helix	trans	-67.2	-6.1	170.6	-64.3	-73.8	-171.3	178.1	3.4	112.9	F227 V251 P252 A253 Q268 L271	F227-R255 VanDerWaalsContact CB-NH1 3.31Å; F227-R255 VanDerWaalsContact CD2-NH2 3.25Å; F227-R255 HydrophobicContact CE2-CG 4.3Å; F227-R255 HydrophobicContact CZ-CG 4.12Å; V251-R255 HydrophobicContact CG1-CB 3.7Å; V251-R255 HydrophobicContact CG1-CG 3.67Å; P252-R255 WeakPolarHBondContact O-CB 3.24Å; P252-R255 PolarHBondContact O-N 3.26Å; A253-R255 PolarHBondContact O-N 2.94Å; R255-Q268 PolarHBondContact O-NE2 3.23Å; R255-L271 HydrophobicContact CB-CD1 4.05Å
256	K	90.1	Very high	90	Very high	86 Å²	86	54.6 Å²	54.6	37%	0.374	29%	0.288	S	S	.	.	G	3₁₀ helix	trans	-88.3	-11.2	165.6	-63.1	-161.5	-99.8	-166.3	0	114.5	A253 W254 E275 F282	A253-K256 WeakPolarHBondContact O-CB 3.49Å; A253-K256 PolarHBondContact O-N 2.83Å; W254-K256 PolarHBondContact O-N 3.23Å; K256-E275 IonicContact NZ-OE1 2.75Å; K256-E275 PolarHBondContact NZ-OE1 3.43Å; K256-E275 IonicContact NZ-OE2 3.57Å; K256-E275 PolarHBondContact NZ-OE2 3.14Å; K256-F282 HydrophobicContact CD-CD1 4.46Å; K256-F282 HydrophobicContact CD-CD2 4.02Å; K256-F282 HydrophobicContact CD-CE1 3.99Å; K256-F282 HydrophobicContact CD-CE2 3.48Å; K256-F282 VanDerWaalsContact CD-CE2 3.48Å; K256-F282 HydrophobicContact CD-CG 4.44Å; K256-F282 HydrophobicContact CD-CZ 3.43Å; K256-F282 VanDerWaalsContact CD-CZ 3.43Å; K256-F282 HydrophobicContact CG-CD1 4.16Å; K256-F282 HydrophobicContact CG-CE1 3.47Å; K256-F282 VanDerWaalsContact CG-CE1 3.47Å; K256-F282 HydrophobicContact CG-CE2 3.91Å; K256-F282 HydrophobicContact CG-CZ 3.29Å; K256-F282 VanDerWaalsContact NZ-CD2 3.3Å
257	E	88.1	Confident	89.9	Confident	51 Å²	51	53.4 Å²	53.4	24%	0.238	28%	0.281	C	S	.	.	S	Bend	trans	-67.9	156.7	172.6	-61.6	178.8	-158.2	0	0	109.8	W254 S259 Q268 R287 R292	W254-E257 VanDerWaalsContact O-CB 3.28Å; W254-E257 WeakPolarHBondContact O-CB 3.42Å; W254-E257 WeakPolarHBondContact O-CG 3.13Å; W254-E257 PolarHBondContact O-N 3.47Å; E257-S259 PolarHBondContact O-N 2.77Å; E257-Q268 PolarHBondContact O-NE2 3.07Å; E257-R287 IonicContact OE1-NE 2.68Å; E257-R287 IonicContact OE1-NH2 3.89Å; E257-R287 IonicContact OE2-CZ 3.77Å; E257-R287 IonicContact OE2-NE 3.72Å; E257-R287 IonicContact OE2-NH2 3.94Å; E257-R287 PolarHBondContact OE2-NH2 2.92Å; E257-R292 VanDerWaalsContact CD-NH2 3.32Å; E257-R292 IonicContact OE1-CZ 2.7Å; E257-R292 IonicContact OE1-NE 3.06Å; E257-R292 PolarHBondContact OE1-NE 2.75Å; E257-R292 IonicContact OE1-NH2 3.35Å; E257-R292 IonicContact OE2-CZ 3.44Å; E257-R292 IonicContact OE2-NE 3.63Å; E257-R292 IonicContact OE2-NH2 3.91Å; E257-R292 PolarHBondContact OE2-NH2 3.35Å
258	Q	80.3	Confident	89.7	Confident	158 Å²	158	54.4 Å²	54.4	74%	0.738	29%	0.286	S	S	*	.	P	Polyproline II helix	trans	-50.2	139.1	176.5	-167.7	69.5	30.6	0	0	111
259	S	80.4	Confident	89.6	Confident	61 Å²	61	58.4 Å²	58.4	43%	0.427	30%	0.303	S	S	.	.	P	Polyproline II helix	trans	-53.7	149	173.6	57.3	0	0	0	0	111.6	E257	E257-S259 PolarHBondContact O-N 2.77Å
260	R	79.6	Confident	89.5	Confident	107 Å²	107	59.2 Å²	59.2	40%	0.404	31%	0.307	S	S	.	.	B	Isolated β-bridge	trans	-135.8	154.1	-178.2	-60.5	180	154.7	-150.2	-10.7	110.9	D262 A263 L264	R260-D262 WeakPolarHBondContact CB-OD1 3.39Å; R260-D262 WeakPolarHBondContact CD-OD1 3.39Å; R260-D262 IonicContact NH1-OD2 2.69Å; R260-D262 PolarHBondContact O-N 2.98Å; R260-A263 CarbonylContact O-C 3.55Å; R260-A263 PolarHBondContact O-N 3.13Å; R260-L264 PolarHBondContact O-N 3.09Å
261	P	75.3	Confident	89.5	Confident	123 Å²	123	58.5 Å²	58.5	80%	0.799	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-28.4	175	25.7	-34.9	0	0	0	113.2	A263	P261-A263 VanDerWaalsContact C-N 3.3Å
262	D	77.6	Confident	89.4	Confident	120 Å²	120	65.6 Å²	65.6	64%	0.642	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78	-8.6	173.1	57.4	-62.6	0	0	0	114.3	R260	R260-D262 WeakPolarHBondContact CB-OD1 3.39Å; R260-D262 WeakPolarHBondContact CD-OD1 3.39Å; R260-D262 IonicContact NH1-OD2 2.69Å; R260-D262 PolarHBondContact O-N 2.98Å
263	A	79.4	Confident	89.5	Confident	22 Å²	22	70.5 Å²	70.5	18%	0.182	35%	0.351	C	S	.	.	B	Isolated β-bridge	trans	-151.4	71	-175.2	0	0	0	0	0	110.8	W254 R260 P261	W254-A263 HydrophobicContact CZ3-CB 4.29Å; R260-A263 CarbonylContact O-C 3.55Å; R260-A263 PolarHBondContact O-N 3.13Å; P261-A263 VanDerWaalsContact C-N 3.3Å
264	L	89.7	Confident	89.7	Confident	95 Å²	95	69.3 Å²	69.3	50%	0.497	34%	0.341	S	S	.	.			trans	-61.4	135.1	178.6	-61.2	-179.2	0	0	0	111.3	V226 F227 R260	V226-L264 HydrophobicContact CG1-CB 4.23Å; V226-L264 HydrophobicContact CG2-CB 4.17Å; V226-L264 HydrophobicContact CG2-CD1 4.27Å; F227-L264 PolarHBondContact N-O 2.98Å; R260-L264 PolarHBondContact O-N 3.09Å
265	I	94.4	Very high	89.9	Confident	27 Å²	27	70.7 Å²	70.7	14%	0.138	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	129	-177.5	175.3	160.6	0	0	0	109.4	F227 Q268 L271	F227-I265 HydrophobicContact CB-CB 4.3Å; F227-I265 HydrophobicContact CB-CG1 4.46Å; F227-I265 HydrophobicContact CD1-CD1 3.58Å; F227-I265 HydrophobicContact CD1-CG1 3.85Å; F227-I265 HydrophobicContact CE1-CD1 4.01Å; F227-I265 HydrophobicContact CG-CD1 4.44Å; F227-I265 VanDerWaalsContact O-CA 3.3Å; F227-I265 WeakPolarHBondContact O-CA 3.37Å; I265-Q268 HydrophobicContact CD1-CB 4.31Å; I265-Q268 HydrophobicContact CD1-CG 3.92Å; I265-Q268 HydrophobicContact CG1-CB 4.28Å; I265-Q268 HydrophobicContact CG1-CG 4.41Å; I265-L271 HydrophobicContact CD1-CD1 4.14Å
266	T	94.2	Very high	90.1	Very high	56 Å²	56	78.3 Å²	78.3	34%	0.344	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	156.7	173.1	65.5	0	0	0	0	110.4	V226 F227 S228 C229 Q268	V226-T266 HydrophobicContact CG1-CG2 3.9Å; F227-T266 PolarHBondContact O-N 2.77Å; F227-T266 VanDerWaalsContact O-N 3.07Å; S228-T266 WeakPolarHBondContact CA-OG1 3.33Å; S228-T266 PolarHBondContact OG-OG1 3.16Å; C229-T266 WeakPolarHBondContact CB-O 3.35Å; C229-T266 PolarHBondContact N-O 3.3Å; C229-T266 PolarHBondContact SG-O 3.48Å; T266-Q268 VanDerWaalsContact C-N 3.27Å; T266-Q268 PolarHBondContact O-N 3.02Å
267	D	94.6	Very high	90.4	Very high	60 Å²	60	77.8 Å²	77.8	32%	0.321	38%	0.382	S	S	.	.			trans	57.9	34.7	167.8	-25.3	-65.7	0	0	0	114	C229 R230 E269 I270	C229-D267 HydrophobicContact CB-CB 4.17Å; C229-D267 VanDerWaalsContact CB-O 3.26Å; C229-D267 WeakPolarHBondContact CB-O 3.36Å; R230-D267 WeakPolarHBondContact CB-OD2 3.38Å; R230-D267 PolarHBondContact N-OD2 3.19Å; D267-E269 VanDerWaalsContact C-OE1 3.29Å; D267-E269 WeakPolarHBondContact CA-OE1 3.3Å; D267-E269 PolarHBondContact O-N 3.31Å; D267-E269 VanDerWaalsContact O-N 3.1Å; D267-I270 HydrophobicContact CB-CD1 3.54Å; D267-I270 HydrophobicContact CB-CG1 4.01Å; D267-I270 VanDerWaalsContact O-CB 3.23Å; D267-I270 WeakPolarHBondContact O-CB 3.42Å; D267-I270 WeakPolarHBondContact O-CG1 3.46Å; D267-I270 PolarHBondContact O-N 3.49Å
268	Q	94.8	Very high	90.8	Very high	32 Å²	32	84 Å²	84	15%	0.15	41%	0.409	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-25.6	-169.3	-168.4	-178.6	41.2	0	0	113.5	R255 E257 I265 T266 I270 L271	R255-Q268 PolarHBondContact O-NE2 3.23Å; E257-Q268 PolarHBondContact O-NE2 3.07Å; I265-Q268 HydrophobicContact CD1-CB 4.31Å; I265-Q268 HydrophobicContact CD1-CG 3.92Å; I265-Q268 HydrophobicContact CG1-CB 4.28Å; I265-Q268 HydrophobicContact CG1-CG 4.41Å; T266-Q268 VanDerWaalsContact C-N 3.27Å; T266-Q268 PolarHBondContact O-N 3.02Å; Q268-I270 VanDerWaalsContact C-N 3.25Å; Q268-I270 PolarHBondContact O-N 3.07Å; Q268-L271 HydrophobicContact CG-CD1 4.49Å; Q268-L271 PolarHBondContact O-N 3.24Å
269	E	95.2	Very high	91.7	Very high	109 Å²	109	77.6 Å²	77.6	51%	0.509	38%	0.379	S	S	.	.	H	α-helix	trans	-62.2	-26.5	171.8	68.5	-62.4	143.6	0	0	113.8	D267 L271 R272 K273	D267-E269 VanDerWaalsContact C-OE1 3.29Å; D267-E269 WeakPolarHBondContact CA-OE1 3.3Å; D267-E269 PolarHBondContact O-N 3.31Å; D267-E269 VanDerWaalsContact O-N 3.1Å; E269-L271 PolarHBondContact O-N 3.26Å; E269-R272 PolarHBondContact O-N 2.95Å; E269-R272 VanDerWaalsContact O-N 3.12Å; E269-K273 PolarHBondContact O-N 2.98Å
270	I	97.3	Very high	92.5	Very high	16 Å²	16	74.9 Å²	74.9	8%	0.082	36%	0.36	C	S	.	.	H	α-helix	trans	-57.1	-39	172.3	-64.5	-179	0	0	0	110.7	C229 R230 Q233 D267 Q268 R272 K273 L274	C229-I270 HydrophobicContact CB-CB 4.03Å; C229-I270 HydrophobicContact CB-CG2 4.43Å; R230-I270 HydrophobicContact CB-CD1 4.43Å; Q233-I270 HydrophobicContact CB-CD1 4.31Å; Q233-I270 HydrophobicContact CB-CG2 4.03Å; D267-I270 HydrophobicContact CB-CD1 3.54Å; D267-I270 HydrophobicContact CB-CG1 4.01Å; D267-I270 VanDerWaalsContact O-CB 3.23Å; D267-I270 WeakPolarHBondContact O-CB 3.42Å; D267-I270 WeakPolarHBondContact O-CG1 3.46Å; D267-I270 PolarHBondContact O-N 3.49Å; Q268-I270 VanDerWaalsContact C-N 3.25Å; Q268-I270 PolarHBondContact O-N 3.07Å; I270-R272 VanDerWaalsContact C-N 3.31Å; I270-R272 PolarHBondContact O-N 3.35Å; I270-K273 WeakPolarHBondContact O-CB 3.34Å; I270-K273 PolarHBondContact O-N 3.47Å; I270-L274 HydrophobicContact CG2-CD1 3.87Å; I270-L274 HydrophobicContact CG2-CG 4.21Å; I270-L274 WeakPolarHBondContact O-CG 3.42Å; I270-L274 PolarHBondContact O-N 3.21Å
271	L	96.8	Very high	93.4	Very high	1 Å²	1	72.9 Å²	72.9	1%	0.005	36%	0.36	C	S	.	.	H	α-helix	trans	-64.3	-37.8	179.6	-50.4	-179.9	0	0	0	111.9	F227 C229 I232 V251 R255 I265 Q268 E269 E275 L280 F282	F227-L271 HydrophobicContact CE1-CD1 4.2Å; F227-L271 HydrophobicContact CE1-CD2 4.29Å; C229-L271 HydrophobicContact CB-CD2 3.96Å; C229-L271 HydrophobicContact CB-CG 4.22Å; C229-L271 VanDerWaalsContact SG-CG 3.58Å; I232-L271 HydrophobicContact CD1-CD2 3.75Å; V251-L271 HydrophobicContact CG1-CD1 4.48Å; R255-L271 HydrophobicContact CB-CD1 4.05Å; I265-L271 HydrophobicContact CD1-CD1 4.14Å; Q268-L271 HydrophobicContact CG-CD1 4.49Å; Q268-L271 PolarHBondContact O-N 3.24Å; E269-L271 PolarHBondContact O-N 3.26Å; L271-E275 WeakPolarHBondContact O-CB 3.26Å; L271-E275 PolarHBondContact O-N 3.03Å; L271-L280 HydrophobicContact CB-CD1 4.32Å; L271-L280 HydrophobicContact CD2-CD1 3.81Å; L271-F282 HydrophobicContact CB-CE1 4.41Å; L271-F282 HydrophobicContact CB-CZ 3.75Å; L271-F282 HydrophobicContact CD1-CE1 4.42Å
272	R	95.6	Very high	94.4	Very high	148 Å²	148	68.4 Å²	68.4	56%	0.558	33%	0.327	S	S	*	.	H	α-helix	trans	-72.9	-33.3	175.6	-73.1	-178.7	-80.1	173.1	-4.8	112.1	E269 I270 K276	E269-R272 PolarHBondContact O-N 2.95Å; E269-R272 VanDerWaalsContact O-N 3.12Å; I270-R272 VanDerWaalsContact C-N 3.31Å; I270-R272 PolarHBondContact O-N 3.35Å; R272-K276 WeakPolarHBondContact O-CB 3.09Å; R272-K276 PolarHBondContact O-N 3.24Å; R272-K276 VanDerWaalsContact O-N 3.1Å
273	K	97.5	Very high	95.3	Very high	106 Å²	106	62.7 Å²	62.7	46%	0.461	30%	0.297	S	S	.	.	H	α-helix	trans	-63.7	-50.4	172	178	179.7	171	-176	0	111.1	E269 I270 E275 K276 E277	E269-K273 PolarHBondContact O-N 2.98Å; I270-K273 WeakPolarHBondContact O-CB 3.34Å; I270-K273 PolarHBondContact O-N 3.47Å; K273-E275 PolarHBondContact O-N 3.44Å; K273-K276 WeakPolarHBondContact O-CB 3.4Å; K273-K276 PolarHBondContact O-N 3.42Å; K273-K276 VanDerWaalsContact O-N 3.15Å; K273-E277 WeakPolarHBondContact CE-OE1 3.25Å; K273-E277 VanDerWaalsContact CG-OE1 3.29Å; K273-E277 WeakPolarHBondContact CG-OE1 3.46Å; K273-E277 PolarHBondContact O-N 3.07Å
274	L	97.6	Very high	96	Very high	4 Å²	4	65 Å²	65	2%	0.021	31%	0.31	C	S	.	.	H	α-helix	trans	-67.6	-32.3	179.7	-65.4	173.7	0	0	0	112.8	I232 V236 I270 E277 K278 I279 L280	I232-L274 HydrophobicContact CG2-CD1 3.69Å; V236-L274 HydrophobicContact CG1-CD2 4.33Å; I270-L274 HydrophobicContact CG2-CD1 3.87Å; I270-L274 HydrophobicContact CG2-CG 4.21Å; I270-L274 WeakPolarHBondContact O-CG 3.42Å; I270-L274 PolarHBondContact O-N 3.21Å; L274-E277 PolarHBondContact O-N 3.32Å; L274-K278 PolarHBondContact O-N 3.09Å; L274-I279 HydrophobicContact CD2-CB 4.33Å; L274-I279 HydrophobicContact CD2-CD1 4.3Å; L274-I279 HydrophobicContact CD2-CG2 4.29Å; L274-I279 PolarHBondContact O-N 3.24Å; L274-L280 HydrophobicContact CB-CB 3.51Å; L274-L280 HydrophobicContact CB-CD1 4.28Å; L274-L280 HydrophobicContact CD1-CD1 4.38Å; L274-L280 PolarHBondContact O-N 3.35Å
275	E	97.2	Very high	96	Very high	74 Å²	74	61.8 Å²	61.8	35%	0.346	30%	0.296	S	S	.	.	H	α-helix	trans	-63.1	-42.2	169.9	177.9	173.3	-138	0	0	111.3	K256 L271 K273 K278 L280 F282	K256-E275 IonicContact NZ-OE1 2.75Å; K256-E275 PolarHBondContact NZ-OE1 3.43Å; K256-E275 IonicContact NZ-OE2 3.57Å; K256-E275 PolarHBondContact NZ-OE2 3.14Å; L271-E275 WeakPolarHBondContact O-CB 3.26Å; L271-E275 PolarHBondContact O-N 3.03Å; K273-E275 PolarHBondContact O-N 3.44Å; E275-K278 PolarHBondContact O-N 3.01Å; E275-K278 VanDerWaalsContact O-N 3.1Å; E275-L280 WeakPolarHBondContact CA-O 3.38Å; E275-L280 HydrophobicContact CB-CD2 4.5Å; E275-F282 HydrophobicContact CB-CD2 4.4Å; E275-F282 HydrophobicContact CB-CE2 3.93Å; E275-F282 VanDerWaalsContact CD-CE2 3.47Å; E275-F282 HydrophobicContact CG-CD2 4.26Å; E275-F282 HydrophobicContact CG-CE2 4.18Å; E275-F282 VanDerWaalsContact OE1-CD2 3.29Å; E275-F282 WeakPolarHBondContact OE1-CD2 3.47Å; E275-F282 VanDerWaalsContact OE2-CE2 3.28Å; E275-F282 WeakPolarHBondContact OE2-CE2 3.47Å
276	K	97.3	Very high	95.8	Very high	188 Å²	188	69.1 Å²	69.1	82%	0.817	32%	0.322	S	S	*	.	H	α-helix	trans	-67.2	-35.9	175.1	-173.2	-176.8	176.7	-173.8	0	112.8	R272 K273 K278	R272-K276 WeakPolarHBondContact O-CB 3.09Å; R272-K276 PolarHBondContact O-N 3.24Å; R272-K276 VanDerWaalsContact O-N 3.1Å; K273-K276 WeakPolarHBondContact O-CB 3.4Å; K273-K276 PolarHBondContact O-N 3.42Å; K273-K276 VanDerWaalsContact O-N 3.15Å; K276-K278 PolarHBondContact O-N 3.34Å
277	E	96.4	Very high	95.7	Very high	75 Å²	75	73.3 Å²	73.3	35%	0.35	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-3.5	172.3	-73.8	175.4	-140.5	0	0	112.9	R240 K273 L274 I279	R240-E277 IonicContact NH1-OE2 2.74Å; R240-E277 PolarHBondContact NH1-OE2 3.21Å; K273-E277 WeakPolarHBondContact CE-OE1 3.25Å; K273-E277 VanDerWaalsContact CG-OE1 3.29Å; K273-E277 WeakPolarHBondContact CG-OE1 3.46Å; K273-E277 PolarHBondContact O-N 3.07Å; L274-E277 PolarHBondContact O-N 3.32Å; E277-I279 HydrophobicContact CB-CD1 3.95Å; E277-I279 HydrophobicContact CB-CG1 4.11Å; E277-I279 PolarHBondContact O-N 3.44Å
278	K	96.6	Very high	95.5	Very high	183 Å²	183	73.3 Å²	73.3	80%	0.796	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.1	14.3	-173.5	-54.4	-179	-178.1	175.4	0	114.8	L274 E275 K276	L274-K278 PolarHBondContact O-N 3.09Å; E275-K278 PolarHBondContact O-N 3.01Å; E275-K278 VanDerWaalsContact O-N 3.1Å; K276-K278 PolarHBondContact O-N 3.34Å
279	I	97.7	Very high	95.2	Very high	22 Å²	22	80.8 Å²	80.8	11%	0.113	37%	0.368	C	S	.	.			trans	-82.9	-35.6	177.3	-64.8	171.2	0	0	0	110.4	V236 I247 T248 V249 L274 E277	V236-I279 HydrophobicContact CG1-CD1 4.01Å; V236-I279 HydrophobicContact CG1-CG2 3.94Å; V236-I279 HydrophobicContact CG2-CG2 3.91Å; I247-I279 HydrophobicContact CB-CG2 4.46Å; I247-I279 HydrophobicContact CG2-CG2 4.18Å; T248-I279 CarbonylContact C-O 3.52Å; T248-I279 WeakPolarHBondContact CA-O 3.26Å; V249-I279 HydrophobicContact CG2-CG2 3.96Å; V249-I279 PolarHBondContact N-O 2.9Å; L274-I279 HydrophobicContact CD2-CB 4.33Å; L274-I279 HydrophobicContact CD2-CD1 4.3Å; L274-I279 HydrophobicContact CD2-CG2 4.29Å; L274-I279 PolarHBondContact O-N 3.24Å; E277-I279 HydrophobicContact CB-CD1 3.95Å; E277-I279 HydrophobicContact CB-CG1 4.11Å; E277-I279 PolarHBondContact O-N 3.44Å
280	L	97.9	Very high	94.7	Very high	4 Å²	4	78.9 Å²	78.9	2%	0.021	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	130.3	-179.5	-175.3	154.3	0	0	0	111.7	V249 V251 L271 L274 E275 F282	V249-L280 HydrophobicContact CB-CB 4.22Å; V249-L280 HydrophobicContact CB-CD1 4.44Å; V249-L280 HydrophobicContact CB-CG 4.23Å; V249-L280 HydrophobicContact CG1-CD1 4.26Å; V249-L280 HydrophobicContact CG1-CG 4.45Å; V249-L280 WeakPolarHBondContact O-CA 3.41Å; V251-L280 HydrophobicContact CB-CD1 4.29Å; V251-L280 HydrophobicContact CB-CD2 4.47Å; V251-L280 HydrophobicContact CG2-CD1 3.74Å; V251-L280 HydrophobicContact CG2-CG 4.32Å; L271-L280 HydrophobicContact CB-CD1 4.32Å; L271-L280 HydrophobicContact CD2-CD1 3.81Å; L274-L280 HydrophobicContact CB-CB 3.51Å; L274-L280 HydrophobicContact CB-CD1 4.28Å; L274-L280 HydrophobicContact CD1-CD1 4.38Å; L274-L280 PolarHBondContact O-N 3.35Å; E275-L280 WeakPolarHBondContact CA-O 3.38Å; E275-L280 HydrophobicContact CB-CD2 4.5Å; L280-F282 HydrophobicContact CD2-CD1 4.02Å; L280-F282 HydrophobicContact CD2-CD2 3.45Å; L280-F282 VanDerWaalsContact CD2-CD2 3.45Å; L280-F282 HydrophobicContact CD2-CE1 3.87Å; L280-F282 HydrophobicContact CD2-CE2 3.28Å; L280-F282 HydrophobicContact CD2-CG 3.87Å; L280-F282 HydrophobicContact CD2-CZ 3.53Å
281	V	97.5	Very high	94.2	Very high	66 Å²	66	87.6 Å²	87.6	40%	0.4	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	124.9	175.8	179.9	0	0	0	0	109.1	T248 V249 F250 V251	T248-V281 HydrophobicContact CG2-CB 4.42Å; T248-V281 HydrophobicContact CG2-CG2 3.95Å; V249-V281 PolarHBondContact O-N 3.14Å; F250-V281 WeakPolarHBondContact CA-O 3.32Å; F250-V281 HydrophobicContact CD1-CB 4.01Å; F250-V281 HydrophobicContact CD1-CG1 4.16Å; F250-V281 HydrophobicContact CE1-CB 3.85Å; F250-V281 HydrophobicContact CE1-CG1 3.72Å; V251-V281 PolarHBondContact N-O 2.98Å
282	F	97.1	Very high	93.8	Very high	28 Å²	28	91.5 Å²	91.5	12%	0.123	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	124.3	178.5	-75.6	-80.8	0	0	0	112.2	V251 A253 K256 L271 E275 L280	V251-F282 HydrophobicContact CB-CD1 4.3Å; V251-F282 HydrophobicContact CB-CE1 4.31Å; V251-F282 HydrophobicContact CG1-CD1 4.35Å; V251-F282 HydrophobicContact CG1-CE1 4.1Å; V251-F282 CarbonylContact O-C 3.49Å; V251-F282 WeakPolarHBondContact O-CA 3.37Å; V251-F282 WeakPolarHBondContact O-CD1 3.46Å; A253-F282 HydrophobicContact CB-CB 4.05Å; K256-F282 HydrophobicContact CD-CD1 4.46Å; K256-F282 HydrophobicContact CD-CD2 4.02Å; K256-F282 HydrophobicContact CD-CE1 3.99Å; K256-F282 HydrophobicContact CD-CE2 3.48Å; K256-F282 VanDerWaalsContact CD-CE2 3.48Å; K256-F282 HydrophobicContact CD-CG 4.44Å; K256-F282 HydrophobicContact CD-CZ 3.43Å; K256-F282 VanDerWaalsContact CD-CZ 3.43Å; K256-F282 HydrophobicContact CG-CD1 4.16Å; K256-F282 HydrophobicContact CG-CE1 3.47Å; K256-F282 VanDerWaalsContact CG-CE1 3.47Å; K256-F282 HydrophobicContact CG-CE2 3.91Å; K256-F282 HydrophobicContact CG-CZ 3.29Å; K256-F282 VanDerWaalsContact NZ-CD2 3.3Å; L271-F282 HydrophobicContact CB-CE1 4.41Å; L271-F282 HydrophobicContact CB-CZ 3.75Å; L271-F282 HydrophobicContact CD1-CE1 4.42Å; E275-F282 HydrophobicContact CB-CD2 4.4Å; E275-F282 HydrophobicContact CB-CE2 3.93Å; E275-F282 VanDerWaalsContact CD-CE2 3.47Å; E275-F282 HydrophobicContact CG-CD2 4.26Å; E275-F282 HydrophobicContact CG-CE2 4.18Å; E275-F282 VanDerWaalsContact OE1-CD2 3.29Å; E275-F282 WeakPolarHBondContact OE1-CD2 3.47Å; E275-F282 VanDerWaalsContact OE2-CE2 3.28Å; E275-F282 WeakPolarHBondContact OE2-CE2 3.47Å; L280-F282 HydrophobicContact CD2-CD1 4.02Å; L280-F282 HydrophobicContact CD2-CD2 3.45Å; L280-F282 VanDerWaalsContact CD2-CD2 3.45Å; L280-F282 HydrophobicContact CD2-CE1 3.87Å; L280-F282 HydrophobicContact CD2-CE2 3.28Å; L280-F282 HydrophobicContact CD2-CG 3.87Å; L280-F282 HydrophobicContact CD2-CZ 3.53Å
283	T	96.3	Very high	93.5	Very high	1 Å²	1	87.5 Å²	87.5	1%	0.006	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	146.5	177.3	64.6	0	0	0	0	111.1	F250 V251 P252 A253 S285 D297 F300	F250-T283 HydrophobicContact CB-CG2 3.95Å; F250-T283 HydrophobicContact CD1-CG2 3.47Å; F250-T283 VanDerWaalsContact CD1-CG2 3.47Å; F250-T283 HydrophobicContact CE1-CG2 4.27Å; F250-T283 HydrophobicContact CG-CG2 4Å; V251-T283 PolarHBondContact O-N 3.43Å; P252-T283 WeakPolarHBondContact CA-OG1 3.34Å; A253-T283 VanDerWaalsContact CB-O 3.26Å; A253-T283 WeakPolarHBondContact CB-O 3.4Å; A253-T283 PolarHBondContact N-O 3.11Å; T283-S285 PolarHBondContact O-N 3.02Å; T283-D297 HydrophobicContact CG2-CB 3.98Å; T283-F300 HydrophobicContact CG2-CB 4.06Å; T283-F300 HydrophobicContact CG2-CD2 3.92Å; T283-F300 HydrophobicContact CG2-CG 4.05Å
284	P	94.1	Very high	93.2	Very high	69 Å²	69	85 Å²	85	45%	0.448	41%	0.41	S	S	.	.	P	Polyproline II helix	trans	-63	129	-172	-24.9	35.5	0	0	0	114.1	C295 F300	P284-C295 WeakPolarHBondContact O-CB 3.46Å; P284-C295 PolarHBondContact O-N 3.49Å; P284-F300 HydrophobicContact CG-CZ 4.15Å
285	S	90.6	Very high	92.8	Very high	29 Å²	29	87.6 Å²	87.6	20%	0.203	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	144.3	165.8	67.4	0	0	0	0	110.6	W254 T283 V293	W254-S285 PolarHBondContact N-OG 2.8Å; T283-S285 PolarHBondContact O-N 3.02Å; S285-V293 CarbonylContact C-O 3.56Å; S285-V293 VanDerWaalsContact CA-O 3.31Å; S285-V293 WeakPolarHBondContact CA-O 3.4Å
286	R	90.3	Very high	92.6	Very high	180 Å²	180	91.4 Å²	91.4	68%	0.679	44%	0.44	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-141.3	164.8	-178.6	63.1	-179.7	-178.3	-148.3	-0.2	111.1	V288 V293	R286-V288 HydrophobicContact CG-CG2 4.09Å; R286-V293 HydrophobicContact CG-CB 4.39Å; R286-V293 PolarHBondContact N-O 3.02Å; R286-V293 PolarHBondContact O-N 3.5Å; R286-V293 VanDerWaalsContact O-O 3.14Å
287	R	91	Very high	92.4	Very high	144 Å²	144	83.5 Å²	83.5	54%	0.543	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	135.5	168.9	-62.4	-175.6	-178.1	-167.9	3	110.1	E257 R291	E257-R287 IonicContact OE1-NE 2.68Å; E257-R287 IonicContact OE1-NH2 3.89Å; E257-R287 IonicContact OE2-CZ 3.77Å; E257-R287 IonicContact OE2-NE 3.72Å; E257-R287 IonicContact OE2-NH2 3.94Å; E257-R287 PolarHBondContact OE2-NH2 2.92Å; R287-R291 CarbonylContact C-O 3.54Å; R287-R291 VanDerWaalsContact CA-O 3.3Å; R287-R291 WeakPolarHBondContact CA-O 3.35Å
288	V	91.3	Very high	92.4	Very high	61 Å²	61	81.6 Å²	81.6	37%	0.37	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	122.8	177.6	-177.4	0	0	0	0	107	R286 G290 R291 V293	R286-V288 HydrophobicContact CG-CG2 4.09Å; V288-G290 PolarHBondContact O-N 3.18Å; V288-R291 PolarHBondContact N-O 3.11Å; V288-R291 PolarHBondContact O-N 3.33Å; V288-V293 HydrophobicContact CB-CG2 4.1Å; V288-V293 HydrophobicContact CG2-CG2 3.91Å
289	Q	88.1	Confident	92.3	Very high	188 Å²	188	76.6 Å²	76.6	88%	0.879	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.5	41	-175.5	-60.6	173.1	-13.5	0	0	112.7	R291	Q289-R291 PolarHBondContact O-N 3.48Å
290	G	85.2	Confident	92.3	Very high	69 Å²	69	79.2 Å²	79.2	71%	0.711	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.9	-24.2	-175.4	0	0	0	0	0	115.6	V288	V288-G290 PolarHBondContact O-N 3.18Å
291	R	87.2	Confident	92.3	Very high	199 Å²	199	79 Å²	79	75%	0.751	39%	0.385	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.9	141.8	177.5	-59.5	-177.9	-180	-169.9	-1	110.8	R287 V288 Q289	R287-R291 CarbonylContact C-O 3.54Å; R287-R291 VanDerWaalsContact CA-O 3.3Å; R287-R291 WeakPolarHBondContact CA-O 3.35Å; V288-R291 PolarHBondContact N-O 3.11Å; V288-R291 PolarHBondContact O-N 3.33Å; Q289-R291 PolarHBondContact O-N 3.48Å
292	R	87.9	Confident	92.3	Very high	83 Å²	83	75.9 Å²	75.9	31%	0.313	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	128.8	174.2	-168.3	-172.1	-77.2	152.7	-6.3	109.3	W254 E257 V294	W254-R292 VanDerWaalsContact CD2-NH1 3.33Å; E257-R292 VanDerWaalsContact CD-NH2 3.32Å; E257-R292 IonicContact OE1-CZ 2.7Å; E257-R292 IonicContact OE1-NE 3.06Å; E257-R292 PolarHBondContact OE1-NE 2.75Å; E257-R292 IonicContact OE1-NH2 3.35Å; E257-R292 IonicContact OE2-CZ 3.44Å; E257-R292 IonicContact OE2-NE 3.63Å; E257-R292 IonicContact OE2-NH2 3.91Å; E257-R292 PolarHBondContact OE2-NH2 3.35Å; R292-V294 HydrophobicContact CG-CG2 3.9Å
293	V	89.5	Confident	92.3	Very high	64 Å²	64	80 Å²	80	39%	0.388	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	119.2	171	-178.7	0	0	0	0	107.2	S285 R286 V288	S285-V293 CarbonylContact C-O 3.56Å; S285-V293 VanDerWaalsContact CA-O 3.31Å; S285-V293 WeakPolarHBondContact CA-O 3.4Å; R286-V293 HydrophobicContact CG-CB 4.39Å; R286-V293 PolarHBondContact N-O 3.02Å; R286-V293 PolarHBondContact O-N 3.5Å; R286-V293 VanDerWaalsContact O-O 3.14Å; V288-V293 HydrophobicContact CB-CG2 4.1Å; V288-V293 HydrophobicContact CG2-CG2 3.91Å
294	V	89.5	Confident	92.4	Very high	54 Å²	54	82.8 Å²	82.8	33%	0.327	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	134.1	-179.6	-172	0	0	0	0	107.7	P252 R292	P252-V294 HydrophobicContact CB-CG1 4.17Å; R292-V294 HydrophobicContact CG-CG2 3.9Å
295	C	90.8	Very high	92.5	Very high	59 Å²	59	79.5 Å²	79.5	40%	0.399	38%	0.377	S	S	.	.			trans	-82.2	134.5	168.6	-63.9	0	0	0	0	109.1	P284 D297 F300	P284-C295 WeakPolarHBondContact O-CB 3.46Å; P284-C295 PolarHBondContact O-N 3.49Å; C295-D297 PolarHBondContact O-N 3.39Å; C295-D297 VanDerWaalsContact O-N 3.13Å; C295-F300 HydrophobicContact CB-CE2 3.98Å
296	Y	91.6	Very high	92.9	Very high	153 Å²	153	82.6 Å²	82.6	60%	0.6	39%	0.385	S	S	*	.			trans	-52.4	116.4	178.7	-63	-66.6	0	0	0	111.7	D298 R299 F300	Y296-D298 VanDerWaalsContact C-N 3.32Å; Y296-R299 PolarHBondContact O-N 2.97Å; Y296-F300 WeakPolarHBondContact O-CD2 3.31Å
297	D	94.4	Very high	93.2	Very high	22 Å²	22	79.1 Å²	79.1	12%	0.118	38%	0.38	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-37	179.2	21.3	-27.6	0	0	0	111.8	S215 P252 T283 C295 R299 F300 I301	S215-D297 WeakPolarHBondContact CB-OD2 3.41Å; S215-D297 PolarHBondContact OG-OD2 3.35Å; P252-D297 VanDerWaalsContact CD-OD2 3.25Å; P252-D297 WeakPolarHBondContact CD-OD2 3.4Å; P252-D297 HydrophobicContact CG-CB 4.38Å; P252-D297 WeakPolarHBondContact CG-OD2 3.38Å; T283-D297 HydrophobicContact CG2-CB 3.98Å; C295-D297 PolarHBondContact O-N 3.39Å; C295-D297 VanDerWaalsContact O-N 3.13Å; D297-R299 PolarHBondContact O-N 3.1Å; D297-R299 VanDerWaalsContact O-N 3.11Å; D297-F300 WeakPolarHBondContact O-CA 3.36Å; D297-F300 WeakPolarHBondContact O-CB 3.48Å; D297-F300 PolarHBondContact O-N 3.18Å; D297-I301 HydrophobicContact CB-CD1 4.36Å; D297-I301 WeakPolarHBondContact O-CG1 3.44Å; D297-I301 PolarHBondContact O-N 3.45Å
298	D	95.8	Very high	93.5	Very high	36 Å²	36	74.4 Å²	74.4	19%	0.193	37%	0.369	C	S	.	.	H	α-helix	trans	-47.8	-40.7	175.8	-44.2	-42.6	0	0	0	113.1	Y296 F300 I301 L302 Y318 L321	Y296-D298 VanDerWaalsContact C-N 3.32Å; D298-F300 VanDerWaalsContact C-N 3.34Å; D298-F300 PolarHBondContact O-N 2.96Å; D298-I301 PolarHBondContact O-N 3.01Å; D298-L302 VanDerWaalsContact O-CB 3.26Å; D298-L302 WeakPolarHBondContact O-CB 3.36Å; D298-L302 PolarHBondContact O-N 3.19Å; D298-Y318 HydrophobicContact CB-CD1 3.71Å; D298-Y318 HydrophobicContact CB-CE1 3.89Å; D298-Y318 WeakPolarHBondContact OD1-CE1 3.3Å; D298-L321 HydrophobicContact CB-CD1 3.73Å
299	R	95.6	Very high	93.7	Very high	77 Å²	77	74.8 Å²	74.8	29%	0.291	37%	0.369	S	S	.	.	H	α-helix	trans	-71.1	-26.9	179.7	-75.2	176	161	74.2	-2.4	113.2	Y296 D297 K303 D320 L321 E324	Y296-R299 PolarHBondContact O-N 2.97Å; D297-R299 PolarHBondContact O-N 3.1Å; D297-R299 VanDerWaalsContact O-N 3.11Å; R299-K303 WeakPolarHBondContact O-CB 3.46Å; R299-K303 PolarHBondContact O-N 2.93Å; R299-D320 IonicContact NH1-OD2 3.14Å; R299-L321 HydrophobicContact CG-CD1 4.2Å; R299-L321 HydrophobicContact CG-CD2 3.71Å; R299-E324 IonicContact CZ-OE1 2.71Å; R299-E324 IonicContact CZ-OE2 3.73Å; R299-E324 IonicContact NE-OE2 2.66Å; R299-E324 IonicContact NH1-OE1 2.85Å; R299-E324 IonicContact NH2-OE1 3.4Å; R299-E324 PolarHBondContact NH2-OE1 3.36Å; R299-E324 IonicContact NH2-OE2 3.84Å; R299-E324 PolarHBondContact NH2-OE2 3.49Å
300	F	97.4	Very high	94.1	Very high	78 Å²	78	65.8 Å²	65.8	34%	0.342	33%	0.327	S	S	.	.	H	α-helix	trans	-80.4	-42.3	172.5	-66.2	-89.7	0	0	0	110.8	F250 T283 P284 C295 Y296 D297 D298 L304	F250-F300 HydrophobicContact CD1-CB 4.13Å; F250-F300 HydrophobicContact CD2-CB 4.32Å; F250-F300 HydrophobicContact CE1-CB 3.91Å; F250-F300 HydrophobicContact CE2-CB 4.1Å; F250-F300 WeakPolarHBondContact CE2-O 3.48Å; F250-F300 HydrophobicContact CG-CB 4.33Å; F250-F300 HydrophobicContact CZ-CB 3.88Å; T283-F300 HydrophobicContact CG2-CB 4.06Å; T283-F300 HydrophobicContact CG2-CD2 3.92Å; T283-F300 HydrophobicContact CG2-CG 4.05Å; P284-F300 HydrophobicContact CG-CZ 4.15Å; C295-F300 HydrophobicContact CB-CE2 3.98Å; Y296-F300 WeakPolarHBondContact O-CD2 3.31Å; D297-F300 WeakPolarHBondContact O-CA 3.36Å; D297-F300 WeakPolarHBondContact O-CB 3.48Å; D297-F300 PolarHBondContact O-N 3.18Å; D298-F300 VanDerWaalsContact C-N 3.34Å; D298-F300 PolarHBondContact O-N 2.96Å; F300-L304 VanDerWaalsContact O-CB 3.31Å; F300-L304 WeakPolarHBondContact O-CB 3.49Å; F300-L304 PolarHBondContact O-N 2.85Å
301	I	97.9	Very high	94.7	Very high	0 Å²	0	62.5 Å²	62.5	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-56.4	-61	175.8	-66.4	160.5	0	0	0	110.3	V211 D213 F250 D297 D298 K303 L304 A305 I312	V211-I301 HydrophobicContact CG1-CB 4.43Å; V211-I301 HydrophobicContact CG1-CG2 4.1Å; D213-I301 HydrophobicContact CB-CD1 3.85Å; F250-I301 HydrophobicContact CB-CD1 4.29Å; F250-I301 HydrophobicContact CB-CG1 3.73Å; F250-I301 HydrophobicContact CD2-CB 4.29Å; F250-I301 HydrophobicContact CD2-CG1 3.64Å; F250-I301 HydrophobicContact CG-CG1 4.06Å; D297-I301 HydrophobicContact CB-CD1 4.36Å; D297-I301 WeakPolarHBondContact O-CG1 3.44Å; D297-I301 PolarHBondContact O-N 3.45Å; D298-I301 PolarHBondContact O-N 3.01Å; I301-K303 PolarHBondContact O-N 2.84Å; I301-L304 PolarHBondContact O-N 3.14Å; I301-A305 WeakPolarHBondContact O-CB 3.47Å; I301-A305 PolarHBondContact O-N 3.13Å; I301-A305 VanDerWaalsContact O-N 3.07Å; I301-I312 HydrophobicContact CG2-CG1 4.48Å; I301-I312 HydrophobicContact CG2-CG2 3.64Å
302	L	97.3	Very high	95.3	Very high	0 Å²	0	53 Å²	53	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-61.3	-43.7	-177.7	176.1	60.1	0	0	0	111.9	D298 Y306 I312 L321 W328 F331 I332	D298-L302 VanDerWaalsContact O-CB 3.26Å; D298-L302 WeakPolarHBondContact O-CB 3.36Å; D298-L302 PolarHBondContact O-N 3.19Å; L302-Y306 WeakPolarHBondContact O-CB 3.49Å; L302-Y306 PolarHBondContact O-N 2.76Å; L302-I312 HydrophobicContact CB-CD1 4.49Å; L302-I312 HydrophobicContact CD1-CD1 3.69Å; L302-L321 HydrophobicContact CB-CD1 4.13Å; L302-L321 HydrophobicContact CD2-CB 3.6Å; L302-L321 HydrophobicContact CD2-CD1 3.54Å; L302-L321 HydrophobicContact CD2-CG 4.19Å; L302-W328 HydrophobicContact CD2-CB 3.98Å; L302-W328 HydrophobicContact CD2-CD2 3.59Å; L302-W328 HydrophobicContact CD2-CE3 3.74Å; L302-W328 HydrophobicContact CD2-CG 3.75Å; L302-W328 HydrophobicContact CD2-CZ3 4.4Å; L302-W328 HydrophobicContact CG-CD2 4.25Å; L302-W328 HydrophobicContact CG-CG 4.24Å; L302-F331 HydrophobicContact CD1-CD1 3.89Å; L302-F331 HydrophobicContact CD1-CE1 4.49Å; L302-I332 HydrophobicContact CD1-CD1 3.96Å; L302-I332 HydrophobicContact CD1-CG1 3.66Å; L302-I332 HydrophobicContact CD2-CD1 4.01Å
303	K	96.7	Very high	95.8	Very high	114 Å²	114	49.1 Å²	49.1	50%	0.496	24%	0.242	S	C	.	.	H	α-helix	trans	-66.8	-43.8	-179	-174.8	-179.1	171	-173	0	111.9	R299 I301 Y306 D307	R299-K303 WeakPolarHBondContact O-CB 3.46Å; R299-K303 PolarHBondContact O-N 2.93Å; I301-K303 PolarHBondContact O-N 2.84Å; K303-Y306 PolarHBondContact O-N 3.33Å; K303-D307 WeakPolarHBondContact CE-OD2 3.42Å; K303-D307 IonicContact NZ-OD2 3.61Å; K303-D307 VanDerWaalsContact O-CB 3.3Å; K303-D307 WeakPolarHBondContact O-CB 3.45Å; K303-D307 PolarHBondContact O-N 2.71Å
304	L	97.9	Very high	96.2	Very high	60 Å²	60	46 Å²	46	31%	0.314	22%	0.224	S	C	.	.	H	α-helix	trans	-63.5	-43.7	178.5	-179.1	64	0	0	0	111.1	V211 T248 F250 F300 I301 S308	V211-L304 HydrophobicContact CG1-CB 4.46Å; V211-L304 HydrophobicContact CG1-CD2 4.22Å; V211-L304 HydrophobicContact CG2-CB 4.31Å; V211-L304 HydrophobicContact CG2-CD2 3.96Å; V211-L304 HydrophobicContact CG2-CG 3.95Å; T248-L304 HydrophobicContact CG2-CD2 3.54Å; F250-L304 HydrophobicContact CE2-CB 3.88Å; F250-L304 HydrophobicContact CE2-CD2 3.58Å; F250-L304 HydrophobicContact CE2-CG 4.38Å; F250-L304 HydrophobicContact CZ-CB 4.24Å; F250-L304 HydrophobicContact CZ-CD2 3.78Å; F300-L304 VanDerWaalsContact O-CB 3.31Å; F300-L304 WeakPolarHBondContact O-CB 3.49Å; F300-L304 PolarHBondContact O-N 2.85Å; I301-L304 PolarHBondContact O-N 3.14Å; L304-S308 WeakPolarHBondContact O-CB 3.35Å; L304-S308 PolarHBondContact O-N 3.35Å; L304-S308 PolarHBondContact O-OG 3.05Å
305	A	97.8	Very high	96.6	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-62.9	-43.8	177.3	0	0	0	0	0	111.5	V211 I301 S308 D309 G310 I312 F331	V211-A305 HydrophobicContact CB-CB 4.14Å; V211-A305 HydrophobicContact CG2-CB 3.89Å; I301-A305 WeakPolarHBondContact O-CB 3.47Å; I301-A305 PolarHBondContact O-N 3.13Å; I301-A305 VanDerWaalsContact O-N 3.07Å; A305-S308 PolarHBondContact O-N 3.44Å; A305-S308 PolarHBondContact O-OG 2.66Å; A305-D309 WeakPolarHBondContact O-CA 3.19Å; A305-D309 PolarHBondContact O-N 2.75Å; A305-G310 PolarHBondContact O-N 2.77Å; A305-I312 HydrophobicContact CB-CD1 4.09Å; A305-I312 HydrophobicContact CB-CG1 3.42Å; A305-I312 VanDerWaalsContact CB-CG1 3.42Å; A305-F331 HydrophobicContact CB-CE1 3.7Å; A305-F331 HydrophobicContact CB-CZ 3.89Å; A305-F331 VanDerWaalsContact O-CZ 3.24Å; A305-F331 WeakPolarHBondContact O-CZ 3.34Å
306	Y	97.6	Very high	96.9	Very high	93 Å²	93	46 Å²	46	37%	0.365	22%	0.218	S	C	.	.	H	α-helix	trans	-63.7	-49.7	177.7	-175.5	-87.9	0	0	0	112.5	L302 K303 S308 D309 E327 W328 F331	L302-Y306 WeakPolarHBondContact O-CB 3.49Å; L302-Y306 PolarHBondContact O-N 2.76Å; K303-Y306 PolarHBondContact O-N 3.33Å; Y306-S308 PolarHBondContact O-N 2.87Å; Y306-S308 VanDerWaalsContact O-N 3.12Å; Y306-D309 PolarHBondContact O-N 2.99Å; Y306-E327 HydrophobicContact CE2-CB 4.26Å; Y306-E327 HydrophobicContact CE2-CG 4.25Å; Y306-W328 AromaticContact CD2-CD1 3.84Å; Y306-F331 HydrophobicContact CD2-CB 3.86Å; Y306-F331 HydrophobicContact CD2-CD1 4.45Å; Y306-F331 AromaticContact CD2-CD2 3.7Å; Y306-F331 HydrophobicContact CD2-CD2 3.7Å; Y306-F331 HydrophobicContact CD2-CE2 4.38Å; Y306-F331 AromaticContact CD2-CG 3.74Å; Y306-F331 HydrophobicContact CD2-CG 3.74Å; Y306-F331 HydrophobicContact CE2-CB 4.31Å; Y306-F331 HydrophobicContact CE2-CD2 4.38Å; Y306-F331 HydrophobicContact CG-CD2 4.49Å
307	D	97.3	Very high	97.1	Very high	107 Å²	107	41.9 Å²	41.9	57%	0.572	21%	0.206	S	C	*	.	H	α-helix	trans	-66.5	-12.3	-179.2	-71.8	-5.6	0	0	0	112.6	K303	K303-D307 WeakPolarHBondContact CE-OD2 3.42Å; K303-D307 IonicContact NZ-OD2 3.61Å; K303-D307 VanDerWaalsContact O-CB 3.3Å; K303-D307 WeakPolarHBondContact O-CB 3.45Å; K303-D307 PolarHBondContact O-N 2.71Å
308	S	96.3	Very high	97.2	Very high	45 Å²	45	41 Å²	41	32%	0.315	20%	0.201	S	C	.	.	H	α-helix	trans	-116.9	-0.9	-180	64.6	0	0	0	0	115.6	L304 A305 Y306 G310	L304-S308 WeakPolarHBondContact O-CB 3.35Å; L304-S308 PolarHBondContact O-N 3.35Å; L304-S308 PolarHBondContact O-OG 3.05Å; A305-S308 PolarHBondContact O-N 3.44Å; A305-S308 PolarHBondContact O-OG 2.66Å; Y306-S308 PolarHBondContact O-N 2.87Å; Y306-S308 VanDerWaalsContact O-N 3.12Å; S308-G310 PolarHBondContact O-N 3.45Å
309	D	96.3	Very high	97.3	Very high	69 Å²	69	47.6 Å²	47.6	37%	0.369	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.5	38.1	-167	-169.1	31.6	0	0	0	113.1	R208 A305 Y306 R335	R208-D309 IonicContact CZ-OD2 2.92Å; R208-D309 PolarHBondContact NH1-O 3.27Å; R208-D309 IonicContact NH1-OD1 3.66Å; R208-D309 PolarHBondContact NH1-OD1 3.32Å; R208-D309 VanDerWaalsContact NH1-OD1 3.14Å; R208-D309 IonicContact NH1-OD2 3.13Å; R208-D309 PolarHBondContact NH1-OD2 2.9Å; R208-D309 IonicContact NH2-OD2 3.24Å; A305-D309 WeakPolarHBondContact O-CA 3.19Å; A305-D309 PolarHBondContact O-N 2.75Å; Y306-D309 PolarHBondContact O-N 2.99Å; D309-R335 IonicContact OD1-CZ 2.76Å; D309-R335 IonicContact OD1-NE 3.54Å; D309-R335 PolarHBondContact OD1-NE 3.13Å; D309-R335 IonicContact OD1-NH2 2.69Å; D309-R335 PolarHBondContact OD1-NH2 2.92Å; D309-R335 IonicContact OD2-NH2 3.05Å
310	G	96.9	Very high	97.2	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	23%	0.227	C	C	.	.			trans	-81	-175.1	177.9	0	0	0	0	0	114.5	P209 A305 S308 F331 R335	P209-G310 CarbonylContact O-C 3.48Å; P209-G310 WeakPolarHBondContact O-CA 3.39Å; A305-G310 PolarHBondContact O-N 2.77Å; S308-G310 PolarHBondContact O-N 3.45Å; G310-F331 WeakPolarHBondContact O-CZ 3.25Å; G310-R335 WeakPolarHBondContact O-CD 3.49Å
311	I	98.2	Very high	97.1	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	139.8	172.1	-62.6	-50.6	0	0	0	109.5	R208 P209 I210 V211 V313 R335 L337 F363 L364	R208-I311 HydrophobicContact CB-CG1 4.12Å; P209-I311 PolarHBondContact O-N 2.9Å; I210-I311 HydrophobicContact CD1-CB 3.94Å; I210-I311 HydrophobicContact CD1-CG1 4.26Å; V211-I311 PolarHBondContact N-O 3.1Å; I311-V313 HydrophobicContact CG2-CG2 4.39Å; I311-R335 HydrophobicContact CD1-CB 4.41Å; I311-L337 HydrophobicContact CG2-CB 3.7Å; I311-L337 HydrophobicContact CG2-CD2 4.27Å; I311-F363 HydrophobicContact CD1-CD1 3.92Å; I311-F363 HydrophobicContact CD1-CE1 3.54Å; I311-F363 HydrophobicContact CD1-CZ 3.92Å; I311-F363 HydrophobicContact CG1-CD1 4.32Å; I311-F363 HydrophobicContact CG1-CE1 4.06Å; I311-F363 HydrophobicContact CG2-CE1 3.73Å; I311-L364 HydrophobicContact CG1-CD2 4.35Å
312	I	98.6	Very high	97	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	127.1	170.2	-58.3	169.4	0	0	0	108.8	V211 I301 L302 A305 Y318 F331 I332 R335 L336 L337	V211-I312 CarbonylContact O-C 3.12Å; V211-I312 WeakPolarHBondContact O-CA 3.47Å; I301-I312 HydrophobicContact CG2-CG1 4.48Å; I301-I312 HydrophobicContact CG2-CG2 3.64Å; L302-I312 HydrophobicContact CB-CD1 4.49Å; L302-I312 HydrophobicContact CD1-CD1 3.69Å; A305-I312 HydrophobicContact CB-CD1 4.09Å; A305-I312 HydrophobicContact CB-CG1 3.42Å; A305-I312 VanDerWaalsContact CB-CG1 3.42Å; I312-Y318 HydrophobicContact CG2-CE2 3.84Å; I312-F331 HydrophobicContact CD1-CD1 4.18Å; I312-F331 HydrophobicContact CD1-CE1 3.89Å; I312-F331 HydrophobicContact CG1-CE1 4.16Å; I312-I332 HydrophobicContact CD1-CG1 4.49Å; I312-R335 PolarHBondContact N-O 3.24Å; I312-L336 HydrophobicContact CB-CD1 4.33Å; I312-L336 HydrophobicContact CG2-CD1 4.1Å; I312-L337 PolarHBondContact O-N 3.37Å
313	V	98.7	Very high	96.8	Very high	0 Å²	0	52 Å²	52	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	102	175.2	-174.4	0	0	0	0	109.1	I210 V211 I212 D213 F239 I311 L337 Y339 F346	I210-V313 HydrophobicContact CG2-CG2 3.61Å; V211-V313 PolarHBondContact O-N 3.12Å; I212-V313 HydrophobicContact CB-CB 4.42Å; I212-V313 HydrophobicContact CG1-CB 4.14Å; I212-V313 HydrophobicContact CG1-CG2 4.22Å; I212-V313 HydrophobicContact CG2-CB 4.33Å; D213-V313 WeakPolarHBondContact CB-O 3.39Å; D213-V313 PolarHBondContact N-O 3.23Å; F239-V313 HydrophobicContact CE2-CG1 4.23Å; F239-V313 HydrophobicContact CE2-CG2 3.83Å; F239-V313 HydrophobicContact CZ-CG1 4.34Å; F239-V313 HydrophobicContact CZ-CG2 3.59Å; I311-V313 HydrophobicContact CG2-CG2 4.39Å; V313-L337 HydrophobicContact CG2-CB 4.44Å; V313-L337 HydrophobicContact CG2-CD2 4.42Å; V313-Y339 HydrophobicContact CG1-CD1 3.81Å; V313-Y339 HydrophobicContact CG1-CE1 4.03Å; V313-F346 HydrophobicContact CG1-CZ 3.93Å
314	S	98.4	Very high	96.7	Very high	0 Å²	0	51 Å²	51	0%	0	25%	0.252	C	S	.	.			trans	-161.9	157.7	178.5	-166.9	0	0	0	0	110.6	D213 N216 D316 Y318 L336 L337	D213-S314 PolarHBondContact OD2-OG 2.75Å; N216-S314 VanDerWaalsContact CB-OG 3.31Å; N216-S314 WeakPolarHBondContact CB-OG 3.04Å; N216-S314 PolarHBondContact ND2-OG 2.73Å; S314-D316 PolarHBondContact OG-N 3.3Å; S314-D316 VanDerWaalsContact OG-N 3.15Å; S314-Y318 WeakPolarHBondContact CB-OH 3.43Å; S314-Y318 PolarHBondContact OG-OH 3.11Å; S314-Y318 VanDerWaalsContact OG-OH 3.13Å; S314-L336 WeakPolarHBondContact O-CD1 2.74Å; S314-L337 PolarHBondContact N-O 2.88Å
315	N	98	Very high	96.5	Very high	44 Å²	44	52 Å²	52	24%	0.235	25%	0.254	C	S	.	.	S	Bend	trans	-96.9	1.6	165.3	-71.3	-38.4	0	0	0	113.3	N216 M338 Y339	N216-N315 WeakPolarHBondContact OD1-CB 3.31Å; N216-N315 PolarHBondContact OD1-N 2.85Å; N216-N315 VanDerWaalsContact OD1-N 3.13Å; N315-M338 HydrophobicContact CB-CE 4.21Å; N315-M338 VanDerWaalsContact OD1-CA 3.31Å; N315-M338 WeakPolarHBondContact OD1-CA 3.25Å; N315-M338 VanDerWaalsContact OD1-CB 3.3Å; N315-M338 WeakPolarHBondContact OD1-CB 3.38Å; N315-Y339 VanDerWaalsContact ND2-CE2 3.31Å; N315-Y339 WeakPolarHBondContact ND2-CE2 3.5Å; N315-Y339 PolarHBondContact ND2-O 2.79Å; N315-Y339 PolarHBondContact OD1-N 2.86Å; N315-Y339 PolarHBondContact OD1-O 3.18Å
316	D	97	Very high	96.3	Very high	68 Å²	68	57 Å²	57	36%	0.364	29%	0.287	S	S	.	.			trans	-81.1	154.5	166.6	-148.7	-62.4	0	0	0	111.3	N216 S314 Y318 L336	N216-D316 PolarHBondContact ND2-N 3.02Å; S314-D316 PolarHBondContact OG-N 3.3Å; S314-D316 VanDerWaalsContact OG-N 3.15Å; D316-Y318 HydrophobicContact CB-CD1 4.34Å; D316-Y318 HydrophobicContact CB-CE1 4.11Å; D316-Y318 PolarHBondContact OD1-N 2.79Å; D316-L336 VanDerWaalsContact O-CD2 3.29Å; D316-L336 WeakPolarHBondContact O-CD2 3.37Å
317	N	96	Very high	96.3	Very high	67 Å²	67	56.3 Å²	56.3	36%	0.358	29%	0.287	S	S	.	.			trans	-102.9	-3	175.3	-54.6	123.4	0	0	0	113.1	R319 Q322	N317-R319 VanDerWaalsContact C-N 3.34Å; N317-R319 HydrophobicContact CB-CG 4.09Å; N317-R319 PolarHBondContact O-N 2.98Å; N317-Q322 PolarHBondContact O-NE2 3.48Å
318	Y	96.6	Very high	96.2	Very high	2 Å²	2	52.7 Å²	52.7	1%	0.008	27%	0.265	C	S	.	.			trans	52.3	47.5	177.6	-49.8	-69.1	0	0	0	113.1	D213 D298 I312 S314 D316 D320 L321 Q322 I332 L336	D213-Y318 WeakPolarHBondContact CB-OH 3.31Å; D213-Y318 PolarHBondContact OD2-OH 3.5Å; D298-Y318 HydrophobicContact CB-CD1 3.71Å; D298-Y318 HydrophobicContact CB-CE1 3.89Å; D298-Y318 WeakPolarHBondContact OD1-CE1 3.3Å; I312-Y318 HydrophobicContact CG2-CE2 3.84Å; S314-Y318 WeakPolarHBondContact CB-OH 3.43Å; S314-Y318 PolarHBondContact OG-OH 3.11Å; S314-Y318 VanDerWaalsContact OG-OH 3.13Å; D316-Y318 HydrophobicContact CB-CD1 4.34Å; D316-Y318 HydrophobicContact CB-CE1 4.11Å; D316-Y318 PolarHBondContact OD1-N 2.79Å; Y318-D320 PolarHBondContact O-N 3Å; Y318-L321 PolarHBondContact O-N 3.14Å; Y318-Q322 WeakPolarHBondContact O-CG 3.39Å; Y318-Q322 PolarHBondContact O-N 3.02Å; Y318-I332 HydrophobicContact CD2-CD1 4.48Å; Y318-L336 HydrophobicContact CE2-CD1 4.3Å
319	R	96.1	Very high	96.2	Very high	175 Å²	175	54.6 Å²	54.6	66%	0.66	27%	0.268	S	S	*	.	H	α-helix	trans	-62.5	-25.2	-168.4	-68.6	178.4	-69.6	-162.3	-4.1	114.1	N317 N323	N317-R319 VanDerWaalsContact C-N 3.34Å; N317-R319 HydrophobicContact CB-CG 4.09Å; N317-R319 PolarHBondContact O-N 2.98Å; R319-N323 PolarHBondContact O-ND2 3.24Å
320	D	94.4	Very high	96.3	Very high	70 Å²	70	57 Å²	57	37%	0.374	28%	0.275	S	S	.	.	H	α-helix	trans	-68.1	-50.3	170.1	64.5	-41.7	0	0	0	110.9	R299 Y318 Q322 N323 E324	R299-D320 IonicContact NH1-OD2 3.14Å; Y318-D320 PolarHBondContact O-N 3Å; D320-Q322 VanDerWaalsContact C-N 3.3Å; D320-Q322 PolarHBondContact O-N 2.75Å; D320-N323 WeakPolarHBondContact O-CB 3.15Å; D320-N323 PolarHBondContact O-N 3.26Å; D320-E324 PolarHBondContact O-N 3.4Å
321	L	95.3	Very high	96.3	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-65.2	-32.1	179.8	-53.1	-172.2	0	0	0	112.6	D298 R299 L302 Y318 N323 E324 W328	D298-L321 HydrophobicContact CB-CD1 3.73Å; R299-L321 HydrophobicContact CG-CD1 4.2Å; R299-L321 HydrophobicContact CG-CD2 3.71Å; L302-L321 HydrophobicContact CB-CD1 4.13Å; L302-L321 HydrophobicContact CD2-CB 3.6Å; L302-L321 HydrophobicContact CD2-CD1 3.54Å; L302-L321 HydrophobicContact CD2-CG 4.19Å; Y318-L321 PolarHBondContact O-N 3.14Å; L321-N323 VanDerWaalsContact C-N 3.25Å; L321-N323 PolarHBondContact O-N 3Å; L321-E324 PolarHBondContact O-N 3.29Å; L321-W328 HydrophobicContact CB-CE3 4.18Å; L321-W328 HydrophobicContact CD2-CZ3 4.4Å
322	Q	95.1	Very high	96.3	Very high	35 Å²	35	58 Å²	58	16%	0.164	28%	0.28	C	S	.	.	H	α-helix	trans	-59.7	-35.2	170.5	-66	-165.2	22.2	0	0	112.6	N317 Y318 D320 K329 I332	N317-Q322 PolarHBondContact O-NE2 3.48Å; Y318-Q322 WeakPolarHBondContact O-CG 3.39Å; Y318-Q322 PolarHBondContact O-N 3.02Å; D320-Q322 VanDerWaalsContact C-N 3.3Å; D320-Q322 PolarHBondContact O-N 2.75Å; Q322-K329 HydrophobicContact CB-CB 3.96Å; Q322-K329 HydrophobicContact CB-CG 4.21Å; Q322-K329 HydrophobicContact CG-CB 4.29Å; Q322-K329 HydrophobicContact CG-CG 4.36Å; Q322-I332 HydrophobicContact CG-CD1 3.71Å
323	N	94	Very high	96.1	Very high	143 Å²	143	63.1 Å²	63.1	77%	0.765	30%	0.303	S	S	*	.	H	α-helix	trans	-82.4	-21.7	-179.1	-67.7	-34.8	0	0	0	112.7	R319 D320 L321	R319-N323 PolarHBondContact O-ND2 3.24Å; D320-N323 WeakPolarHBondContact O-CB 3.15Å; D320-N323 PolarHBondContact O-N 3.26Å; L321-N323 VanDerWaalsContact C-N 3.25Å; L321-N323 PolarHBondContact O-N 3Å
324	E	95	Very high	96	Very high	92 Å²	92	66.7 Å²	66.7	43%	0.43	32%	0.32	S	S	.	.	H	α-helix	trans	-70.6	-35.1	175.4	-80.6	168.6	-124.8	0	0	112.9	R299 D320 L321 W328	R299-E324 IonicContact CZ-OE1 2.71Å; R299-E324 IonicContact CZ-OE2 3.73Å; R299-E324 IonicContact NE-OE2 2.66Å; R299-E324 IonicContact NH1-OE1 2.85Å; R299-E324 IonicContact NH2-OE1 3.4Å; R299-E324 PolarHBondContact NH2-OE1 3.36Å; R299-E324 IonicContact NH2-OE2 3.84Å; R299-E324 PolarHBondContact NH2-OE2 3.49Å; D320-E324 PolarHBondContact O-N 3.4Å; L321-E324 PolarHBondContact O-N 3.29Å; E324-W328 HydrophobicContact CB-CE3 4.45Å; E324-W328 HydrophobicContact CB-CZ3 4.43Å
325	K	92.7	Very high	96	Very high	82 Å²	82	68.7 Å²	68.7	36%	0.357	33%	0.327	S	S	.	.			trans	-149.9	127.8	-175	-73.5	-178.7	171.9	-163.2	0	113.4	E327 W328 K329	K325-E327 VanDerWaalsContact C-N 3.3Å; K325-E327 HydrophobicContact CB-CG 4.31Å; K325-E327 HydrophobicContact CD-CG 4.49Å; K325-E327 WeakPolarHBondContact CD-OE1 3.17Å; K325-E327 IonicContact NZ-OE1 3.96Å; K325-E327 PolarHBondContact O-N 3.08Å; K325-W328 HydrophobicContact CB-CB 3.91Å; K325-W328 HydrophobicContact CB-CD2 4.03Å; K325-W328 HydrophobicContact CB-CE3 4.11Å; K325-W328 HydrophobicContact CB-CG 3.92Å; K325-W328 HydrophobicContact CD-CD2 3.65Å; K325-W328 HydrophobicContact CD-CE3 3.87Å; K325-W328 HydrophobicContact CD-CG 4.1Å; K325-W328 HydrophobicContact CD-CH2 4.31Å; K325-W328 HydrophobicContact CD-CZ2 4.11Å; K325-W328 HydrophobicContact CD-CZ3 4.19Å; K325-W328 HydrophobicContact CG-CD2 4.31Å; K325-W328 HydrophobicContact CG-CE3 4.22Å; K325-W328 WeakPolarHBondContact O-CB 3.31Å; K325-W328 PolarHBondContact O-N 3.18Å; K325-W328 VanDerWaalsContact O-N 3.11Å; K325-K329 PolarHBondContact O-N 2.96Å
326	P	94.8	Very high	96	Very high	105 Å²	105	67.3 Å²	67.3	68%	0.682	32%	0.32	S	S	*	.	H	α-helix	trans	-65.3	-31.2	176.8	28.1	-34.7	0	0	0	112.8	W328 K329 K330	P326-W328 VanDerWaalsContact C-N 3.31Å; P326-W328 PolarHBondContact O-N 2.82Å; P326-K329 PolarHBondContact O-N 3.04Å; P326-K330 PolarHBondContact O-N 3.42Å
327	E	96.2	Very high	96.1	Very high	79 Å²	79	64.1 Å²	64.1	37%	0.369	30%	0.303	S	S	.	.	H	α-helix	trans	-66.8	-31.2	174.1	65.3	-89.2	-154.2	0	0	112.9	Y306 K325 F331	Y306-E327 HydrophobicContact CE2-CB 4.26Å; Y306-E327 HydrophobicContact CE2-CG 4.25Å; K325-E327 VanDerWaalsContact C-N 3.3Å; K325-E327 HydrophobicContact CB-CG 4.31Å; K325-E327 HydrophobicContact CD-CG 4.49Å; K325-E327 WeakPolarHBondContact CD-OE1 3.17Å; K325-E327 IonicContact NZ-OE1 3.96Å; K325-E327 PolarHBondContact O-N 3.08Å; E327-F331 WeakPolarHBondContact O-CB 3.41Å; E327-F331 PolarHBondContact O-N 3.37Å; E327-F331 VanDerWaalsContact O-N 3.1Å
328	W	95.9	Very high	96.2	Very high	30 Å²	30	65.1 Å²	65.1	11%	0.114	31%	0.307	C	S	.	.	H	α-helix	trans	-76.4	-42.6	174.8	-79	-5.5	0	0	0	112	L302 Y306 L321 E324 K325 P326 K330 F331 I332	L302-W328 HydrophobicContact CD2-CB 3.98Å; L302-W328 HydrophobicContact CD2-CD2 3.59Å; L302-W328 HydrophobicContact CD2-CE3 3.74Å; L302-W328 HydrophobicContact CD2-CG 3.75Å; L302-W328 HydrophobicContact CD2-CZ3 4.4Å; L302-W328 HydrophobicContact CG-CD2 4.25Å; L302-W328 HydrophobicContact CG-CG 4.24Å; Y306-W328 AromaticContact CD2-CD1 3.84Å; L321-W328 HydrophobicContact CB-CE3 4.18Å; L321-W328 HydrophobicContact CD2-CZ3 4.4Å; E324-W328 HydrophobicContact CB-CE3 4.45Å; E324-W328 HydrophobicContact CB-CZ3 4.43Å; K325-W328 HydrophobicContact CB-CB 3.91Å; K325-W328 HydrophobicContact CB-CD2 4.03Å; K325-W328 HydrophobicContact CB-CE3 4.11Å; K325-W328 HydrophobicContact CB-CG 3.92Å; K325-W328 HydrophobicContact CD-CD2 3.65Å; K325-W328 HydrophobicContact CD-CE3 3.87Å; K325-W328 HydrophobicContact CD-CG 4.1Å; K325-W328 HydrophobicContact CD-CH2 4.31Å; K325-W328 HydrophobicContact CD-CZ2 4.11Å; K325-W328 HydrophobicContact CD-CZ3 4.19Å; K325-W328 HydrophobicContact CG-CD2 4.31Å; K325-W328 HydrophobicContact CG-CE3 4.22Å; K325-W328 WeakPolarHBondContact O-CB 3.31Å; K325-W328 PolarHBondContact O-N 3.18Å; K325-W328 VanDerWaalsContact O-N 3.11Å; P326-W328 VanDerWaalsContact C-N 3.31Å; P326-W328 PolarHBondContact O-N 2.82Å; W328-K330 PolarHBondContact O-N 3.08Å; W328-F331 PolarHBondContact O-N 2.92Å; W328-I332 WeakPolarHBondContact O-CD1 3.45Å; W328-I332 WeakPolarHBondContact O-CG1 3.33Å; W328-I332 PolarHBondContact O-N 3.36Å
329	K	96.6	Very high	96.3	Very high	86 Å²	86	65.5 Å²	65.5	37%	0.374	31%	0.308	S	S	.	.	H	α-helix	trans	-52	-54.9	171.2	175	168.6	177.5	174.4	0	111.3	Q322 K325 P326 F331 I332 E333	Q322-K329 HydrophobicContact CB-CB 3.96Å; Q322-K329 HydrophobicContact CB-CG 4.21Å; Q322-K329 HydrophobicContact CG-CB 4.29Å; Q322-K329 HydrophobicContact CG-CG 4.36Å; K325-K329 PolarHBondContact O-N 2.96Å; P326-K329 PolarHBondContact O-N 3.04Å; K329-F331 VanDerWaalsContact C-N 3.28Å; K329-F331 PolarHBondContact O-N 3.09Å; K329-I332 PolarHBondContact O-N 3.42Å; K329-E333 WeakPolarHBondContact CE-OE1 3.34Å; K329-E333 HydrophobicContact CG-CG 4.42Å; K329-E333 IonicContact NZ-OE1 2.75Å; K329-E333 WeakPolarHBondContact O-CG 3.36Å; K329-E333 PolarHBondContact O-N 2.98Å
330	K	97	Very high	96.4	Very high	120 Å²	120	60.6 Å²	60.6	52%	0.522	30%	0.3	S	S	.	.	H	α-helix	trans	-58.5	-41.4	179	-175.2	-176	174	-170.4	0	111.8	P326 W328 E333 E334	P326-K330 PolarHBondContact O-N 3.42Å; W328-K330 PolarHBondContact O-N 3.08Å; K330-E333 PolarHBondContact O-N 3.24Å; K330-E334 VanDerWaalsContact CE-CD 3.42Å; K330-E334 WeakPolarHBondContact CE-OE1 3.11Å; K330-E334 IonicContact NZ-OE1 3.64Å; K330-E334 PolarHBondContact NZ-OE1 2.9Å; K330-E334 PolarHBondContact O-N 3.33Å; K330-E334 VanDerWaalsContact O-N 3.09Å
331	F	97.6	Very high	96.5	Very high	17 Å²	17	58.8 Å²	58.8	8%	0.075	29%	0.29	C	S	.	.	H	α-helix	trans	-61.8	-47.5	178.4	-174.6	-90.5	0	0	0	111.7	L302 A305 Y306 G310 I312 E327 W328 K329 E333 E334 R335	L302-F331 HydrophobicContact CD1-CD1 3.89Å; L302-F331 HydrophobicContact CD1-CE1 4.49Å; A305-F331 HydrophobicContact CB-CE1 3.7Å; A305-F331 HydrophobicContact CB-CZ 3.89Å; A305-F331 VanDerWaalsContact O-CZ 3.24Å; A305-F331 WeakPolarHBondContact O-CZ 3.34Å; Y306-F331 HydrophobicContact CD2-CB 3.86Å; Y306-F331 HydrophobicContact CD2-CD1 4.45Å; Y306-F331 AromaticContact CD2-CD2 3.7Å; Y306-F331 HydrophobicContact CD2-CD2 3.7Å; Y306-F331 HydrophobicContact CD2-CE2 4.38Å; Y306-F331 AromaticContact CD2-CG 3.74Å; Y306-F331 HydrophobicContact CD2-CG 3.74Å; Y306-F331 HydrophobicContact CE2-CB 4.31Å; Y306-F331 HydrophobicContact CE2-CD2 4.38Å; Y306-F331 HydrophobicContact CG-CD2 4.49Å; G310-F331 WeakPolarHBondContact O-CZ 3.25Å; I312-F331 HydrophobicContact CD1-CD1 4.18Å; I312-F331 HydrophobicContact CD1-CE1 3.89Å; I312-F331 HydrophobicContact CG1-CE1 4.16Å; E327-F331 WeakPolarHBondContact O-CB 3.41Å; E327-F331 PolarHBondContact O-N 3.37Å; E327-F331 VanDerWaalsContact O-N 3.1Å; W328-F331 PolarHBondContact O-N 2.92Å; K329-F331 VanDerWaalsContact C-N 3.28Å; K329-F331 PolarHBondContact O-N 3.09Å; F331-E333 PolarHBondContact O-N 3.46Å; F331-E334 CarbonylContact O-C 3.58Å; F331-E334 PolarHBondContact O-N 3.23Å; F331-E334 VanDerWaalsContact O-N 3.16Å; F331-R335 HydrophobicContact CD1-CB 4.13Å; F331-R335 HydrophobicContact CD1-CG 4.31Å; F331-R335 HydrophobicContact CD2-CG 3.93Å; F331-R335 HydrophobicContact CE1-CB 3.79Å; F331-R335 HydrophobicContact CE1-CG 4.05Å; F331-R335 HydrophobicContact CE2-CB 4.33Å; F331-R335 HydrophobicContact CE2-CG 3.66Å; F331-R335 HydrophobicContact CG-CG 4.25Å; F331-R335 HydrophobicContact CZ-CB 3.89Å; F331-R335 HydrophobicContact CZ-CG 3.71Å; F331-R335 WeakPolarHBondContact O-CB 3.33Å; F331-R335 WeakPolarHBondContact O-CG 3.41Å; F331-R335 PolarHBondContact O-N 3.38Å
332	I	97.4	Very high	96.5	Very high	4 Å²	4	62.9 Å²	62.9	2%	0.021	31%	0.314	C	S	.	.	H	α-helix	trans	-60.5	-45.6	177.4	-65.4	157.5	0	0	0	110.5	L302 I312 Y318 Q322 W328 K329 E334 R335 L336	L302-I332 HydrophobicContact CD1-CD1 3.96Å; L302-I332 HydrophobicContact CD1-CG1 3.66Å; L302-I332 HydrophobicContact CD2-CD1 4.01Å; I312-I332 HydrophobicContact CD1-CG1 4.49Å; Y318-I332 HydrophobicContact CD2-CD1 4.48Å; Q322-I332 HydrophobicContact CG-CD1 3.71Å; W328-I332 WeakPolarHBondContact O-CD1 3.45Å; W328-I332 WeakPolarHBondContact O-CG1 3.33Å; W328-I332 PolarHBondContact O-N 3.36Å; K329-I332 PolarHBondContact O-N 3.42Å; I332-E334 PolarHBondContact O-N 2.81Å; I332-R335 PolarHBondContact O-N 3.16Å; I332-L336 HydrophobicContact CG2-CB 4.3Å; I332-L336 HydrophobicContact CG2-CD2 4.33Å; I332-L336 VanDerWaalsContact O-CB 3.25Å; I332-L336 WeakPolarHBondContact O-CB 3.36Å; I332-L336 PolarHBondContact O-N 3.24Å; I332-L336 VanDerWaalsContact O-N 3.08Å
333	E	96	Very high	96.5	Very high	106 Å²	106	68 Å²	68	50%	0.495	34%	0.342	S	S	.	.	H	α-helix	trans	-60.3	-26.2	176.9	-71	174.1	154.2	0	0	113.7	K329 K330 F331 L353	K329-E333 WeakPolarHBondContact CE-OE1 3.34Å; K329-E333 HydrophobicContact CG-CG 4.42Å; K329-E333 IonicContact NZ-OE1 2.75Å; K329-E333 WeakPolarHBondContact O-CG 3.36Å; K329-E333 PolarHBondContact O-N 2.98Å; K330-E333 PolarHBondContact O-N 3.24Å; F331-E333 PolarHBondContact O-N 3.46Å; E333-L353 WeakPolarHBondContact O-CD2 3.44Å
334	E	96.5	Very high	96.6	Very high	75 Å²	75	64.7 Å²	64.7	35%	0.35	33%	0.325	S	S	.	.	H	α-helix	trans	-107.7	-3.5	-179.8	-65.6	-172.2	179.1	0	0	115.2	K330 F331 I332	K330-E334 VanDerWaalsContact CE-CD 3.42Å; K330-E334 WeakPolarHBondContact CE-OE1 3.11Å; K330-E334 IonicContact NZ-OE1 3.64Å; K330-E334 PolarHBondContact NZ-OE1 2.9Å; K330-E334 PolarHBondContact O-N 3.33Å; K330-E334 VanDerWaalsContact O-N 3.09Å; F331-E334 CarbonylContact O-C 3.58Å; F331-E334 PolarHBondContact O-N 3.23Å; F331-E334 VanDerWaalsContact O-N 3.16Å; I332-E334 PolarHBondContact O-N 2.81Å
335	R	97.7	Very high	96.6	Very high	42 Å²	42	66.4 Å²	66.4	16%	0.158	33%	0.331	C	S	.	.	H	α-helix	trans	-141.1	-0.5	-169.8	-60	-71.4	-173.2	-72.7	-10.6	115.8	D309 G310 I311 I312 F331 I332	D309-R335 IonicContact OD1-CZ 2.76Å; D309-R335 IonicContact OD1-NE 3.54Å; D309-R335 PolarHBondContact OD1-NE 3.13Å; D309-R335 IonicContact OD1-NH2 2.69Å; D309-R335 PolarHBondContact OD1-NH2 2.92Å; D309-R335 IonicContact OD2-NH2 3.05Å; G310-R335 WeakPolarHBondContact O-CD 3.49Å; I311-R335 HydrophobicContact CD1-CB 4.41Å; I312-R335 PolarHBondContact N-O 3.24Å; F331-R335 HydrophobicContact CD1-CB 4.13Å; F331-R335 HydrophobicContact CD1-CG 4.31Å; F331-R335 HydrophobicContact CD2-CG 3.93Å; F331-R335 HydrophobicContact CE1-CB 3.79Å; F331-R335 HydrophobicContact CE1-CG 4.05Å; F331-R335 HydrophobicContact CE2-CB 4.33Å; F331-R335 HydrophobicContact CE2-CG 3.66Å; F331-R335 HydrophobicContact CG-CG 4.25Å; F331-R335 HydrophobicContact CZ-CB 3.89Å; F331-R335 HydrophobicContact CZ-CG 3.71Å; F331-R335 WeakPolarHBondContact O-CB 3.33Å; F331-R335 WeakPolarHBondContact O-CG 3.41Å; F331-R335 PolarHBondContact O-N 3.38Å; I332-R335 PolarHBondContact O-N 3.16Å
336	L	98.3	Very high	96.9	Very high	16 Å²	16	63 Å²	63	8%	0.084	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	127.4	173.2	-175.9	65.8	0	0	0	111.2	I312 S314 D316 Y318 I332 M338	I312-L336 HydrophobicContact CB-CD1 4.33Å; I312-L336 HydrophobicContact CG2-CD1 4.1Å; S314-L336 WeakPolarHBondContact O-CD1 2.74Å; D316-L336 VanDerWaalsContact O-CD2 3.29Å; D316-L336 WeakPolarHBondContact O-CD2 3.37Å; Y318-L336 HydrophobicContact CE2-CD1 4.3Å; I332-L336 HydrophobicContact CG2-CB 4.3Å; I332-L336 HydrophobicContact CG2-CD2 4.33Å; I332-L336 VanDerWaalsContact O-CB 3.25Å; I332-L336 WeakPolarHBondContact O-CB 3.36Å; I332-L336 PolarHBondContact O-N 3.24Å; I332-L336 VanDerWaalsContact O-N 3.08Å; L336-M338 HydrophobicContact CD2-CG 4.31Å; L336-M338 HydrophobicContact CG-CG 4.38Å
337	L	98.5	Very high	97	Very high	0 Å²	0	61.6 Å²	61.6	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	101	171.5	-175.5	55.2	0	0	0	110	F239 I311 I312 V313 S314 P348 P349 P352 L360 F363 L364	F239-L337 HydrophobicContact CE1-CD2 4.14Å; F239-L337 HydrophobicContact CZ-CD2 3.94Å; I311-L337 HydrophobicContact CG2-CB 3.7Å; I311-L337 HydrophobicContact CG2-CD2 4.27Å; I312-L337 PolarHBondContact O-N 3.37Å; V313-L337 HydrophobicContact CG2-CB 4.44Å; V313-L337 HydrophobicContact CG2-CD2 4.42Å; S314-L337 PolarHBondContact N-O 2.88Å; L337-P348 HydrophobicContact CD1-CB 4.09Å; L337-P348 HydrophobicContact CD2-CB 4.36Å; L337-P348 HydrophobicContact CG-CB 4.31Å; L337-P349 HydrophobicContact CD1-CG 4.49Å; L337-P352 HydrophobicContact CD1-CB 3.89Å; L337-P352 HydrophobicContact CD1-CG 3.72Å; L337-L360 HydrophobicContact CD1-CD1 3.81Å; L337-L360 HydrophobicContact CD2-CD1 4.03Å; L337-F363 HydrophobicContact CB-CE1 4.01Å; L337-F363 HydrophobicContact CD1-CE1 4.37Å; L337-L364 HydrophobicContact CD2-CD2 4.11Å
338	M	98.2	Very high	97.1	Very high	89 Å²	89	58.7 Å²	58.7	44%	0.438	29%	0.289	S	S	.	.			trans	-71.4	164	169.7	-62.7	-170.4	75.8	0	0	111.2	N315 L336 P349	N315-M338 HydrophobicContact CB-CE 4.21Å; N315-M338 VanDerWaalsContact OD1-CA 3.31Å; N315-M338 WeakPolarHBondContact OD1-CA 3.25Å; N315-M338 VanDerWaalsContact OD1-CB 3.3Å; N315-M338 WeakPolarHBondContact OD1-CB 3.38Å; L336-M338 HydrophobicContact CD2-CG 4.31Å; L336-M338 HydrophobicContact CG-CG 4.38Å; M338-P349 WeakPolarHBondContact O-CD 3.29Å
339	Y	98.4	Very high	97.2	Very high	9 Å²	9	59.4 Å²	59.4	4%	0.035	30%	0.298	C	S	.	.			trans	-154.7	161.8	179.2	57.2	-93.5	0	0	0	112	N216 V217 V313 N315 F341 F346	N216-Y339 PolarHBondContact O-OH 3.13Å; N216-Y339 PolarHBondContact OD1-OH 3.37Å; V217-Y339 VanDerWaalsContact CA-OH 3.25Å; V217-Y339 WeakPolarHBondContact CA-OH 3.46Å; V217-Y339 HydrophobicContact CG2-CE1 3.82Å; V217-Y339 HydrophobicContact CG2-CE2 4.43Å; V217-Y339 WeakPolarHBondContact CG2-OH 3.31Å; V217-Y339 PolarHBondContact N-OH 3.08Å; V313-Y339 HydrophobicContact CG1-CD1 3.81Å; V313-Y339 HydrophobicContact CG1-CE1 4.03Å; N315-Y339 VanDerWaalsContact ND2-CE2 3.31Å; N315-Y339 WeakPolarHBondContact ND2-CE2 3.5Å; N315-Y339 PolarHBondContact ND2-O 2.79Å; N315-Y339 PolarHBondContact OD1-N 2.86Å; N315-Y339 PolarHBondContact OD1-O 3.18Å; Y339-F341 HydrophobicContact CD2-CD2 4.04Å; Y339-F341 HydrophobicContact CD2-CE2 4.05Å; Y339-F341 AromaticContact CE2-CD2 3.92Å; Y339-F341 HydrophobicContact CE2-CD2 3.92Å; Y339-F341 AromaticContact CE2-CE2 3.79Å; Y339-F341 HydrophobicContact CE2-CE2 3.79Å; Y339-F346 AromaticContact CD1-CE2 3.77Å; Y339-F346 HydrophobicContact CD1-CE2 3.77Å; Y339-F346 HydrophobicContact CD1-CZ 4.12Å; Y339-F346 HydrophobicContact CD2-CD2 4.17Å; Y339-F346 AromaticContact CD2-CE2 3.69Å; Y339-F346 HydrophobicContact CD2-CE2 3.69Å; Y339-F346 HydrophobicContact CE1-CE2 4.46Å; Y339-F346 HydrophobicContact CE2-CE2 4.43Å; Y339-F346 HydrophobicContact CG-CD2 4.19Å; Y339-F346 AromaticContact CG-CE2 3.35Å; Y339-F346 HydrophobicContact CG-CE2 3.35Å; Y339-F346 AromaticContact CG-CZ 3.95Å; Y339-F346 HydrophobicContact CG-CZ 3.95Å
340	S	97.9	Very high	97.1	Very high	72 Å²	72	61.6 Å²	61.6	50%	0.503	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	153.2	162.7	-60.7	0	0	0	0	110.4	M347	S340-M347 PolarHBondContact N-O 3.15Å; S340-M347 PolarHBondContact O-N 2.79Å
341	F	97.7	Very high	97	Very high	33 Å²	33	59.7 Å²	59.7	15%	0.145	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	138	160.2	-83.9	-76.7	0	0	0	109.2	V217 H221 L234 Y339 K345 F346	V217-F341 HydrophobicContact CG1-CE2 4.03Å; V217-F341 HydrophobicContact CG1-CZ 4.01Å; H221-F341 HydrophobicContact CB-CD2 4.16Å; H221-F341 HydrophobicContact CB-CE2 4.09Å; H221-F341 HydrophobicContact CB-CG 4.44Å; H221-F341 HydrophobicContact CB-CZ 4.3Å; H221-F341 AromaticContact CD2-CD1 3.58Å; H221-F341 AromaticContact CD2-CE1 3.74Å; H221-F341 AromaticContact CD2-CG 3.98Å; L234-F341 HydrophobicContact CB-CE1 4.35Å; Y339-F341 HydrophobicContact CD2-CD2 4.04Å; Y339-F341 HydrophobicContact CD2-CE2 4.05Å; Y339-F341 AromaticContact CE2-CD2 3.92Å; Y339-F341 HydrophobicContact CE2-CD2 3.92Å; Y339-F341 AromaticContact CE2-CE2 3.79Å; Y339-F341 HydrophobicContact CE2-CE2 3.79Å; F341-K345 WeakPolarHBondContact CA-O 3.27Å; F341-F346 HydrophobicContact CD1-CB 4.35Å; F341-F346 HydrophobicContact CE1-CB 3.84Å; F341-F346 AromaticContact CE1-CD2 3.86Å; F341-F346 HydrophobicContact CE1-CD2 3.86Å; F341-F346 HydrophobicContact CE1-CG 4.36Å; F341-F346 HydrophobicContact CE2-CD2 4.04Å; F341-F346 HydrophobicContact CZ-CB 4.41Å; F341-F346 AromaticContact CZ-CD2 3.6Å; F341-F346 HydrophobicContact CZ-CD2 3.6Å; F341-F346 HydrophobicContact CZ-CE2 4.39Å; F341-F346 HydrophobicContact CZ-CG 4.46Å
342	V	95.9	Very high	96.9	Very high	86 Å²	86	60.1 Å²	60.1	52%	0.521	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	87.9	168.7	-177.1	0	0	0	0	106.3	K345 M347	V342-K345 PolarHBondContact N-O 2.83Å; V342-K345 WeakPolarHBondContact O-CB 3.46Å; V342-K345 PolarHBondContact O-N 2.91Å; V342-K345 VanDerWaalsContact O-N 3.13Å; V342-M347 HydrophobicContact CB-SD 4.39Å; V342-M347 HydrophobicContact CG2-SD 3.91Å
343	N	93.4	Very high	96.7	Very high	141 Å²	141	63.3 Å²	63.3	75%	0.754	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.9	-141.6	-160.6	-48.1	-29	0	0	0	109.7	K345	N343-K345 PolarHBondContact O-N 3.37Å
344	D	96.1	Very high	96.6	Very high	75 Å²	75	59.7 Å²	59.7	40%	0.401	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-7.7	174.1	-77.4	57.1	0	0	0	115	R230 L234 F346	R230-D344 IonicContact CZ-OD2 3.59Å; R230-D344 IonicContact NE-OD2 3.54Å; R230-D344 PolarHBondContact NE-OD2 3Å; R230-D344 IonicContact NH2-OD2 2.68Å; R230-D344 PolarHBondContact NH2-OD2 3.18Å; L234-D344 HydrophobicContact CD1-CB 3.81Å; L234-D344 WeakPolarHBondContact CD1-O 3.3Å; L234-D344 HydrophobicContact CD2-CB 4.24Å; L234-D344 WeakPolarHBondContact CD2-O 3.31Å; D344-F346 PolarHBondContact O-N 3.42Å
345	K	96.8	Very high	96.2	Very high	128 Å²	128	66.8 Å²	66.8	56%	0.557	35%	0.345	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.6	105	-179	-164.4	-176.1	174.3	-168	0	112	F341 V342 N343 M347	F341-K345 WeakPolarHBondContact CA-O 3.27Å; V342-K345 PolarHBondContact N-O 2.83Å; V342-K345 WeakPolarHBondContact O-CB 3.46Å; V342-K345 PolarHBondContact O-N 2.91Å; V342-K345 VanDerWaalsContact O-N 3.13Å; N343-K345 PolarHBondContact O-N 3.37Å; K345-M347 HydrophobicContact CD-CG 3.96Å; K345-M347 HydrophobicContact CD-SD 3.7Å; K345-M347 HydrophobicContact CG-CG 3.9Å; K345-M347 HydrophobicContact CG-SD 4.24Å
346	F	98.3	Very high	95.8	Very high	10 Å²	10	73.6 Å²	73.6	4%	0.044	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	128.2	166	-174.1	-110.9	0	0	0	110.9	A235 W238 F239 V313 Y339 F341 D344 P348	A235-F346 HydrophobicContact CB-CD2 4.02Å; A235-F346 HydrophobicContact CB-CE1 4.48Å; A235-F346 HydrophobicContact CB-CE2 3.91Å; A235-F346 HydrophobicContact CB-CG 4.35Å; A235-F346 HydrophobicContact CB-CZ 4.16Å; W238-F346 HydrophobicContact CB-CD1 3.83Å; W238-F346 HydrophobicContact CB-CE1 4.48Å; W238-F346 AromaticContact CD1-CD1 4Å; W238-F346 HydrophobicContact CD2-CD1 4.07Å; W238-F346 HydrophobicContact CD2-CE1 4.27Å; W238-F346 HydrophobicContact CE3-CE1 4.38Å; W238-F346 AromaticContact CG-CD1 3.69Å; W238-F346 HydrophobicContact CG-CD1 3.69Å; W238-F346 HydrophobicContact CG-CE1 4.31Å; F239-F346 AromaticContact CE2-CE1 3.94Å; F239-F346 HydrophobicContact CE2-CE1 3.94Å; F239-F346 HydrophobicContact CE2-CZ 4.16Å; F239-F346 HydrophobicContact CZ-CE1 4.16Å; F239-F346 HydrophobicContact CZ-CZ 4.45Å; V313-F346 HydrophobicContact CG1-CZ 3.93Å; Y339-F346 AromaticContact CD1-CE2 3.77Å; Y339-F346 HydrophobicContact CD1-CE2 3.77Å; Y339-F346 HydrophobicContact CD1-CZ 4.12Å; Y339-F346 HydrophobicContact CD2-CD2 4.17Å; Y339-F346 AromaticContact CD2-CE2 3.69Å; Y339-F346 HydrophobicContact CD2-CE2 3.69Å; Y339-F346 HydrophobicContact CE1-CE2 4.46Å; Y339-F346 HydrophobicContact CE2-CE2 4.43Å; Y339-F346 HydrophobicContact CG-CD2 4.19Å; Y339-F346 AromaticContact CG-CE2 3.35Å; Y339-F346 HydrophobicContact CG-CE2 3.35Å; Y339-F346 AromaticContact CG-CZ 3.95Å; Y339-F346 HydrophobicContact CG-CZ 3.95Å; F341-F346 HydrophobicContact CD1-CB 4.35Å; F341-F346 HydrophobicContact CE1-CB 3.84Å; F341-F346 AromaticContact CE1-CD2 3.86Å; F341-F346 HydrophobicContact CE1-CD2 3.86Å; F341-F346 HydrophobicContact CE1-CG 4.36Å; F341-F346 HydrophobicContact CE2-CD2 4.04Å; F341-F346 HydrophobicContact CZ-CB 4.41Å; F341-F346 AromaticContact CZ-CD2 3.6Å; F341-F346 HydrophobicContact CZ-CD2 3.6Å; F341-F346 HydrophobicContact CZ-CE2 4.39Å; F341-F346 HydrophobicContact CZ-CG 4.46Å; D344-F346 PolarHBondContact O-N 3.42Å; F346-P348 HydrophobicContact CD1-CG 4.44Å; F346-P348 HydrophobicContact CE1-CB 4.49Å; F346-P348 HydrophobicContact CE1-CG 4.07Å
347	M	97.6	Very high	95.5	Very high	76 Å²	76	74.4 Å²	74.4	37%	0.374	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	87.5	-175.5	-69.5	-171.4	52.3	0	0	111.7	S340 V342 K345	S340-M347 PolarHBondContact N-O 3.15Å; S340-M347 PolarHBondContact O-N 2.79Å; V342-M347 HydrophobicContact CB-SD 4.39Å; V342-M347 HydrophobicContact CG2-SD 3.91Å; K345-M347 HydrophobicContact CD-CG 3.96Å; K345-M347 HydrophobicContact CD-SD 3.7Å; K345-M347 HydrophobicContact CG-CG 3.9Å; K345-M347 HydrophobicContact CG-SD 4.24Å
348	P	97.8	Very high	95.3	Very high	17 Å²	17	76.8 Å²	76.8	11%	0.11	41%	0.406	C	S	.	.			trans	-69.9	154.4	164	30.5	-33.2	0	0	0	111	W238 L337 F346 L360	W238-P348 HydrophobicContact CD2-CG 4.4Å; W238-P348 HydrophobicContact CH2-CG 3.76Å; W238-P348 HydrophobicContact CZ2-CG 3.48Å; W238-P348 VanDerWaalsContact CZ2-CG 3.48Å; W238-P348 HydrophobicContact CZ3-CG 4.29Å; L337-P348 HydrophobicContact CD1-CB 4.09Å; L337-P348 HydrophobicContact CD2-CB 4.36Å; L337-P348 HydrophobicContact CG-CB 4.31Å; F346-P348 HydrophobicContact CD1-CG 4.44Å; F346-P348 HydrophobicContact CE1-CB 4.49Å; F346-P348 HydrophobicContact CE1-CG 4.07Å; P348-L360 HydrophobicContact CB-CD2 4.37Å; P348-L360 HydrophobicContact CG-CD2 4.05Å
349	P	96.8	Very high	95.1	Very high	45 Å²	45	75.3 Å²	75.3	29%	0.292	40%	0.404	S	S	.	.			trans	-75.9	145	177	32.1	-35.3	0	0	0	112.1	L337 M338 D351	L337-P349 HydrophobicContact CD1-CG 4.49Å; M338-P349 WeakPolarHBondContact O-CD 3.29Å; P349-D351 PolarHBondContact O-N 3.43Å
350	D	94.9	Very high	95	Very high	133 Å²	133	75.6 Å²	75.6	71%	0.711	41%	0.406	S	S	*	.	S	Bend	trans	-69.2	-19.1	175.1	-74.7	-49.7	0	0	0	113.3	S359 L360	D350-S359 CarbonylContact O-C 3.6Å; D350-S359 WeakPolarHBondContact O-CA 3.34Å; D350-L360 PolarHBondContact O-N 2.76Å
351	D	94.5	Very high	94.8	Very high	80 Å²	80	77.6 Å²	77.6	43%	0.428	41%	0.408	S	S	.	.			trans	-123	76	175	64.1	-37.8	0	0	0	112.5	P349 L353 G354 R355	P349-D351 PolarHBondContact O-N 3.43Å; D351-L353 VanDerWaalsContact C-N 3.26Å; D351-L353 PolarHBondContact O-N 3.24Å; D351-L353 VanDerWaalsContact O-N 3.1Å; D351-G354 WeakPolarHBondContact O-CA 3.46Å; D351-G354 PolarHBondContact O-N 2.87Å; D351-G354 VanDerWaalsContact OD2-C 3.25Å; D351-G354 WeakPolarHBondContact OD2-CA 3.02Å; D351-R355 PolarHBondContact OD2-N 2.93Å
352	P	95.4	Very high	94.6	Very high	25 Å²	25	77.3 Å²	77.3	16%	0.162	41%	0.408	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57	-30.8	-173	-28.7	37	0	0	0	116	L337 L360 F363	L337-P352 HydrophobicContact CD1-CB 3.89Å; L337-P352 HydrophobicContact CD1-CG 3.72Å; P352-L360 HydrophobicContact CG-CB 4.26Å; P352-L360 HydrophobicContact CG-CD1 3.81Å; P352-F363 HydrophobicContact CB-CD1 4.17Å; P352-F363 HydrophobicContact CB-CD2 4.1Å; P352-F363 HydrophobicContact CB-CE1 4.18Å; P352-F363 HydrophobicContact CB-CE2 4.1Å; P352-F363 HydrophobicContact CB-CG 4.12Å; P352-F363 HydrophobicContact CB-CZ 4.13Å; P352-F363 HydrophobicContact CG-CB 4.26Å; P352-F363 HydrophobicContact CG-CD1 4.03Å; P352-F363 HydrophobicContact CG-CD2 4.43Å; P352-F363 HydrophobicContact CG-CE1 4.46Å; P352-F363 HydrophobicContact CG-CG 4Å
353	L	94.6	Very high	94.6	Very high	72 Å²	72	73.6 Å²	73.6	38%	0.377	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.2	26.8	175.3	-52.3	-179.5	0	0	0	111.6	E333 D351 F363	E333-L353 WeakPolarHBondContact O-CD2 3.44Å; D351-L353 VanDerWaalsContact C-N 3.26Å; D351-L353 PolarHBondContact O-N 3.24Å; D351-L353 VanDerWaalsContact O-N 3.1Å; L353-F363 HydrophobicContact CD1-CD2 4.37Å; L353-F363 HydrophobicContact CD1-CE2 4.08Å; L353-F363 HydrophobicContact CD2-CE2 4.11Å; L353-F363 HydrophobicContact CG-CD2 4.3Å; L353-F363 HydrophobicContact CG-CE2 3.92Å
354	G	92.4	Very high	94.7	Very high	29 Å²	29	67.3 Å²	67.3	30%	0.299	35%	0.351	S	S	.	.			trans	67.7	-175.8	-177.2	0	0	0	0	0	114.6	D351 H356 G357	D351-G354 WeakPolarHBondContact O-CA 3.46Å; D351-G354 PolarHBondContact O-N 2.87Å; D351-G354 VanDerWaalsContact OD2-C 3.25Å; D351-G354 WeakPolarHBondContact OD2-CA 3.02Å; G354-H356 PolarHBondContact O-N 3.25Å; G354-G357 PolarHBondContact O-N 3.33Å
355	R	89.9	Confident	94.7	Very high	224 Å²	224	65.5 Å²	65.5	85%	0.845	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.5	-25.3	-175.3	-172.9	177.9	-176.5	-169.3	3.3	117	D351	D351-R355 PolarHBondContact OD2-N 2.93Å
356	H	89.1	Confident	94.5	Very high	185 Å²	185	64.3 Å²	64.3	86%	0.856	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.4	-5.2	-179.7	-68	-71.5	0	0	0	113.9	G354	G354-H356 PolarHBondContact O-N 3.25Å
357	G	91.1	Very high	94	Very high	33 Å²	33	71 Å²	71	34%	0.34	36%	0.358	S	S	.	.	S	Bend	trans	-83.1	-175.8	176.3	0	0	0	0	0	114.5	G354	G354-G357 PolarHBondContact O-N 3.33Å
358	P	93.7	Very high	93.2	Very high	51 Å²	51	71.4 Å²	71.4	33%	0.331	37%	0.367	S	S	.	.			trans	-70.1	155.9	168.3	32.2	-35.5	0	0	0	111.3	N362 F363	P358-N362 HydrophobicContact CB-CB 4.3Å; P358-F363 HydrophobicContact CB-CB 4.47Å; P358-F363 HydrophobicContact CG-CB 3.99Å; P358-F363 HydrophobicContact CG-CD2 3.92Å; P358-F363 HydrophobicContact CG-CG 4.46Å
359	S	94.6	Very high	92.3	Very high	58 Å²	58	74.2 Å²	74.2	41%	0.406	38%	0.383	S	S	.	.			trans	-66.7	151	163.4	51.3	0	0	0	0	110.9	D350 E361 N362 F363	D350-S359 CarbonylContact O-C 3.6Å; D350-S359 WeakPolarHBondContact O-CA 3.34Å; S359-E361 VanDerWaalsContact C-N 3.26Å; S359-E361 PolarHBondContact O-N 3.07Å; S359-E361 VanDerWaalsContact O-N 3.14Å; S359-N362 CarbonylContact O-C 3.59Å; S359-N362 WeakPolarHBondContact O-CA 3.48Å; S359-N362 PolarHBondContact O-N 2.83Å; S359-F363 PolarHBondContact O-N 2.91Å
360	L	95.6	Very high	90.8	Very high	14 Å²	14	77.7 Å²	77.7	7%	0.073	40%	0.403	C	S	.	.	H	α-helix	trans	-45.7	-45.5	179.4	178.6	61	0	0	0	113.5	W238 L337 P348 D350 P352 N362 F363 L364	W238-L360 HydrophobicContact CH2-CD2 3.85Å; W238-L360 HydrophobicContact CH2-CG 4.45Å; W238-L360 HydrophobicContact CZ2-CD2 4.13Å; L337-L360 HydrophobicContact CD1-CD1 3.81Å; L337-L360 HydrophobicContact CD2-CD1 4.03Å; P348-L360 HydrophobicContact CB-CD2 4.37Å; P348-L360 HydrophobicContact CG-CD2 4.05Å; D350-L360 PolarHBondContact O-N 2.76Å; P352-L360 HydrophobicContact CG-CB 4.26Å; P352-L360 HydrophobicContact CG-CD1 3.81Å; L360-N362 VanDerWaalsContact C-N 3.3Å; L360-N362 PolarHBondContact O-N 2.69Å; L360-F363 WeakPolarHBondContact O-CB 3.32Å; L360-F363 PolarHBondContact O-N 3.4Å; L360-L364 HydrophobicContact CD1-CD1 3.87Å; L360-L364 HydrophobicContact CD1-CG 4.11Å; L360-L364 HydrophobicContact CG-CD1 4Å; L360-L364 WeakPolarHBondContact O-CB 2.81Å; L360-L364 VanDerWaalsContact O-CG 3.27Å; L360-L364 WeakPolarHBondContact O-CG 3.46Å; L360-L364 PolarHBondContact O-N 3.13Å
361	E	93.9	Very high	89.3	Confident	115 Å²	115	74.1 Å²	74.1	54%	0.537	39%	0.387	S	S	.	.	H	α-helix	trans	-61.9	-33	177.9	-162.4	-165.1	164.7	0	0	113.8	S359 R365	S359-E361 VanDerWaalsContact C-N 3.26Å; S359-E361 PolarHBondContact O-N 3.07Å; S359-E361 VanDerWaalsContact O-N 3.14Å; E361-R365 WeakPolarHBondContact O-CG 3.18Å; E361-R365 IonicContact OE1-CZ 2.95Å; E361-R365 IonicContact OE1-NH1 2.75Å; E361-R365 PolarHBondContact OE1-NH1 3.4Å; E361-R365 IonicContact OE1-NH2 3.49Å; E361-R365 PolarHBondContact OE1-NH2 3.28Å
362	N	93.7	Very high	87.4	Confident	26 Å²	26	76.9 Å²	76.9	14%	0.139	40%	0.397	C	S	.	.	H	α-helix	trans	-88.1	-25.9	177	-84.8	-27.8	0	0	0	112.7	P358 S359 L360 R365 P368 V369	P358-N362 HydrophobicContact CB-CB 4.3Å; S359-N362 CarbonylContact O-C 3.59Å; S359-N362 WeakPolarHBondContact O-CA 3.48Å; S359-N362 PolarHBondContact O-N 2.83Å; L360-N362 VanDerWaalsContact C-N 3.3Å; L360-N362 PolarHBondContact O-N 2.69Å; N362-R365 PolarHBondContact O-N 2.95Å; N362-P368 HydrophobicContact CB-CB 4.33Å; N362-V369 PolarHBondContact ND2-O 3.32Å; N362-V369 PolarHBondContact OD1-N 3.1Å; N362-V369 PolarHBondContact OD1-O 2.98Å
363	F	96.3	Very high	85.4	Confident	9 Å²	9	83.9 Å²	83.9	4%	0.039	43%	0.428	C	S	.	.	H	α-helix	trans	-65.6	-43.2	170	-177.3	-94.2	0	0	0	110.9	R208 I311 L337 P352 L353 P358 S359 L360 R365	R208-F363 WeakPolarHBondContact CD-O 3.42Å; R208-F363 PolarHBondContact NE-O 3.12Å; I311-F363 HydrophobicContact CD1-CD1 3.92Å; I311-F363 HydrophobicContact CD1-CE1 3.54Å; I311-F363 HydrophobicContact CD1-CZ 3.92Å; I311-F363 HydrophobicContact CG1-CD1 4.32Å; I311-F363 HydrophobicContact CG1-CE1 4.06Å; I311-F363 HydrophobicContact CG2-CE1 3.73Å; L337-F363 HydrophobicContact CB-CE1 4.01Å; L337-F363 HydrophobicContact CD1-CE1 4.37Å; P352-F363 HydrophobicContact CB-CD1 4.17Å; P352-F363 HydrophobicContact CB-CD2 4.1Å; P352-F363 HydrophobicContact CB-CE1 4.18Å; P352-F363 HydrophobicContact CB-CE2 4.1Å; P352-F363 HydrophobicContact CB-CG 4.12Å; P352-F363 HydrophobicContact CB-CZ 4.13Å; P352-F363 HydrophobicContact CG-CB 4.26Å; P352-F363 HydrophobicContact CG-CD1 4.03Å; P352-F363 HydrophobicContact CG-CD2 4.43Å; P352-F363 HydrophobicContact CG-CE1 4.46Å; P352-F363 HydrophobicContact CG-CG 4Å; L353-F363 HydrophobicContact CD1-CD2 4.37Å; L353-F363 HydrophobicContact CD1-CE2 4.08Å; L353-F363 HydrophobicContact CD2-CE2 4.11Å; L353-F363 HydrophobicContact CG-CD2 4.3Å; L353-F363 HydrophobicContact CG-CE2 3.92Å; P358-F363 HydrophobicContact CB-CB 4.47Å; P358-F363 HydrophobicContact CG-CB 3.99Å; P358-F363 HydrophobicContact CG-CD2 3.92Å; P358-F363 HydrophobicContact CG-CG 4.46Å; S359-F363 PolarHBondContact O-N 2.91Å; L360-F363 WeakPolarHBondContact O-CB 3.32Å; L360-F363 PolarHBondContact O-N 3.4Å; F363-R365 PolarHBondContact O-N 3.38Å
364	L	96.3	Very high	83.3	Confident	9 Å²	9	88.3 Å²	88.3	5%	0.047	44%	0.444	C	S	.	.	S	Bend	trans	-71.9	-4.6	176.7	-67.1	170.9	0	0	0	114.5	R208 I210 W238 F239 I311 L337 L360	R208-L364 PolarHBondContact N-O 3.28Å; I210-L364 HydrophobicContact CD1-CD2 3.75Å; W238-L364 HydrophobicContact CH2-CD1 4.16Å; W238-L364 HydrophobicContact CZ3-CD1 4.09Å; F239-L364 HydrophobicContact CD1-CD2 4.49Å; F239-L364 HydrophobicContact CE1-CD2 3.89Å; I311-L364 HydrophobicContact CG1-CD2 4.35Å; L337-L364 HydrophobicContact CD2-CD2 4.11Å; L360-L364 HydrophobicContact CD1-CD1 3.87Å; L360-L364 HydrophobicContact CD1-CG 4.11Å; L360-L364 HydrophobicContact CG-CD1 4Å; L360-L364 WeakPolarHBondContact O-CB 2.81Å; L360-L364 VanDerWaalsContact O-CG 3.27Å; L360-L364 WeakPolarHBondContact O-CG 3.46Å; L360-L364 PolarHBondContact O-N 3.13Å
365	R	94.6	Very high	81.8	Confident	37 Å²	37	93 Å²	93	14%	0.14	46%	0.456	C	S	.	.	B	Isolated β-bridge	trans	-107	145.7	-179.5	-78.7	179	178.7	135.9	7.4	113.2	N206 L207 R208 E361 N362 F363 R367 V369	N206-R365 CarbonylContact O-C 3.56Å; N206-R365 WeakPolarHBondContact O-CA 3.09Å; L207-R365 HydrophobicContact CD2-CG 4.11Å; R208-R365 PolarHBondContact NE-O 3.31Å; R208-R365 PolarHBondContact NH2-O 3.22Å; E361-R365 WeakPolarHBondContact O-CG 3.18Å; E361-R365 IonicContact OE1-CZ 2.95Å; E361-R365 IonicContact OE1-NH1 2.75Å; E361-R365 PolarHBondContact OE1-NH1 3.4Å; E361-R365 IonicContact OE1-NH2 3.49Å; E361-R365 PolarHBondContact OE1-NH2 3.28Å; N362-R365 PolarHBondContact O-N 2.95Å; F363-R365 PolarHBondContact O-N 3.38Å; R365-R367 WeakPolarHBondContact CB-O 3.46Å; R365-V369 VanDerWaalsContact NH1-CG2 3.34Å
366	K	92.4	Very high	80.9	Confident	102 Å²	102	88.7 Å²	88.7	44%	0.443	45%	0.446	S	S	.	.	S	Bend	trans	-67.5	-50.7	171.6	-66.3	172	179.6	126.7	0	110.6	D205 N206 L207 R208	D205-K366 WeakPolarHBondContact O-CD 3.38Å; D205-K366 PolarHBondContact O-NZ 3.2Å; N206-K366 PolarHBondContact O-N 3.35Å; L207-K366 WeakPolarHBondContact O-CE 3.42Å; L207-K366 PolarHBondContact O-NZ 3.36Å; R208-K366 HydrophobicContact CG-CG 3.95Å; R208-K366 PolarHBondContact NH2-O 3.4Å
367	R	88.6	Confident	80.4	Confident	152 Å²	152	84 Å²	84	57%	0.574	43%	0.432	S	S	*	.	S	Bend	trans	-103.3	116.4	174.5	-66.8	-175	-74.3	-167.4	-1	108.4	N206 R365 V369	N206-R367 PolarHBondContact ND2-NH2 3.17Å; N206-R367 PolarHBondContact OD1-NE 3.28Å; N206-R367 PolarHBondContact OD1-NH2 3.41Å; R365-R367 WeakPolarHBondContact CB-O 3.46Å; R367-V369 PolarHBondContact O-N 3.11Å
368	P	81.9	Confident	80.1	Confident	84 Å²	84	83 Å²	83	55%	0.545	42%	0.419	S	S	.	.			trans	-69.3	129.6	179.9	28.1	-33.7	0	0	0	110.2	N362 V370	N362-P368 HydrophobicContact CB-CB 4.33Å; P368-V370 PolarHBondContact O-N 3.35Å; P368-V370 VanDerWaalsContact O-N 3.11Å
369	V	78.6	Confident	79.5	Confident	76 Å²	76	85.3 Å²	85.3	46%	0.461	43%	0.434	S	S	.	.			trans	-73.5	103.5	169.4	174.9	0	0	0	0	107.4	N362 R365 R367 P371	N362-V369 PolarHBondContact ND2-O 3.32Å; N362-V369 PolarHBondContact OD1-N 3.1Å; N362-V369 PolarHBondContact OD1-O 2.98Å; R365-V369 VanDerWaalsContact NH1-CG2 3.34Å; R367-V369 PolarHBondContact O-N 3.11Å; V369-P371 WeakPolarHBondContact O-CD 3.46Å
370	V	64.5	Low	78.7	Confident	117 Å²	117	89.4 Å²	89.4	71%	0.709	44%	0.442	S	S	*	.			trans	-65.9	116.1	171.5	178.5	0	0	0	0	107.5	P368 E372	P368-V370 PolarHBondContact O-N 3.35Å; P368-V370 VanDerWaalsContact O-N 3.11Å; V370-E372 PolarHBondContact O-N 2.93Å
371	P	63.3	Low	78.1	Confident	58 Å²	58	90.2 Å²	90.2	38%	0.377	45%	0.454	S	S	.	.			trans	-72.5	95.1	-178.3	-17.6	33.4	0	0	0	109.5	V369 H373 K374	V369-P371 WeakPolarHBondContact O-CD 3.46Å; P371-H373 PolarHBondContact O-N 3.14Å; P371-K374 HydrophobicContact CB-CD 4.01Å; P371-K374 HydrophobicContact CB-CG 4.05Å; P371-K374 HydrophobicContact CG-CD 4.24Å; P371-K374 PolarHBondContact O-N 2.86Å
372	E	54.1	Low	77.4	Confident	138 Å²	138	92.2 Å²	92.2	65%	0.645	46%	0.46	S	S	*	.	G	3₁₀ helix	trans	-56.2	-31.2	-171.9	-170.8	161.9	-133.1	0	0	112.4	V370 K374	V370-E372 PolarHBondContact O-N 2.93Å; E372-K374 VanDerWaalsContact C-N 3.3Å; E372-K374 PolarHBondContact O-N 2.85Å
373	H	53.7	Low	76.7	Confident	173 Å²	173	99.7 Å²	99.7	80%	0.801	49%	0.492	S	S	*	.	G	3₁₀ helix	trans	-76.4	-4.7	-179.3	-32.2	-46.9	0	0	0	114.5	P371 K375	P371-H373 PolarHBondContact O-N 3.14Å; H373-K375 VanDerWaalsContact C-N 3.29Å; H373-K375 PolarHBondContact O-N 2.86Å
374	K	50.6	Low	76	Confident	165 Å²	165	99.6 Å²	99.6	72%	0.717	49%	0.492	S	S	*	.	G	3₁₀ helix	trans	-80.9	-0.5	179.2	-79.8	-173.7	178.9	177	0	114.8	P371 E372 Q376	P371-K374 HydrophobicContact CB-CD 4.01Å; P371-K374 HydrophobicContact CB-CG 4.05Å; P371-K374 HydrophobicContact CG-CD 4.24Å; P371-K374 PolarHBondContact O-N 2.86Å; E372-K374 VanDerWaalsContact C-N 3.3Å; E372-K374 PolarHBondContact O-N 2.85Å; K374-Q376 PolarHBondContact O-N 3.36Å; K374-Q376 VanDerWaalsContact O-N 3.11Å
375	K	61.2	Low	75.3	Confident	127 Å²	127	105.4 Å²	105.4	55%	0.552	53%	0.528	S	S	*	.	S	Bend	trans	-73.4	98.9	162.1	-59.6	172.7	-176.4	159.2	0	107.8	H373 Y393	H373-K375 VanDerWaalsContact C-N 3.29Å; H373-K375 PolarHBondContact O-N 2.86Å; K375-Y393 HydrophobicContact CB-CD2 4.2Å; K375-Y393 HydrophobicContact CB-CG 4.1Å; K375-Y393 HydrophobicContact CD-CD2 4.1Å; K375-Y393 WeakPolarHBondContact O-CB 3.19Å
376	Q	70.5	Confident	74.3	Confident	134 Å²	134	109.9 Å²	109.9	63%	0.626	55%	0.546	S	S	*	.	P	Polyproline II helix	trans	-52.3	133.1	176.5	-76	-71.8	-18.5	0	0	110.8	K374 C378 Y392 Y393	K374-Q376 PolarHBondContact O-N 3.36Å; K374-Q376 VanDerWaalsContact O-N 3.11Å; Q376-C378 PolarHBondContact O-N 2.86Å; Q376-Y392 HydrophobicContact CB-CD1 4.14Å; Q376-Y392 WeakPolarHBondContact O-CB 3.32Å; Q376-Y393 PolarHBondContact O-N 3.16Å
377	P	79.8	Confident	73.4	Confident	87 Å²	87	106.2 Å²	106.2	57%	0.565	54%	0.537	S	S	*	.	B	Isolated β-bridge	trans	-59.2	137	178.7	25.3	-33.9	0	0	0	110.6
378	C	84	Confident	72.6	Confident	10 Å²	10	105 Å²	105	7%	0.068	54%	0.537	C	S	.	.	P	Polyproline II helix	trans	-63.5	127.8	-179.8	-174.5	0	0	0	0	110.5	Q376 Y380 G381 C390 Y392 Y393 H394	Q376-C378 PolarHBondContact O-N 2.86Å; C378-Y380 PolarHBondContact O-N 2.77Å; C378-G381 PolarHBondContact O-N 3.15Å; C378-C390 VanDerWaalsContact SG-SG 3.63Å; C378-Y392 VanDerWaalsContact CA-CB 3.46Å; C378-Y393 WeakPolarHBondContact CB-O 3.23Å; C378-Y393 PolarHBondContact N-O 3.19Å; C378-H394 WeakPolarHBondContact CB-CE1 3.17Å; C378-H394 VanDerWaalsContact CB-NE2 3.28Å; C378-H394 WeakPolarHBondContact CB-NE2 3.29Å; C378-H394 VanDerWaalsContact SG-CE1 3.53Å
379	P	81	Confident	72.1	Confident	101 Å²	101	108.2 Å²	108.2	66%	0.656	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-15.4	179.3	25.2	-34.8	0	0	0	113.3
380	Y	78.6	Confident	72.1	Confident	144 Å²	144	105.8 Å²	105.8	57%	0.565	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.5	-10.9	174.8	-53.7	-69.3	0	0	0	113.8	C378 K382 K383	C378-Y380 PolarHBondContact O-N 2.77Å; Y380-K382 PolarHBondContact O-N 3.49Å; Y380-K383 WeakPolarHBondContact O-CA 3.26Å; Y380-K383 VanDerWaalsContact O-CB 3.31Å; Y380-K383 WeakPolarHBondContact O-CB 3.5Å; Y380-K383 PolarHBondContact O-N 3.07Å
381	G	81.6	Confident	72.6	Confident	31 Å²	31	109.4 Å²	109.4	32%	0.32	54%	0.535	S	S	.	.	G	3₁₀ helix	trans	48.4	-126	176.7	0	0	0	0	0	113.6	C378 K383 C384 H394	C378-G381 PolarHBondContact O-N 3.15Å; G381-K383 PolarHBondContact O-N 3.21Å; G381-C384 WeakPolarHBondContact O-CB 3.34Å; G381-C384 PolarHBondContact O-N 3.16Å; G381-H394 PolarHBondContact O-CE1 2.68Å; G381-H394 PolarHBondContact O-ND1 3.11Å
382	K	79.1	Confident	73.3	Confident	156 Å²	156	112 Å²	112	68%	0.678	54%	0.538	S	S	*	.	G	3₁₀ helix	trans	-55.3	-33.4	173.8	-58.6	-172.7	-173.5	-92.6	0	113.4	Y380 C384 E396	Y380-K382 PolarHBondContact O-N 3.49Å; K382-C384 PolarHBondContact O-N 3.45Å; K382-E396 WeakPolarHBondContact CE-OE1 3.49Å; K382-E396 WeakPolarHBondContact CE-OE2 3.43Å; K382-E396 WeakPolarHBondContact CG-OE2 3.28Å; K382-E396 IonicContact NZ-OE1 3.12Å; K382-E396 PolarHBondContact NZ-OE1 3.05Å; K382-E396 IonicContact NZ-OE2 3.71Å; K382-E396 PolarHBondContact NZ-OE2 2.82Å
383	K	79.9	Confident	74.4	Confident	184 Å²	184	109.6 Å²	109.6	80%	0.8	52%	0.524	S	S	*	.	G	3₁₀ helix	trans	-80.6	5.9	-175.1	-52.1	-179	-179.8	-180	0	113.7	Y380 G381 T385	Y380-K383 WeakPolarHBondContact O-CA 3.26Å; Y380-K383 VanDerWaalsContact O-CB 3.31Å; Y380-K383 WeakPolarHBondContact O-CB 3.5Å; Y380-K383 PolarHBondContact O-N 3.07Å; G381-K383 PolarHBondContact O-N 3.21Å; K383-T385 PolarHBondContact O-N 3.3Å
384	C	82.6	Confident	75.6	Confident	6 Å²	6	102.3 Å²	102.3	4%	0.041	49%	0.49	C	S	.	.			trans	-76.5	103.2	-176.1	-177.9	0	0	0	0	113.2	G381 K382 Y386 G387 C390 H394 R397	G381-C384 WeakPolarHBondContact O-CB 3.34Å; G381-C384 PolarHBondContact O-N 3.16Å; K382-C384 PolarHBondContact O-N 3.45Å; C384-Y386 PolarHBondContact O-N 2.94Å; C384-G387 PolarHBondContact O-N 3.43Å; C384-C390 PolarHBondContact SG-SG 3.34Å; C384-H394 WeakPolarHBondContact CB-CE1 3.44Å; C384-H394 PolarHBondContact SG-NE2 2.89Å; C384-R397 PolarHBondContact O-NH2 2.55Å
385	T	80.8	Confident	76.6	Confident	131 Å²	131	98.3 Å²	98.3	80%	0.804	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-17.7	177	52.2	0	0	0	0	114.6	K383 G387	K383-T385 PolarHBondContact O-N 3.3Å; T385-G387 PolarHBondContact O-N 2.84Å
386	Y	74	Confident	77	Confident	132 Å²	132	97.9 Å²	97.9	52%	0.518	48%	0.481	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-10.7	178.1	-64.7	-84.9	0	0	0	114	C384 K389 C390	C384-Y386 PolarHBondContact O-N 2.94Å; Y386-K389 CarbonylContact O-C 3.49Å; Y386-K389 WeakPolarHBondContact O-CA 3.39Å; Y386-K389 WeakPolarHBondContact O-CB 3.34Å; Y386-K389 PolarHBondContact O-N 3.43Å; Y386-C390 PolarHBondContact O-N 2.88Å
387	G	73.4	Confident	77	Confident	24 Å²	24	94.7 Å²	94.7	25%	0.247	46%	0.463	C	S	.	.	G	3₁₀ helix	trans	55.4	-138.7	173.8	0	0	0	0	0	113.5	C384 T385 K389 C390 R397	C384-G387 PolarHBondContact O-N 3.43Å; T385-G387 PolarHBondContact O-N 2.84Å; G387-K389 PolarHBondContact O-N 3.06Å; G387-K389 VanDerWaalsContact O-N 3.15Å; G387-C390 WeakPolarHBondContact O-CB 3.35Å; G387-C390 PolarHBondContact O-N 2.89Å; G387-R397 PolarHBondContact O-NH1 2.84Å
388	H	70.8	Confident	75.9	Confident	127 Å²	127	94.2 Å²	94.2	59%	0.588	46%	0.459	S	S	*	.	G	3₁₀ helix	trans	-66.4	-5.9	174.2	66.9	-78	0	0	0	114.2	S404	H388-S404 WeakPolarHBondContact CE1-CB 3.34Å; H388-S404 WeakPolarHBondContact NE2-CB 3.43Å
389	K	72.1	Confident	74.6	Confident	151 Å²	151	101.3 Å²	101.3	66%	0.657	50%	0.496	S	S	*	.	G	3₁₀ helix	trans	-96.7	4.5	175.2	-52.9	-174.7	-176.8	-64.1	0	112.7	Y386 G387	Y386-K389 CarbonylContact O-C 3.49Å; Y386-K389 WeakPolarHBondContact O-CA 3.39Å; Y386-K389 WeakPolarHBondContact O-CB 3.34Å; Y386-K389 PolarHBondContact O-N 3.43Å; G387-K389 PolarHBondContact O-N 3.06Å; G387-K389 VanDerWaalsContact O-N 3.15Å
390	C	77.8	Confident	73.4	Confident	25 Å²	25	102.8 Å²	102.8	17%	0.169	49%	0.494	C	S	.	.			trans	-70.1	132.5	175	-161	0	0	0	0	111	C378 C384 Y386 G387 Y392	C378-C390 VanDerWaalsContact SG-SG 3.63Å; C384-C390 PolarHBondContact SG-SG 3.34Å; Y386-C390 PolarHBondContact O-N 2.88Å; G387-C390 WeakPolarHBondContact O-CB 3.35Å; G387-C390 PolarHBondContact O-N 2.89Å; C390-Y392 PolarHBondContact O-N 2.98Å
391	K	74.9	Confident	72.1	Confident	193 Å²	193	100.8 Å²	100.8	84%	0.839	50%	0.498	S	S	*	.	S	Bend	trans	-67.7	-16.6	173.2	-174	176.7	177.4	-178.4	0	113.2
392	Y	78.8	Confident	71.1	Confident	114 Å²	114	107.4 Å²	107.4	45%	0.447	52%	0.521	S	S	.	.	S	Bend	trans	-108	160	-171.7	-59.5	-88.3	0	0	0	112	Q376 C378 C390 H394	Q376-Y392 HydrophobicContact CB-CD1 4.14Å; Q376-Y392 WeakPolarHBondContact O-CB 3.32Å; C378-Y392 VanDerWaalsContact CA-CB 3.46Å; C390-Y392 PolarHBondContact O-N 2.98Å; Y392-H394 PolarHBondContact O-CD2 3.46Å
393	Y	77.7	Confident	70.2	Confident	86 Å²	86	107.5 Å²	107.5	34%	0.337	52%	0.517	S	S	.	.	B	Isolated β-bridge	trans	-73.6	147.1	-173.9	-169.6	-133.8	0	0	0	113.7	K375 Q376 C378 P395 V398	K375-Y393 HydrophobicContact CB-CD2 4.2Å; K375-Y393 HydrophobicContact CB-CG 4.1Å; K375-Y393 HydrophobicContact CD-CD2 4.1Å; K375-Y393 WeakPolarHBondContact O-CB 3.19Å; Q376-Y393 PolarHBondContact O-N 3.16Å; C378-Y393 WeakPolarHBondContact CB-O 3.23Å; C378-Y393 PolarHBondContact N-O 3.19Å; Y393-P395 HydrophobicContact CE1-CB 3.97Å; Y393-P395 HydrophobicContact CE1-CG 4.45Å; Y393-V398 HydrophobicContact CE2-CG2 4.06Å; Y393-V398 WeakPolarHBondContact OH-CG2 3.29Å
394	H	79.3	Confident	69.5	Low	20 Å²	20	99.2 Å²	99.2	9%	0.093	48%	0.483	C	S	.	.			trans	-137.2	93.6	175.5	-73.3	-74.9	0	0	0	108.7	C378 G381 C384 Y392 E396 R397	C378-H394 WeakPolarHBondContact CB-CE1 3.17Å; C378-H394 VanDerWaalsContact CB-NE2 3.28Å; C378-H394 WeakPolarHBondContact CB-NE2 3.29Å; C378-H394 VanDerWaalsContact SG-CE1 3.53Å; G381-H394 PolarHBondContact O-CE1 2.68Å; G381-H394 PolarHBondContact O-ND1 3.11Å; C384-H394 WeakPolarHBondContact CB-CE1 3.44Å; C384-H394 PolarHBondContact SG-NE2 2.89Å; Y392-H394 PolarHBondContact O-CD2 3.46Å; H394-E396 PolarHBondContact O-N 2.85Å; H394-R397 HydrophobicContact CB-CB 4Å; H394-R397 HydrophobicContact CB-CG 3.82Å; H394-R397 PolarHBondContact CD2-NH1 3.18Å; H394-R397 PolarHBondContact NE2-NH1 2.86Å; H394-R397 PolarHBondContact O-N 3.34Å
395	P	71.3	Confident	68.7	Low	82 Å²	82	103.8 Å²	103.8	53%	0.532	51%	0.51	S	S	.	.	G	3₁₀ helix	trans	-57.9	-34	179.9	21.7	-32.2	0	0	0	111.9	Y393 R397 V398	Y393-P395 HydrophobicContact CE1-CB 3.97Å; Y393-P395 HydrophobicContact CE1-CG 4.45Å; P395-R397 PolarHBondContact O-N 3.44Å; P395-V398 WeakPolarHBondContact O-CG2 3.15Å; P395-V398 PolarHBondContact O-N 3.2Å
396	E	69.1	Low	68	Low	117 Å²	117	99.9 Å²	99.9	55%	0.547	49%	0.491	S	S	.	.	G	3₁₀ helix	trans	-70.2	-0.8	178	-51.4	-166.2	-171.2	0	0	115	K382 H394	K382-E396 WeakPolarHBondContact CE-OE1 3.49Å; K382-E396 WeakPolarHBondContact CE-OE2 3.43Å; K382-E396 WeakPolarHBondContact CG-OE2 3.28Å; K382-E396 IonicContact NZ-OE1 3.12Å; K382-E396 PolarHBondContact NZ-OE1 3.05Å; K382-E396 IonicContact NZ-OE2 3.71Å; K382-E396 PolarHBondContact NZ-OE2 2.82Å; H394-E396 PolarHBondContact O-N 2.85Å
397	R	70	Confident	68	Low	67 Å²	67	96.8 Å²	96.8	25%	0.253	48%	0.484	S	S	.	.	G	3₁₀ helix	trans	-111.1	1.2	176.6	-62.8	-179.5	-174.3	154.5	3.1	113.1	C384 G387 H394 P395 N399 Q400	C384-R397 PolarHBondContact O-NH2 2.55Å; G387-R397 PolarHBondContact O-NH1 2.84Å; H394-R397 HydrophobicContact CB-CB 4Å; H394-R397 HydrophobicContact CB-CG 3.82Å; H394-R397 PolarHBondContact CD2-NH1 3.18Å; H394-R397 PolarHBondContact NE2-NH1 2.86Å; H394-R397 PolarHBondContact O-N 3.34Å; P395-R397 PolarHBondContact O-N 3.44Å; R397-N399 VanDerWaalsContact C-N 3.34Å; R397-Q400 PolarHBondContact O-N 3.23Å
398	V	57.8	Low	68.1	Low	78 Å²	78	99.4 Å²	99.4	47%	0.473	49%	0.49	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-39.8	179.5	176.4	0	0	0	0	111	Y393 P395 Q400	Y393-V398 HydrophobicContact CE2-CG2 4.06Å; Y393-V398 WeakPolarHBondContact OH-CG2 3.29Å; P395-V398 WeakPolarHBondContact O-CG2 3.15Å; P395-V398 PolarHBondContact O-N 3.2Å; V398-Q400 VanDerWaalsContact C-N 3.34Å; V398-Q400 PolarHBondContact O-N 2.77Å
399	N	55.4	Low	68.4	Low	158 Å²	158	98.8 Å²	98.8	85%	0.845	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.2	17	-177.6	-61.8	4.8	0	0	0	113.7	R397	R397-N399 VanDerWaalsContact C-N 3.34Å
400	Q	56.1	Low	68.9	Low	132 Å²	132	98.6 Å²	98.6	62%	0.617	49%	0.485	S	S	*	.	S	Bend	trans	-112	134.3	170	-74.5	-169.9	-14.6	0	0	110	R397 V398 Q402	R397-Q400 PolarHBondContact O-N 3.23Å; V398-Q400 VanDerWaalsContact C-N 3.34Å; V398-Q400 PolarHBondContact O-N 2.77Å; Q400-Q402 PolarHBondContact O-N 3.44Å
401	P	51.8	Low	68.7	Low	102 Å²	102	98.5 Å²	98.5	66%	0.662	49%	0.486	S	S	*	.			trans	-61.4	125.2	178.2	25.6	-33.6	0	0	0	109.9	R403	P401-R403 PolarHBondContact O-N 3.42Å
402	Q	59.8	Low	68.7	Low	171 Å²	171	95.2 Å²	95.2	80%	0.799	47%	0.472	S	S	*	.			trans	-76.1	46.1	-172	-60.5	-176.5	17.3	0	0	113.8	Q400	Q400-Q402 PolarHBondContact O-N 3.44Å
403	R	60.6	Low	68.7	Low	157 Å²	157	92.5 Å²	92.5	59%	0.592	47%	0.473	S	S	*	.			trans	-90.9	137.5	170.9	-65.4	-178	178.2	168.6	2	108.3	P401 D407 E408	P401-R403 PolarHBondContact O-N 3.42Å; R403-D407 HydrophobicContact CB-CB 4.38Å; R403-E408 HydrophobicContact CB-CB 4.23Å
404	S	65.9	Low	68.6	Low	11 Å²	11	95.8 Å²	95.8	8%	0.077	49%	0.489	C	S	.	.			trans	-69.7	154.4	164.1	82.9	0	0	0	0	108.9	H388 A406 D407 E408	H388-S404 WeakPolarHBondContact CE1-CB 3.34Å; H388-S404 WeakPolarHBondContact NE2-CB 3.43Å; S404-A406 PolarHBondContact O-N 3.11Å; S404-A406 PolarHBondContact OG-N 3.2Å; S404-D407 VanDerWaalsContact CB-OD2 3.29Å; S404-D407 WeakPolarHBondContact CB-OD2 3.18Å; S404-D407 CarbonylContact O-C 3.54Å; S404-D407 WeakPolarHBondContact O-CA 3.39Å; S404-D407 PolarHBondContact O-N 3Å; S404-D407 VanDerWaalsContact OG-CG 3.26Å; S404-D407 PolarHBondContact OG-N 3.48Å; S404-D407 PolarHBondContact OG-OD2 3.32Å; S404-E408 PolarHBondContact O-N 2.86Å
405	V	64.3	Low	68.2	Low	101 Å²	101	100.3 Å²	100.3	61%	0.612	51%	0.513	S	S	*	.	H	α-helix	trans	-54	-31.5	176.3	-177.8	0	0	0	0	111.4	L409	V405-L409 HydrophobicContact CG1-CD1 3.99Å; V405-L409 HydrophobicContact CG1-CG 4.35Å; V405-L409 VanDerWaalsContact O-CB 3.27Å; V405-L409 WeakPolarHBondContact O-CB 2.99Å; V405-L409 WeakPolarHBondContact O-CG 3.24Å; V405-L409 PolarHBondContact O-N 3.03Å
406	A	66	Low	68.2	Low	50 Å²	50	99.8 Å²	99.8	41%	0.413	51%	0.511	S	S	.	.	H	α-helix	trans	-72.8	-28.5	174.4	0	0	0	0	0	113.9	S404 R410	S404-A406 PolarHBondContact O-N 3.11Å; S404-A406 PolarHBondContact OG-N 3.2Å; A406-R410 VanDerWaalsContact O-CB 3.29Å; A406-R410 WeakPolarHBondContact O-CB 3.39Å; A406-R410 WeakPolarHBondContact O-CG 3.49Å; A406-R410 PolarHBondContact O-N 3.06Å; A406-R410 VanDerWaalsContact O-N 3.14Å; A406-R410 PolarHBondContact O-NE 3.25Å
407	D	74.1	Confident	68.1	Low	67 Å²	67	96.4 Å²	96.4	36%	0.358	50%	0.504	S	S	.	.	H	α-helix	trans	-82.7	-33.9	175.3	-58.7	-50.5	0	0	0	111.8	R403 S404 R410 A411	R403-D407 HydrophobicContact CB-CB 4.38Å; S404-D407 VanDerWaalsContact CB-OD2 3.29Å; S404-D407 WeakPolarHBondContact CB-OD2 3.18Å; S404-D407 CarbonylContact O-C 3.54Å; S404-D407 WeakPolarHBondContact O-CA 3.39Å; S404-D407 PolarHBondContact O-N 3Å; S404-D407 VanDerWaalsContact OG-CG 3.26Å; S404-D407 PolarHBondContact OG-N 3.48Å; S404-D407 PolarHBondContact OG-OD2 3.32Å; D407-R410 PolarHBondContact O-N 3.14Å; D407-R410 IonicContact OD1-CZ 3.61Å; D407-R410 IonicContact OD1-NE 2.72Å; D407-R410 IonicContact OD1-NH2 2.71Å; D407-R410 PolarHBondContact OD1-NH2 3.44Å; D407-A411 WeakPolarHBondContact O-CB 3.37Å; D407-A411 PolarHBondContact O-N 2.81Å
408	E	76.1	Confident	67.6	Low	79 Å²	79	97.5 Å²	97.5	37%	0.369	52%	0.518	S	S	.	.	H	α-helix	trans	-65.9	-49.9	171.4	-178.1	167.8	-143.8	0	0	111.3	R403 S404 R410 A411 F412	R403-E408 HydrophobicContact CB-CB 4.23Å; S404-E408 PolarHBondContact O-N 2.86Å; E408-R410 VanDerWaalsContact C-N 3.29Å; E408-R410 PolarHBondContact O-N 2.9Å; E408-A411 WeakPolarHBondContact O-CB 3.47Å; E408-A411 PolarHBondContact O-N 3.43Å; E408-F412 HydrophobicContact CG-CD2 3.76Å; E408-F412 HydrophobicContact CG-CE2 3.5Å; E408-F412 VanDerWaalsContact CG-CE2 3.5Å; E408-F412 VanDerWaalsContact O-CD2 3.28Å; E408-F412 WeakPolarHBondContact O-CD2 3.27Å; E408-F412 PolarHBondContact O-N 3.15Å
409	L	76.4	Confident	67.5	Low	113 Å²	113	100.6 Å²	100.6	59%	0.592	53%	0.525	S	S	*	.	H	α-helix	trans	-59.9	-36.9	172.3	-72.5	170.7	0	0	0	112.2	V405 A413	V405-L409 HydrophobicContact CG1-CD1 3.99Å; V405-L409 HydrophobicContact CG1-CG 4.35Å; V405-L409 VanDerWaalsContact O-CB 3.27Å; V405-L409 WeakPolarHBondContact O-CB 2.99Å; V405-L409 WeakPolarHBondContact O-CG 3.24Å; V405-L409 PolarHBondContact O-N 3.03Å; L409-A413 VanDerWaalsContact O-CB 3.23Å; L409-A413 WeakPolarHBondContact O-CB 3.48Å; L409-A413 PolarHBondContact O-N 2.96Å
410	R	83.3	Confident	67.5	Low	148 Å²	148	98.4 Å²	98.4	56%	0.558	52%	0.517	S	S	*	.	H	α-helix	trans	-69.9	-31.3	172.9	-79	-177.2	-68.7	-151.6	5.3	113.2	A406 D407 E408 K414	A406-R410 VanDerWaalsContact O-CB 3.29Å; A406-R410 WeakPolarHBondContact O-CB 3.39Å; A406-R410 WeakPolarHBondContact O-CG 3.49Å; A406-R410 PolarHBondContact O-N 3.06Å; A406-R410 VanDerWaalsContact O-N 3.14Å; A406-R410 PolarHBondContact O-NE 3.25Å; D407-R410 PolarHBondContact O-N 3.14Å; D407-R410 IonicContact OD1-CZ 3.61Å; D407-R410 IonicContact OD1-NE 2.72Å; D407-R410 IonicContact OD1-NH2 2.71Å; D407-R410 PolarHBondContact OD1-NH2 3.44Å; E408-R410 VanDerWaalsContact C-N 3.29Å; E408-R410 PolarHBondContact O-N 2.9Å; R410-K414 WeakPolarHBondContact O-CB 3.38Å; R410-K414 VanDerWaalsContact O-CG 3.26Å; R410-K414 WeakPolarHBondContact O-CG 3.02Å; R410-K414 PolarHBondContact O-N 2.93Å; R410-K414 VanDerWaalsContact O-N 3.11Å
411	A	73.8	Confident	67.2	Low	22 Å²	22	98.8 Å²	98.8	18%	0.182	52%	0.521	C	S	.	.	H	α-helix	trans	-69.9	-48.1	173	0	0	0	0	0	110.7	D407 E408 A413 K414 L415	D407-A411 WeakPolarHBondContact O-CB 3.37Å; D407-A411 PolarHBondContact O-N 2.81Å; E408-A411 WeakPolarHBondContact O-CB 3.47Å; E408-A411 PolarHBondContact O-N 3.43Å; A411-A413 VanDerWaalsContact C-N 3.35Å; A411-A413 PolarHBondContact O-N 3.05Å; A411-K414 PolarHBondContact O-N 3.18Å; A411-L415 WeakPolarHBondContact O-CG 3.46Å; A411-L415 PolarHBondContact O-N 3.33Å
412	F	75.7	Confident	67.1	Low	124 Å²	124	98.1 Å²	98.1	54%	0.544	52%	0.518	S	S	.	.	H	α-helix	trans	-60.3	-41.5	174.9	-76.5	-60.1	0	0	0	112.4	E408 K414 L415 S416	E408-F412 HydrophobicContact CG-CD2 3.76Å; E408-F412 HydrophobicContact CG-CE2 3.5Å; E408-F412 VanDerWaalsContact CG-CE2 3.5Å; E408-F412 VanDerWaalsContact O-CD2 3.28Å; E408-F412 WeakPolarHBondContact O-CD2 3.27Å; E408-F412 PolarHBondContact O-N 3.15Å; F412-K414 VanDerWaalsContact C-N 3.34Å; F412-K414 PolarHBondContact O-N 3.31Å; F412-L415 PolarHBondContact O-N 3.15Å; F412-S416 WeakPolarHBondContact O-CB 3.49Å; F412-S416 PolarHBondContact O-N 2.92Å; F412-S416 PolarHBondContact O-OG 2.83Å
413	A	79.2	Confident	66.4	Low	58 Å²	58	97.4 Å²	97.4	48%	0.479	52%	0.515	S	S	.	.	H	α-helix	trans	-64.7	-33.9	175.4	0	0	0	0	0	113.4	L409 A411 S416 A417	L409-A413 VanDerWaalsContact O-CB 3.23Å; L409-A413 WeakPolarHBondContact O-CB 3.48Å; L409-A413 PolarHBondContact O-N 2.96Å; A411-A413 VanDerWaalsContact C-N 3.35Å; A411-A413 PolarHBondContact O-N 3.05Å; A413-S416 PolarHBondContact O-OG 3.46Å; A413-A417 WeakPolarHBondContact O-CB 3.45Å; A413-A417 PolarHBondContact O-N 3.21Å; A413-A417 VanDerWaalsContact O-N 3.16Å
414	K	75	Confident	65.7	Low	154 Å²	154	93.5 Å²	93.5	67%	0.67	52%	0.524	S	S	*	.	H	α-helix	trans	-70.4	-42.5	172.9	-76	173.5	178.5	-173.5	0	111.7	R410 A411 F412 A417 V418	R410-K414 WeakPolarHBondContact O-CB 3.38Å; R410-K414 VanDerWaalsContact O-CG 3.26Å; R410-K414 WeakPolarHBondContact O-CG 3.02Å; R410-K414 PolarHBondContact O-N 2.93Å; R410-K414 VanDerWaalsContact O-N 3.11Å; A411-K414 PolarHBondContact O-N 3.18Å; F412-K414 VanDerWaalsContact C-N 3.34Å; F412-K414 PolarHBondContact O-N 3.31Å; K414-A417 PolarHBondContact O-N 2.71Å; K414-V418 WeakPolarHBondContact O-CG2 3.5Å; K414-V418 PolarHBondContact O-N 2.72Å
415	L	71.3	Confident	64.5	Low	116 Å²	116	97 Å²	97	61%	0.607	55%	0.553	S	S	*	*	H	α-helix	trans	-67.5	-39.3	179.3	-69	168.8	0	0	0	112.2	A411 F412 V418 K419	A411-L415 WeakPolarHBondContact O-CG 3.46Å; A411-L415 PolarHBondContact O-N 3.33Å; F412-L415 PolarHBondContact O-N 3.15Å; L415-V418 PolarHBondContact O-N 3.46Å; L415-K419 PolarHBondContact O-N 3.45Å; L415-K419 VanDerWaalsContact O-N 3.17Å
416	S	70.8	Confident	63.2	Low	70 Å²	70	100.1 Å²	100.1	49%	0.49	57%	0.566	S	S	.	*	H	α-helix	trans	-68.5	-39.4	175.1	63.3	0	0	0	0	112.3	F412 A413 K419 T420	F412-S416 WeakPolarHBondContact O-CB 3.49Å; F412-S416 PolarHBondContact O-N 2.92Å; F412-S416 PolarHBondContact O-OG 2.83Å; A413-S416 PolarHBondContact O-OG 3.46Å; S416-K419 PolarHBondContact O-N 2.94Å; S416-T420 PolarHBondContact O-N 3.35Å
417	A	66.8	Low	62	Low	47 Å²	47	102.5 Å²	102.5	39%	0.388	59%	0.585	S	S	.	*	H	α-helix	trans	-58.7	-47.6	173.3	0	0	0	0	0	111.9	A413 K414 K419 T420 M421	A413-A417 WeakPolarHBondContact O-CB 3.45Å; A413-A417 PolarHBondContact O-N 3.21Å; A413-A417 VanDerWaalsContact O-N 3.16Å; K414-A417 PolarHBondContact O-N 2.71Å; A417-K419 VanDerWaalsContact C-N 3.31Å; A417-K419 PolarHBondContact O-N 3.02Å; A417-T420 PolarHBondContact O-N 2.89Å; A417-T420 VanDerWaalsContact O-N 3.15Å; A417-T420 PolarHBondContact O-OG1 3.46Å; A417-M421 WeakPolarHBondContact O-CG 3.34Å; A417-M421 PolarHBondContact O-N 3.27Å
418	V	59.9	Low	60.2	Low	90 Å²	90	108.4 Å²	108.4	55%	0.545	61%	0.608	S	S	.	*	H	α-helix	trans	-59	-40.5	177.5	171	0	0	0	0	111.8	K414 L415 T420 M421 S422	K414-V418 WeakPolarHBondContact O-CG2 3.5Å; K414-V418 PolarHBondContact O-N 2.72Å; L415-V418 PolarHBondContact O-N 3.46Å; V418-T420 VanDerWaalsContact C-N 3.34Å; V418-T420 PolarHBondContact O-N 3.15Å; V418-M421 WeakPolarHBondContact O-CG 3.5Å; V418-M421 PolarHBondContact O-N 2.97Å; V418-S422 PolarHBondContact O-N 2.94Å; V418-S422 PolarHBondContact O-OG 3.48Å
419	K	55.1	Low	58.3	Low	142 Å²	142	110.6 Å²	110.6	62%	0.617	63%	0.63	S	S	*	*	H	α-helix	trans	-62.3	-38.7	176.9	-172	171.2	-179.7	177.6	0	112.7	L415 S416 A417 M421 S422	L415-K419 PolarHBondContact O-N 3.45Å; L415-K419 VanDerWaalsContact O-N 3.17Å; S416-K419 PolarHBondContact O-N 2.94Å; A417-K419 VanDerWaalsContact C-N 3.31Å; A417-K419 PolarHBondContact O-N 3.02Å; K419-M421 VanDerWaalsContact C-N 3.29Å; K419-M421 PolarHBondContact O-N 3.29Å; K419-S422 PolarHBondContact O-OG 3.32Å
420	T	55.3	Low	56.1	Low	112 Å²	112	108.4 Å²	108.4	69%	0.687	64%	0.635	S	S	*	*	H	α-helix	trans	-71.4	-19.4	179.6	57.3	0	0	0	0	114.7	S416 A417 V418	S416-T420 PolarHBondContact O-N 3.35Å; A417-T420 PolarHBondContact O-N 2.89Å; A417-T420 VanDerWaalsContact O-N 3.15Å; A417-T420 PolarHBondContact O-OG1 3.46Å; V418-T420 VanDerWaalsContact C-N 3.34Å; V418-T420 PolarHBondContact O-N 3.15Å
421	M	50.8	Low	53.7	Low	140 Å²	140	108.5 Å²	108.5	69%	0.69	65%	0.653	S	S	*	*	H	α-helix	trans	-96.6	-15.1	178.8	57.4	-166.5	-70.1	0	0	114	A417 V418 K419	A417-M421 WeakPolarHBondContact O-CG 3.34Å; A417-M421 PolarHBondContact O-N 3.27Å; V418-M421 WeakPolarHBondContact O-CG 3.5Å; V418-M421 PolarHBondContact O-N 2.97Å; K419-M421 VanDerWaalsContact C-N 3.29Å; K419-M421 PolarHBondContact O-N 3.29Å
422	S	49.1	Very low	51.6	Low	88 Å²	88	110.6 Å²	110.6	62%	0.615	68%	0.676	S	S	*	*	H	α-helix	trans	-79.2	-24.9	171.2	48.1	0	0	0	0	114.2	V418 K419	V418-S422 PolarHBondContact O-N 2.94Å; V418-S422 PolarHBondContact O-OG 3.48Å; K419-S422 PolarHBondContact O-OG 3.32Å
423	E	46.1	Very low	50.1	Low	157 Å²	157	110.8 Å²	110.8	73%	0.734	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.8	-12.1	-171.4	-150	169.7	144.8	0	0	113.6
424	G	44.9	Very low	47.8	Very low	75 Å²	75	112.8 Å²	112.8	77%	0.773	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.6	5	-173.6	0	0	0	0	0	116.8
425	A	40.5	Very low	45.7	Very low	84 Å²	84	109.7 Å²	109.7	69%	0.694	71%	0.71	S	S	*	*	S	Bend	trans	-123.2	16	-156.6	0	0	0	0	0	117.3
426	L	37.4	Very low	43.9	Very low	167 Å²	167	110 Å²	110	87%	0.874	72%	0.716	S	S	*	*			trans	-148.6	95.7	172	-165.5	63.9	0	0	0	113.6
427	A	41.2	Very low	42.2	Very low	100 Å²	100	116.7 Å²	116.7	83%	0.826	74%	0.736	S	S	*	*			trans	-144	63.2	-177.7	0	0	0	0	0	113.8
428	K	36.3	Very low	40.4	Very low	191 Å²	191	117.6 Å²	117.6	83%	0.83	75%	0.751	S	S	*	*			trans	-173	143.4	165.5	-103.9	165.4	178.8	178.3	0	107.2
429	C	35	Very low	39.1	Very low	124 Å²	124	121.2 Å²	121.2	84%	0.838	77%	0.767	S	S	*	*			cis	-144.2	177.4	3.1	-130.2	0	0	0	0	110.1
430	G	31.1	Very low	38.1	Very low	68 Å²	68	120.4 Å²	120.4	70%	0.701	77%	0.774	S	S	*	*			trans	-70.3	170.8	-174.5	0	0	0	0	0	116.4
431	T	31.9	Very low	37	Very low	150 Å²	150	118.2 Å²	118.2	92%	0.92	77%	0.773	S	S	*	*				-159.9	154.9	85.1	-60.9	0	0	0	0	111.8
432	G	30	Very low	36.3	Very low	65 Å²	65	117 Å²	117	67%	0.67	78%	0.778	S	S	*	*			trans	-82	-165.2	179.1	0	0	0	0	0	115.3
433	P	44.3	Very low	35.4	Very low	128 Å²	128	121.8 Å²	121.8	83%	0.831	79%	0.791	S	S	*	*			cis	-142.3	172.3	35.6	42.6	-25	0	0	0	118.7
434	A	31.5	Very low	34.7	Very low	101 Å²	101	117.7 Å²	117.7	84%	0.835	78%	0.784	S	S	*	*			trans	53.9	146.4	151.2	0	0	0	0	0	121.3
435	A	30.6	Very low	34.2	Very low	89 Å²	89	123.6 Å²	123.6	74%	0.736	79%	0.788	S	S	*	*			cis	-159.8	174.8	-16.4	0	0	0	0	0	106.8
436	V	32.9	Very low	33.8	Very low	122 Å²	122	130.8 Å²	130.8	74%	0.739	80%	0.798	S	S	*	*			cis	-168.5	140	44.7	170.9	0	0	0	0	109.5
437	K	34.8	Very low	33.5	Very low	210 Å²	210	129.5 Å²	129.5	91%	0.913	80%	0.797	S	S	*	*			trans	49.6	145.4	164.5	-68	177.4	177.3	-175.3	0	119.6
438	G	30.1	Very low	33.3	Very low	67 Å²	67	129 Å²	129	69%	0.691	79%	0.792	S	S	*	*			cis	-158.5	155.9	-3.3	0	0	0	0	0	109.5
439	D	32.6	Very low	33.5	Very low	166 Å²	166	125.5 Å²	125.5	89%	0.888	79%	0.789	S	S	*	*				67.8	121.4	91.4	-131.6	37.8	0	0	0	112.9
440	V	34.9	Very low	33.3	Very low	125 Å²	125	129.4 Å²	129.4	76%	0.758	79%	0.792	S	S	*	*			cis	-148.1	142.4	11	176.4	0	0	0	0	110.8
441	G	30.6	Very low	33.8	Very low	66 Å²	66	138 Å²	138	68%	0.68	80%	0.803	S	S	*	*			trans	61.1	157	149.2	0	0	0	0	0	121
442	S	35.7	Very low	33.9	Very low	114 Å²	114	139.7 Å²	139.7	80%	0.797	80%	0.8	S	S	*	*			cis	-156.1	169.7	-10	-80.9	0	0	0	0	110.6
443	E	31.1	Very low	33.9	Very low	188 Å²	188	141.4 Å²	141.4	88%	0.879	80%	0.802	S	S	*	*			trans	-9.2	154.4	161.8	-66.2	-168.4	95.2	0	0	121.8
444	A	32.3	Very low	33.6	Very low	72 Å²	72	142.7 Å²	142.7	60%	0.595	80%	0.802	S	S	*	*			cis	-172.6	171.3	-13.8	0	0	0	0	0	111.4
445	K	32.9	Very low	34.4	Very low	198 Å²	198	143.5 Å²	143.5	86%	0.861	80%	0.799	S	S	*	*			trans	50.4	107.1	155.2	-74.9	172.1	-179.8	165.6	0	120
446	R	32.5	Very low	34.4	Very low	235 Å²	235	143.8 Å²	143.8	89%	0.887	80%	0.795	S	S	*	*				5.4	131.9	124	-51	173.7	-176.7	168.2	-0.6	117
447	V	30.7	Very low	34.4	Very low	141 Å²	141	144.9 Å²	144.9	86%	0.855	80%	0.796	S	S	*	*				177.4	148.6	107.4	149.5	0	0	0	0	109.4
448	A	38.2	Very low	34.3	Very low	89 Å²	89	146.7 Å²	146.7	74%	0.736	80%	0.797	S	S	*	*			trans	-98.6	140.8	179.8	0	0	0	0	0	113.4
449	P	40.6	Very low	34.3	Very low	118 Å²	118	148.9 Å²	148.9	77%	0.766	80%	0.801	S	S	*	*			trans	-92.4	128.6	147.9	23.9	-9.9	0	0	0	109.5
450	K	30.1	Very low	34.4	Very low	206 Å²	206	147.6 Å²	147.6	90%	0.896	80%	0.799	S	S	*	*				58.7	122.6	73.5	-86.5	-173.6	172.3	179.2	0	114.5
451	R	41.8	Very low	34.1	Very low	249 Å²	249	146 Å²	146	94%	0.94	80%	0.799	S	S	*	*			trans	-67.5	141.1	177	-69.4	171.5	155.4	-140.7	-3.3	112.9
452	Q	33.2	Very low	34	Very low	184 Å²	184	149.3 Å²	149.3	86%	0.86	81%	0.811	S	S	*	*			trans	-154.5	109.3	148.5	-100.1	163.4	-13.8	0	0	104.6
453	S	31.7	Very low	33.7	Very low	101 Å²	101	152.2 Å²	152.2	71%	0.706	81%	0.812	S	S	*	*				73.6	107.7	85.2	69.1	0	0	0	0	113.8
454	D	36.2	Very low	34.5	Very low	156 Å²	156	148.2 Å²	148.2	83%	0.834	80%	0.802	S	S	*	*			trans	-48.1	168	163.7	-62.4	-81.8	0	0	0	113.8
455	P	49.5	Very low	34.5	Very low	117 Å²	117	150.3 Å²	150.3	76%	0.76	81%	0.807	S	S	*	*			cis	-142.4	-173.9	19.4	41.2	-21.4	0	0	0	117.2
456	S	29.1	Very low	34.4	Very low	95 Å²	95	149.5 Å²	149.5	66%	0.664	81%	0.806	S	S	*	*				127.5	113.1	130	-159.1	0	0	0	0	117.9
457	I	34.2	Very low	34.4	Very low	146 Å²	146	142.2 Å²	142.2	75%	0.749	80%	0.796	S	S	*	*			trans	51.2	112.9	141.5	-54.8	170.8	0	0	0	119.1
458	R	33.1	Very low	34.4	Very low	248 Å²	248	143 Å²	143	94%	0.936	79%	0.794	S	S	*	*				-164.2	144.2	114.9	-105.2	171.2	-166.8	-168.1	3.1	111.6
459	S	30.3	Very low	34	Very low	112 Å²	112	143.2 Å²	143.2	78%	0.783	79%	0.791	S	S	*	*			trans	-130.1	139.2	179.7	43.9	0	0	0	0	111.3
460	V	33.3	Very low	33.6	Very low	139 Å²	139	143.8 Å²	143.8	84%	0.842	79%	0.792	S	S	*	*			trans	-147.7	99.4	173.2	-177.6	0	0	0	0	104.3
461	A	28.4	Very low	33.6	Very low	91 Å²	91	137.7 Å²	137.7	75%	0.752	78%	0.78	S	S	*	*				80	102.9	70.1	0	0	0	0	0	113.7
462	C	29.4	Very low	33.1	Very low	137 Å²	137	136.3 Å²	136.3	93%	0.926	78%	0.775	S	S	*	*			trans	-170.5	138.8	135.9	-107.1	0	0	0	0	111.2
463	E	29.3	Very low	33	Very low	175 Å²	175	134.9 Å²	134.9	82%	0.818	77%	0.765	S	S	*	*			trans	-108.9	-177.7	175.8	-84.4	-79.5	138.2	0	0	108.6
464	P	47.7	Very low	32.8	Very low	104 Å²	104	134.8 Å²	134.8	68%	0.675	77%	0.765	S	S	*	*			cis	-134.1	-175.5	4.2	39.9	-21.4	0	0	0	115.4
465	V	31.4	Very low	32.6	Very low	115 Å²	115	133.1 Å²	133.1	70%	0.697	75%	0.752	S	S	*	*				-178.2	119.4	114.5	152.8	0	0	0	0	110.9
466	E	31.6	Very low	31.8	Very low	182 Å²	182	133 Å²	133	85%	0.85	75%	0.749	S	S	*	*			trans	29.9	141.4	144.5	-52.6	-172.1	139.7	0	0	121.8
467	A	31.8	Very low	31.8	Very low	81 Å²	81	135.6 Å²	135.6	67%	0.669	76%	0.756	S	S	*	*			cis	-166.4	153	0.8	0	0	0	0	0	113.7
468	L	31.5	Very low	31.6	Very low	157 Å²	157	134.2 Å²	134.2	82%	0.822	76%	0.759	S	S	*	*			trans	55.6	102.7	153.7	-58.2	172	0	0	0	118.8
469	S	29.6	Very low	31.7	Very low	95 Å²	95	128.9 Å²	128.9	66%	0.664	75%	0.754	S	S	*	*				77.6	137.2	72	76.1	0	0	0	0	115
470	V	31.3	Very low	32.5	Very low	129 Å²	129	129.1 Å²	129.1	78%	0.782	75%	0.753	S	S	*	*				-164.7	131.9	76.2	154.4	0	0	0	0	113.2
471	A	30.3	Very low	32.4	Very low	78 Å²	78	127.6 Å²	127.6	65%	0.645	75%	0.748	S	S	*	*			trans	49.6	153.3	142.7	0	0	0	0	0	124.1
472	R	31.8	Very low	32.6	Very low	220 Å²	220	131 Å²	131	83%	0.83	75%	0.753	S	S	*	*			cis	-169.5	142	-12.1	-106.3	168.4	-171.3	164.9	1.6	110.9
473	K	30.5	Very low	32.7	Very low	154 Å²	154	131 Å²	131	67%	0.67	75%	0.748	S	S	*	*			trans	59.1	153.2	145.3	-61.3	-174.8	159	-127.9	0	120.2	E475	K473-E475 WeakPolarHBondContact CB-OE2 3.44Å; K473-E475 WeakPolarHBondContact CD-OE2 3.39Å; K473-E475 WeakPolarHBondContact CG-OE2 3.27Å; K473-E475 IonicContact NZ-OE1 2.78Å; K473-E475 PolarHBondContact NZ-OE1 3.32Å; K473-E475 IonicContact NZ-OE2 3.48Å; K473-E475 PolarHBondContact NZ-OE2 3.45Å
474	S	29.3	Very low	32.7	Very low	100 Å²	100	128.1 Å²	128.1	70%	0.699	75%	0.747	S	S	*	*			cis	72.5	158.5	22.4	67	0	0	0	0	115.8
475	E	30.3	Very low	32	Very low	121 Å²	121	127.4 Å²	127.4	57%	0.565	75%	0.751	S	S	*	*			cis	-145	160.5	17.5	-66.9	88	100.5	0	0	109.4	K473	K473-E475 WeakPolarHBondContact CB-OE2 3.44Å; K473-E475 WeakPolarHBondContact CD-OE2 3.39Å; K473-E475 WeakPolarHBondContact CG-OE2 3.27Å; K473-E475 IonicContact NZ-OE1 2.78Å; K473-E475 PolarHBondContact NZ-OE1 3.32Å; K473-E475 IonicContact NZ-OE2 3.48Å; K473-E475 PolarHBondContact NZ-OE2 3.45Å
476	T	32.7	Very low	32	Very low	113 Å²	113	129.6 Å²	129.6	69%	0.693	76%	0.758	S	S	*	*			cis	-174.7	160	-21.4	36.8	0	0	0	0	112.3
477	N	29.7	Very low	32	Very low	151 Å²	151	125.9 Å²	125.9	81%	0.807	75%	0.751	S	S	*	*			trans	77.8	165.4	163.2	-51.5	-36.1	0	0	0	119.8
478	S	30.2	Very low	31.9	Very low	116 Å²	116	128.6 Å²	128.6	81%	0.811	76%	0.76	S	S	*	*			cis	-157.3	174.4	25.1	-55.1	0	0	0	0	115.5
479	V	34.3	Very low	32.8	Very low	137 Å²	137	126.4 Å²	126.4	83%	0.83	76%	0.755	S	S	*	*			trans	-135.8	164	168.5	-153.2	0	0	0	0	109.8
480	P	48.3	Very low	32.7	Very low	116 Å²	116	128.6 Å²	128.6	75%	0.753	76%	0.764	S	S	*	*				-158.9	159.2	108.5	39.7	-20.8	0	0	0	119.7
481	S	31.7	Very low	32.6	Very low	108 Å²	108	130 Å²	130	76%	0.755	76%	0.764	S	S	*	*			trans	64.4	156.9	152.8	-102.9	0	0	0	0	120.7
482	L	32.5	Very low	32.6	Very low	162 Å²	162	133.8 Å²	133.8	85%	0.848	77%	0.768	S	S	*	*			cis	-131.9	170.2	25.4	-71.1	165.6	0	0	0	115
483	V	30.6	Very low	33	Very low	137 Å²	137	128.7 Å²	128.7	83%	0.83	76%	0.764	S	S	*	*			trans	-149.9	142.9	-177	175.9	0	0	0	0	112.8
484	S	30.6	Very low	33	Very low	114 Å²	114	125.5 Å²	125.5	80%	0.797	77%	0.766	S	S	*	*			trans	152.8	140.8	153	-73.5	0	0	0	0	111.2
485	A	31.2	Very low	33.1	Very low	90 Å²	90	130.5 Å²	130.5	74%	0.744	78%	0.775	S	S	*	*			cis	102.9	142	32	0	0	0	0	0	112.7
486	L	32.6	Very low	33.1	Very low	161 Å²	161	129.1 Å²	129.1	84%	0.843	78%	0.779	S	S	*	*			cis	-168	177.3	1.8	-124.1	175.7	0	0	0	113
487	S	30.9	Very low	33.1	Very low	103 Å²	103	131.6 Å²	131.6	72%	0.72	78%	0.783	S	S	*	*			trans	89.9	159.7	150.3	-61	0	0	0	0	124.4
488	V	29.8	Very low	33.1	Very low	139 Å²	139	128.7 Å²	128.7	84%	0.842	78%	0.779	S	S	*	*			trans	-157.7	-170.2	-174.9	-65.7	0	0	0	0	109.4
489	P	50.8	Low	33.1	Very low	111 Å²	111	128.1 Å²	128.1	72%	0.721	78%	0.782	S	S	*	*			cis	-133.8	-158.8	-8.5	44.9	-25.8	0	0	0	114
490	T	26.9	Very low	32.8	Very low	140 Å²	140	125.3 Å²	125.3	86%	0.859	78%	0.78	S	S	*	*			trans	-176	-179.1	152.8	-77.8	0	0	0	0	112.9
491	M	28.9	Very low	32	Very low	159 Å²	159	123.9 Å²	123.9	78%	0.783	78%	0.778	S	S	*	*			trans	-132.1	156.8	-154.5	-69.3	-103.2	83.9	0	0	118.9
492	Q	30.9	Very low	32.1	Very low	157 Å²	157	125.8 Å²	125.8	73%	0.734	78%	0.779	S	S	*	*			trans	66.7	160.8	143.8	-78.1	-86.1	-50.1	0	0	119.1
493	P	41.1	Very low	31.9	Very low	114 Å²	114	124.6 Å²	124.6	74%	0.74	77%	0.774	S	S	*	*			cis	-105	-147.2	22.6	29.8	-8.5	0	0	0	113.8
494	A	30	Very low	31.9	Very low	87 Å²	87	123.8 Å²	123.8	72%	0.719	77%	0.769	S	S	*	*			cis	-155.8	-153.9	11.3	0	0	0	0	0	115
495	K	31.8	Very low	31.9	Very low	204 Å²	204	128.9 Å²	128.9	89%	0.887	77%	0.771	S	S	*	*			trans	-150.7	168.1	-171.8	-54.7	175.8	-173.9	174.1	0	109.1
496	S	29.9	Very low	31.8	Very low	92 Å²	92	130.1 Å²	130.1	64%	0.643	77%	0.774	S	S	*	*			cis	-152.4	175	-7	28.9	0	0	0	0	106.8
497	H	32.1	Very low	31.6	Very low	166 Å²	166	126.9 Å²	126.9	77%	0.769	77%	0.771	S	S	*	*			cis	-153.8	156.3	46.2	-78.5	-100	0	0	0	108.9
498	A	30.6	Very low	31.6	Very low	89 Å²	89	127.3 Å²	127.3	74%	0.736	77%	0.774	S	S	*	*				62.1	129.8	63.8	0	0	0	0	0	114
499	A	30.2	Very low	31.4	Very low	105 Å²	105	126.2 Å²	126.2	87%	0.868	77%	0.772	S	S	*	*			cis	-164	169.5	-3	0	0	0	0	0	112.7
500	G	27.6	Very low	31.2	Very low	77 Å²	77	125.9 Å²	125.9	79%	0.794	77%	0.77	S	S	*	*			trans	100.2	150.6	159.1	0	0	0	0	0	117.1
501	A	31	Very low	31.4	Very low	86 Å²	86	125.4 Å²	125.4	71%	0.711	77%	0.767	S	S	*	*			cis	-162.1	137	-9.4	0	0	0	0	0	113.2
502	L	32.9	Very low	32.1	Very low	149 Å²	149	123.7 Å²	123.7	78%	0.78	77%	0.767	S	S	*	*			trans	63.3	126.1	147	-59.7	172.6	0	0	0	119.1
503	N	28.8	Very low	31.8	Very low	136 Å²	136	119.7 Å²	119.7	73%	0.727	77%	0.769	S	S	*	*				64.3	139.3	74.6	-79.6	-21.4	0	0	0	113.4
504	T	31.6	Very low	31.2	Very low	121 Å²	121	119.6 Å²	119.6	74%	0.742	77%	0.77	S	S	*	*			cis	-140.5	150.2	13.2	34.3	0	0	0	0	110.7
505	R	30.1	Very low	31.1	Very low	221 Å²	221	121.8 Å²	121.8	83%	0.834	77%	0.77	S	S	*	*				58.9	115.9	73.3	-90.5	-174.1	177.1	-121.8	0.8	117.2
506	S	28.5	Very low	31	Very low	116 Å²	116	119 Å²	119	81%	0.811	76%	0.76	S	S	*	*			trans	69.4	146.6	148.8	-56.4	0	0	0	0	119.8
507	A	29.2	Very low	30.9	Very low	93 Å²	93	123.5 Å²	123.5	77%	0.769	77%	0.768	S	S	*	*			cis	-117.9	-113.7	-2.7	0	0	0	0	0	113.2
508	S	30.5	Very low	30.7	Very low	112 Å²	112	118.7 Å²	118.7	78%	0.783	76%	0.757	S	S	*	*			cis	-154.7	171.2	5.5	-59.3	0	0	0	0	111.5
509	S	26.4	Very low	30.5	Very low	115 Å²	115	122.6 Å²	122.6	80%	0.804	76%	0.76	S	S	*	*			trans	-165	179.2	179.3	-119.9	0	0	0	0	109.3
510	P	47.2	Very low	30.4	Very low	105 Å²	105	123.9 Å²	123.9	68%	0.682	75%	0.752	S	S	*	*			cis	-143.1	-162.7	-16.2	29	-2.8	0	0	0	114.6
511	V	29.7	Very low	30.3	Very low	130 Å²	130	125 Å²	125	79%	0.788	75%	0.748	S	S	*	*			trans	73.4	175	153.4	-109.3	0	0	0	0	121.4
512	P	44.4	Very low	30.2	Very low	122 Å²	122	127.5 Å²	127.5	79%	0.792	75%	0.748	S	S	*	*				-140.6	-162.7	-124.8	49.7	-28.3	0	0	0	117.3
513	G	24.6	Very low	30	Very low	74 Å²	74	128.1 Å²	128.1	76%	0.763	75%	0.747	S	S	*	*			trans	87.5	169.6	161.6	0	0	0	0	0	114.9
514	S	27.1	Very low	29.9	Very low	111 Å²	111	129.8 Å²	129.8	78%	0.776	75%	0.75	S	S	*	*			cis	-163.6	-178.9	-13.1	-165.8	0	0	0	0	109.1
515	L	29.8	Very low	29.7	Very low	134 Å²	134	131.9 Å²	131.9	70%	0.702	75%	0.754	S	S	*	*			trans	69.3	108.5	161.4	-60.1	169.9	0	0	0	120.7
516	Q	29.7	Very low	29.6	Very low	145 Å²	145	127.1 Å²	127.1	68%	0.678	75%	0.754	S	S	*	*				63.8	149.6	118.6	-64.7	-178.4	-28.9	0	0	123.9
517	F	27.1	Very low	29.5	Very low	186 Å²	186	126.2 Å²	126.2	82%	0.816	75%	0.748	S	S	*	*			trans	65	155.2	164.9	-58.2	-68.3	0	0	0	117.6
518	A	26.8	Very low	29.4	Very low	65 Å²	65	128.8 Å²	128.8	54%	0.537	75%	0.747	S	S	.	*			cis	179.9	163.9	-37.1	0	0	0	0	0	106.7
519	H	27.6	Very low	29.1	Very low	172 Å²	172	132 Å²	132	80%	0.796	75%	0.749	S	S	*	*			trans	66.4	143.7	179	-60.3	-78.9	0	0	0	114.2
520	N	27.9	Very low	29.2	Very low	131 Å²	131	137 Å²	137	70%	0.701	75%	0.752	S	S	*	*			cis	-142.7	145.2	-6.5	-96.7	-17.4	0	0	0	105.9
521	S	25.3	Very low	30	Very low	102 Å²	102	137.3 Å²	137.3	71%	0.713	75%	0.754	S	S	*	*			cis	69	129.9	43.4	-160.7	0	0	0	0	112.1
522	L	29	Very low	31.1	Very low	138 Å²	138	135.8 Å²	135.8	72%	0.723	75%	0.747	S	S	*	*			cis	-169	-177.4	-17.1	-167.9	64.1	0	0	0	105.4
523	E	28.4	Very low	30.4	Very low	161 Å²	161	136.9 Å²	136.9	75%	0.752	75%	0.745	S	S	*	*			trans	70.5	156.1	154.7	-68.6	-165.8	-160.6	0	0	119.3
524	H	28.1	Very low	30.9	Very low	171 Å²	171	140.2 Å²	140.2	79%	0.792	74%	0.744	S	S	*	*			cis	-155.8	-174.6	-37	-144.1	-109.5	0	0	0	109.5
525	M	27.1	Very low	31.1	Very low	166 Å²	166	140.9 Å²	140.9	82%	0.818	74%	0.743	S	S	*	*			trans	-69.9	142.8	-176.5	-61.9	-170.5	73.6	0	0	116
526	S	26.7	Very low	31.3	Very low	121 Å²	121	139.6 Å²	139.6	85%	0.846	74%	0.741	S	S	*	*			trans	162	171.4	134.8	47.7	0	0	0	0	110.6
527	S	27.9	Very low	31.4	Very low	96 Å²	96	139.3 Å²	139.3	67%	0.671	75%	0.745	S	S	*	*			cis	-179.1	153.4	-43.1	-166.3	0	0	0	0	107.7
528	I	25.6	Very low	31.9	Very low	147 Å²	147	134.8 Å²	134.8	75%	0.754	74%	0.736	S	S	*	*			trans	73.5	155.3	160.3	-68	151.2	0	0	0	119
529	Q	24.7	Very low	32.3	Very low	179 Å²	179	140.7 Å²	140.7	84%	0.836	75%	0.752	S	S	*	*			trans	89.6	97.9	159.8	-97	161.2	-20.2	0	0	122.6
530	Y	27.5	Very low	32.5	Very low	221 Å²	221	135.6 Å²	135.6	87%	0.867	75%	0.746	S	S	*	*			trans	-79.6	177.5	143.3	-85.4	-98.2	0	0	0	110.5
531	P	65.8	Low	32.7	Very low	111 Å²	111	134.3 Å²	134.3	72%	0.721	75%	0.753	S	S	*	*			cis	-119.2	-128.5	-15.7	32.3	-9	0	0	0	108.2
532	P	52.7	Low	33.1	Very low	98 Å²	98	134.4 Å²	134.4	64%	0.636	75%	0.754	S	S	*	*			cis	-131.4	-153.2	-29.3	30.9	-6.3	0	0	0	112.6
533	I	29.8	Very low	33.1	Very low	146 Å²	146	134 Å²	134	75%	0.749	76%	0.757	S	S	*	*			trans	74	128.5	156.7	-69.2	164.1	0	0	0	116.8
534	L	34.4	Very low	33	Very low	143 Å²	143	131.7 Å²	131.7	75%	0.749	75%	0.754	S	S	*	*			cis	-164	145.4	-9.5	-101.8	178.1	0	0	0	110.2
535	V	31.3	Very low	32.9	Very low	125 Å²	125	133 Å²	133	76%	0.758	75%	0.754	S	S	*	*			trans	59.4	142.1	138.5	165.6	0	0	0	0	119.1
536	T	34.2	Very low	32.9	Very low	107 Å²	107	128.7 Å²	128.7	66%	0.656	74%	0.74	S	S	*	*			cis	-140.4	154.1	35.8	55.7	0	0	0	0	115.8
537	N	31.7	Very low	33	Very low	140 Å²	140	130.2 Å²	130.2	75%	0.749	73%	0.734	S	S	*	*			trans	60	146.3	143.1	-64.1	6.1	0	0	0	120.1
538	S	36.8	Very low	32.9	Very low	90 Å²	90	132.8 Å²	132.8	63%	0.629	74%	0.735	S	S	*	*			cis	176.4	144.9	-7.8	46.9	0	0	0	0	107.1
539	H	35.9	Very low	33.4	Very low	189 Å²	189	135.4 Å²	135.4	88%	0.875	74%	0.741	S	S	*	*			cis	-156.1	178.4	-7.8	-77.1	-44.7	0	0	0	105.5
540	G	31.4	Very low	33.9	Very low	65 Å²	65	132.6 Å²	132.6	67%	0.67	74%	0.739	S	S	*	*			cis	161.6	175.4	0.5	0	0	0	0	0	110.1
541	A	32.9	Very low	34.1	Very low	104 Å²	104	131.5 Å²	131.5	86%	0.86	74%	0.738	S	S	*	*			trans	64.9	136.1	-176.9	0	0	0	0	0	116.8
542	S	32.3	Very low	32.2	Very low	105 Å²	105	135.7 Å²	135.7	73%	0.734	74%	0.741	S	S	*	*			cis	-161.5	131.4	-11.8	51	0	0	0	0	113.4
543	V	28.8	Very low	30.9	Very low	129 Å²	129	137 Å²	137	78%	0.782	74%	0.743	S	S	*	*			trans	63.3	106.6	145.4	178.1	0	0	0	0	118.2
544	T	26.4	Very low	31	Very low	113 Å²	113	135.1 Å²	135.1	69%	0.693	74%	0.743	S	S	*	*				55.3	148.6	88.9	24.1	0	0	0	0	116.5
545	Y	27.4	Very low	30.7	Very low	199 Å²	199	134.7 Å²	134.7	78%	0.78	75%	0.746	S	S	*	*			cis	-147	140.6	29.1	-148.7	-109.3	0	0	0	109.2
546	S	27.7	Very low	30.6	Very low	75 Å²	75	133 Å²	133	52%	0.524	74%	0.74	S	S	.	*				52.7	146.4	83.2	-7	0	0	0	0	115.4
547	E	27.7	Very low	30.4	Very low	152 Å²	152	134 Å²	134	71%	0.71	74%	0.741	S	S	*	*			cis	-165.2	-174.3	-4.4	-142.5	-168	131.3	0	0	111.3
548	Q	26.4	Very low	30.4	Very low	151 Å²	151	135.6 Å²	135.6	71%	0.706	74%	0.744	S	S	*	*			trans	70.2	139.7	157.6	-116.7	85.9	85.8	0	0	122.2
549	F	36.1	Very low	30.1	Very low	201 Å²	201	134.6 Å²	134.6	88%	0.882	75%	0.748	S	S	*	*			trans	-87.2	154.2	156.5	-85.2	-95.5	0	0	0	110.9
550	P	35.6	Very low	29.6	Very low	121 Å²	121	135.6 Å²	135.6	79%	0.786	75%	0.745	S	S	*	*			trans	-129.5	-177.5	130.9	37.8	-29.1	0	0	0	113.2
551	K	29.7	Very low	29.6	Very low	197 Å²	197	141.8 Å²	141.8	86%	0.857	75%	0.75	S	S	*	*			trans	-106.9	174.4	175.7	-66.3	178	175.8	178.9	0	111.1
552	Y	27.1	Very low	29.6	Very low	200 Å²	200	141.1 Å²	141.1	78%	0.784	74%	0.739	S	S	*	*			trans	109.3	139.7	147	-117.8	-98.4	0	0	0	119.3
553	D	24.1	Very low	29.7	Very low	124 Å²	124	143.9 Å²	143.9	66%	0.663	74%	0.744	S	S	*	*			trans	21.9	117	171.7	-65.5	-9.3	0	0	0	124.2
554	S	33.8	Very low	29.6	Very low	108 Å²	108	146 Å²	146	76%	0.755	75%	0.745	S	S	*	*				20.9	116.7	113	170.7	0	0	0	0	119.8
555	V	28	Very low	29.8	Very low	133 Å²	133	144.3 Å²	144.3	81%	0.806	74%	0.738	S	S	*	*				-162	145.2	124.5	-101.1	0	0	0	0	113.6
556	S	28.7	Very low	29.9	Very low	91 Å²	91	141 Å²	141	64%	0.636	73%	0.734	S	S	*	*			trans	39.8	115.5	147.7	67.1	0	0	0	0	123.1
557	D	29.6	Very low	29.8	Very low	127 Å²	127	146.7 Å²	146.7	68%	0.679	75%	0.75	S	S	*	*				76.9	133	118.9	-67.6	-44.1	0	0	0	125.6
558	H	32.2	Very low	30.1	Very low	174 Å²	174	144 Å²	144	81%	0.806	75%	0.747	S	S	*	*			trans	55.8	118.7	143.3	-53.3	-5.4	0	0	0	118.6
559	G	29.3	Very low	30.2	Very low	69 Å²	69	144.2 Å²	144.2	71%	0.711	75%	0.753	S	S	*	*			cis	126	152.8	0.7	0	0	0	0	0	112.3
560	Y	27.2	Very low	29.8	Very low	209 Å²	209	143 Å²	143	82%	0.82	75%	0.752	S	S	*	*			trans	-166	126.5	166.1	-133.3	-123.8	0	0	0	112.6
561	Y	31.4	Very low	29.3	Very low	196 Å²	196	141.9 Å²	141.9	77%	0.769	75%	0.748	S	S	*	*			trans	61.3	144.3	161.7	-81.3	-120.7	0	0	0	119.5
562	S	31.8	Very low	29.2	Very low	90 Å²	90	140.5 Å²	140.5	63%	0.629	75%	0.746	S	S	*	*			cis	-165.3	161.6	-22	-155.6	0	0	0	0	111.6
563	L	33.9	Very low	29.1	Very low	163 Å²	163	136.1 Å²	136.1	85%	0.853	75%	0.745	S	S	*	*			trans	63.6	91.4	167.8	-55.6	-175.1	0	0	0	118.8
564	H	28.8	Very low	29.2	Very low	173 Å²	173	135.2 Å²	135.2	80%	0.801	75%	0.748	S	S	*	*			trans	-63.6	145.6	148	-99.8	-103.9	0	0	0	111
565	S	29.6	Very low	29	Very low	78 Å²	78	136.7 Å²	136.7	55%	0.545	75%	0.745	S	S	.	*				63.8	148.2	87.9	96	0	0	0	0	114.6
566	D	29.1	Very low	29	Very low	130 Å²	130	137.5 Å²	137.5	70%	0.695	74%	0.74	S	S	*	*			cis	-127.3	-156.6	5.4	-68.4	-85.4	0	0	0	111.5
567	F	26.6	Very low	28.8	Very low	194 Å²	194	138.8 Å²	138.8	85%	0.851	74%	0.739	S	S	*	*				-155.7	158.4	66.1	-90.2	-81	0	0	0	114.7
568	S	33.6	Very low	28.9	Very low	94 Å²	94	137.7 Å²	137.7	66%	0.657	74%	0.737	S	S	*	*			trans	-141.4	166.4	155.7	-74.8	0	0	0	0	108.9
569	N	27.8	Very low	28.7	Very low	156 Å²	156	135.9 Å²	135.9	83%	0.834	73%	0.734	S	S	*	*			trans	76	152	-179.5	-39.1	-50.6	0	0	0	113.9
570	M	28.4	Very low	28.6	Very low	175 Å²	175	136.3 Å²	136.3	86%	0.862	73%	0.725	S	S	*	*			cis	-143	157.2	12.1	-81.6	-164.6	87.7	0	0	114.8
571	S	24.9	Very low	28.7	Very low	98 Å²	98	135.2 Å²	135.2	69%	0.685	73%	0.725	S	S	*	*			trans	48.7	123.6	135.6	-160.5	0	0	0	0	124.4
572	M	27.8	Very low	28.5	Very low	169 Å²	169	131 Å²	131	83%	0.833	72%	0.723	S	S	*	*			trans	8.5	137.3	143.8	-53	-172.9	71.6	0	0	121.7
573	S	25.5	Very low	28.2	Very low	107 Å²	107	130.7 Å²	130.7	75%	0.748	72%	0.721	S	S	*	*				179.4	151.4	105.3	-77.5	0	0	0	0	116
574	S	26.4	Very low	27.8	Very low	106 Å²	106	129.8 Å²	129.8	74%	0.741	71%	0.714	S	S	*	*			trans	75.7	117.7	141.1	-76.1	0	0	0	0	125.5
575	M	28.2	Very low	27.8	Very low	139 Å²	139	128 Å²	128	69%	0.685	71%	0.706	S	S	*	*				85.9	116.9	122.2	-59.9	-90.7	79.7	0	0	122.7
576	H	28.6	Very low	27.7	Very low	149 Å²	149	132.2 Å²	132.2	69%	0.69	72%	0.717	S	S	*	*			trans	57.1	158.9	145.4	-62.2	-67.1	0	0	0	119.9
577	N	25.3	Very low	27.5	Very low	118 Å²	118	132.6 Å²	132.6	63%	0.631	72%	0.715	S	S	*	*			cis	-138.3	131.5	0.7	-147.5	34.7	0	0	0	108.7
578	V	29.9	Very low	27.6	Very low	104 Å²	104	130.7 Å²	130.7	63%	0.63	71%	0.708	S	S	*	*				28.2	110.2	98.6	-158	0	0	0	0	115.1
579	D	28.9	Very low	27.5	Very low	137 Å²	137	133.3 Å²	133.3	73%	0.733	72%	0.72	S	S	*	*				169.9	150.2	125.7	-93.5	-25.3	0	0	0	111.7
580	S	28.2	Very low	27.7	Very low	77 Å²	77	135 Å²	135	54%	0.538	72%	0.716	S	S	.	*			cis	-172	-177.3	-27.4	-115.7	0	0	0	0	111.3
581	F	29	Very low	27.7	Very low	186 Å²	186	135.1 Å²	135.1	82%	0.816	71%	0.714	S	S	*	*			trans	88.6	115.1	169.7	-67.1	-94.5	0	0	0	116.1
582	C	25.4	Very low	27.9	Very low	108 Å²	108	139.9 Å²	139.9	73%	0.73	72%	0.717	S	S	*	*			cis	87.6	146.2	46.9	-77.1	0	0	0	0	112.6
583	S	25.9	Very low	28.2	Very low	84 Å²	84	137.5 Å²	137.5	59%	0.587	71%	0.712	S	S	*	*			cis	-168.9	170.1	-16	-166.6	0	0	0	0	108.3
584	M	26.7	Very low	29.4	Very low	144 Å²	144	137.9 Å²	137.9	71%	0.709	71%	0.712	S	S	*	*			trans	65.9	152.9	154	-72.3	138.9	77.9	0	0	115.7
585	E	27.6	Very low	29.4	Very low	134 Å²	134	138 Å²	138	63%	0.626	71%	0.713	S	S	*	*			cis	-157.5	149.3	4.2	-133.5	153.3	-159.2	0	0	110.2
586	H	28.2	Very low	29.4	Very low	167 Å²	167	140.1 Å²	140.1	77%	0.773	72%	0.721	S	S	*	*			trans	51.7	163.4	138.5	-78.2	-152	0	0	0	120.3
587	E	24.9	Very low	29.3	Very low	138 Å²	138	138.6 Å²	138.6	65%	0.645	73%	0.726	S	S	*	*			cis	-151.9	177.4	-3.2	-124.9	-93	70.6	0	0	109.4
588	H	28.8	Very low	30.7	Very low	154 Å²	154	137.8 Å²	137.8	71%	0.713	73%	0.727	S	S	*	*			trans	-81.4	164.6	-178.2	-67.1	-108.5	0	0	0	114.2
589	V	31.3	Very low	30.6	Very low	149 Å²	149	141.1 Å²	141.1	90%	0.903	74%	0.736	S	S	*	*			trans	-124.6	136.9	162.7	178.9	0	0	0	0	109.8
590	Y	31.1	Very low	30.7	Very low	193 Å²	193	138.7 Å²	138.7	76%	0.757	73%	0.729	S	S	*	*			trans	-98.7	153	-166.1	-90.5	-104.6	0	0	0	115.1
591	Q	28.3	Very low	30.8	Very low	176 Å²	176	139.8 Å²	139.8	82%	0.822	74%	0.736	S	S	*	*				-176.8	138.1	126.2	-99.2	170.2	44	0	0	110.7
592	R	30	Very low	31.1	Very low	199 Å²	199	138.3 Å²	138.3	75%	0.751	74%	0.735	S	S	*	*			cis	-166.5	127.2	-12.9	-138.7	-168.2	-168.9	170.2	3.5	113.1
593	T	34	Very low	31.3	Very low	118 Å²	118	136.8 Å²	136.8	72%	0.724	73%	0.726	S	S	*	*			trans	58.2	163.9	139.7	46	0	0	0	0	123
594	P	50.5	Low	31.6	Very low	115 Å²	115	141.1 Å²	141.1	75%	0.747	74%	0.737	S	S	*	*			cis	-138.1	157.7	-21.8	33.2	-14.8	0	0	0	116.6
595	S	26.1	Very low	31.7	Very low	110 Å²	110	139.3 Å²	139.3	77%	0.769	74%	0.738	S	S	*	*				169.1	121.8	121.7	62.5	0	0	0	0	116.1
596	H	28.1	Very low	31.7	Very low	183 Å²	183	140.4 Å²	140.4	85%	0.847	75%	0.748	S	S	*	*			trans	27.9	104.8	150.1	-64.7	-87.7	0	0	0	123.9
597	C	27.1	Very low	31.8	Very low	116 Å²	116	137.5 Å²	137.5	78%	0.784	75%	0.747	S	S	*	*				10.4	163.3	110.5	-71.6	0	0	0	0	122.5
598	P	54.7	Low	31.9	Very low	101 Å²	101	138.1 Å²	138.1	66%	0.656	76%	0.755	S	S	*	*			cis	-147.3	-161.5	-18.7	38.7	-15.8	0	0	0	116.4
599	E	28.4	Very low	32.6	Very low	175 Å²	175	136.4 Å²	136.4	82%	0.818	76%	0.76	S	S	*	*			trans	79.7	150.2	150	-76.8	-174.8	111.7	0	0	121.2
600	S	29.6	Very low	32.4	Very low	86 Å²	86	139.7 Å²	139.7	60%	0.601	76%	0.762	S	S	*	*			cis	-157.2	148.1	-8.4	-126.6	0	0	0	0	115.4
601	C	31.6	Very low	32.5	Very low	100 Å²	100	135.1 Å²	135.1	68%	0.676	76%	0.759	S	S	*	*			trans	45.7	128.7	138.5	-65.6	0	0	0	0	126.9
602	L	35.4	Very low	32.6	Very low	154 Å²	154	131.6 Å²	131.6	81%	0.806	75%	0.754	S	S	*	*				52.3	153.4	116.3	-51.5	171	0	0	0	121.6
603	S	29.6	Very low	32.6	Very low	76 Å²	76	133.3 Å²	133.3	53%	0.531	76%	0.762	S	S	.	*			cis	-178.7	175.1	-17.6	-90.2	0	0	0	0	110.8
604	H	31.2	Very low	32.4	Very low	176 Å²	176	131.1 Å²	131.1	82%	0.815	76%	0.763	S	S	*	*			trans	76.6	153.3	160.5	-51.9	-56.9	0	0	0	117.9
605	S	28.8	Very low	31.6	Very low	106 Å²	106	134 Å²	134	74%	0.741	77%	0.766	S	S	*	*			cis	-163.5	175.1	-13	-100.7	0	0	0	0	111.4
606	N	28.9	Very low	32	Very low	156 Å²	156	136.3 Å²	136.3	83%	0.834	77%	0.769	S	S	*	*			trans	-82.9	152.4	-169.4	-52.3	-16.1	0	0	0	116.4
607	S	29.5	Very low	32.4	Very low	107 Å²	107	137.8 Å²	137.8	75%	0.748	77%	0.769	S	S	*	*				153.9	132.8	107.5	54.2	0	0	0	0	117
608	D	27.7	Very low	33.8	Very low	150 Å²	150	137.5 Å²	137.5	80%	0.802	77%	0.766	S	S	*	*			trans	55	102.4	144.1	-52.5	-20.2	0	0	0	125.9
609	S	42.8	Very low	32.6	Very low	118 Å²	118	137.6 Å²	137.6	83%	0.825	77%	0.768	S	S	*	*				48.3	117.3	121.2	-55.6	0	0	0	0	124.6
610	F	27.1	Very low	33	Very low	218 Å²	218	133.8 Å²	133.8	96%	0.956	76%	0.761	S	S	*	*			trans	-150.7	-178	145.1	-150.9	-107	0	0	0	112.4
611	S	33	Very low	33.2	Very low	97 Å²	97	135.7 Å²	135.7	68%	0.678	77%	0.769	S	S	*	*			trans	-129.6	147.8	-148.1	-166.4	0	0	0	0	119.4
612	S	29.9	Very low	33.2	Very low	102 Å²	102	137.8 Å²	137.8	71%	0.713	77%	0.774	S	S	*	*			trans	65.5	125.3	145.9	-164.7	0	0	0	0	123.7
613	Y	30.6	Very low	32.9	Very low	236 Å²	236	134.8 Å²	134.8	93%	0.925	77%	0.765	S	S	*	*				-156.7	161.6	116	-129.7	-98.2	0	0	0	111.8
614	G	29.7	Very low	33	Very low	72 Å²	72	136.5 Å²	136.5	74%	0.742	78%	0.777	S	S	*	*			trans	-81.7	-158.1	-166.8	0	0	0	0	0	117.4
615	E	33.6	Very low	33.1	Very low	174 Å²	174	134.6 Å²	134.6	81%	0.813	77%	0.772	S	S	*	*			cis	-165	152	2.6	-173.8	179.9	-125.2	0	0	110.5
616	L	34.3	Very low	33.2	Very low	160 Å²	160	137.3 Å²	137.3	84%	0.838	77%	0.773	S	S	*	*			trans	160.1	155.7	134	-83.5	169.9	0	0	0	114.7
617	Y	37.3	Very low	33.3	Very low	213 Å²	213	137 Å²	137	84%	0.835	77%	0.767	S	S	*	*			trans	-96.9	174.9	-165.4	-103.1	-114.6	0	0	0	114.4
618	P	56.2	Low	33.5	Very low	111 Å²	111	135.9 Å²	135.9	72%	0.721	76%	0.759	S	S	*	*			cis	-120.3	-163.5	-0.4	44.7	-30.7	0	0	0	112.2
619	S	30.2	Very low	33.8	Very low	102 Å²	102	135.2 Å²	135.2	71%	0.713	75%	0.754	S	S	*	*			cis	-146	-124.1	8.5	-149.2	0	0	0	0	115.9
620	S	36.3	Very low	33.3	Very low	96 Å²	96	138.6 Å²	138.6	67%	0.671	75%	0.754	S	S	*	*			trans	-158.3	167.8	-139.9	55.5	0	0	0	0	113.2
621	V	33.5	Very low	33.4	Very low	125 Å²	125	133.1 Å²	133.1	76%	0.758	74%	0.738	S	S	*	*			cis	-134.8	149.5	21.8	-74.3	0	0	0	0	110.2
622	D	31.2	Very low	33.3	Very low	145 Å²	145	135.4 Å²	135.4	78%	0.775	74%	0.738	S	S	*	*				65.3	126.1	81.2	-136.1	-1.7	0	0	0	113.7
623	S	30.1	Very low	33.5	Very low	90 Å²	90	136.8 Å²	136.8	63%	0.629	73%	0.733	S	S	*	*			cis	-151.6	159.4	14.4	-49	0	0	0	0	115.1
624	S	30.6	Very low	33.4	Very low	112 Å²	112	133.5 Å²	133.5	78%	0.783	73%	0.726	S	S	*	*			trans	57.6	147.8	135.7	-81	0	0	0	0	123.5
625	L	34.5	Very low	33.4	Very low	136 Å²	136	134.5 Å²	134.5	71%	0.712	73%	0.727	S	S	*	*			cis	-164.8	146.5	-3.4	-166.4	69.9	0	0	0	111.6
626	E	31.3	Very low	34.3	Very low	163 Å²	163	131.9 Å²	131.9	76%	0.762	73%	0.725	S	S	*	*			trans	27.6	164.3	151.8	-65.1	178.8	133.2	0	0	123.8
627	E	30.4	Very low	34.2	Very low	150 Å²	150	128.4 Å²	128.4	70%	0.701	72%	0.72	S	S	*	*			cis	-165.1	172.8	-8.6	-106	-108.6	114.7	0	0	105.7
628	S	32.8	Very low	34.3	Very low	84 Å²	84	127.2 Å²	127.2	59%	0.587	72%	0.722	S	S	*	*			cis	172.9	-161.2	-22.7	-169.8	0	0	0	0	110.8
629	I	33.5	Very low	33	Very low	135 Å²	135	126.4 Å²	126.4	69%	0.692	73%	0.725	S	S	*	*			trans	64.8	109.9	164.5	-63.9	168.1	0	0	0	116.3
630	K	33	Very low	33.2	Very low	189 Å²	189	131.7 Å²	131.7	82%	0.822	73%	0.729	S	S	*	*				73.2	140.5	72.1	-84.1	-175.7	179.5	176.9	0	114.7
631	V	29.1	Very low	32.7	Very low	104 Å²	104	133.2 Å²	133.2	63%	0.63	73%	0.727	S	S	*	*			cis	-170.8	161.1	-0.1	80.1	0	0	0	0	113.1
632	Q	31.8	Very low	32.5	Very low	144 Å²	144	135.7 Å²	135.7	67%	0.673	73%	0.731	S	S	*	*			trans	65.2	159	155.5	-80.8	166	-109.5	0	0	120.7
633	Q	33.1	Very low	32.3	Very low	131 Å²	131	133.6 Å²	133.6	61%	0.612	73%	0.733	S	S	*	*			cis	-163	164.9	-14.9	-130.8	165.3	-6.4	0	0	114.3
634	Q	29.5	Very low	32.3	Very low	168 Å²	168	138.6 Å²	138.6	79%	0.785	74%	0.744	S	S	*	*			trans	74.3	154.7	144.1	-85.7	154.6	-6.4	0	0	123.9
635	A	28.4	Very low	32.3	Very low	92 Å²	92	139 Å²	139	76%	0.76	75%	0.747	S	S	*	*			trans	-124.3	-147.3	174.2	0	0	0	0	0	107.8
636	P	53.8	Low	32.5	Very low	119 Å²	119	141.5 Å²	141.5	77%	0.773	76%	0.755	S	S	*	*			cis	-143.5	-154.2	4.2	44.3	-21.9	0	0	0	115.3
637	A	32.5	Very low	32.7	Very low	87 Å²	87	137 Å²	137	72%	0.719	75%	0.753	S	S	*	*			trans	76.9	155.3	151.2	0	0	0	0	0	120.4
638	Q	37.9	Very low	33.4	Very low	188 Å²	188	140.2 Å²	140.2	88%	0.879	76%	0.764	S	S	*	*			cis	-171.4	174	-35.4	-129	-177.6	13.1	0	0	110.7
639	A	30.1	Very low	34.2	Very low	95 Å²	95	146.2 Å²	146.2	79%	0.785	77%	0.774	S	S	*	*			trans	72.6	159.8	157.7	0	0	0	0	0	120.2
640	R	32.9	Very low	35.1	Very low	212 Å²	212	146.7 Å²	146.7	80%	0.8	77%	0.773	S	S	*	*			cis	-175.4	157.2	-29.4	-170.2	-169	159.9	151.1	-3.7	110.6
641	M	26.8	Very low	35.8	Very low	129 Å²	129	144.2 Å²	144.2	64%	0.635	77%	0.769	S	S	*	*			trans	96.9	167.8	161.2	-53.5	-75.5	46.4	0	0	120.3
642	Q	29.2	Very low	36.4	Very low	177 Å²	177	143 Å²	143	83%	0.827	77%	0.77	S	S	*	*			trans	-131.3	164	-157.7	-50.8	155.4	-72.7	0	0	111.6
643	A	26.9	Very low	36.3	Very low	101 Å²	101	144.5 Å²	144.5	84%	0.835	78%	0.782	S	S	*	*				171.6	158.9	128.1	0	0	0	0	0	114.2
644	F	30.5	Very low	36.1	Very low	194 Å²	194	144.6 Å²	144.6	85%	0.851	79%	0.791	S	S	*	*			trans	-99.4	166.7	177.1	-74.9	-102	0	0	0	112.1
645	S	29.7	Very low	36.1	Very low	121 Å²	121	147.8 Å²	147.8	85%	0.846	80%	0.796	S	S	*	*				178.9	171.8	92.6	-68.3	0	0	0	0	114.7
646	H	39.8	Very low	36.7	Very low	188 Å²	188	149.1 Å²	149.1	87%	0.87	80%	0.795	S	S	*	*			trans	-95.6	169.9	-168	-69.8	-95.9	0	0	0	117.2
647	G	34.1	Very low	35.8	Very low	70 Å²	70	152 Å²	152	72%	0.722	80%	0.798	S	S	*	*			trans	180	93.7	156	0	0	0	0	0	119.9
648	F	46.6	Very low	36	Very low	216 Å²	216	152.7 Å²	152.7	95%	0.947	80%	0.797	S	S	*	*			trans	39.1	-157	151.1	-75.6	-85.7	0	0	0	121.3
649	R	48.9	Very low	35.8	Very low	210 Å²	210	155 Å²	155	79%	0.792	80%	0.8	S	S	*	*			trans	-154.9	-169.3	-165.2	-56.8	-173.7	179.9	175.9	0.5	109
650	H	53.1	Low	35.8	Very low	146 Å²	146	154.1 Å²	154.1	68%	0.676	80%	0.799	S	S	*	*			cis	-163.6	148.7	15.3	-128	-57.4	0	0	0	109.7
651	D	47.4	Very low	35.9	Very low	136 Å²	136	152.4 Å²	152.4	73%	0.727	80%	0.801	S	S	*	*			trans	61.9	162.8	149.9	-80.8	-138.1	0	0	0	120.3
652	A	40.5	Very low	36.2	Very low	78 Å²	78	153.6 Å²	153.6	65%	0.645	81%	0.805	S	S	*	*			cis	-162.4	-176.5	-13.9	0	0	0	0	0	111.6
653	L	30.1	Very low	36.7	Very low	177 Å²	177	152.7 Å²	152.7	93%	0.927	80%	0.8	S	S	*	*			trans	71.4	147.2	172.2	-79.4	179	0	0	0	119.8
654	T	29.5	Very low	38	Very low	133 Å²	133	151.8 Å²	151.8	82%	0.816	79%	0.786	S	S	*	*			trans	-84.1	130.9	175.4	50	0	0	0	0	112.5
655	R	29.6	Very low	38.2	Very low	234 Å²	234	151.3 Å²	151.3	88%	0.883	78%	0.784	S	S	*	*			trans	159	97.7	132.4	-178.2	-178.7	-122.7	158.3	-1.6	113.2
656	V	39.8	Very low	38.4	Very low	121 Å²	121	154.9 Å²	154.9	73%	0.733	79%	0.787	S	S	*	*			trans	50.8	115.6	145.5	-174.1	0	0	0	0	120
657	Q	36.7	Very low	37.9	Very low	179 Å²	179	149.2 Å²	149.2	84%	0.836	78%	0.779	S	S	*	*			trans	80.3	132.3	158	-70.9	170.6	7.6	0	0	121.8
658	S	34.9	Very low	38.9	Very low	101 Å²	101	151.6 Å²	151.6	71%	0.706	78%	0.782	S	S	*	*			trans	81.2	133.1	146.8	-72.7	0	0	0	0	124.7
659	Y	33.8	Very low	38.2	Very low	237 Å²	237	152.6 Å²	152.6	93%	0.929	78%	0.779	S	S	*	*			trans	46.1	134	146.3	-76.2	-96.3	0	0	0	124.8
660	G	31.8	Very low	37.6	Very low	76 Å²	76	150.7 Å²	150.7	78%	0.784	78%	0.777	S	S	*	*				114.1	110.5	122.2	0	0	0	0	0	124.6
661	Q	34.2	Very low	37.1	Very low	177 Å²	177	150.7 Å²	150.7	83%	0.827	78%	0.777	S	S	*	*			trans	29.2	132.1	140.5	-95.4	172.6	-74.3	0	0	128.6
662	E	33.6	Very low	36.8	Very low	154 Å²	154	149.1 Å²	149.1	72%	0.72	78%	0.777	S	S	*	*				70.3	140.5	125.8	-91.8	-179.1	121.8	0	0	130.5
663	E	39.4	Very low	36.6	Very low	157 Å²	157	149.1 Å²	149.1	73%	0.734	79%	0.785	S	S	*	*			trans	78.2	161.4	140.3	-79.6	-91.4	100.9	0	0	124.1
664	P	54.3	Low	36.8	Very low	83 Å²	83	145.1 Å²	145.1	54%	0.539	78%	0.777	S	S	.	*			trans	-154.5	-163	-137	47.2	-23	0	0	0	120.2
665	K	35.3	Very low	37.2	Very low	184 Å²	184	146.9 Å²	146.9	80%	0.8	78%	0.776	S	S	*	*			trans	76.5	158.4	146.5	-80.7	175.1	-176.2	159.8	0	124.4
666	Q	33.1	Very low	37.4	Very low	196 Å²	196	143.8 Å²	143.8	92%	0.916	78%	0.775	S	S	*	*			trans	80.9	158.7	165.2	-41.6	-158.1	37	0	0	117.6
667	G	28.8	Very low	37	Very low	68 Å²	68	142.2 Å²	142.2	70%	0.701	78%	0.775	S	S	*	*			cis	-165.4	-168.9	6.2	0	0	0	0	0	115
668	P	54.6	Low	38.2	Very low	120 Å²	120	138.8 Å²	138.8	78%	0.779	77%	0.769	S	S	*	*			trans	-134	165	-155.8	42.3	-28.3	0	0	0	119.9
669	R	33.2	Very low	38.1	Very low	238 Å²	238	141.7 Å²	141.7	90%	0.898	77%	0.771	S	S	*	*			trans	155.4	128.6	132.9	-92	-176.7	168.4	-170.5	-1	119.1
670	K	36.7	Very low	38.1	Very low	169 Å²	169	135.8 Å²	135.8	74%	0.735	75%	0.754	S	S	*	*			trans	46.2	121.1	135.4	-78	-166.9	161	-140.5	0	126.5
671	Q	41.3	Very low	38.1	Very low	146 Å²	146	139.1 Å²	139.1	68%	0.682	75%	0.749	S	S	*	*				76.7	158.3	127.2	-75.3	-169	-118.1	0	0	122.1
672	S	41.3	Very low	37.8	Very low	104 Å²	104	138.9 Å²	138.9	73%	0.727	75%	0.748	S	S	*	*			cis	-176.5	145.8	-29.5	53.9	0	0	0	0	113.7
673	G	36.2	Very low	37.5	Very low	78 Å²	78	136.3 Å²	136.3	80%	0.804	75%	0.753	S	S	*	*			trans	174.4	-171.5	171.5	0	0	0	0	0	111.4
674	A	35.6	Very low	37	Very low	92 Å²	92	135.1 Å²	135.1	76%	0.76	76%	0.756	S	S	*	*			cis	176.2	153.7	-20.7	0	0	0	0	0	107.8
675	H	36.3	Very low	35.9	Very low	171 Å²	171	138.1 Å²	138.1	79%	0.792	77%	0.773	S	S	*	*			cis	-162.7	152.2	-16	-125.5	-79.1	0	0	0	111.3
676	L	35.2	Very low	35.5	Very low	168 Å²	168	133 Å²	133	88%	0.88	77%	0.773	S	S	*	*			trans	69.8	147.6	163.9	-68.1	171.9	0	0	0	122.2
677	A	30.3	Very low	35.4	Very low	89 Å²	89	127.8 Å²	127.8	74%	0.736	76%	0.763	S	S	*	*			trans	-157.3	-151.5	-174.3	0	0	0	0	0	108.2
678	P	63.3	Low	35.5	Very low	107 Å²	107	136 Å²	136	70%	0.695	77%	0.773	S	S	*	*			cis	-144	-159	5.6	45.2	-23.2	0	0	0	116.4
679	H	32.9	Very low	34.3	Very low	162 Å²	162	135 Å²	135	75%	0.75	77%	0.768	S	S	*	*			trans	76.7	149	151.4	-89.4	25.7	0	0	0	121.1
680	I	33.8	Very low	34.1	Very low	112 Å²	112	128.8 Å²	128.8	57%	0.574	76%	0.761	S	S	*	*			cis	-164.3	157.3	-22.8	-140.3	-167.1	0	0	0	113.6
681	Q	30.6	Very low	34	Very low	146 Å²	146	126.7 Å²	126.7	68%	0.682	77%	0.766	S	S	*	*			trans	58.7	132.4	154.4	-74.4	176.2	0	0	0	126.5
682	H	28.4	Very low	34.2	Very low	172 Å²	172	125.5 Å²	125.5	80%	0.796	77%	0.772	S	S	*	*			trans	65.5	148.5	134	-70	-55.6	0	0	0	125.6
683	A	26.8	Very low	33.6	Very low	100 Å²	100	123.5 Å²	123.5	83%	0.826	77%	0.767	S	S	*	*			trans	112.1	160.4	139.2	0	0	0	0	0	119.4
684	T	29.4	Very low	33.2	Very low	132 Å²	132	126.5 Å²	126.5	81%	0.81	77%	0.765	S	S	*	*			trans	-120	166.7	-153.6	-38.1	0	0	0	0	111.3
685	V	30.4	Very low	32.8	Very low	147 Å²	147	132.4 Å²	132.4	89%	0.891	77%	0.769	S	S	*	*			trans	76.6	130.1	167.9	-171.8	0	0	0	0	115.8
686	G	26.9	Very low	33.3	Very low	77 Å²	77	128.9 Å²	128.9	79%	0.794	76%	0.761	S	S	*	*			trans	176	121.9	168.9	0	0	0	0	0	111.2
687	A	31.6	Very low	33.1	Very low	85 Å²	85	128.7 Å²	128.7	70%	0.702	76%	0.76	S	S	*	*			trans	-136.7	155.8	178	0	0	0	0	0	110.1
688	R	30.1	Very low	33.1	Very low	242 Å²	242	127.7 Å²	127.7	91%	0.913	75%	0.752	S	S	*	*			trans	72	155.9	-178.2	-50.1	163.5	179	-113.2	0.3	112.7
689	S	29.3	Very low	31.7	Very low	97 Å²	97	130.9 Å²	130.9	68%	0.678	76%	0.757	S	S	*	*			cis	-169.1	179.3	-23.6	52.9	0	0	0	0	109.4
690	S	29.4	Very low	31.5	Very low	109 Å²	109	129.6 Å²	129.6	76%	0.762	76%	0.756	S	S	*	*			trans	73	139.5	153.4	28.7	0	0	0	0	120.1
691	C	35.3	Very low	31.2	Very low	124 Å²	124	130.6 Å²	130.6	84%	0.838	77%	0.767	S	S	*	*			trans	-80.7	-174.9	167.6	-34.3	0	0	0	0	110.2
692	P	46	Very low	31.2	Very low	122 Å²	122	131.1 Å²	131.1	79%	0.792	77%	0.774	S	S	*	*			cis	-125.6	-176.3	28.3	38.9	-18.1	0	0	0	113.9
693	G	26.9	Very low	32.3	Very low	61 Å²	61	127.9 Å²	127.9	63%	0.629	77%	0.768	S	S	*	*				89.9	139.8	79.1	0	0	0	0	0	111.6
694	D	28.9	Very low	33.4	Very low	141 Å²	141	128.2 Å²	128.2	75%	0.754	76%	0.762	S	S	*	*			cis	-162.9	142.2	0.2	-88	-62.8	0	0	0	111.8
695	Y	26.3	Very low	33.5	Very low	216 Å²	216	129.1 Å²	129.1	85%	0.847	76%	0.761	S	S	*	*			trans	53.7	176.5	148.9	-87.3	-96.4	0	0	0	121
696	P	48.4	Very low	33.4	Very low	97 Å²	97	127.5 Å²	127.5	63%	0.63	76%	0.756	S	S	*	*			cis	-133.3	175.8	-8.4	38.2	-19.9	0	0	0	118.2
697	L	30.9	Very low	33.7	Very low	165 Å²	165	128.8 Å²	128.8	86%	0.864	75%	0.753	S	S	*	*			trans	71.4	147.5	147.1	-80.4	160.5	0	0	0	120
698	A	30.2	Very low	33.7	Very low	68 Å²	68	133 Å²	133	56%	0.562	76%	0.758	S	S	*	*			cis	-158	158.5	-0.6	0	0	0	0	0	114.3
699	Q	32.4	Very low	34.8	Very low	173 Å²	173	126.1 Å²	126.1	81%	0.808	75%	0.745	S	S	*	*			trans	59.5	146.9	152.6	-66.7	177.7	-3.3	0	0	119.1
700	N	29.5	Very low	35	Very low	135 Å²	135	127.4 Å²	127.4	72%	0.722	75%	0.749	S	S	*	*			cis	-154.8	-176	-13.2	-90.2	-24.2	0	0	0	105.9
701	V	28.4	Very low	35.4	Very low	134 Å²	134	134 Å²	134	81%	0.812	76%	0.757	S	S	*	*			cis	-139.8	171.3	16.7	179.7	0	0	0	0	108.9
702	L	29.4	Very low	35.1	Very low	156 Å²	156	134 Å²	134	82%	0.817	76%	0.759	S	S	*	*			trans	-153.6	-177.4	-175.2	-93.9	178.3	0	0	0	109.6
703	P	51.5	Low	34.4	Very low	104 Å²	104	136.7 Å²	136.7	68%	0.675	77%	0.765	S	S	*	*			cis	-131.3	-132.9	-26.3	37.1	-15	0	0	0	108.5
704	P	50.7	Low	34.5	Very low	108 Å²	108	137.1 Å²	137.1	70%	0.701	77%	0.769	S	S	*	*			cis	-124	-176	-32.8	37.4	-18.9	0	0	0	112.8
705	L	30.7	Very low	34.7	Very low	151 Å²	151	138.4 Å²	138.4	79%	0.791	77%	0.773	S	S	*	*			cis	-147.8	147.9	10	-161	79.4	0	0	0	112
706	S	28.7	Very low	35	Very low	112 Å²	112	135.2 Å²	135.2	78%	0.783	78%	0.776	S	S	*	*			trans	59.3	120.2	160.3	55.9	0	0	0	0	120.4
707	S	32.4	Very low	34.3	Very low	104 Å²	104	140.1 Å²	140.1	73%	0.727	78%	0.782	S	S	*	*			trans	-121.6	144.3	176	57.7	0	0	0	0	110.1
708	Q	33.3	Very low	34.4	Very low	174 Å²	174	139.2 Å²	139.2	81%	0.813	78%	0.775	S	S	*	*				63	166.4	97.2	-54.7	-68.4	-2.2	0	0	115.6
709	P	52.4	Low	34.4	Very low	97 Å²	97	141.8 Å²	141.8	63%	0.63	78%	0.78	S	S	*	*			cis	-141	167.8	-47.6	39.5	-23.5	0	0	0	116.2
710	T	33.8	Very low	34.4	Very low	125 Å²	125	139.1 Å²	139.1	77%	0.767	78%	0.78	S	S	*	*			trans	46.9	140.3	143.9	56.7	0	0	0	0	126
711	R	37.5	Very low	34.6	Very low	246 Å²	246	140.4 Å²	140.4	93%	0.928	79%	0.785	S	S	*	*			trans	80.5	115.3	145.1	-83.3	-173.8	175	-159.1	0.3	121.3
712	S	28.6	Very low	34.9	Very low	126 Å²	126	140 Å²	140	88%	0.881	79%	0.788	S	S	*	*			trans	-154.5	-179.6	138.2	65.5	0	0	0	0	110.5
713	L	31.8	Very low	34.9	Very low	178 Å²	178	139 Å²	139	93%	0.932	78%	0.784	S	S	*	*			trans	-111.4	156.7	-169.5	-69.7	159.6	0	0	0	112.6
714	G	28.7	Very low	34.2	Very low	69 Å²	69	137.4 Å²	137.4	71%	0.711	78%	0.775	S	S	*	*			trans	129.7	95.9	140.8	0	0	0	0	0	119.4
715	M	32.5	Very low	33.4	Very low	169 Å²	169	141.9 Å²	141.9	83%	0.833	78%	0.778	S	S	*	*			trans	49.3	128.5	139.3	-65.3	173.2	53.4	0	0	122.2
716	T	33.1	Very low	33.4	Very low	148 Å²	148	141.6 Å²	141.6	91%	0.908	78%	0.776	S	S	*	*			trans	-145.1	152.7	130.1	3.2	0	0	0	0	111.8
717	R	34.4	Very low	33.5	Very low	201 Å²	201	146.6 Å²	146.6	76%	0.758	78%	0.779	S	S	*	*			trans	-92.6	174.4	162.8	-59.9	174.4	173.1	152.6	-4.5	107.5
718	M	33.1	Very low	33.4	Very low	146 Å²	146	148.4 Å²	148.4	72%	0.719	78%	0.781	S	S	*	*			cis	-146.4	-176.5	0.9	-137.1	148.7	82.4	0	0	104.7
719	D	29.4	Very low	33.3	Very low	122 Å²	122	145.7 Å²	145.7	65%	0.652	78%	0.781	S	S	*	*			cis	-175.7	154.7	42.3	-122.2	-43.2	0	0	0	108.6
720	S	32.3	Very low	32.2	Very low	116 Å²	116	148 Å²	148	81%	0.811	79%	0.788	S	S	*	*			trans	-170.2	111.8	148.6	-87.3	0	0	0	0	112.1
721	I	33.7	Very low	32.6	Very low	163 Å²	163	147.8 Å²	147.8	84%	0.836	79%	0.789	S	S	*	*			trans	-36	136.1	165.7	44.2	170.5	0	0	0	116.1
722	S	33.9	Very low	32.2	Very low	125 Å²	125	143.2 Å²	143.2	87%	0.874	78%	0.78	S	S	*	*			trans	-111.3	129.3	144.8	-64.2	0	0	0	0	107.8
723	D	29.7	Very low	32.3	Very low	135 Å²	135	146.8 Å²	146.8	72%	0.722	77%	0.774	S	S	*	*			trans	-126.6	178.1	161	-156.9	-1.5	0	0	0	109.9	R725	D723-R725 IonicContact OD1-NH2 3.83Å
724	S	38.1	Very low	32.1	Very low	70 Å²	70	145.2 Å²	145.2	49%	0.49	76%	0.762	S	S	.	*			trans	-156.3	157.5	-132.4	60.1	0	0	0	0	112.5
725	R	34.2	Very low	32	Very low	203 Å²	203	151.3 Å²	151.3	77%	0.766	76%	0.764	S	S	*	*			trans	78.8	149.3	-180	-53.7	156.1	-82.8	-168.9	-5.1	110.7	D723	D723-R725 IonicContact OD1-NH2 3.83Å
726	L	30.4	Very low	31.9	Very low	145 Å²	145	153.4 Å²	153.4	76%	0.759	76%	0.762	S	S	*	*				-151.1	147.9	51.7	-82.1	163.1	0	0	0	116
727	Y	29.4	Very low	32.6	Very low	216 Å²	216	151.3 Å²	151.3	85%	0.847	75%	0.751	S	S	*	*			trans	78.1	155.1	151	-93.4	-79.9	0	0	0	123
728	D	31.5	Very low	33	Very low	143 Å²	143	147 Å²	147	77%	0.765	75%	0.749	S	S	*	*			trans	-94.5	-177	-164.3	-126.7	-59	0	0	0	113.3
729	S	30.2	Very low	32.8	Very low	116 Å²	116	147.3 Å²	147.3	81%	0.811	75%	0.753	S	S	*	*			trans	80.9	142	161.5	79	0	0	0	0	119.4
730	N	30.5	Very low	32.7	Very low	145 Å²	145	146.8 Å²	146.8	78%	0.775	76%	0.757	S	S	*	*			trans	-133.8	132.8	-177.4	167.4	18.2	0	0	0	108.3
731	P	42.2	Very low	32.5	Very low	121 Å²	121	150.6 Å²	150.6	79%	0.786	75%	0.754	S	S	*	*			trans	-135.6	174.4	143.9	35.5	-21	0	0	0	114.7
732	M	28.3	Very low	32.2	Very low	150 Å²	150	148 Å²	148	74%	0.739	74%	0.738	S	S	*	*			trans	-83	150.9	-155.5	-64.7	159.9	53.9	0	0	117.6
733	R	31.1	Very low	32.1	Very low	202 Å²	202	149.8 Å²	149.8	76%	0.762	73%	0.733	S	S	*	*			trans	87.9	132.4	133.7	-93.8	-179.9	-166.5	-97.5	0.9	122.4
734	Q	27	Very low	32	Very low	145 Å²	145	152.2 Å²	152.2	68%	0.678	74%	0.74	S	S	*	*			trans	90.1	115.8	142.4	-72.6	-169.7	85.3	0	0	122.7
735	R	27.9	Very low	31.5	Very low	197 Å²	197	153.6 Å²	153.6	74%	0.743	76%	0.755	S	S	*	*				52.6	142.8	126.9	-64.2	-167.7	165.9	-170.6	-0.6	120.2
736	R	28.9	Very low	31.1	Very low	212 Å²	212	148.3 Å²	148.3	80%	0.8	75%	0.749	S	S	*	*			cis	-161.7	177.4	-8.9	-116.1	-166.8	174.3	175.6	-2.2	109.1
737	P	49.2	Very low	31	Very low	105 Å²	105	153.2 Å²	153.2	68%	0.682	76%	0.758	S	S	*	*			trans	-109	-175.9	-157.8	44.3	-41.1	0	0	0	115.5
738	P	42.1	Very low	31	Very low	111 Å²	111	149.9 Å²	149.9	72%	0.721	76%	0.755	S	S	*	*			trans	-121.5	157.4	130.3	36.7	-28.4	0	0	0	112
739	L	29.6	Very low	31.1	Very low	151 Å²	151	148 Å²	148	79%	0.791	75%	0.75	S	S	*	*			cis	-165.3	138.9	-11.2	-113.3	169.8	0	0	0	108.8
740	C	27.5	Very low	31	Very low	111 Å²	111	150.2 Å²	150.2	75%	0.75	75%	0.752	S	S	*	*			trans	57.7	153.5	156.5	-77.8	0	0	0	0	119.6
741	R	27.5	Very low	31.5	Very low	196 Å²	196	148.4 Å²	148.4	74%	0.74	75%	0.748	S	S	*	*			cis	-166.6	146.1	-18.8	-155.8	171.1	155.2	172	-13.6	103.7
742	E	27.4	Very low	30.7	Very low	108 Å²	108	149.1 Å²	149.1	51%	0.505	76%	0.755	S	S	.	*				-175	135.6	60.5	-172.6	83.8	-116.2	0	0	109.3
743	Q	31	Very low	30.7	Very low	164 Å²	164	145.3 Å²	145.3	77%	0.766	75%	0.754	S	S	*	*			trans	53	126.8	157.5	-67	167.1	50.7	0	0	121.6
744	H	28.3	Very low	30.6	Very low	186 Å²	186	142.6 Å²	142.6	86%	0.861	76%	0.755	S	S	*	*			trans	-100.7	158.5	171.4	-76.3	-128	0	0	0	111.4
745	A	28.1	Very low	30.7	Very low	99 Å²	99	143.1 Å²	143.1	82%	0.818	76%	0.757	S	S	*	*			trans	-142.4	103.7	148.6	0	0	0	0	0	110.2
746	S	25.7	Very low	30.8	Very low	91 Å²	91	137.5 Å²	137.5	64%	0.636	75%	0.748	S	S	*	*			trans	-126.1	137.4	169.6	53.3	0	0	0	0	108.3
747	W	28.7	Very low	30.9	Very low	248 Å²	248	138.8 Å²	138.8	94%	0.939	76%	0.755	S	S	*	*			trans	-105.5	107.6	-178.5	-74	107	0	0	0	111.5
748	D	28.6	Very low	29.9	Very low	146 Å²	146	137.1 Å²	137.1	78%	0.781	76%	0.756	S	S	*	*			trans	-87.7	154.4	158.6	-81.2	-52.6	0	0	0	110.2
749	P	33.5	Very low	29.2	Very low	104 Å²	104	142 Å²	142	68%	0.675	76%	0.762	S	S	*	*			trans	-91.9	-173.2	174.2	37.1	-35.4	0	0	0	113.6
750	L	28.1	Very low	29.2	Very low	162 Å²	162	142 Å²	142	85%	0.848	76%	0.758	S	S	*	*			trans	87.9	155	175.1	-51.5	174	0	0	0	116.3
751	P	42	Very low	29.1	Very low	107 Å²	107	141.9 Å²	141.9	70%	0.695	76%	0.758	S	S	*	*			cis	-137.2	-175.2	-38.2	38.2	-21.2	0	0	0	114.4
752	C	25.4	Very low	29.2	Very low	136 Å²	136	143 Å²	143	92%	0.919	76%	0.764	S	S	*	*			trans	75.9	147.1	174.2	-56	0	0	0	0	116.6
753	G	27.7	Very low	29.8	Very low	71 Å²	71	144 Å²	144	73%	0.732	78%	0.779	S	S	*	*			cis	-172.1	-177.7	-1.9	0	0	0	0	0	114.3
754	N	28.7	Very low	29.7	Very low	144 Å²	144	144.2 Å²	144.2	77%	0.77	79%	0.785	S	S	*	*			trans	-55.8	158.9	177.9	-68.7	87.9	0	0	0	115.6
755	E	29	Very low	29.7	Very low	157 Å²	157	141 Å²	141	73%	0.734	78%	0.784	S	S	*	*			cis	-168.5	170.7	-6	-79.1	-107.9	175.3	0	0	106.4
756	S	30.1	Very low	29.6	Very low	79 Å²	79	143.4 Å²	143.4	55%	0.552	78%	0.783	S	S	*	*			cis	-174.9	176.4	-25.5	-85.4	0	0	0	0	109.6
757	Y	30.9	Very low	29.8	Very low	239 Å²	239	144.2 Å²	144.2	94%	0.937	79%	0.788	S	S	*	*			trans	69.5	144.7	-178.2	-62.3	-89.6	0	0	0	116.4
758	G	27.4	Very low	29.9	Very low	69 Å²	69	140.1 Å²	140.1	71%	0.711	78%	0.784	S	S	*	*			cis	174.3	146.6	-11.7	0	0	0	0	0	115.5
759	Y	27.8	Very low	30.2	Very low	214 Å²	214	141 Å²	141	84%	0.839	79%	0.786	S	S	*	*			trans	65.5	137.4	159.1	-104.7	-65.5	0	0	0	123.9
760	H	29.4	Very low	30.2	Very low	152 Å²	152	141.4 Å²	141.4	70%	0.704	79%	0.788	S	S	*	*			trans	89.2	106.9	148.5	-82.3	-58	0	0	0	124.4
761	S	26.1	Very low	30.1	Very low	108 Å²	108	139.7 Å²	139.7	76%	0.755	79%	0.788	S	S	*	*				87.5	142.5	126.5	-60.1	0	0	0	0	122.7
762	Y	29.1	Very low	29.5	Very low	218 Å²	218	141.1 Å²	141.1	86%	0.855	80%	0.799	S	S	*	*			trans	-83.1	167.6	175.6	-68	-94	0	0	0	112.8
763	P	39.3	Very low	29.5	Very low	129 Å²	129	142.7 Å²	142.7	84%	0.838	79%	0.793	S	S	*	*				-134.7	179.2	94.3	30.5	-14	0	0	0	114.7
764	L	30.6	Very low	29.6	Very low	170 Å²	170	148.6 Å²	148.6	89%	0.89	79%	0.793	S	S	*	*			trans	-94.5	154.8	-173.5	-51.3	95.1	0	0	0	113.8
765	S	27.4	Very low	29.6	Very low	118 Å²	118	149.1 Å²	149.1	83%	0.825	80%	0.801	S	S	*	*				-164.5	152.6	127.6	-159.7	0	0	0	0	114.4
766	N	25.9	Very low	29.8	Very low	149 Å²	149	148.8 Å²	148.8	80%	0.797	80%	0.801	S	S	*	*			trans	-38.1	145	-176.7	-68.5	-18.3	0	0	0	121.6
767	S	29.7	Very low	29.9	Very low	108 Å²	108	150.4 Å²	150.4	76%	0.755	81%	0.808	S	S	*	*			trans	65.4	114.3	131.9	-162.8	0	0	0	0	121.2
768	L	30.5	Very low	30	Very low	162 Å²	162	151.2 Å²	151.2	85%	0.848	81%	0.809	S	S	*	*				-176.1	140	116.6	-99	164.2	0	0	0	111.4
769	M	36.5	Very low	30.5	Very low	166 Å²	166	153 Å²	153	82%	0.818	81%	0.811	S	S	*	*			trans	-106.8	127.3	169.4	-92.2	-70.5	-64.6	0	0	110.1
770	P	33.5	Very low	30.8	Very low	112 Å²	112	150.7 Å²	150.7	73%	0.727	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-91.1	142.2	159	-10.9	29.6	0	0	0	111.5
771	C	24.9	Very low	31.4	Very low	125 Å²	125	148.4 Å²	148.4	85%	0.845	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-76	156.9	-177.1	-60.8	0	0	0	0	113.8
772	C	28.8	Very low	32.1	Very low	138 Å²	138	150.7 Å²	150.7	93%	0.932	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-87	132.5	157	-71.8	0	0	0	0	109.9
773	E	26.8	Very low	32.5	Very low	169 Å²	169	149.9 Å²	149.9	79%	0.79	81%	0.813	S	S	*	*			trans	-147.7	141.8	169.2	-168	165.6	-141.5	0	0	108.5
774	R	30	Very low	32.4	Very low	195 Å²	195	151 Å²	151	74%	0.736	81%	0.809	S	S	*	*			cis	170.3	114.2	-21.4	172.6	-169.5	-154.8	160.5	4.4	104.2
775	V	28.8	Very low	32.7	Very low	155 Å²	155	151 Å²	151	94%	0.939	80%	0.804	S	S	*	*			trans	-130.6	141.8	169	-177.1	0	0	0	0	108.1
776	M	31.9	Very low	33.2	Very low	149 Å²	149	154.8 Å²	154.8	73%	0.734	81%	0.809	S	S	*	*			trans	-104.6	132.3	-152.1	-63.9	-171.9	-69.6	0	0	115.3
777	V	32.7	Very low	33.8	Very low	113 Å²	113	153.8 Å²	153.8	69%	0.685	80%	0.802	S	S	*	*				45.4	123.2	127	-173.4	0	0	0	0	119
778	R	32.1	Very low	34.1	Very low	257 Å²	257	158.6 Å²	158.6	97%	0.97	80%	0.804	S	S	*	*				-113.7	137.7	125.3	-95.6	-174.8	164.6	179.1	-4.6	108.7
779	S	37.8	Very low	34.1	Very low	106 Å²	106	158.3 Å²	158.3	74%	0.741	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-91.3	156.5	-160.1	32.3	0	0	0	0	114.7
780	M	34	Very low	33.7	Very low	165 Å²	165	155.7 Å²	155.7	81%	0.813	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-96	160.9	164.1	-79.4	-70.3	178.4	0	0	110.6
781	P	43.1	Very low	34.4	Very low	105 Å²	105	155.4 Å²	155.4	68%	0.682	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-74	142.2	-177.6	-17.4	32.7	0	0	0	114.2	K783	P781-K783 PolarHBondContact O-N 2.92Å
782	D	41.2	Very low	34.6	Very low	155 Å²	155	159.6 Å²	159.6	83%	0.829	80%	0.798	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.9	39.3	-164.9	-43.2	-95.8	0	0	0	116.3
783	K	36.8	Very low	34.5	Very low	201 Å²	201	160.6 Å²	160.6	87%	0.874	79%	0.789	S	S	*	*	T	Hydrogen-bonded Turn	trans	-127.4	8	-178.1	-72.5	-163.8	173.8	-172.5	0	116.1	P781	P781-K783 PolarHBondContact O-N 2.92Å
784	M	37.7	Very low	34.9	Very low	154 Å²	154	160.6 Å²	160.6	76%	0.759	79%	0.794	S	S	*	*	S	Bend	trans	-122.8	-10.6	-179.6	-155.3	149.7	70.2	0	0	115.4
785	E	37.4	Very low	34.9	Very low	170 Å²	170	156.8 Å²	156.8	79%	0.794	79%	0.794	S	S	*	*	G	3₁₀ helix	trans	-87.8	-16.8	-177.8	-64.3	-172.3	145.5	0	0	114.3	I787	E785-I787 PolarHBondContact O-N 3.43Å; E785-I787 VanDerWaalsContact O-N 3.17Å
786	Q	36.9	Very low	34.8	Very low	196 Å²	196	154.6 Å²	154.6	92%	0.916	79%	0.786	S	S	*	*	G	3₁₀ helix	trans	-73.6	-0.7	178.9	-75.2	-170.1	-23.2	0	0	115.3
787	I	38.7	Very low	35	Very low	129 Å²	129	152.8 Å²	152.8	66%	0.662	80%	0.795	S	S	*	*	G	3₁₀ helix	trans	-100.8	-18.8	-174.9	-57.7	178.7	0	0	0	112.1	E785	E785-I787 PolarHBondContact O-N 3.43Å; E785-I787 VanDerWaalsContact O-N 3.17Å
788	W	36.7	Very low	35.1	Very low	208 Å²	208	151.6 Å²	151.6	79%	0.788	80%	0.797	S	S	*	*	S	Bend	trans	-131	93.5	-174.5	-75	87.1	0	0	0	112.6
789	N	29.7	Very low	35	Very low	157 Å²	157	148.4 Å²	148.4	84%	0.84	79%	0.793	S	S	*	*			trans	95.8	104	165.2	-49.2	-57.4	0	0	0	118.4
790	S	28.1	Very low	34.6	Very low	110 Å²	110	152.4 Å²	152.4	77%	0.769	80%	0.799	S	S	*	*			trans	-152.6	137	133.8	-166.2	0	0	0	0	109.5
791	P	49.3	Very low	34.4	Very low	106 Å²	106	153.8 Å²	153.8	69%	0.688	80%	0.804	S	S	*	*			trans	-114.5	152.3	-168.2	40.2	-31.5	0	0	0	115.3
792	W	28.8	Very low	33.8	Very low	214 Å²	214	155.5 Å²	155.5	81%	0.811	80%	0.803	S	S	*	*			trans	-144.8	113.1	156.9	-67.7	100.1	0	0	0	106.7
793	E	25.9	Very low	33.7	Very low	159 Å²	159	159.4 Å²	159.4	74%	0.743	81%	0.806	S	S	*	*				68.9	131.5	95	-73	-162.6	155.4	0	0	114.6	P795	E793-P795 WeakPolarHBondContact O-CD 3.42Å
794	N	35.4	Very low	34.2	Very low	168 Å²	168	158.4 Å²	158.4	90%	0.898	80%	0.798	S	S	*	*			trans	-80.6	126.8	176.5	-77.2	-16	0	0	0	111.3
795	P	30.6	Very low	35.2	Very low	115 Å²	115	156.7 Å²	156.7	75%	0.747	80%	0.796	S	S	*	*			trans	-86.4	153.4	153.6	-6.6	26.8	0	0	0	111.4	E793	E793-P795 WeakPolarHBondContact O-CD 3.42Å
796	S	25.1	Very low	36.6	Very low	110 Å²	110	150 Å²	150	77%	0.769	77%	0.765	S	S	*	*			trans	-26.9	146	164.8	51.1	0	0	0	0	118.1	A798	S796-A798 PolarHBondContact O-N 3.43Å
797	A	36.8	Very low	38.2	Very low	111 Å²	111	143.6 Å²	143.6	92%	0.917	74%	0.741	S	S	*	*	S	Bend	trans	-58.9	117.7	173.8	0	0	0	0	0	114
798	A	34	Very low	39.5	Very low	87 Å²	87	144.2 Å²	144.2	72%	0.719	75%	0.745	S	S	*	*			trans	-158.3	161.2	157.6	0	0	0	0	0	109.4	S796	S796-A798 PolarHBondContact O-N 3.43Å
799	E	30	Very low	41.1	Very low	191 Å²	191	140.9 Å²	140.9	89%	0.893	74%	0.738	S	S	*	*			trans	58.1	91	167.9	-55.9	-167.2	158.2	0	0	117.4	Q801	E799-Q801 PolarHBondContact O-N 2.87Å
800	H	29.5	Very low	43.1	Very low	189 Å²	189	134.2 Å²	134.2	88%	0.875	70%	0.702	S	S	*	*			trans	-61.6	118.5	158	-80.2	-97.3	0	0	0	110.2	E802	H800-E802 PolarHBondContact O-N 3.45Å
801	Q	29.6	Very low	45.7	Very low	195 Å²	195	134.5 Å²	134.5	91%	0.911	69%	0.687	S	S	*	*			trans	-81.3	101.1	158.6	-168.5	160.8	36.9	0	0	109	E799 R803	E799-Q801 PolarHBondContact O-N 2.87Å; Q801-R803 PolarHBondContact O-N 3.28Å
802	E	32.4	Very low	47.2	Very low	141 Å²	141	134.4 Å²	134.4	66%	0.659	68%	0.677	S	S	*	*			trans	-59	128.2	-177.7	-63	-177.7	120.1	0	0	111.7	H800 Y804	H800-E802 PolarHBondContact O-N 3.45Å; E802-Y804 PolarHBondContact O-N 3.05Å; E802-Y804 VanDerWaalsContact O-N 3.13Å
803	R	38	Very low	49.9	Very low	236 Å²	236	125.4 Å²	125.4	89%	0.891	65%	0.646	S	S	*	*			trans	-71	104.1	157.4	-69.5	-172.4	-170.7	170.4	4.6	107.1	Q801 V805	Q801-R803 PolarHBondContact O-N 3.28Å; R803-V805 PolarHBondContact O-N 3.13Å
804	Y	48.2	Very low	52.8	Low	180 Å²	180	120 Å²	120	71%	0.706	62%	0.619	S	S	*	*			trans	-57.8	107.4	171.1	-94.6	-95.7	0	0	0	110	E802 I806	E802-Y804 PolarHBondContact O-N 3.05Å; E802-Y804 VanDerWaalsContact O-N 3.13Å; Y804-I806 PolarHBondContact O-N 3.11Å
805	V	58.1	Low	55.2	Low	119 Å²	119	118.7 Å²	118.7	72%	0.721	60%	0.602	S	S	*	*	P	Polyproline II helix	trans	-71.8	123.5	172.4	-179.7	0	0	0	0	107.2	R803 P807	R803-V805 PolarHBondContact O-N 3.13Å; V805-P807 VanDerWaalsContact O-CD 3.27Å; V805-P807 WeakPolarHBondContact O-CD 3.5Å; V805-P807 VanDerWaalsContact O-N 3.16Å
806	I	67	Low	57.8	Low	29 Å²	29	116.9 Å²	116.9	15%	0.149	59%	0.586	C	S	.	*	P	Polyproline II helix	trans	-60	118.5	171.1	-62.1	179	0	0	0	106.9	Y804 Q810 Y814 M830	Y804-I806 PolarHBondContact O-N 3.11Å; I806-Q810 HydrophobicContact CG2-CB 3.96Å; I806-Y814 HydrophobicContact CD1-CD1 3.9Å; I806-Y814 HydrophobicContact CD1-CD2 3.38Å; I806-Y814 HydrophobicContact CD1-CE1 4.12Å; I806-Y814 HydrophobicContact CD1-CE2 3.64Å; I806-Y814 HydrophobicContact CD1-CG 3.53Å; I806-M830 HydrophobicContact CG2-CE 4.42Å
807	P	69.8	Low	60.7	Low	61 Å²	61	112 Å²	112	40%	0.396	55%	0.551	S	S	.	*	P	Polyproline II helix	trans	-56.6	142.6	-175.8	-27.3	35.9	0	0	0	111.6	V805 H809 Q810 Y811	V805-P807 VanDerWaalsContact O-CD 3.27Å; V805-P807 WeakPolarHBondContact O-CD 3.5Å; V805-P807 VanDerWaalsContact O-N 3.16Å; P807-H809 PolarHBondContact O-N 3.24Å; P807-Q810 WeakPolarHBondContact O-CA 3.44Å; P807-Q810 PolarHBondContact O-N 2.78Å; P807-Y811 PolarHBondContact O-N 3.47Å; P807-Y811 VanDerWaalsContact O-N 3.11Å
808	D	66.9	Low	63.2	Low	143 Å²	143	108.3 Å²	108.3	77%	0.765	52%	0.518	S	S	*	.	H	α-helix	trans	-54.3	-35.8	-171.3	-61.2	-59.3	0	0	0	113.2	Q810 Y811	D808-Q810 PolarHBondContact O-N 3.04Å; D808-Y811 WeakPolarHBondContact O-CB 3.37Å; D808-Y811 PolarHBondContact O-N 3.4Å; D808-Y811 VanDerWaalsContact O-N 3.13Å
809	H	68.9	Low	65.7	Low	138 Å²	138	110.4 Å²	110.4	64%	0.639	52%	0.517	S	S	*	.	H	α-helix	trans	-64.3	-21.5	176.6	74.3	-95.9	0	0	0	114.1	P807	P807-H809 PolarHBondContact O-N 3.24Å
810	Q	72.7	Confident	68.3	Low	17 Å²	17	107.2 Å²	107.2	8%	0.079	51%	0.505	C	S	.	.	H	α-helix	trans	-100.2	-16.1	173.6	-51.8	-164.1	3.2	0	0	112.8	I806 P807 D808 Q812 T813 Y814 M830 P834	I806-Q810 HydrophobicContact CG2-CB 3.96Å; P807-Q810 WeakPolarHBondContact O-CA 3.44Å; P807-Q810 PolarHBondContact O-N 2.78Å; D808-Q810 PolarHBondContact O-N 3.04Å; Q810-Q812 VanDerWaalsContact C-N 3.3Å; Q810-Q812 PolarHBondContact O-N 3.47Å; Q810-T813 WeakPolarHBondContact O-CA 3.36Å; Q810-T813 WeakPolarHBondContact O-CB 3.14Å; Q810-T813 PolarHBondContact O-N 3.28Å; Q810-Y814 PolarHBondContact O-N 2.88Å; Q810-M830 HydrophobicContact CB-CE 3.82Å; Q810-P834 PolarHBondContact NE2-O 3.19Å; Q810-P834 VanDerWaalsContact NE2-O 3.15Å
811	Y	82.5	Confident	71.1	Confident	115 Å²	115	99.9 Å²	99.9	45%	0.451	47%	0.471	S	S	.	.	H	α-helix	trans	-60.3	-37	-174.7	-173.7	-99.4	0	0	0	113	P807 D808 Y814 R815	P807-Y811 PolarHBondContact O-N 3.47Å; P807-Y811 VanDerWaalsContact O-N 3.11Å; D808-Y811 WeakPolarHBondContact O-CB 3.37Å; D808-Y811 PolarHBondContact O-N 3.4Å; D808-Y811 VanDerWaalsContact O-N 3.13Å; Y811-Y814 HydrophobicContact CD2-CD1 4.42Å; Y811-Y814 HydrophobicContact CE2-CD1 4.39Å; Y811-Y814 WeakPolarHBondContact O-CB 3.42Å; Y811-Y814 PolarHBondContact O-N 3.24Å; Y811-R815 WeakPolarHBondContact O-CB 3.47Å; Y811-R815 PolarHBondContact O-N 3.18Å
812	Q	81.6	Confident	74	Confident	104 Å²	104	93.3 Å²	93.3	49%	0.486	45%	0.445	S	S	.	.	H	α-helix	trans	-67.4	-38.7	174.9	-171.3	59.6	54.9	0	0	112.2	Q810 R815 N816	Q810-Q812 VanDerWaalsContact C-N 3.3Å; Q810-Q812 PolarHBondContact O-N 3.47Å; Q812-R815 PolarHBondContact O-N 3.35Å; Q812-N816 PolarHBondContact NE2-OD1 3.27Å; Q812-N816 WeakPolarHBondContact O-CB 3.38Å; Q812-N816 PolarHBondContact O-N 3.29Å; Q812-N816 PolarHBondContact O-ND2 2.88Å; Q812-N816 PolarHBondContact O-OD1 3Å
813	T	83.8	Confident	76.5	Confident	25 Å²	25	88.8 Å²	88.8	15%	0.153	43%	0.432	C	S	.	.	H	α-helix	trans	-64.7	-45.2	173.7	-67.6	0	0	0	0	111.1	Q810 R815 N816 L817 M830 P839 L842	Q810-T813 WeakPolarHBondContact O-CA 3.36Å; Q810-T813 WeakPolarHBondContact O-CB 3.14Å; Q810-T813 PolarHBondContact O-N 3.28Å; T813-R815 PolarHBondContact O-N 3.08Å; T813-N816 PolarHBondContact O-N 3.3Å; T813-L817 HydrophobicContact CG2-CD1 3.89Å; T813-L817 WeakPolarHBondContact O-CB 3.28Å; T813-L817 WeakPolarHBondContact O-CG 3.16Å; T813-L817 PolarHBondContact O-N 3.09Å; T813-M830 HydrophobicContact CG2-CE 4.45Å; T813-P839 HydrophobicContact CG2-CB 4.07Å; T813-L842 HydrophobicContact CG2-CD1 3.63Å
814	Y	86.9	Confident	78.8	Confident	45 Å²	45	86 Å²	86	18%	0.176	42%	0.422	C	S	.	.	H	α-helix	trans	-54.8	-50.3	173.1	171.2	-104.4	0	0	0	111.5	I806 Q810 Y811 N816 L817 C818 V826 H827 M830	I806-Y814 HydrophobicContact CD1-CD1 3.9Å; I806-Y814 HydrophobicContact CD1-CD2 3.38Å; I806-Y814 HydrophobicContact CD1-CE1 4.12Å; I806-Y814 HydrophobicContact CD1-CE2 3.64Å; I806-Y814 HydrophobicContact CD1-CG 3.53Å; Q810-Y814 PolarHBondContact O-N 2.88Å; Y811-Y814 HydrophobicContact CD2-CD1 4.42Å; Y811-Y814 HydrophobicContact CE2-CD1 4.39Å; Y811-Y814 WeakPolarHBondContact O-CB 3.42Å; Y811-Y814 PolarHBondContact O-N 3.24Å; Y814-N816 PolarHBondContact O-N 3.26Å; Y814-L817 PolarHBondContact O-N 3.38Å; Y814-C818 WeakPolarHBondContact CE2-SG 3.49Å; Y814-C818 VanDerWaalsContact CZ-SG 3.5Å; Y814-C818 WeakPolarHBondContact O-CB 3.33Å; Y814-C818 PolarHBondContact O-N 3.29Å; Y814-C818 PolarHBondContact O-SG 2.87Å; Y814-V826 HydrophobicContact CD2-CB 4.46Å; Y814-V826 HydrophobicContact CD2-CG1 3.73Å; Y814-V826 HydrophobicContact CE2-CB 4.34Å; Y814-V826 HydrophobicContact CE2-CG1 4.1Å; Y814-H827 HydrophobicContact CE2-CB 4.12Å; Y814-M830 HydrophobicContact CD2-SD 3.87Å; Y814-M830 HydrophobicContact CG-SD 4.3Å
815	R	87.1	Confident	80.7	Confident	142 Å²	142	78 Å²	78	54%	0.536	39%	0.391	S	S	.	.	H	α-helix	trans	-62	-43.5	179.5	-164.3	178.5	-168.5	177	5.3	112.2	Y811 Q812 T813 L817 C818 N819	Y811-R815 WeakPolarHBondContact O-CB 3.47Å; Y811-R815 PolarHBondContact O-N 3.18Å; Q812-R815 PolarHBondContact O-N 3.35Å; T813-R815 PolarHBondContact O-N 3.08Å; R815-L817 VanDerWaalsContact C-N 3.34Å; R815-L817 PolarHBondContact O-N 3.13Å; R815-C818 PolarHBondContact O-N 2.87Å; R815-N819 PolarHBondContact O-N 3.3Å; R815-N819 PolarHBondContact O-ND2 2.94Å; R815-N819 PolarHBondContact O-OD1 3.15Å
816	N	85.1	Confident	82.2	Confident	77 Å²	77	72.3 Å²	72.3	41%	0.412	36%	0.357	S	S	.	.	H	α-helix	trans	-62.1	-40.3	177	-70.3	-7.2	0	0	0	111.9	Q812 T813 Y814	Q812-N816 PolarHBondContact NE2-OD1 3.27Å; Q812-N816 WeakPolarHBondContact O-CB 3.38Å; Q812-N816 PolarHBondContact O-N 3.29Å; Q812-N816 PolarHBondContact O-ND2 2.88Å; Q812-N816 PolarHBondContact O-OD1 3Å; T813-N816 PolarHBondContact O-N 3.3Å; Y814-N816 PolarHBondContact O-N 3.26Å
817	L	85.5	Confident	83.1	Confident	6 Å²	6	74 Å²	74	3%	0.031	37%	0.365	C	S	.	.	H	α-helix	trans	-73.3	-34.6	177.6	-69.8	169	0	0	0	112.7	T813 Y814 R815 N819 I820 F821 V826 M830 L842 A843 I846	T813-L817 HydrophobicContact CG2-CD1 3.89Å; T813-L817 WeakPolarHBondContact O-CB 3.28Å; T813-L817 WeakPolarHBondContact O-CG 3.16Å; T813-L817 PolarHBondContact O-N 3.09Å; Y814-L817 PolarHBondContact O-N 3.38Å; R815-L817 VanDerWaalsContact C-N 3.34Å; R815-L817 PolarHBondContact O-N 3.13Å; L817-N819 PolarHBondContact O-N 3.12Å; L817-I820 PolarHBondContact O-N 2.87Å; L817-F821 HydrophobicContact CD2-CD2 4.33Å; L817-F821 HydrophobicContact CD2-CE2 4.25Å; L817-F821 PolarHBondContact O-N 3.17Å; L817-V826 HydrophobicContact CB-CG1 3.65Å; L817-V826 HydrophobicContact CB-CG2 4.24Å; L817-V826 HydrophobicContact CD1-CG1 4.32Å; L817-M830 HydrophobicContact CD1-SD 4.4Å; L817-L842 HydrophobicContact CD1-CB 3.62Å; L817-L842 HydrophobicContact CD1-CD1 3.78Å; L817-L842 HydrophobicContact CD1-CG 4.36Å; L817-A843 HydrophobicContact CD2-CB 3.97Å; L817-I846 HydrophobicContact CB-CD1 4.41Å; L817-I846 HydrophobicContact CD1-CD1 4.13Å; L817-I846 HydrophobicContact CD2-CD1 4.3Å
818	C	88.6	Confident	84	Confident	35 Å²	35	72.8 Å²	72.8	24%	0.236	36%	0.357	C	S	.	.	H	α-helix	trans	-67.4	-19.7	176	-69.3	0	0	0	0	113.8	Y814 R815 I820 F821 A823	Y814-C818 WeakPolarHBondContact CE2-SG 3.49Å; Y814-C818 VanDerWaalsContact CZ-SG 3.5Å; Y814-C818 WeakPolarHBondContact O-CB 3.33Å; Y814-C818 PolarHBondContact O-N 3.29Å; Y814-C818 PolarHBondContact O-SG 2.87Å; R815-C818 PolarHBondContact O-N 2.87Å; C818-I820 PolarHBondContact O-N 3.16Å; C818-F821 WeakPolarHBondContact CA-O 3.26Å; C818-A823 HydrophobicContact CB-CB 4.35Å
819	N	86.6	Confident	85	Confident	131 Å²	131	66 Å²	66	70%	0.701	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.8	-13.3	171	-64.5	-23.1	0	0	0	113	R815 L817	R815-N819 PolarHBondContact O-N 3.3Å; R815-N819 PolarHBondContact O-ND2 2.94Å; R815-N819 PolarHBondContact O-OD1 3.15Å; L817-N819 PolarHBondContact O-N 3.12Å
820	I	85.8	Confident	86	Confident	124 Å²	124	59.8 Å²	59.8	64%	0.636	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.8	-34.4	-174	-55.4	175.6	0	0	0	111.4	L817 C818	L817-I820 PolarHBondContact O-N 2.87Å; C818-I820 PolarHBondContact O-N 3.16Å
821	F	88.8	Confident	86.6	Confident	34 Å²	34	64.6 Å²	64.6	15%	0.149	32%	0.315	C	S	.	.	S	Bend	trans	-129.9	153.9	-175.1	-54.4	-72.9	0	0	0	112	L817 C818 A823 V826 A843 I846 V847 L850	L817-F821 HydrophobicContact CD2-CD2 4.33Å; L817-F821 HydrophobicContact CD2-CE2 4.25Å; L817-F821 PolarHBondContact O-N 3.17Å; C818-F821 WeakPolarHBondContact CA-O 3.26Å; F821-A823 PolarHBondContact O-N 3.18Å; F821-V826 HydrophobicContact CB-CG2 3.82Å; F821-A843 HydrophobicContact CE2-CB 3.89Å; F821-A843 HydrophobicContact CZ-CB 4.3Å; F821-I846 HydrophobicContact CB-CG2 3.68Å; F821-I846 HydrophobicContact CD1-CG2 3.7Å; F821-I846 HydrophobicContact CD2-CB 4.42Å; F821-I846 HydrophobicContact CD2-CD1 4.11Å; F821-I846 HydrophobicContact CD2-CG2 3.85Å; F821-I846 HydrophobicContact CE1-CG2 4.25Å; F821-I846 HydrophobicContact CE2-CG2 4.38Å; F821-I846 HydrophobicContact CG-CB 4.49Å; F821-I846 HydrophobicContact CG-CG2 3.47Å; F821-I846 VanDerWaalsContact CG-CG2 3.47Å; F821-V847 HydrophobicContact CE1-CG2 3.66Å; F821-V847 HydrophobicContact CZ-CG2 3.74Å; F821-L850 HydrophobicContact CD1-CD1 3.85Å; F821-L850 HydrophobicContact CE1-CD1 4.38Å
822	P	89	Confident	86.8	Confident	58 Å²	58	66.3 Å²	66.3	38%	0.377	33%	0.325	S	S	.	.			trans	-59.3	125.7	-178.5	-23.7	34	0	0	0	112.8	Y824 I825 V826	P822-Y824 VanDerWaalsContact C-N 3.26Å; P822-Y824 HydrophobicContact CB-CD1 3.82Å; P822-Y824 HydrophobicContact CB-CE1 3.47Å; P822-Y824 VanDerWaalsContact CB-CE1 3.47Å; P822-Y824 HydrophobicContact CG-CE1 4.44Å; P822-Y824 PolarHBondContact O-N 3.28Å; P822-Y824 VanDerWaalsContact O-N 3.09Å; P822-I825 HydrophobicContact CB-CD1 4.19Å; P822-I825 HydrophobicContact CB-CG1 4.28Å; P822-I825 HydrophobicContact CG-CD1 4.12Å; P822-I825 WeakPolarHBondContact O-CA 3.38Å; P822-I825 WeakPolarHBondContact O-CB 3.31Å; P822-I825 PolarHBondContact O-N 2.83Å; P822-V826 PolarHBondContact O-N 3.3Å; P822-V826 VanDerWaalsContact O-N 3.16Å
823	A	85.3	Confident	87	Confident	45 Å²	45	63.1 Å²	63.1	37%	0.372	31%	0.311	S	S	.	.	H	α-helix	trans	-54.9	-34.9	-169.6	0	0	0	0	0	114.7	C818 F821 I825 V826 H827	C818-A823 HydrophobicContact CB-CB 4.35Å; F821-A823 PolarHBondContact O-N 3.18Å; A823-I825 VanDerWaalsContact C-N 3.29Å; A823-I825 PolarHBondContact O-N 3.39Å; A823-V826 PolarHBondContact O-N 2.85Å; A823-H827 WeakPolarHBondContact O-CB 3.35Å; A823-H827 PolarHBondContact O-N 2.92Å
824	Y	86.8	Confident	86.8	Confident	177 Å²	177	65.8 Å²	65.8	69%	0.694	33%	0.329	S	S	*	.	H	α-helix	trans	-65.1	-31	176.1	72.7	-87.6	0	0	0	113	P822 S828	P822-Y824 VanDerWaalsContact C-N 3.26Å; P822-Y824 HydrophobicContact CB-CD1 3.82Å; P822-Y824 HydrophobicContact CB-CE1 3.47Å; P822-Y824 VanDerWaalsContact CB-CE1 3.47Å; P822-Y824 HydrophobicContact CG-CE1 4.44Å; P822-Y824 PolarHBondContact O-N 3.28Å; P822-Y824 VanDerWaalsContact O-N 3.09Å; Y824-S828 WeakPolarHBondContact O-CB 3.15Å; Y824-S828 PolarHBondContact O-N 3.3Å
825	I	88	Confident	86.5	Confident	12 Å²	12	70.2 Å²	70.2	6%	0.062	35%	0.351	C	S	.	.	H	α-helix	trans	-76.5	-43.6	175.2	-55.2	-179.4	0	0	0	109.7	P822 A823 S828 V829 I846 K849 L850	P822-I825 HydrophobicContact CB-CD1 4.19Å; P822-I825 HydrophobicContact CB-CG1 4.28Å; P822-I825 HydrophobicContact CG-CD1 4.12Å; P822-I825 WeakPolarHBondContact O-CA 3.38Å; P822-I825 WeakPolarHBondContact O-CB 3.31Å; P822-I825 PolarHBondContact O-N 2.83Å; A823-I825 VanDerWaalsContact C-N 3.29Å; A823-I825 PolarHBondContact O-N 3.39Å; I825-S828 CarbonylContact O-C 3.16Å; I825-S828 PolarHBondContact O-N 3.48Å; I825-V829 HydrophobicContact CG2-CG2 4.47Å; I825-V829 WeakPolarHBondContact O-CG2 3.47Å; I825-V829 PolarHBondContact O-N 3.15Å; I825-I846 HydrophobicContact CG2-CG2 4.07Å; I825-K849 HydrophobicContact CG2-CD 4.09Å; I825-L850 HydrophobicContact CD1-CD2 3.43Å; I825-L850 VanDerWaalsContact CD1-CD2 3.43Å; I825-L850 HydrophobicContact CD1-CG 4.02Å
826	V	88.6	Confident	86.1	Confident	0 Å²	0	64.9 Å²	64.9	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-58.4	-51.7	177	-175.9	0	0	0	0	110.5	Y814 L817 F821 P822 A823 S828 V829 M830 I846	Y814-V826 HydrophobicContact CD2-CB 4.46Å; Y814-V826 HydrophobicContact CD2-CG1 3.73Å; Y814-V826 HydrophobicContact CE2-CB 4.34Å; Y814-V826 HydrophobicContact CE2-CG1 4.1Å; L817-V826 HydrophobicContact CB-CG1 3.65Å; L817-V826 HydrophobicContact CB-CG2 4.24Å; L817-V826 HydrophobicContact CD1-CG1 4.32Å; F821-V826 HydrophobicContact CB-CG2 3.82Å; P822-V826 PolarHBondContact O-N 3.3Å; P822-V826 VanDerWaalsContact O-N 3.16Å; A823-V826 PolarHBondContact O-N 2.85Å; V826-S828 PolarHBondContact O-N 3.38Å; V826-V829 PolarHBondContact O-N 2.75Å; V826-V829 VanDerWaalsContact O-N 3.09Å; V826-M830 HydrophobicContact CG1-SD 3.98Å; V826-M830 PolarHBondContact O-N 3.19Å; V826-I846 HydrophobicContact CB-CD1 4.38Å; V826-I846 HydrophobicContact CG1-CD1 4.24Å; V826-I846 HydrophobicContact CG2-CD1 4.05Å
827	H	87.9	Confident	85.7	Confident	66 Å²	66	65.2 Å²	65.2	31%	0.306	34%	0.337	S	S	.	.	H	α-helix	trans	-53.5	-56.6	175.3	-168.9	-71.7	0	0	0	110.6	Y814 A823 V829 M830 E831	Y814-H827 HydrophobicContact CE2-CB 4.12Å; A823-H827 WeakPolarHBondContact O-CB 3.35Å; A823-H827 PolarHBondContact O-N 2.92Å; H827-V829 PolarHBondContact O-N 2.85Å; H827-M830 PolarHBondContact O-N 3.09Å; H827-M830 VanDerWaalsContact O-N 3.13Å; H827-E831 IonicContact CE1-OE2 2.74Å; H827-E831 IonicContact ND1-OE2 3.63Å; H827-E831 PolarHBondContact ND1-OE2 3.01Å; H827-E831 VanDerWaalsContact ND1-OE2 3.12Å; H827-E831 WeakPolarHBondContact O-CB 3.46Å; H827-E831 PolarHBondContact O-N 2.94Å
828	S	88.3	Confident	85.6	Confident	34 Å²	34	67.1 Å²	67.1	24%	0.238	35%	0.348	C	S	.	.	H	α-helix	trans	-69.6	0.6	-179.1	-173.5	0	0	0	0	114.4	Y824 I825 V826 E831 K832 K849	Y824-S828 WeakPolarHBondContact O-CB 3.15Å; Y824-S828 PolarHBondContact O-N 3.3Å; I825-S828 CarbonylContact O-C 3.16Å; I825-S828 PolarHBondContact O-N 3.48Å; V826-S828 PolarHBondContact O-N 3.38Å; S828-E831 WeakPolarHBondContact CA-OE2 3.33Å; S828-K832 WeakPolarHBondContact O-CG 3.45Å; S828-K849 PolarHBondContact O-NZ 2.96Å; S828-K849 PolarHBondContact OG-NZ 3.25Å
829	V	88.1	Confident	85.2	Confident	2 Å²	2	68.2 Å²	68.2	1%	0.012	35%	0.354	C	S	.	.	H	α-helix	trans	-99.3	-48.1	166.1	167.9	0	0	0	0	110.4	I825 V826 H827 K832 N833 L842 V845 I846 K849	I825-V829 HydrophobicContact CG2-CG2 4.47Å; I825-V829 WeakPolarHBondContact O-CG2 3.47Å; I825-V829 PolarHBondContact O-N 3.15Å; V826-V829 PolarHBondContact O-N 2.75Å; V826-V829 VanDerWaalsContact O-N 3.09Å; H827-V829 PolarHBondContact O-N 2.85Å; V829-K832 CarbonylContact O-C 3.58Å; V829-K832 PolarHBondContact O-N 2.89Å; V829-K832 VanDerWaalsContact O-N 3.15Å; V829-N833 WeakPolarHBondContact O-CB 3.33Å; V829-N833 PolarHBondContact O-N 3.13Å; V829-N833 PolarHBondContact O-ND2 2.89Å; V829-L842 HydrophobicContact CG1-CD2 4.06Å; V829-V845 HydrophobicContact CG1-CB 3.93Å; V829-V845 HydrophobicContact CG1-CG1 3.58Å; V829-V845 HydrophobicContact CG2-CG1 4.23Å; V829-I846 HydrophobicContact CB-CG1 3.89Å; V829-I846 HydrophobicContact CG1-CG1 3.97Å; V829-I846 HydrophobicContact CG2-CG1 3.81Å; V829-K849 HydrophobicContact CG2-CD 3.46Å; V829-K849 VanDerWaalsContact CG2-CD 3.46Å
830	M	89.1	Confident	85	Confident	6 Å²	6	69.4 Å²	69.4	3%	0.03	36%	0.356	C	S	.	.	H	α-helix	trans	-63.7	-43.5	178.8	-66.7	179.5	68.1	0	0	111.5	I806 Q810 T813 Y814 L817 V826 H827 K832 N833 P834 L842	I806-M830 HydrophobicContact CG2-CE 4.42Å; Q810-M830 HydrophobicContact CB-CE 3.82Å; T813-M830 HydrophobicContact CG2-CE 4.45Å; Y814-M830 HydrophobicContact CD2-SD 3.87Å; Y814-M830 HydrophobicContact CG-SD 4.3Å; L817-M830 HydrophobicContact CD1-SD 4.4Å; V826-M830 HydrophobicContact CG1-SD 3.98Å; V826-M830 PolarHBondContact O-N 3.19Å; H827-M830 PolarHBondContact O-N 3.09Å; H827-M830 VanDerWaalsContact O-N 3.13Å; M830-K832 PolarHBondContact O-N 3.25Å; M830-N833 CarbonylContact O-C 3.56Å; M830-N833 PolarHBondContact O-N 3.34Å; M830-P834 WeakPolarHBondContact O-CA 3.08Å; M830-P834 VanDerWaalsContact O-N 3.1Å; M830-L842 HydrophobicContact CE-CD1 4.14Å; M830-L842 HydrophobicContact CG-CD1 3.9Å; M830-L842 HydrophobicContact CG-CD2 3.84Å; M830-L842 HydrophobicContact CG-CG 4.49Å; M830-L842 HydrophobicContact SD-CD1 4.16Å
831	E	86.3	Confident	84.9	Confident	119 Å²	119	68.5 Å²	68.5	56%	0.556	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.3	-36.3	171.4	179.7	-177.9	-168.1	0	0	113.2	H827 S828	H827-E831 IonicContact CE1-OE2 2.74Å; H827-E831 IonicContact ND1-OE2 3.63Å; H827-E831 PolarHBondContact ND1-OE2 3.01Å; H827-E831 VanDerWaalsContact ND1-OE2 3.12Å; H827-E831 WeakPolarHBondContact O-CB 3.46Å; H827-E831 PolarHBondContact O-N 2.94Å; S828-E831 WeakPolarHBondContact CA-OE2 3.33Å
832	K	85.9	Confident	84.9	Confident	151 Å²	151	66.9 Å²	66.9	66%	0.657	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.6	-10.5	178.9	-66.5	-165	176.5	-161.7	0	114	S828 V829 M830	S828-K832 WeakPolarHBondContact O-CG 3.45Å; V829-K832 CarbonylContact O-C 3.58Å; V829-K832 PolarHBondContact O-N 2.89Å; V829-K832 VanDerWaalsContact O-N 3.15Å; M830-K832 PolarHBondContact O-N 3.25Å
833	N	84.7	Confident	84.8	Confident	36 Å²	36	65.2 Å²	65.2	19%	0.193	33%	0.333	C	S	.	.			trans	-138.1	55.2	-178.2	-55.4	-93.5	0	0	0	110.6	V829 M830 H835 L836	V829-N833 WeakPolarHBondContact O-CB 3.33Å; V829-N833 PolarHBondContact O-N 3.13Å; V829-N833 PolarHBondContact O-ND2 2.89Å; M830-N833 CarbonylContact O-C 3.56Å; M830-N833 PolarHBondContact O-N 3.34Å; N833-H835 PolarHBondContact O-N 3.44Å; N833-L836 HydrophobicContact CB-CB 4.22Å; N833-L836 HydrophobicContact CB-CD1 3.78Å; N833-L836 HydrophobicContact CB-CG 3.97Å; N833-L836 PolarHBondContact O-N 3.07Å
834	P	81.2	Confident	85	Confident	82 Å²	82	65.7 Å²	65.7	53%	0.532	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-14.4	-172.6	27.1	-36.6	0	0	0	113.8	Q810 M830	Q810-P834 PolarHBondContact NE2-O 3.19Å; Q810-P834 VanDerWaalsContact NE2-O 3.15Å; M830-P834 WeakPolarHBondContact O-CA 3.08Å; M830-P834 VanDerWaalsContact O-N 3.1Å
835	H	79.4	Confident	85.1	Confident	138 Å²	138	59.5 Å²	59.5	64%	0.639	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.9	-12.1	174.4	57.5	-92.7	0	0	0	113.8	N833 T837	N833-H835 PolarHBondContact O-N 3.44Å; H835-T837 PolarHBondContact O-N 2.83Å
836	L	79.4	Confident	85.2	Confident	30 Å²	30	59 Å²	59	16%	0.157	32%	0.315	C	S	.	.			trans	-93.6	94.5	176.1	-63.1	-176	0	0	0	110	N833 L842 V845	N833-L836 HydrophobicContact CB-CB 4.22Å; N833-L836 HydrophobicContact CB-CD1 3.78Å; N833-L836 HydrophobicContact CB-CG 3.97Å; N833-L836 PolarHBondContact O-N 3.07Å; L836-L842 HydrophobicContact CB-CD2 3.89Å; L836-L842 HydrophobicContact CB-CG 4.21Å; L836-L842 WeakPolarHBondContact O-CD1 3.45Å; L836-L842 WeakPolarHBondContact O-CG 3.45Å; L836-V845 HydrophobicContact CD1-CG2 4.15Å
837	T	76.9	Confident	85.1	Confident	83 Å²	83	61.1 Å²	61.1	51%	0.509	33%	0.328	S	S	.	.			trans	-87.2	-17.5	176.2	50.4	0	0	0	0	113.7	H835	H835-T837 PolarHBondContact O-N 2.83Å
838	D	83.8	Confident	85.1	Confident	47 Å²	47	61.9 Å²	61.9	25%	0.251	34%	0.337	S	S	.	.			trans	-73	121.3	179.8	168.1	28.8	0	0	0	111.8	Q840 Q841 L842	D838-Q840 PolarHBondContact O-N 2.94Å; D838-Q840 WeakPolarHBondContact OD1-CB 3.4Å; D838-Q840 PolarHBondContact OD1-N 3.45Å; D838-Q841 HydrophobicContact CB-CB 4.25Å; D838-Q841 HydrophobicContact CB-CG 4.5Å; D838-Q841 PolarHBondContact O-N 3.2Å; D838-Q841 VanDerWaalsContact OD2-CG 3.23Å; D838-Q841 WeakPolarHBondContact OD2-CG 3.24Å; D838-Q841 PolarHBondContact OD2-N 3.36Å; D838-Q841 PolarHBondContact OD2-NE2 3.04Å; D838-L842 WeakPolarHBondContact O-CG 3.47Å; D838-L842 PolarHBondContact O-N 3.43Å
839	P	80.2	Confident	84.8	Confident	57 Å²	57	63.5 Å²	63.5	37%	0.37	34%	0.34	S	S	.	.	H	α-helix	trans	-58.3	-29.8	175.8	23.7	-34.5	0	0	0	113.9	T813 A843	T813-P839 HydrophobicContact CG2-CB 4.07Å; P839-A843 VanDerWaalsContact O-CB 3.26Å; P839-A843 WeakPolarHBondContact O-CB 3.48Å; P839-A843 PolarHBondContact O-N 3Å
840	Q	82.6	Confident	84.6	Confident	157 Å²	157	66 Å²	66	73%	0.734	35%	0.353	S	S	*	.	H	α-helix	trans	-73.9	-46.1	-177.4	-54.9	-172.1	18.2	0	0	111.3	D838 A843 A844	D838-Q840 PolarHBondContact O-N 2.94Å; D838-Q840 WeakPolarHBondContact OD1-CB 3.4Å; D838-Q840 PolarHBondContact OD1-N 3.45Å; Q840-A843 PolarHBondContact O-N 2.91Å; Q840-A844 PolarHBondContact O-N 3.07Å
841	Q	83.2	Confident	84.1	Confident	104 Å²	104	74.6 Å²	74.6	49%	0.486	39%	0.385	S	S	.	.	H	α-helix	trans	-62	-44.2	171.9	-77	165.4	77.2	0	0	112.3	D838 A843 A844 V845	D838-Q841 HydrophobicContact CB-CB 4.25Å; D838-Q841 HydrophobicContact CB-CG 4.5Å; D838-Q841 PolarHBondContact O-N 3.2Å; D838-Q841 VanDerWaalsContact OD2-CG 3.23Å; D838-Q841 WeakPolarHBondContact OD2-CG 3.24Å; D838-Q841 PolarHBondContact OD2-N 3.36Å; D838-Q841 PolarHBondContact OD2-NE2 3.04Å; Q841-A843 PolarHBondContact O-N 3.01Å; Q841-A844 PolarHBondContact O-N 2.77Å; Q841-V845 WeakPolarHBondContact O-CG2 3.45Å; Q841-V845 PolarHBondContact O-N 2.79Å
842	L	88.7	Confident	83.4	Confident	0 Å²	0	73.6 Å²	73.6	0%	0	39%	0.391	C	S	.	.	H	α-helix	trans	-59.4	-44.6	174.6	-74.9	172.9	0	0	0	111.9	T813 L817 V829 M830 L836 D838 A844 V845 I846	T813-L842 HydrophobicContact CG2-CD1 3.63Å; L817-L842 HydrophobicContact CD1-CB 3.62Å; L817-L842 HydrophobicContact CD1-CD1 3.78Å; L817-L842 HydrophobicContact CD1-CG 4.36Å; V829-L842 HydrophobicContact CG1-CD2 4.06Å; M830-L842 HydrophobicContact CE-CD1 4.14Å; M830-L842 HydrophobicContact CG-CD1 3.9Å; M830-L842 HydrophobicContact CG-CD2 3.84Å; M830-L842 HydrophobicContact CG-CG 4.49Å; M830-L842 HydrophobicContact SD-CD1 4.16Å; L836-L842 HydrophobicContact CB-CD2 3.89Å; L836-L842 HydrophobicContact CB-CG 4.21Å; L836-L842 WeakPolarHBondContact O-CD1 3.45Å; L836-L842 WeakPolarHBondContact O-CG 3.45Å; D838-L842 WeakPolarHBondContact O-CG 3.47Å; D838-L842 PolarHBondContact O-N 3.43Å; L842-A844 VanDerWaalsContact C-N 3.34Å; L842-A844 PolarHBondContact O-N 3.23Å; L842-V845 PolarHBondContact O-N 3.49Å; L842-I846 WeakPolarHBondContact O-CD1 3.31Å; L842-I846 VanDerWaalsContact O-CG1 3.24Å; L842-I846 WeakPolarHBondContact O-CG1 3.23Å; L842-I846 PolarHBondContact O-N 3.43Å
843	A	87.6	Confident	82.1	Confident	23 Å²	23	71.1 Å²	71.1	19%	0.19	39%	0.392	C	S	.	.	H	α-helix	trans	-60.6	-40.3	175.5	0	0	0	0	0	112.4	L817 F821 P839 Q840 Q841 I846 V847	L817-A843 HydrophobicContact CD2-CB 3.97Å; F821-A843 HydrophobicContact CE2-CB 3.89Å; F821-A843 HydrophobicContact CZ-CB 4.3Å; P839-A843 VanDerWaalsContact O-CB 3.26Å; P839-A843 WeakPolarHBondContact O-CB 3.48Å; P839-A843 PolarHBondContact O-N 3Å; Q840-A843 PolarHBondContact O-N 2.91Å; Q841-A843 PolarHBondContact O-N 3.01Å; A843-I846 PolarHBondContact O-N 3.06Å; A843-V847 WeakPolarHBondContact O-CB 3.41Å; A843-V847 WeakPolarHBondContact O-CG2 3.4Å; A843-V847 PolarHBondContact O-N 3.12Å
844	A	88.6	Confident	80.1	Confident	56 Å²	56	80.3 Å²	80.3	46%	0.463	43%	0.433	S	S	.	.	H	α-helix	trans	-63.2	-40.7	175.4	0	0	0	0	0	112.5	Q840 Q841 L842 T848	Q840-A844 PolarHBondContact O-N 3.07Å; Q841-A844 PolarHBondContact O-N 2.77Å; L842-A844 VanDerWaalsContact C-N 3.34Å; L842-A844 PolarHBondContact O-N 3.23Å; A844-T848 WeakPolarHBondContact O-CB 3.35Å; A844-T848 PolarHBondContact O-N 3.46Å; A844-T848 PolarHBondContact O-OG1 2.88Å
845	V	88.2	Confident	80.1	Confident	47 Å²	47	80.3 Å²	80.3	29%	0.285	43%	0.428	S	S	.	.	H	α-helix	trans	-68	-40.3	174.9	178.5	0	0	0	0	111.3	V829 L836 Q841 L842 T848 K849	V829-V845 HydrophobicContact CG1-CB 3.93Å; V829-V845 HydrophobicContact CG1-CG1 3.58Å; V829-V845 HydrophobicContact CG2-CG1 4.23Å; L836-V845 HydrophobicContact CD1-CG2 4.15Å; Q841-V845 WeakPolarHBondContact O-CG2 3.45Å; Q841-V845 PolarHBondContact O-N 2.79Å; L842-V845 PolarHBondContact O-N 3.49Å; V845-T848 PolarHBondContact O-N 2.88Å; V845-K849 WeakPolarHBondContact O-CB 3.41Å; V845-K849 PolarHBondContact O-N 3.47Å
846	I	90.2	Very high	80.1	Confident	0 Å²	0	77.2 Å²	77.2	0%	0	42%	0.417	C	S	.	.	H	α-helix	trans	-61.2	-47.2	174.7	-68.1	158	0	0	0	111.2	L817 F821 I825 V826 V829 L842 A843 T848 K849 L850	L817-I846 HydrophobicContact CB-CD1 4.41Å; L817-I846 HydrophobicContact CD1-CD1 4.13Å; L817-I846 HydrophobicContact CD2-CD1 4.3Å; F821-I846 HydrophobicContact CB-CG2 3.68Å; F821-I846 HydrophobicContact CD1-CG2 3.7Å; F821-I846 HydrophobicContact CD2-CB 4.42Å; F821-I846 HydrophobicContact CD2-CD1 4.11Å; F821-I846 HydrophobicContact CD2-CG2 3.85Å; F821-I846 HydrophobicContact CE1-CG2 4.25Å; F821-I846 HydrophobicContact CE2-CG2 4.38Å; F821-I846 HydrophobicContact CG-CB 4.49Å; F821-I846 HydrophobicContact CG-CG2 3.47Å; F821-I846 VanDerWaalsContact CG-CG2 3.47Å; I825-I846 HydrophobicContact CG2-CG2 4.07Å; V826-I846 HydrophobicContact CB-CD1 4.38Å; V826-I846 HydrophobicContact CG1-CD1 4.24Å; V826-I846 HydrophobicContact CG2-CD1 4.05Å; V829-I846 HydrophobicContact CB-CG1 3.89Å; V829-I846 HydrophobicContact CG1-CG1 3.97Å; V829-I846 HydrophobicContact CG2-CG1 3.81Å; L842-I846 WeakPolarHBondContact O-CD1 3.31Å; L842-I846 VanDerWaalsContact O-CG1 3.24Å; L842-I846 WeakPolarHBondContact O-CG1 3.23Å; L842-I846 PolarHBondContact O-N 3.43Å; A843-I846 PolarHBondContact O-N 3.06Å; I846-T848 VanDerWaalsContact C-N 3.31Å; I846-T848 PolarHBondContact O-N 3.49Å; I846-K849 PolarHBondContact O-N 3.06Å; I846-L850 HydrophobicContact CG2-CD1 3.92Å; I846-L850 WeakPolarHBondContact O-CB 3.42Å; I846-L850 WeakPolarHBondContact O-CG 3.44Å; I846-L850 PolarHBondContact O-N 2.77Å
847	V	87.9	Confident	80.1	Confident	45 Å²	45	79.8 Å²	79.8	27%	0.273	43%	0.432	S	S	.	.	H	α-helix	trans	-63.3	-37.3	177.1	169.2	0	0	0	0	111.6	F821 A843 R851	F821-V847 HydrophobicContact CE1-CG2 3.66Å; F821-V847 HydrophobicContact CZ-CG2 3.74Å; A843-V847 WeakPolarHBondContact O-CB 3.41Å; A843-V847 WeakPolarHBondContact O-CG2 3.4Å; A843-V847 PolarHBondContact O-N 3.12Å; V847-R851 VanDerWaalsContact O-CG 3.31Å; V847-R851 WeakPolarHBondContact O-CG 3.39Å; V847-R851 PolarHBondContact O-N 2.98Å
848	T	86	Confident	80.3	Confident	83 Å²	83	79.6 Å²	79.6	51%	0.509	43%	0.427	S	S	.	.	H	α-helix	trans	-67	-45.8	176.1	-56.5	0	0	0	0	111	A844 V845 I846 L850 R851 S852	A844-T848 WeakPolarHBondContact O-CB 3.35Å; A844-T848 PolarHBondContact O-N 3.46Å; A844-T848 PolarHBondContact O-OG1 2.88Å; V845-T848 PolarHBondContact O-N 2.88Å; I846-T848 VanDerWaalsContact C-N 3.31Å; I846-T848 PolarHBondContact O-N 3.49Å; T848-L850 PolarHBondContact O-N 3.31Å; T848-R851 PolarHBondContact O-N 3.02Å; T848-R851 VanDerWaalsContact O-N 3.12Å; T848-S852 PolarHBondContact O-N 3.27Å; T848-S852 PolarHBondContact O-OG 3.32Å
849	K	84	Confident	80.1	Confident	67 Å²	67	81.7 Å²	81.7	29%	0.291	44%	0.438	S	S	.	.	H	α-helix	trans	-62.2	-40.5	176.7	-170	176.7	178.2	-172.6	0	112.2	I825 S828 V829 V845 I846 R851 S852 C853	I825-K849 HydrophobicContact CG2-CD 4.09Å; S828-K849 PolarHBondContact O-NZ 2.96Å; S828-K849 PolarHBondContact OG-NZ 3.25Å; V829-K849 HydrophobicContact CG2-CD 3.46Å; V829-K849 VanDerWaalsContact CG2-CD 3.46Å; V845-K849 WeakPolarHBondContact O-CB 3.41Å; V845-K849 PolarHBondContact O-N 3.47Å; I846-K849 PolarHBondContact O-N 3.06Å; K849-R851 VanDerWaalsContact C-N 3.33Å; K849-R851 PolarHBondContact O-N 3.31Å; K849-S852 PolarHBondContact O-N 3.43Å; K849-C853 PolarHBondContact O-N 3.42Å; K849-C853 PolarHBondContact O-SG 2.78Å
850	L	83	Confident	80.1	Confident	55 Å²	55	83.3 Å²	83.3	29%	0.288	44%	0.443	S	S	.	.	H	α-helix	trans	-60.6	-39.2	172.2	-84.2	164.3	0	0	0	112.6	F821 I825 I846 T848 S852 C853	F821-L850 HydrophobicContact CD1-CD1 3.85Å; F821-L850 HydrophobicContact CE1-CD1 4.38Å; I825-L850 HydrophobicContact CD1-CD2 3.43Å; I825-L850 VanDerWaalsContact CD1-CD2 3.43Å; I825-L850 HydrophobicContact CD1-CG 4.02Å; I846-L850 HydrophobicContact CG2-CD1 3.92Å; I846-L850 WeakPolarHBondContact O-CB 3.42Å; I846-L850 WeakPolarHBondContact O-CG 3.44Å; I846-L850 PolarHBondContact O-N 2.77Å; T848-L850 PolarHBondContact O-N 3.31Å; L850-S852 VanDerWaalsContact C-N 3.35Å; L850-C853 PolarHBondContact O-N 3.48Å
851	R	79.2	Confident	79.9	Confident	186 Å²	186	78.1 Å²	78.1	70%	0.702	42%	0.422	S	S	*	.	H	α-helix	trans	-71.6	-25	176.6	-74.1	173	-180	178.3	1.8	113.7	V847 T848 K849 C853	V847-R851 VanDerWaalsContact O-CG 3.31Å; V847-R851 WeakPolarHBondContact O-CG 3.39Å; V847-R851 PolarHBondContact O-N 2.98Å; T848-R851 PolarHBondContact O-N 3.02Å; T848-R851 VanDerWaalsContact O-N 3.12Å; K849-R851 VanDerWaalsContact C-N 3.33Å; K849-R851 PolarHBondContact O-N 3.31Å; R851-C853 VanDerWaalsContact C-N 3.29Å
852	S	71.1	Confident	79.7	Confident	99 Å²	99	76.1 Å²	76.1	69%	0.692	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.6	2.6	172.7	-61.2	0	0	0	0	114.1	T848 K849 L850	T848-S852 PolarHBondContact O-N 3.27Å; T848-S852 PolarHBondContact O-OG 3.32Å; K849-S852 PolarHBondContact O-N 3.43Å; L850-S852 VanDerWaalsContact C-N 3.35Å
853	C	57.3	Low	78.9	Confident	98 Å²	98	82.4 Å²	82.4	66%	0.662	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103	15	170.8	-65.3	0	0	0	0	112.8	K849 L850 R851	K849-C853 PolarHBondContact O-N 3.42Å; K849-C853 PolarHBondContact O-SG 2.78Å; L850-C853 PolarHBondContact O-N 3.48Å; R851-C853 VanDerWaalsContact C-N 3.29Å
854	H	44.2	Very low	78.2	Confident	230 Å²	230	87.8 Å²	87.8	100%	1.065	48%	0.475	S	S	*	.			trans	-131.7	0	177.6	-86.8	-63.5	0	0	0	110.9

Retrieved 854 of 854 residues in 129 ms (Link to these results)

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