A0A077Z7R5_TRITR Loading...

Vps16 C and Golgin A5 domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z7R5, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 955 aa.

						>A0A077Z7R5_TRITR|A0A077Z7R5
MDNWQAQSNNGCNEMQLDKDNCQCVVAVRSASKNRRRLHNVGTATSSSSSRTDEQEHIVPSECQQSCEPYSDKCFEEQSHLSLPLVERDSGTESDEELELIETNSMTSVAVSQTSDYYASQPSWSISSCHSVVGSPVCCALNDQDLNCWDNLSIHCSSEQPPTDDANEQIMDPELPLHHYHTRQQFQRLKQQISIGATSPRRAADNANTNTNSSSSSSTGSNNEPTGIAGRRANFSVSDSSKTAFVCLKRSRERLEQESAKRGNDEQKKKESSDATWPNVHHATRRTAPIRLLIPPAAEETKLDLQETTSEEMPSNGSTSADMSPRKKSRHHNALKCSATSARPSLNFEKMQKKMVKPMHHHRKKGSSSSSLLSCGSSRDSMKAKVKLRVGPILRWRQAAPPMQIRSDHFVFVHWGAQAWSDGYQLRSCGNNYLFRPLESADDAFNQMEHDVDDDLTLRQLLSAIIKQVRRVDNLDVPQPESCFGRMDEDFWNTSTISCFSFDDQHAETARTIEELGNRLQSFDMGSSQSDETDASDLSSFQSPKAGEVGIDISAERSSQSSNVQSSGNFAERRPERKNTPEEYAKLQKEFNKAQSKLCTLEKQLYHDRYMTTSHEDTIRRIAQGEPYSFCSCRSAVEKVSLLEKAFEFGDGDAICCVLLFLEGTLAPSAFRQLLLEYSYAAKHYVFMLRQLEDTEKLIETLLLLGQQEELVNVELRKIKMQRDSEAKIRALRKAIGGAMFAGSFSEERRFLQEQLDLLERQLPVEDSDTKAIVQGQGEKFFRFPKSQSLVGLSVLETLEYCCLYHYDLPSNSFASPLSIRAQYKISDRQFGWIVAKALAAQHMWPELQKLMLAKNLFGKQKLKSPISCEQFLRLLSMHGAPSSEMVVYISSLTNGQRKLDLAKKYKCDNIVVEQLVALRDRAALLQYISGLTPNSESAQKAMDALDNPVTFFLV
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	33.9	Very low	30.5	Very low	225 Å²	225	155.4 Å²	155.4	100%	1.108	84%	0.838	S	S	*	*				0	82.9	0	-69.9	-177.5	176.5	0	0	111.2
2	D	32.9	Very low	30	Very low	144 Å²	144	151.9 Å²	151.9	77%	0.77	83%	0.833	S	S	*	*			cis	-176.3	147.9	-28.4	-84.2	-35.9	0	0	0	106.4
3	N	33.5	Very low	29.8	Very low	148 Å²	148	152.7 Å²	152.7	79%	0.791	84%	0.835	S	S	*	*			cis	-150.3	158.9	-27	-171.6	16	0	0	0	107.1
4	W	23.5	Very low	29.8	Very low	229 Å²	229	156.1 Å²	156.1	87%	0.867	84%	0.842	S	S	*	*			trans	-72.4	137.6	177.3	-98.6	63.8	0	0	0	112.2
5	Q	33.3	Very low	29.6	Very low	194 Å²	194	155.5 Å²	155.5	91%	0.907	84%	0.835	S	S	*	*			trans	-161.2	137.7	141.4	-116	163.3	-4.9	0	0	111.6
6	A	29.6	Very low	29.8	Very low	85 Å²	85	158.4 Å²	158.4	70%	0.702	84%	0.842	S	S	*	*			trans	-119	146.3	174.4	0	0	0	0	0	109.5
7	Q	34	Very low	29.7	Very low	204 Å²	204	156.8 Å²	156.8	95%	0.953	83%	0.832	S	S	*	*			trans	-145.7	158.6	165.2	-110.4	177.3	-3.3	0	0	109.6
8	S	28.3	Very low	29.8	Very low	96 Å²	96	156.8 Å²	156.8	67%	0.671	83%	0.833	S	S	*	*			trans	-119.4	172.8	-153.9	65.6	0	0	0	0	114.8
9	N	28.5	Very low	29.7	Very low	136 Å²	136	157.6 Å²	157.6	73%	0.727	83%	0.828	S	S	*	*			trans	88.7	144.6	159.8	-55.9	-4.8	0	0	0	118.7
10	N	29.1	Very low	29.9	Very low	168 Å²	168	157.8 Å²	157.8	90%	0.898	83%	0.83	S	S	*	*			trans	74.2	116.4	162.2	-55	-17.7	0	0	0	118.1
11	G	28.8	Very low	30	Very low	80 Å²	80	158 Å²	158	83%	0.825	83%	0.832	S	S	*	*			trans	162.4	98.2	168.7	0	0	0	0	0	112.5
12	C	24.3	Very low	29.7	Very low	114 Å²	114	152 Å²	152	77%	0.77	81%	0.811	S	S	*	*			trans	-87.5	161.3	166.7	-70.1	0	0	0	0	110.7
13	N	27.6	Very low	29.4	Very low	162 Å²	162	153.8 Å²	153.8	87%	0.866	81%	0.814	S	S	*	*			trans	72.2	113.5	170	-44.8	-37.2	0	0	0	116.7
14	E	30.6	Very low	29.1	Very low	200 Å²	200	152.6 Å²	152.6	94%	0.935	82%	0.816	S	S	*	*				-147.7	142.3	110.2	-140.5	179.1	150.1	0	0	110.5
15	M	26.7	Very low	29	Very low	148 Å²	148	148 Å²	148	73%	0.729	81%	0.813	S	S	*	*			trans	-117.5	109.2	-177.2	-177.8	-176.1	75.5	0	0	108.9	L17	M15-L17 HydrophobicContact CE-CD2 4.05Å; M15-L17 HydrophobicContact CE-CG 4.1Å; M15-L17 PolarHBondContact O-N 3.3Å
16	Q	32.1	Very low	28.7	Very low	202 Å²	202	145.5 Å²	145.5	94%	0.944	81%	0.811	S	S	*	*			trans	-81	93.5	-173.6	-148.3	166	18.4	0	0	111
17	L	28.1	Very low	28.4	Very low	131 Å²	131	145.5 Å²	145.5	69%	0.686	81%	0.811	S	S	*	*			trans	-61.3	128.5	175.4	-76.7	151.3	0	0	0	111.8	M15	M15-L17 HydrophobicContact CE-CD2 4.05Å; M15-L17 HydrophobicContact CE-CG 4.1Å; M15-L17 PolarHBondContact O-N 3.3Å
18	D	31.3	Very low	27.9	Very low	157 Å²	157	142.2 Å²	142.2	84%	0.84	81%	0.805	S	S	*	*			trans	-90.9	153	149	-152.6	-8.1	0	0	0	109.6
19	K	28.7	Very low	27.8	Very low	171 Å²	171	148.7 Å²	148.7	74%	0.743	81%	0.814	S	S	*	*			trans	-111.6	126.4	-162.4	-63.6	167.5	-174.5	166.8	0	111.4
20	D	33.7	Very low	27.7	Very low	162 Å²	162	147.2 Å²	147.2	87%	0.866	82%	0.815	S	S	*	*				178.8	113.9	124.1	-94.4	-15.1	0	0	0	112.4
21	N	31.6	Very low	27.6	Very low	163 Å²	163	143.4 Å²	143.4	87%	0.872	81%	0.807	S	S	*	*				151.3	133	119.6	-161.1	11.8	0	0	0	111
22	C	27.2	Very low	27.4	Very low	99 Å²	99	144.9 Å²	144.9	67%	0.669	80%	0.804	S	S	*	*			trans	-116.6	143.8	-163.3	-75.7	0	0	0	0	114.1
23	Q	27	Very low	27.7	Very low	180 Å²	180	148.7 Å²	148.7	84%	0.841	81%	0.808	S	S	*	*			trans	58.1	138.5	142.6	-61.2	172.4	-17.4	0	0	118.1
24	C	26.9	Very low	27.8	Very low	123 Å²	123	147.8 Å²	147.8	83%	0.831	80%	0.803	S	S	*	*				-160.4	171.9	64.3	-95.8	0	0	0	0	112.7
25	V	22.6	Very low	27.7	Very low	132 Å²	132	148.7 Å²	148.7	80%	0.8	80%	0.798	S	S	*	*			trans	-141.3	145	-161.1	169.7	0	0	0	0	112.6
26	V	25.1	Very low	27.9	Very low	142 Å²	142	151.2 Å²	151.2	86%	0.861	80%	0.799	S	S	*	*			trans	78.4	150.5	158	151.7	0	0	0	0	121.7
27	A	24.8	Very low	27.7	Very low	85 Å²	85	152.3 Å²	152.3	70%	0.702	80%	0.795	S	S	*	*			trans	115.7	73.6	151.5	0	0	0	0	0	121.5
28	V	23.6	Very low	27.9	Very low	136 Å²	136	153.6 Å²	153.6	82%	0.824	80%	0.802	S	S	*	*				14.7	125	129.6	-158.4	0	0	0	0	120.6
29	R	26.5	Very low	28	Very low	231 Å²	231	153.7 Å²	153.7	87%	0.872	80%	0.796	S	S	*	*				176.4	125.4	115.1	-98.3	-177.1	170.8	136.9	0	117.7
30	S	25.3	Very low	28.1	Very low	106 Å²	106	151.9 Å²	151.9	74%	0.741	80%	0.795	S	S	*	*			trans	60.8	125	132.9	-57.7	0	0	0	0	125.5
31	A	26.6	Very low	28	Very low	88 Å²	88	151.6 Å²	151.6	73%	0.727	80%	0.799	S	S	*	*				89.3	96.4	126.5	0	0	0	0	0	123.5
32	S	26.1	Very low	28	Very low	110 Å²	110	147.2 Å²	147.2	77%	0.769	79%	0.793	S	S	*	*				52.8	114.9	113.6	-52.1	0	0	0	0	123
33	K	30.4	Very low	27.9	Very low	195 Å²	195	149.8 Å²	149.8	85%	0.848	81%	0.805	S	S	*	*				175.7	159.8	108.5	-97.1	164.4	-178.3	173	0	116.4
34	N	29.8	Very low	28.2	Very low	143 Å²	143	146 Å²	146	77%	0.765	81%	0.805	S	S	*	*			trans	65.7	74.3	150.6	-66.2	0.9	0	0	0	123.4
35	R	27.9	Very low	28.2	Very low	219 Å²	219	147 Å²	147	83%	0.826	81%	0.807	S	S	*	*				24.1	116.9	99.6	-147.9	-169.2	-161.1	-175	6.9	118.7
36	R	30.1	Very low	28.8	Very low	200 Å²	200	146.8 Å²	146.8	76%	0.755	81%	0.812	S	S	*	*				146.9	141.9	123.6	-83.7	-179.6	166.6	164.5	-3.9	117.1
37	R	29.2	Very low	29	Very low	225 Å²	225	145.2 Å²	145.2	85%	0.849	81%	0.807	S	S	*	*			trans	67.3	149.4	152.6	-74.9	176.3	173.6	-178.5	-4.5	117.2
38	L	32.2	Very low	29.4	Very low	159 Å²	159	146.9 Å²	146.9	83%	0.832	81%	0.814	S	S	*	*			cis	-124.4	161.9	-4.9	-73.4	96.5	0	0	0	108.8
39	H	32.4	Very low	29.7	Very low	158 Å²	158	145.5 Å²	145.5	73%	0.731	81%	0.81	S	S	*	*			cis	103.1	110.3	24.7	-149.3	-86.2	0	0	0	115.1
40	N	30.3	Very low	30.1	Very low	133 Å²	133	139.7 Å²	139.7	71%	0.711	81%	0.805	S	S	*	*			trans	32.2	124.6	160.3	-56.9	6.2	0	0	0	123.3
41	V	32.7	Very low	30.2	Very low	156 Å²	156	145.6 Å²	145.6	95%	0.945	81%	0.811	S	S	*	*				-159.4	145.6	120.4	177.6	0	0	0	0	105.9
42	G	31.6	Very low	30.5	Very low	72 Å²	72	147.6 Å²	147.6	74%	0.742	81%	0.814	S	S	*	*			cis	173.2	151.8	-5.6	0	0	0	0	0	109.6
43	T	25.8	Very low	30.7	Very low	152 Å²	152	149.3 Å²	149.3	93%	0.933	82%	0.815	S	S	*	*			trans	-103.7	147.1	-174	43.1	0	0	0	0	113.5
44	A	32.3	Very low	30.8	Very low	101 Å²	101	149.9 Å²	149.9	84%	0.835	82%	0.82	S	S	*	*			trans	-150.5	143	164.3	0	0	0	0	0	111.4
45	T	27.7	Very low	30.7	Very low	143 Å²	143	150.9 Å²	150.9	88%	0.877	82%	0.82	S	S	*	*			trans	-137.4	140.8	178.6	47.6	0	0	0	0	110.4
46	S	33.7	Very low	30.9	Very low	128 Å²	128	150 Å²	150	90%	0.895	83%	0.826	S	S	*	*			trans	-160.6	165.3	166.6	51.8	0	0	0	0	110.9
47	S	30	Very low	30.8	Very low	109 Å²	109	147.7 Å²	147.7	76%	0.762	82%	0.823	S	S	*	*			trans	-140.7	-171.7	-160.5	58.2	0	0	0	0	113
48	S	33.4	Very low	30.9	Very low	121 Å²	121	145.3 Å²	145.3	85%	0.846	83%	0.825	S	S	*	*			trans	77.3	157.7	175.3	83.9	0	0	0	0	116.1
49	S	29.6	Very low	30.8	Very low	107 Å²	107	143 Å²	143	75%	0.748	82%	0.818	S	S	*	*			cis	-170.6	178.5	-29.3	-172.5	0	0	0	0	109.5
50	S	34.2	Very low	30.9	Very low	109 Å²	109	141.5 Å²	141.5	76%	0.762	82%	0.822	S	S	*	*			trans	63.2	142.4	176.1	41.5	0	0	0	0	117.4
51	R	28.3	Very low	31	Very low	229 Å²	229	140.8 Å²	140.8	86%	0.864	83%	0.828	S	S	*	*			cis	99.2	100.6	22.9	-92.4	-167.6	160.3	-176.5	-5.4	115.9
52	T	33.8	Very low	30.8	Very low	131 Å²	131	141.4 Å²	141.4	80%	0.804	82%	0.82	S	S	*	*			trans	-175.7	122.2	137.7	33.1	0	0	0	0	104.3
53	D	28.7	Very low	30.6	Very low	145 Å²	145	144.3 Å²	144.3	78%	0.775	83%	0.827	S	S	*	*				65	98.4	59.1	-65.3	-40.7	0	0	0	113.5
54	E	33.6	Very low	30.6	Very low	207 Å²	207	144.4 Å²	144.4	97%	0.967	82%	0.817	S	S	*	*			trans	-155.4	153.7	153.4	-131.3	169.3	-168.4	0	0	109.8
55	Q	27.8	Very low	30.6	Very low	164 Å²	164	148.2 Å²	148.2	77%	0.766	82%	0.818	S	S	*	*			trans	-148.9	124.3	-158.6	176.3	-174.7	1.3	0	0	111.6
56	E	31.2	Very low	30.7	Very low	201 Å²	201	146.2 Å²	146.2	94%	0.939	81%	0.81	S	S	*	*			trans	-132.2	151.3	169.8	-79.3	-156.3	120	0	0	113.6
57	H	28.2	Very low	30.5	Very low	151 Å²	151	145 Å²	145	70%	0.699	80%	0.8	S	S	*	*			trans	-111.4	130.7	-173.3	-109.9	-101.6	0	0	0	110.7
58	I	31.7	Very low	30.4	Very low	175 Å²	175	148 Å²	148	90%	0.897	80%	0.802	S	S	*	*			trans	-136.9	138.5	150.7	-59	-175.6	0	0	0	108.6
59	V	30.6	Very low	30.3	Very low	111 Å²	111	147.5 Å²	147.5	67%	0.673	80%	0.796	S	S	*	*			trans	-123.6	147	-173.6	170.5	0	0	0	0	108.2
60	P	34.5	Very low	30.3	Very low	126 Å²	126	153.9 Å²	153.9	82%	0.818	81%	0.806	S	S	*	*			trans	-88.3	171.4	-160.2	35.5	-37.6	0	0	0	115.2
61	S	31.9	Very low	30.2	Very low	119 Å²	119	153.2 Å²	153.2	83%	0.832	80%	0.801	S	S	*	*			trans	-115.2	151.2	177.5	58.2	0	0	0	0	113
62	E	27.8	Very low	30.2	Very low	169 Å²	169	149.2 Å²	149.2	79%	0.79	80%	0.796	S	S	*	*			trans	-83.1	167.4	-171.2	-57.2	146.6	109.4	0	0	114.7
63	C	27.9	Very low	30	Very low	132 Å²	132	152.7 Å²	152.7	89%	0.892	80%	0.801	S	S	*	*			trans	-152.2	134	140.4	-158	0	0	0	0	109.9
64	Q	26.6	Very low	29.8	Very low	154 Å²	154	151.4 Å²	151.4	72%	0.72	80%	0.801	S	S	*	*			trans	-118.3	147.9	-172.7	-57.9	169.8	-54.8	0	0	112
65	Q	31.8	Very low	29.5	Very low	182 Å²	182	150.9 Å²	150.9	85%	0.85	80%	0.796	S	S	*	*			trans	177.2	113.5	147.8	-98.1	148.6	49.4	0	0	108
66	S	28.9	Very low	29.5	Very low	101 Å²	101	152 Å²	152	71%	0.706	80%	0.802	S	S	*	*				71.9	127.2	80.1	76.1	0	0	0	0	112.3
67	C	29.7	Very low	29.4	Very low	102 Å²	102	150.2 Å²	150.2	69%	0.689	79%	0.793	S	S	*	*			cis	-157.1	171.7	11.7	-88.5	0	0	0	0	108.5
68	E	28.9	Very low	29.4	Very low	171 Å²	171	152.2 Å²	152.2	80%	0.799	80%	0.803	S	S	*	*			cis	-161.6	168.4	-11.3	-110.8	167.9	114.6	0	0	108.8
69	P	30.1	Very low	29.4	Very low	112 Å²	112	148.3 Å²	148.3	73%	0.727	79%	0.791	S	S	*	*			trans	-95.9	164.4	-174.9	37.9	-34.6	0	0	0	115
70	Y	31	Very low	29.1	Very low	241 Å²	241	152 Å²	152	95%	0.945	80%	0.801	S	S	*	*			trans	-134.3	151.1	162.3	-117.4	-92.8	0	0	0	111.1
71	S	32.3	Very low	28.9	Very low	94 Å²	94	153.8 Å²	153.8	66%	0.657	80%	0.802	S	S	*	*			trans	-103	148.3	-156.2	59.5	0	0	0	0	116.4
72	D	27.2	Very low	28.6	Very low	145 Å²	145	153.3 Å²	153.3	78%	0.775	80%	0.799	S	S	*	*			trans	17.9	128.5	141.9	-52.2	-32.2	0	0	0	120.3
73	K	29.6	Very low	28.6	Very low	205 Å²	205	153.4 Å²	153.4	89%	0.891	80%	0.804	S	S	*	*				-160.9	127	116.9	-108.3	161.8	-172	176.9	0	112.1
74	C	24.1	Very low	28.8	Very low	117 Å²	117	152.4 Å²	152.4	79%	0.791	80%	0.796	S	S	*	*			trans	-78.5	151.4	169.3	-53	0	0	0	0	110.6
75	F	28.6	Very low	28.7	Very low	197 Å²	197	151.6 Å²	151.6	86%	0.864	80%	0.796	S	S	*	*			trans	-148.3	119.1	147.5	-120.3	-84.5	0	0	0	108.4
76	E	26.1	Very low	28.7	Very low	188 Å²	188	148.6 Å²	148.6	88%	0.879	79%	0.79	S	S	*	*			trans	-85.8	132.6	161.7	-68.1	176.7	108.5	0	0	107.6
77	E	30.7	Very low	28.8	Very low	163 Å²	163	151.5 Å²	151.5	76%	0.762	79%	0.792	S	S	*	*			trans	-145.3	90	167.8	-164.4	160	-137.5	0	0	110.1	S79	E77-S79 PolarHBondContact O-N 3.01Å
78	Q	26.6	Very low	28.7	Very low	193 Å²	193	154 Å²	154	90%	0.902	79%	0.787	S	S	*	*			trans	-70.2	105.9	168.1	-74.1	-176.9	-19.5	0	0	109.1
79	S	31.6	Very low	28.9	Very low	92 Å²	92	153.1 Å²	153.1	64%	0.643	79%	0.788	S	S	*	*			trans	-120.8	106.2	169.6	46.9	0	0	0	0	110.3	E77 L81	E77-S79 PolarHBondContact O-N 3.01Å; S79-L81 PolarHBondContact O-N 2.77Å
80	H	26.1	Very low	28.8	Very low	190 Å²	190	153.2 Å²	153.2	88%	0.88	79%	0.791	S	S	*	*			trans	-63.2	119.9	165.4	-76.2	-111.7	0	0	0	108.7
81	L	28.8	Very low	28.8	Very low	162 Å²	162	144.6 Å²	144.6	85%	0.848	78%	0.776	S	S	*	*			trans	-148.2	120.1	165.3	-110.2	163.2	0	0	0	111.6	S79	S79-L81 PolarHBondContact O-N 2.77Å
82	S	26.6	Very low	28.6	Very low	109 Å²	109	146.7 Å²	146.7	76%	0.762	78%	0.784	S	S	*	*			trans	-43.9	134.4	-176.1	-44	0	0	0	0	115.4	P84	S82-P84 WeakPolarHBondContact O-CD 3.46Å
83	L	28.4	Very low	29	Very low	172 Å²	172	148.4 Å²	148.4	90%	0.901	79%	0.788	S	S	*	*			trans	-68.8	127.2	161.6	-72.6	173	0	0	0	109.9
84	P	31	Very low	29.1	Very low	110 Å²	110	144 Å²	144	71%	0.714	78%	0.783	S	S	*	*			trans	-73.6	132.8	167.1	-11.2	27.7	0	0	0	110.2	S82 V86	S82-P84 WeakPolarHBondContact O-CD 3.46Å; P84-V86 PolarHBondContact O-N 2.64Å
85	L	25.4	Very low	29.7	Very low	138 Å²	138	146.6 Å²	146.6	72%	0.723	79%	0.789	S	S	*	*			trans	-72.7	115.1	164.7	179.5	72.7	0	0	0	108.5	L303	L85-L303 HydrophobicContact CD1-CD1 3.56Å; L85-L303 HydrophobicContact CD1-CD2 3.9Å; L85-L303 HydrophobicContact CD1-CG 4.41Å
86	V	30.5	Very low	30.1	Very low	119 Å²	119	144.9 Å²	144.9	72%	0.721	78%	0.784	S	S	*	*			trans	-132.4	137	167.1	-176.7	0	0	0	0	108.9	P84	P84-V86 PolarHBondContact O-N 2.64Å
87	E	31.1	Very low	30.5	Very low	162 Å²	162	145.4 Å²	145.4	76%	0.757	79%	0.786	S	S	*	*			trans	-57.4	160.3	-161.5	-67.9	136.8	142	0	0	116.6
88	R	28.1	Very low	30.4	Very low	153 Å²	153	143.3 Å²	143.3	58%	0.577	78%	0.78	S	S	*	*			trans	-68.5	132.2	159.3	-69.8	-176	176.3	95.2	-2.5	108.4	L303 D304 L305	R88-L303 VanDerWaalsContact CZ-O 3.28Å; R88-L303 PolarHBondContact NH1-O 2.69Å; R88-L303 PolarHBondContact NH2-O 3.1Å; R88-D304 PolarHBondContact NH1-O 3.49Å; R88-D304 VanDerWaalsContact NH1-O 3.13Å; R88-L305 HydrophobicContact CB-CD1 4.3Å
89	D	32.8	Very low	30.8	Very low	153 Å²	153	143.5 Å²	143.5	82%	0.818	78%	0.78	S	S	*	*			trans	-122.1	112.4	163.8	-156.7	-10.7	0	0	0	109.5	G91	D89-G91 PolarHBondContact O-N 3.21Å; D89-G91 VanDerWaalsContact O-N 3.07Å
90	S	28.1	Very low	30.6	Very low	114 Å²	114	145.6 Å²	145.6	80%	0.797	78%	0.784	S	S	*	*			trans	-86.2	53.4	-175.7	45.1	0	0	0	0	111.8	T92	S90-T92 PolarHBondContact O-N 2.83Å; S90-T92 VanDerWaalsContact O-N 3.12Å
91	G	31	Very low	30.8	Very low	61 Å²	61	145 Å²	145	63%	0.629	79%	0.785	S	S	*	*			trans	-72.2	97.5	-179	0	0	0	0	0	113.7	D89 E93	D89-G91 PolarHBondContact O-N 3.21Å; D89-G91 VanDerWaalsContact O-N 3.07Å; G91-E93 PolarHBondContact O-N 3.27Å
92	T	29.1	Very low	30.9	Very low	137 Å²	137	145.4 Å²	145.4	84%	0.84	78%	0.783	S	S	*	*			trans	-80.7	97.6	164.2	51	0	0	0	0	110.6	S90	S90-T92 PolarHBondContact O-N 2.83Å; S90-T92 VanDerWaalsContact O-N 3.12Å
93	E	35	Very low	31	Very low	181 Å²	181	146.2 Å²	146.2	85%	0.846	78%	0.783	S	S	*	*			trans	-106.3	94.4	170.6	-70.3	-171.9	138.2	0	0	111	G91	G91-E93 PolarHBondContact O-N 3.27Å
94	S	31.8	Very low	31	Very low	114 Å²	114	145.7 Å²	145.7	80%	0.797	78%	0.782	S	S	*	*			trans	-77.6	132.6	152	51.7	0	0	0	0	108.9
95	D	36.4	Very low	30.8	Very low	171 Å²	171	145.1 Å²	145.1	91%	0.914	78%	0.78	S	S	*	*			trans	-131.6	134.1	168.5	-142.3	-0.2	0	0	0	108.6
96	E	37.8	Very low	30.8	Very low	160 Å²	160	147.7 Å²	147.7	75%	0.748	79%	0.79	S	S	*	*			trans	-94.9	154.4	-154.9	-57.2	-175.7	125.8	0	0	114.3
97	E	32.5	Very low	30.7	Very low	199 Å²	199	148.2 Å²	148.2	93%	0.93	79%	0.794	S	S	*	*			trans	-145.7	116.9	140.5	-157.1	167.1	-158.6	0	0	108.3
98	L	29.5	Very low	30.4	Very low	120 Å²	120	146 Å²	146	63%	0.628	80%	0.797	S	S	*	*			trans	-79.8	143.9	-172.8	-72.1	98.1	0	0	0	112.8	L100	L98-L100 HydrophobicContact CD2-CD1 4.08Å
99	E	34.1	Very low	30.4	Very low	196 Å²	196	145.7 Å²	145.7	92%	0.916	81%	0.811	S	S	*	*			trans	-144.1	129.3	139.4	-134.8	175.4	-151.1	0	0	110.4
100	L	28.5	Very low	30.2	Very low	137 Å²	137	142.9 Å²	142.9	72%	0.717	81%	0.809	S	S	*	*			trans	-85.1	135.2	-174.9	-71.3	75.7	0	0	0	111.1	L98	L98-L100 HydrophobicContact CD2-CD1 4.08Å
101	I	31	Very low	30.1	Very low	176 Å²	176	143 Å²	143	90%	0.903	81%	0.805	S	S	*	*			trans	-131	129.9	144.7	-62.1	-174.8	0	0	0	108.2
102	E	31	Very low	30	Very low	172 Å²	172	146 Å²	146	80%	0.804	82%	0.816	S	S	*	*			trans	-76.7	150.6	-165.7	-60.1	167.5	115.3	0	0	113.8
103	T	28.6	Very low	30	Very low	125 Å²	125	147.4 Å²	147.4	77%	0.767	81%	0.814	S	S	*	*			trans	-65.4	132.6	162.8	51.2	0	0	0	0	110.9
104	N	26.9	Very low	29.8	Very low	162 Å²	162	145.5 Å²	145.5	87%	0.866	81%	0.814	S	S	*	*			trans	179.5	131.6	136.6	-98.8	-47.8	0	0	0	113.3
105	S	28.5	Very low	29.8	Very low	97 Å²	97	145.1 Å²	145.1	68%	0.678	81%	0.812	S	S	*	*				163.2	95.9	124.8	-176.5	0	0	0	0	111.5
106	M	24.2	Very low	29.3	Very low	192 Å²	192	143.9 Å²	143.9	95%	0.946	81%	0.805	S	S	*	*			trans	-71.8	137.3	154.6	-72.8	173.7	60.4	0	0	109.2
107	T	29.6	Very low	28.8	Very low	130 Å²	130	145.9 Å²	145.9	80%	0.798	81%	0.807	S	S	*	*			trans	-145	115.3	164.6	24.3	0	0	0	0	110.4
108	S	24.7	Very low	28.8	Very low	116 Å²	116	146.6 Å²	146.6	81%	0.811	80%	0.803	S	S	*	*			trans	-91.8	148.3	171.4	52.1	0	0	0	0	111.2
109	V	28	Very low	28.7	Very low	146 Å²	146	145.3 Å²	145.3	89%	0.885	81%	0.81	S	S	*	*			trans	178	135.2	162.9	133.2	0	0	0	0	106.4
110	A	29	Very low	28.4	Very low	94 Å²	94	141.1 Å²	141.1	78%	0.777	80%	0.802	S	S	*	*			cis	-147.5	171.8	-7.4	0	0	0	0	0	110.9
111	V	26	Very low	28.3	Very low	117 Å²	117	141.3 Å²	141.3	71%	0.709	80%	0.799	S	S	*	*			trans	-92.4	147.6	-177.2	171.3	0	0	0	0	111.7	Q113	V111-Q113 HydrophobicContact CG1-CG 3.96Å
112	S	28.8	Very low	28.1	Very low	123 Å²	123	137.7 Å²	137.7	86%	0.86	79%	0.787	S	S	*	*			trans	-131.4	121.6	147.8	-73.7	0	0	0	0	109.2
113	Q	27.7	Very low	27.9	Very low	168 Å²	168	134.5 Å²	134.5	79%	0.785	78%	0.783	S	S	*	*			trans	-76	157.9	170.3	-66.8	148.4	-18.5	0	0	108.6	V111	V111-Q113 HydrophobicContact CG1-CG 3.96Å
114	T	32	Very low	27.7	Very low	140 Å²	140	139 Å²	139	86%	0.859	79%	0.786	S	S	*	*				-159.8	175.8	53.8	50	0	0	0	0	109.5
115	S	30.8	Very low	27.5	Very low	106 Å²	106	136.8 Å²	136.8	74%	0.741	78%	0.784	S	S	*	*			cis	-147.4	154.4	0.7	-171.9	0	0	0	0	109.2
116	D	27	Very low	27.3	Very low	146 Å²	146	138.6 Å²	138.6	78%	0.781	79%	0.785	S	S	*	*			trans	-68.5	151.9	179.5	-39.1	-85.8	0	0	0	113.9
117	Y	27	Very low	27.3	Very low	201 Å²	201	135.3 Å²	135.3	79%	0.788	78%	0.78	S	S	*	*				-170.8	157.5	102	-144.8	-110.2	0	0	0	112.8
118	Y	32.4	Very low	27.1	Very low	215 Å²	215	132.6 Å²	132.6	84%	0.843	77%	0.767	S	S	*	*			trans	71.7	100.5	-176.2	-71.3	-67.6	0	0	0	118.5
119	A	26.4	Very low	27	Very low	93 Å²	93	132.6 Å²	132.6	77%	0.769	77%	0.765	S	S	*	*			trans	-119.7	138.9	164.1	0	0	0	0	0	110.4
120	S	27.4	Very low	26.9	Very low	107 Å²	107	134 Å²	134	75%	0.748	76%	0.762	S	S	*	*			trans	164.2	94.6	141.7	45.5	0	0	0	0	114.4
121	Q	28.2	Very low	26.7	Very low	141 Å²	141	135 Å²	135	66%	0.659	76%	0.763	S	S	*	*			trans	-172.5	143.7	141.1	-88.4	-32.6	-74.3	0	0	109.7
122	P	26.1	Very low	26.8	Very low	101 Å²	101	134.9 Å²	134.9	66%	0.656	76%	0.763	S	S	*	*			trans	-101	126.7	172.6	35.3	-28.5	0	0	0	112.8
123	S	26.4	Very low	26.7	Very low	104 Å²	104	136.2 Å²	136.2	73%	0.727	77%	0.765	S	S	*	*			trans	-148.6	92.3	165.7	48.1	0	0	0	0	108.9
124	W	24.7	Very low	26.8	Very low	219 Å²	219	130.6 Å²	130.6	83%	0.83	75%	0.752	S	S	*	*				64	80.3	95.9	-74	56.4	0	0	0	112.6	I126	W124-I126 PolarHBondContact O-N 3.1Å
125	S	22.9	Very low	26.5	Very low	117 Å²	117	127.6 Å²	127.6	82%	0.818	74%	0.737	S	S	*	*			trans	-71.1	90.7	169.5	50.7	0	0	0	0	110.6	S127	S125-S127 VanDerWaalsContact C-N 3.34Å; S125-S127 PolarHBondContact O-N 2.96Å
126	I	24.3	Very low	26.4	Very low	135 Å²	135	126.5 Å²	126.5	69%	0.692	73%	0.728	S	S	*	*			trans	-79.4	83.5	176.8	-59.9	-180	0	0	0	109.4	W124 S128	W124-I126 PolarHBondContact O-N 3.1Å; I126-S128 VanDerWaalsContact C-N 3.27Å; I126-S128 PolarHBondContact O-N 3.47Å
127	S	23.9	Very low	26.5	Very low	122 Å²	122	122.5 Å²	122.5	85%	0.853	71%	0.708	S	S	*	*			trans	-75.6	80.1	162.7	56.4	0	0	0	0	109.3	S125	S125-S127 VanDerWaalsContact C-N 3.34Å; S125-S127 PolarHBondContact O-N 2.96Å
128	S	24.7	Very low	26.6	Very low	74 Å²	74	115.2 Å²	115.2	52%	0.517	69%	0.686	S	S	.	*			trans	-126.8	107.3	-176.7	-169.2	0	0	0	0	113.5	I126 H130	I126-S128 VanDerWaalsContact C-N 3.27Å; I126-S128 PolarHBondContact O-N 3.47Å; S128-H130 PolarHBondContact O-N 3.45Å
129	C	23.1	Very low	26.3	Very low	115 Å²	115	109.4 Å²	109.4	78%	0.777	68%	0.676	S	S	*	*				36	57	127.8	-56.1	0	0	0	0	119.2
130	H	26	Very low	26.4	Very low	176 Å²	176	109.1 Å²	109.1	82%	0.815	67%	0.674	S	S	*	*			trans	-109.3	78.3	158.6	-95.8	-94.3	0	0	0	111.6	S128 V132	S128-H130 PolarHBondContact O-N 3.45Å; H130-V132 VanDerWaalsContact C-N 3.29Å; H130-V132 PolarHBondContact O-N 3.34Å
131	S	25.2	Very low	26.6	Very low	114 Å²	114	106.9 Å²	106.9	80%	0.797	65%	0.653	S	S	*	*			trans	-71.3	79.4	170.6	39.4	0	0	0	0	111	V133	S131-V133 PolarHBondContact O-N 2.98Å; S131-V133 VanDerWaalsContact O-N 3.09Å
132	V	28.6	Very low	26.9	Very low	115 Å²	115	104.9 Å²	104.9	70%	0.697	65%	0.647	S	S	*	*			trans	-58.4	115.8	175.5	178.9	0	0	0	0	110	H130 G134	H130-V132 VanDerWaalsContact C-N 3.29Å; H130-V132 PolarHBondContact O-N 3.34Å; V132-G134 PolarHBondContact O-N 3.16Å
133	V	26.5	Very low	27.4	Very low	152 Å²	152	103 Å²	103	92%	0.921	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.8	101.5	-178.5	-177.6	0	0	0	0	109.7	S131	S131-V133 PolarHBondContact O-N 2.98Å; S131-V133 VanDerWaalsContact O-N 3.09Å
134	G	29.1	Very low	28	Very low	49 Å²	49	105.2 Å²	105.2	51%	0.505	63%	0.63	S	S	.	*	T	Hydrogen-bonded Turn	trans	137.4	9.8	175.9	0	0	0	0	0	117.5	V132 P136 K720	V132-G134 PolarHBondContact O-N 3.16Å; G134-P136 WeakPolarHBondContact O-CD 3.27Å; G134-K720 PolarHBondContact O-NZ 3.49Å
135	S	26.4	Very low	28.7	Very low	77 Å²	77	97.7 Å²	97.7	54%	0.538	61%	0.606	S	S	.	*			trans	-98.7	98.7	176	-166.8	0	0	0	0	113.9	V137	S135-V137 VanDerWaalsContact C-N 3.28Å; S135-V137 PolarHBondContact O-N 2.9Å
136	P	27.4	Very low	29.6	Very low	84 Å²	84	93 Å²	93	55%	0.545	57%	0.572	S	S	.	*			trans	-88.1	65.1	167.1	37.2	-35.6	0	0	0	110.2	G134 K720	G134-P136 WeakPolarHBondContact O-CD 3.27Å; P136-K720 HydrophobicContact CG-CD 4.48Å
137	V	29.7	Very low	30.3	Very low	62 Å²	62	91.6 Å²	91.6	38%	0.376	57%	0.565	S	S	.	*	S	Bend	trans	-120.3	94.7	166.6	-179.8	0	0	0	0	106.2	S135 F751	S135-V137 VanDerWaalsContact C-N 3.28Å; S135-V137 PolarHBondContact O-N 2.9Å; V137-F751 HydrophobicContact CG1-CB 3.85Å
138	C	29.7	Very low	30.9	Very low	48 Å²	48	90.3 Å²	90.3	32%	0.324	56%	0.555	S	S	.	*			trans	40.2	80.3	-179.3	-66.2	0	0	0	0	114.6	A140 F751	C138-A140 PolarHBondContact O-N 3.21Å; C138-F751 HydrophobicContact CB-CD1 4.21Å
139	C	26	Very low	31.4	Very low	92 Å²	92	89.8 Å²	89.8	62%	0.622	54%	0.542	S	S	*	.			trans	-61.9	88.8	158	-60.9	0	0	0	0	108.6	L141	C139-L141 HydrophobicContact CB-CD2 4.3Å; C139-L141 HydrophobicContact CB-CG 4.26Å; C139-L141 PolarHBondContact O-N 2.99Å
140	A	28.5	Very low	32.1	Very low	88 Å²	88	88.9 Å²	88.9	73%	0.727	53%	0.529	S	S	*	.			trans	-71.7	69.8	167.7	0	0	0	0	0	108.1	C138 N142	C138-A140 PolarHBondContact O-N 3.21Å; A140-N142 PolarHBondContact O-N 2.93Å; A140-N142 VanDerWaalsContact O-N 3.15Å
141	L	30.6	Very low	32.3	Very low	59 Å²	59	88 Å²	88	31%	0.309	53%	0.531	S	S	.	.			trans	-54.5	119.6	175.7	-68	-178.4	0	0	0	108.1	C139 D145 W149 Q830	C139-L141 HydrophobicContact CB-CD2 4.3Å; C139-L141 HydrophobicContact CB-CG 4.26Å; C139-L141 PolarHBondContact O-N 2.99Å; L141-D145 WeakPolarHBondContact CA-OD2 3.35Å; L141-D145 HydrophobicContact CB-CB 4.03Å; L141-D145 HydrophobicContact CD2-CB 3.97Å; L141-D145 HydrophobicContact CG-CB 4.43Å; L141-W149 HydrophobicContact CD1-CZ2 3.89Å; L141-Q830 PolarHBondContact O-NE2 3.41Å; L141-Q830 VanDerWaalsContact O-NE2 3.1Å
142	N	34.3	Very low	32.3	Very low	99 Å²	99	88.7 Å²	88.7	53%	0.529	53%	0.525	S	S	.	.			trans	-68.2	158.9	179.3	-153.2	1.7	0	0	0	107.9	A140 Q144 D145	A140-N142 PolarHBondContact O-N 2.93Å; A140-N142 VanDerWaalsContact O-N 3.15Å; N142-Q144 PolarHBondContact O-N 3.2Å; N142-D145 PolarHBondContact N-OD2 3.43Å; N142-D145 PolarHBondContact O-N 2.87Å
143	D	36.6	Very low	32.2	Very low	63 Å²	63	87 Å²	87	34%	0.337	52%	0.519	S	S	.	.	G	3₁₀ helix	trans	-60.5	-16.4	-177.2	-79.1	-49.4	0	0	0	112.2	S827 R829	D143-S827 PolarHBondContact OD1-OG 3.02Å; D143-R829 PolarHBondContact O-NH1 3.04Å
144	Q	39.5	Very low	32.3	Very low	150 Å²	150	86.8 Å²	86.8	70%	0.701	51%	0.51	S	S	*	.	G	3₁₀ helix	trans	-68.1	-35.7	172.3	-67.8	172.2	-16	0	0	113.7	N142 L146	N142-Q144 PolarHBondContact O-N 3.2Å; Q144-L146 PolarHBondContact O-N 3.17Å
145	D	40.9	Very low	32.2	Very low	60 Å²	60	92.5 Å²	92.5	32%	0.321	52%	0.524	S	S	.	.	G	3₁₀ helix	trans	-73.1	-10.6	-173.1	-58.2	-45.9	0	0	0	113.6	L141 N142 N147 C148	L141-D145 WeakPolarHBondContact CA-OD2 3.35Å; L141-D145 HydrophobicContact CB-CB 4.03Å; L141-D145 HydrophobicContact CD2-CB 3.97Å; L141-D145 HydrophobicContact CG-CB 4.43Å; N142-D145 PolarHBondContact N-OD2 3.43Å; N142-D145 PolarHBondContact O-N 2.87Å; D145-N147 PolarHBondContact O-N 3.33Å; D145-C148 WeakPolarHBondContact O-CB 3.38Å; D145-C148 PolarHBondContact O-N 2.92Å; D145-C148 VanDerWaalsContact O-N 3.08Å
146	L	40.6	Very low	32.2	Very low	20 Å²	20	94.3 Å²	94.3	11%	0.105	54%	0.535	C	S	.	.	G	3₁₀ helix	trans	-65.1	-16.5	178.6	-76.9	167.7	0	0	0	113.5	Q144 C148 R829 Q830	Q144-L146 PolarHBondContact O-N 3.17Å; L146-C148 PolarHBondContact O-N 3.01Å; L146-R829 HydrophobicContact CD1-CB 4.5Å; L146-R829 HydrophobicContact CD1-CG 3.68Å; L146-Q830 HydrophobicContact CD1-CG 4.34Å
147	N	38.2	Very low	32	Very low	104 Å²	104	96.4 Å²	96.4	56%	0.556	55%	0.552	S	S	*	*	G	3₁₀ helix	trans	-72.9	-16.6	174.1	-67.3	-4.7	0	0	0	112.8	D145 W149	D145-N147 PolarHBondContact O-N 3.33Å; N147-W149 VanDerWaalsContact C-N 3.32Å; N147-W149 PolarHBondContact O-N 3.45Å
148	C	36.8	Very low	31.9	Very low	95 Å²	95	99.3 Å²	99.3	64%	0.642	58%	0.575	S	S	*	*	G	3₁₀ helix	trans	-83	-1.9	-176.7	-53.4	0	0	0	0	114.4	D145 L146 D150	D145-C148 WeakPolarHBondContact O-CB 3.38Å; D145-C148 PolarHBondContact O-N 2.92Å; D145-C148 VanDerWaalsContact O-N 3.08Å; L146-C148 PolarHBondContact O-N 3.01Å; C148-D150 PolarHBondContact O-N 3.13Å
149	W	36.7	Very low	31.6	Very low	64 Å²	64	105.7 Å²	105.7	24%	0.242	60%	0.6	C	S	.	*	G	3₁₀ helix	trans	-82	-7.7	-165	-79.5	61.5	0	0	0	115.6	L141 N147 N151 L152 L796	L141-W149 HydrophobicContact CD1-CZ2 3.89Å; N147-W149 VanDerWaalsContact C-N 3.32Å; N147-W149 PolarHBondContact O-N 3.45Å; W149-N151 PolarHBondContact O-N 3.06Å; W149-L152 PolarHBondContact O-N 3.22Å; W149-L152 VanDerWaalsContact O-N 3.14Å; W149-L796 HydrophobicContact CH2-CD1 4.49Å; W149-L796 HydrophobicContact CZ2-CD1 4.45Å
150	D	36.1	Very low	31.7	Very low	95 Å²	95	110.6 Å²	110.6	51%	0.508	61%	0.614	S	S	.	*	G	3₁₀ helix	trans	-62.7	-11.9	-175.1	-80.5	-13.2	0	0	0	114.2	C148 R874	C148-D150 PolarHBondContact O-N 3.13Å; D150-R874 IonicContact OD1-CZ 2.8Å; D150-R874 IonicContact OD1-NH1 2.74Å; D150-R874 PolarHBondContact OD1-NH1 3.09Å; D150-R874 IonicContact OD1-NH2 3.58Å; D150-R874 IonicContact OD2-CZ 2.89Å; D150-R874 IonicContact OD2-NH1 2.66Å; D150-R874 PolarHBondContact OD2-NH1 3.37Å; D150-R874 IonicContact OD2-NH2 2.73Å; D150-R874 PolarHBondContact OD2-NH2 3.28Å; D150-R874 VanDerWaalsContact OD2-NH2 3.14Å
151	N	30.9	Very low	31.6	Very low	158 Å²	158	112.1 Å²	112.1	85%	0.845	62%	0.616	S	S	*	*	G	3₁₀ helix	trans	-98.5	-2.6	178.3	-72.8	-47.8	0	0	0	115.5	W149 S153	W149-N151 PolarHBondContact O-N 3.06Å; N151-S153 PolarHBondContact O-N 2.74Å
152	L	25.3	Very low	31.6	Very low	128 Å²	128	114.6 Å²	114.6	67%	0.67	64%	0.636	S	S	*	*			trans	-99.2	48.6	-176.5	-92	161.2	0	0	0	113.3	W149	W149-L152 PolarHBondContact O-N 3.22Å; W149-L152 VanDerWaalsContact O-N 3.14Å
153	S	26.6	Very low	31.5	Very low	81 Å²	81	116.4 Å²	116.4	57%	0.566	65%	0.65	S	S	*	*			trans	-85.7	116.4	174.1	-166.2	0	0	0	0	111.4	N151 H155	N151-S153 PolarHBondContact O-N 2.74Å; S153-H155 PolarHBondContact O-N 3.35Å
154	I	28.4	Very low	31	Very low	146 Å²	146	121 Å²	121	75%	0.749	68%	0.675	S	S	*	*			trans	-79.7	101	175.7	-60.6	175.7	0	0	0	108.4	C156	I154-C156 PolarHBondContact O-N 2.99Å
155	H	26.2	Very low	30.6	Very low	170 Å²	170	121.5 Å²	121.5	79%	0.787	68%	0.682	S	S	*	*	P	Polyproline II helix	trans	-64.3	120.3	175.9	-114.4	-82.1	0	0	0	111.5	S153	S153-H155 PolarHBondContact O-N 3.35Å
156	C	26.4	Very low	30.3	Very low	115 Å²	115	123.1 Å²	123.1	78%	0.777	71%	0.705	S	S	*	*	P	Polyproline II helix	trans	-78.6	150.6	158.4	-73.5	0	0	0	0	110.1	I154	I154-C156 PolarHBondContact O-N 2.99Å
157	S	23.1	Very low	29.8	Very low	128 Å²	128	128.6 Å²	128.6	90%	0.895	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-80.4	137.2	-158	-43.6	0	0	0	0	116.3
158	S	28.5	Very low	29.5	Very low	123 Å²	123	131.6 Å²	131.6	86%	0.86	74%	0.744	S	S	*	*			trans	-158.7	154.4	136.3	-162	0	0	0	0	109.6
159	E	23.9	Very low	29.1	Very low	182 Å²	182	134.9 Å²	134.9	85%	0.85	75%	0.75	S	S	*	*			trans	-107.9	140.7	-175.5	-60.7	-179.5	125.3	0	0	112.4
160	Q	27	Very low	28.8	Very low	195 Å²	195	139.6 Å²	139.6	91%	0.911	78%	0.779	S	S	*	*			trans	-176.3	133.7	139.4	-106.5	170.3	1.8	0	0	112.5
161	P	26.5	Very low	28.6	Very low	120 Å²	120	143.7 Å²	143.7	78%	0.779	80%	0.797	S	S	*	*			trans	-123.6	142.5	178.4	39.1	-27.9	0	0	0	115.9
162	P	30.9	Very low	28.5	Very low	110 Å²	110	142.6 Å²	142.6	71%	0.714	79%	0.791	S	S	*	*			trans	-136.2	123	157.4	37.4	-22	0	0	0	113.7
163	T	31.8	Very low	29	Very low	137 Å²	137	140.7 Å²	140.7	84%	0.84	79%	0.787	S	S	*	*				86.3	130.9	104.5	59.4	0	0	0	0	117.4
164	D	26	Very low	29.3	Very low	160 Å²	160	144.7 Å²	144.7	86%	0.856	80%	0.796	S	S	*	*			trans	-93.5	151.3	-178.8	-45.3	-89.1	0	0	0	114.8
165	D	32.5	Very low	29.5	Very low	160 Å²	160	142.7 Å²	142.7	86%	0.856	79%	0.787	S	S	*	*			trans	-167.6	120.3	146.9	-94.8	-37	0	0	0	107
166	A	33.9	Very low	29.7	Very low	95 Å²	95	139.5 Å²	139.5	79%	0.785	78%	0.781	S	S	*	*				71.1	132.7	85.9	0	0	0	0	0	114.5
167	N	30.5	Very low	29.9	Very low	135 Å²	135	141.9 Å²	141.9	72%	0.722	79%	0.785	S	S	*	*			cis	-168	-175.8	-5.1	-176.3	32.2	0	0	0	110
168	E	31.1	Very low	30.2	Very low	166 Å²	166	144.6 Å²	144.6	78%	0.776	78%	0.783	S	S	*	*			trans	81.2	163	164.8	-52.2	-175.3	174	0	0	118.9
169	Q	28.6	Very low	30.6	Very low	164 Å²	164	146.9 Å²	146.9	77%	0.766	78%	0.78	S	S	*	*				-165.1	176.7	-75.7	-106.2	-175.1	15	0	0	111.4
170	I	31.1	Very low	30.9	Very low	163 Å²	163	142.7 Å²	142.7	84%	0.836	76%	0.757	S	S	*	*			trans	78.9	138.2	170.5	-48.8	167.3	0	0	0	115.5
171	M	32.3	Very low	31.2	Very low	182 Å²	182	139.9 Å²	139.9	90%	0.897	74%	0.744	S	S	*	*			cis	-162.9	155.8	-41.3	-119.2	179.2	74	0	0	111
172	D	28.2	Very low	31.6	Very low	134 Å²	134	139.5 Å²	139.5	72%	0.717	74%	0.739	S	S	*	*			trans	-68.8	178.9	180	-102.8	-42.3	0	0	0	115
173	P	35	Very low	31.9	Very low	89 Å²	89	142.9 Å²	142.9	58%	0.578	74%	0.738	S	S	*	*			cis	-135.2	-153.9	20.7	41.3	-19.3	0	0	0	114.2
174	E	33.5	Very low	32.3	Very low	165 Å²	165	138.9 Å²	138.9	77%	0.771	71%	0.709	S	S	*	*			cis	-164	158.4	6.7	-138.7	117.4	-123.6	0	0	108
175	L	32.1	Very low	32.9	Very low	104 Å²	104	137 Å²	137	55%	0.545	70%	0.695	S	S	.	*			cis	-143	-71.3	-12.3	-171.2	62.1	0	0	0	115.7	Y180	L175-Y180 HydrophobicContact CD1-CE1 4.15Å
176	P	30.9	Very low	33.1	Very low	103 Å²	103	135.3 Å²	135.3	67%	0.669	68%	0.681	S	S	*	*			trans	-126.3	127.2	-141.6	32	-11.3	0	0	0	118.2
177	L	30.4	Very low	33.7	Very low	165 Å²	165	135.5 Å²	135.5	86%	0.864	67%	0.666	S	S	*	*	S	Bend	trans	-146.1	114.4	139	-141.8	100.8	0	0	0	112.1	H179	L177-H179 VanDerWaalsContact C-N 3.34Å; L177-H179 PolarHBondContact O-N 3.3Å
178	H	30.3	Very low	34.3	Very low	184 Å²	184	135.7 Å²	135.7	85%	0.852	66%	0.656	S	S	*	*	S	Bend	trans	12.7	34.3	164.8	-125.9	-81.1	0	0	0	124.8
179	H	35.6	Very low	34.6	Very low	172 Å²	172	132 Å²	132	80%	0.796	64%	0.641	S	S	*	*	S	Bend	trans	-132.2	11.5	161.9	-116.3	57.1	0	0	0	114.2	L177	L177-H179 VanDerWaalsContact C-N 3.34Å; L177-H179 PolarHBondContact O-N 3.3Å
180	Y	30.8	Very low	35.4	Very low	93 Å²	93	130.7 Å²	130.7	37%	0.365	63%	0.633	S	S	.	*	H	α-helix	trans	-87.7	-32.7	-160.9	-149.5	-123.3	0	0	0	114.2	L175 R183 Q184	L175-Y180 HydrophobicContact CD1-CE1 4.15Å; Y180-R183 PolarHBondContact O-N 2.96Å; Y180-R183 VanDerWaalsContact O-N 3.16Å; Y180-Q184 HydrophobicContact CD1-CG 3.97Å; Y180-Q184 HydrophobicContact CE1-CG 3.86Å; Y180-Q184 PolarHBondContact O-N 3.16Å
181	H	32.5	Very low	35.9	Very low	137 Å²	137	128.8 Å²	128.8	63%	0.634	62%	0.62	S	S	*	*	H	α-helix	trans	-66	-46.6	-168.6	-143.9	-124.8	0	0	0	113.2	R183 Q184 Q185	H181-R183 VanDerWaalsContact C-N 3.27Å; H181-R183 PolarHBondContact O-N 3.33Å; H181-Q184 PolarHBondContact O-N 3.01Å; H181-Q185 WeakPolarHBondContact O-CG 3.49Å; H181-Q185 PolarHBondContact O-N 2.97Å
182	T	35.1	Very low	36.5	Very low	112 Å²	112	127 Å²	127	69%	0.687	61%	0.61	S	S	*	*	H	α-helix	trans	-60.7	-37.9	174.3	-39.2	0	0	0	0	111.5	F186	T182-F186 WeakPolarHBondContact O-CB 3.3Å; T182-F186 PolarHBondContact O-N 3.46Å
183	R	36.6	Very low	37.1	Very low	180 Å²	180	125.8 Å²	125.8	68%	0.679	60%	0.602	S	S	*	*	H	α-helix	trans	-71.2	-42.6	-179.1	-145.3	179.7	-165.1	-147.7	5.3	111.6	Y180 H181 F186 Q187	Y180-R183 PolarHBondContact O-N 2.96Å; Y180-R183 VanDerWaalsContact O-N 3.16Å; H181-R183 VanDerWaalsContact C-N 3.27Å; H181-R183 PolarHBondContact O-N 3.33Å; R183-F186 PolarHBondContact O-N 3.18Å; R183-Q187 WeakPolarHBondContact O-CG 3.46Å; R183-Q187 PolarHBondContact O-N 3.28Å
184	Q	42.1	Very low	37.5	Very low	53 Å²	53	125.5 Å²	125.5	25%	0.248	60%	0.602	C	S	.	*	H	α-helix	trans	-65.9	-40.1	173.4	-86	-149.2	-2.6	0	0	112.7	Y180 H181 F186 Q187 R188	Y180-Q184 HydrophobicContact CD1-CG 3.97Å; Y180-Q184 HydrophobicContact CE1-CG 3.86Å; Y180-Q184 PolarHBondContact O-N 3.16Å; H181-Q184 PolarHBondContact O-N 3.01Å; Q184-F186 VanDerWaalsContact C-N 3.31Å; Q184-F186 PolarHBondContact O-N 3Å; Q184-Q187 PolarHBondContact O-N 3.05Å; Q184-R188 WeakPolarHBondContact O-CB 3.27Å; Q184-R188 WeakPolarHBondContact O-CG 3.32Å; Q184-R188 PolarHBondContact O-N 3.03Å
185	Q	37.9	Very low	37.9	Very low	120 Å²	120	124.5 Å²	124.5	56%	0.561	60%	0.601	S	S	*	*	H	α-helix	trans	-62.5	-40.6	173.6	-72.7	-168.9	6.2	0	0	111.1	H181 Q187 R188 L189	H181-Q185 WeakPolarHBondContact O-CG 3.49Å; H181-Q185 PolarHBondContact O-N 2.97Å; Q185-Q187 PolarHBondContact O-N 3.22Å; Q185-R188 PolarHBondContact O-N 3.46Å; Q185-L189 WeakPolarHBondContact O-CB 3.22Å; Q185-L189 PolarHBondContact O-N 3.24Å
186	F	37.3	Very low	38.1	Very low	126 Å²	126	123 Å²	123	55%	0.553	61%	0.611	S	S	*	*	H	α-helix	trans	-65.3	-36	174.4	-139.3	-82	0	0	0	113.1	T182 R183 Q184 K190	T182-F186 WeakPolarHBondContact O-CB 3.3Å; T182-F186 PolarHBondContact O-N 3.46Å; R183-F186 PolarHBondContact O-N 3.18Å; Q184-F186 VanDerWaalsContact C-N 3.31Å; Q184-F186 PolarHBondContact O-N 3Å; F186-K190 HydrophobicContact CD1-CG 4.38Å; F186-K190 WeakPolarHBondContact O-CB 3.33Å; F186-K190 WeakPolarHBondContact O-CG 3.49Å; F186-K190 PolarHBondContact O-N 3.03Å
187	Q	45.5	Very low	38.1	Very low	99 Å²	99	121.8 Å²	121.8	46%	0.463	61%	0.609	S	S	.	*	H	α-helix	trans	-69.4	-44.6	174.2	-78.7	173.4	-40.9	0	0	112.3	R183 Q184 Q185 L189 K190 Q191	R183-Q187 WeakPolarHBondContact O-CG 3.46Å; R183-Q187 PolarHBondContact O-N 3.28Å; Q184-Q187 PolarHBondContact O-N 3.05Å; Q185-Q187 PolarHBondContact O-N 3.22Å; Q187-L189 VanDerWaalsContact C-N 3.32Å; Q187-L189 PolarHBondContact O-N 2.84Å; Q187-K190 WeakPolarHBondContact O-CB 3.45Å; Q187-K190 PolarHBondContact O-N 3.48Å; Q187-Q191 WeakPolarHBondContact O-CG 3.4Å; Q187-Q191 PolarHBondContact O-N 3.01Å
188	R	43.4	Very low	38.3	Very low	139 Å²	139	120.6 Å²	120.6	53%	0.525	61%	0.609	S	S	.	*	H	α-helix	trans	-60.2	-42.2	174	-76.3	180	170.4	121.7	2.3	111.2	Q184 Q185 Q191 Q192	Q184-R188 WeakPolarHBondContact O-CB 3.27Å; Q184-R188 WeakPolarHBondContact O-CG 3.32Å; Q184-R188 PolarHBondContact O-N 3.03Å; Q185-R188 PolarHBondContact O-N 3.46Å; R188-Q191 PolarHBondContact O-N 3.11Å; R188-Q192 WeakPolarHBondContact O-CG 3.29Å; R188-Q192 PolarHBondContact O-N 3.45Å
189	L	38.2	Very low	38.3	Very low	87 Å²	87	116.7 Å²	116.7	46%	0.455	60%	0.602	S	S	.	*	H	α-helix	trans	-65	-43	174.9	-157	77	0	0	0	111.8	Q185 Q187 Q191 Q192 I193	Q185-L189 WeakPolarHBondContact O-CB 3.22Å; Q185-L189 PolarHBondContact O-N 3.24Å; Q187-L189 VanDerWaalsContact C-N 3.32Å; Q187-L189 PolarHBondContact O-N 2.84Å; L189-Q191 PolarHBondContact O-N 3.22Å; L189-Q192 PolarHBondContact O-N 3.04Å; L189-I193 HydrophobicContact CG-CD1 4.21Å; L189-I193 VanDerWaalsContact O-CG1 3.29Å; L189-I193 WeakPolarHBondContact O-CG1 3.34Å; L189-I193 PolarHBondContact O-N 3.46Å
190	K	44.2	Very low	38.2	Very low	138 Å²	138	114.5 Å²	114.5	60%	0.6	60%	0.604	S	S	*	*	H	α-helix	trans	-59.2	-43.6	172.6	-86.5	-173.3	172.9	-172.9	0	112.3	F186 Q187 I193 S194	F186-K190 HydrophobicContact CD1-CG 4.38Å; F186-K190 WeakPolarHBondContact O-CB 3.33Å; F186-K190 WeakPolarHBondContact O-CG 3.49Å; F186-K190 PolarHBondContact O-N 3.03Å; Q187-K190 WeakPolarHBondContact O-CB 3.45Å; Q187-K190 PolarHBondContact O-N 3.48Å; K190-I193 PolarHBondContact O-N 3.19Å; K190-S194 VanDerWaalsContact O-CB 3.24Å; K190-S194 WeakPolarHBondContact O-CB 3.5Å; K190-S194 PolarHBondContact O-N 2.94Å
191	Q	42.3	Very low	38.2	Very low	122 Å²	122	120.5 Å²	120.5	57%	0.57	63%	0.625	S	S	*	*	H	α-helix	trans	-65.5	-45.3	178.4	-76.1	175.3	-19.6	0	0	111.6	Q187 R188 L189 I193 S194 I195	Q187-Q191 WeakPolarHBondContact O-CG 3.4Å; Q187-Q191 PolarHBondContact O-N 3.01Å; R188-Q191 PolarHBondContact O-N 3.11Å; L189-Q191 PolarHBondContact O-N 3.22Å; Q191-I193 VanDerWaalsContact C-N 3.27Å; Q191-I193 PolarHBondContact O-N 2.81Å; Q191-S194 PolarHBondContact O-N 3.3Å; Q191-I195 WeakPolarHBondContact O-CD1 3.42Å; Q191-I195 VanDerWaalsContact O-CG1 3.28Å; Q191-I195 WeakPolarHBondContact O-CG1 3.28Å; Q191-I195 PolarHBondContact O-N 2.9Å
192	Q	44.6	Very low	38	Very low	146 Å²	146	125 Å²	125	68%	0.682	64%	0.637	S	S	*	*	H	α-helix	trans	-61.2	-33.4	175.8	-73.4	178.2	-4.1	0	0	112.9	R188 L189	R188-Q192 WeakPolarHBondContact O-CG 3.29Å; R188-Q192 PolarHBondContact O-N 3.45Å; L189-Q192 PolarHBondContact O-N 3.04Å
193	I	41.3	Very low	37.9	Very low	108 Å²	108	124.8 Å²	124.8	55%	0.554	65%	0.646	S	S	*	*	H	α-helix	trans	-76.6	-39.9	174.3	-67.7	166.7	0	0	0	111.6	L189 K190 Q191 G196	L189-I193 HydrophobicContact CG-CD1 4.21Å; L189-I193 VanDerWaalsContact O-CG1 3.29Å; L189-I193 WeakPolarHBondContact O-CG1 3.34Å; L189-I193 PolarHBondContact O-N 3.46Å; K190-I193 PolarHBondContact O-N 3.19Å; Q191-I193 VanDerWaalsContact C-N 3.27Å; Q191-I193 PolarHBondContact O-N 2.81Å; I193-G196 PolarHBondContact O-N 2.68Å
194	S	42.5	Very low	37.6	Very low	83 Å²	83	120.1 Å²	120.1	58%	0.58	65%	0.647	S	S	*	*	H	α-helix	trans	-67.2	-41.7	-177.7	-168.3	0	0	0	0	112.9	K190 Q191 G196 A197	K190-S194 VanDerWaalsContact O-CB 3.24Å; K190-S194 WeakPolarHBondContact O-CB 3.5Å; K190-S194 PolarHBondContact O-N 2.94Å; Q191-S194 PolarHBondContact O-N 3.3Å; S194-G196 PolarHBondContact O-N 3.11Å; S194-G196 VanDerWaalsContact O-N 3.11Å; S194-A197 PolarHBondContact O-N 2.95Å; S194-A197 VanDerWaalsContact O-N 3.14Å
195	I	42.4	Very low	37.2	Very low	144 Å²	144	124.5 Å²	124.5	74%	0.738	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.4	-19.1	179.2	-67.3	164.8	0	0	0	112	Q191	Q191-I195 WeakPolarHBondContact O-CD1 3.42Å; Q191-I195 VanDerWaalsContact O-CG1 3.28Å; Q191-I195 WeakPolarHBondContact O-CG1 3.28Å; Q191-I195 PolarHBondContact O-N 2.9Å
196	G	36.1	Very low	37.1	Very low	73 Å²	73	125.8 Å²	125.8	75%	0.753	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.5	5.6	176.4	0	0	0	0	0	116.3	I193 S194	I193-G196 PolarHBondContact O-N 2.68Å; S194-G196 PolarHBondContact O-N 3.11Å; S194-G196 VanDerWaalsContact O-N 3.11Å
197	A	31.8	Very low	37	Very low	77 Å²	77	123.9 Å²	123.9	64%	0.636	69%	0.69	S	S	*	*			trans	-136.5	38.6	-160.6	0	0	0	0	0	116.9	S194	S194-A197 PolarHBondContact O-N 2.95Å; S194-A197 VanDerWaalsContact O-N 3.14Å
198	T	34.8	Very low	36.6	Very low	139 Å²	139	125.9 Å²	125.9	85%	0.853	70%	0.704	S	S	*	*			trans	-100.7	147.3	167.6	52.5	0	0	0	0	112.2
199	S	29.5	Very low	36.3	Very low	102 Å²	102	124.8 Å²	124.8	71%	0.713	71%	0.712	S	S	*	*			trans	-129.5	140.6	-167.5	169	0	0	0	0	112.6
200	P	33.9	Very low	36.2	Very low	127 Å²	127	126.8 Å²	126.8	83%	0.825	72%	0.724	S	S	*	*			trans	-93	147.6	155.1	-6.1	25.7	0	0	0	111.2
201	R	29.6	Very low	35.9	Very low	219 Å²	219	125 Å²	125	83%	0.826	72%	0.724	S	S	*	*			trans	-123.5	158.4	177.5	-101.9	-173.8	170.8	-165.1	-1.1	111
202	R	29.9	Very low	35.6	Very low	230 Å²	230	126.1 Å²	126.1	87%	0.868	74%	0.735	S	S	*	*			trans	81.1	159	154.3	-79.9	176.1	173.7	166.1	-2.5	120.3
203	A	32.3	Very low	35.4	Very low	108 Å²	108	124 Å²	124	89%	0.893	74%	0.736	S	S	*	*			trans	81.6	139.7	167.7	0	0	0	0	0	116.9
204	A	29.6	Very low	35.3	Very low	83 Å²	83	124.2 Å²	124.2	69%	0.686	75%	0.747	S	S	*	*			trans	-127.2	152.9	175.5	0	0	0	0	0	108.2
205	D	33.6	Very low	35.1	Very low	145 Å²	145	125 Å²	125	78%	0.775	75%	0.752	S	S	*	*				161.1	149.1	125.1	-81.6	-16.1	0	0	0	112.5
206	N	35.9	Very low	34.9	Very low	147 Å²	147	123.3 Å²	123.3	79%	0.786	75%	0.753	S	S	*	*			trans	54.1	98	154.5	-64.9	-35.7	0	0	0	121.8
207	A	36.3	Very low	34.9	Very low	85 Å²	85	124.8 Å²	124.8	70%	0.702	75%	0.752	S	S	*	*				74.1	123	110.5	0	0	0	0	0	123.1
208	N	35.6	Very low	35.2	Very low	142 Å²	142	126.3 Å²	126.3	76%	0.759	76%	0.758	S	S	*	*			trans	76.2	125.8	135.8	-79.1	-1.4	0	0	0	123.2
209	T	37.1	Very low	35.3	Very low	115 Å²	115	126.4 Å²	126.4	71%	0.706	76%	0.759	S	S	*	*			trans	70.6	149.3	141.1	60.2	0	0	0	0	118.6
210	N	37.4	Very low	35.5	Very low	130 Å²	130	125.2 Å²	125.2	70%	0.695	76%	0.763	S	S	*	*			cis	-159.3	140.2	-3.7	-122.7	5.8	0	0	0	114.8
211	T	37.2	Very low	35.6	Very low	99 Å²	99	123.9 Å²	123.9	61%	0.607	76%	0.756	S	S	*	*			trans	56.6	131.6	137.3	58.8	0	0	0	0	125.9
212	N	37.2	Very low	35.8	Very low	147 Å²	147	120.1 Å²	120.1	79%	0.786	75%	0.752	S	S	*	*			trans	75	154.8	142.9	-51.9	-13.9	0	0	0	118.9
213	S	39.6	Very low	36.1	Very low	102 Å²	102	115.9 Å²	115.9	71%	0.713	75%	0.747	S	S	*	*			cis	-154.4	153.9	18.4	-38.9	0	0	0	0	114.4
214	S	38.4	Very low	36	Very low	112 Å²	112	119 Å²	119	78%	0.783	74%	0.743	S	S	*	*			trans	41.8	147.1	141.3	52.2	0	0	0	0	123.3
215	S	38.5	Very low	36.3	Very low	99 Å²	99	120.5 Å²	120.5	69%	0.692	75%	0.746	S	S	*	*			cis	-173.6	157.4	3	42.7	0	0	0	0	114.4
216	S	38.6	Very low	36.2	Very low	108 Å²	108	121 Å²	121	76%	0.755	75%	0.754	S	S	*	*			trans	61.9	146.7	147.6	57.1	0	0	0	0	122
217	S	37	Very low	35.9	Very low	104 Å²	104	117.2 Å²	117.2	73%	0.727	75%	0.75	S	S	*	*			cis	-176	166.3	-17.4	51.9	0	0	0	0	111.7
218	S	37.8	Very low	35.6	Very low	109 Å²	109	122 Å²	122	76%	0.762	76%	0.762	S	S	*	*			trans	73.9	142.4	172.5	79.3	0	0	0	0	116.6
219	T	35.8	Very low	35.3	Very low	142 Å²	142	119.4 Å²	119.4	87%	0.871	76%	0.76	S	S	*	*			cis	-160	139.6	-12	9.5	0	0	0	0	108.7
220	G	33.9	Very low	34.9	Very low	77 Å²	77	117.8 Å²	117.8	79%	0.794	77%	0.766	S	S	*	*			trans	154.1	63.8	170.6	0	0	0	0	0	119.2
221	S	36.7	Very low	34.5	Very low	98 Å²	98	123.8 Å²	123.8	69%	0.685	78%	0.779	S	S	*	*			trans	26.5	109.3	153.8	179	0	0	0	0	121
222	N	34.6	Very low	34.1	Very low	140 Å²	140	128.8 Å²	128.8	75%	0.749	79%	0.787	S	S	*	*				51.3	129.4	128	-46	-10.5	0	0	0	119.6
223	N	35.5	Very low	33.5	Very low	142 Å²	142	126 Å²	126	76%	0.759	79%	0.785	S	S	*	*			cis	-160.7	161.1	2.2	-84.5	-10.5	0	0	0	105.9
224	E	30.1	Very low	32.9	Very low	172 Å²	172	127.5 Å²	127.5	80%	0.804	78%	0.784	S	S	*	*			cis	-158	138	-20.8	178.6	174.5	-173.2	0	0	105.2
225	P	35.4	Very low	32.3	Very low	115 Å²	115	129.3 Å²	129.3	75%	0.747	78%	0.778	S	S	*	*			trans	-99.7	156.2	-162.8	37.3	-35.8	0	0	0	114.9
226	T	31.6	Very low	31.8	Very low	155 Å²	155	128.9 Å²	128.9	95%	0.951	78%	0.775	S	S	*	*			trans	-168.6	154.9	148.3	5.8	0	0	0	0	113.4
227	G	30.2	Very low	31.3	Very low	68 Å²	68	127.5 Å²	127.5	70%	0.701	76%	0.762	S	S	*	*			trans	88.3	71.7	147.7	0	0	0	0	0	118.7	A229	G227-A229 PolarHBondContact O-N 3.36Å
228	I	28.7	Very low	31.2	Very low	187 Å²	187	123.8 Å²	123.8	96%	0.959	74%	0.736	S	S	*	*			trans	-69.4	112.5	152.5	-63.8	175	0	0	0	107.7
229	A	30.2	Very low	30.9	Very low	87 Å²	87	124 Å²	124	72%	0.719	73%	0.729	S	S	*	*			trans	-134.8	144.2	172.8	0	0	0	0	0	110.1	G227 R231	G227-A229 PolarHBondContact O-N 3.36Å; A229-R231 PolarHBondContact O-N 3.36Å
230	G	28.7	Very low	30.7	Very low	80 Å²	80	120.3 Å²	120.3	83%	0.825	71%	0.709	S	S	*	*			trans	-61.2	132.9	-168.5	0	0	0	0	0	114.2	R232	G230-R232 PolarHBondContact O-N 3.38Å; G230-R232 VanDerWaalsContact O-N 3.17Å
231	R	28.4	Very low	30.6	Very low	257 Å²	257	118.8 Å²	118.8	97%	0.97	69%	0.686	S	S	*	*			trans	-64.4	113.5	177.4	-69.9	-173.9	178.9	-163.4	-0.1	110.7	A229	A229-R231 PolarHBondContact O-N 3.36Å
232	R	28.6	Very low	30.5	Very low	203 Å²	203	118.6 Å²	118.6	77%	0.766	67%	0.673	S	S	*	*			trans	-104.8	109.8	167.2	-152	-178.5	-152.6	163.5	9.7	108.5	G230 N234	G230-R232 PolarHBondContact O-N 3.38Å; G230-R232 VanDerWaalsContact O-N 3.17Å; R232-N234 PolarHBondContact O-N 2.95Å
233	A	24.6	Very low	30.6	Very low	90 Å²	90	115.8 Å²	115.8	74%	0.744	66%	0.661	S	S	*	*			trans	-73.8	91	178.3	0	0	0	0	0	110.1	F235	A233-F235 PolarHBondContact O-N 2.9Å
234	N	28.2	Very low	30.5	Very low	132 Å²	132	110.8 Å²	110.8	71%	0.706	64%	0.64	S	S	*	*			trans	-83.5	108.8	171.3	-67.1	-20.3	0	0	0	108.7	R232 S236	R232-N234 PolarHBondContact O-N 2.95Å; N234-S236 PolarHBondContact O-N 2.92Å; N234-S236 VanDerWaalsContact O-N 3.15Å
235	F	24.7	Very low	30.9	Very low	150 Å²	150	107.2 Å²	107.2	66%	0.658	62%	0.622	S	S	*	*			trans	-69.9	106.2	168.9	-80.5	-93	0	0	0	109.8	A233	A233-F235 PolarHBondContact O-N 2.9Å
236	S	27.6	Very low	31.1	Very low	90 Å²	90	105.5 Å²	105.5	63%	0.629	61%	0.609	S	S	*	*			trans	-99.4	108.5	168.8	56.2	0	0	0	0	110.2	N234 S238	N234-S236 PolarHBondContact O-N 2.92Å; N234-S236 VanDerWaalsContact O-N 3.15Å; S236-S238 PolarHBondContact O-N 3.38Å
237	V	28.5	Very low	31.4	Very low	80 Å²	80	99.9 Å²	99.9	49%	0.485	58%	0.575	S	S	.	*			trans	-50.1	132.1	151.2	174.7	0	0	0	0	107	D239 K242	V237-D239 PolarHBondContact O-N 3.1Å; V237-K242 HydrophobicContact CG1-CG 4.2Å; V237-K242 PolarHBondContact O-NZ 3.23Å
238	S	34.7	Very low	32	Very low	25 Å²	25	98.2 Å²	98.2	18%	0.175	55%	0.55	C	S	.	*			trans	-54.2	142.7	-174.7	82.2	0	0	0	0	111.2	S236 S240 S241 K242	S236-S238 PolarHBondContact O-N 3.38Å; S238-S240 PolarHBondContact O-N 3.36Å; S238-S241 PolarHBondContact O-N 2.87Å; S238-S241 PolarHBondContact OG-N 3Å; S238-S241 PolarHBondContact OG-OG 2.81Å; S238-K242 PolarHBondContact O-N 3.24Å
239	D	32.4	Very low	32.9	Very low	113 Å²	113	95 Å²	95	60%	0.604	53%	0.529	S	S	*	.	H	α-helix	trans	-68.3	-20.8	175.7	-70.8	-33.7	0	0	0	111.4	V237 K242 T243	V237-D239 PolarHBondContact O-N 3.1Å; D239-K242 IonicContact OD1-NZ 2.72Å; D239-K242 PolarHBondContact OD1-NZ 3.17Å; D239-T243 WeakPolarHBondContact O-CB 3.26Å; D239-T243 PolarHBondContact O-N 3.3Å; D239-T243 PolarHBondContact O-OG1 2.95Å
240	S	31.6	Very low	33.7	Very low	65 Å²	65	98.3 Å²	98.3	46%	0.455	52%	0.523	S	S	.	.	H	α-helix	trans	-59.1	-54.9	167.9	-51.3	0	0	0	0	111.7	S238 K242 T243 A244	S238-S240 PolarHBondContact O-N 3.36Å; S240-K242 PolarHBondContact O-N 3.39Å; S240-T243 PolarHBondContact O-N 2.88Å; S240-T243 VanDerWaalsContact O-N 3.14Å; S240-A244 WeakPolarHBondContact O-CB 3.28Å; S240-A244 PolarHBondContact O-N 3.36Å
241	S	32.4	Very low	34.5	Very low	46 Å²	46	96 Å²	96	32%	0.322	49%	0.494	S	S	.	.	H	α-helix	trans	-65.7	-36.5	-178.1	-53.7	0	0	0	0	112.2	S238 F245	S238-S241 PolarHBondContact O-N 2.87Å; S238-S241 PolarHBondContact OG-N 3Å; S238-S241 PolarHBondContact OG-OG 2.81Å; S241-F245 PolarHBondContact O-N 3.28Å; S241-F245 VanDerWaalsContact O-N 3.11Å
242	K	34.8	Very low	35.6	Very low	94 Å²	94	87.4 Å²	87.4	41%	0.409	46%	0.462	S	S	.	.	H	α-helix	trans	-63.8	-44.3	171.7	-61.9	-168.5	-159.1	85.9	0	112	V237 S238 D239 S240 F245 V246	V237-K242 HydrophobicContact CG1-CG 4.2Å; V237-K242 PolarHBondContact O-NZ 3.23Å; S238-K242 PolarHBondContact O-N 3.24Å; D239-K242 IonicContact OD1-NZ 2.72Å; D239-K242 PolarHBondContact OD1-NZ 3.17Å; S240-K242 PolarHBondContact O-N 3.39Å; K242-F245 PolarHBondContact O-N 2.78Å; K242-V246 WeakPolarHBondContact O-CG2 3.26Å; K242-V246 PolarHBondContact O-N 2.91Å; K242-V246 VanDerWaalsContact O-N 3.11Å
243	T	35	Very low	36.7	Very low	80 Å²	80	82 Å²	82	49%	0.491	45%	0.445	S	S	.	.	H	α-helix	trans	-67.8	-42.8	-179.4	-60.3	0	0	0	0	110.6	D239 S240 F245 V246 C247	D239-T243 WeakPolarHBondContact O-CB 3.26Å; D239-T243 PolarHBondContact O-N 3.3Å; D239-T243 PolarHBondContact O-OG1 2.95Å; S240-T243 PolarHBondContact O-N 2.88Å; S240-T243 VanDerWaalsContact O-N 3.14Å; T243-F245 PolarHBondContact O-N 3.08Å; T243-V246 PolarHBondContact O-N 3.47Å; T243-C247 WeakPolarHBondContact O-CB 3.13Å; T243-C247 PolarHBondContact O-N 3.31Å; T243-C247 PolarHBondContact O-SG 3.06Å; T243-C247 VanDerWaalsContact O-SG 3.34Å
244	A	35	Very low	37.8	Very low	38 Å²	38	84.1 Å²	84.1	31%	0.314	43%	0.434	S	S	.	.	H	α-helix	trans	-55.3	-49.6	174	0	0	0	0	0	111.2	S240 V246 C247 L248	S240-A244 WeakPolarHBondContact O-CB 3.28Å; S240-A244 PolarHBondContact O-N 3.36Å; A244-V246 PolarHBondContact O-N 3.31Å; A244-C247 PolarHBondContact O-N 2.86Å; A244-L248 WeakPolarHBondContact O-CB 3.32Å; A244-L248 WeakPolarHBondContact O-CD1 3.41Å; A244-L248 PolarHBondContact O-N 3.03Å
245	F	37.7	Very low	38.8	Very low	97 Å²	97	82.9 Å²	82.9	43%	0.425	43%	0.427	S	S	.	.	H	α-helix	trans	-63.5	-41.7	-180	-155.7	-88.7	0	0	0	112.9	S241 K242 T243 K249 Q691	S241-F245 PolarHBondContact O-N 3.28Å; S241-F245 VanDerWaalsContact O-N 3.11Å; K242-F245 PolarHBondContact O-N 2.78Å; T243-F245 PolarHBondContact O-N 3.08Å; F245-K249 PolarHBondContact O-N 2.92Å; F245-K249 VanDerWaalsContact O-N 3.16Å; F245-Q691 HydrophobicContact CE2-CB 4.42Å
246	V	38.6	Very low	40.1	Very low	79 Å²	79	80.4 Å²	80.4	48%	0.479	42%	0.417	S	S	.	.	H	α-helix	trans	-68.1	-37.2	175.7	172.3	0	0	0	0	111.8	K242 T243 A244 R250	K242-V246 WeakPolarHBondContact O-CG2 3.26Å; K242-V246 PolarHBondContact O-N 2.91Å; K242-V246 VanDerWaalsContact O-N 3.11Å; T243-V246 PolarHBondContact O-N 3.47Å; A244-V246 PolarHBondContact O-N 3.31Å; V246-R250 WeakPolarHBondContact O-CG 3.47Å; V246-R250 PolarHBondContact O-N 2.95Å
247	C	39.7	Very low	41.4	Very low	37 Å²	37	81 Å²	81	25%	0.25	41%	0.41	C	S	.	.	H	α-helix	trans	-74.2	-37.8	177.8	-74.4	0	0	0	0	112.6	T243 A244 K249 R250 S251	T243-C247 WeakPolarHBondContact O-CB 3.13Å; T243-C247 PolarHBondContact O-N 3.31Å; T243-C247 PolarHBondContact O-SG 3.06Å; T243-C247 VanDerWaalsContact O-SG 3.34Å; A244-C247 PolarHBondContact O-N 2.86Å; C247-K249 VanDerWaalsContact C-N 3.34Å; C247-K249 PolarHBondContact O-N 3.02Å; C247-R250 PolarHBondContact O-N 2.87Å; C247-S251 VanDerWaalsContact O-CB 3.28Å; C247-S251 WeakPolarHBondContact O-CB 3.14Å; C247-S251 PolarHBondContact O-N 2.92Å
248	L	42.7	Very low	42.4	Very low	32 Å²	32	81.2 Å²	81.2	17%	0.168	41%	0.406	C	S	.	.	H	α-helix	trans	-56.4	-50.4	169.8	-105.6	83.1	0	0	0	110.3	A244 R250 S251 R252 L660 L692	A244-L248 WeakPolarHBondContact O-CB 3.32Å; A244-L248 WeakPolarHBondContact O-CD1 3.41Å; A244-L248 PolarHBondContact O-N 3.03Å; L248-R250 VanDerWaalsContact C-N 3.34Å; L248-R250 PolarHBondContact O-N 2.89Å; L248-S251 PolarHBondContact O-N 3.18Å; L248-S251 VanDerWaalsContact O-N 3.17Å; L248-R252 WeakPolarHBondContact O-CB 3.48Å; L248-R252 PolarHBondContact O-N 3.13Å; L248-L660 HydrophobicContact CD1-CD1 4.16Å; L248-L660 HydrophobicContact CD2-CD1 3.78Å; L248-L660 HydrophobicContact CG-CD1 4.09Å; L248-L692 HydrophobicContact CB-CD2 4.43Å; L248-L692 HydrophobicContact CD2-CD1 4.04Å; L248-L692 HydrophobicContact CD2-CD2 3.87Å; L248-L692 HydrophobicContact CD2-CG 4.45Å
249	K	46.4	Very low	43	Very low	121 Å²	121	83.8 Å²	83.8	53%	0.526	42%	0.424	S	S	.	.	H	α-helix	trans	-59.3	-43.6	178.9	-171.2	161.7	-173.4	157	0	111.9	F245 C247 E253	F245-K249 PolarHBondContact O-N 2.92Å; F245-K249 VanDerWaalsContact O-N 3.16Å; C247-K249 VanDerWaalsContact C-N 3.34Å; C247-K249 PolarHBondContact O-N 3.02Å; K249-E253 WeakPolarHBondContact O-CB 3.41Å; K249-E253 VanDerWaalsContact O-CG 3.3Å; K249-E253 WeakPolarHBondContact O-CG 3.26Å; K249-E253 PolarHBondContact O-N 3.13Å
250	R	47.7	Very low	43.9	Very low	156 Å²	156	80.9 Å²	80.9	59%	0.589	42%	0.415	S	S	*	.	H	α-helix	trans	-67.4	-36.1	174.3	-76.9	-179.8	175.3	-179.7	1.9	114.1	V246 C247 L248 E253 R254	V246-R250 WeakPolarHBondContact O-CG 3.47Å; V246-R250 PolarHBondContact O-N 2.95Å; C247-R250 PolarHBondContact O-N 2.87Å; L248-R250 VanDerWaalsContact C-N 3.34Å; L248-R250 PolarHBondContact O-N 2.89Å; R250-E253 PolarHBondContact O-N 3.5Å; R250-R254 WeakPolarHBondContact O-CG 3.43Å; R250-R254 PolarHBondContact O-N 3.38Å
251	S	45.5	Very low	44.8	Very low	30 Å²	30	83.3 Å²	83.3	21%	0.21	42%	0.418	C	S	.	.	H	α-helix	trans	-66.9	-43.7	177.8	-169.9	0	0	0	0	110.3	C247 L248 R254 L255	C247-S251 VanDerWaalsContact O-CB 3.28Å; C247-S251 WeakPolarHBondContact O-CB 3.14Å; C247-S251 PolarHBondContact O-N 2.92Å; L248-S251 PolarHBondContact O-N 3.18Å; L248-S251 VanDerWaalsContact O-N 3.17Å; S251-R254 WeakPolarHBondContact O-CB 3.37Å; S251-R254 PolarHBondContact O-N 2.86Å; S251-L255 PolarHBondContact O-N 3.45Å
252	R	51.6	Low	45.4	Very low	78 Å²	78	89.1 Å²	89.1	29%	0.294	43%	0.433	S	S	.	.	H	α-helix	trans	-60.8	-48.1	169.9	-177	179.5	173.4	157	16	112.2	L248 R254 L255 E256 D694	L248-R252 WeakPolarHBondContact O-CB 3.48Å; L248-R252 PolarHBondContact O-N 3.13Å; R252-R254 PolarHBondContact O-N 3.36Å; R252-L255 PolarHBondContact O-N 2.88Å; R252-L255 VanDerWaalsContact O-N 3.11Å; R252-E256 HydrophobicContact CG-CG 4.35Å; R252-E256 WeakPolarHBondContact CG-OE1 3.24Å; R252-E256 IonicContact CZ-OE1 2.77Å; R252-E256 IonicContact NE-OE1 3.36Å; R252-E256 PolarHBondContact NE-OE1 3.28Å; R252-E256 IonicContact NH2-OE1 2.66Å; R252-E256 PolarHBondContact NH2-OE1 3.28Å; R252-E256 WeakPolarHBondContact O-CB 3.36Å; R252-E256 WeakPolarHBondContact O-CG 3.38Å; R252-E256 PolarHBondContact O-N 3.4Å; R252-D694 VanDerWaalsContact CZ-CG 3.46Å; R252-D694 IonicContact CZ-OD1 3.49Å; R252-D694 IonicContact CZ-OD2 3.47Å; R252-D694 VanDerWaalsContact NH1-CB 3.27Å; R252-D694 IonicContact NH1-OD1 2.88Å; R252-D694 PolarHBondContact NH1-OD1 3.49Å; R252-D694 IonicContact NH1-OD2 2.66Å; R252-D694 PolarHBondContact NH1-OD2 3.46Å; R252-D694 VanDerWaalsContact NH1-OD2 3.13Å; R252-D694 IonicContact NH2-OD1 2.99Å; R252-D694 PolarHBondContact NH2-OD1 3.28Å; R252-D694 IonicContact NH2-OD2 2.72Å; R252-D694 PolarHBondContact NH2-OD2 2.99Å
253	E	51	Low	45.7	Very low	89 Å²	89	86 Å²	86	42%	0.416	43%	0.427	S	S	.	.	H	α-helix	trans	-58.2	-32	174.4	-77.1	172.9	-164.5	0	0	112.4	K249 R250 Q257	K249-E253 WeakPolarHBondContact O-CB 3.41Å; K249-E253 VanDerWaalsContact O-CG 3.3Å; K249-E253 WeakPolarHBondContact O-CG 3.26Å; K249-E253 PolarHBondContact O-N 3.13Å; R250-E253 PolarHBondContact O-N 3.5Å; E253-Q257 VanDerWaalsContact O-CB 3.29Å; E253-Q257 WeakPolarHBondContact O-CB 3.4Å; E253-Q257 WeakPolarHBondContact O-CG 3.39Å; E253-Q257 PolarHBondContact O-N 2.98Å; E253-Q257 VanDerWaalsContact O-N 3.12Å; E253-Q257 PolarHBondContact O-NE2 3.02Å
254	R	49.2	Very low	46.2	Very low	135 Å²	135	86.1 Å²	86.1	51%	0.509	43%	0.425	S	S	.	.	H	α-helix	trans	-70.7	-48.2	171.5	-80.3	-178.7	171.6	-163.4	0.7	111.7	R250 S251 R252 E256 Q257 E258 D504	R250-R254 WeakPolarHBondContact O-CG 3.43Å; R250-R254 PolarHBondContact O-N 3.38Å; S251-R254 WeakPolarHBondContact O-CB 3.37Å; S251-R254 PolarHBondContact O-N 2.86Å; R252-R254 PolarHBondContact O-N 3.36Å; R254-E256 PolarHBondContact O-N 3.3Å; R254-Q257 CarbonylContact O-C 3.57Å; R254-Q257 WeakPolarHBondContact O-CB 3.47Å; R254-Q257 PolarHBondContact O-N 3.44Å; R254-Q257 VanDerWaalsContact O-N 3.16Å; R254-E258 PolarHBondContact O-N 3.04Å; R254-D504 IonicContact CZ-OD2 2.68Å; R254-D504 IonicContact NH1-OD2 2.55Å; R254-D504 PolarHBondContact NH1-OD2 3.43Å; R254-D504 IonicContact NH2-OD2 3.43Å; R254-D504 PolarHBondContact NH2-OD2 3.04Å
255	L	49.3	Very low	46.5	Very low	106 Å²	106	89.2 Å²	89.2	56%	0.555	44%	0.436	S	S	*	.	H	α-helix	trans	-60.9	-43.3	178.4	-77	166.5	0	0	0	112	S251 R252 E258 S259	S251-L255 PolarHBondContact O-N 3.45Å; R252-L255 PolarHBondContact O-N 2.88Å; R252-L255 VanDerWaalsContact O-N 3.11Å; L255-E258 PolarHBondContact O-N 2.87Å; L255-S259 WeakPolarHBondContact O-CB 3.26Å; L255-S259 PolarHBondContact O-N 2.66Å; L255-S259 PolarHBondContact O-OG 2.96Å; L255-S259 VanDerWaalsContact O-OG 3.08Å
256	E	51.5	Low	46.6	Very low	97 Å²	97	92.2 Å²	92.2	45%	0.453	45%	0.451	S	S	.	.	H	α-helix	trans	-63.8	-39.7	173.5	-71.2	176.4	-176.9	0	0	111.5	R252 R254 S259 A260	R252-E256 HydrophobicContact CG-CG 4.35Å; R252-E256 WeakPolarHBondContact CG-OE1 3.24Å; R252-E256 IonicContact CZ-OE1 2.77Å; R252-E256 IonicContact NE-OE1 3.36Å; R252-E256 PolarHBondContact NE-OE1 3.28Å; R252-E256 IonicContact NH2-OE1 2.66Å; R252-E256 PolarHBondContact NH2-OE1 3.28Å; R252-E256 WeakPolarHBondContact O-CB 3.36Å; R252-E256 WeakPolarHBondContact O-CG 3.38Å; R252-E256 PolarHBondContact O-N 3.4Å; R254-E256 PolarHBondContact O-N 3.3Å; E256-S259 PolarHBondContact O-N 3.36Å; E256-A260 WeakPolarHBondContact O-CB 3.15Å; E256-A260 PolarHBondContact O-N 2.66Å
257	Q	54.6	Low	46.7	Very low	103 Å²	103	95.3 Å²	95.3	48%	0.481	46%	0.461	S	S	.	.	H	α-helix	trans	-66.6	-31.7	172.4	-80	170.6	68.2	0	0	113.4	E253 R254 K261	E253-Q257 VanDerWaalsContact O-CB 3.29Å; E253-Q257 WeakPolarHBondContact O-CB 3.4Å; E253-Q257 WeakPolarHBondContact O-CG 3.39Å; E253-Q257 PolarHBondContact O-N 2.98Å; E253-Q257 VanDerWaalsContact O-N 3.12Å; E253-Q257 PolarHBondContact O-NE2 3.02Å; R254-Q257 CarbonylContact O-C 3.57Å; R254-Q257 WeakPolarHBondContact O-CB 3.47Å; R254-Q257 PolarHBondContact O-N 3.44Å; R254-Q257 VanDerWaalsContact O-N 3.16Å; Q257-K261 WeakPolarHBondContact O-CB 3.26Å; Q257-K261 WeakPolarHBondContact O-CD 3.46Å; Q257-K261 WeakPolarHBondContact O-CG 3.32Å; Q257-K261 PolarHBondContact O-N 3.41Å
258	E	50	Low	46.7	Very low	85 Å²	85	101 Å²	101	40%	0.397	48%	0.481	S	S	.	.	H	α-helix	trans	-73.3	-42.8	173.4	-74.3	-154.9	178.2	0	0	112.6	R254 L255 A260 K261 R262	R254-E258 PolarHBondContact O-N 3.04Å; L255-E258 PolarHBondContact O-N 2.87Å; E258-A260 VanDerWaalsContact C-N 3.3Å; E258-A260 PolarHBondContact O-N 3.07Å; E258-K261 PolarHBondContact O-N 3.19Å; E258-R262 VanDerWaalsContact O-CG 3.28Å; E258-R262 WeakPolarHBondContact O-CG 3.3Å; E258-R262 PolarHBondContact O-N 2.77Å; E258-R262 IonicContact OE2-CZ 2.73Å; E258-R262 IonicContact OE2-NH2 3.86Å; E258-R262 PolarHBondContact OE2-NH2 2.65Å
259	S	46.8	Very low	46.4	Very low	79 Å²	79	108.8 Å²	108.8	55%	0.552	51%	0.513	S	S	*	.	H	α-helix	trans	-57.9	-44.8	171.3	-62.7	0	0	0	0	110.9	L255 E256 K261 R262 G263	L255-S259 WeakPolarHBondContact O-CB 3.26Å; L255-S259 PolarHBondContact O-N 2.66Å; L255-S259 PolarHBondContact O-OG 2.96Å; L255-S259 VanDerWaalsContact O-OG 3.08Å; E256-S259 PolarHBondContact O-N 3.36Å; S259-K261 PolarHBondContact O-N 3.45Å; S259-R262 PolarHBondContact O-N 2.88Å; S259-G263 PolarHBondContact O-N 2.96Å
260	A	50.8	Low	45.9	Very low	52 Å²	52	111 Å²	111	43%	0.43	52%	0.523	S	S	.	.	H	α-helix	trans	-68.5	-28.4	176	0	0	0	0	0	113.7	E256 E258 N264	E256-A260 WeakPolarHBondContact O-CB 3.15Å; E256-A260 PolarHBondContact O-N 2.66Å; E258-A260 VanDerWaalsContact C-N 3.3Å; E258-A260 PolarHBondContact O-N 3.07Å; A260-N264 VanDerWaalsContact O-CB 3.26Å; A260-N264 WeakPolarHBondContact O-CB 3.47Å; A260-N264 PolarHBondContact O-N 3.36Å; A260-N264 PolarHBondContact O-ND2 3.28Å
261	K	50.8	Low	45.1	Very low	116 Å²	116	112.3 Å²	112.3	50%	0.504	54%	0.536	S	S	.	.	H	α-helix	trans	-68.7	-50.9	170.1	-77.3	161.7	-168.7	167.1	0	110.7	Q257 E258 S259 G263 N264 D265	Q257-K261 WeakPolarHBondContact O-CB 3.26Å; Q257-K261 WeakPolarHBondContact O-CD 3.46Å; Q257-K261 WeakPolarHBondContact O-CG 3.32Å; Q257-K261 PolarHBondContact O-N 3.41Å; E258-K261 PolarHBondContact O-N 3.19Å; S259-K261 PolarHBondContact O-N 3.45Å; K261-G263 VanDerWaalsContact C-N 3.3Å; K261-G263 PolarHBondContact O-N 3.37Å; K261-N264 PolarHBondContact O-N 3.35Å; K261-D265 PolarHBondContact O-N 3.36Å
262	R	44.2	Very low	44.4	Very low	168 Å²	168	116.4 Å²	116.4	63%	0.634	57%	0.565	S	S	*	*	H	α-helix	trans	-55	-45.3	178.4	-65.4	167.9	-153.8	-140.1	7.3	110.8	E258 S259 D265 E266	E258-R262 VanDerWaalsContact O-CG 3.28Å; E258-R262 WeakPolarHBondContact O-CG 3.3Å; E258-R262 PolarHBondContact O-N 2.77Å; E258-R262 IonicContact OE2-CZ 2.73Å; E258-R262 IonicContact OE2-NH2 3.86Å; E258-R262 PolarHBondContact OE2-NH2 2.65Å; S259-R262 PolarHBondContact O-N 2.88Å; R262-D265 PolarHBondContact O-N 2.88Å; R262-E266 PolarHBondContact O-N 3.41Å
263	G	42.3	Very low	43.7	Very low	28 Å²	28	117.7 Å²	117.7	29%	0.289	59%	0.586	S	S	.	*	H	α-helix	trans	-67.6	-38.6	173.4	0	0	0	0	0	114.8	S259 K261 D265 E266 Q267	S259-G263 PolarHBondContact O-N 2.96Å; K261-G263 VanDerWaalsContact C-N 3.3Å; K261-G263 PolarHBondContact O-N 3.37Å; G263-D265 VanDerWaalsContact C-N 3.33Å; G263-D265 PolarHBondContact O-N 3.44Å; G263-E266 PolarHBondContact O-N 2.9Å; G263-Q267 PolarHBondContact O-N 3.11Å
264	N	45	Very low	42.8	Very low	83 Å²	83	120.9 Å²	120.9	44%	0.444	61%	0.605	S	S	.	*	H	α-helix	trans	-67.9	-30.3	176	-93.6	-79.8	0	0	0	113.2	A260 K261 E266 Q267 K268	A260-N264 VanDerWaalsContact O-CB 3.26Å; A260-N264 WeakPolarHBondContact O-CB 3.47Å; A260-N264 PolarHBondContact O-N 3.36Å; A260-N264 PolarHBondContact O-ND2 3.28Å; K261-N264 PolarHBondContact O-N 3.35Å; N264-E266 VanDerWaalsContact C-N 3.31Å; N264-Q267 PolarHBondContact O-N 2.98Å; N264-K268 WeakPolarHBondContact O-CB 3.38Å; N264-K268 WeakPolarHBondContact O-CG 3.37Å; N264-K268 PolarHBondContact O-N 3.11Å
265	D	41	Very low	41.9	Very low	103 Å²	103	118.7 Å²	118.7	55%	0.551	62%	0.616	S	S	*	*	H	α-helix	trans	-75.8	-21.2	178.2	-68.4	-30.7	0	0	0	112.1	K261 R262 G263 K268	K261-D265 PolarHBondContact O-N 3.36Å; R262-D265 PolarHBondContact O-N 2.88Å; G263-D265 VanDerWaalsContact C-N 3.33Å; G263-D265 PolarHBondContact O-N 3.44Å; D265-K268 IonicContact OD1-NZ 2.73Å
266	E	40.7	Very low	41.1	Very low	160 Å²	160	119.2 Å²	119.2	75%	0.748	62%	0.624	S	S	*	*	H	α-helix	trans	-74.8	-41.5	161.5	-66.1	-162.8	104.8	0	0	112.5	R262 G263 N264	R262-E266 PolarHBondContact O-N 3.41Å; G263-E266 PolarHBondContact O-N 2.9Å; N264-E266 VanDerWaalsContact C-N 3.31Å
267	Q	40.6	Very low	40	Very low	144 Å²	144	125.1 Å²	125.1	67%	0.673	64%	0.642	S	S	*	*	H	α-helix	trans	-72.7	-31	-178.7	-101.5	178.5	-65.4	0	0	114.4	G263 N264 K269 K270	G263-Q267 PolarHBondContact O-N 3.11Å; N264-Q267 PolarHBondContact O-N 2.98Å; Q267-K269 PolarHBondContact O-N 2.82Å; Q267-K270 PolarHBondContact O-N 3.46Å
268	K	38.3	Very low	39.1	Very low	156 Å²	156	125.8 Å²	125.8	68%	0.678	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.6	-8	177.6	-89	177.5	-179.9	166.9	0	115.1	N264 D265 K270	N264-K268 WeakPolarHBondContact O-CB 3.38Å; N264-K268 WeakPolarHBondContact O-CG 3.37Å; N264-K268 PolarHBondContact O-N 3.11Å; D265-K268 IonicContact OD1-NZ 2.73Å; K268-K270 PolarHBondContact O-N 3.42Å
269	K	37.2	Very low	38.2	Very low	195 Å²	195	128.4 Å²	128.4	85%	0.848	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.1	2.2	168.9	-99.2	177.9	176.7	173	0	114	Q267	Q267-K269 PolarHBondContact O-N 2.82Å
270	K	35.6	Very low	37.5	Very low	168 Å²	168	132 Å²	132	73%	0.73	69%	0.691	S	S	*	*	S	Bend	trans	-132.3	139.5	177.2	-72.2	175.5	178.9	167.5	0	112.2	Q267 K268	Q267-K270 PolarHBondContact O-N 3.46Å; K268-K270 PolarHBondContact O-N 3.42Å
271	E	32	Very low	36.6	Very low	184 Å²	184	137.3 Å²	137.3	86%	0.86	71%	0.706	S	S	*	*			trans	67.5	89.8	161.7	-64.8	171.3	-179.6	0	0	116.8
272	S	30.9	Very low	35.8	Very low	116 Å²	116	140.7 Å²	140.7	81%	0.811	72%	0.723	S	S	*	*			trans	-111.9	105.8	165.5	57.5	0	0	0	0	111.5
273	S	35.3	Very low	35	Very low	105 Å²	105	136.2 Å²	136.2	73%	0.734	72%	0.722	S	S	*	*			trans	176.8	120.2	154.9	53.6	0	0	0	0	112.5
274	D	32.8	Very low	34.5	Very low	155 Å²	155	141.2 Å²	141.2	83%	0.829	75%	0.748	S	S	*	*			trans	34.5	128.9	142.4	-45.1	-30.3	0	0	0	120.6
275	A	30.8	Very low	33.8	Very low	90 Å²	90	148.8 Å²	148.8	74%	0.744	77%	0.77	S	S	*	*				72.6	131.3	52.8	0	0	0	0	0	112.7
276	T	32.2	Very low	33.1	Very low	116 Å²	116	155.3 Å²	155.3	71%	0.712	79%	0.787	S	S	*	*			cis	-172.1	125.7	47.4	-93.4	0	0	0	0	113.4
277	W	27.8	Very low	32.7	Very low	221 Å²	221	154.9 Å²	154.9	84%	0.837	80%	0.795	S	S	*	*			trans	50	175.6	143.9	-62.9	86.3	0	0	0	123.3
278	P	35.3	Very low	32	Very low	118 Å²	118	152 Å²	152	77%	0.766	80%	0.796	S	S	*	*			cis	-129.9	-170.4	-20	28	-3.5	0	0	0	116.8
279	N	32.2	Very low	31.6	Very low	139 Å²	139	150.9 Å²	150.9	74%	0.743	81%	0.805	S	S	*	*			trans	-94.6	167.4	-168.7	-42.6	-67.6	0	0	0	118.4
280	V	31.8	Very low	31.2	Very low	155 Å²	155	149.5 Å²	149.5	94%	0.939	81%	0.805	S	S	*	*			trans	-143.7	163.6	143	-179.8	0	0	0	0	110.9
281	H	30.7	Very low	30.7	Very low	163 Å²	163	151.7 Å²	151.7	76%	0.755	81%	0.808	S	S	*	*			trans	-105.8	159.5	-158.7	-131.9	-120.4	0	0	0	116.3
282	H	34.3	Very low	30.5	Very low	187 Å²	187	150.9 Å²	150.9	87%	0.866	81%	0.809	S	S	*	*				-166.9	162.1	122.7	-122.6	-93.9	0	0	0	113.4
283	A	27.5	Very low	30.4	Very low	74 Å²	74	152.5 Å²	152.5	61%	0.612	81%	0.808	S	S	*	*			trans	-153	152.7	-167.6	0	0	0	0	0	116.6
284	T	32.5	Very low	30.2	Very low	134 Å²	134	154.7 Å²	154.7	82%	0.822	81%	0.81	S	S	*	*			trans	-164.2	154.3	160.9	38.8	0	0	0	0	107.9
285	R	31	Very low	30.2	Very low	242 Å²	242	152.2 Å²	152.2	91%	0.913	80%	0.803	S	S	*	*			cis	-143.1	-139.4	-4.2	-132.1	178.3	-167.8	-136.5	3.5	108.1
286	R	26.1	Very low	30.2	Very low	240 Å²	240	153.9 Å²	153.9	91%	0.906	81%	0.805	S	S	*	*			trans	-147.1	151	169.6	-74.6	179.9	174.5	161.4	-3.7	111.2
287	T	30.9	Very low	30.1	Very low	151 Å²	151	153.3 Å²	153.3	93%	0.926	81%	0.813	S	S	*	*			trans	-136.8	154.7	156	45.5	0	0	0	0	109
288	A	26.5	Very low	30.4	Very low	83 Å²	83	147.3 Å²	147.3	69%	0.686	81%	0.81	S	S	*	*			trans	-114.8	155.8	-172.2	0	0	0	0	0	111.7	I290	A288-I290 PolarHBondContact O-N 3.01Å
289	P	29.7	Very low	30.2	Very low	132 Å²	132	151 Å²	151	86%	0.857	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-72.2	122.1	177.5	29.2	-33.8	0	0	0	111.2
290	I	28.7	Very low	30.3	Very low	167 Å²	167	153.9 Å²	153.9	86%	0.856	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-76.3	140.5	173.8	-64	174.6	0	0	0	109.3	A288	A288-I290 PolarHBondContact O-N 3.01Å
291	R	26.3	Very low	30.3	Very low	213 Å²	213	153.3 Å²	153.3	80%	0.804	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-76.3	121.9	171.8	-73.7	175.7	168.9	167.7	-5.4	109.9	L293	R291-L293 PolarHBondContact O-N 3.25Å
292	L	27.1	Very low	30.3	Very low	168 Å²	168	153 Å²	153	88%	0.88	82%	0.82	S	S	*	*			trans	-74.5	101.1	158	-87.4	163.1	0	0	0	108.7
293	L	28	Very low	30.3	Very low	149 Å²	149	149.2 Å²	149.2	78%	0.78	81%	0.806	S	S	*	*			trans	-73.9	127.6	153.5	-81.6	111.2	0	0	0	107.7	R291 P295	R291-L293 PolarHBondContact O-N 3.25Å; L293-P295 WeakPolarHBondContact O-CD 3.22Å
294	I	31.3	Very low	30.4	Very low	151 Å²	151	150.7 Å²	150.7	77%	0.774	80%	0.803	S	S	*	*			trans	-90.7	112.8	169.6	-61.4	172.5	0	0	0	106.3
295	P	32.8	Very low	30.4	Very low	104 Å²	104	150 Å²	150	68%	0.675	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-66.4	149.5	170.5	29.4	-33.8	0	0	0	109.9	L293	L293-P295 WeakPolarHBondContact O-CD 3.22Å
296	P	31.9	Very low	30.3	Very low	124 Å²	124	147 Å²	147	81%	0.805	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-65.9	145.8	175.1	29.6	-34.5	0	0	0	110.6	A298	P296-A298 PolarHBondContact O-N 3.3Å
297	A	30	Very low	30.6	Very low	104 Å²	104	144.9 Å²	144.9	86%	0.86	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-70	117	171.4	0	0	0	0	0	109.7
298	A	33.1	Very low	30.3	Very low	96 Å²	96	143.2 Å²	143.2	79%	0.793	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-82.5	171.7	168.2	0	0	0	0	0	110.9	P296	P296-A298 PolarHBondContact O-N 3.3Å
299	E	31.7	Very low	30.6	Very low	196 Å²	196	145.5 Å²	145.5	92%	0.916	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-92.9	142.8	-162.2	-62.2	166	138.4	0	0	113.1
300	E	33.6	Very low	30.7	Very low	198 Å²	198	144.9 Å²	144.9	93%	0.925	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-101.2	125.2	167.9	-71.2	-171.5	153	0	0	110.1
301	T	33.4	Very low	30.7	Very low	144 Å²	144	146.1 Å²	146.1	88%	0.883	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-81.8	128.2	-179.9	46	0	0	0	0	112.2
302	K	30.8	Very low	31	Very low	156 Å²	156	144.9 Å²	144.9	68%	0.678	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-82.6	141.5	178.5	-177.3	171.2	-178	-93.8	0	112.1	D304	K302-D304 WeakPolarHBondContact CE-OD1 3.34Å; K302-D304 IonicContact NZ-OD1 2.65Å; K302-D304 PolarHBondContact NZ-OD1 3.16Å; K302-D304 IonicContact NZ-OD2 3.55Å; K302-D304 PolarHBondContact NZ-OD2 3.43Å
303	L	33.2	Very low	31.4	Very low	108 Å²	108	144.9 Å²	144.9	57%	0.565	79%	0.788	S	S	*	*			trans	-132.3	141.5	160	-87.9	166.5	0	0	0	108.9	L85 R88	L85-L303 HydrophobicContact CD1-CD1 3.56Å; L85-L303 HydrophobicContact CD1-CD2 3.9Å; L85-L303 HydrophobicContact CD1-CG 4.41Å; R88-L303 VanDerWaalsContact CZ-O 3.28Å; R88-L303 PolarHBondContact NH1-O 2.69Å; R88-L303 PolarHBondContact NH2-O 3.1Å
304	D	29.9	Very low	31.9	Very low	104 Å²	104	142.9 Å²	142.9	56%	0.556	78%	0.783	S	S	*	*			trans	-101.9	170	179.8	-70.4	-75.8	0	0	0	112.1	R88 K302	R88-D304 PolarHBondContact NH1-O 3.49Å; R88-D304 VanDerWaalsContact NH1-O 3.13Å; K302-D304 WeakPolarHBondContact CE-OD1 3.34Å; K302-D304 IonicContact NZ-OD1 2.65Å; K302-D304 PolarHBondContact NZ-OD1 3.16Å; K302-D304 IonicContact NZ-OD2 3.55Å; K302-D304 PolarHBondContact NZ-OD2 3.43Å
305	L	32.4	Very low	32.2	Very low	119 Å²	119	139.9 Å²	139.9	62%	0.623	78%	0.776	S	S	*	*			trans	-159.9	141.1	149.7	-112.1	158.4	0	0	0	107.8	R88	R88-L305 HydrophobicContact CB-CD1 4.3Å
306	Q	29.6	Very low	32.3	Very low	180 Å²	180	143 Å²	143	84%	0.841	79%	0.787	S	S	*	*			trans	-100.1	153.8	-176.1	-63.4	170.7	-61.3	0	0	109.9
307	E	31	Very low	32.3	Very low	195 Å²	195	141 Å²	141	91%	0.911	79%	0.789	S	S	*	*			trans	-127.8	131.4	165.6	-154.5	171.3	-141.2	0	0	109.5
308	T	26.1	Very low	32.5	Very low	116 Å²	116	141.2 Å²	141.2	71%	0.712	78%	0.784	S	S	*	*			trans	-141.3	125.3	-179.1	56.2	0	0	0	0	109.4
309	T	31.5	Very low	32.5	Very low	132 Å²	132	143.2 Å²	143.2	81%	0.81	79%	0.787	S	S	*	*				-173.7	123.1	127.3	26.9	0	0	0	0	111.7
310	S	33.1	Very low	32.5	Very low	119 Å²	119	139.3 Å²	139.3	83%	0.832	78%	0.781	S	S	*	*				54.1	137.3	127.9	-47.9	0	0	0	0	122.3
311	E	27.8	Very low	32.6	Very low	192 Å²	192	134 Å²	134	90%	0.897	77%	0.771	S	S	*	*			trans	-82.1	156.2	178.1	-53.3	160.7	105.3	0	0	112.8
312	E	33.4	Very low	32.4	Very low	187 Å²	187	133.3 Å²	133.3	87%	0.874	76%	0.762	S	S	*	*				-158	152.8	120.6	-116.3	179.9	-178.5	0	0	112.7
313	M	35.6	Very low	32.6	Very low	169 Å²	169	134 Å²	134	83%	0.833	77%	0.77	S	S	*	*			trans	-135.8	179.5	-179.7	-84	-81.4	119.8	0	0	106.4
314	P	38.3	Very low	32.5	Very low	106 Å²	106	133.7 Å²	133.7	69%	0.688	78%	0.777	S	S	*	*			cis	-143.8	-176.6	11.2	42.2	-22.2	0	0	0	117.3
315	S	37.2	Very low	33.1	Very low	88 Å²	88	134.1 Å²	134.1	62%	0.615	79%	0.785	S	S	*	*			trans	86.6	110.4	136.7	71.6	0	0	0	0	123.1
316	N	34.1	Very low	33.1	Very low	170 Å²	170	140.4 Å²	140.4	91%	0.909	80%	0.8	S	S	*	*				63.8	111.4	118.9	-54.6	-13.4	0	0	0	121.9
317	G	33.5	Very low	33.2	Very low	82 Å²	82	141.4 Å²	141.4	85%	0.845	80%	0.802	S	S	*	*			trans	-162.7	129.2	154.2	0	0	0	0	0	110.1
318	S	32.8	Very low	33.4	Very low	109 Å²	109	142.5 Å²	142.5	76%	0.762	80%	0.804	S	S	*	*			trans	-127.7	173.8	-164.1	61.2	0	0	0	0	114.5
319	T	34.5	Very low	33.6	Very low	138 Å²	138	141.4 Å²	141.4	85%	0.847	80%	0.801	S	S	*	*			trans	76.7	154.8	171.9	72.8	0	0	0	0	117.5
320	S	30.6	Very low	33.8	Very low	114 Å²	114	146.7 Å²	146.7	80%	0.797	81%	0.806	S	S	*	*			cis	-173.3	165.6	-28.9	-173.3	0	0	0	0	109.8
321	A	35	Very low	33.8	Very low	87 Å²	87	148.3 Å²	148.3	72%	0.719	80%	0.8	S	S	*	*			trans	59.2	115.9	168.5	0	0	0	0	0	117.1
322	D	30	Very low	34.2	Very low	129 Å²	129	146.9 Å²	146.9	69%	0.69	79%	0.793	S	S	*	*				58.1	111.2	61.6	-170.9	29.9	0	0	0	115.2
323	M	34.1	Very low	34.2	Very low	171 Å²	171	145.2 Å²	145.2	84%	0.842	79%	0.79	S	S	*	*			trans	-171.7	156.6	133.1	-102.4	-66.3	120.9	0	0	110.6
324	S	31.7	Very low	33.9	Very low	101 Å²	101	142 Å²	142	71%	0.706	79%	0.79	S	S	*	*			trans	-118.1	-153.7	-159.2	-159.6	0	0	0	0	114.3
325	P	41.8	Very low	33.6	Very low	113 Å²	113	145.4 Å²	145.4	73%	0.734	80%	0.802	S	S	*	*				-120.1	-179	-105.3	40.3	-26	0	0	0	114.6
326	R	32.4	Very low	33.1	Very low	250 Å²	250	150.9 Å²	150.9	94%	0.943	82%	0.815	S	S	*	*			trans	-145	128.3	159.8	-120.2	171.5	-171.1	-166.4	1.5	116.4
327	K	32.2	Very low	32.8	Very low	202 Å²	202	149.3 Å²	149.3	88%	0.878	82%	0.815	S	S	*	*			trans	-73.9	155.9	178.9	-57.3	170.2	179.6	175.6	0	112.5
328	K	35.4	Very low	32.4	Very low	217 Å²	217	151.2 Å²	151.2	94%	0.943	82%	0.816	S	S	*	*			trans	-148.5	152.2	138.1	-109.7	164.1	-172.3	176	0	110.4
329	S	29.8	Very low	32.3	Very low	93 Å²	93	150.9 Å²	150.9	65%	0.65	82%	0.819	S	S	*	*			trans	-121.7	153.3	-169	157.1	0	0	0	0	110.7
330	R	36.1	Very low	31.9	Very low	243 Å²	243	150.8 Å²	150.8	92%	0.917	82%	0.819	S	S	*	*			trans	-153.4	145.9	137.8	-114.3	165	-176	-178.7	-1	113.2
331	H	34.1	Very low	31.8	Very low	154 Å²	154	151.6 Å²	151.6	71%	0.713	83%	0.825	S	S	*	*			trans	-65.5	161.2	173.9	-57.9	-86.3	0	0	0	110.5
332	H	34.9	Very low	31.4	Very low	162 Å²	162	151.4 Å²	151.4	75%	0.75	82%	0.823	S	S	*	*				-167.8	166.9	66.5	-120.9	-84.1	0	0	0	116.6
333	N	34.6	Very low	31.3	Very low	151 Å²	151	156.3 Å²	156.3	81%	0.807	83%	0.832	S	S	*	*			trans	79.8	125.5	162.1	-60.9	-12.6	0	0	0	117.7
334	A	27.7	Very low	30.9	Very low	101 Å²	101	154 Å²	154	84%	0.835	83%	0.829	S	S	*	*			trans	-119.3	146.3	-178.8	0	0	0	0	0	110.5
335	L	32.3	Very low	30.8	Very low	178 Å²	178	154.4 Å²	154.4	93%	0.932	83%	0.832	S	S	*	*			trans	-122.2	133.1	158.1	-88.3	167.1	0	0	0	108.6
336	K	26.5	Very low	30.6	Very low	204 Å²	204	153.7 Å²	153.7	89%	0.887	82%	0.822	S	S	*	*			trans	-77.6	133.6	177.4	-68.8	174	175.3	176	0	109.9
337	C	28.9	Very low	31	Very low	137 Å²	137	145.5 Å²	145.5	93%	0.926	80%	0.797	S	S	*	*			trans	-153.8	124.9	132.7	-100.7	0	0	0	0	110.5
338	S	25.7	Very low	31.3	Very low	122 Å²	122	139 Å²	139	85%	0.853	77%	0.769	S	S	*	*			trans	-103.6	124.9	178.7	52.3	0	0	0	0	110.3
339	A	29.2	Very low	31.6	Very low	101 Å²	101	133.8 Å²	133.8	84%	0.835	75%	0.748	S	S	*	*			trans	-153.9	114.6	160.2	0	0	0	0	0	110.1
340	T	27.7	Very low	32.3	Very low	137 Å²	137	136.4 Å²	136.4	84%	0.84	75%	0.747	S	S	*	*			trans	-71.1	141.1	159.3	40.1	0	0	0	0	108.6	A342	T340-A342 VanDerWaalsContact C-N 3.28Å; T340-A342 PolarHBondContact O-N 2.9Å
341	S	28.6	Very low	32.8	Very low	131 Å²	131	126.2 Å²	126.2	92%	0.916	71%	0.711	S	S	*	*			trans	-73.1	80.6	-178.5	-170.4	0	0	0	0	111.3
342	A	25.7	Very low	33.2	Very low	82 Å²	82	123.3 Å²	123.3	68%	0.678	70%	0.697	S	S	*	*			trans	-69.9	130.7	171.8	0	0	0	0	0	109.9	T340 P344	T340-A342 VanDerWaalsContact C-N 3.28Å; T340-A342 PolarHBondContact O-N 2.9Å; A342-P344 WeakPolarHBondContact O-CD 3.31Å
343	R	27.5	Very low	33.7	Very low	232 Å²	232	121.9 Å²	121.9	88%	0.875	69%	0.689	S	S	*	*			trans	-54.8	125.3	179.1	-63.5	-179.4	-178.2	-176.4	0.7	110.3	S345	R343-S345 PolarHBondContact O-N 3.16Å
344	P	26.2	Very low	34.1	Very low	122 Å²	122	122.5 Å²	122.5	79%	0.792	68%	0.684	S	S	*	*			trans	-71.7	93.5	167.5	29.5	-32.4	0	0	0	108.6	A342 L346	A342-P344 WeakPolarHBondContact O-CD 3.31Å; P344-L346 PolarHBondContact O-N 3.12Å
345	S	29.3	Very low	34.7	Very low	111 Å²	111	122 Å²	122	78%	0.776	67%	0.666	S	S	*	*			trans	-66.7	103.9	175.3	46.8	0	0	0	0	109.9	R343 N347	R343-S345 PolarHBondContact O-N 3.16Å; S345-N347 PolarHBondContact O-N 3.23Å
346	L	36.9	Very low	35	Very low	97 Å²	97	119.5 Å²	119.5	51%	0.508	66%	0.658	S	S	.	*			trans	-60.5	102.4	168.6	-75.5	172.5	0	0	0	108	P344 F348 M351	P344-L346 PolarHBondContact O-N 3.12Å; L346-F348 VanDerWaalsContact C-N 3.33Å; L346-F348 WeakPolarHBondContact O-CD2 3.46Å; L346-F348 PolarHBondContact O-N 3.21Å; L346-M351 HydrophobicContact CB-CE 3.98Å; L346-M351 HydrophobicContact CD1-CE 4.48Å; L346-M351 HydrophobicContact CD2-CE 4.02Å; L346-M351 HydrophobicContact CG-CE 4.39Å
347	N	42	Very low	35.3	Very low	79 Å²	79	117.3 Å²	117.3	42%	0.422	65%	0.648	S	S	.	*			trans	-71.4	91.2	-179.4	-175.8	-75.3	0	0	0	108.8	S345 E349 K350 M351	S345-N347 PolarHBondContact O-N 3.23Å; N347-E349 PolarHBondContact O-N 3.44Å; N347-E349 VanDerWaalsContact O-N 3.16Å; N347-K350 HydrophobicContact CB-CB 4.3Å; N347-K350 HydrophobicContact CB-CD 4.27Å; N347-K350 HydrophobicContact CB-CG 4.48Å; N347-K350 WeakPolarHBondContact O-CB 3.29Å; N347-K350 PolarHBondContact O-N 2.95Å; N347-K350 WeakPolarHBondContact OD1-CB 3.48Å; N347-K350 VanDerWaalsContact OD1-CG 3.3Å; N347-K350 WeakPolarHBondContact OD1-CG 3.38Å; N347-K350 PolarHBondContact OD1-N 2.93Å; N347-M351 PolarHBondContact O-N 3.38Å
348	F	38.6	Very low	35.4	Very low	65 Å²	65	116.3 Å²	116.3	29%	0.285	64%	0.64	S	S	.	*	H	α-helix	trans	-47.8	-41.8	-178.2	-75.3	-96.9	0	0	0	112.4	L346 K350 M351 Q352 F814	L346-F348 VanDerWaalsContact C-N 3.33Å; L346-F348 WeakPolarHBondContact O-CD2 3.46Å; L346-F348 PolarHBondContact O-N 3.21Å; F348-K350 PolarHBondContact O-N 3.2Å; F348-M351 WeakPolarHBondContact O-CA 3.33Å; F348-M351 WeakPolarHBondContact O-CB 3.33Å; F348-M351 PolarHBondContact O-N 3.14Å; F348-Q352 PolarHBondContact O-N 2.82Å; F348-F814 AromaticContact CD1-CE1 3.95Å; F348-F814 HydrophobicContact CD1-CE1 3.95Å; F348-F814 HydrophobicContact CD1-CZ 4.08Å; F348-F814 HydrophobicContact CE1-CE1 4.14Å
349	E	40.6	Very low	35.8	Very low	107 Å²	107	118.2 Å²	118.2	50%	0.5	64%	0.637	S	S	.	*	H	α-helix	trans	-61.5	-39.2	180	-153	-164.5	148.8	0	0	112.8	N347 M351 K353	N347-E349 PolarHBondContact O-N 3.44Å; N347-E349 VanDerWaalsContact O-N 3.16Å; E349-M351 VanDerWaalsContact C-N 3.29Å; E349-M351 PolarHBondContact O-N 3.31Å; E349-K353 WeakPolarHBondContact O-CB 3.48Å; E349-K353 VanDerWaalsContact O-CG 3.23Å; E349-K353 WeakPolarHBondContact O-CG 3.26Å; E349-K353 PolarHBondContact O-N 3.35Å; E349-K353 VanDerWaalsContact O-N 3.08Å; E349-K353 WeakPolarHBondContact OE1-CE 3.1Å; E349-K353 IonicContact OE1-NZ 2.71Å; E349-K353 PolarHBondContact OE1-NZ 3.36Å
350	K	46.3	Very low	36.1	Very low	149 Å²	149	121.7 Å²	121.7	65%	0.648	64%	0.636	S	S	*	*	H	α-helix	trans	-70	-21.9	172	-80.1	177.7	-178.8	176.8	0	113.3	N347 F348 K354	N347-K350 HydrophobicContact CB-CB 4.3Å; N347-K350 HydrophobicContact CB-CD 4.27Å; N347-K350 HydrophobicContact CB-CG 4.48Å; N347-K350 WeakPolarHBondContact O-CB 3.29Å; N347-K350 PolarHBondContact O-N 2.95Å; N347-K350 WeakPolarHBondContact OD1-CB 3.48Å; N347-K350 VanDerWaalsContact OD1-CG 3.3Å; N347-K350 WeakPolarHBondContact OD1-CG 3.38Å; N347-K350 PolarHBondContact OD1-N 2.93Å; F348-K350 PolarHBondContact O-N 3.2Å; K350-K354 WeakPolarHBondContact O-CG 3.36Å
351	M	45	Very low	36.6	Very low	29 Å²	29	123.2 Å²	123.2	14%	0.143	63%	0.633	C	S	.	*	H	α-helix	trans	-82	-47.4	175.9	-124.2	-179	-60.4	0	0	111.1	L346 N347 F348 E349 K353 K354 M355 F814	L346-M351 HydrophobicContact CB-CE 3.98Å; L346-M351 HydrophobicContact CD1-CE 4.48Å; L346-M351 HydrophobicContact CD2-CE 4.02Å; L346-M351 HydrophobicContact CG-CE 4.39Å; N347-M351 PolarHBondContact O-N 3.38Å; F348-M351 WeakPolarHBondContact O-CA 3.33Å; F348-M351 WeakPolarHBondContact O-CB 3.33Å; F348-M351 PolarHBondContact O-N 3.14Å; E349-M351 VanDerWaalsContact C-N 3.29Å; E349-M351 PolarHBondContact O-N 3.31Å; M351-K353 VanDerWaalsContact C-N 3.31Å; M351-K353 PolarHBondContact O-N 2.75Å; M351-K354 WeakPolarHBondContact O-CB 3.45Å; M351-K354 PolarHBondContact O-N 3.19Å; M351-M355 PolarHBondContact O-N 2.84Å; M351-F814 HydrophobicContact CB-CE2 3.9Å; M351-F814 HydrophobicContact CB-CZ 3.7Å; M351-F814 HydrophobicContact CE-CE1 4.02Å; M351-F814 HydrophobicContact CE-CZ 4.21Å; M351-F814 HydrophobicContact CG-CE2 4.26Å; M351-F814 HydrophobicContact CG-CZ 4.16Å; M351-F814 HydrophobicContact SD-CD1 4.05Å; M351-F814 HydrophobicContact SD-CD2 4.43Å; M351-F814 HydrophobicContact SD-CE1 3.67Å; M351-F814 HydrophobicContact SD-CE2 4.09Å; M351-F814 HydrophobicContact SD-CG 4.41Å; M351-F814 HydrophobicContact SD-CZ 3.7Å
352	Q	42.9	Very low	36.8	Very low	93 Å²	93	126.4 Å²	126.4	44%	0.435	63%	0.633	S	S	.	*	H	α-helix	trans	-54.5	-46.6	171.7	-70.6	176.9	-11	0	0	111.3	F348 K354 M355 V356	F348-Q352 PolarHBondContact O-N 2.82Å; Q352-K354 PolarHBondContact O-N 3.17Å; Q352-M355 PolarHBondContact O-N 3.46Å; Q352-V356 PolarHBondContact O-N 3.33Å
353	K	46	Very low	37.2	Very low	132 Å²	132	134.2 Å²	134.2	57%	0.574	65%	0.645	S	S	*	*	H	α-helix	trans	-66.5	-3.8	176.1	-70.6	173	-176.7	176.3	0	115.1	E349 M351	E349-K353 WeakPolarHBondContact O-CB 3.48Å; E349-K353 VanDerWaalsContact O-CG 3.23Å; E349-K353 WeakPolarHBondContact O-CG 3.26Å; E349-K353 PolarHBondContact O-N 3.35Å; E349-K353 VanDerWaalsContact O-N 3.08Å; E349-K353 WeakPolarHBondContact OE1-CE 3.1Å; E349-K353 IonicContact OE1-NZ 2.71Å; E349-K353 PolarHBondContact OE1-NZ 3.36Å; M351-K353 VanDerWaalsContact C-N 3.31Å; M351-K353 PolarHBondContact O-N 2.75Å
354	K	43	Very low	37.5	Very low	163 Å²	163	132.2 Å²	132.2	71%	0.709	64%	0.643	S	S	*	*	H	α-helix	trans	-101.2	-33.6	171.6	-79.3	-179.8	175.4	-173.3	0	113.5	K350 M351 Q352	K350-K354 WeakPolarHBondContact O-CG 3.36Å; M351-K354 WeakPolarHBondContact O-CB 3.45Å; M351-K354 PolarHBondContact O-N 3.19Å; Q352-K354 PolarHBondContact O-N 3.17Å
355	M	40.9	Very low	37.8	Very low	90 Å²	90	136.5 Å²	136.5	44%	0.443	65%	0.649	S	S	.	*	H	α-helix	trans	-73.1	-31.4	177.2	-72	177.8	69.2	0	0	112.6	M351 Q352 K357 P764 F814	M351-M355 PolarHBondContact O-N 2.84Å; Q352-M355 PolarHBondContact O-N 3.46Å; M355-K357 PolarHBondContact O-N 3.38Å; M355-P764 HydrophobicContact CE-CB 3.98Å; M355-P764 HydrophobicContact SD-CB 4.37Å; M355-F814 HydrophobicContact SD-CD2 3.69Å; M355-F814 HydrophobicContact SD-CE2 4.18Å
356	V	38.7	Very low	38	Very low	126 Å²	126	135 Å²	135	76%	0.764	65%	0.651	S	S	*	*	S	Bend	trans	-81.7	56.5	177.8	-166.3	0	0	0	0	111.4	Q352	Q352-V356 PolarHBondContact O-N 3.33Å
357	K	31.2	Very low	37.8	Very low	159 Å²	159	135.8 Å²	135.8	69%	0.691	66%	0.664	S	S	*	*			trans	-139	116.2	172.6	-74.7	-166.2	174.3	-170.4	0	111.4	M355	M355-K357 PolarHBondContact O-N 3.38Å
358	P	32.5	Very low	37.5	Very low	115 Å²	115	137.6 Å²	137.6	75%	0.747	68%	0.683	S	S	*	*			trans	-70.1	136.7	177	28.6	-33.6	0	0	0	111.4	H360	P358-H360 PolarHBondContact O-N 2.74Å
359	M	33.2	Very low	37.2	Very low	163 Å²	163	139 Å²	139	80%	0.803	70%	0.702	S	S	*	*			trans	-77	86.1	174.3	-79.1	-174.1	62.2	0	0	111.8	H361	M359-H361 PolarHBondContact O-N 3.02Å
360	H	35.1	Very low	36.8	Very low	174 Å²	174	139.4 Å²	139.4	81%	0.806	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-70.6	121.5	159.6	-82.6	-20.3	0	0	0	110.4	P358	P358-H360 PolarHBondContact O-N 2.74Å
361	H	37.7	Very low	36.2	Very low	169 Å²	169	137 Å²	137	78%	0.782	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-69.3	131	177.8	-83.9	29.3	0	0	0	111.8	M359 R363	M359-H361 PolarHBondContact O-N 3.02Å; H361-R363 PolarHBondContact O-N 3.02Å
362	H	32.7	Very low	35.5	Very low	197 Å²	197	142.9 Å²	142.9	91%	0.912	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-71.2	121	172.2	-86	-70.5	0	0	0	111.7
363	R	34	Very low	34.9	Very low	247 Å²	247	145.5 Å²	145.5	93%	0.932	77%	0.765	S	S	*	*			trans	-104.9	141.4	154.9	-166.3	166.6	176.8	157.5	-1.6	109.7	H361	H361-R363 PolarHBondContact O-N 3.02Å
364	K	34.4	Very low	34.1	Very low	189 Å²	189	144 Å²	144	82%	0.822	77%	0.771	S	S	*	*			trans	-91.1	145.7	-165.9	-94	174.5	177.1	168.1	0	114.1
365	K	32.5	Very low	33.3	Very low	212 Å²	212	142.4 Å²	142.4	92%	0.922	78%	0.779	S	S	*	*			trans	68.1	124.9	154	-67.8	-179.2	174.6	-172.3	0	119
366	G	34.1	Very low	32.9	Very low	79 Å²	79	141.8 Å²	141.8	81%	0.814	80%	0.796	S	S	*	*			trans	178.8	129.8	164.6	0	0	0	0	0	107.1
367	S	33.2	Very low	32.5	Very low	114 Å²	114	141.5 Å²	141.5	80%	0.797	80%	0.799	S	S	*	*			trans	-112.5	160.7	-165	-61.1	0	0	0	0	113.6
368	S	34.2	Very low	32.6	Very low	118 Å²	118	139.2 Å²	139.2	83%	0.825	80%	0.804	S	S	*	*			trans	75	146.4	161.8	-52	0	0	0	0	116.5
369	S	32.8	Very low	32.5	Very low	95 Å²	95	144.6 Å²	144.6	66%	0.664	81%	0.809	S	S	*	*			cis	-175.2	148.2	-14.5	44.7	0	0	0	0	110.4
370	S	32.1	Very low	32.5	Very low	114 Å²	114	144.9 Å²	144.9	80%	0.797	81%	0.814	S	S	*	*			trans	59.6	164.6	165.2	37.9	0	0	0	0	116.2
371	S	33.1	Very low	32.2	Very low	100 Å²	100	140.6 Å²	140.6	70%	0.699	80%	0.804	S	S	*	*			cis	-173.7	156.4	-12.6	45	0	0	0	0	107.9
372	L	30.6	Very low	31.9	Very low	152 Å²	152	141.9 Å²	141.9	80%	0.796	81%	0.812	S	S	*	*			cis	-167.6	176.4	-9.7	-110	173.5	0	0	0	109.7
373	L	31	Very low	31.8	Very low	148 Å²	148	141.3 Å²	141.3	78%	0.775	81%	0.807	S	S	*	*			trans	60.8	111.4	150.3	-73.2	164.4	0	0	0	122.5
374	S	28.5	Very low	31.5	Very low	100 Å²	100	134.6 Å²	134.6	70%	0.699	81%	0.805	S	S	*	*				82.3	106.9	111.2	-168	0	0	0	0	123
375	C	26.6	Very low	31.3	Very low	129 Å²	129	134.2 Å²	134.2	87%	0.872	80%	0.803	S	S	*	*				55.5	121.3	125.4	-156.7	0	0	0	0	121.6
376	G	32.4	Very low	30.9	Very low	77 Å²	77	130.8 Å²	130.8	79%	0.794	80%	0.8	S	S	*	*			trans	-172.3	120.6	159.7	0	0	0	0	0	111.1
377	S	31.1	Very low	30.7	Very low	120 Å²	120	134.7 Å²	134.7	84%	0.839	79%	0.794	S	S	*	*			trans	-95.2	143.4	-176	73.4	0	0	0	0	113
378	S	32.9	Very low	30.3	Very low	112 Å²	112	137.3 Å²	137.3	78%	0.783	80%	0.798	S	S	*	*				-156.1	165.9	128.9	-157.5	0	0	0	0	112.4
379	R	30	Very low	29.9	Very low	228 Å²	228	141.8 Å²	141.8	86%	0.86	80%	0.797	S	S	*	*			trans	-57.5	145.1	179.1	-59.1	153.7	173	158.8	-3.8	111.8
380	D	33.5	Very low	29.8	Very low	169 Å²	169	144.4 Å²	144.4	90%	0.904	81%	0.809	S	S	*	*				-157.4	165.3	104.3	-123.3	-33.8	0	0	0	114.1
381	S	28.7	Very low	29.4	Very low	84 Å²	84	141.8 Å²	141.8	59%	0.587	80%	0.8	S	S	*	*			trans	-111	119.2	-170.8	140.2	0	0	0	0	112.9
382	M	31.5	Very low	29.4	Very low	196 Å²	196	143.3 Å²	143.3	97%	0.966	81%	0.807	S	S	*	*			trans	-127.2	127.5	160.2	-72.3	-160	175.9	0	0	112.4
383	K	30	Very low	29.4	Very low	184 Å²	184	144.1 Å²	144.1	80%	0.8	81%	0.811	S	S	*	*			trans	-92.3	101	-174.6	-66.2	169.2	-178.3	170.4	0	109.8	K385	K383-K385 PolarHBondContact O-N 3.27Å
384	A	28.6	Very low	29.1	Very low	107 Å²	107	144.9 Å²	144.9	88%	0.884	82%	0.815	S	S	*	*			trans	-64.4	99.4	172.2	0	0	0	0	0	110.3
385	K	29	Very low	28.9	Very low	180 Å²	180	151.2 Å²	151.2	78%	0.783	82%	0.823	S	S	*	*			trans	-113.2	74.3	-172.7	-161.1	168.9	-171.8	173.3	0	110.8	K383 K387	K383-K385 PolarHBondContact O-N 3.27Å; K385-K387 PolarHBondContact O-N 3.02Å
386	V	26	Very low	28.7	Very low	141 Å²	141	156.7 Å²	156.7	86%	0.855	83%	0.826	S	S	*	*			trans	-55.9	118.9	174.1	-179.7	0	0	0	0	108.8
387	K	28.1	Very low	28.3	Very low	160 Å²	160	164.3 Å²	164.3	70%	0.696	83%	0.831	S	S	*	*			trans	-136	82.5	-172.8	-161.1	-178.3	-175.4	-169.2	0	110.6	K385 R389	K385-K387 PolarHBondContact O-N 3.02Å; K387-R389 PolarHBondContact O-N 3.42Å
388	L	25.6	Very low	28.2	Very low	169 Å²	169	167.5 Å²	167.5	89%	0.885	83%	0.832	S	S	*	*			trans	-55.4	129.1	168.9	-69.8	162	0	0	0	109.7
389	R	26.5	Very low	27.8	Very low	212 Å²	212	167.2 Å²	167.2	80%	0.8	84%	0.836	S	S	*	*			trans	-150.2	131.8	164.8	-129	-179.3	-171	-172.1	0.3	110.4	K387	K387-R389 PolarHBondContact O-N 3.42Å
390	V	29.5	Very low	27.6	Very low	151 Å²	151	160.5 Å²	160.5	92%	0.915	83%	0.83	S	S	*	*			trans	-87.3	140.1	179.5	179.9	0	0	0	0	109.3
391	G	25.1	Very low	27.3	Very low	59 Å²	59	158 Å²	158	61%	0.608	82%	0.823	S	S	*	*			trans	-121.6	152.7	173.6	0	0	0	0	0	111.2
392	P	31.5	Very low	27.2	Very low	132 Å²	132	159.9 Å²	159.9	86%	0.857	83%	0.833	S	S	*	*			trans	-91.7	157	-158	35.4	-37	0	0	0	115.3
393	I	30.5	Very low	26.9	Very low	169 Å²	169	158.5 Å²	158.5	87%	0.867	83%	0.826	S	S	*	*			trans	-105.3	136.5	172.3	-67.6	176.2	0	0	0	110
394	L	26.3	Very low	26.6	Very low	164 Å²	164	158.8 Å²	158.8	86%	0.859	83%	0.831	S	S	*	*			trans	-82.6	158.3	177.2	-93.7	135.4	0	0	0	112.9
395	R	24.2	Very low	26.5	Very low	232 Å²	232	160.1 Å²	160.1	88%	0.875	82%	0.821	S	S	*	*			trans	-56.9	139	175.7	-64.2	176.3	177.5	174	-1.7	112
396	W	21.9	Very low	26.3	Very low	244 Å²	244	161.9 Å²	161.9	92%	0.924	82%	0.823	S	S	*	*			trans	-132.1	138.9	141.3	-99	81.4	0	0	0	110.2
397	R	23.5	Very low	26.4	Very low	237 Å²	237	158 Å²	158	89%	0.894	80%	0.802	S	S	*	*			trans	-88	131	166.4	-84.3	-178.9	166	-169.4	-3.2	108.2
398	Q	28.3	Very low	26.4	Very low	188 Å²	188	156.3 Å²	156.3	88%	0.879	80%	0.801	S	S	*	*			trans	-146.6	153.7	148.5	-109.5	171.1	10.2	0	0	109
399	A	25	Very low	26.5	Very low	105 Å²	105	154.2 Å²	154.2	87%	0.868	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-88.4	137.4	-161.1	0	0	0	0	0	113.3
400	A	26.5	Very low	26.5	Very low	88 Å²	88	152.2 Å²	152.2	73%	0.727	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-102.9	141.3	149.9	0	0	0	0	0	107.9
401	P	26.5	Very low	26.5	Very low	115 Å²	115	148.8 Å²	148.8	75%	0.747	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-71.5	151.4	-179.1	30	-35.1	0	0	0	111.6	M403	P401-M403 PolarHBondContact O-N 2.95Å
402	P	27.7	Very low	26.6	Very low	125 Å²	125	150.2 Å²	150.2	81%	0.812	75%	0.753	S	S	*	*			trans	-70.5	102.6	173.9	29.5	-33.4	0	0	0	110	Q404	P402-Q404 PolarHBondContact O-N 3.35Å
403	M	24.4	Very low	26.6	Very low	166 Å²	166	148.6 Å²	148.6	82%	0.818	74%	0.74	S	S	*	*			trans	-74.4	109.4	174.9	-159.3	171.7	-163.4	0	0	109.1	P401 I405	P401-M403 PolarHBondContact O-N 2.95Å; M403-I405 PolarHBondContact O-N 3.48Å
404	Q	24	Very low	26.6	Very low	191 Å²	191	146.6 Å²	146.6	89%	0.893	73%	0.727	S	S	*	*			trans	-67.8	102.1	-179.1	-70.1	178.8	-57.3	0	0	111	P402	P402-Q404 PolarHBondContact O-N 3.35Å
405	I	26.7	Very low	27.1	Very low	134 Å²	134	144.3 Å²	144.3	69%	0.687	71%	0.707	S	S	*	*			trans	-97.4	104.7	168.7	-60.1	177.1	0	0	0	107.7	M403	M403-I405 PolarHBondContact O-N 3.48Å
406	R	23.9	Very low	27.5	Very low	218 Å²	218	134.4 Å²	134.4	82%	0.823	68%	0.677	S	S	*	*			trans	-83.1	109.4	170.3	-83.6	175.7	155.6	169.9	-5.8	109.4
407	S	29.1	Very low	28.1	Very low	59 Å²	59	125.7 Å²	125.7	41%	0.413	66%	0.657	S	S	.	*			trans	-158.9	35.8	173.3	61	0	0	0	0	113.2	H409 F410	S407-H409 PolarHBondContact O-N 2.84Å; S407-H409 VanDerWaalsContact O-N 3.08Å; S407-F410 PolarHBondContact O-N 2.92Å
408	D	27.8	Very low	28.8	Very low	125 Å²	125	118 Å²	118	67%	0.668	63%	0.631	S	S	*	*	H	α-helix	trans	-60.2	-26	-168.8	-51.7	-65	0	0	0	113.9	F410	D408-F410 PolarHBondContact O-N 3.45Å
409	H	28.5	Very low	29.3	Very low	125 Å²	125	109.1 Å²	109.1	58%	0.579	59%	0.59	S	S	*	*	H	α-helix	trans	-66.8	-31.4	174.6	-72.7	-77.3	0	0	0	114.4	S407 V413	S407-H409 PolarHBondContact O-N 2.84Å; S407-H409 VanDerWaalsContact O-N 3.08Å; H409-V413 PolarHBondContact O-N 3.23Å
410	F	25.9	Very low	30.1	Very low	169 Å²	169	112.8 Å²	112.8	74%	0.741	58%	0.582	S	S	*	*	H	α-helix	trans	-74.6	-35.3	-176.5	-115.1	-84.5	0	0	0	112.2	S407 D408 H414	S407-F410 PolarHBondContact O-N 2.92Å; D408-F410 PolarHBondContact O-N 3.45Å; F410-H414 PolarHBondContact O-N 2.91Å
411	V	29.2	Very low	30.7	Very low	80 Å²	80	113.4 Å²	113.4	49%	0.485	58%	0.58	S	S	.	*	H	α-helix	trans	-64.3	-44.5	176.4	-175.6	0	0	0	0	110	V413 H414 W415	V411-V413 PolarHBondContact O-N 3.01Å; V411-H414 PolarHBondContact O-N 3.24Å; V411-W415 HydrophobicContact CG1-CG 4.46Å; V411-W415 WeakPolarHBondContact O-CB 3.28Å; V411-W415 PolarHBondContact O-N 2.78Å
412	F	27.5	Very low	31.5	Very low	89 Å²	89	109.9 Å²	109.9	39%	0.39	56%	0.555	S	S	.	*	H	α-helix	trans	-63.6	-39.2	-178.3	-126.8	-98.6	0	0	0	113.2	G416 L426 Y433	F412-G416 PolarHBondContact O-N 3.14Å; F412-L426 HydrophobicContact CE1-CD2 3.96Å; F412-Y433 HydrophobicContact CE1-CD2 4.11Å; F412-Y433 HydrophobicContact CE1-CE2 4.26Å; F412-Y433 HydrophobicContact CE1-CG 4.28Å; F412-Y433 AromaticContact CZ-CD2 3.74Å; F412-Y433 HydrophobicContact CZ-CD2 3.74Å; F412-Y433 HydrophobicContact CZ-CE2 4.11Å; F412-Y433 HydrophobicContact CZ-CG 4.18Å
413	V	30.4	Very low	32.4	Very low	97 Å²	97	105.6 Å²	105.6	59%	0.588	53%	0.534	S	S	*	.	H	α-helix	trans	-67.9	-43.5	176	175.5	0	0	0	0	111.2	H409 V411 G416 A417	H409-V413 PolarHBondContact O-N 3.23Å; V411-V413 PolarHBondContact O-N 3.01Å; V413-G416 PolarHBondContact O-N 3.48Å; V413-A417 WeakPolarHBondContact O-CB 3.35Å; V413-A417 PolarHBondContact O-N 3.07Å
414	H	31.5	Very low	33.4	Very low	128 Å²	128	98.3 Å²	98.3	59%	0.593	50%	0.497	S	S	*	.	H	α-helix	trans	-69.4	-37.7	179.1	-164	-36.4	0	0	0	112.2	F410 V411 Q418	F410-H414 PolarHBondContact O-N 2.91Å; V411-H414 PolarHBondContact O-N 3.24Å; H414-Q418 WeakPolarHBondContact O-CB 3.47Å; H414-Q418 PolarHBondContact O-N 3.31Å
415	W	35.7	Very low	34.6	Very low	115 Å²	115	93.1 Å²	93.1	44%	0.436	47%	0.473	S	S	.	.	H	α-helix	trans	-67.1	-44.2	173.4	-89.4	36.8	0	0	0	111.8	V411 Q418 A419 F435	V411-W415 HydrophobicContact CG1-CG 4.46Å; V411-W415 WeakPolarHBondContact O-CB 3.28Å; V411-W415 PolarHBondContact O-N 2.78Å; W415-Q418 PolarHBondContact O-N 3.26Å; W415-A419 WeakPolarHBondContact O-CB 3.39Å; W415-A419 PolarHBondContact O-N 3.05Å; W415-F435 HydrophobicContact CE3-CE2 4.26Å; W415-F435 HydrophobicContact CE3-CZ 4.36Å
416	G	33.3	Very low	35.3	Very low	24 Å²	24	89.5 Å²	89.5	25%	0.247	46%	0.455	C	S	.	.	H	α-helix	trans	-59.4	-49.8	175.9	0	0	0	0	0	112.2	F412 V413 A419 W420	F412-G416 PolarHBondContact O-N 3.14Å; V413-G416 PolarHBondContact O-N 3.48Å; G416-A419 PolarHBondContact O-N 3Å; G416-W420 WeakPolarHBondContact O-CB 3.09Å; G416-W420 PolarHBondContact O-N 2.87Å
417	A	35.2	Very low	36.1	Very low	62 Å²	62	85.4 Å²	85.4	51%	0.512	44%	0.439	S	S	.	.	H	α-helix	trans	-64.6	-40.8	178.4	0	0	0	0	0	113	V413 W420 S421	V413-A417 WeakPolarHBondContact O-CB 3.35Å; V413-A417 PolarHBondContact O-N 3.07Å; A417-W420 PolarHBondContact O-N 2.84Å; A417-S421 WeakPolarHBondContact O-CB 3.45Å; A417-S421 PolarHBondContact O-N 3.43Å
418	Q	38.4	Very low	36.4	Very low	75 Å²	75	86.4 Å²	86.4	35%	0.35	45%	0.447	S	S	.	.	H	α-helix	trans	-64.6	-46	176.2	-177.7	62.7	56.1	0	0	111.3	H414 W415 W420 S421 D422	H414-Q418 WeakPolarHBondContact O-CB 3.47Å; H414-Q418 PolarHBondContact O-N 3.31Å; W415-Q418 PolarHBondContact O-N 3.26Å; Q418-W420 PolarHBondContact O-N 3.48Å; Q418-S421 CarbonylContact O-C 3.05Å; Q418-S421 WeakPolarHBondContact O-CB 3.28Å; Q418-S421 PolarHBondContact O-N 2.89Å; Q418-D422 PolarHBondContact NE2-OD1 2.91Å; Q418-D422 PolarHBondContact NE2-OD2 3.09Å; Q418-D422 WeakPolarHBondContact O-CB 3.24Å; Q418-D422 PolarHBondContact O-N 3.47Å
419	A	38.3	Very low	36.5	Very low	2 Å²	2	84.2 Å²	84.2	2%	0.017	44%	0.44	C	S	.	.	H	α-helix	trans	-64.3	-39.1	178.4	0	0	0	0	0	112.2	W415 G416 D422 G423 Y424 F435	W415-A419 WeakPolarHBondContact O-CB 3.39Å; W415-A419 PolarHBondContact O-N 3.05Å; G416-A419 PolarHBondContact O-N 3Å; A419-D422 CarbonylContact O-C 3.52Å; A419-D422 PolarHBondContact O-N 3.31Å; A419-D422 VanDerWaalsContact O-N 3.13Å; A419-G423 PolarHBondContact O-N 2.76Å; A419-Y424 CarbonylContact C-O 3.48Å; A419-Y424 PolarHBondContact O-N 3.07Å; A419-F435 HydrophobicContact CB-CD1 3.54Å; A419-F435 HydrophobicContact CB-CE1 3.25Å; A419-F435 HydrophobicContact CB-CZ 4.14Å
420	W	41.3	Very low	37.2	Very low	182 Å²	182	81.4 Å²	81.4	69%	0.689	45%	0.445	S	S	*	.	H	α-helix	trans	-64.3	-41.2	174.8	-142	55.3	0	0	0	111.3	G416 A417 Q418 D422 G423 Y424	G416-W420 WeakPolarHBondContact O-CB 3.09Å; G416-W420 PolarHBondContact O-N 2.87Å; A417-W420 PolarHBondContact O-N 2.84Å; Q418-W420 PolarHBondContact O-N 3.48Å; W420-D422 VanDerWaalsContact C-N 3.27Å; W420-D422 PolarHBondContact O-N 3.4Å; W420-G423 PolarHBondContact O-N 2.87Å; W420-Y424 WeakPolarHBondContact CA-O 3.34Å
421	S	39.7	Very low	37.2	Very low	100 Å²	100	80.9 Å²	80.9	70%	0.699	45%	0.45	S	S	*	.	H	α-helix	trans	-65.6	-26.6	171.9	-170.6	0	0	0	0	113.7	A417 Q418	A417-S421 WeakPolarHBondContact O-CB 3.45Å; A417-S421 PolarHBondContact O-N 3.43Å; Q418-S421 CarbonylContact O-C 3.05Å; Q418-S421 WeakPolarHBondContact O-CB 3.28Å; Q418-S421 PolarHBondContact O-N 2.89Å
422	D	42.7	Very low	37.2	Very low	41 Å²	41	80.4 Å²	80.4	22%	0.219	44%	0.444	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.1	4.8	176.2	-71.5	-34.5	0	0	0	112.9	Q418 A419 W420 Y424 R690	Q418-D422 PolarHBondContact NE2-OD1 2.91Å; Q418-D422 PolarHBondContact NE2-OD2 3.09Å; Q418-D422 WeakPolarHBondContact O-CB 3.24Å; Q418-D422 PolarHBondContact O-N 3.47Å; A419-D422 CarbonylContact O-C 3.52Å; A419-D422 PolarHBondContact O-N 3.31Å; A419-D422 VanDerWaalsContact O-N 3.13Å; W420-D422 VanDerWaalsContact C-N 3.27Å; W420-D422 PolarHBondContact O-N 3.4Å; D422-Y424 HydrophobicContact CB-CD2 4.33Å; D422-Y424 WeakPolarHBondContact O-CD2 3.45Å; D422-Y424 WeakPolarHBondContact O-CE2 3.36Å; D422-R690 IonicContact OD1-CZ 2.72Å; D422-R690 IonicContact OD1-NH1 3.47Å; D422-R690 PolarHBondContact OD1-NH1 2.85Å; D422-R690 IonicContact OD1-NH2 2.74Å; D422-R690 IonicContact OD2-NH1 3.63Å; D422-R690 PolarHBondContact OD2-NH1 3.33Å
423	G	46.8	Very low	37.7	Very low	35 Å²	35	81 Å²	81	36%	0.361	45%	0.445	S	S	.	.	T	Hydrogen-bonded Turn	trans	93.7	20.8	172.8	0	0	0	0	0	116.8	A419 W420 L438	A419-G423 PolarHBondContact O-N 2.76Å; W420-G423 PolarHBondContact O-N 2.87Å; G423-L438 WeakPolarHBondContact O-CD1 3.41Å; G423-L438 PolarHBondContact O-N 3.09Å
424	Y	46.4	Very low	38	Very low	14 Å²	14	78.9 Å²	78.9	6%	0.055	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	133	-177.1	-65.9	-95.5	0	0	0	113.2	A419 W420 D422 F435 R436 P437 H684	A419-Y424 CarbonylContact C-O 3.48Å; A419-Y424 PolarHBondContact O-N 3.07Å; W420-Y424 WeakPolarHBondContact CA-O 3.34Å; D422-Y424 HydrophobicContact CB-CD2 4.33Å; D422-Y424 WeakPolarHBondContact O-CD2 3.45Å; D422-Y424 WeakPolarHBondContact O-CE2 3.36Å; Y424-F435 HydrophobicContact CD1-CB 4.19Å; Y424-R436 CarbonylContact C-O 3.56Å; Y424-R436 VanDerWaalsContact CA-O 3.25Å; Y424-R436 WeakPolarHBondContact CA-O 3.5Å; Y424-P437 HydrophobicContact CD1-CG 4.26Å; Y424-P437 HydrophobicContact CE1-CB 4.4Å; Y424-P437 HydrophobicContact CE1-CG 3.82Å; Y424-H684 AromaticContact CE1-CE1 3.52Å; Y424-H684 AromaticContact CE1-NE2 3.6Å; Y424-H684 AromaticContact CZ-NE2 3.95Å; Y424-H684 PolarHBondContact OH-CD2 3.3Å; Y424-H684 VanDerWaalsContact OH-CD2 3.26Å; Y424-H684 PolarHBondContact OH-NE2 2.92Å
425	Q	49	Very low	38.6	Very low	81 Å²	81	75.1 Å²	75.1	38%	0.379	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	134.4	168.5	-167.4	-174.7	50.4	0	0	110.3	R436 L438	Q425-R436 PolarHBondContact N-O 3.21Å; Q425-R436 PolarHBondContact O-N 3.21Å; Q425-L438 HydrophobicContact CB-CD1 4.25Å
426	L	41.3	Very low	38.9	Very low	59 Å²	59	73.3 Å²	73.3	31%	0.309	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	111.3	169.7	-168.4	88.7	0	0	0	109.9	F412 Y433 L434 F435	F412-L426 HydrophobicContact CE1-CD2 3.96Å; L426-Y433 HydrophobicContact CD2-CD1 3.68Å; L426-Y433 HydrophobicContact CD2-CE1 4.29Å; L426-Y433 HydrophobicContact CD2-CG 4.21Å; L426-Y433 HydrophobicContact CG-CD1 4.03Å; L426-Y433 HydrophobicContact CG-CG 4.43Å; L426-L434 WeakPolarHBondContact CA-O 3.2Å; L426-F435 HydrophobicContact CB-CE1 4.41Å; L426-F435 HydrophobicContact CD1-CD1 3.79Å; L426-F435 HydrophobicContact CD1-CD2 4.49Å; L426-F435 HydrophobicContact CD1-CE1 3.37Å; L426-F435 HydrophobicContact CD1-CE2 4.14Å; L426-F435 HydrophobicContact CD1-CG 4.33Å; L426-F435 HydrophobicContact CD1-CZ 3.58Å
427	R	39.3	Very low	39.4	Very low	131 Å²	131	73.4 Å²	73.4	49%	0.494	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	139.5	170.3	-89.1	-168.5	173.5	-141.6	1.8	111.4	Y433 L434	R427-Y433 CarbonylContact O-C 3.56Å; R427-Y433 VanDerWaalsContact O-CA 3.32Å; R427-Y433 WeakPolarHBondContact O-CA 3.48Å; R427-L434 PolarHBondContact N-O 3.41Å; R427-L434 PolarHBondContact O-N 3.27Å
428	S	36.1	Very low	39.9	Very low	81 Å²	81	74.9 Å²	74.9	57%	0.566	40%	0.4	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.6	129.1	166.7	179.7	0	0	0	0	109.6
429	C	30.9	Very low	40.1	Very low	78 Å²	78	75 Å²	75	53%	0.527	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	91.4	176	-163.6	0	0	0	0	108.5	N431 N432 L434	C429-N431 PolarHBondContact O-N 3.36Å; C429-N432 PolarHBondContact N-O 2.98Å; C429-N432 PolarHBondContact O-N 2.94Å; C429-N432 VanDerWaalsContact O-N 3.12Å; C429-L434 HydrophobicContact CB-CD1 3.87Å; C429-L434 HydrophobicContact CB-CG 4.17Å
430	G	43.2	Very low	40.3	Very low	66 Å²	66	78 Å²	78	68%	0.68	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.4	-122.4	-170.6	0	0	0	0	0	111.7
431	N	26.2	Very low	40	Very low	158 Å²	158	70.7 Å²	70.7	85%	0.845	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.5	-5.7	177.8	-67.6	-15.3	0	0	0	113.7	C429	C429-N431 PolarHBondContact O-N 3.36Å
432	N	28.5	Very low	39.9	Very low	70 Å²	70	68.8 Å²	68.8	37%	0.374	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	160.9	-178.4	-69.4	-19.9	0	0	0	111.2	C429	C429-N432 PolarHBondContact N-O 2.98Å; C429-N432 PolarHBondContact O-N 2.94Å; C429-N432 VanDerWaalsContact O-N 3.12Å
433	Y	37.1	Very low	39.8	Very low	102 Å²	102	71.4 Å²	71.4	40%	0.4	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	133.2	167.2	-66.5	-90.4	0	0	0	109	F412 L426 R427	F412-Y433 HydrophobicContact CE1-CD2 4.11Å; F412-Y433 HydrophobicContact CE1-CE2 4.26Å; F412-Y433 HydrophobicContact CE1-CG 4.28Å; F412-Y433 AromaticContact CZ-CD2 3.74Å; F412-Y433 HydrophobicContact CZ-CD2 3.74Å; F412-Y433 HydrophobicContact CZ-CE2 4.11Å; F412-Y433 HydrophobicContact CZ-CG 4.18Å; L426-Y433 HydrophobicContact CD2-CD1 3.68Å; L426-Y433 HydrophobicContact CD2-CE1 4.29Å; L426-Y433 HydrophobicContact CD2-CG 4.21Å; L426-Y433 HydrophobicContact CG-CD1 4.03Å; L426-Y433 HydrophobicContact CG-CG 4.43Å; R427-Y433 CarbonylContact O-C 3.56Å; R427-Y433 VanDerWaalsContact O-CA 3.32Å; R427-Y433 WeakPolarHBondContact O-CA 3.48Å
434	L	37.7	Very low	39.5	Very low	53 Å²	53	71.6 Å²	71.6	28%	0.277	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	136.5	-179.1	-59.1	179	0	0	0	109.9	L426 R427 C429 D651	L426-L434 WeakPolarHBondContact CA-O 3.2Å; R427-L434 PolarHBondContact N-O 3.41Å; R427-L434 PolarHBondContact O-N 3.27Å; C429-L434 HydrophobicContact CB-CD1 3.87Å; C429-L434 HydrophobicContact CB-CG 4.17Å; L434-D651 WeakPolarHBondContact CD2-OD2 3.45Å
435	F	44.7	Very low	39.3	Very low	48 Å²	48	73.5 Å²	73.5	21%	0.211	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	102.6	166.5	-68.9	-72	0	0	0	108.9	W415 A419 Y424 L426	W415-F435 HydrophobicContact CE3-CE2 4.26Å; W415-F435 HydrophobicContact CE3-CZ 4.36Å; A419-F435 HydrophobicContact CB-CD1 3.54Å; A419-F435 HydrophobicContact CB-CE1 3.25Å; A419-F435 HydrophobicContact CB-CZ 4.14Å; Y424-F435 HydrophobicContact CD1-CB 4.19Å; L426-F435 HydrophobicContact CB-CE1 4.41Å; L426-F435 HydrophobicContact CD1-CD1 3.79Å; L426-F435 HydrophobicContact CD1-CD2 4.49Å; L426-F435 HydrophobicContact CD1-CE1 3.37Å; L426-F435 HydrophobicContact CD1-CE2 4.14Å; L426-F435 HydrophobicContact CD1-CG 4.33Å; L426-F435 HydrophobicContact CD1-CZ 3.58Å
436	R	41.8	Very low	39.2	Very low	78 Å²	78	74 Å²	74	29%	0.294	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	138.2	172.4	-158.2	177.9	-162.6	-160.9	4.2	108.4	Y424 Q425 E439	Y424-R436 CarbonylContact C-O 3.56Å; Y424-R436 VanDerWaalsContact CA-O 3.25Å; Y424-R436 WeakPolarHBondContact CA-O 3.5Å; Q425-R436 PolarHBondContact N-O 3.21Å; Q425-R436 PolarHBondContact O-N 3.21Å; R436-E439 IonicContact CZ-OE1 2.72Å; R436-E439 IonicContact CZ-OE2 3.23Å; R436-E439 VanDerWaalsContact NE-CD 3.28Å; R436-E439 IonicContact NE-OE1 3.89Å; R436-E439 PolarHBondContact NE-OE1 2.99Å; R436-E439 IonicContact NE-OE2 3.41Å; R436-E439 PolarHBondContact NE-OE2 3.26Å; R436-E439 IonicContact NH1-OE1 3.78Å; R436-E439 IonicContact NH1-OE2 3.47Å; R436-E439 PolarHBondContact NH1-OE2 3.14Å; R436-E439 IonicContact NH2-OE1 2.88Å; R436-E439 PolarHBondContact NH2-OE1 2.93Å; R436-E439 IonicContact NH2-OE2 2.66Å; R436-E439 PolarHBondContact NH2-OE2 2.89Å
437	P	42.8	Very low	39.5	Very low	25 Å²	25	77 Å²	77	16%	0.162	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-51.8	154.5	163.2	-22.7	32.9	0	0	0	110.3	Y424 E439	Y424-P437 HydrophobicContact CD1-CG 4.26Å; Y424-P437 HydrophobicContact CE1-CB 4.4Å; Y424-P437 HydrophobicContact CE1-CG 3.82Å; P437-E439 VanDerWaalsContact C-N 3.32Å; P437-E439 PolarHBondContact O-N 3.32Å
438	L	46.8	Very low	39.6	Very low	93 Å²	93	75.5 Å²	75.5	49%	0.487	42%	0.42	S	S	.	.			trans	-65.3	96.6	165.4	-91.7	77	0	0	0	109.2	G423 Q425 A444	G423-L438 WeakPolarHBondContact O-CD1 3.41Å; G423-L438 PolarHBondContact O-N 3.09Å; Q425-L438 HydrophobicContact CB-CD1 4.25Å; L438-A444 HydrophobicContact CD2-CB 4.39Å
439	E	42.4	Very low	40	Very low	77 Å²	77	76.6 Å²	76.6	36%	0.36	42%	0.416	S	S	.	.			trans	-75.9	118.5	171.6	-79	177	-152	0	0	110.2	R436 P437	R436-E439 IonicContact CZ-OE1 2.72Å; R436-E439 IonicContact CZ-OE2 3.23Å; R436-E439 VanDerWaalsContact NE-CD 3.28Å; R436-E439 IonicContact NE-OE1 3.89Å; R436-E439 PolarHBondContact NE-OE1 2.99Å; R436-E439 IonicContact NE-OE2 3.41Å; R436-E439 PolarHBondContact NE-OE2 3.26Å; R436-E439 IonicContact NH1-OE1 3.78Å; R436-E439 IonicContact NH1-OE2 3.47Å; R436-E439 PolarHBondContact NH1-OE2 3.14Å; R436-E439 IonicContact NH2-OE1 2.88Å; R436-E439 PolarHBondContact NH2-OE1 2.93Å; R436-E439 IonicContact NH2-OE2 2.66Å; R436-E439 PolarHBondContact NH2-OE2 2.89Å; P437-E439 VanDerWaalsContact C-N 3.32Å; P437-E439 PolarHBondContact O-N 3.32Å
440	S	42.5	Very low	41	Very low	65 Å²	65	80.5 Å²	80.5	46%	0.455	43%	0.427	S	S	.	.			trans	59.1	140.7	-175.6	-163.8	0	0	0	0	116.1	D442	S440-D442 PolarHBondContact O-N 3.04Å; S440-D442 PolarHBondContact OG-N 3.25Å; S440-D442 PolarHBondContact OG-OD2 3.49Å
441	A	34.8	Very low	41.3	Very low	30 Å²	30	83.8 Å²	83.8	25%	0.248	43%	0.429	C	S	.	.	H	α-helix	trans	-53.8	-44.4	159.2	0	0	0	0	0	110.9	D443 A444 F445 V469	A441-D443 PolarHBondContact O-N 3.17Å; A441-A444 PolarHBondContact O-N 3.41Å; A441-F445 HydrophobicContact CB-CD2 3.8Å; A441-F445 HydrophobicContact CB-CE2 3.76Å; A441-F445 WeakPolarHBondContact O-CB 3.4Å; A441-F445 WeakPolarHBondContact O-CD2 3.44Å; A441-F445 WeakPolarHBondContact O-CG 3.4Å; A441-F445 PolarHBondContact O-N 3.38Å; A441-V469 HydrophobicContact CB-CG1 4.29Å
442	D	37.6	Very low	42.2	Very low	59 Å²	59	77.6 Å²	77.6	32%	0.316	40%	0.396	S	S	.	.	H	α-helix	trans	-66.2	-37.4	-168.8	-60	-63.4	0	0	0	113.3	S440 F445 N446 R470	S440-D442 PolarHBondContact O-N 3.04Å; S440-D442 PolarHBondContact OG-N 3.25Å; S440-D442 PolarHBondContact OG-OD2 3.49Å; D442-F445 PolarHBondContact O-N 2.93Å; D442-N446 WeakPolarHBondContact O-CB 3.46Å; D442-N446 PolarHBondContact O-N 3.41Å; D442-N446 PolarHBondContact O-ND2 2.93Å; D442-R470 IonicContact OD1-CZ 3.77Å; D442-R470 IonicContact OD1-NE 2.71Å; D442-R470 IonicContact OD1-NH2 3.7Å; D442-R470 PolarHBondContact OD1-NH2 2.89Å
443	D	40.5	Very low	42.9	Very low	97 Å²	97	80.8 Å²	80.8	52%	0.519	41%	0.413	S	S	.	.	H	α-helix	trans	-69.7	-38.1	179.8	-95.9	14.3	0	0	0	112.2	A441 Q447	A441-D443 PolarHBondContact O-N 3.17Å; D443-Q447 PolarHBondContact O-N 3.48Å
444	A	39.2	Very low	43.5	Very low	39 Å²	39	83.6 Å²	83.6	32%	0.322	44%	0.435	S	S	.	.	H	α-helix	trans	-71.1	-38.3	174.1	0	0	0	0	0	112.2	L438 A441 M448	L438-A444 HydrophobicContact CD2-CB 4.39Å; A441-A444 PolarHBondContact O-N 3.41Å; A444-M448 PolarHBondContact O-N 3.09Å
445	F	42.9	Very low	43.8	Very low	53 Å²	53	84.1 Å²	84.1	23%	0.232	44%	0.439	C	S	.	.	H	α-helix	trans	-77	-33.4	178.6	-68.2	-50.4	0	0	0	113.3	A441 D442 Q447 M448 E449	A441-F445 HydrophobicContact CB-CD2 3.8Å; A441-F445 HydrophobicContact CB-CE2 3.76Å; A441-F445 WeakPolarHBondContact O-CB 3.4Å; A441-F445 WeakPolarHBondContact O-CD2 3.44Å; A441-F445 WeakPolarHBondContact O-CG 3.4Å; A441-F445 PolarHBondContact O-N 3.38Å; D442-F445 PolarHBondContact O-N 2.93Å; F445-Q447 VanDerWaalsContact C-N 3.26Å; F445-Q447 PolarHBondContact O-N 3.24Å; F445-M448 PolarHBondContact O-N 2.94Å; F445-M448 VanDerWaalsContact O-N 3.11Å; F445-E449 WeakPolarHBondContact O-CB 3.22Å; F445-E449 PolarHBondContact O-N 3.41Å
446	N	46.9	Very low	43.9	Very low	92 Å²	92	87.4 Å²	87.4	49%	0.492	46%	0.458	S	S	.	.	H	α-helix	trans	-61.6	-35.8	171.6	-76.3	-33.3	0	0	0	111.5	D442	D442-N446 WeakPolarHBondContact O-CB 3.46Å; D442-N446 PolarHBondContact O-N 3.41Å; D442-N446 PolarHBondContact O-ND2 2.93Å
447	Q	48.2	Very low	44	Very low	123 Å²	123	88.6 Å²	88.6	58%	0.575	47%	0.474	S	S	*	.	H	α-helix	trans	-66.8	-40.9	173.4	-153	84.5	89.3	0	0	111.1	D443 F445	D443-Q447 PolarHBondContact O-N 3.48Å; F445-Q447 VanDerWaalsContact C-N 3.26Å; F445-Q447 PolarHBondContact O-N 3.24Å
448	M	41.8	Very low	44	Very low	99 Å²	99	91.2 Å²	91.2	49%	0.488	49%	0.486	S	S	.	.	H	α-helix	trans	-80	-35	-175.1	-164.4	176.7	-63.7	0	0	113.9	A444 F445 H450 D451 V452	A444-M448 PolarHBondContact O-N 3.09Å; F445-M448 PolarHBondContact O-N 2.94Å; F445-M448 VanDerWaalsContact O-N 3.11Å; M448-H450 PolarHBondContact O-N 3.23Å; M448-D451 PolarHBondContact O-N 3.14Å; M448-V452 WeakPolarHBondContact O-CG2 3.46Å
449	E	43.8	Very low	44	Very low	103 Å²	103	92.3 Å²	92.3	48%	0.481	48%	0.484	S	S	.	.	H	α-helix	trans	-68	-20.4	175.1	-171.9	164.2	-147.4	0	0	111.8	F445	F445-E449 WeakPolarHBondContact O-CB 3.22Å; F445-E449 PolarHBondContact O-N 3.41Å
450	H	51.8	Low	44.4	Very low	160 Å²	160	94.6 Å²	94.6	74%	0.741	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.7	-19.5	174.4	-122	-61.2	0	0	0	114.8	M448	M448-H450 PolarHBondContact O-N 3.23Å
451	D	48.5	Very low	44.4	Very low	136 Å²	136	96.6 Å²	96.6	73%	0.727	50%	0.5	S	S	*	.	S	Bend	trans	-101.6	2.5	-177.8	-77.8	-10.6	0	0	0	112.9	M448	M448-D451 PolarHBondContact O-N 3.14Å
452	V	46.8	Very low	44.8	Very low	27 Å²	27	96.6 Å²	96.6	16%	0.164	50%	0.495	C	S	.	.			trans	-102.4	92.3	177.7	178.1	0	0	0	0	111	M448 L458 R459 L462	M448-V452 WeakPolarHBondContact O-CG2 3.46Å; V452-L458 HydrophobicContact CG1-CB 4.28Å; V452-R459 HydrophobicContact CG1-CG 4.4Å; V452-R459 PolarHBondContact O-NE 3.14Å; V452-R459 PolarHBondContact O-NH2 2.99Å; V452-L462 HydrophobicContact CG2-CD1 4.4Å
453	D	42.4	Very low	45.1	Very low	137 Å²	137	96 Å²	96	73%	0.733	50%	0.496	S	S	*	.			trans	-74.4	142	168.2	-74.9	-42.8	0	0	0	112.1	D455	D453-D455 VanDerWaalsContact C-N 3.27Å; D453-D455 PolarHBondContact O-N 2.97Å
454	D	49	Very low	45.3	Very low	161 Å²	161	94.1 Å²	94.1	86%	0.861	49%	0.493	S	S	*	.	S	Bend	trans	49.5	-18.1	166.9	-67.5	-19.2	0	0	0	122.2	L456	D454-L456 PolarHBondContact O-N 3.25Å; D454-L456 VanDerWaalsContact O-N 3.07Å
455	D	44.8	Very low	45.4	Very low	64 Å²	64	96 Å²	96	34%	0.342	50%	0.498	S	S	.	.			trans	-80.5	95.4	178.5	-169.2	-19.2	0	0	0	112.8	D453 T457 L458 R459	D453-D455 VanDerWaalsContact C-N 3.27Å; D453-D455 PolarHBondContact O-N 2.97Å; D455-T457 PolarHBondContact O-N 3.27Å; D455-T457 VanDerWaalsContact OD1-CA 3.3Å; D455-T457 WeakPolarHBondContact OD1-CA 3.43Å; D455-T457 WeakPolarHBondContact OD1-CB 3.5Å; D455-T457 PolarHBondContact OD1-N 3.43Å; D455-T457 PolarHBondContact OD1-OG1 3.44Å; D455-L458 HydrophobicContact CB-CB 4.01Å; D455-L458 HydrophobicContact CB-CD1 4.03Å; D455-L458 HydrophobicContact CB-CG 4.32Å; D455-L458 PolarHBondContact O-N 3.43Å; D455-L458 PolarHBondContact OD1-N 2.84Å; D455-L458 WeakPolarHBondContact OD2-CD1 3.47Å; D455-R459 PolarHBondContact O-N 3.46Å; D455-R459 VanDerWaalsContact O-N 3.14Å
456	L	46.4	Very low	45.3	Very low	118 Å²	118	94.7 Å²	94.7	62%	0.618	49%	0.492	S	S	*	.	H	α-helix	trans	-58.8	-32.5	175	-172.9	67.7	0	0	0	113.2	D454 Q460	D454-L456 PolarHBondContact O-N 3.25Å; D454-L456 VanDerWaalsContact O-N 3.07Å; L456-Q460 WeakPolarHBondContact O-CG 3.47Å; L456-Q460 PolarHBondContact O-N 3.01Å
457	T	44.2	Very low	45.1	Very low	103 Å²	103	96.4 Å²	96.4	63%	0.632	50%	0.495	S	S	*	.	H	α-helix	trans	-70.7	-44.2	179.6	-4.3	0	0	0	0	111	D455 Q460 L461	D455-T457 PolarHBondContact O-N 3.27Å; D455-T457 VanDerWaalsContact OD1-CA 3.3Å; D455-T457 WeakPolarHBondContact OD1-CA 3.43Å; D455-T457 WeakPolarHBondContact OD1-CB 3.5Å; D455-T457 PolarHBondContact OD1-N 3.43Å; D455-T457 PolarHBondContact OD1-OG1 3.44Å; T457-Q460 PolarHBondContact O-N 2.95Å; T457-L461 PolarHBondContact O-N 3.36Å
458	L	42.5	Very low	44.6	Very low	80 Å²	80	94.4 Å²	94.4	42%	0.419	49%	0.486	S	S	.	.	H	α-helix	trans	-60.7	-43.2	172.3	-88.1	172	0	0	0	111.6	V452 D455 Q460 L461 L462	V452-L458 HydrophobicContact CG1-CB 4.28Å; D455-L458 HydrophobicContact CB-CB 4.01Å; D455-L458 HydrophobicContact CB-CD1 4.03Å; D455-L458 HydrophobicContact CB-CG 4.32Å; D455-L458 PolarHBondContact O-N 3.43Å; D455-L458 PolarHBondContact OD1-N 2.84Å; D455-L458 WeakPolarHBondContact OD2-CD1 3.47Å; L458-Q460 VanDerWaalsContact C-N 3.34Å; L458-Q460 PolarHBondContact O-N 3.16Å; L458-L461 PolarHBondContact O-N 3.43Å; L458-L462 WeakPolarHBondContact O-CB 3.34Å; L458-L462 PolarHBondContact O-N 3.15Å
459	R	46.9	Very low	44.3	Very low	115 Å²	115	91.9 Å²	91.9	43%	0.434	48%	0.476	S	S	.	.	H	α-helix	trans	-62.2	-37.8	175.7	-71.2	-172.8	178.8	-159.3	-0.4	113	V452 D455 S463	V452-R459 HydrophobicContact CG1-CG 4.4Å; V452-R459 PolarHBondContact O-NE 3.14Å; V452-R459 PolarHBondContact O-NH2 2.99Å; D455-R459 PolarHBondContact O-N 3.46Å; D455-R459 VanDerWaalsContact O-N 3.14Å; R459-S463 WeakPolarHBondContact O-CB 3.37Å; R459-S463 PolarHBondContact O-N 3.38Å
460	Q	50.2	Low	43.9	Very low	125 Å²	125	93 Å²	93	58%	0.584	48%	0.476	S	S	*	.	H	α-helix	trans	-67.5	-40.5	174.2	-73	179.8	24.5	0	0	112.3	L456 T457 L458 S463 A464	L456-Q460 WeakPolarHBondContact O-CG 3.47Å; L456-Q460 PolarHBondContact O-N 3.01Å; T457-Q460 PolarHBondContact O-N 2.95Å; L458-Q460 VanDerWaalsContact C-N 3.34Å; L458-Q460 PolarHBondContact O-N 3.16Å; Q460-S463 PolarHBondContact O-N 2.66Å; Q460-A464 PolarHBondContact O-N 2.85Å
461	L	43.8	Very low	43.2	Very low	108 Å²	108	93 Å²	93	57%	0.565	47%	0.47	S	S	*	.	H	α-helix	trans	-65.3	-46.5	176.8	-163.5	76.2	0	0	0	111.6	T457 L458 S463 A464 I465	T457-L461 PolarHBondContact O-N 3.36Å; L458-L461 PolarHBondContact O-N 3.43Å; L461-S463 PolarHBondContact O-N 3.47Å; L461-A464 WeakPolarHBondContact O-CB 3.39Å; L461-A464 PolarHBondContact O-N 2.78Å; L461-I465 HydrophobicContact CG-CD1 4.23Å; L461-I465 WeakPolarHBondContact O-CG1 3.43Å; L461-I465 PolarHBondContact O-N 3.08Å
462	L	42.6	Very low	42.6	Very low	29 Å²	29	91.2 Å²	91.2	15%	0.152	46%	0.463	C	S	.	.	H	α-helix	trans	-56.9	-47.5	172	-85.6	159.1	0	0	0	111.2	V452 L458 A464 I465 I466	V452-L462 HydrophobicContact CG2-CD1 4.4Å; L458-L462 WeakPolarHBondContact O-CB 3.34Å; L458-L462 PolarHBondContact O-N 3.15Å; L462-A464 VanDerWaalsContact C-N 3.27Å; L462-A464 PolarHBondContact O-N 3.18Å; L462-I465 PolarHBondContact O-N 3.19Å; L462-I465 VanDerWaalsContact O-N 3.15Å; L462-I466 WeakPolarHBondContact O-CB 3.44Å; L462-I466 WeakPolarHBondContact O-CD1 3.31Å; L462-I466 VanDerWaalsContact O-CG1 3.23Å; L462-I466 WeakPolarHBondContact O-CG1 3.49Å; L462-I466 PolarHBondContact O-N 2.9Å
463	S	44.5	Very low	42.1	Very low	48 Å²	48	95 Å²	95	34%	0.336	48%	0.482	S	S	.	.	H	α-helix	trans	-59.6	-35.4	176.7	-168.6	0	0	0	0	112.9	R459 Q460 L461 K467	R459-S463 WeakPolarHBondContact O-CB 3.37Å; R459-S463 PolarHBondContact O-N 3.38Å; Q460-S463 PolarHBondContact O-N 2.66Å; L461-S463 PolarHBondContact O-N 3.47Å; S463-K467 WeakPolarHBondContact O-CB 3.49Å; S463-K467 WeakPolarHBondContact O-CD 3.49Å; S463-K467 VanDerWaalsContact O-CG 3.25Å; S463-K467 WeakPolarHBondContact O-CG 3.44Å; S463-K467 PolarHBondContact O-N 2.81Å; S463-K467 VanDerWaalsContact O-N 3.12Å; S463-K467 PolarHBondContact OG-NZ 3.45Å; S463-K467 VanDerWaalsContact OG-NZ 3.08Å
464	A	44.5	Very low	41.7	Very low	56 Å²	56	94.5 Å²	94.5	46%	0.463	48%	0.48	S	S	.	.	H	α-helix	trans	-70.5	-42.5	175.1	0	0	0	0	0	112.1	Q460 L461 L462 K467 Q468	Q460-A464 PolarHBondContact O-N 2.85Å; L461-A464 WeakPolarHBondContact O-CB 3.39Å; L461-A464 PolarHBondContact O-N 2.78Å; L462-A464 VanDerWaalsContact C-N 3.27Å; L462-A464 PolarHBondContact O-N 3.18Å; A464-K467 PolarHBondContact O-N 2.99Å; A464-Q468 PolarHBondContact O-N 3.14Å; A464-Q468 VanDerWaalsContact O-N 3.1Å
465	I	41	Very low	40.8	Very low	80 Å²	80	92.6 Å²	92.6	41%	0.41	47%	0.469	S	S	.	.	H	α-helix	trans	-63.7	-47.5	175.9	-67.3	164.1	0	0	0	110.5	L461 L462 K467 Q468 V469	L461-I465 HydrophobicContact CG-CD1 4.23Å; L461-I465 WeakPolarHBondContact O-CG1 3.43Å; L461-I465 PolarHBondContact O-N 3.08Å; L462-I465 PolarHBondContact O-N 3.19Å; L462-I465 VanDerWaalsContact O-N 3.15Å; I465-K467 VanDerWaalsContact C-N 3.3Å; I465-K467 PolarHBondContact O-N 2.84Å; I465-Q468 CarbonylContact O-C 3.3Å; I465-Q468 WeakPolarHBondContact O-CA 3.45Å; I465-Q468 PolarHBondContact O-N 3.34Å; I465-V469 HydrophobicContact CG2-CG2 4.2Å; I465-V469 WeakPolarHBondContact O-CG2 3.27Å; I465-V469 PolarHBondContact O-N 3.32Å
466	I	40	Very low	40.1	Very low	24 Å²	24	97.5 Å²	97.5	12%	0.123	50%	0.495	C	S	.	.	H	α-helix	trans	-56.3	-43.1	175.9	-69.9	163.2	0	0	0	111	L462 Q468 R470	L462-I466 WeakPolarHBondContact O-CB 3.44Å; L462-I466 WeakPolarHBondContact O-CD1 3.31Å; L462-I466 VanDerWaalsContact O-CG1 3.23Å; L462-I466 WeakPolarHBondContact O-CG1 3.49Å; L462-I466 PolarHBondContact O-N 2.9Å; I466-Q468 VanDerWaalsContact C-N 3.27Å; I466-Q468 PolarHBondContact O-N 2.64Å; I466-R470 VanDerWaalsContact O-CB 3.3Å; I466-R470 WeakPolarHBondContact O-CB 3.44Å; I466-R470 WeakPolarHBondContact O-CG 3.33Å; I466-R470 PolarHBondContact O-N 2.89Å
467	K	44.5	Very low	39.4	Very low	128 Å²	128	97.9 Å²	97.9	56%	0.557	50%	0.502	S	S	*	.	H	α-helix	trans	-66.8	-24.4	175.3	-76.8	165.6	-176.4	146.3	0	113.7	S463 A464 I465 R471	S463-K467 WeakPolarHBondContact O-CB 3.49Å; S463-K467 WeakPolarHBondContact O-CD 3.49Å; S463-K467 VanDerWaalsContact O-CG 3.25Å; S463-K467 WeakPolarHBondContact O-CG 3.44Å; S463-K467 PolarHBondContact O-N 2.81Å; S463-K467 VanDerWaalsContact O-N 3.12Å; S463-K467 PolarHBondContact OG-NZ 3.45Å; S463-K467 VanDerWaalsContact OG-NZ 3.08Å; A464-K467 PolarHBondContact O-N 2.99Å; I465-K467 VanDerWaalsContact C-N 3.3Å; I465-K467 PolarHBondContact O-N 2.84Å; K467-R471 WeakPolarHBondContact O-CD 3.46Å; K467-R471 WeakPolarHBondContact O-CG 3.48Å
468	Q	37.7	Very low	38.6	Very low	82 Å²	82	98 Å²	98	38%	0.383	51%	0.505	S	S	.	.	H	α-helix	trans	-87.6	-41.1	178.5	-158.3	74.9	-24.2	0	0	111.7	A464 I465 I466 R471	A464-Q468 PolarHBondContact O-N 3.14Å; A464-Q468 VanDerWaalsContact O-N 3.1Å; I465-Q468 CarbonylContact O-C 3.3Å; I465-Q468 WeakPolarHBondContact O-CA 3.45Å; I465-Q468 PolarHBondContact O-N 3.34Å; I466-Q468 VanDerWaalsContact C-N 3.27Å; I466-Q468 PolarHBondContact O-N 2.64Å; Q468-R471 WeakPolarHBondContact O-CB 3.46Å; Q468-R471 PolarHBondContact O-N 2.99Å; Q468-R471 VanDerWaalsContact O-N 3.14Å
469	V	35	Very low	38	Very low	46 Å²	46	102.8 Å²	102.8	28%	0.279	53%	0.525	S	S	.	.	H	α-helix	trans	-61.9	-47.8	172.9	173.5	0	0	0	0	110.3	A441 I465 R471 V472 D473	A441-V469 HydrophobicContact CB-CG1 4.29Å; I465-V469 HydrophobicContact CG2-CG2 4.2Å; I465-V469 WeakPolarHBondContact O-CG2 3.27Å; I465-V469 PolarHBondContact O-N 3.32Å; V469-R471 PolarHBondContact O-N 2.78Å; V469-V472 WeakPolarHBondContact O-CB 3.29Å; V469-V472 PolarHBondContact O-N 3.07Å; V469-D473 VanDerWaalsContact CG1-OD2 3.25Å; V469-D473 WeakPolarHBondContact CG1-OD2 3.44Å; V469-D473 PolarHBondContact O-N 3.15Å; V469-D473 VanDerWaalsContact O-N 3.1Å
470	R	34.3	Very low	37.4	Very low	125 Å²	125	100.8 Å²	100.8	47%	0.472	53%	0.527	S	S	.	.	H	α-helix	trans	-62.1	-11.9	175	-71.3	-179.5	178.6	161.3	3.8	114.5	D442 I466 N474	D442-R470 IonicContact OD1-CZ 3.77Å; D442-R470 IonicContact OD1-NE 2.71Å; D442-R470 IonicContact OD1-NH2 3.7Å; D442-R470 PolarHBondContact OD1-NH2 2.89Å; I466-R470 VanDerWaalsContact O-CB 3.3Å; I466-R470 WeakPolarHBondContact O-CB 3.44Å; I466-R470 WeakPolarHBondContact O-CG 3.33Å; I466-R470 PolarHBondContact O-N 2.89Å; R470-N474 WeakPolarHBondContact O-CB 3.47Å; R470-N474 PolarHBondContact O-N 3.12Å; R470-N474 PolarHBondContact O-ND2 3.3Å
471	R	36.8	Very low	36.6	Very low	162 Å²	162	103.7 Å²	103.7	61%	0.611	54%	0.541	S	S	*	.	H	α-helix	trans	-85.2	-19.9	169.8	-76	166.1	172.5	165.5	-5	113.6	K467 Q468 V469	K467-R471 WeakPolarHBondContact O-CD 3.46Å; K467-R471 WeakPolarHBondContact O-CG 3.48Å; Q468-R471 WeakPolarHBondContact O-CB 3.46Å; Q468-R471 PolarHBondContact O-N 2.99Å; Q468-R471 VanDerWaalsContact O-N 3.14Å; V469-R471 PolarHBondContact O-N 2.78Å
472	V	37.1	Very low	36.5	Very low	98 Å²	98	102.4 Å²	102.4	59%	0.594	54%	0.541	S	S	*	.	H	α-helix	trans	-85.8	-43.7	174.6	-176.7	0	0	0	0	109.6	V469 L475	V469-V472 WeakPolarHBondContact O-CB 3.29Å; V469-V472 PolarHBondContact O-N 3.07Å; V472-L475 PolarHBondContact O-N 2.73Å
473	D	36	Very low	36.5	Very low	105 Å²	105	105.1 Å²	105.1	56%	0.561	56%	0.561	S	S	*	*	H	α-helix	trans	-78.8	-16.9	-177.1	-58.6	-38.9	0	0	0	114.4	V469 L475	V469-D473 VanDerWaalsContact CG1-OD2 3.25Å; V469-D473 WeakPolarHBondContact CG1-OD2 3.44Å; V469-D473 PolarHBondContact O-N 3.15Å; V469-D473 VanDerWaalsContact O-N 3.1Å; D473-L475 VanDerWaalsContact C-N 3.29Å
474	N	34.1	Very low	36.6	Very low	128 Å²	128	103.8 Å²	103.8	68%	0.684	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93	25.8	171.7	-74.6	-89.3	0	0	0	113	R470	R470-N474 WeakPolarHBondContact O-CB 3.47Å; R470-N474 PolarHBondContact O-N 3.12Å; R470-N474 PolarHBondContact O-ND2 3.3Å
475	L	30.8	Very low	36.3	Very low	121 Å²	121	103.9 Å²	103.9	63%	0.634	56%	0.555	S	S	*	*	S	Bend	trans	-78.8	116.8	152.2	-75.6	166.2	0	0	0	107	V472 D473 V477	V472-L475 PolarHBondContact O-N 2.73Å; D473-L475 VanDerWaalsContact C-N 3.29Å; L475-V477 VanDerWaalsContact C-N 3.27Å; L475-V477 PolarHBondContact O-N 2.89Å
476	D	29.7	Very low	36.2	Very low	166 Å²	166	111.5 Å²	111.5	89%	0.888	58%	0.579	S	S	*	*			trans	-59	90.7	169.3	-81.5	-56.7	0	0	0	109.2	P478	D476-P478 WeakPolarHBondContact O-CD 3.19Å
477	V	31.1	Very low	36.1	Very low	126 Å²	126	117.4 Å²	117.4	76%	0.764	61%	0.608	S	S	*	*			trans	-71.7	111.1	167.4	179.5	0	0	0	0	105.9	L475 Q479	L475-V477 VanDerWaalsContact C-N 3.27Å; L475-V477 PolarHBondContact O-N 2.89Å; V477-Q479 PolarHBondContact O-N 2.69Å
478	P	27.5	Very low	36.3	Very low	107 Å²	107	117.6 Å²	117.6	70%	0.695	62%	0.615	S	S	*	*			trans	-61.8	136.9	177	-16.7	31.6	0	0	0	108	D476	D476-P478 WeakPolarHBondContact O-CD 3.19Å
479	Q	30.8	Very low	36.9	Very low	179 Å²	179	118 Å²	118	84%	0.836	62%	0.617	S	S	*	*			trans	-56.7	132.3	162.9	-75.3	-157.2	-30.2	0	0	107.8	V477 E481	V477-Q479 PolarHBondContact O-N 2.69Å; Q479-E481 PolarHBondContact O-N 2.66Å
480	P	34.3	Very low	37.7	Very low	74 Å²	74	123.1 Å²	123.1	48%	0.481	64%	0.643	S	S	.	*			trans	-62.9	114.3	179.4	25.1	-32.4	0	0	0	108.6	S482 E677	P480-S482 PolarHBondContact O-N 3.49Å; P480-E677 HydrophobicContact CB-CG 4.3Å; P480-E677 HydrophobicContact CG-CG 4.03Å
481	E	33.5	Very low	38.7	Very low	185 Å²	185	123.1 Å²	123.1	86%	0.864	65%	0.646	S	S	*	*			trans	-58.4	117.7	170.9	-73	-165	161.8	0	0	108	Q479 C483	Q479-E481 PolarHBondContact O-N 2.66Å; E481-C483 PolarHBondContact O-N 3.23Å
482	S	41.1	Very low	39.4	Very low	82 Å²	82	116.2 Å²	116.2	57%	0.573	62%	0.62	S	S	*	*			trans	-55.7	110.6	-159.3	61	0	0	0	0	112.5	P480 F484 G485	P480-S482 PolarHBondContact O-N 3.49Å; S482-F484 PolarHBondContact O-N 3.12Å; S482-G485 PolarHBondContact O-N 3.47Å; S482-G485 VanDerWaalsContact O-N 3.07Å
483	C	42.2	Very low	40.4	Very low	85 Å²	85	113.8 Å²	113.8	57%	0.574	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62	-13.8	-179	-75	0	0	0	0	113.5	E481 G485	E481-C483 PolarHBondContact O-N 3.23Å; C483-G485 VanDerWaalsContact C-N 3.3Å; C483-G485 PolarHBondContact O-N 2.92Å
484	F	45.7	Very low	41.2	Very low	21 Å²	21	112.8 Å²	112.8	9%	0.092	60%	0.602	C	S	.	*	T	Hydrogen-bonded Turn	trans	-71.4	-15.7	175.2	-62.6	-77.1	0	0	0	114.6	S482 R486 W492 A636 V640	S482-F484 PolarHBondContact O-N 3.12Å; F484-R486 PolarHBondContact O-N 3.48Å; F484-W492 HydrophobicContact CD1-CD2 4.21Å; F484-W492 AromaticContact CD1-CE2 3.76Å; F484-W492 HydrophobicContact CD1-CH2 4.46Å; F484-W492 AromaticContact CD1-CZ2 3.9Å; F484-W492 HydrophobicContact CD1-CZ2 3.9Å; F484-W492 AromaticContact CD1-NE1 3.99Å; F484-W492 HydrophobicContact CE1-CD2 4.13Å; F484-W492 HydrophobicContact CE1-CE3 4.28Å; F484-W492 HydrophobicContact CE1-CH2 4.17Å; F484-W492 HydrophobicContact CE1-CZ2 4.06Å; F484-W492 HydrophobicContact CE1-CZ3 4.29Å; F484-A636 HydrophobicContact CD1-CB 3.61Å; F484-A636 HydrophobicContact CE1-CB 4.1Å; F484-A636 HydrophobicContact CG-CB 4.26Å; F484-V640 HydrophobicContact CD2-CG2 4.28Å; F484-V640 HydrophobicContact CE2-CG2 3.87Å; F484-V640 HydrophobicContact CZ-CG2 4.3Å
485	G	39.3	Very low	41.6	Very low	57 Å²	57	108.7 Å²	108.7	59%	0.588	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.2	13.1	-164.1	0	0	0	0	0	118.8	S482 C483	S482-G485 PolarHBondContact O-N 3.47Å; S482-G485 VanDerWaalsContact O-N 3.07Å; C483-G485 VanDerWaalsContact C-N 3.3Å; C483-G485 PolarHBondContact O-N 2.92Å
486	R	39	Very low	42	Very low	241 Å²	241	110 Å²	110	91%	0.909	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-159.2	13.6	-173.8	-120.2	171.4	-147	-115.7	3.7	119.9	F484	F484-R486 PolarHBondContact O-N 3.48Å
487	M	38.2	Very low	42.4	Very low	148 Å²	148	107.2 Å²	107.2	73%	0.729	58%	0.581	S	S	*	*	S	Bend	trans	-137.2	154	179.3	-69.6	-171.8	176.5	0	0	113
488	D	47.7	Very low	42.7	Very low	132 Å²	132	106.6 Å²	106.6	71%	0.706	58%	0.581	S	S	*	*			trans	-58.8	139.5	-163.1	-59.4	-60.1	0	0	0	115.2	D490 F491	D488-D490 PolarHBondContact O-N 2.99Å; D488-D490 VanDerWaalsContact O-N 3.16Å; D488-F491 VanDerWaalsContact O-CB 3.32Å; D488-F491 WeakPolarHBondContact O-CB 3.22Å; D488-F491 PolarHBondContact O-N 3.42Å
489	E	49.8	Very low	42.9	Very low	91 Å²	91	105.1 Å²	105.1	43%	0.425	57%	0.573	S	S	.	*	H	α-helix	trans	-53	-35	176.8	-74.6	-88.4	108.3	0	0	113.6	F491 W492 N493 S635 A636	E489-F491 PolarHBondContact O-N 3.48Å; E489-W492 PolarHBondContact O-N 3.03Å; E489-N493 PolarHBondContact O-N 3.23Å; E489-S635 WeakPolarHBondContact OE1-CA 3.28Å; E489-S635 WeakPolarHBondContact OE1-CB 3.27Å; E489-S635 WeakPolarHBondContact OE2-CA 3.24Å; E489-S635 WeakPolarHBondContact OE2-CB 3.12Å; E489-A636 PolarHBondContact OE1-N 3.22Å
490	D	53.4	Low	43.2	Very low	153 Å²	153	102.3 Å²	102.3	82%	0.818	56%	0.558	S	S	*	*	H	α-helix	trans	-66.4	-21.1	179	-72.7	-19.6	0	0	0	113.2	D488	D488-D490 PolarHBondContact O-N 2.99Å; D488-D490 VanDerWaalsContact O-N 3.16Å
491	F	53.6	Low	43.5	Very low	124 Å²	124	100.4 Å²	100.4	54%	0.544	55%	0.547	S	S	.	.	H	α-helix	trans	-74.7	-34	177.9	178.7	-104.3	0	0	0	112.2	D488 E489	D488-F491 VanDerWaalsContact O-CB 3.32Å; D488-F491 WeakPolarHBondContact O-CB 3.22Å; D488-F491 PolarHBondContact O-N 3.42Å; E489-F491 PolarHBondContact O-N 3.48Å
492	W	52.3	Low	43.9	Very low	17 Å²	17	95.3 Å²	95.3	6%	0.064	52%	0.522	C	S	.	.	H	α-helix	trans	-89.3	-26.9	-173.2	-61.4	118.6	0	0	0	113.6	F484 E489 A636 L666 A667 A670	F484-W492 HydrophobicContact CD1-CD2 4.21Å; F484-W492 AromaticContact CD1-CE2 3.76Å; F484-W492 HydrophobicContact CD1-CH2 4.46Å; F484-W492 AromaticContact CD1-CZ2 3.9Å; F484-W492 HydrophobicContact CD1-CZ2 3.9Å; F484-W492 AromaticContact CD1-NE1 3.99Å; F484-W492 HydrophobicContact CE1-CD2 4.13Å; F484-W492 HydrophobicContact CE1-CE3 4.28Å; F484-W492 HydrophobicContact CE1-CH2 4.17Å; F484-W492 HydrophobicContact CE1-CZ2 4.06Å; F484-W492 HydrophobicContact CE1-CZ3 4.29Å; E489-W492 PolarHBondContact O-N 3.03Å; W492-A636 HydrophobicContact CB-CB 4.37Å; W492-A636 HydrophobicContact CG-CB 4.25Å; W492-L666 CarbonylContact O-C 3.45Å; W492-L666 WeakPolarHBondContact O-CA 3.34Å; W492-A667 PolarHBondContact O-N 3.05Å; W492-A670 HydrophobicContact CE3-CB 3.38Å; W492-A670 HydrophobicContact CZ3-CB 3.64Å
493	N	59	Low	44.1	Very low	47 Å²	47	94.2 Å²	94.2	25%	0.251	51%	0.51	S	S	.	.	B	Isolated β-bridge	trans	-102.3	111.3	-172.3	-79.9	-45.5	0	0	0	112.6	E489 R634 K639	E489-N493 PolarHBondContact O-N 3.23Å; N493-R634 PolarHBondContact ND2-O 2.74Å; N493-R634 PolarHBondContact OD1-O 2.91Å; N493-K639 PolarHBondContact OD1-NZ 3.12Å
494	T	51	Low	44.2	Very low	84 Å²	84	93.7 Å²	93.7	52%	0.515	50%	0.501	S	S	.	.			trans	-88.5	-11	177.4	51.9	0	0	0	0	114	T496 T665 L666 A667	T494-T496 PolarHBondContact O-N 3.4Å; T494-T665 PolarHBondContact N-O 3.42Å; T494-L666 PolarHBondContact OG1-O 3.47Å; T494-A667 HydrophobicContact CG2-CB 3.87Å
495	S	42.9	Very low	44.1	Very low	42 Å²	42	99.1 Å²	99.1	29%	0.294	53%	0.527	S	S	.	.			trans	-85.8	108	-171.6	-108.6	0	0	0	0	113.3	I497 G664	S495-I497 PolarHBondContact O-N 2.95Å; S495-I497 WeakPolarHBondContact OG-CG1 3.28Å; S495-G664 PolarHBondContact OG-O 3.44Å
496	T	40.4	Very low	44.3	Very low	149 Å²	149	100.8 Å²	100.8	91%	0.914	52%	0.519	S	S	*	.			trans	-78.8	8.3	152.6	51.3	0	0	0	0	112.4	T494 S498	T494-T496 PolarHBondContact O-N 3.4Å; T496-S498 PolarHBondContact O-N 2.93Å
497	I	38	Very low	44.6	Very low	108 Å²	108	91.4 Å²	91.4	55%	0.554	49%	0.493	S	S	*	.			trans	-76	120.1	-175.2	-57.9	-179.3	0	0	0	110	S495 C499	S495-I497 PolarHBondContact O-N 2.95Å; S495-I497 WeakPolarHBondContact OG-CG1 3.28Å; I497-C499 PolarHBondContact O-N 2.91Å; I497-C499 VanDerWaalsContact O-N 3.07Å
498	S	35.9	Very low	44.9	Very low	112 Å²	112	90.3 Å²	90.3	78%	0.783	49%	0.486	S	S	*	.			trans	-70.2	100.8	169.9	56.2	0	0	0	0	110.7	T496	T496-S498 PolarHBondContact O-N 2.93Å
499	C	33.4	Very low	44.7	Very low	76 Å²	76	87 Å²	87	51%	0.514	47%	0.471	S	S	.	.			trans	45.1	83.7	160.9	-62.5	0	0	0	0	115.4	I497 S501 C631	I497-C499 PolarHBondContact O-N 2.91Å; I497-C499 VanDerWaalsContact O-N 3.07Å; C499-S501 PolarHBondContact O-N 2.9Å; C499-C631 VanDerWaalsContact CB-SG 3.56Å
500	F	35.3	Very low	44.6	Very low	120 Å²	120	85.1 Å²	85.1	53%	0.526	47%	0.471	S	S	.	.			trans	-60.6	120.5	169.2	-177.2	-92.9	0	0	0	110.5	F502	F500-F502 HydrophobicContact CD1-CD2 4.43Å; F500-F502 AromaticContact CE1-CD2 3.77Å; F500-F502 HydrophobicContact CE1-CD2 3.77Å; F500-F502 AromaticContact CE1-CE2 3.86Å; F500-F502 HydrophobicContact CE1-CE2 3.86Å; F500-F502 HydrophobicContact CE1-CG 4.39Å
501	S	41.8	Very low	44.7	Very low	35 Å²	35	85.8 Å²	85.8	25%	0.245	46%	0.462	C	S	.	.			trans	-110	136.5	170	179.8	0	0	0	0	109.5	C499 D503 Y610	C499-S501 PolarHBondContact O-N 2.9Å; S501-D503 PolarHBondContact O-N 3.39Å; S501-D503 PolarHBondContact OG-N 3.33Å; S501-Y610 PolarHBondContact OG-OH 2.83Å
502	F	42.3	Very low	44.5	Very low	77 Å²	77	83.2 Å²	83.2	34%	0.338	46%	0.456	S	S	.	.	S	Bend	trans	-65.7	-28.4	172.9	-101.8	-94.5	0	0	0	112.1	F500 D504 Y628	F500-F502 HydrophobicContact CD1-CD2 4.43Å; F500-F502 AromaticContact CE1-CD2 3.77Å; F500-F502 HydrophobicContact CE1-CD2 3.77Å; F500-F502 AromaticContact CE1-CE2 3.86Å; F500-F502 HydrophobicContact CE1-CE2 3.86Å; F500-F502 HydrophobicContact CE1-CG 4.39Å; F502-D504 VanDerWaalsContact C-N 3.32Å; F502-D504 PolarHBondContact O-N 3.23Å; F502-Y628 HydrophobicContact CD2-CE2 4.23Å; F502-Y628 WeakPolarHBondContact CD2-OH 3.27Å; F502-Y628 WeakPolarHBondContact CE2-OH 3.37Å
503	D	45.1	Very low	44.5	Very low	60 Å²	60	86.9 Å²	86.9	32%	0.321	48%	0.476	S	S	.	.			trans	-92.1	49.8	-179.4	-82.5	-28.2	0	0	0	113	S501 Q505 H506	S501-D503 PolarHBondContact O-N 3.39Å; S501-D503 PolarHBondContact OG-N 3.33Å; D503-Q505 PolarHBondContact O-N 3.27Å; D503-H506 WeakPolarHBondContact O-CB 3.36Å; D503-H506 PolarHBondContact O-N 3.23Å
504	D	44.8	Very low	44.6	Very low	74 Å²	74	91 Å²	91	40%	0.396	49%	0.494	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-16.5	175.9	-152.3	37.4	0	0	0	112.7	R254 F502 H506 A507	R254-D504 IonicContact CZ-OD2 2.68Å; R254-D504 IonicContact NH1-OD2 2.55Å; R254-D504 PolarHBondContact NH1-OD2 3.43Å; R254-D504 IonicContact NH2-OD2 3.43Å; R254-D504 PolarHBondContact NH2-OD2 3.04Å; F502-D504 VanDerWaalsContact C-N 3.32Å; F502-D504 PolarHBondContact O-N 3.23Å; D504-H506 PolarHBondContact O-N 2.97Å; D504-A507 WeakPolarHBondContact O-CB 3.07Å; D504-A507 PolarHBondContact O-N 3.5Å; D504-A507 VanDerWaalsContact O-N 3.13Å
505	Q	41.6	Very low	45.1	Very low	134 Å²	134	92.8 Å²	92.8	63%	0.626	50%	0.496	S	S	*	.	H	α-helix	trans	-61.4	-26.2	168.7	-63.5	-173.8	52.5	0	0	113.2	D503 A507 E508 T509	D503-Q505 PolarHBondContact O-N 3.27Å; Q505-A507 VanDerWaalsContact C-N 3.28Å; Q505-A507 PolarHBondContact O-N 2.92Å; Q505-E508 PolarHBondContact O-N 2.85Å; Q505-T509 PolarHBondContact O-N 3.01Å; Q505-T509 PolarHBondContact O-OG1 3.23Å
506	H	44.7	Very low	45.5	Very low	93 Å²	93	95.5 Å²	95.5	43%	0.431	51%	0.507	S	S	.	.	H	α-helix	trans	-68.5	-25.5	174.4	-90.4	-55.8	0	0	0	112.6	D503 D504 T509 A510 R609	D503-H506 WeakPolarHBondContact O-CB 3.36Å; D503-H506 PolarHBondContact O-N 3.23Å; D504-H506 PolarHBondContact O-N 2.97Å; H506-T509 WeakPolarHBondContact CA-OG1 3.44Å; H506-T509 PolarHBondContact O-OG1 2.9Å; H506-A510 WeakPolarHBondContact O-CB 3.33Å; H506-A510 PolarHBondContact O-N 3.1Å; H506-R609 PolarHBondContact NE2-NH1 3.23Å
507	A	44.7	Very low	45.9	Very low	43 Å²	43	89.4 Å²	89.4	36%	0.355	47%	0.474	S	S	.	.	H	α-helix	trans	-74.7	-36.2	174.9	0	0	0	0	0	112.7	D504 Q505 R511	D504-A507 WeakPolarHBondContact O-CB 3.07Å; D504-A507 PolarHBondContact O-N 3.5Å; D504-A507 VanDerWaalsContact O-N 3.13Å; Q505-A507 VanDerWaalsContact C-N 3.28Å; Q505-A507 PolarHBondContact O-N 2.92Å; A507-R511 WeakPolarHBondContact O-CG 3.39Å; A507-R511 PolarHBondContact O-N 3.4Å
508	E	43.9	Very low	47.3	Very low	126 Å²	126	89.2 Å²	89.2	59%	0.589	47%	0.474	S	S	*	.	H	α-helix	trans	-77.2	-35.9	175.9	-66	-170.1	145.7	0	0	112.4	Q505 T512	Q505-E508 PolarHBondContact O-N 2.85Å; E508-T512 PolarHBondContact O-N 3.36Å; E508-T512 VanDerWaalsContact O-N 3.16Å; E508-T512 PolarHBondContact O-OG1 3.47Å
509	T	44.1	Very low	48.1	Very low	63 Å²	63	91.3 Å²	91.3	39%	0.387	47%	0.465	S	S	.	.	H	α-helix	trans	-70.4	-39.4	173.2	49.1	0	0	0	0	112.5	Q505 H506 R511 T512 I513	Q505-T509 PolarHBondContact O-N 3.01Å; Q505-T509 PolarHBondContact O-OG1 3.23Å; H506-T509 WeakPolarHBondContact CA-OG1 3.44Å; H506-T509 PolarHBondContact O-OG1 2.9Å; T509-R511 PolarHBondContact O-N 3.04Å; T509-T512 WeakPolarHBondContact CA-OG1 3.48Å; T509-T512 PolarHBondContact O-N 3.22Å; T509-T512 PolarHBondContact O-OG1 2.94Å; T509-T512 VanDerWaalsContact O-OG1 3.13Å; T509-I513 VanDerWaalsContact O-CG1 3.28Å; T509-I513 WeakPolarHBondContact O-CG1 3.49Å; T509-I513 PolarHBondContact O-N 3.17Å
510	A	48.3	Very low	48.9	Very low	51 Å²	51	93.5 Å²	93.5	42%	0.421	47%	0.471	S	S	.	.	H	α-helix	trans	-58.2	-44.8	174	0	0	0	0	0	112.3	H506 T512 I513 E514	H506-A510 WeakPolarHBondContact O-CB 3.33Å; H506-A510 PolarHBondContact O-N 3.1Å; A510-T512 PolarHBondContact O-N 3.23Å; A510-I513 PolarHBondContact O-N 2.97Å; A510-E514 PolarHBondContact O-N 2.87Å
511	R	55.4	Low	49.8	Very low	167 Å²	167	95.8 Å²	95.8	63%	0.63	48%	0.483	S	S	*	.	H	α-helix	trans	-62.8	-40.5	175.6	-73.1	-178.3	-167.6	148.9	8.4	113.1	A507 T509 I513 E514 E515	A507-R511 WeakPolarHBondContact O-CG 3.39Å; A507-R511 PolarHBondContact O-N 3.4Å; T509-R511 PolarHBondContact O-N 3.04Å; R511-I513 VanDerWaalsContact C-N 3.34Å; R511-E514 PolarHBondContact O-N 2.88Å; R511-E515 WeakPolarHBondContact O-CB 3.17Å; R511-E515 PolarHBondContact O-N 2.9Å
512	T	50.1	Low	50.2	Low	70 Å²	70	98.3 Å²	98.3	43%	0.429	50%	0.501	S	S	.	.	H	α-helix	trans	-73	-27.4	178.4	38.9	0	0	0	0	112.4	E508 T509 A510 L516	E508-T512 PolarHBondContact O-N 3.36Å; E508-T512 VanDerWaalsContact O-N 3.16Å; E508-T512 PolarHBondContact O-OG1 3.47Å; T509-T512 WeakPolarHBondContact CA-OG1 3.48Å; T509-T512 PolarHBondContact O-N 3.22Å; T509-T512 PolarHBondContact O-OG1 2.94Å; T509-T512 VanDerWaalsContact O-OG1 3.13Å; A510-T512 PolarHBondContact O-N 3.23Å; T512-L516 WeakPolarHBondContact O-CB 3.3Å; T512-L516 WeakPolarHBondContact O-CG 3.2Å; T512-L516 PolarHBondContact O-N 3.11Å
513	I	51.9	Low	50	Low	94 Å²	94	102.5 Å²	102.5	48%	0.482	52%	0.519	S	S	.	.	H	α-helix	trans	-68.7	-44.5	168.9	-68.5	164.7	0	0	0	110.9	T509 A510 R511 L516 G517	T509-I513 VanDerWaalsContact O-CG1 3.28Å; T509-I513 WeakPolarHBondContact O-CG1 3.49Å; T509-I513 PolarHBondContact O-N 3.17Å; A510-I513 PolarHBondContact O-N 2.97Å; R511-I513 VanDerWaalsContact C-N 3.34Å; I513-L516 PolarHBondContact O-N 3.08Å; I513-G517 PolarHBondContact O-N 2.88Å
514	E	60.7	Low	49.7	Very low	134 Å²	134	106.6 Å²	106.6	63%	0.626	54%	0.541	S	S	*	.	H	α-helix	trans	-59.9	-45	171.8	-76.1	-168.5	128.1	0	0	111.8	A510 R511 L516 G517 N518	A510-E514 PolarHBondContact O-N 2.87Å; R511-E514 PolarHBondContact O-N 2.88Å; E514-L516 PolarHBondContact O-N 3Å; E514-G517 PolarHBondContact O-N 3.29Å; E514-N518 WeakPolarHBondContact O-CB 3.31Å; E514-N518 PolarHBondContact O-N 3.41Å; E514-N518 PolarHBondContact O-ND2 3.16Å
515	E	62.6	Low	49.4	Very low	120 Å²	120	111.3 Å²	111.3	56%	0.561	56%	0.563	S	S	*	*	H	α-helix	trans	-64.9	-39.3	179.6	-169.8	171.6	-168.5	0	0	112	R511 R519	R511-E515 WeakPolarHBondContact O-CB 3.17Å; R511-E515 PolarHBondContact O-N 2.9Å; E515-R519 WeakPolarHBondContact O-CB 3.41Å; E515-R519 VanDerWaalsContact O-CG 3.24Å; E515-R519 WeakPolarHBondContact O-CG 3.45Å; E515-R519 PolarHBondContact O-N 2.85Å
516	L	51.2	Low	49.1	Very low	99 Å²	99	108 Å²	108	52%	0.518	57%	0.565	S	S	.	*	H	α-helix	trans	-67.3	-40.4	172.7	-75	169.2	0	0	0	112.4	T512 I513 E514 R519 L520	T512-L516 WeakPolarHBondContact O-CB 3.3Å; T512-L516 WeakPolarHBondContact O-CG 3.2Å; T512-L516 PolarHBondContact O-N 3.11Å; I513-L516 PolarHBondContact O-N 3.08Å; E514-L516 PolarHBondContact O-N 3Å; L516-R519 PolarHBondContact O-N 3.2Å; L516-L520 WeakPolarHBondContact O-CG 3.42Å; L516-L520 PolarHBondContact O-N 3.15Å
517	G	48.4	Very low	48.6	Very low	22 Å²	22	109.2 Å²	109.2	23%	0.227	58%	0.584	C	S	.	*	H	α-helix	trans	-61.5	-46.6	175.7	0	0	0	0	0	112.3	I513 E514 R519 L520 Q521	I513-G517 PolarHBondContact O-N 2.88Å; E514-G517 PolarHBondContact O-N 3.29Å; G517-R519 VanDerWaalsContact C-N 3.34Å; G517-R519 PolarHBondContact O-N 3.2Å; G517-L520 PolarHBondContact O-N 3.36Å; G517-Q521 PolarHBondContact O-N 3.2Å; G517-Q521 VanDerWaalsContact O-N 3.1Å
518	N	65.9	Low	48.3	Very low	104 Å²	104	113 Å²	113	56%	0.556	61%	0.608	S	S	*	*	H	α-helix	trans	-62.4	-39.4	174.7	-73	-52.3	0	0	0	112	E514 Q521 S522	E514-N518 WeakPolarHBondContact O-CB 3.31Å; E514-N518 PolarHBondContact O-N 3.41Å; E514-N518 PolarHBondContact O-ND2 3.16Å; N518-Q521 PolarHBondContact O-N 3.33Å; N518-S522 PolarHBondContact O-N 3.47Å
519	R	52.9	Low	48	Very low	156 Å²	156	115.5 Å²	115.5	59%	0.589	62%	0.619	S	S	*	*	H	α-helix	trans	-68	-34.6	175.9	-75.2	177.5	66.6	-172.7	-1.5	113.1	E515 L516 G517 S522	E515-R519 WeakPolarHBondContact O-CB 3.41Å; E515-R519 VanDerWaalsContact O-CG 3.24Å; E515-R519 WeakPolarHBondContact O-CG 3.45Å; E515-R519 PolarHBondContact O-N 2.85Å; L516-R519 PolarHBondContact O-N 3.2Å; G517-R519 VanDerWaalsContact C-N 3.34Å; G517-R519 PolarHBondContact O-N 3.2Å; R519-S522 PolarHBondContact O-N 2.79Å; R519-S522 PolarHBondContact O-OG 3.44Å
520	L	51.2	Low	47.8	Very low	122 Å²	122	117.7 Å²	117.7	64%	0.639	64%	0.637	S	S	*	*	H	α-helix	trans	-68.1	-36.5	174	-79.9	162.9	0	0	0	112.3	L516 G517 S522 F523	L516-L520 WeakPolarHBondContact O-CG 3.42Å; L516-L520 PolarHBondContact O-N 3.15Å; G517-L520 PolarHBondContact O-N 3.36Å; L520-S522 PolarHBondContact O-N 3.49Å; L520-F523 PolarHBondContact O-N 2.88Å
521	Q	53.1	Low	47.4	Very low	167 Å²	167	121.7 Å²	121.7	78%	0.78	65%	0.652	S	S	*	*	H	α-helix	trans	-67.2	-17.9	173.7	-71.1	-176.4	1.2	0	0	113.8	G517 N518	G517-Q521 PolarHBondContact O-N 3.2Å; G517-Q521 VanDerWaalsContact O-N 3.1Å; N518-Q521 PolarHBondContact O-N 3.33Å
522	S	50.7	Low	46.8	Very low	88 Å²	88	122.2 Å²	122.2	62%	0.615	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.4	1.2	177.6	67.2	0	0	0	0	115.3	N518 R519 L520 D524	N518-S522 PolarHBondContact O-N 3.47Å; R519-S522 PolarHBondContact O-N 2.79Å; R519-S522 PolarHBondContact O-OG 3.44Å; L520-S522 PolarHBondContact O-N 3.49Å; S522-D524 PolarHBondContact O-N 3.31Å
523	F	38.5	Very low	46.3	Very low	165 Å²	165	124.6 Å²	124.6	72%	0.724	68%	0.676	S	S	*	*			trans	-87.8	79.2	175.8	-98.5	-85.8	0	0	0	111.8	L520	L520-F523 PolarHBondContact O-N 2.88Å
524	D	38.8	Very low	45.5	Very low	146 Å²	146	127.5 Å²	127.5	78%	0.781	69%	0.693	S	S	*	*			trans	-86.1	131.7	163.7	-172	7.2	0	0	0	110.2	S522	S522-D524 PolarHBondContact O-N 3.31Å
525	M	39.6	Very low	44.6	Very low	173 Å²	173	125.3 Å²	125.3	85%	0.852	70%	0.697	S	S	*	*			trans	-151	62.1	-170.8	-86.2	-69.6	-65.4	0	0	110.1
526	G	34.8	Very low	43.5	Very low	66 Å²	66	124.8 Å²	124.8	68%	0.68	71%	0.707	S	S	*	*			trans	-158.2	21.9	-171	0	0	0	0	0	118.5	S528	G526-S528 PolarHBondContact O-N 2.94Å
527	S	33	Very low	42.9	Very low	117 Å²	117	126.9 Å²	126.9	82%	0.818	72%	0.718	S	S	*	*			trans	-79.9	104.5	-179.5	60.6	0	0	0	0	113
528	S	40.1	Very low	42.4	Very low	123 Å²	123	132.6 Å²	132.6	86%	0.86	74%	0.743	S	S	*	*			trans	-164.7	129	148.2	-81.3	0	0	0	0	112.2	G526	G526-S528 PolarHBondContact O-N 2.94Å
529	Q	36.5	Very low	40.9	Very low	178 Å²	178	132.7 Å²	132.7	83%	0.832	75%	0.752	S	S	*	*			trans	-66.5	147.7	-170.3	-58.9	151.5	-83.3	0	0	115.2
530	S	40	Very low	40.1	Very low	109 Å²	109	130.3 Å²	130.3	76%	0.762	76%	0.759	S	S	*	*				151.8	152	126.9	54	0	0	0	0	112.5
531	D	40.3	Very low	39.4	Very low	135 Å²	135	132.5 Å²	132.5	72%	0.722	76%	0.764	S	S	*	*			cis	-170.9	126.8	-38.9	-93	-27.6	0	0	0	106.2
532	E	42	Very low	38.7	Very low	178 Å²	178	132.9 Å²	132.9	83%	0.832	77%	0.766	S	S	*	*			trans	61.1	160.7	160	-55.9	-162.8	157.2	0	0	119.1
533	T	40	Very low	37.7	Very low	121 Å²	121	134 Å²	134	74%	0.742	77%	0.774	S	S	*	*			cis	-147.6	175.7	-1.7	-8.1	0	0	0	0	112.4
534	D	36.1	Very low	37.8	Very low	155 Å²	155	132.5 Å²	132.5	83%	0.829	78%	0.78	S	S	*	*			trans	-72.4	154.7	-168.3	-50	-75.7	0	0	0	119.8
535	A	40.2	Very low	37.5	Very low	87 Å²	87	135.2 Å²	135.2	72%	0.719	79%	0.785	S	S	*	*			trans	-176.7	113.2	139.3	0	0	0	0	0	108.5
536	S	40.7	Very low	37.3	Very low	110 Å²	110	132.3 Å²	132.3	77%	0.769	79%	0.788	S	S	*	*				60.9	136.2	78.2	79.6	0	0	0	0	114.1
537	D	37.7	Very low	37.3	Very low	142 Å²	142	132.9 Å²	132.9	76%	0.759	80%	0.795	S	S	*	*			cis	-161.6	-180	3.1	-145.9	-33.9	0	0	0	111.6
538	L	39.1	Very low	37.3	Very low	142 Å²	142	136.6 Å²	136.6	74%	0.743	80%	0.799	S	S	*	*			trans	59.1	100.8	158.4	-60.9	170.1	0	0	0	118.6
539	S	34.7	Very low	37.1	Very low	107 Å²	107	137.2 Å²	137.2	75%	0.748	80%	0.797	S	S	*	*				71	125.4	83.3	79.3	0	0	0	0	117.5
540	S	35.9	Very low	37	Very low	105 Å²	105	132.1 Å²	132.1	73%	0.734	79%	0.793	S	S	*	*			trans	176.7	124.2	138.2	-165.4	0	0	0	0	115.4
541	F	36.5	Very low	36.8	Very low	169 Å²	169	134.6 Å²	134.6	74%	0.741	80%	0.796	S	S	*	*			trans	55.4	112.1	143	-77.7	-114.2	0	0	0	124.9
542	Q	37.5	Very low	36.5	Very low	174 Å²	174	135 Å²	135	81%	0.813	80%	0.798	S	S	*	*				61.3	134	123	-66.5	-176.8	-22.8	0	0	123.5
543	S	30	Very low	36.3	Very low	112 Å²	112	132.9 Å²	132.9	78%	0.783	79%	0.791	S	S	*	*			trans	-87.9	167.9	168.5	-39.5	0	0	0	0	113
544	P	40.1	Very low	36.1	Very low	133 Å²	133	132.7 Å²	132.7	86%	0.864	80%	0.795	S	S	*	*				-133.4	-177.5	117.4	38	-29.7	0	0	0	114.1
545	K	33.4	Very low	36.2	Very low	204 Å²	204	129.1 Å²	129.1	89%	0.887	79%	0.786	S	S	*	*			trans	-122.6	169.6	-178.9	-74.6	-175.7	176.5	-178.9	0	111.9
546	A	33.9	Very low	36.1	Very low	111 Å²	111	132.1 Å²	132.1	92%	0.917	79%	0.786	S	S	*	*			trans	89.7	143	154.8	0	0	0	0	0	118.2
547	G	35.5	Very low	36	Very low	79 Å²	79	135.9 Å²	135.9	81%	0.814	78%	0.783	S	S	*	*			trans	146.2	122.7	-173.3	0	0	0	0	0	109.7
548	E	33.1	Very low	36.1	Very low	194 Å²	194	134 Å²	134	91%	0.907	78%	0.781	S	S	*	*			trans	-106.9	179.8	-176.8	-68.3	180	95.2	0	0	112.3
549	V	36.8	Very low	36.1	Very low	136 Å²	136	131.7 Å²	131.7	82%	0.824	78%	0.776	S	S	*	*			trans	79.2	92.4	162.1	-164.5	0	0	0	0	118.4
550	G	32.8	Very low	36.3	Very low	72 Å²	72	135.3 Å²	135.3	74%	0.742	78%	0.782	S	S	*	*				76.2	162.9	110.8	0	0	0	0	0	123
551	I	36.5	Very low	36.4	Very low	161 Å²	161	134.8 Å²	134.8	83%	0.826	78%	0.778	S	S	*	*			trans	79.1	88.3	159.5	-47	-180	0	0	0	118.9
552	D	34.7	Very low	36.5	Very low	142 Å²	142	131.5 Å²	131.5	76%	0.759	78%	0.776	S	S	*	*				62.2	151.9	110.3	-124.3	-12.6	0	0	0	125.7
553	I	37.8	Very low	36.5	Very low	135 Å²	135	130.9 Å²	130.9	69%	0.692	78%	0.778	S	S	*	*			trans	79.4	126.4	150.4	-71.5	158.1	0	0	0	123.1
554	S	36	Very low	36.8	Very low	117 Å²	117	131.7 Å²	131.7	82%	0.818	78%	0.778	S	S	*	*			trans	69.5	165.4	151.8	-76.1	0	0	0	0	122.7
555	A	37.6	Very low	36.8	Very low	79 Å²	79	134.8 Å²	134.8	65%	0.653	78%	0.781	S	S	*	*			cis	-178.8	164	-36.5	0	0	0	0	0	111
556	E	37.4	Very low	37	Very low	150 Å²	150	130.1 Å²	130.1	70%	0.701	77%	0.774	S	S	*	*			trans	66.8	159	162.4	-56.6	-145.9	126.3	0	0	117.4
557	R	38.7	Very low	37.2	Very low	190 Å²	190	130.5 Å²	130.5	72%	0.717	77%	0.77	S	S	*	*			cis	-162.7	161	-8.2	-124.4	177.2	-154.1	-170.6	20.2	112.3
558	S	40.1	Very low	37.3	Very low	102 Å²	102	129.9 Å²	129.9	71%	0.713	76%	0.764	S	S	*	*			trans	65.6	151.9	145.5	-72.5	0	0	0	0	120.9
559	S	39.9	Very low	37.6	Very low	93 Å²	93	128.5 Å²	128.5	65%	0.65	76%	0.762	S	S	*	*			cis	-169	168.3	-8.6	-98.3	0	0	0	0	111.7
560	Q	39	Very low	37.7	Very low	184 Å²	184	131 Å²	131	86%	0.86	76%	0.763	S	S	*	*			trans	70.1	158.2	159.2	-70.9	162.5	8	0	0	119.9
561	S	36.9	Very low	38.2	Very low	94 Å²	94	130.3 Å²	130.3	66%	0.657	75%	0.75	S	S	*	*				-172.9	141	-52.3	46.3	0	0	0	0	112.2
562	S	38	Very low	38.2	Very low	99 Å²	99	131.6 Å²	131.6	69%	0.692	75%	0.752	S	S	*	*			trans	45.4	123.2	152.1	61.1	0	0	0	0	121.3
563	N	38.4	Very low	38.6	Very low	161 Å²	161	135.8 Å²	135.8	86%	0.861	76%	0.758	S	S	*	*				-165.3	167.3	92.6	-123.5	-17.7	0	0	0	114.2
564	V	35.7	Very low	38.7	Very low	129 Å²	129	140.8 Å²	140.8	78%	0.782	77%	0.768	S	S	*	*			trans	-127.3	136.8	-179.2	171.5	0	0	0	0	109.8
565	Q	41.4	Very low	39.1	Very low	199 Å²	199	140.3 Å²	140.3	93%	0.93	76%	0.762	S	S	*	*			trans	-166.4	160.4	142.9	-109.6	158.3	21.4	0	0	113.7
566	S	36.7	Very low	39.3	Very low	106 Å²	106	143.9 Å²	143.9	74%	0.741	77%	0.765	S	S	*	*			trans	-104.2	150.6	-171.7	173.7	0	0	0	0	111.7
567	S	38.1	Very low	39.9	Very low	119 Å²	119	147.3 Å²	147.3	83%	0.832	77%	0.771	S	S	*	*				174.4	146.1	125.6	-79.4	0	0	0	0	113.9
568	G	37.8	Very low	40.4	Very low	66 Å²	66	146.1 Å²	146.1	68%	0.68	77%	0.772	S	S	*	*			trans	100.3	107.8	142.1	0	0	0	0	0	119.1
569	N	39.6	Very low	41.2	Very low	164 Å²	164	146.6 Å²	146.6	88%	0.877	77%	0.766	S	S	*	*			trans	46.5	114.2	137.2	-50.8	-15.9	0	0	0	120
570	F	38.4	Very low	42.4	Very low	190 Å²	190	145 Å²	145	83%	0.833	75%	0.752	S	S	*	*				178	166.1	93	-169.7	-104.1	0	0	0	111	E572	F570-E572 PolarHBondContact O-N 3.47Å
571	A	42.7	Very low	44.1	Very low	57 Å²	57	141.7 Å²	141.7	47%	0.471	75%	0.747	S	S	.	*			trans	-66.3	128	-173.9	0	0	0	0	0	114.8
572	E	38	Very low	46.1	Very low	187 Å²	187	144.9 Å²	144.9	87%	0.874	75%	0.751	S	S	*	*				56.3	76.7	124.4	-161	160.2	-150.6	0	0	117.4	F570	F570-E572 PolarHBondContact O-N 3.47Å
573	R	41.8	Very low	47.9	Very low	231 Å²	231	145.2 Å²	145.2	87%	0.872	74%	0.742	S	S	*	*			trans	-131.1	127.4	159.1	-62.7	-170.9	-172.4	-139.7	-0.7	110.7
574	R	40.5	Very low	49.5	Very low	240 Å²	240	144.4 Å²	144.4	91%	0.906	73%	0.728	S	S	*	*			trans	-76.4	120	-173.6	-161.1	-175.1	-141.8	161.9	5.2	109.9	E576	R574-E576 PolarHBondContact O-N 2.84Å; R574-E576 VanDerWaalsContact O-N 3.14Å
575	P	44.4	Very low	51.7	Low	107 Å²	107	141.1 Å²	141.1	70%	0.695	71%	0.714	S	S	*	*			trans	-76.2	104.2	178	29.3	-32.7	0	0	0	110.4	R577	P575-R577 PolarHBondContact O-N 3.13Å
576	E	42.4	Very low	53.8	Low	154 Å²	154	138.2 Å²	138.2	72%	0.72	70%	0.698	S	S	*	*			trans	-61.3	100.3	159.2	-70.5	-173.9	165.5	0	0	108.7	R574 K578	R574-E576 PolarHBondContact O-N 2.84Å; R574-E576 VanDerWaalsContact O-N 3.14Å; E576-K578 HydrophobicContact CB-CG 4.45Å; E576-K578 PolarHBondContact O-N 2.72Å; E576-K578 WeakPolarHBondContact OE2-CE 3.08Å; E576-K578 IonicContact OE2-NZ 3.41Å
577	R	49.5	Very low	55.8	Low	222 Å²	222	138.4 Å²	138.4	84%	0.838	69%	0.691	S	S	*	*			trans	-71.2	88.3	165.2	-74.2	-173.7	177.6	166.9	-0.3	108.2	P575 N579	P575-R577 PolarHBondContact O-N 3.13Å; R577-N579 VanDerWaalsContact C-N 3.31Å; R577-N579 PolarHBondContact O-N 2.67Å; R577-N579 PolarHBondContact O-OD1 3.09Å
578	K	48.8	Very low	57.9	Low	165 Å²	165	137 Å²	137	72%	0.717	67%	0.671	S	S	*	*			trans	-68.1	93.1	167.3	-66.9	-177.8	178.9	-178.7	0	107.6	E576 T580	E576-K578 HydrophobicContact CB-CG 4.45Å; E576-K578 PolarHBondContact O-N 2.72Å; E576-K578 WeakPolarHBondContact OE2-CE 3.08Å; E576-K578 IonicContact OE2-NZ 3.41Å; K578-T580 PolarHBondContact O-N 2.79Å
579	N	56.6	Low	60.2	Low	111 Å²	111	141.7 Å²	141.7	59%	0.594	67%	0.672	S	S	*	*			trans	-49.6	127.8	171.4	-63.7	-6.7	0	0	0	108.4	R577	R577-N579 VanDerWaalsContact C-N 3.31Å; R577-N579 PolarHBondContact O-N 2.67Å; R577-N579 PolarHBondContact O-OD1 3.09Å
580	T	65.5	Low	62.3	Low	60 Å²	60	139.1 Å²	139.1	37%	0.368	66%	0.655	S	S	.	*			trans	-68.5	154.2	-179	57.1	0	0	0	0	111	K578 E582 E583 Y584	K578-T580 PolarHBondContact O-N 2.79Å; T580-E582 PolarHBondContact O-N 3.1Å; T580-E583 WeakPolarHBondContact CB-OE2 3.42Å; T580-E583 PolarHBondContact N-OE2 3.15Å; T580-E583 PolarHBondContact O-N 3.41Å; T580-E583 WeakPolarHBondContact OG1-CB 3.48Å; T580-E583 WeakPolarHBondContact OG1-CG 3.47Å; T580-E583 PolarHBondContact OG1-N 3.39Å; T580-E583 VanDerWaalsContact OG1-N 3.08Å; T580-E583 PolarHBondContact OG1-OE2 3.23Å; T580-Y584 PolarHBondContact O-N 3.37Å
581	P	75.7	Confident	64.4	Low	114 Å²	114	135.5 Å²	135.5	74%	0.74	64%	0.64	S	S	*	*	H	α-helix	trans	-55.8	-31.1	171.2	-25.8	35.5	0	0	0	112.6	Y584 A585	P581-Y584 PolarHBondContact O-N 3.11Å; P581-A585 VanDerWaalsContact O-CB 3.31Å; P581-A585 WeakPolarHBondContact O-CB 3.27Å; P581-A585 PolarHBondContact O-N 2.75Å
582	E	77.7	Confident	66.3	Low	161 Å²	161	136.8 Å²	136.8	75%	0.752	64%	0.638	S	S	*	*	H	α-helix	trans	-70.2	-44.2	176.2	-60.2	-171.9	163.8	0	0	112.8	T580 Y584 A585 K586	T580-E582 PolarHBondContact O-N 3.1Å; E582-Y584 VanDerWaalsContact C-N 3.3Å; E582-Y584 PolarHBondContact O-N 2.77Å; E582-A585 PolarHBondContact O-N 3.49Å; E582-K586 VanDerWaalsContact O-CB 3.31Å; E582-K586 WeakPolarHBondContact O-CB 3.37Å; E582-K586 PolarHBondContact O-N 3.39Å
583	E	75.8	Confident	68.7	Low	106 Å²	106	134.7 Å²	134.7	50%	0.495	63%	0.626	S	S	.	*	H	α-helix	trans	-60.9	-40.9	171.8	-76.3	165.1	124.1	0	0	111.2	T580 K586 L587	T580-E583 WeakPolarHBondContact CB-OE2 3.42Å; T580-E583 PolarHBondContact N-OE2 3.15Å; T580-E583 PolarHBondContact O-N 3.41Å; T580-E583 WeakPolarHBondContact OG1-CB 3.48Å; T580-E583 WeakPolarHBondContact OG1-CG 3.47Å; T580-E583 PolarHBondContact OG1-N 3.39Å; T580-E583 VanDerWaalsContact OG1-N 3.08Å; T580-E583 PolarHBondContact OG1-OE2 3.23Å; E583-K586 PolarHBondContact O-N 2.81Å; E583-L587 WeakPolarHBondContact O-CB 3.34Å; E583-L587 PolarHBondContact O-N 3.15Å
584	Y	71.8	Confident	70.3	Confident	144 Å²	144	125.9 Å²	125.9	57%	0.565	60%	0.603	S	S	*	*	H	α-helix	trans	-65.3	-45.5	176.8	-157.3	-83.5	0	0	0	111.6	T580 P581 E582 K586 L587 Q588	T580-Y584 PolarHBondContact O-N 3.37Å; P581-Y584 PolarHBondContact O-N 3.11Å; E582-Y584 VanDerWaalsContact C-N 3.3Å; E582-Y584 PolarHBondContact O-N 2.77Å; Y584-K586 VanDerWaalsContact C-N 3.33Å; Y584-K586 PolarHBondContact O-N 3.28Å; Y584-L587 PolarHBondContact O-N 3.17Å; Y584-Q588 WeakPolarHBondContact O-CB 3.44Å; Y584-Q588 PolarHBondContact O-N 3Å
585	A	82.7	Confident	72.1	Confident	60 Å²	60	119.2 Å²	119.2	50%	0.496	58%	0.582	S	S	.	*	H	α-helix	trans	-62.8	-37.5	175.5	0	0	0	0	0	112.5	P581 E582 K589	P581-A585 VanDerWaalsContact O-CB 3.31Å; P581-A585 WeakPolarHBondContact O-CB 3.27Å; P581-A585 PolarHBondContact O-N 2.75Å; E582-A585 PolarHBondContact O-N 3.49Å; A585-K589 WeakPolarHBondContact O-CB 3.46Å; A585-K589 PolarHBondContact O-N 3.12Å
586	K	84.5	Confident	73.8	Confident	138 Å²	138	117.8 Å²	117.8	60%	0.6	58%	0.575	S	S	*	*	H	α-helix	trans	-65.1	-45.9	173.5	-173.7	-178.1	177.1	-173.2	0	111.3	E582 E583 Y584 K589 E590	E582-K586 VanDerWaalsContact O-CB 3.31Å; E582-K586 WeakPolarHBondContact O-CB 3.37Å; E582-K586 PolarHBondContact O-N 3.39Å; E583-K586 PolarHBondContact O-N 2.81Å; Y584-K586 VanDerWaalsContact C-N 3.33Å; Y584-K586 PolarHBondContact O-N 3.28Å; K586-K589 WeakPolarHBondContact O-CB 3.33Å; K586-K589 PolarHBondContact O-N 3.06Å; K586-E590 PolarHBondContact O-N 2.94Å
587	L	79	Confident	75.5	Confident	111 Å²	111	116.7 Å²	116.7	58%	0.581	57%	0.567	S	S	*	*	H	α-helix	trans	-63.9	-41.5	177.9	-168	69.1	0	0	0	111.6	E583 Y584 K589 E590 F591	E583-L587 WeakPolarHBondContact O-CB 3.34Å; E583-L587 PolarHBondContact O-N 3.15Å; Y584-L587 PolarHBondContact O-N 3.17Å; L587-K589 VanDerWaalsContact C-N 3.31Å; L587-K589 PolarHBondContact O-N 3.39Å; L587-E590 PolarHBondContact O-N 3.08Å; L587-F591 WeakPolarHBondContact O-CB 3.37Å; L587-F591 PolarHBondContact O-N 3.31Å
588	Q	81.7	Confident	76.6	Confident	89 Å²	89	111 Å²	111	42%	0.416	55%	0.553	S	S	.	*	H	α-helix	trans	-59.7	-41.2	173.3	-162.1	80.6	33.1	0	0	111.5	Y584 F591 N592	Y584-Q588 WeakPolarHBondContact O-CB 3.44Å; Y584-Q588 PolarHBondContact O-N 3Å; Q588-F591 PolarHBondContact O-N 3.08Å; Q588-N592 WeakPolarHBondContact O-CB 3.48Å; Q588-N592 PolarHBondContact O-N 2.83Å; Q588-N592 PolarHBondContact O-OD1 3.45Å
589	K	86.6	Confident	77.9	Confident	164 Å²	164	105.5 Å²	105.5	71%	0.713	54%	0.535	S	S	*	.	H	α-helix	trans	-68.1	-36.5	177.6	-168.7	173.2	-175.1	173.6	0	112.3	A585 K586 L587 K593	A585-K589 WeakPolarHBondContact O-CB 3.46Å; A585-K589 PolarHBondContact O-N 3.12Å; K586-K589 WeakPolarHBondContact O-CB 3.33Å; K586-K589 PolarHBondContact O-N 3.06Å; L587-K589 VanDerWaalsContact C-N 3.31Å; L587-K589 PolarHBondContact O-N 3.39Å; K589-K593 VanDerWaalsContact O-CB 3.31Å; K589-K593 WeakPolarHBondContact O-CB 3.4Å; K589-K593 PolarHBondContact O-N 3.05Å; K589-K593 VanDerWaalsContact O-N 3.14Å
590	E	83.5	Confident	78.9	Confident	111 Å²	111	103.7 Å²	103.7	52%	0.519	53%	0.528	S	S	.	.	H	α-helix	trans	-72.9	-38.6	173.5	-72.3	-174.5	-172	0	0	112.3	K586 L587 K593 A594	K586-E590 PolarHBondContact O-N 2.94Å; L587-E590 PolarHBondContact O-N 3.08Å; E590-K593 PolarHBondContact O-N 2.7Å; E590-A594 WeakPolarHBondContact O-CB 3.47Å; E590-A594 PolarHBondContact O-N 2.67Å
591	F	83.1	Confident	79.2	Confident	114 Å²	114	105.2 Å²	105.2	50%	0.5	53%	0.533	S	S	.	.	H	α-helix	trans	-59.3	-50.8	172.4	-179.4	-91.6	0	0	0	111.6	L587 Q588 K593 A594 Q595	L587-F591 WeakPolarHBondContact O-CB 3.37Å; L587-F591 PolarHBondContact O-N 3.31Å; Q588-F591 PolarHBondContact O-N 3.08Å; F591-K593 VanDerWaalsContact C-N 3.27Å; F591-K593 PolarHBondContact O-N 2.72Å; F591-A594 WeakPolarHBondContact O-CB 3.49Å; F591-A594 PolarHBondContact O-N 2.88Å; F591-A594 VanDerWaalsContact O-N 3.09Å; F591-Q595 WeakPolarHBondContact O-CB 3.47Å; F591-Q595 PolarHBondContact O-N 2.91Å
592	N	83.7	Confident	78.9	Confident	83 Å²	83	104.5 Å²	104.5	44%	0.444	52%	0.52	S	S	.	.	H	α-helix	trans	-60.7	-37	177.4	-68.4	-5.8	0	0	0	111.8	Q588 S596	Q588-N592 WeakPolarHBondContact O-CB 3.48Å; Q588-N592 PolarHBondContact O-N 2.83Å; Q588-N592 PolarHBondContact O-OD1 3.45Å; N592-S596 WeakPolarHBondContact O-CB 3.39Å; N592-S596 PolarHBondContact O-N 3.03Å
593	K	86.5	Confident	78.6	Confident	143 Å²	143	103.7 Å²	103.7	62%	0.622	51%	0.514	S	S	*	.	H	α-helix	trans	-68.6	-36.2	175.1	-171.8	178.3	-177.4	-178.5	0	112.3	K589 E590 F591 K597	K589-K593 VanDerWaalsContact O-CB 3.31Å; K589-K593 WeakPolarHBondContact O-CB 3.4Å; K589-K593 PolarHBondContact O-N 3.05Å; K589-K593 VanDerWaalsContact O-N 3.14Å; E590-K593 PolarHBondContact O-N 2.7Å; F591-K593 VanDerWaalsContact C-N 3.27Å; F591-K593 PolarHBondContact O-N 2.72Å; K593-K597 WeakPolarHBondContact O-CG 3.22Å; K593-K597 PolarHBondContact O-N 3.1Å; K593-K597 VanDerWaalsContact O-N 3.14Å
594	A	76.9	Confident	78.1	Confident	47 Å²	47	103.4 Å²	103.4	39%	0.388	51%	0.513	S	S	.	.	H	α-helix	trans	-69.9	-44.5	174.2	0	0	0	0	0	111.7	E590 F591 S596 K597 L598	E590-A594 WeakPolarHBondContact O-CB 3.47Å; E590-A594 PolarHBondContact O-N 2.67Å; F591-A594 WeakPolarHBondContact O-CB 3.49Å; F591-A594 PolarHBondContact O-N 2.88Å; F591-A594 VanDerWaalsContact O-N 3.09Å; A594-S596 PolarHBondContact O-N 2.78Å; A594-K597 WeakPolarHBondContact O-CB 3.34Å; A594-K597 PolarHBondContact O-N 2.85Å; A594-L598 WeakPolarHBondContact O-CG 3.47Å; A594-L598 PolarHBondContact O-N 2.87Å
595	Q	78.2	Confident	77.6	Confident	100 Å²	100	100.9 Å²	100.9	47%	0.467	51%	0.509	S	S	.	.	H	α-helix	trans	-62.2	-41.8	176.7	-168.3	179.3	32	0	0	111.9	F591 L598 C599	F591-Q595 WeakPolarHBondContact O-CB 3.47Å; F591-Q595 PolarHBondContact O-N 2.91Å; Q595-L598 PolarHBondContact O-N 3.21Å; Q595-C599 PolarHBondContact O-N 3.27Å
596	S	79.3	Confident	76.7	Confident	76 Å²	76	105.1 Å²	105.1	53%	0.531	51%	0.513	S	S	.	.	H	α-helix	trans	-61.8	-42.8	173	177.4	0	0	0	0	112	N592 A594 C599 T600	N592-S596 WeakPolarHBondContact O-CB 3.39Å; N592-S596 PolarHBondContact O-N 3.03Å; A594-S596 PolarHBondContact O-N 2.78Å; S596-C599 PolarHBondContact O-N 3.1Å; S596-T600 PolarHBondContact O-N 3.02Å; S596-T600 VanDerWaalsContact O-N 3.09Å; S596-T600 PolarHBondContact O-OG1 3.27Å; S596-T600 VanDerWaalsContact O-OG1 3.05Å
597	K	79.4	Confident	75.6	Confident	131 Å²	131	103.8 Å²	103.8	57%	0.57	51%	0.509	S	S	*	.	H	α-helix	trans	-62	-43.6	173.6	-80.9	-176.4	169.4	-164.2	0	112.5	K593 A594 T600 L601	K593-K597 WeakPolarHBondContact O-CG 3.22Å; K593-K597 PolarHBondContact O-N 3.1Å; K593-K597 VanDerWaalsContact O-N 3.14Å; A594-K597 WeakPolarHBondContact O-CB 3.34Å; A594-K597 PolarHBondContact O-N 2.85Å; K597-T600 PolarHBondContact O-N 2.68Å; K597-L601 WeakPolarHBondContact O-CB 3.33Å; K597-L601 WeakPolarHBondContact O-CG 3.46Å; K597-L601 PolarHBondContact O-N 3.12Å
598	L	72.2	Confident	74.5	Confident	102 Å²	102	103 Å²	103	53%	0.534	51%	0.505	S	S	.	.	H	α-helix	trans	-59.5	-49.7	177.3	-74.5	169.7	0	0	0	110.8	A594 Q595 T600 L601 E602	A594-L598 WeakPolarHBondContact O-CG 3.47Å; A594-L598 PolarHBondContact O-N 2.87Å; Q595-L598 PolarHBondContact O-N 3.21Å; L598-T600 VanDerWaalsContact C-N 3.26Å; L598-T600 PolarHBondContact O-N 3.48Å; L598-L601 CarbonylContact O-C 3.55Å; L598-L601 PolarHBondContact O-N 3.06Å; L598-L601 VanDerWaalsContact O-N 3.09Å; L598-E602 WeakPolarHBondContact O-CB 3.47Å; L598-E602 VanDerWaalsContact O-CG 3.31Å; L598-E602 WeakPolarHBondContact O-CG 3.34Å; L598-E602 PolarHBondContact O-N 2.94Å
599	C	75	Confident	73.1	Confident	51 Å²	51	102.1 Å²	102.1	35%	0.345	50%	0.498	S	S	.	.	H	α-helix	trans	-60.5	-32.8	176.9	-173.8	0	0	0	0	113.2	Q595 S596 E602 K603	Q595-C599 PolarHBondContact O-N 3.27Å; S596-C599 PolarHBondContact O-N 3.1Å; C599-E602 WeakPolarHBondContact CA-OE2 3.33Å; C599-K603 WeakPolarHBondContact O-CD 3.39Å; C599-K603 VanDerWaalsContact O-CG 3.29Å; C599-K603 WeakPolarHBondContact O-CG 3.37Å; C599-K603 PolarHBondContact O-N 2.84Å; C599-K603 PolarHBondContact SG-NZ 3.11Å; C599-K603 VanDerWaalsContact SG-NZ 3.37Å
600	T	77.3	Confident	71.5	Confident	73 Å²	73	95.9 Å²	95.9	45%	0.448	47%	0.47	S	S	.	.	H	α-helix	trans	-69.9	-45.3	172.8	-57.2	0	0	0	0	111.7	S596 K597 L598 K603 Q604	S596-T600 PolarHBondContact O-N 3.02Å; S596-T600 VanDerWaalsContact O-N 3.09Å; S596-T600 PolarHBondContact O-OG1 3.27Å; S596-T600 VanDerWaalsContact O-OG1 3.05Å; K597-T600 PolarHBondContact O-N 2.68Å; L598-T600 VanDerWaalsContact C-N 3.26Å; L598-T600 PolarHBondContact O-N 3.48Å; T600-K603 PolarHBondContact O-N 2.59Å; T600-Q604 WeakPolarHBondContact O-CG 3.48Å; T600-Q604 PolarHBondContact O-N 2.99Å
601	L	72.5	Confident	70	Confident	91 Å²	91	95 Å²	95	48%	0.476	47%	0.467	S	S	.	.	H	α-helix	trans	-66.5	-37.8	178.4	-71.7	167.1	0	0	0	112.3	K597 L598 K603 Q604 L605	K597-L601 WeakPolarHBondContact O-CB 3.33Å; K597-L601 WeakPolarHBondContact O-CG 3.46Å; K597-L601 PolarHBondContact O-N 3.12Å; L598-L601 CarbonylContact O-C 3.55Å; L598-L601 PolarHBondContact O-N 3.06Å; L598-L601 VanDerWaalsContact O-N 3.09Å; L601-K603 VanDerWaalsContact C-N 3.34Å; L601-K603 PolarHBondContact O-N 2.7Å; L601-Q604 PolarHBondContact O-N 3.42Å; L601-L605 WeakPolarHBondContact O-CB 3.42Å; L601-L605 VanDerWaalsContact O-CG 3.29Å; L601-L605 WeakPolarHBondContact O-CG 3.35Å; L601-L605 PolarHBondContact O-N 3.5Å
602	E	68.8	Low	68.7	Low	100 Å²	100	95.2 Å²	95.2	47%	0.467	48%	0.478	S	S	.	.	H	α-helix	trans	-61.1	-42.2	172.8	-73.6	170.3	154.7	0	0	111.3	L598 C599 Y606	L598-E602 WeakPolarHBondContact O-CB 3.47Å; L598-E602 VanDerWaalsContact O-CG 3.31Å; L598-E602 WeakPolarHBondContact O-CG 3.34Å; L598-E602 PolarHBondContact O-N 2.94Å; C599-E602 WeakPolarHBondContact CA-OE2 3.33Å; E602-Y606 VanDerWaalsContact O-CB 3.31Å; E602-Y606 WeakPolarHBondContact O-CB 3.34Å; E602-Y606 PolarHBondContact O-N 3.35Å
603	K	71.7	Confident	67.6	Low	143 Å²	143	92.5 Å²	92.5	62%	0.622	46%	0.464	S	S	*	.	H	α-helix	trans	-68.2	-37.1	175.5	-74.7	168.2	-178	164.1	0	112.5	C599 T600 L601 H607	C599-K603 WeakPolarHBondContact O-CD 3.39Å; C599-K603 VanDerWaalsContact O-CG 3.29Å; C599-K603 WeakPolarHBondContact O-CG 3.37Å; C599-K603 PolarHBondContact O-N 2.84Å; C599-K603 PolarHBondContact SG-NZ 3.11Å; C599-K603 VanDerWaalsContact SG-NZ 3.37Å; T600-K603 PolarHBondContact O-N 2.59Å; L601-K603 VanDerWaalsContact C-N 3.34Å; L601-K603 PolarHBondContact O-N 2.7Å; K603-H607 WeakPolarHBondContact O-CB 3.01Å; K603-H607 PolarHBondContact O-N 3.4Å
604	Q	65	Low	67.3	Low	101 Å²	101	88 Å²	88	47%	0.472	45%	0.451	S	S	.	.	H	α-helix	trans	-67.4	-48.7	174.3	-72.8	175.5	-56.7	0	0	111.1	T600 L601 Y606 H607 D608	T600-Q604 WeakPolarHBondContact O-CG 3.48Å; T600-Q604 PolarHBondContact O-N 2.99Å; L601-Q604 PolarHBondContact O-N 3.42Å; Q604-Y606 VanDerWaalsContact C-N 3.27Å; Q604-Y606 PolarHBondContact O-N 2.92Å; Q604-H607 CarbonylContact O-C 3.59Å; Q604-H607 WeakPolarHBondContact O-CA 3.15Å; Q604-H607 WeakPolarHBondContact O-CB 3.36Å; Q604-H607 PolarHBondContact O-N 3.34Å; Q604-D608 VanDerWaalsContact O-CG 3.23Å; Q604-D608 PolarHBondContact O-N 3.07Å
605	L	62.3	Low	67.7	Low	91 Å²	91	87.3 Å²	87.3	48%	0.476	44%	0.44	S	S	.	.	H	α-helix	trans	-59	-36.4	173.9	-72.5	169.7	0	0	0	112.5	L601 R609	L601-L605 WeakPolarHBondContact O-CB 3.42Å; L601-L605 VanDerWaalsContact O-CG 3.29Å; L601-L605 WeakPolarHBondContact O-CG 3.35Å; L601-L605 PolarHBondContact O-N 3.5Å; L605-R609 WeakPolarHBondContact O-CB 3.48Å; L605-R609 WeakPolarHBondContact O-CD 3.4Å; L605-R609 WeakPolarHBondContact O-CG 3.23Å; L605-R609 PolarHBondContact O-N 3.31Å; L605-R609 VanDerWaalsContact O-N 3.12Å
606	Y	63.1	Low	68	Low	149 Å²	149	86.4 Å²	86.4	58%	0.584	44%	0.435	S	S	*	.	H	α-helix	trans	-66.9	-41	172.4	-169.6	-84.9	0	0	0	111.7	E602 Q604 Y610	E602-Y606 VanDerWaalsContact O-CB 3.31Å; E602-Y606 WeakPolarHBondContact O-CB 3.34Å; E602-Y606 PolarHBondContact O-N 3.35Å; Q604-Y606 VanDerWaalsContact C-N 3.27Å; Q604-Y606 PolarHBondContact O-N 2.92Å; Y606-Y610 HydrophobicContact CD1-CD2 4.13Å; Y606-Y610 AromaticContact CD2-CD2 3.6Å; Y606-Y610 HydrophobicContact CD2-CD2 3.6Å; Y606-Y610 AromaticContact CD2-CE2 3.71Å; Y606-Y610 HydrophobicContact CD2-CE2 3.71Å; Y606-Y610 HydrophobicContact CE1-CD2 4.14Å; Y606-Y610 AromaticContact CE2-CD2 3.62Å; Y606-Y610 HydrophobicContact CE2-CD2 3.62Å; Y606-Y610 AromaticContact CE2-CE2 3.71Å; Y606-Y610 HydrophobicContact CE2-CE2 3.71Å; Y606-Y610 AromaticContact CG-CD2 3.86Å; Y606-Y610 HydrophobicContact CG-CD2 3.86Å; Y606-Y610 HydrophobicContact CG-CE2 4.38Å; Y606-Y610 AromaticContact CZ-CD2 3.89Å; Y606-Y610 WeakPolarHBondContact O-CB 3.48Å; Y606-Y610 VanDerWaalsContact O-CD2 3.29Å; Y606-Y610 WeakPolarHBondContact O-CD2 3.28Å; Y606-Y610 PolarHBondContact O-N 3.12Å; Y606-Y610 VanDerWaalsContact O-N 3.09Å
607	H	61.4	Low	68.3	Low	109 Å²	109	85.6 Å²	85.6	51%	0.505	43%	0.425	S	S	.	.	H	α-helix	trans	-63.1	-51.8	175.8	-159.7	74.9	0	0	0	111.2	K603 Q604 R609 Y610 M611	K603-H607 WeakPolarHBondContact O-CB 3.01Å; K603-H607 PolarHBondContact O-N 3.4Å; Q604-H607 CarbonylContact O-C 3.59Å; Q604-H607 WeakPolarHBondContact O-CA 3.15Å; Q604-H607 WeakPolarHBondContact O-CB 3.36Å; Q604-H607 PolarHBondContact O-N 3.34Å; H607-R609 VanDerWaalsContact C-N 3.3Å; H607-R609 PolarHBondContact O-N 2.93Å; H607-Y610 PolarHBondContact O-N 2.85Å; H607-M611 HydrophobicContact CB-CG 4.42Å; H607-M611 VanDerWaalsContact CE1-CG 3.42Å; H607-M611 WeakPolarHBondContact CE1-CG 3.41Å; H607-M611 VanDerWaalsContact ND1-CG 3.33Å; H607-M611 WeakPolarHBondContact ND1-CG 3.25Å; H607-M611 WeakPolarHBondContact O-CB 3.31Å; H607-M611 WeakPolarHBondContact O-CG 3.42Å; H607-M611 PolarHBondContact O-N 3.21Å
608	D	56.9	Low	68.6	Low	95 Å²	95	79.4 Å²	79.4	51%	0.508	40%	0.398	S	S	.	.	H	α-helix	trans	-67.8	-27.9	-175.2	-59	-20	0	0	0	113.2	Q604 R621	Q604-D608 VanDerWaalsContact O-CG 3.23Å; Q604-D608 PolarHBondContact O-N 3.07Å; D608-R621 PolarHBondContact O-NH1 2.98Å; D608-R621 PolarHBondContact O-NH2 3.05Å
609	R	51.8	Low	69.4	Low	71 Å²	71	74.5 Å²	74.5	27%	0.268	37%	0.373	S	S	.	.	H	α-helix	trans	-81.4	-34.8	174.8	-71.9	176.5	179.8	-165.3	3	114	H506 L605 H607 P627	H506-R609 PolarHBondContact NE2-NH1 3.23Å; L605-R609 WeakPolarHBondContact O-CB 3.48Å; L605-R609 WeakPolarHBondContact O-CD 3.4Å; L605-R609 WeakPolarHBondContact O-CG 3.23Å; L605-R609 PolarHBondContact O-N 3.31Å; L605-R609 VanDerWaalsContact O-N 3.12Å; H607-R609 VanDerWaalsContact C-N 3.3Å; H607-R609 PolarHBondContact O-N 2.93Å; R609-P627 HydrophobicContact CG-CB 4.12Å; R609-P627 HydrophobicContact CG-CG 3.84Å
610	Y	52.2	Low	70	Confident	33 Å²	33	77.1 Å²	77.1	13%	0.129	38%	0.375	C	S	.	.	H	α-helix	trans	-118	-1.5	-167.7	-61.9	-69.2	0	0	0	115.6	S501 Y606 H607	S501-Y610 PolarHBondContact OG-OH 2.83Å; Y606-Y610 HydrophobicContact CD1-CD2 4.13Å; Y606-Y610 AromaticContact CD2-CD2 3.6Å; Y606-Y610 HydrophobicContact CD2-CD2 3.6Å; Y606-Y610 AromaticContact CD2-CE2 3.71Å; Y606-Y610 HydrophobicContact CD2-CE2 3.71Å; Y606-Y610 HydrophobicContact CE1-CD2 4.14Å; Y606-Y610 AromaticContact CE2-CD2 3.62Å; Y606-Y610 HydrophobicContact CE2-CD2 3.62Å; Y606-Y610 AromaticContact CE2-CE2 3.71Å; Y606-Y610 HydrophobicContact CE2-CE2 3.71Å; Y606-Y610 AromaticContact CG-CD2 3.86Å; Y606-Y610 HydrophobicContact CG-CD2 3.86Å; Y606-Y610 HydrophobicContact CG-CE2 4.38Å; Y606-Y610 AromaticContact CZ-CD2 3.89Å; Y606-Y610 WeakPolarHBondContact O-CB 3.48Å; Y606-Y610 VanDerWaalsContact O-CD2 3.29Å; Y606-Y610 WeakPolarHBondContact O-CD2 3.28Å; Y606-Y610 PolarHBondContact O-N 3.12Å; Y606-Y610 VanDerWaalsContact O-N 3.09Å; H607-Y610 PolarHBondContact O-N 2.85Å
611	M	53.1	Low	70.2	Confident	91 Å²	91	75.9 Å²	75.9	45%	0.448	36%	0.362	S	S	.	.	S	Bend	trans	-83.6	165.2	168.4	-68.6	-64.9	96.7	0	0	112.5	H607 T613	H607-M611 HydrophobicContact CB-CG 4.42Å; H607-M611 VanDerWaalsContact CE1-CG 3.42Å; H607-M611 WeakPolarHBondContact CE1-CG 3.41Å; H607-M611 VanDerWaalsContact ND1-CG 3.33Å; H607-M611 WeakPolarHBondContact ND1-CG 3.25Å; H607-M611 WeakPolarHBondContact O-CB 3.31Å; H607-M611 WeakPolarHBondContact O-CG 3.42Å; H607-M611 PolarHBondContact O-N 3.21Å; M611-T613 PolarHBondContact O-N 3.35Å
612	T	54.6	Low	70.8	Confident	119 Å²	119	72.3 Å²	72.3	73%	0.73	34%	0.343	S	S	*	.			trans	-59.5	91.2	-175.7	51.2	0	0	0	0	113.2
613	T	62.5	Low	71.5	Confident	26 Å²	26	68.7 Å²	68.7	16%	0.16	33%	0.331	C	S	.	.			trans	-70.9	159.9	152.7	32.1	0	0	0	0	110.5	M611 D617 T618	M611-T613 PolarHBondContact O-N 3.35Å; T613-D617 HydrophobicContact CG2-CB 3.93Å; T613-T618 PolarHBondContact OG1-OG1 3.34Å
614	S	79.7	Confident	72.1	Confident	48 Å²	48	67.4 Å²	67.4	34%	0.336	33%	0.327	S	S	.	.			trans	-66.1	168.1	169.2	86.1	0	0	0	0	110.8	E616 D617 T618	S614-E616 VanDerWaalsContact C-N 3.3Å; S614-E616 WeakPolarHBondContact CB-OE2 3.49Å; S614-E616 PolarHBondContact O-N 2.97Å; S614-E616 PolarHBondContact OG-N 3.3Å; S614-E616 PolarHBondContact OG-OE2 3.13Å; S614-D617 PolarHBondContact O-N 3.44Å; S614-D617 PolarHBondContact OG-N 3Å; S614-D617 VanDerWaalsContact OG-N 3.1Å; S614-T618 WeakPolarHBondContact O-CB 3.38Å; S614-T618 PolarHBondContact O-N 2.87Å; S614-T618 PolarHBondContact O-OG1 2.76Å
615	H	84.6	Confident	72.7	Confident	34 Å²	34	64.7 Å²	64.7	16%	0.157	33%	0.326	C	S	.	.	H	α-helix	trans	-60.5	-43.7	174.7	-65	165.2	0	0	0	110.4	D617 T618 I619 C633 E638 S641 L642 K645	H615-D617 PolarHBondContact O-N 3.5Å; H615-T618 WeakPolarHBondContact O-CB 3.2Å; H615-T618 PolarHBondContact O-N 2.93Å; H615-I619 WeakPolarHBondContact O-CG1 3.38Å; H615-I619 PolarHBondContact O-N 3.2Å; H615-C633 PolarHBondContact NE2-SG 3.12Å; H615-E638 PolarHBondContact CE1-O 2.85Å; H615-S641 PolarHBondContact ND1-OG 2.85Å; H615-L642 HydrophobicContact CB-CD1 4.18Å; H615-K645 HydrophobicContact CB-CB 4.08Å; H615-K645 HydrophobicContact CB-CG 3.83Å
616	E	85.7	Confident	73.3	Confident	81 Å²	81	64.9 Å²	64.9	38%	0.379	33%	0.325	S	S	.	.	H	α-helix	trans	-62.2	-43.2	178.4	-51.4	77.9	-172.3	0	0	112.7	S614 T618 R620 K645	S614-E616 VanDerWaalsContact C-N 3.3Å; S614-E616 WeakPolarHBondContact CB-OE2 3.49Å; S614-E616 PolarHBondContact O-N 2.97Å; S614-E616 PolarHBondContact OG-N 3.3Å; S614-E616 PolarHBondContact OG-OE2 3.13Å; E616-T618 VanDerWaalsContact C-N 3.33Å; E616-R620 WeakPolarHBondContact O-CB 3.18Å; E616-R620 PolarHBondContact O-N 3.41Å; E616-K645 HydrophobicContact CG-CD 4.27Å; E616-K645 HydrophobicContact CG-CG 4.29Å; E616-K645 WeakPolarHBondContact OE1-CE 3.47Å
617	D	85	Confident	73.6	Confident	59 Å²	59	60 Å²	60	32%	0.316	31%	0.311	S	S	.	.	H	α-helix	trans	-67.9	-34.8	175.9	-76.2	-13.1	0	0	0	111.7	T613 S614 H615 R620 R621	T613-D617 HydrophobicContact CG2-CB 3.93Å; S614-D617 PolarHBondContact O-N 3.44Å; S614-D617 PolarHBondContact OG-N 3Å; S614-D617 VanDerWaalsContact OG-N 3.1Å; H615-D617 PolarHBondContact O-N 3.5Å; D617-R620 PolarHBondContact O-N 3.42Å; D617-R620 IonicContact OD1-CZ 3.77Å; D617-R620 IonicContact OD1-NH1 2.69Å; D617-R620 PolarHBondContact OD1-NH1 3.06Å; D617-R620 IonicContact OD1-NH2 3.96Å; D617-R620 PolarHBondContact OD1-NH2 3.38Å; D617-R621 WeakPolarHBondContact O-CG 3.42Å; D617-R621 PolarHBondContact O-N 2.94Å
618	T	85.6	Confident	74.2	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-67.1	-44.9	176.2	-53.8	0	0	0	0	111.1	T613 S614 H615 E616 R621 I622 F630 L642	T613-T618 PolarHBondContact OG1-OG1 3.34Å; S614-T618 WeakPolarHBondContact O-CB 3.38Å; S614-T618 PolarHBondContact O-N 2.87Å; S614-T618 PolarHBondContact O-OG1 2.76Å; H615-T618 WeakPolarHBondContact O-CB 3.2Å; H615-T618 PolarHBondContact O-N 2.93Å; E616-T618 VanDerWaalsContact C-N 3.33Å; T618-R621 PolarHBondContact O-N 2.91Å; T618-I622 WeakPolarHBondContact O-CG1 3.44Å; T618-I622 PolarHBondContact O-N 3.03Å; T618-F630 HydrophobicContact CG2-CD1 4.21Å; T618-F630 HydrophobicContact CG2-CE1 4.22Å; T618-L642 HydrophobicContact CG2-CD1 4.49Å
619	I	88.3	Confident	75.1	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-63.2	-43.2	173.7	-63.2	-53.9	0	0	0	111.3	H615 R621 I622 A623 L642 K645 A646 F649 A654 V658	H615-I619 WeakPolarHBondContact O-CG1 3.38Å; H615-I619 PolarHBondContact O-N 3.2Å; I619-R621 VanDerWaalsContact C-N 3.34Å; I619-R621 PolarHBondContact O-N 3.42Å; I619-I622 HydrophobicContact CD1-CD1 4.18Å; I619-I622 PolarHBondContact O-N 2.98Å; I619-I622 VanDerWaalsContact O-N 3.16Å; I619-A623 PolarHBondContact O-N 3.42Å; I619-L642 HydrophobicContact CD1-CD1 3.9Å; I619-L642 HydrophobicContact CD1-CG 4.49Å; I619-L642 HydrophobicContact CG1-CD1 4.27Å; I619-K645 HydrophobicContact CG1-CB 4.37Å; I619-A646 HydrophobicContact CD1-CB 3.71Å; I619-A646 HydrophobicContact CG1-CB 4.32Å; I619-F649 HydrophobicContact CG2-CB 3.54Å; I619-F649 HydrophobicContact CG2-CD1 3.98Å; I619-F649 HydrophobicContact CG2-CD2 3.97Å; I619-F649 HydrophobicContact CG2-CG 3.56Å; I619-A654 HydrophobicContact CG2-CB 4.12Å; I619-V658 HydrophobicContact CD1-CG2 3.66Å
620	R	87.3	Confident	76.5	Confident	105 Å²	105	50.3 Å²	50.3	40%	0.396	27%	0.266	S	S	.	.	H	α-helix	trans	-58.9	-43.6	176.9	-165.1	-172.6	-53.8	119.1	29.2	111.7	E616 D617 I622 A623 Q624 F649	E616-R620 WeakPolarHBondContact O-CB 3.18Å; E616-R620 PolarHBondContact O-N 3.41Å; D617-R620 PolarHBondContact O-N 3.42Å; D617-R620 IonicContact OD1-CZ 3.77Å; D617-R620 IonicContact OD1-NH1 2.69Å; D617-R620 PolarHBondContact OD1-NH1 3.06Å; D617-R620 IonicContact OD1-NH2 3.96Å; D617-R620 PolarHBondContact OD1-NH2 3.38Å; R620-I622 PolarHBondContact O-N 3.01Å; R620-A623 PolarHBondContact O-N 2.69Å; R620-Q624 WeakPolarHBondContact O-CB 3.45Å; R620-Q624 VanDerWaalsContact O-CG 3.27Å; R620-Q624 WeakPolarHBondContact O-CG 3.23Å; R620-Q624 PolarHBondContact O-N 3.33Å; R620-Q624 PolarHBondContact O-OE1 2.84Å; R620-F649 HydrophobicContact CB-CE2 4.05Å; R620-F649 HydrophobicContact CG-CE2 4.11Å; R620-F649 HydrophobicContact CG-CZ 4.36Å
621	R	82.9	Confident	77.2	Confident	48 Å²	48	50.6 Å²	50.6	18%	0.181	27%	0.272	C	S	.	.	H	α-helix	trans	-58.7	-45.1	174.5	-77.5	177.3	174	-172.7	-1	112	D608 D617 T618 I619 Q624 G625 E626	D608-R621 PolarHBondContact O-NH1 2.98Å; D608-R621 PolarHBondContact O-NH2 3.05Å; D617-R621 WeakPolarHBondContact O-CG 3.42Å; D617-R621 PolarHBondContact O-N 2.94Å; T618-R621 PolarHBondContact O-N 2.91Å; I619-R621 VanDerWaalsContact C-N 3.34Å; I619-R621 PolarHBondContact O-N 3.42Å; R621-Q624 PolarHBondContact O-N 3.12Å; R621-G625 PolarHBondContact O-N 2.94Å; R621-E626 HydrophobicContact CB-CB 4.03Å; R621-E626 HydrophobicContact CG-CB 4.09Å; R621-E626 PolarHBondContact O-N 3.14Å
622	I	84.8	Confident	77.9	Confident	15 Å²	15	47.6 Å²	47.6	8%	0.077	26%	0.26	C	S	.	.	H	α-helix	trans	-60.1	-50.8	178.1	-61.3	160.6	0	0	0	110.9	T618 I619 R620 Q624 G625 Y628 F630 A654 C657	T618-I622 WeakPolarHBondContact O-CG1 3.44Å; T618-I622 PolarHBondContact O-N 3.03Å; I619-I622 HydrophobicContact CD1-CD1 4.18Å; I619-I622 PolarHBondContact O-N 2.98Å; I619-I622 VanDerWaalsContact O-N 3.16Å; R620-I622 PolarHBondContact O-N 3.01Å; I622-Q624 PolarHBondContact O-N 3.37Å; I622-G625 PolarHBondContact O-N 3.1Å; I622-Y628 HydrophobicContact CB-CD1 4.26Å; I622-Y628 HydrophobicContact CB-CE1 4.38Å; I622-Y628 HydrophobicContact CD1-CD2 4.16Å; I622-Y628 HydrophobicContact CD1-CE2 4.32Å; I622-Y628 HydrophobicContact CD1-CG 4.32Å; I622-Y628 HydrophobicContact CG1-CD1 3.47Å; I622-Y628 VanDerWaalsContact CG1-CD1 3.47Å; I622-Y628 HydrophobicContact CG1-CD2 3.78Å; I622-Y628 HydrophobicContact CG1-CE1 3.74Å; I622-Y628 HydrophobicContact CG1-CE2 4.04Å; I622-Y628 HydrophobicContact CG1-CG 3.48Å; I622-Y628 VanDerWaalsContact CG1-CG 3.48Å; I622-Y628 HydrophobicContact CG2-CE1 4.29Å; I622-F630 HydrophobicContact CD1-CE1 3.79Å; I622-F630 HydrophobicContact CD1-CZ 3.8Å; I622-A654 HydrophobicContact CB-CB 4.19Å; I622-A654 HydrophobicContact CG2-CB 3.9Å; I622-C657 HydrophobicContact CG2-CB 4.03Å
623	A	83.6	Confident	78.9	Confident	25 Å²	25	42.1 Å²	42.1	21%	0.207	23%	0.227	C	C	.	.	H	α-helix	trans	-63.6	-27.6	179.7	0	0	0	0	0	113.5	I619 R620 F649 D651	I619-A623 PolarHBondContact O-N 3.42Å; R620-A623 PolarHBondContact O-N 2.69Å; A623-F649 HydrophobicContact CB-CD1 4.27Å; A623-F649 HydrophobicContact CB-CE1 3.37Å; A623-F649 HydrophobicContact CB-CZ 3.81Å; A623-D651 HydrophobicContact CB-CB 4.17Å; A623-D651 WeakPolarHBondContact CB-OD2 3.36Å
624	Q	83.8	Confident	79.5	Confident	115 Å²	115	49 Å²	49	54%	0.537	25%	0.25	S	C	.	.	H	α-helix	trans	-84	-10	174.2	-70.6	173.3	-31.5	0	0	113.4	R620 R621 I622 E626	R620-Q624 WeakPolarHBondContact O-CB 3.45Å; R620-Q624 VanDerWaalsContact O-CG 3.27Å; R620-Q624 WeakPolarHBondContact O-CG 3.23Å; R620-Q624 PolarHBondContact O-N 3.33Å; R620-Q624 PolarHBondContact O-OE1 2.84Å; R621-Q624 PolarHBondContact O-N 3.12Å; I622-Q624 PolarHBondContact O-N 3.37Å; Q624-E626 VanDerWaalsContact C-N 3.27Å; Q624-E626 HydrophobicContact CB-CG 4.06Å
625	G	76.8	Confident	79.4	Confident	44 Å²	44	47.6 Å²	47.6	45%	0.454	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	71.5	19.9	-173.1	0	0	0	0	0	113.9	R621 I622	R621-G625 PolarHBondContact O-N 2.94Å; I622-G625 PolarHBondContact O-N 3.1Å
626	E	74.7	Confident	79	Confident	96 Å²	96	46.1 Å²	46.1	45%	0.449	23%	0.234	S	C	.	.			trans	-79.1	153.2	174.5	-67.5	-163.3	163.8	0	0	111.6	R621 Q624 Y628	R621-E626 HydrophobicContact CB-CB 4.03Å; R621-E626 HydrophobicContact CG-CB 4.09Å; R621-E626 PolarHBondContact O-N 3.14Å; Q624-E626 VanDerWaalsContact C-N 3.27Å; Q624-E626 HydrophobicContact CB-CG 4.06Å; E626-Y628 WeakPolarHBondContact O-CD1 3.44Å; E626-Y628 PolarHBondContact O-N 2.99Å
627	P	69.2	Low	78.9	Confident	46 Å²	46	46.8 Å²	46.8	30%	0.299	24%	0.243	S	C	.	.			trans	-60.8	120.9	175	24.7	-34.7	0	0	0	111.8	R609	R609-P627 HydrophobicContact CG-CB 4.12Å; R609-P627 HydrophobicContact CG-CG 3.84Å
628	Y	75.7	Confident	78.9	Confident	42 Å²	42	47.4 Å²	47.4	17%	0.165	24%	0.244	C	C	.	.			trans	-120.4	168.1	-177.7	62.6	-94.2	0	0	0	112	F502 I622 E626 F630	F502-Y628 HydrophobicContact CD2-CE2 4.23Å; F502-Y628 WeakPolarHBondContact CD2-OH 3.27Å; F502-Y628 WeakPolarHBondContact CE2-OH 3.37Å; I622-Y628 HydrophobicContact CB-CD1 4.26Å; I622-Y628 HydrophobicContact CB-CE1 4.38Å; I622-Y628 HydrophobicContact CD1-CD2 4.16Å; I622-Y628 HydrophobicContact CD1-CE2 4.32Å; I622-Y628 HydrophobicContact CD1-CG 4.32Å; I622-Y628 HydrophobicContact CG1-CD1 3.47Å; I622-Y628 VanDerWaalsContact CG1-CD1 3.47Å; I622-Y628 HydrophobicContact CG1-CD2 3.78Å; I622-Y628 HydrophobicContact CG1-CE1 3.74Å; I622-Y628 HydrophobicContact CG1-CE2 4.04Å; I622-Y628 HydrophobicContact CG1-CG 3.48Å; I622-Y628 VanDerWaalsContact CG1-CG 3.48Å; I622-Y628 HydrophobicContact CG2-CE1 4.29Å; E626-Y628 WeakPolarHBondContact O-CD1 3.44Å; E626-Y628 PolarHBondContact O-N 2.99Å; Y628-F630 HydrophobicContact CD2-CE1 4.24Å; Y628-F630 HydrophobicContact CD2-CE2 4.16Å; Y628-F630 AromaticContact CD2-CZ 3.95Å; Y628-F630 HydrophobicContact CD2-CZ 3.95Å; Y628-F630 HydrophobicContact CE2-CD2 4.33Å; Y628-F630 HydrophobicContact CE2-CE1 4.35Å; Y628-F630 AromaticContact CE2-CE2 3.6Å; Y628-F630 HydrophobicContact CE2-CE2 3.6Å; Y628-F630 AromaticContact CE2-CZ 3.62Å; Y628-F630 HydrophobicContact CE2-CZ 3.62Å
629	S	74.3	Confident	79	Confident	13 Å²	13	47.8 Å²	47.8	9%	0.091	25%	0.246	C	C	.	.			trans	-147.3	136.8	178.7	-174.2	0	0	0	0	111.7	C631	S629-C631 WeakPolarHBondContact OG-CB 3.3Å; S629-C631 PolarHBondContact OG-N 2.98Å; S629-C631 PolarHBondContact OG-SG 3.06Å
630	F	80.9	Confident	79	Confident	17 Å²	17	48.4 Å²	48.4	8%	0.075	25%	0.249	C	C	.	.			trans	-98	14	172.8	-55.3	-55.3	0	0	0	112.9	T618 I622 Y628 S632 C633 L642 V658 F661	T618-F630 HydrophobicContact CG2-CD1 4.21Å; T618-F630 HydrophobicContact CG2-CE1 4.22Å; I622-F630 HydrophobicContact CD1-CE1 3.79Å; I622-F630 HydrophobicContact CD1-CZ 3.8Å; Y628-F630 HydrophobicContact CD2-CE1 4.24Å; Y628-F630 HydrophobicContact CD2-CE2 4.16Å; Y628-F630 AromaticContact CD2-CZ 3.95Å; Y628-F630 HydrophobicContact CD2-CZ 3.95Å; Y628-F630 HydrophobicContact CE2-CD2 4.33Å; Y628-F630 HydrophobicContact CE2-CE1 4.35Å; Y628-F630 AromaticContact CE2-CE2 3.6Å; Y628-F630 HydrophobicContact CE2-CE2 3.6Å; Y628-F630 AromaticContact CE2-CZ 3.62Å; Y628-F630 HydrophobicContact CE2-CZ 3.62Å; F630-S632 PolarHBondContact O-N 2.95Å; F630-S632 VanDerWaalsContact O-N 3.1Å; F630-C633 PolarHBondContact O-N 3.41Å; F630-L642 HydrophobicContact CD1-CD2 3.63Å; F630-L642 HydrophobicContact CE1-CD2 3.83Å; F630-V658 HydrophobicContact CE1-CG2 4.2Å; F630-V658 HydrophobicContact CZ-CG2 4.31Å; F630-F661 HydrophobicContact CB-CD1 4.08Å; F630-F661 HydrophobicContact CB-CD2 3.71Å; F630-F661 HydrophobicContact CB-CE1 3.85Å; F630-F661 HydrophobicContact CB-CE2 3.46Å; F630-F661 VanDerWaalsContact CB-CE2 3.46Å; F630-F661 HydrophobicContact CB-CG 4.01Å; F630-F661 HydrophobicContact CB-CZ 3.54Å; F630-F661 HydrophobicContact CD1-CD1 4.37Å; F630-F661 HydrophobicContact CD2-CB 3.57Å; F630-F661 HydrophobicContact CD2-CD1 4.01Å; F630-F661 AromaticContact CD2-CD2 3.56Å; F630-F661 HydrophobicContact CD2-CD2 3.56Å; F630-F661 HydrophobicContact CD2-CE2 4.25Å; F630-F661 AromaticContact CD2-CG 3.42Å; F630-F661 HydrophobicContact CD2-CG 3.42Å; F630-F661 VanDerWaalsContact CD2-CG 3.42Å; F630-F661 HydrophobicContact CE2-CB 3.56Å; F630-F661 HydrophobicContact CE2-CD2 4.44Å; F630-F661 AromaticContact CE2-CG 3.94Å; F630-F661 HydrophobicContact CE2-CG 3.94Å; F630-F661 HydrophobicContact CG-CB 4.35Å; F630-F661 AromaticContact CG-CD1 3.93Å; F630-F661 HydrophobicContact CG-CD1 3.93Å; F630-F661 AromaticContact CG-CD2 3.91Å; F630-F661 HydrophobicContact CG-CD2 3.91Å; F630-F661 HydrophobicContact CG-CE1 4.18Å; F630-F661 HydrophobicContact CG-CE2 4.17Å; F630-F661 AromaticContact CG-CG 3.78Å; F630-F661 HydrophobicContact CG-CG 3.78Å; F630-F661 HydrophobicContact CG-CZ 4.3Å; F630-F661 HydrophobicContact CZ-CB 4.35Å
631	C	67.3	Low	79.1	Confident	39 Å²	39	45 Å²	45	26%	0.264	24%	0.242	S	C	.	.	S	Bend	trans	-63.9	-15.6	-174.2	-72.7	0	0	0	0	115.3	C499 S629 R634	C499-C631 VanDerWaalsContact CB-SG 3.56Å; S629-C631 WeakPolarHBondContact OG-CB 3.3Å; S629-C631 PolarHBondContact OG-N 2.98Å; S629-C631 PolarHBondContact OG-SG 3.06Å; C631-R634 PolarHBondContact O-NE 3.19Å
632	S	68.5	Low	79.5	Confident	28 Å²	28	42.7 Å²	42.7	20%	0.196	23%	0.233	C	C	.	.	S	Bend	trans	-76.9	-47.1	173.4	43.5	0	0	0	0	112.8	F630 R634	F630-S632 PolarHBondContact O-N 2.95Å; F630-S632 VanDerWaalsContact O-N 3.1Å; S632-R634 PolarHBondContact O-N 3.33Å
633	C	75.3	Confident	79.8	Confident	4 Å²	4	42 Å²	42	3%	0.027	23%	0.23	C	C	.	.			trans	-77.5	89.8	-169.2	-52.8	0	0	0	0	111.8	H615 F630 E638 K639 L642 F661	H615-C633 PolarHBondContact NE2-SG 3.12Å; F630-C633 PolarHBondContact O-N 3.41Å; C633-E638 HydrophobicContact CB-CB 4.11Å; C633-K639 HydrophobicContact CB-CG 4.31Å; C633-K639 VanDerWaalsContact O-CE 3.27Å; C633-K639 WeakPolarHBondContact O-CE 3.39Å; C633-L642 HydrophobicContact CB-CD2 4.39Å; C633-F661 HydrophobicContact CB-CE1 4.24Å; C633-F661 HydrophobicContact CB-CZ 4.37Å
634	R	75.3	Confident	80.1	Confident	169 Å²	169	44.4 Å²	44.4	64%	0.638	24%	0.236	S	C	*	.			trans	-105.3	-45.7	-172.6	-68.5	175.1	-177	-152.6	0	112.2	N493 C631 S632 E638 K639	N493-R634 PolarHBondContact ND2-O 2.74Å; N493-R634 PolarHBondContact OD1-O 2.91Å; C631-R634 PolarHBondContact O-NE 3.19Å; S632-R634 PolarHBondContact O-N 3.33Å; R634-E638 PolarHBondContact N-OE2 3.28Å; R634-K639 WeakPolarHBondContact O-CE 3.32Å
635	S	77.1	Confident	80.4	Confident	20 Å²	20	41.2 Å²	41.2	14%	0.14	22%	0.221	C	C	.	.	S	Bend	trans	-70.5	159.3	177.7	63.2	0	0	0	0	112.1	E489 V637 E638 K639	E489-S635 WeakPolarHBondContact OE1-CA 3.28Å; E489-S635 WeakPolarHBondContact OE1-CB 3.27Å; E489-S635 WeakPolarHBondContact OE2-CA 3.24Å; E489-S635 WeakPolarHBondContact OE2-CB 3.12Å; S635-V637 PolarHBondContact O-N 2.85Å; S635-E638 WeakPolarHBondContact CB-OE2 3.38Å; S635-E638 PolarHBondContact N-OE2 3.05Å; S635-E638 WeakPolarHBondContact OG-CB 3.26Å; S635-E638 WeakPolarHBondContact OG-CG 3.43Å; S635-E638 PolarHBondContact OG-N 3.39Å; S635-E638 VanDerWaalsContact OG-N 3.08Å; S635-E638 PolarHBondContact OG-OE2 3.13Å; S635-K639 WeakPolarHBondContact O-CB 3.18Å; S635-K639 VanDerWaalsContact O-CG 3.26Å; S635-K639 WeakPolarHBondContact O-CG 3.07Å; S635-K639 PolarHBondContact O-N 3.03Å
636	A	77.3	Confident	81.1	Confident	3 Å²	3	39.1 Å²	39.1	3%	0.025	20%	0.199	C	C	.	.	H	α-helix	trans	-61.2	-34.3	172.7	0	0	0	0	0	111.6	F484 E489 W492 K639 V640	F484-A636 HydrophobicContact CD1-CB 3.61Å; F484-A636 HydrophobicContact CE1-CB 4.1Å; F484-A636 HydrophobicContact CG-CB 4.26Å; E489-A636 PolarHBondContact OE1-N 3.22Å; W492-A636 HydrophobicContact CB-CB 4.37Å; W492-A636 HydrophobicContact CG-CB 4.25Å; A636-K639 PolarHBondContact O-N 2.88Å; A636-V640 WeakPolarHBondContact O-CG2 3.48Å; A636-V640 PolarHBondContact O-N 3.22Å
637	V	83.5	Confident	81.9	Confident	94 Å²	94	36.8 Å²	36.8	57%	0.57	19%	0.188	S	C	*	.	H	α-helix	trans	-70.3	-45.5	-179.2	-176.9	0	0	0	0	112	S635 K639 V640 S641	S635-V637 PolarHBondContact O-N 2.85Å; V637-K639 VanDerWaalsContact C-N 3.26Å; V637-K639 PolarHBondContact O-N 3.42Å; V637-V640 PolarHBondContact O-N 2.74Å; V637-S641 WeakPolarHBondContact O-CB 3.43Å; V637-S641 PolarHBondContact O-N 2.67Å
638	E	84.5	Confident	82.9	Confident	73 Å²	73	40.7 Å²	40.7	34%	0.341	20%	0.202	S	C	.	.	H	α-helix	trans	-61.8	-37.7	174.8	-70	158	145.7	0	0	111.6	H615 C633 R634 S635 S641 L642	H615-E638 PolarHBondContact CE1-O 2.85Å; C633-E638 HydrophobicContact CB-CB 4.11Å; R634-E638 PolarHBondContact N-OE2 3.28Å; S635-E638 WeakPolarHBondContact CB-OE2 3.38Å; S635-E638 PolarHBondContact N-OE2 3.05Å; S635-E638 WeakPolarHBondContact OG-CB 3.26Å; S635-E638 WeakPolarHBondContact OG-CG 3.43Å; S635-E638 PolarHBondContact OG-N 3.39Å; S635-E638 VanDerWaalsContact OG-N 3.08Å; S635-E638 PolarHBondContact OG-OE2 3.13Å; E638-S641 PolarHBondContact O-N 2.98Å; E638-L642 WeakPolarHBondContact O-CB 3.41Å; E638-L642 PolarHBondContact O-N 3.33Å
639	K	88	Confident	83.5	Confident	7 Å²	7	42.7 Å²	42.7	3%	0.03	21%	0.212	C	C	.	.	H	α-helix	trans	-66	-42	178.4	-79.7	178.9	-173.7	-169.4	0	113.3	N493 C633 R634 S635 A636 V637 L643 F661 L662 T665 L666	N493-K639 PolarHBondContact OD1-NZ 3.12Å; C633-K639 HydrophobicContact CB-CG 4.31Å; C633-K639 VanDerWaalsContact O-CE 3.27Å; C633-K639 WeakPolarHBondContact O-CE 3.39Å; R634-K639 WeakPolarHBondContact O-CE 3.32Å; S635-K639 WeakPolarHBondContact O-CB 3.18Å; S635-K639 VanDerWaalsContact O-CG 3.26Å; S635-K639 WeakPolarHBondContact O-CG 3.07Å; S635-K639 PolarHBondContact O-N 3.03Å; A636-K639 PolarHBondContact O-N 2.88Å; V637-K639 VanDerWaalsContact C-N 3.26Å; V637-K639 PolarHBondContact O-N 3.42Å; K639-L643 PolarHBondContact O-N 2.86Å; K639-F661 HydrophobicContact CG-CE1 4.15Å; K639-L662 HydrophobicContact CB-CD2 3.53Å; K639-L662 HydrophobicContact CD-CD2 4.12Å; K639-L662 HydrophobicContact CG-CD2 3.85Å; K639-T665 VanDerWaalsContact NZ-CB 3.34Å; K639-T665 PolarHBondContact NZ-OG1 2.66Å; K639-L666 HydrophobicContact CD-CD2 3.81Å; K639-L666 HydrophobicContact CD-CG 4.39Å
640	V	88	Confident	84	Confident	13 Å²	13	42.4 Å²	42.4	8%	0.079	21%	0.211	C	C	.	.	H	α-helix	trans	-67.9	-46.2	173.2	168.9	0	0	0	0	110.5	F484 A636 V637 L642 L643 E644 L674 Y678	F484-V640 HydrophobicContact CD2-CG2 4.28Å; F484-V640 HydrophobicContact CE2-CG2 3.87Å; F484-V640 HydrophobicContact CZ-CG2 4.3Å; A636-V640 WeakPolarHBondContact O-CG2 3.48Å; A636-V640 PolarHBondContact O-N 3.22Å; V637-V640 PolarHBondContact O-N 2.74Å; V640-L642 VanDerWaalsContact C-N 3.3Å; V640-L642 PolarHBondContact O-N 3.32Å; V640-L643 WeakPolarHBondContact O-CA 3.22Å; V640-L643 WeakPolarHBondContact O-CB 3.42Å; V640-L643 PolarHBondContact O-N 3.49Å; V640-E644 HydrophobicContact CG1-CG 4.37Å; V640-E644 WeakPolarHBondContact CG1-OE1 3.4Å; V640-E644 WeakPolarHBondContact O-CG 3.38Å; V640-E644 PolarHBondContact O-N 3.35Å; V640-L674 HydrophobicContact CG2-CD1 4.3Å; V640-Y678 HydrophobicContact CG1-CE2 4.32Å; V640-Y678 WeakPolarHBondContact CG1-OH 3.25Å
641	S	89.4	Confident	84.1	Confident	34 Å²	34	42 Å²	42	24%	0.238	21%	0.209	C	C	.	.	H	α-helix	trans	-59.6	-37.6	177.3	178.5	0	0	0	0	113.1	H615 V637 E638 L643 E644 K645	H615-S641 PolarHBondContact ND1-OG 2.85Å; V637-S641 WeakPolarHBondContact O-CB 3.43Å; V637-S641 PolarHBondContact O-N 2.67Å; E638-S641 PolarHBondContact O-N 2.98Å; S641-L643 VanDerWaalsContact C-N 3.32Å; S641-L643 PolarHBondContact O-N 3.21Å; S641-E644 PolarHBondContact O-N 2.7Å; S641-K645 WeakPolarHBondContact O-CG 3.35Å; S641-K645 PolarHBondContact O-N 2.89Å
642	L	91.2	Very high	84.9	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-61.9	-38.8	173.4	178.5	68.8	0	0	0	112.1	H615 T618 I619 F630 C633 E638 V640 A646 V658 F661	H615-L642 HydrophobicContact CB-CD1 4.18Å; T618-L642 HydrophobicContact CG2-CD1 4.49Å; I619-L642 HydrophobicContact CD1-CD1 3.9Å; I619-L642 HydrophobicContact CD1-CG 4.49Å; I619-L642 HydrophobicContact CG1-CD1 4.27Å; F630-L642 HydrophobicContact CD1-CD2 3.63Å; F630-L642 HydrophobicContact CE1-CD2 3.83Å; C633-L642 HydrophobicContact CB-CD2 4.39Å; E638-L642 WeakPolarHBondContact O-CB 3.41Å; E638-L642 PolarHBondContact O-N 3.33Å; V640-L642 VanDerWaalsContact C-N 3.3Å; V640-L642 PolarHBondContact O-N 3.32Å; L642-A646 PolarHBondContact O-N 3.01Å; L642-V658 HydrophobicContact CD2-CG1 4.06Å; L642-V658 HydrophobicContact CD2-CG2 4.12Å; L642-V658 HydrophobicContact CG-CG1 4.09Å; L642-V658 HydrophobicContact CG-CG2 4Å; L642-F661 HydrophobicContact CD2-CD1 4.26Å; L642-F661 HydrophobicContact CD2-CE1 4.22Å
643	L	91.4	Very high	85.6	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-70.8	-39.8	176.4	-177.7	67	0	0	0	111.7	K639 V640 S641 K645 A646 F647 V658 L659 L662 L674 A681	K639-L643 PolarHBondContact O-N 2.86Å; V640-L643 WeakPolarHBondContact O-CA 3.22Å; V640-L643 WeakPolarHBondContact O-CB 3.42Å; V640-L643 PolarHBondContact O-N 3.49Å; S641-L643 VanDerWaalsContact C-N 3.32Å; S641-L643 PolarHBondContact O-N 3.21Å; L643-K645 VanDerWaalsContact C-N 3.34Å; L643-K645 PolarHBondContact O-N 3.28Å; L643-A646 WeakPolarHBondContact O-CA 3.36Å; L643-A646 VanDerWaalsContact O-CB 3.31Å; L643-A646 WeakPolarHBondContact O-CB 3.25Å; L643-A646 PolarHBondContact O-N 2.99Å; L643-A646 VanDerWaalsContact O-N 3.08Å; L643-F647 HydrophobicContact CD1-CE1 4.45Å; L643-F647 HydrophobicContact CD1-CE2 4.16Å; L643-F647 HydrophobicContact CD1-CZ 3.93Å; L643-F647 HydrophobicContact CD2-CE2 4.05Å; L643-F647 HydrophobicContact CD2-CZ 4.23Å; L643-F647 HydrophobicContact CG-CD2 4.32Å; L643-F647 HydrophobicContact CG-CE2 3.63Å; L643-F647 HydrophobicContact CG-CZ 3.89Å; L643-F647 VanDerWaalsContact O-CD2 3.32Å; L643-F647 WeakPolarHBondContact O-CD2 3Å; L643-F647 PolarHBondContact O-N 3.33Å; L643-V658 HydrophobicContact CB-CG1 4.07Å; L643-V658 HydrophobicContact CD1-CB 4.47Å; L643-V658 HydrophobicContact CD1-CG1 4Å; L643-L659 HydrophobicContact CD1-CD2 4.33Å; L643-L659 HydrophobicContact CD1-CG 4.25Å; L643-L662 HydrophobicContact CB-CD1 4.15Å; L643-L662 HydrophobicContact CD1-CD1 4.39Å; L643-L662 HydrophobicContact CD2-CD1 3.97Å; L643-L662 HydrophobicContact CG-CD1 4.4Å; L643-L674 HydrophobicContact CD2-CD1 4.14Å; L643-L674 HydrophobicContact CD2-CD2 3.81Å; L643-L674 HydrophobicContact CD2-CG 4.23Å; L643-A681 HydrophobicContact CD2-CB 4.27Å
644	E	90.8	Very high	86.2	Confident	75 Å²	75	43.4 Å²	43.4	35%	0.35	21%	0.214	S	C	.	.	H	α-helix	trans	-60.7	-42.7	173.6	-69.6	168.4	164.7	0	0	111.2	V640 S641 A646 F647 E648 Y678	V640-E644 HydrophobicContact CG1-CG 4.37Å; V640-E644 WeakPolarHBondContact CG1-OE1 3.4Å; V640-E644 WeakPolarHBondContact O-CG 3.38Å; V640-E644 PolarHBondContact O-N 3.35Å; S641-E644 PolarHBondContact O-N 2.7Å; E644-A646 VanDerWaalsContact C-N 3.31Å; E644-A646 PolarHBondContact O-N 3.3Å; E644-F647 PolarHBondContact O-N 3.26Å; E644-E648 PolarHBondContact O-N 2.69Å; E644-Y678 HydrophobicContact CG-CE1 4.1Å; E644-Y678 PolarHBondContact OE1-OH 3.4Å
645	K	90.1	Very high	86.9	Confident	48 Å²	48	35.4 Å²	35.4	21%	0.209	18%	0.184	C	C	.	.	H	α-helix	trans	-68.6	-25.3	172.3	-64	-42.9	-174.4	-175.6	0	113.9	H615 E616 I619 S641 L643 E648 F649	H615-K645 HydrophobicContact CB-CB 4.08Å; H615-K645 HydrophobicContact CB-CG 3.83Å; E616-K645 HydrophobicContact CG-CD 4.27Å; E616-K645 HydrophobicContact CG-CG 4.29Å; E616-K645 WeakPolarHBondContact OE1-CE 3.47Å; I619-K645 HydrophobicContact CG1-CB 4.37Å; S641-K645 WeakPolarHBondContact O-CG 3.35Å; S641-K645 PolarHBondContact O-N 2.89Å; L643-K645 VanDerWaalsContact C-N 3.34Å; L643-K645 PolarHBondContact O-N 3.28Å; K645-E648 HydrophobicContact CD-CG 4.49Å; K645-E648 VanDerWaalsContact CD-OE2 3.25Å; K645-E648 WeakPolarHBondContact CD-OE2 3.27Å; K645-E648 IonicContact NZ-OE1 3.86Å; K645-E648 PolarHBondContact NZ-OE1 3.48Å; K645-E648 IonicContact NZ-OE2 2.76Å; K645-E648 PolarHBondContact NZ-OE2 3.11Å; K645-F649 WeakPolarHBondContact O-CB 3.4Å; K645-F649 PolarHBondContact O-N 2.8Å
646	A	90.9	Very high	87.5	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-68.3	-39.4	169.5	0	0	0	0	0	111.5	I619 L642 L643 E644 G650 I655 V658	I619-A646 HydrophobicContact CD1-CB 3.71Å; I619-A646 HydrophobicContact CG1-CB 4.32Å; L642-A646 PolarHBondContact O-N 3.01Å; L643-A646 WeakPolarHBondContact O-CA 3.36Å; L643-A646 VanDerWaalsContact O-CB 3.31Å; L643-A646 WeakPolarHBondContact O-CB 3.25Å; L643-A646 PolarHBondContact O-N 2.99Å; L643-A646 VanDerWaalsContact O-N 3.08Å; E644-A646 VanDerWaalsContact C-N 3.31Å; E644-A646 PolarHBondContact O-N 3.3Å; A646-G650 PolarHBondContact O-N 2.82Å; A646-I655 HydrophobicContact CB-CG1 3.76Å; A646-I655 WeakPolarHBondContact O-CG1 3.43Å; A646-V658 HydrophobicContact CB-CG2 4.25Å
647	F	90.7	Very high	88	Confident	47 Å²	47	36.1 Å²	36.1	21%	0.206	19%	0.188	C	C	.	.	H	α-helix	trans	-68.2	-45	174.1	-62.6	-47.1	0	0	0	112.9	L643 E644 F649 G650 I655 Y678 A681	L643-F647 HydrophobicContact CD1-CE1 4.45Å; L643-F647 HydrophobicContact CD1-CE2 4.16Å; L643-F647 HydrophobicContact CD1-CZ 3.93Å; L643-F647 HydrophobicContact CD2-CE2 4.05Å; L643-F647 HydrophobicContact CD2-CZ 4.23Å; L643-F647 HydrophobicContact CG-CD2 4.32Å; L643-F647 HydrophobicContact CG-CE2 3.63Å; L643-F647 HydrophobicContact CG-CZ 3.89Å; L643-F647 VanDerWaalsContact O-CD2 3.32Å; L643-F647 WeakPolarHBondContact O-CD2 3Å; L643-F647 PolarHBondContact O-N 3.33Å; E644-F647 PolarHBondContact O-N 3.26Å; F647-F649 PolarHBondContact O-N 3.3Å; F647-G650 PolarHBondContact O-N 3.17Å; F647-I655 HydrophobicContact CD1-CD1 3.8Å; F647-I655 HydrophobicContact CD1-CG1 4.05Å; F647-I655 HydrophobicContact CD1-CG2 4.37Å; F647-I655 HydrophobicContact CE1-CD1 4.3Å; F647-I655 HydrophobicContact CE1-CG1 4.37Å; F647-I655 HydrophobicContact CE1-CG2 3.84Å; F647-Y678 AromaticContact CE2-CD1 3.88Å; F647-Y678 HydrophobicContact CE2-CD1 3.88Å; F647-Y678 HydrophobicContact CE2-CG 4.48Å; F647-A681 HydrophobicContact CE1-CB 4.49Å; F647-A681 HydrophobicContact CZ-CB 3.7Å
648	E	89.8	Confident	88.4	Confident	129 Å²	129	31.6 Å²	31.6	60%	0.603	16%	0.161	S	C	*	.	H	α-helix	trans	-57.6	-31.7	175.9	-75.6	178.5	-152.3	0	0	112.8	E644 K645	E644-E648 PolarHBondContact O-N 2.69Å; K645-E648 HydrophobicContact CD-CG 4.49Å; K645-E648 VanDerWaalsContact CD-OE2 3.25Å; K645-E648 WeakPolarHBondContact CD-OE2 3.27Å; K645-E648 IonicContact NZ-OE1 3.86Å; K645-E648 PolarHBondContact NZ-OE1 3.48Å; K645-E648 IonicContact NZ-OE2 2.76Å; K645-E648 PolarHBondContact NZ-OE2 3.11Å
649	F	88.6	Confident	88.7	Confident	83 Å²	83	28.1 Å²	28.1	36%	0.364	15%	0.145	S	C	.	.	H	α-helix	trans	-80.6	-24.4	177.6	-164.2	-82.7	0	0	0	113	I619 R620 A623 K645 F647 D651	I619-F649 HydrophobicContact CG2-CB 3.54Å; I619-F649 HydrophobicContact CG2-CD1 3.98Å; I619-F649 HydrophobicContact CG2-CD2 3.97Å; I619-F649 HydrophobicContact CG2-CG 3.56Å; R620-F649 HydrophobicContact CB-CE2 4.05Å; R620-F649 HydrophobicContact CG-CE2 4.11Å; R620-F649 HydrophobicContact CG-CZ 4.36Å; A623-F649 HydrophobicContact CB-CD1 4.27Å; A623-F649 HydrophobicContact CB-CE1 3.37Å; A623-F649 HydrophobicContact CB-CZ 3.81Å; K645-F649 WeakPolarHBondContact O-CB 3.4Å; K645-F649 PolarHBondContact O-N 2.8Å; F647-F649 PolarHBondContact O-N 3.3Å; F649-D651 VanDerWaalsContact C-N 3.31Å; F649-D651 HydrophobicContact CD1-CB 3.61Å; F649-D651 HydrophobicContact CE1-CB 3.91Å; F649-D651 PolarHBondContact O-N 2.92Å
650	G	84.6	Confident	88.7	Confident	8 Å²	8	29.8 Å²	29.8	8%	0.082	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	72.1	13.4	174	0	0	0	0	0	116.2	A646 F647	A646-G650 PolarHBondContact O-N 2.82Å; F647-G650 PolarHBondContact O-N 3.17Å
651	D	83.4	Confident	88.7	Confident	7 Å²	7	30.7 Å²	30.7	4%	0.037	16%	0.156	C	C	.	.			trans	-91.2	116.8	179	-175.1	-63.1	0	0	0	111.6	L434 A623 F649 D653 A654 I655	L434-D651 WeakPolarHBondContact CD2-OD2 3.45Å; A623-D651 HydrophobicContact CB-CB 4.17Å; A623-D651 WeakPolarHBondContact CB-OD2 3.36Å; F649-D651 VanDerWaalsContact C-N 3.31Å; F649-D651 HydrophobicContact CD1-CB 3.61Å; F649-D651 HydrophobicContact CE1-CB 3.91Å; F649-D651 PolarHBondContact O-N 2.92Å; D651-D653 PolarHBondContact O-N 3.4Å; D651-D653 WeakPolarHBondContact OD1-CA 3.21Å; D651-D653 PolarHBondContact OD1-N 2.88Å; D651-A654 HydrophobicContact CB-CB 3.96Å; D651-A654 PolarHBondContact O-N 3.01Å; D651-A654 PolarHBondContact OD1-N 3.25Å; D651-I655 WeakPolarHBondContact O-CD1 3.33Å; D651-I655 VanDerWaalsContact O-CG1 3.29Å; D651-I655 WeakPolarHBondContact O-CG1 3.2Å; D651-I655 PolarHBondContact O-N 2.86Å
652	G	85.2	Confident	88.8	Confident	8 Å²	8	29 Å²	29	8%	0.082	15%	0.145	C	C	.	.	H	α-helix	trans	-67.8	-30	-175.9	0	0	0	0	0	115.6	C656	G652-C656 PolarHBondContact O-N 2.82Å; G652-C656 VanDerWaalsContact O-N 3.15Å; G652-C656 PolarHBondContact O-SG 3.48Å
653	D	82.5	Confident	88.7	Confident	93 Å²	93	31.9 Å²	31.9	50%	0.497	16%	0.158	S	C	.	.	H	α-helix	trans	-73.8	-39	175.6	-83.7	-0.9	0	0	0	109.6	D651 C656 C657	D651-D653 PolarHBondContact O-N 3.4Å; D651-D653 WeakPolarHBondContact OD1-CA 3.21Å; D651-D653 PolarHBondContact OD1-N 2.88Å; D653-C656 PolarHBondContact O-N 2.85Å; D653-C657 PolarHBondContact O-N 2.65Å; D653-C657 PolarHBondContact O-SG 3.49Å
654	A	87.8	Confident	88.4	Confident	0 Å²	0	34 Å²	34	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-64.3	-45	175.1	0	0	0	0	0	112.5	I619 I622 D651 C656 C657 V658	I619-A654 HydrophobicContact CG2-CB 4.12Å; I622-A654 HydrophobicContact CB-CB 4.19Å; I622-A654 HydrophobicContact CG2-CB 3.9Å; D651-A654 HydrophobicContact CB-CB 3.96Å; D651-A654 PolarHBondContact O-N 3.01Å; D651-A654 PolarHBondContact OD1-N 3.25Å; A654-C656 VanDerWaalsContact C-N 3.31Å; A654-C656 PolarHBondContact O-N 2.69Å; A654-C657 PolarHBondContact O-N 2.66Å; A654-V658 WeakPolarHBondContact O-CG2 3.49Å; A654-V658 PolarHBondContact O-N 3.01Å
655	I	90.2	Very high	88.1	Confident	2 Å²	2	31.5 Å²	31.5	1%	0.01	17%	0.17	C	C	.	.	H	α-helix	trans	-58.1	-43.8	174.2	-67.9	160.5	0	0	0	110.6	A646 F647 D651 V658 L659 H684	A646-I655 HydrophobicContact CB-CG1 3.76Å; A646-I655 WeakPolarHBondContact O-CG1 3.43Å; F647-I655 HydrophobicContact CD1-CD1 3.8Å; F647-I655 HydrophobicContact CD1-CG1 4.05Å; F647-I655 HydrophobicContact CD1-CG2 4.37Å; F647-I655 HydrophobicContact CE1-CD1 4.3Å; F647-I655 HydrophobicContact CE1-CG1 4.37Å; F647-I655 HydrophobicContact CE1-CG2 3.84Å; D651-I655 WeakPolarHBondContact O-CD1 3.33Å; D651-I655 VanDerWaalsContact O-CG1 3.29Å; D651-I655 WeakPolarHBondContact O-CG1 3.2Å; D651-I655 PolarHBondContact O-N 2.86Å; I655-V658 PolarHBondContact O-N 2.88Å; I655-L659 HydrophobicContact CG2-CD1 3.83Å; I655-L659 WeakPolarHBondContact O-CB 3.36Å; I655-L659 WeakPolarHBondContact O-CD1 3.23Å; I655-L659 WeakPolarHBondContact O-CG 3.29Å; I655-L659 PolarHBondContact O-N 2.88Å; I655-H684 HydrophobicContact CG2-CB 3.77Å
656	C	89.5	Confident	87.9	Confident	18 Å²	18	29.6 Å²	29.6	12%	0.122	16%	0.162	C	C	.	.	H	α-helix	trans	-66.7	-39.4	177	-66.3	0	0	0	0	112.8	G652 D653 A654 V658 L659 L660 M688	G652-C656 PolarHBondContact O-N 2.82Å; G652-C656 VanDerWaalsContact O-N 3.15Å; G652-C656 PolarHBondContact O-SG 3.48Å; D653-C656 PolarHBondContact O-N 2.85Å; A654-C656 VanDerWaalsContact C-N 3.31Å; A654-C656 PolarHBondContact O-N 2.69Å; C656-V658 PolarHBondContact O-N 3.06Å; C656-L659 PolarHBondContact O-N 3.13Å; C656-L660 WeakPolarHBondContact O-CD1 3.21Å; C656-L660 VanDerWaalsContact O-CG 3.3Å; C656-L660 WeakPolarHBondContact O-CG 3.41Å; C656-L660 PolarHBondContact O-N 3.03Å; C656-M688 HydrophobicContact CB-SD 4.03Å
657	C	87.9	Confident	87.7	Confident	19 Å²	19	30 Å²	30	13%	0.128	17%	0.166	C	C	.	.	H	α-helix	trans	-61.7	-41.7	175.7	-69.7	0	0	0	0	112.2	I622 D653 A654 F661	I622-C657 HydrophobicContact CG2-CB 4.03Å; D653-C657 PolarHBondContact O-N 2.65Å; D653-C657 PolarHBondContact O-SG 3.49Å; A654-C657 PolarHBondContact O-N 2.66Å; C657-F661 PolarHBondContact O-N 3.26Å
658	V	91	Very high	87.5	Confident	0 Å²	0	31.8 Å²	31.8	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-65.8	-46.7	174.5	176	0	0	0	0	110.6	I619 F630 L642 L643 A646 A654 I655 C656 L660 F661 L662	I619-V658 HydrophobicContact CD1-CG2 3.66Å; F630-V658 HydrophobicContact CE1-CG2 4.2Å; F630-V658 HydrophobicContact CZ-CG2 4.31Å; L642-V658 HydrophobicContact CD2-CG1 4.06Å; L642-V658 HydrophobicContact CD2-CG2 4.12Å; L642-V658 HydrophobicContact CG-CG1 4.09Å; L642-V658 HydrophobicContact CG-CG2 4Å; L643-V658 HydrophobicContact CB-CG1 4.07Å; L643-V658 HydrophobicContact CD1-CB 4.47Å; L643-V658 HydrophobicContact CD1-CG1 4Å; A646-V658 HydrophobicContact CB-CG2 4.25Å; A654-V658 WeakPolarHBondContact O-CG2 3.49Å; A654-V658 PolarHBondContact O-N 3.01Å; I655-V658 PolarHBondContact O-N 2.88Å; C656-V658 PolarHBondContact O-N 3.06Å; V658-L660 VanDerWaalsContact C-N 3.29Å; V658-L660 PolarHBondContact O-N 3.47Å; V658-F661 WeakPolarHBondContact O-CB 3.42Å; V658-F661 PolarHBondContact O-N 2.99Å; V658-L662 HydrophobicContact CG1-CD1 3.92Å; V658-L662 HydrophobicContact CG1-CG 4.04Å; V658-L662 WeakPolarHBondContact O-CG 3.49Å; V658-L662 PolarHBondContact O-N 2.73Å
659	L	91.7	Very high	87.4	Confident	0 Å²	0	28.4 Å²	28.4	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-56.4	-40.1	178.9	-77.1	162.8	0	0	0	113.3	L643 I655 C656 L662 E663 F671 L674 L675 A681 H684	L643-L659 HydrophobicContact CD1-CD2 4.33Å; L643-L659 HydrophobicContact CD1-CG 4.25Å; I655-L659 HydrophobicContact CG2-CD1 3.83Å; I655-L659 WeakPolarHBondContact O-CB 3.36Å; I655-L659 WeakPolarHBondContact O-CD1 3.23Å; I655-L659 WeakPolarHBondContact O-CG 3.29Å; I655-L659 PolarHBondContact O-N 2.88Å; C656-L659 PolarHBondContact O-N 3.13Å; L659-L662 PolarHBondContact O-N 3.1Å; L659-E663 WeakPolarHBondContact O-CB 3.34Å; L659-E663 PolarHBondContact O-N 2.86Å; L659-F671 HydrophobicContact CD2-CE2 4.15Å; L659-F671 HydrophobicContact CD2-CZ 4.44Å; L659-F671 WeakPolarHBondContact O-CE2 3.43Å; L659-L674 HydrophobicContact CD2-CD2 4.44Å; L659-L675 HydrophobicContact CD2-CD2 4.19Å; L659-A681 HydrophobicContact CD1-CB 4.4Å; L659-A681 HydrophobicContact CD2-CB 3.71Å; L659-H684 HydrophobicContact CD1-CB 3.91Å
660	L	88.8	Confident	87.3	Confident	42 Å²	42	24.5 Å²	24.5	22%	0.22	16%	0.156	C	C	.	.	H	α-helix	trans	-66.2	-37.5	175.5	-70.3	161.6	0	0	0	112.8	L248 C656 V658 G664 M688	L248-L660 HydrophobicContact CD1-CD1 4.16Å; L248-L660 HydrophobicContact CD2-CD1 3.78Å; L248-L660 HydrophobicContact CG-CD1 4.09Å; C656-L660 WeakPolarHBondContact O-CD1 3.21Å; C656-L660 VanDerWaalsContact O-CG 3.3Å; C656-L660 WeakPolarHBondContact O-CG 3.41Å; C656-L660 PolarHBondContact O-N 3.03Å; V658-L660 VanDerWaalsContact C-N 3.29Å; V658-L660 PolarHBondContact O-N 3.47Å; L660-G664 PolarHBondContact O-N 3.33Å; L660-M688 HydrophobicContact CD1-SD 3.76Å; L660-M688 HydrophobicContact CD2-CE 3.62Å; L660-M688 HydrophobicContact CD2-SD 3.77Å; L660-M688 HydrophobicContact CG-CE 4.03Å; L660-M688 HydrophobicContact CG-SD 3.67Å
661	F	88.1	Confident	87.7	Confident	31 Å²	31	24.6 Å²	24.6	14%	0.136	15%	0.154	C	C	.	.	H	α-helix	trans	-69.1	-39.7	174.3	161.9	-106.1	0	0	0	112.3	F630 C633 K639 L642 C657 V658 G664 T665	F630-F661 HydrophobicContact CB-CD1 4.08Å; F630-F661 HydrophobicContact CB-CD2 3.71Å; F630-F661 HydrophobicContact CB-CE1 3.85Å; F630-F661 HydrophobicContact CB-CE2 3.46Å; F630-F661 VanDerWaalsContact CB-CE2 3.46Å; F630-F661 HydrophobicContact CB-CG 4.01Å; F630-F661 HydrophobicContact CB-CZ 3.54Å; F630-F661 HydrophobicContact CD1-CD1 4.37Å; F630-F661 HydrophobicContact CD2-CB 3.57Å; F630-F661 HydrophobicContact CD2-CD1 4.01Å; F630-F661 AromaticContact CD2-CD2 3.56Å; F630-F661 HydrophobicContact CD2-CD2 3.56Å; F630-F661 HydrophobicContact CD2-CE2 4.25Å; F630-F661 AromaticContact CD2-CG 3.42Å; F630-F661 HydrophobicContact CD2-CG 3.42Å; F630-F661 VanDerWaalsContact CD2-CG 3.42Å; F630-F661 HydrophobicContact CE2-CB 3.56Å; F630-F661 HydrophobicContact CE2-CD2 4.44Å; F630-F661 AromaticContact CE2-CG 3.94Å; F630-F661 HydrophobicContact CE2-CG 3.94Å; F630-F661 HydrophobicContact CG-CB 4.35Å; F630-F661 AromaticContact CG-CD1 3.93Å; F630-F661 HydrophobicContact CG-CD1 3.93Å; F630-F661 AromaticContact CG-CD2 3.91Å; F630-F661 HydrophobicContact CG-CD2 3.91Å; F630-F661 HydrophobicContact CG-CE1 4.18Å; F630-F661 HydrophobicContact CG-CE2 4.17Å; F630-F661 AromaticContact CG-CG 3.78Å; F630-F661 HydrophobicContact CG-CG 3.78Å; F630-F661 HydrophobicContact CG-CZ 4.3Å; F630-F661 HydrophobicContact CZ-CB 4.35Å; C633-F661 HydrophobicContact CB-CE1 4.24Å; C633-F661 HydrophobicContact CB-CZ 4.37Å; K639-F661 HydrophobicContact CG-CE1 4.15Å; L642-F661 HydrophobicContact CD2-CD1 4.26Å; L642-F661 HydrophobicContact CD2-CE1 4.22Å; C657-F661 PolarHBondContact O-N 3.26Å; V658-F661 WeakPolarHBondContact O-CB 3.42Å; V658-F661 PolarHBondContact O-N 2.99Å; F661-G664 PolarHBondContact O-N 3Å; F661-T665 HydrophobicContact CD2-CG2 3.9Å; F661-T665 HydrophobicContact CE2-CG2 3.67Å; F661-T665 HydrophobicContact CZ-CG2 4.43Å; F661-T665 WeakPolarHBondContact O-CB 3.4Å; F661-T665 WeakPolarHBondContact O-CG2 3.45Å; F661-T665 PolarHBondContact O-N 3.14Å; F661-T665 PolarHBondContact O-OG1 2.99Å
662	L	90.5	Very high	88.1	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-63.5	-48.5	175.2	-66.3	-179.1	0	0	0	110.9	K639 L643 V658 L659 G664 T665 L666 F671 L674	K639-L662 HydrophobicContact CB-CD2 3.53Å; K639-L662 HydrophobicContact CD-CD2 4.12Å; K639-L662 HydrophobicContact CG-CD2 3.85Å; L643-L662 HydrophobicContact CB-CD1 4.15Å; L643-L662 HydrophobicContact CD1-CD1 4.39Å; L643-L662 HydrophobicContact CD2-CD1 3.97Å; L643-L662 HydrophobicContact CG-CD1 4.4Å; V658-L662 HydrophobicContact CG1-CD1 3.92Å; V658-L662 HydrophobicContact CG1-CG 4.04Å; V658-L662 WeakPolarHBondContact O-CG 3.49Å; V658-L662 PolarHBondContact O-N 2.73Å; L659-L662 PolarHBondContact O-N 3.1Å; L662-G664 VanDerWaalsContact C-N 3.33Å; L662-G664 PolarHBondContact O-N 2.9Å; L662-T665 PolarHBondContact O-N 3Å; L662-L666 HydrophobicContact CB-CD1 4.06Å; L662-L666 HydrophobicContact CD2-CD1 4.31Å; L662-L666 VanDerWaalsContact O-CB 3.24Å; L662-L666 WeakPolarHBondContact O-CB 3.38Å; L662-L666 VanDerWaalsContact O-CG 3.32Å; L662-L666 WeakPolarHBondContact O-CG 3.11Å; L662-L666 PolarHBondContact O-N 2.73Å; L662-F671 HydrophobicContact CB-CD2 4.12Å; L662-F671 HydrophobicContact CB-CE2 4.15Å; L662-L674 HydrophobicContact CD1-CD1 3.9Å; L662-L674 HydrophobicContact CD1-CD2 4.48Å
663	E	89.4	Confident	88.3	Confident	60 Å²	60	33.1 Å²	33.1	28%	0.28	19%	0.186	S	C	.	.	H	α-helix	trans	-56.2	-45.2	173.8	175.6	168.5	-125.5	0	0	112.6	L659 T665 F671 Y685 K697	L659-E663 WeakPolarHBondContact O-CB 3.34Å; L659-E663 PolarHBondContact O-N 2.86Å; E663-T665 PolarHBondContact O-N 3.4Å; E663-F671 HydrophobicContact CB-CD1 4.18Å; E663-F671 HydrophobicContact CB-CD2 4.2Å; E663-F671 HydrophobicContact CB-CE1 3.93Å; E663-F671 HydrophobicContact CB-CE2 3.96Å; E663-F671 HydrophobicContact CB-CG 4.32Å; E663-F671 HydrophobicContact CB-CZ 3.82Å; E663-F671 HydrophobicContact CG-CD1 4.34Å; E663-F671 HydrophobicContact CG-CE1 4.22Å; E663-Y685 PolarHBondContact OE1-OH 3.28Å; E663-K697 WeakPolarHBondContact OE1-CE 3.43Å; E663-K697 IonicContact OE1-NZ 2.66Å; E663-K697 PolarHBondContact OE1-NZ 3.02Å; E663-K697 IonicContact OE2-NZ 3.8Å; E663-K697 PolarHBondContact OE2-NZ 3.38Å
664	G	85	Confident	88.8	Confident	45 Å²	45	28.8 Å²	28.8	46%	0.464	16%	0.163	S	C	.	.	H	α-helix	trans	-71.9	-10.1	-177.9	0	0	0	0	0	115.3	S495 L660 F661 L662	S495-G664 PolarHBondContact OG-O 3.44Å; L660-G664 PolarHBondContact O-N 3.33Å; F661-G664 PolarHBondContact O-N 3Å; L662-G664 VanDerWaalsContact C-N 3.33Å; L662-G664 PolarHBondContact O-N 2.9Å
665	T	85.4	Confident	89.1	Confident	21 Å²	21	28.9 Å²	28.9	13%	0.129	16%	0.164	C	C	.	.	H	α-helix	trans	-128.6	-20	-173.6	64.3	0	0	0	0	115.6	T494 K639 F661 L662 E663	T494-T665 PolarHBondContact N-O 3.42Å; K639-T665 VanDerWaalsContact NZ-CB 3.34Å; K639-T665 PolarHBondContact NZ-OG1 2.66Å; F661-T665 HydrophobicContact CD2-CG2 3.9Å; F661-T665 HydrophobicContact CE2-CG2 3.67Å; F661-T665 HydrophobicContact CZ-CG2 4.43Å; F661-T665 WeakPolarHBondContact O-CB 3.4Å; F661-T665 WeakPolarHBondContact O-CG2 3.45Å; F661-T665 PolarHBondContact O-N 3.14Å; F661-T665 PolarHBondContact O-OG1 2.99Å; L662-T665 PolarHBondContact O-N 3Å; E663-T665 PolarHBondContact O-N 3.4Å
666	L	86.1	Confident	89.2	Confident	8 Å²	8	33.6 Å²	33.6	4%	0.042	19%	0.188	C	C	.	.	B	Isolated β-bridge	trans	-86.6	166	175.7	-67.2	177.3	0	0	0	112.2	W492 T494 K639 L662 A670 F671 L674	W492-L666 CarbonylContact O-C 3.45Å; W492-L666 WeakPolarHBondContact O-CA 3.34Å; T494-L666 PolarHBondContact OG1-O 3.47Å; K639-L666 HydrophobicContact CD-CD2 3.81Å; K639-L666 HydrophobicContact CD-CG 4.39Å; L662-L666 HydrophobicContact CB-CD1 4.06Å; L662-L666 HydrophobicContact CD2-CD1 4.31Å; L662-L666 VanDerWaalsContact O-CB 3.24Å; L662-L666 WeakPolarHBondContact O-CB 3.38Å; L662-L666 VanDerWaalsContact O-CG 3.32Å; L662-L666 WeakPolarHBondContact O-CG 3.11Å; L662-L666 PolarHBondContact O-N 2.73Å; L666-A670 HydrophobicContact CB-CB 4.25Å; L666-F671 HydrophobicContact CB-CB 4.47Å; L666-L674 HydrophobicContact CD1-CD1 4.36Å
667	A	85.2	Confident	89.2	Confident	9 Å²	9	35.1 Å²	35.1	7%	0.074	19%	0.193	C	C	.	.			trans	-66.6	142.8	163.8	0	0	0	0	0	111	W492 T494 S669 A670 F671	W492-A667 PolarHBondContact O-N 3.05Å; T494-A667 HydrophobicContact CG2-CB 3.87Å; A667-S669 PolarHBondContact O-N 3.23Å; A667-S669 VanDerWaalsContact O-N 3.13Å; A667-A670 HydrophobicContact CB-CB 4.13Å; A667-A670 WeakPolarHBondContact O-CA 3.49Å; A667-A670 VanDerWaalsContact O-CB 3.29Å; A667-A670 WeakPolarHBondContact O-CB 3.31Å; A667-A670 PolarHBondContact O-N 3.04Å; A667-F671 PolarHBondContact O-N 3.09Å
668	P	86.5	Confident	89.3	Confident	85 Å²	85	36.2 Å²	36.2	55%	0.552	20%	0.195	S	C	*	.	H	α-helix	trans	-58.3	-28.1	177.8	-28.1	35.9	0	0	0	114.2	R672	P668-R672 WeakPolarHBondContact O-CB 3.42Å; P668-R672 VanDerWaalsContact O-CG 3.23Å; P668-R672 WeakPolarHBondContact O-CG 3.47Å; P668-R672 VanDerWaalsContact O-CZ 3.23Å; P668-R672 PolarHBondContact O-N 3.3Å; P668-R672 PolarHBondContact O-NE 2.67Å; P668-R672 PolarHBondContact O-NH1 2.87Å
669	S	87.9	Confident	89.1	Confident	58 Å²	58	39.3 Å²	39.3	41%	0.406	22%	0.217	S	C	.	.	H	α-helix	trans	-65	-45.6	169.7	39.9	0	0	0	0	112.3	A667 R672 Q673	A667-S669 PolarHBondContact O-N 3.23Å; A667-S669 VanDerWaalsContact O-N 3.13Å; S669-R672 PolarHBondContact O-N 3.31Å; S669-Q673 PolarHBondContact O-N 3.46Å
670	A	87.6	Confident	88.9	Confident	1 Å²	1	45.7 Å²	45.7	1%	0.008	24%	0.242	C	C	.	.	H	α-helix	trans	-65.7	-46.1	-178.8	0	0	0	0	0	112.2	W492 L666 A667 R672 Q673 L674	W492-A670 HydrophobicContact CE3-CB 3.38Å; W492-A670 HydrophobicContact CZ3-CB 3.64Å; L666-A670 HydrophobicContact CB-CB 4.25Å; A667-A670 HydrophobicContact CB-CB 4.13Å; A667-A670 WeakPolarHBondContact O-CA 3.49Å; A667-A670 VanDerWaalsContact O-CB 3.29Å; A667-A670 WeakPolarHBondContact O-CB 3.31Å; A667-A670 PolarHBondContact O-N 3.04Å; A670-R672 VanDerWaalsContact C-N 3.32Å; A670-R672 PolarHBondContact O-N 3.14Å; A670-Q673 PolarHBondContact O-N 3.11Å; A670-L674 WeakPolarHBondContact O-CB 3.12Å; A670-L674 PolarHBondContact O-N 3.44Å
671	F	92.3	Very high	89.1	Confident	10 Å²	10	43.7 Å²	43.7	4%	0.044	23%	0.232	C	C	.	.	H	α-helix	trans	-62.3	-40.1	176.3	-175.6	-111.9	0	0	0	111.5	L659 L662 E663 L666 A667 L674 L675 Y685	L659-F671 HydrophobicContact CD2-CE2 4.15Å; L659-F671 HydrophobicContact CD2-CZ 4.44Å; L659-F671 WeakPolarHBondContact O-CE2 3.43Å; L662-F671 HydrophobicContact CB-CD2 4.12Å; L662-F671 HydrophobicContact CB-CE2 4.15Å; E663-F671 HydrophobicContact CB-CD1 4.18Å; E663-F671 HydrophobicContact CB-CD2 4.2Å; E663-F671 HydrophobicContact CB-CE1 3.93Å; E663-F671 HydrophobicContact CB-CE2 3.96Å; E663-F671 HydrophobicContact CB-CG 4.32Å; E663-F671 HydrophobicContact CB-CZ 3.82Å; E663-F671 HydrophobicContact CG-CD1 4.34Å; E663-F671 HydrophobicContact CG-CE1 4.22Å; L666-F671 HydrophobicContact CB-CB 4.47Å; A667-F671 PolarHBondContact O-N 3.09Å; F671-L674 PolarHBondContact O-N 3.17Å; F671-L675 HydrophobicContact CD1-CD1 4.11Å; F671-L675 HydrophobicContact CE1-CD1 3.67Å; F671-L675 HydrophobicContact CE1-CG 4.23Å; F671-L675 HydrophobicContact CZ-CD1 4.07Å; F671-L675 HydrophobicContact CZ-CD2 4.17Å; F671-L675 HydrophobicContact CZ-CG 4.23Å; F671-L675 WeakPolarHBondContact O-CG 3.25Å; F671-L675 PolarHBondContact O-N 3.3Å; F671-Y685 HydrophobicContact CE1-CD1 4.5Å; F671-Y685 HydrophobicContact CE1-CD2 4.44Å; F671-Y685 AromaticContact CE1-CE1 3.95Å; F671-Y685 HydrophobicContact CE1-CE1 3.95Å; F671-Y685 AromaticContact CE1-CE2 3.91Å; F671-Y685 HydrophobicContact CE1-CE2 3.91Å; F671-Y685 AromaticContact CE1-CZ 3.67Å; F671-Y685 AromaticContact CZ-CD2 3.97Å; F671-Y685 HydrophobicContact CZ-CD2 3.97Å; F671-Y685 HydrophobicContact CZ-CE1 4.37Å; F671-Y685 AromaticContact CZ-CE2 3.78Å; F671-Y685 HydrophobicContact CZ-CE2 3.78Å; F671-Y685 HydrophobicContact CZ-CG 4.39Å
672	R	91	Very high	89.3	Confident	118 Å²	118	42.5 Å²	42.5	45%	0.445	23%	0.227	S	C	.	.	H	α-helix	trans	-64.9	-37.9	173.3	-73.4	-169	-57.6	-92.9	0.5	113.3	P668 S669 A670 L675 L676 L704	P668-R672 WeakPolarHBondContact O-CB 3.42Å; P668-R672 VanDerWaalsContact O-CG 3.23Å; P668-R672 WeakPolarHBondContact O-CG 3.47Å; P668-R672 VanDerWaalsContact O-CZ 3.23Å; P668-R672 PolarHBondContact O-N 3.3Å; P668-R672 PolarHBondContact O-NE 2.67Å; P668-R672 PolarHBondContact O-NH1 2.87Å; S669-R672 PolarHBondContact O-N 3.31Å; A670-R672 VanDerWaalsContact C-N 3.32Å; A670-R672 PolarHBondContact O-N 3.14Å; R672-L675 PolarHBondContact O-N 3.4Å; R672-L676 WeakPolarHBondContact O-CG 3.41Å; R672-L676 PolarHBondContact O-N 3.45Å; R672-L676 VanDerWaalsContact O-N 3.16Å; R672-L704 HydrophobicContact CB-CD1 4.18Å; R672-L704 HydrophobicContact CB-CD2 3.64Å; R672-L704 HydrophobicContact CG-CD1 4.48Å; R672-L704 HydrophobicContact CG-CD2 3.6Å
673	Q	90.7	Very high	89.3	Confident	75 Å²	75	47.9 Å²	47.9	35%	0.35	25%	0.251	S	S	.	.	H	α-helix	trans	-64.5	-44.4	174.5	-177.8	171.6	-13.7	0	0	111.2	S669 A670 L675 L676 E677	S669-Q673 PolarHBondContact O-N 3.46Å; A670-Q673 PolarHBondContact O-N 3.11Å; Q673-L675 VanDerWaalsContact C-N 3.33Å; Q673-L675 PolarHBondContact O-N 2.83Å; Q673-L676 WeakPolarHBondContact O-CB 3.41Å; Q673-L676 PolarHBondContact O-N 3.24Å; Q673-L676 VanDerWaalsContact O-N 3.07Å; Q673-E677 WeakPolarHBondContact O-CB 3.39Å; Q673-E677 PolarHBondContact O-N 2.98Å
674	L	92.7	Very high	89.4	Confident	2 Å²	2	45.2 Å²	45.2	1%	0.01	24%	0.238	C	C	.	.	H	α-helix	trans	-59.7	-39.6	174.9	177.7	153.3	0	0	0	112.3	V640 L643 L659 L662 L666 A670 F671 L676 E677 Y678 A681	V640-L674 HydrophobicContact CG2-CD1 4.3Å; L643-L674 HydrophobicContact CD2-CD1 4.14Å; L643-L674 HydrophobicContact CD2-CD2 3.81Å; L643-L674 HydrophobicContact CD2-CG 4.23Å; L659-L674 HydrophobicContact CD2-CD2 4.44Å; L662-L674 HydrophobicContact CD1-CD1 3.9Å; L662-L674 HydrophobicContact CD1-CD2 4.48Å; L666-L674 HydrophobicContact CD1-CD1 4.36Å; A670-L674 WeakPolarHBondContact O-CB 3.12Å; A670-L674 PolarHBondContact O-N 3.44Å; F671-L674 PolarHBondContact O-N 3.17Å; L674-L676 VanDerWaalsContact C-N 3.32Å; L674-L676 PolarHBondContact O-N 3.09Å; L674-E677 PolarHBondContact O-N 2.94Å; L674-Y678 HydrophobicContact CG-CD2 4.16Å; L674-Y678 WeakPolarHBondContact O-CB 3.47Å; L674-Y678 PolarHBondContact O-N 2.78Å; L674-A681 HydrophobicContact CD2-CB 4.46Å
675	L	93.2	Very high	89.8	Confident	3 Å²	3	43.2 Å²	43.2	2%	0.016	22%	0.217	C	C	.	.	H	α-helix	trans	-67.9	-28.6	174.6	-68	178.7	0	0	0	113.3	L659 F671 R672 Q673 A681 A682 Y685	L659-L675 HydrophobicContact CD2-CD2 4.19Å; F671-L675 HydrophobicContact CD1-CD1 4.11Å; F671-L675 HydrophobicContact CE1-CD1 3.67Å; F671-L675 HydrophobicContact CE1-CG 4.23Å; F671-L675 HydrophobicContact CZ-CD1 4.07Å; F671-L675 HydrophobicContact CZ-CD2 4.17Å; F671-L675 HydrophobicContact CZ-CG 4.23Å; F671-L675 WeakPolarHBondContact O-CG 3.25Å; F671-L675 PolarHBondContact O-N 3.3Å; R672-L675 PolarHBondContact O-N 3.4Å; Q673-L675 VanDerWaalsContact C-N 3.33Å; Q673-L675 PolarHBondContact O-N 2.83Å; L675-A681 HydrophobicContact CD2-CB 4.26Å; L675-A682 WeakPolarHBondContact O-CB 3.42Å; L675-Y685 HydrophobicContact CD1-CD1 3.5Å; L675-Y685 VanDerWaalsContact CD1-CD1 3.5Å; L675-Y685 HydrophobicContact CD1-CE1 3.68Å; L675-Y685 HydrophobicContact CD1-CG 4.32Å; L675-Y685 HydrophobicContact CD2-CD1 4.04Å; L675-Y685 HydrophobicContact CD2-CG 4.11Å; L675-Y685 HydrophobicContact CG-CD1 4.44Å
676	L	91.9	Very high	90.1	Very high	101 Å²	101	42.7 Å²	42.7	53%	0.529	21%	0.213	S	C	.	.	H	α-helix	trans	-76.3	-35.1	174	-72.6	169.6	0	0	0	112.3	R672 Q673 L674 L704 L705	R672-L676 WeakPolarHBondContact O-CG 3.41Å; R672-L676 PolarHBondContact O-N 3.45Å; R672-L676 VanDerWaalsContact O-N 3.16Å; Q673-L676 WeakPolarHBondContact O-CB 3.41Å; Q673-L676 PolarHBondContact O-N 3.24Å; Q673-L676 VanDerWaalsContact O-N 3.07Å; L674-L676 VanDerWaalsContact C-N 3.32Å; L674-L676 PolarHBondContact O-N 3.09Å; L676-L704 HydrophobicContact CD1-CD1 3.88Å; L676-L704 HydrophobicContact CD1-CG 4.46Å; L676-L704 HydrophobicContact CD2-CD1 4.37Å; L676-L704 HydrophobicContact CD2-CG 4.19Å; L676-L704 HydrophobicContact CG-CD1 4.18Å; L676-L704 HydrophobicContact CG-CG 4.21Å; L676-L705 HydrophobicContact CD2-CD2 4.45Å
677	E	90.1	Very high	90.2	Very high	49 Å²	49	44 Å²	44	23%	0.229	22%	0.219	C	C	.	.	H	α-helix	trans	-76.7	-43.7	-179.6	-171.2	168.4	-144.5	0	0	111.6	P480 Q673 L674	P480-E677 HydrophobicContact CB-CG 4.3Å; P480-E677 HydrophobicContact CG-CG 4.03Å; Q673-E677 WeakPolarHBondContact O-CB 3.39Å; Q673-E677 PolarHBondContact O-N 2.98Å; L674-E677 PolarHBondContact O-N 2.94Å
678	Y	90.5	Very high	90.5	Very high	42 Å²	42	44.1 Å²	44.1	17%	0.165	22%	0.218	C	C	.	.			trans	-105	83.9	-177.6	-65.4	-95.5	0	0	0	111.2	V640 E644 F647 L674 Y680 A681 A682	V640-Y678 HydrophobicContact CG1-CE2 4.32Å; V640-Y678 WeakPolarHBondContact CG1-OH 3.25Å; E644-Y678 HydrophobicContact CG-CE1 4.1Å; E644-Y678 PolarHBondContact OE1-OH 3.4Å; F647-Y678 AromaticContact CE2-CD1 3.88Å; F647-Y678 HydrophobicContact CE2-CD1 3.88Å; F647-Y678 HydrophobicContact CE2-CG 4.48Å; L674-Y678 HydrophobicContact CG-CD2 4.16Å; L674-Y678 WeakPolarHBondContact O-CB 3.47Å; L674-Y678 PolarHBondContact O-N 2.78Å; Y678-Y680 PolarHBondContact O-N 3.11Å; Y678-Y680 VanDerWaalsContact O-N 3.11Å; Y678-A681 WeakPolarHBondContact O-CA 3.33Å; Y678-A681 VanDerWaalsContact O-CB 3.29Å; Y678-A681 WeakPolarHBondContact O-CB 3.3Å; Y678-A681 PolarHBondContact O-N 3.34Å; Y678-A682 PolarHBondContact O-N 3.22Å; Y678-A682 VanDerWaalsContact O-N 3.1Å
679	S	87	Confident	90.7	Very high	66 Å²	66	40.1 Å²	40.1	46%	0.462	19%	0.192	S	C	.	.	H	α-helix	trans	-58	-26.9	-177.8	67.5	0	0	0	0	114.7	A682 K683	S679-A682 WeakPolarHBondContact O-CB 3.39Å; S679-A682 PolarHBondContact O-N 2.88Å; S679-K683 WeakPolarHBondContact O-CG 3.33Å; S679-K683 PolarHBondContact O-N 3.48Å; S679-K683 VanDerWaalsContact O-N 3.13Å
680	Y	87.1	Confident	90.7	Very high	133 Å²	133	39.7 Å²	39.7	52%	0.522	18%	0.182	S	C	.	.	H	α-helix	trans	-70.1	-40.8	171.8	-63.9	-80.9	0	0	0	112.1	Y678 A682 K683 H684	Y678-Y680 PolarHBondContact O-N 3.11Å; Y678-Y680 VanDerWaalsContact O-N 3.11Å; Y680-A682 VanDerWaalsContact C-N 3.3Å; Y680-A682 PolarHBondContact O-N 3.48Å; Y680-K683 PolarHBondContact O-N 3.01Å; Y680-H684 PolarHBondContact O-CD2 3.16Å; Y680-H684 PolarHBondContact O-N 3.17Å; Y680-H684 VanDerWaalsContact O-N 3.08Å
681	A	92.1	Very high	90.6	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-59.1	-43.3	171.2	0	0	0	0	0	110.9	L643 F647 L659 L674 L675 Y678 K683 H684 Y685	L643-A681 HydrophobicContact CD2-CB 4.27Å; F647-A681 HydrophobicContact CE1-CB 4.49Å; F647-A681 HydrophobicContact CZ-CB 3.7Å; L659-A681 HydrophobicContact CD1-CB 4.4Å; L659-A681 HydrophobicContact CD2-CB 3.71Å; L674-A681 HydrophobicContact CD2-CB 4.46Å; L675-A681 HydrophobicContact CD2-CB 4.26Å; Y678-A681 WeakPolarHBondContact O-CA 3.33Å; Y678-A681 VanDerWaalsContact O-CB 3.29Å; Y678-A681 WeakPolarHBondContact O-CB 3.3Å; Y678-A681 PolarHBondContact O-N 3.34Å; A681-K683 PolarHBondContact O-N 3.16Å; A681-H684 PolarHBondContact O-N 3.22Å; A681-Y685 WeakPolarHBondContact O-CB 3.19Å; A681-Y685 PolarHBondContact O-N 2.97Å
682	A	92.8	Very high	90.3	Very high	6 Å²	6	43.5 Å²	43.5	5%	0.05	20%	0.2	C	C	.	.	H	α-helix	trans	-57.2	-44.5	175.3	0	0	0	0	0	112.9	L675 Y678 S679 Y680 Y685 V686 L705	L675-A682 WeakPolarHBondContact O-CB 3.42Å; Y678-A682 PolarHBondContact O-N 3.22Å; Y678-A682 VanDerWaalsContact O-N 3.1Å; S679-A682 WeakPolarHBondContact O-CB 3.39Å; S679-A682 PolarHBondContact O-N 2.88Å; Y680-A682 VanDerWaalsContact C-N 3.3Å; Y680-A682 PolarHBondContact O-N 3.48Å; A682-Y685 PolarHBondContact O-N 2.98Å; A682-V686 WeakPolarHBondContact O-CB 3.23Å; A682-V686 VanDerWaalsContact O-CG2 3.3Å; A682-V686 WeakPolarHBondContact O-CG2 3.4Å; A682-V686 PolarHBondContact O-N 3Å; A682-L705 HydrophobicContact CB-CD1 3.8Å; A682-L705 HydrophobicContact CB-CD2 3.6Å; A682-L705 HydrophobicContact CB-CG 4.36Å
683	K	91.3	Very high	90	Very high	113 Å²	113	45.6 Å²	45.6	49%	0.491	22%	0.215	S	C	.	.	H	α-helix	trans	-60.8	-50.7	175.7	-70.8	173	-177.5	176.8	0	112.3	S679 Y680 A681 Y685 V686 F687	S679-K683 WeakPolarHBondContact O-CG 3.33Å; S679-K683 PolarHBondContact O-N 3.48Å; S679-K683 VanDerWaalsContact O-N 3.13Å; Y680-K683 PolarHBondContact O-N 3.01Å; A681-K683 PolarHBondContact O-N 3.16Å; K683-Y685 VanDerWaalsContact C-N 3.33Å; K683-Y685 PolarHBondContact O-N 3.04Å; K683-V686 PolarHBondContact O-N 3.01Å; K683-F687 WeakPolarHBondContact O-CB 3.4Å; K683-F687 PolarHBondContact O-N 3.18Å
684	H	90.2	Very high	89.9	Confident	4 Å²	4	42.9 Å²	42.9	2%	0.019	20%	0.203	C	C	.	.	H	α-helix	trans	-60.6	-42.7	177.5	-83	-92.9	0	0	0	111.8	Y424 I655 L659 Y680 A681 F687 M688	Y424-H684 AromaticContact CE1-CE1 3.52Å; Y424-H684 AromaticContact CE1-NE2 3.6Å; Y424-H684 AromaticContact CZ-NE2 3.95Å; Y424-H684 PolarHBondContact OH-CD2 3.3Å; Y424-H684 VanDerWaalsContact OH-CD2 3.26Å; Y424-H684 PolarHBondContact OH-NE2 2.92Å; I655-H684 HydrophobicContact CG2-CB 3.77Å; L659-H684 HydrophobicContact CD1-CB 3.91Å; Y680-H684 PolarHBondContact O-CD2 3.16Å; Y680-H684 PolarHBondContact O-N 3.17Å; Y680-H684 VanDerWaalsContact O-N 3.08Å; A681-H684 PolarHBondContact O-N 3.22Å; H684-F687 PolarHBondContact O-N 3.02Å; H684-M688 WeakPolarHBondContact O-CB 3.49Å; H684-M688 PolarHBondContact O-N 2.88Å
685	Y	93.5	Very high	89.6	Confident	4 Å²	4	45.1 Å²	45.1	2%	0.016	22%	0.217	C	C	.	.	H	α-helix	trans	-66.2	-45.9	179.6	-173.2	-114.3	0	0	0	112	E663 F671 L675 A681 A682 K683 F687 M688 L689 K697 T701	E663-Y685 PolarHBondContact OE1-OH 3.28Å; F671-Y685 HydrophobicContact CE1-CD1 4.5Å; F671-Y685 HydrophobicContact CE1-CD2 4.44Å; F671-Y685 AromaticContact CE1-CE1 3.95Å; F671-Y685 HydrophobicContact CE1-CE1 3.95Å; F671-Y685 AromaticContact CE1-CE2 3.91Å; F671-Y685 HydrophobicContact CE1-CE2 3.91Å; F671-Y685 AromaticContact CE1-CZ 3.67Å; F671-Y685 AromaticContact CZ-CD2 3.97Å; F671-Y685 HydrophobicContact CZ-CD2 3.97Å; F671-Y685 HydrophobicContact CZ-CE1 4.37Å; F671-Y685 AromaticContact CZ-CE2 3.78Å; F671-Y685 HydrophobicContact CZ-CE2 3.78Å; F671-Y685 HydrophobicContact CZ-CG 4.39Å; L675-Y685 HydrophobicContact CD1-CD1 3.5Å; L675-Y685 VanDerWaalsContact CD1-CD1 3.5Å; L675-Y685 HydrophobicContact CD1-CE1 3.68Å; L675-Y685 HydrophobicContact CD1-CG 4.32Å; L675-Y685 HydrophobicContact CD2-CD1 4.04Å; L675-Y685 HydrophobicContact CD2-CG 4.11Å; L675-Y685 HydrophobicContact CG-CD1 4.44Å; A681-Y685 WeakPolarHBondContact O-CB 3.19Å; A681-Y685 PolarHBondContact O-N 2.97Å; A682-Y685 PolarHBondContact O-N 2.98Å; K683-Y685 VanDerWaalsContact C-N 3.33Å; K683-Y685 PolarHBondContact O-N 3.04Å; Y685-F687 PolarHBondContact O-N 3.17Å; Y685-M688 HydrophobicContact CD2-CE 3.47Å; Y685-M688 VanDerWaalsContact CD2-CE 3.47Å; Y685-M688 HydrophobicContact CE2-CE 3.52Å; Y685-M688 PolarHBondContact O-N 3.46Å; Y685-L689 HydrophobicContact CD1-CD1 4.08Å; Y685-L689 HydrophobicContact CE1-CD1 3.57Å; Y685-L689 HydrophobicContact CE1-CG 4.22Å; Y685-L689 HydrophobicContact CE2-CD2 4.26Å; Y685-L689 HydrophobicContact CE2-CG 4.33Å; Y685-L689 WeakPolarHBondContact O-CG 3.14Å; Y685-L689 PolarHBondContact O-N 3.26Å; Y685-K697 WeakPolarHBondContact OH-CE 3.35Å; Y685-K697 PolarHBondContact OH-NZ 3.28Å; Y685-T701 HydrophobicContact CD1-CG2 3.7Å; Y685-T701 HydrophobicContact CE1-CG2 3.83Å; Y685-T701 WeakPolarHBondContact CE1-OG1 3.03Å
686	V	91.9	Very high	89.5	Confident	9 Å²	9	50.1 Å²	50.1	6%	0.055	24%	0.24	C	C	.	.	H	α-helix	trans	-59.5	-44	173.3	163.5	0	0	0	0	111.4	A682 K683 L689 R690 L698 T701 L702 L705	A682-V686 WeakPolarHBondContact O-CB 3.23Å; A682-V686 VanDerWaalsContact O-CG2 3.3Å; A682-V686 WeakPolarHBondContact O-CG2 3.4Å; A682-V686 PolarHBondContact O-N 3Å; K683-V686 PolarHBondContact O-N 3.01Å; V686-L689 PolarHBondContact O-N 3.48Å; V686-R690 WeakPolarHBondContact O-CG 3.4Å; V686-R690 PolarHBondContact O-N 2.87Å; V686-L698 HydrophobicContact CG1-CD1 3.97Å; V686-T701 HydrophobicContact CG2-CG2 3.78Å; V686-L702 HydrophobicContact CG1-CD2 4.01Å; V686-L702 HydrophobicContact CG2-CD2 3.99Å; V686-L705 HydrophobicContact CG2-CD1 3.77Å
687	F	89.5	Confident	89.4	Confident	36 Å²	36	47.8 Å²	47.8	16%	0.158	23%	0.226	C	C	.	.	H	α-helix	trans	-60.9	-47.8	175	179.7	-94.1	0	0	0	111.6	K683 H684 Y685 L689 R690 Q691	K683-F687 WeakPolarHBondContact O-CB 3.4Å; K683-F687 PolarHBondContact O-N 3.18Å; H684-F687 PolarHBondContact O-N 3.02Å; Y685-F687 PolarHBondContact O-N 3.17Å; F687-L689 PolarHBondContact O-N 3.42Å; F687-R690 WeakPolarHBondContact O-CB 3.44Å; F687-R690 PolarHBondContact O-N 3.03Å; F687-R690 VanDerWaalsContact O-N 3.17Å; F687-Q691 HydrophobicContact CD1-CG 4.14Å; F687-Q691 HydrophobicContact CE1-CG 3.77Å; F687-Q691 HydrophobicContact CZ-CG 4.04Å; F687-Q691 WeakPolarHBondContact O-CG 3.42Å; F687-Q691 PolarHBondContact O-N 3.38Å
688	M	90	Very high	89.6	Confident	12 Å²	12	45.9 Å²	45.9	6%	0.059	22%	0.217	C	C	.	.	H	α-helix	trans	-58.7	-44.5	176.5	-176.7	-170.2	72.2	0	0	111.9	C656 L660 H684 Y685 R690 Q691 L692	C656-M688 HydrophobicContact CB-SD 4.03Å; L660-M688 HydrophobicContact CD1-SD 3.76Å; L660-M688 HydrophobicContact CD2-CE 3.62Å; L660-M688 HydrophobicContact CD2-SD 3.77Å; L660-M688 HydrophobicContact CG-CE 4.03Å; L660-M688 HydrophobicContact CG-SD 3.67Å; H684-M688 WeakPolarHBondContact O-CB 3.49Å; H684-M688 PolarHBondContact O-N 2.88Å; Y685-M688 HydrophobicContact CD2-CE 3.47Å; Y685-M688 VanDerWaalsContact CD2-CE 3.47Å; Y685-M688 HydrophobicContact CE2-CE 3.52Å; Y685-M688 PolarHBondContact O-N 3.46Å; M688-R690 VanDerWaalsContact C-N 3.33Å; M688-R690 PolarHBondContact O-N 3.46Å; M688-Q691 PolarHBondContact O-N 2.94Å; M688-L692 HydrophobicContact CE-CD1 4.45Å; M688-L692 HydrophobicContact CG-CD1 3.87Å; M688-L692 HydrophobicContact CG-CG 4.42Å; M688-L692 WeakPolarHBondContact O-CB 3.47Å; M688-L692 VanDerWaalsContact O-CG 3.31Å; M688-L692 WeakPolarHBondContact O-CG 3.32Å; M688-L692 PolarHBondContact O-N 3Å; M688-L692 HydrophobicContact SD-CD1 4.44Å
689	L	91	Very high	89.6	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-63.8	-36	176.8	-67.7	-177.5	0	0	0	112.5	Y685 V686 F687 L692 E693 D694 K697 L698 T701	Y685-L689 HydrophobicContact CD1-CD1 4.08Å; Y685-L689 HydrophobicContact CE1-CD1 3.57Å; Y685-L689 HydrophobicContact CE1-CG 4.22Å; Y685-L689 HydrophobicContact CE2-CD2 4.26Å; Y685-L689 HydrophobicContact CE2-CG 4.33Å; Y685-L689 WeakPolarHBondContact O-CG 3.14Å; Y685-L689 PolarHBondContact O-N 3.26Å; V686-L689 PolarHBondContact O-N 3.48Å; F687-L689 PolarHBondContact O-N 3.42Å; L689-L692 PolarHBondContact O-N 3Å; L689-E693 PolarHBondContact O-N 3.04Å; L689-D694 HydrophobicContact CB-CB 4.43Å; L689-D694 HydrophobicContact CD2-CB 3.96Å; L689-D694 PolarHBondContact O-N 2.92Å; L689-K697 HydrophobicContact CD1-CB 4.45Å; L689-K697 HydrophobicContact CD1-CG 4.34Å; L689-K697 HydrophobicContact CD2-CB 4.44Å; L689-K697 HydrophobicContact CD2-CD 3.86Å; L689-K697 HydrophobicContact CD2-CG 4.31Å; L689-L698 HydrophobicContact CB-CB 4.18Å; L689-L698 HydrophobicContact CB-CD1 4.16Å; L689-L698 HydrophobicContact CD1-CB 4.45Å; L689-T701 HydrophobicContact CD1-CG2 4.4Å; L689-T701 WeakPolarHBondContact CD1-OG1 3.14Å
690	R	88.8	Confident	89.8	Confident	50 Å²	50	48.5 Å²	48.5	19%	0.189	22%	0.224	C	C	.	.	H	α-helix	trans	-61.2	-46.4	170.6	-71	168.1	168.8	-174.8	0.1	111.4	D422 V686 F687 M688 L692 E693 L698 E710	D422-R690 IonicContact OD1-CZ 2.72Å; D422-R690 IonicContact OD1-NH1 3.47Å; D422-R690 PolarHBondContact OD1-NH1 2.85Å; D422-R690 IonicContact OD1-NH2 2.74Å; D422-R690 IonicContact OD2-NH1 3.63Å; D422-R690 PolarHBondContact OD2-NH1 3.33Å; V686-R690 WeakPolarHBondContact O-CG 3.4Å; V686-R690 PolarHBondContact O-N 2.87Å; F687-R690 WeakPolarHBondContact O-CB 3.44Å; F687-R690 PolarHBondContact O-N 3.03Å; F687-R690 VanDerWaalsContact O-N 3.17Å; M688-R690 VanDerWaalsContact C-N 3.33Å; M688-R690 PolarHBondContact O-N 3.46Å; R690-L692 VanDerWaalsContact C-N 3.33Å; R690-L692 PolarHBondContact O-N 3.48Å; R690-E693 PolarHBondContact O-N 3.49Å; R690-L698 HydrophobicContact CG-CD1 4.3Å; R690-L698 HydrophobicContact CG-CD2 3.83Å; R690-E710 IonicContact CZ-OE2 3.65Å; R690-E710 IonicContact NH2-OE1 2.98Å; R690-E710 PolarHBondContact NH2-OE1 2.95Å; R690-E710 IonicContact NH2-OE2 3.05Å; R690-E710 PolarHBondContact NH2-OE2 3.38Å
691	Q	85.5	Confident	90.1	Very high	53 Å²	53	42.6 Å²	42.6	25%	0.248	20%	0.202	C	C	.	.	H	α-helix	trans	-68	-30	179.6	-60.9	-58.9	-18.5	0	0	113.2	F245 F687 M688 E693	F245-Q691 HydrophobicContact CE2-CB 4.42Å; F687-Q691 HydrophobicContact CD1-CG 4.14Å; F687-Q691 HydrophobicContact CE1-CG 3.77Å; F687-Q691 HydrophobicContact CZ-CG 4.04Å; F687-Q691 WeakPolarHBondContact O-CG 3.42Å; F687-Q691 PolarHBondContact O-N 3.38Å; M688-Q691 PolarHBondContact O-N 2.94Å; Q691-E693 VanDerWaalsContact C-N 3.26Å; Q691-E693 PolarHBondContact O-N 3.21Å
692	L	85.2	Confident	90.2	Very high	37 Å²	37	42.6 Å²	42.6	19%	0.194	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.4	3.7	174.9	-65.9	173.2	0	0	0	113.8	L248 M688 L689 R690 D694	L248-L692 HydrophobicContact CB-CD2 4.43Å; L248-L692 HydrophobicContact CD2-CD1 4.04Å; L248-L692 HydrophobicContact CD2-CD2 3.87Å; L248-L692 HydrophobicContact CD2-CG 4.45Å; M688-L692 HydrophobicContact CE-CD1 4.45Å; M688-L692 HydrophobicContact CG-CD1 3.87Å; M688-L692 HydrophobicContact CG-CG 4.42Å; M688-L692 WeakPolarHBondContact O-CB 3.47Å; M688-L692 VanDerWaalsContact O-CG 3.31Å; M688-L692 WeakPolarHBondContact O-CG 3.32Å; M688-L692 PolarHBondContact O-N 3Å; M688-L692 HydrophobicContact SD-CD1 4.44Å; L689-L692 PolarHBondContact O-N 3Å; R690-L692 VanDerWaalsContact C-N 3.33Å; R690-L692 PolarHBondContact O-N 3.48Å; L692-D694 HydrophobicContact CB-CB 4.41Å; L692-D694 PolarHBondContact O-N 3.4Å; L692-D694 VanDerWaalsContact O-N 3.14Å
693	E	85.6	Confident	90.1	Very high	162 Å²	162	47.5 Å²	47.5	76%	0.757	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.6	24.7	-174.2	-57.2	-172.2	134.3	0	0	114	L689 R690 Q691 T695	L689-E693 PolarHBondContact O-N 3.04Å; R690-E693 PolarHBondContact O-N 3.49Å; Q691-E693 VanDerWaalsContact C-N 3.26Å; Q691-E693 PolarHBondContact O-N 3.21Å; E693-T695 VanDerWaalsContact C-N 3.26Å; E693-T695 PolarHBondContact O-N 3.32Å; E693-T695 PolarHBondContact O-OG1 2.87Å; E693-T695 VanDerWaalsContact O-OG1 3.13Å
694	D	87.4	Confident	90.1	Very high	19 Å²	19	44.5 Å²	44.5	10%	0.102	22%	0.216	C	C	.	.			trans	-79.4	66.3	-167.8	-158.7	-1.1	0	0	0	113.3	R252 L689 L692 E696 K697 L698	R252-D694 VanDerWaalsContact CZ-CG 3.46Å; R252-D694 IonicContact CZ-OD1 3.49Å; R252-D694 IonicContact CZ-OD2 3.47Å; R252-D694 VanDerWaalsContact NH1-CB 3.27Å; R252-D694 IonicContact NH1-OD1 2.88Å; R252-D694 PolarHBondContact NH1-OD1 3.49Å; R252-D694 IonicContact NH1-OD2 2.66Å; R252-D694 PolarHBondContact NH1-OD2 3.46Å; R252-D694 VanDerWaalsContact NH1-OD2 3.13Å; R252-D694 IonicContact NH2-OD1 2.99Å; R252-D694 PolarHBondContact NH2-OD1 3.28Å; R252-D694 IonicContact NH2-OD2 2.72Å; R252-D694 PolarHBondContact NH2-OD2 2.99Å; L689-D694 HydrophobicContact CB-CB 4.43Å; L689-D694 HydrophobicContact CD2-CB 3.96Å; L689-D694 PolarHBondContact O-N 2.92Å; L692-D694 HydrophobicContact CB-CB 4.41Å; L692-D694 PolarHBondContact O-N 3.4Å; L692-D694 VanDerWaalsContact O-N 3.14Å; D694-E696 PolarHBondContact O-N 2.89Å; D694-K697 HydrophobicContact CB-CB 4.32Å; D694-K697 VanDerWaalsContact CG-CB 3.45Å; D694-K697 PolarHBondContact O-N 3.18Å; D694-K697 WeakPolarHBondContact OD2-CD 3.35Å; D694-L698 WeakPolarHBondContact O-CB 3.38Å; D694-L698 PolarHBondContact O-N 3.09Å
695	T	87.8	Confident	90.3	Very high	49 Å²	49	46.2 Å²	46.2	30%	0.301	23%	0.225	S	C	.	.	H	α-helix	trans	-63	-39.5	-161.1	-56.8	0	0	0	0	113.7	E693 I699 V714 K718	E693-T695 VanDerWaalsContact C-N 3.26Å; E693-T695 PolarHBondContact O-N 3.32Å; E693-T695 PolarHBondContact O-OG1 2.87Å; E693-T695 VanDerWaalsContact O-OG1 3.13Å; T695-I699 HydrophobicContact CG2-CD1 4.16Å; T695-I699 WeakPolarHBondContact O-CB 3.38Å; T695-I699 WeakPolarHBondContact O-CD1 3.33Å; T695-I699 VanDerWaalsContact O-CG1 3.26Å; T695-I699 WeakPolarHBondContact O-CG1 3.34Å; T695-I699 PolarHBondContact O-N 3.37Å; T695-V714 HydrophobicContact CG2-CG1 3.82Å; T695-K718 HydrophobicContact CG2-CB 4.45Å; T695-K718 HydrophobicContact CG2-CD 3.74Å
696	E	89.8	Confident	90.1	Very high	108 Å²	108	48.7 Å²	48.7	51%	0.505	25%	0.252	S	S	.	.	H	α-helix	trans	-70.6	-42	178.7	-51.2	-49.8	121	0	0	111.6	D694 I699 E700 K718	D694-E696 PolarHBondContact O-N 2.89Å; E696-I699 WeakPolarHBondContact O-CB 3.38Å; E696-I699 PolarHBondContact O-N 3.35Å; E696-E700 PolarHBondContact O-N 2.73Å; E696-K718 WeakPolarHBondContact OE1-CE 3.36Å; E696-K718 IonicContact OE1-NZ 2.69Å; E696-K718 PolarHBondContact OE1-NZ 3.29Å; E696-K718 IonicContact OE2-NZ 3.21Å; E696-K718 PolarHBondContact OE2-NZ 2.91Å
697	K	90.5	Very high	89.9	Confident	51 Å²	51	52.1 Å²	52.1	22%	0.222	27%	0.267	C	S	.	.	H	α-helix	trans	-71.3	-33.7	-179.8	-156.7	179.4	-176.6	-140.2	0	112.2	E663 Y685 L689 D694 E700 T701	E663-K697 WeakPolarHBondContact OE1-CE 3.43Å; E663-K697 IonicContact OE1-NZ 2.66Å; E663-K697 PolarHBondContact OE1-NZ 3.02Å; E663-K697 IonicContact OE2-NZ 3.8Å; E663-K697 PolarHBondContact OE2-NZ 3.38Å; Y685-K697 WeakPolarHBondContact OH-CE 3.35Å; Y685-K697 PolarHBondContact OH-NZ 3.28Å; L689-K697 HydrophobicContact CD1-CB 4.45Å; L689-K697 HydrophobicContact CD1-CG 4.34Å; L689-K697 HydrophobicContact CD2-CB 4.44Å; L689-K697 HydrophobicContact CD2-CD 3.86Å; L689-K697 HydrophobicContact CD2-CG 4.31Å; D694-K697 HydrophobicContact CB-CB 4.32Å; D694-K697 VanDerWaalsContact CG-CB 3.45Å; D694-K697 PolarHBondContact O-N 3.18Å; D694-K697 WeakPolarHBondContact OD2-CD 3.35Å; K697-E700 PolarHBondContact O-N 3.22Å; K697-T701 VanDerWaalsContact O-CB 3.31Å; K697-T701 WeakPolarHBondContact O-CB 3.38Å; K697-T701 PolarHBondContact O-N 2.98Å; K697-T701 PolarHBondContact O-OG1 3.33Å
698	L	93.1	Very high	89.8	Confident	10 Å²	10	53.3 Å²	53.3	5%	0.052	27%	0.273	C	S	.	.	H	α-helix	trans	-63.3	-43.4	169.6	179.7	60.5	0	0	0	110.7	V686 L689 R690 D694 T701 L702 V714	V686-L698 HydrophobicContact CG1-CD1 3.97Å; L689-L698 HydrophobicContact CB-CB 4.18Å; L689-L698 HydrophobicContact CB-CD1 4.16Å; L689-L698 HydrophobicContact CD1-CB 4.45Å; R690-L698 HydrophobicContact CG-CD1 4.3Å; R690-L698 HydrophobicContact CG-CD2 3.83Å; D694-L698 WeakPolarHBondContact O-CB 3.38Å; D694-L698 PolarHBondContact O-N 3.09Å; L698-T701 PolarHBondContact O-N 3.03Å; L698-L702 HydrophobicContact CD1-CD1 3.79Å; L698-L702 HydrophobicContact CD1-CD2 4.46Å; L698-L702 HydrophobicContact CD1-CG 3.95Å; L698-L702 HydrophobicContact CG-CD1 3.81Å; L698-L702 HydrophobicContact CG-CG 4.37Å; L698-L702 WeakPolarHBondContact O-CB 3.43Å; L698-L702 VanDerWaalsContact O-CG 3.23Å; L698-L702 WeakPolarHBondContact O-CG 3.31Å; L698-L702 PolarHBondContact O-N 2.8Å; L698-V714 HydrophobicContact CD2-CG1 4.18Å; L698-V714 HydrophobicContact CD2-CG2 3.68Å; L698-V714 HydrophobicContact CG-CG2 4.16Å
699	I	91.4	Very high	89.8	Confident	27 Å²	27	59.5 Å²	59.5	14%	0.138	30%	0.302	C	S	.	.	H	α-helix	trans	-59.4	-47.3	173.2	-79.7	165.7	0	0	0	111.5	T695 E696 T701 L703 L711 V714 K718	T695-I699 HydrophobicContact CG2-CD1 4.16Å; T695-I699 WeakPolarHBondContact O-CB 3.38Å; T695-I699 WeakPolarHBondContact O-CD1 3.33Å; T695-I699 VanDerWaalsContact O-CG1 3.26Å; T695-I699 WeakPolarHBondContact O-CG1 3.34Å; T695-I699 PolarHBondContact O-N 3.37Å; E696-I699 WeakPolarHBondContact O-CB 3.38Å; E696-I699 PolarHBondContact O-N 3.35Å; I699-T701 VanDerWaalsContact C-N 3.32Å; I699-T701 PolarHBondContact O-N 3.37Å; I699-L703 VanDerWaalsContact O-CB 3.27Å; I699-L703 WeakPolarHBondContact O-CB 3.45Å; I699-L703 PolarHBondContact O-N 2.79Å; I699-L703 VanDerWaalsContact O-N 3.07Å; I699-L711 HydrophobicContact CB-CD1 4.06Å; I699-L711 HydrophobicContact CG1-CD1 3.95Å; I699-L711 HydrophobicContact CG2-CD1 3.93Å; I699-V714 HydrophobicContact CD1-CG1 4.14Å; I699-V714 HydrophobicContact CG1-CG1 3.8Å; I699-K718 HydrophobicContact CD1-CD 4.25Å
700	E	91.9	Very high	89.7	Confident	135 Å²	135	62.2 Å²	62.2	63%	0.631	32%	0.315	S	S	*	.	H	α-helix	trans	-61.5	-39.8	176.4	-71.6	178.3	-171.2	0	0	112.4	E696 K697 L704	E696-E700 PolarHBondContact O-N 2.73Å; K697-E700 PolarHBondContact O-N 3.22Å; E700-L704 WeakPolarHBondContact O-CB 3.25Å; E700-L704 PolarHBondContact O-N 3.21Å; E700-L704 VanDerWaalsContact O-N 3.08Å
701	T	93.1	Very high	89.8	Confident	9 Å²	9	60 Å²	60	6%	0.055	31%	0.307	C	S	.	.	H	α-helix	trans	-70.7	-46.7	-179.4	-57.6	0	0	0	0	112	Y685 V686 L689 K697 L698 I699 L703 L704 L705	Y685-T701 HydrophobicContact CD1-CG2 3.7Å; Y685-T701 HydrophobicContact CE1-CG2 3.83Å; Y685-T701 WeakPolarHBondContact CE1-OG1 3.03Å; V686-T701 HydrophobicContact CG2-CG2 3.78Å; L689-T701 HydrophobicContact CD1-CG2 4.4Å; L689-T701 WeakPolarHBondContact CD1-OG1 3.14Å; K697-T701 VanDerWaalsContact O-CB 3.31Å; K697-T701 WeakPolarHBondContact O-CB 3.38Å; K697-T701 PolarHBondContact O-N 2.98Å; K697-T701 PolarHBondContact O-OG1 3.33Å; L698-T701 PolarHBondContact O-N 3.03Å; I699-T701 VanDerWaalsContact C-N 3.32Å; I699-T701 PolarHBondContact O-N 3.37Å; T701-L703 VanDerWaalsContact C-N 3.3Å; T701-L703 PolarHBondContact O-N 3.42Å; T701-L704 WeakPolarHBondContact O-CB 3.37Å; T701-L704 PolarHBondContact O-N 3.26Å; T701-L705 HydrophobicContact CG2-CD1 3.86Å; T701-L705 VanDerWaalsContact O-CG 3.26Å; T701-L705 WeakPolarHBondContact O-CG 3.48Å; T701-L705 PolarHBondContact O-N 3.44Å
702	L	93.3	Very high	90.1	Very high	0 Å²	0	57.6 Å²	57.6	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-65.8	-34.9	178.6	-67.2	169.8	0	0	0	111.7	V686 L698 L705 G706 Q707 E710 L711 V714	V686-L702 HydrophobicContact CG1-CD2 4.01Å; V686-L702 HydrophobicContact CG2-CD2 3.99Å; L698-L702 HydrophobicContact CD1-CD1 3.79Å; L698-L702 HydrophobicContact CD1-CD2 4.46Å; L698-L702 HydrophobicContact CD1-CG 3.95Å; L698-L702 HydrophobicContact CG-CD1 3.81Å; L698-L702 HydrophobicContact CG-CG 4.37Å; L698-L702 WeakPolarHBondContact O-CB 3.43Å; L698-L702 VanDerWaalsContact O-CG 3.23Å; L698-L702 WeakPolarHBondContact O-CG 3.31Å; L698-L702 PolarHBondContact O-N 2.8Å; L702-L705 PolarHBondContact O-N 2.73Å; L702-G706 PolarHBondContact O-N 3.08Å; L702-Q707 HydrophobicContact CB-CB 4.49Å; L702-Q707 HydrophobicContact CD2-CB 3.95Å; L702-Q707 VanDerWaalsContact CD2-OE1 3.25Å; L702-Q707 PolarHBondContact O-N 2.87Å; L702-E710 HydrophobicContact CD1-CB 3.99Å; L702-E710 HydrophobicContact CD2-CB 3.8Å; L702-E710 HydrophobicContact CG-CB 4.46Å; L702-L711 HydrophobicContact CB-CB 4.06Å; L702-L711 HydrophobicContact CB-CD1 4.31Å; L702-V714 HydrophobicContact CD1-CG2 3.85Å
703	L	91.7	Very high	90.3	Very high	110 Å²	110	59.6 Å²	59.6	58%	0.576	31%	0.307	S	S	*	.	H	α-helix	trans	-65.7	-41.9	173.5	-178.7	63.3	0	0	0	112.2	I699 T701 G706 L711	I699-L703 VanDerWaalsContact O-CB 3.27Å; I699-L703 WeakPolarHBondContact O-CB 3.45Å; I699-L703 PolarHBondContact O-N 2.79Å; I699-L703 VanDerWaalsContact O-N 3.07Å; T701-L703 VanDerWaalsContact C-N 3.3Å; T701-L703 PolarHBondContact O-N 3.42Å; L703-G706 PolarHBondContact O-N 3.27Å; L703-L711 HydrophobicContact CB-CD2 4.09Å; L703-L711 HydrophobicContact CD1-CD2 3.99Å
704	L	91.8	Very high	90.6	Very high	50 Å²	50	52.3 Å²	52.3	26%	0.262	27%	0.273	S	S	.	.	H	α-helix	trans	-59.6	-45.4	173.5	173.1	72.3	0	0	0	111.8	R672 L676 E700 T701 G706	R672-L704 HydrophobicContact CB-CD1 4.18Å; R672-L704 HydrophobicContact CB-CD2 3.64Å; R672-L704 HydrophobicContact CG-CD1 4.48Å; R672-L704 HydrophobicContact CG-CD2 3.6Å; L676-L704 HydrophobicContact CD1-CD1 3.88Å; L676-L704 HydrophobicContact CD1-CG 4.46Å; L676-L704 HydrophobicContact CD2-CD1 4.37Å; L676-L704 HydrophobicContact CD2-CG 4.19Å; L676-L704 HydrophobicContact CG-CD1 4.18Å; L676-L704 HydrophobicContact CG-CG 4.21Å; E700-L704 WeakPolarHBondContact O-CB 3.25Å; E700-L704 PolarHBondContact O-N 3.21Å; E700-L704 VanDerWaalsContact O-N 3.08Å; T701-L704 WeakPolarHBondContact O-CB 3.37Å; T701-L704 PolarHBondContact O-N 3.26Å; L704-G706 PolarHBondContact O-N 2.81Å
705	L	92.8	Very high	90.7	Very high	39 Å²	39	51.7 Å²	51.7	20%	0.204	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-1.3	-177.7	-62.8	168.7	0	0	0	113.7	L676 A682 V686 T701 L702 Q707	L676-L705 HydrophobicContact CD2-CD2 4.45Å; A682-L705 HydrophobicContact CB-CD1 3.8Å; A682-L705 HydrophobicContact CB-CD2 3.6Å; A682-L705 HydrophobicContact CB-CG 4.36Å; V686-L705 HydrophobicContact CG2-CD1 3.77Å; T701-L705 HydrophobicContact CG2-CD1 3.86Å; T701-L705 VanDerWaalsContact O-CG 3.26Å; T701-L705 WeakPolarHBondContact O-CG 3.48Å; T701-L705 PolarHBondContact O-N 3.44Å; L702-L705 PolarHBondContact O-N 2.73Å; L705-Q707 HydrophobicContact CB-CG 3.95Å; L705-Q707 PolarHBondContact O-N 3.39Å
706	G	89.2	Confident	90.9	Very high	57 Å²	57	51.1 Å²	51.1	59%	0.588	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.2	13.6	-176.1	0	0	0	0	0	114.7	L702 L703 L704 Q708	L702-G706 PolarHBondContact O-N 3.08Å; L703-G706 PolarHBondContact O-N 3.27Å; L704-G706 PolarHBondContact O-N 2.81Å; G706-Q708 PolarHBondContact O-N 2.91Å
707	Q	88.4	Confident	90.9	Very high	80 Å²	80	53.3 Å²	53.3	37%	0.374	27%	0.268	S	S	.	.			trans	-80.6	67.3	-174.6	-68.5	-171.8	-43.3	0	0	111.6	L702 L705 E709 E710 L711	L702-Q707 HydrophobicContact CB-CB 4.49Å; L702-Q707 HydrophobicContact CD2-CB 3.95Å; L702-Q707 VanDerWaalsContact CD2-OE1 3.25Å; L702-Q707 PolarHBondContact O-N 2.87Å; L705-Q707 HydrophobicContact CB-CG 3.95Å; L705-Q707 PolarHBondContact O-N 3.39Å; Q707-E709 PolarHBondContact O-N 3.06Å; Q707-E710 HydrophobicContact CB-CB 4.33Å; Q707-E710 PolarHBondContact O-N 3.01Å; Q707-L711 WeakPolarHBondContact O-CB 3.27Å; Q707-L711 PolarHBondContact O-N 3.01Å
708	Q	88.1	Confident	90.9	Very high	61 Å²	61	53.1 Å²	53.1	29%	0.285	27%	0.268	S	S	.	.	H	α-helix	trans	-63.3	-35.3	-169.3	-166.9	68.1	15.2	0	0	114	G706 L711 V712 M740 F745	G706-Q708 PolarHBondContact O-N 2.91Å; Q708-L711 PolarHBondContact O-N 3.44Å; Q708-V712 WeakPolarHBondContact O-CB 3.41Å; Q708-V712 WeakPolarHBondContact O-CG2 3.45Å; Q708-V712 PolarHBondContact O-N 3.22Å; Q708-M740 PolarHBondContact NE2-O 3.32Å; Q708-F745 HydrophobicContact CB-CE2 4.04Å; Q708-F745 HydrophobicContact CB-CZ 4.34Å; Q708-F745 HydrophobicContact CG-CD2 4.01Å; Q708-F745 HydrophobicContact CG-CE2 3.34Å; Q708-F745 HydrophobicContact CG-CZ 4.03Å
709	E	88.7	Confident	90.8	Very high	142 Å²	142	53 Å²	53	66%	0.664	27%	0.267	S	S	*	.	H	α-helix	trans	-65.4	-46.4	177.4	-67	178.7	-178.7	0	0	111.9	Q707 V712 N713 F745	Q707-E709 PolarHBondContact O-N 3.06Å; E709-V712 WeakPolarHBondContact O-CB 3.48Å; E709-V712 PolarHBondContact O-N 3.05Å; E709-N713 PolarHBondContact O-N 3.23Å; E709-N713 PolarHBondContact O-ND2 3.36Å; E709-F745 HydrophobicContact CB-CZ 4.42Å; E709-F745 HydrophobicContact CG-CE1 3.92Å; E709-F745 HydrophobicContact CG-CZ 3.64Å
710	E	89.1	Confident	90.7	Very high	57 Å²	57	56.4 Å²	56.4	27%	0.266	28%	0.281	S	S	.	.	H	α-helix	trans	-63.9	-41.7	174.4	-80.1	-66.7	161.6	0	0	111.9	R690 L702 Q707 V712 N713 V714	R690-E710 IonicContact CZ-OE2 3.65Å; R690-E710 IonicContact NH2-OE1 2.98Å; R690-E710 PolarHBondContact NH2-OE1 2.95Å; R690-E710 IonicContact NH2-OE2 3.05Å; R690-E710 PolarHBondContact NH2-OE2 3.38Å; L702-E710 HydrophobicContact CD1-CB 3.99Å; L702-E710 HydrophobicContact CD2-CB 3.8Å; L702-E710 HydrophobicContact CG-CB 4.46Å; Q707-E710 HydrophobicContact CB-CB 4.33Å; Q707-E710 PolarHBondContact O-N 3.01Å; E710-V712 VanDerWaalsContact C-N 3.32Å; E710-V712 PolarHBondContact O-N 2.8Å; E710-N713 WeakPolarHBondContact O-CB 3.29Å; E710-N713 PolarHBondContact O-N 2.95Å; E710-V714 WeakPolarHBondContact O-CG2 3.41Å; E710-V714 PolarHBondContact O-N 3.34Å
711	L	91.1	Very high	90.5	Very high	3 Å²	3	55.8 Å²	55.8	2%	0.016	28%	0.279	C	S	.	.	H	α-helix	trans	-59.6	-43.2	175.6	179.1	61.6	0	0	0	111.7	I699 L702 L703 Q707 Q708 V714 E715 M740	I699-L711 HydrophobicContact CB-CD1 4.06Å; I699-L711 HydrophobicContact CG1-CD1 3.95Å; I699-L711 HydrophobicContact CG2-CD1 3.93Å; L702-L711 HydrophobicContact CB-CB 4.06Å; L702-L711 HydrophobicContact CB-CD1 4.31Å; L703-L711 HydrophobicContact CB-CD2 4.09Å; L703-L711 HydrophobicContact CD1-CD2 3.99Å; Q707-L711 WeakPolarHBondContact O-CB 3.27Å; Q707-L711 PolarHBondContact O-N 3.01Å; Q708-L711 PolarHBondContact O-N 3.44Å; L711-V714 PolarHBondContact O-N 2.77Å; L711-E715 PolarHBondContact O-N 3.25Å; L711-E715 VanDerWaalsContact O-N 3.1Å; L711-M740 HydrophobicContact CD1-CE 3.86Å; L711-M740 HydrophobicContact CD2-CE 4.1Å; L711-M740 HydrophobicContact CG-CE 3.71Å; L711-M740 HydrophobicContact CG-SD 4.23Å
712	V	91.1	Very high	90.4	Very high	3 Å²	3	58.5 Å²	58.5	2%	0.018	29%	0.291	C	S	.	.	H	α-helix	trans	-61.4	-47.9	172.3	158.6	0	0	0	0	110.9	Q708 E709 E710 V714 E715 L716 M740 F741 F745	Q708-V712 WeakPolarHBondContact O-CB 3.41Å; Q708-V712 WeakPolarHBondContact O-CG2 3.45Å; Q708-V712 PolarHBondContact O-N 3.22Å; E709-V712 WeakPolarHBondContact O-CB 3.48Å; E709-V712 PolarHBondContact O-N 3.05Å; E710-V712 VanDerWaalsContact C-N 3.32Å; E710-V712 PolarHBondContact O-N 2.8Å; V712-V714 VanDerWaalsContact C-N 3.27Å; V712-V714 PolarHBondContact O-N 2.79Å; V712-E715 PolarHBondContact O-N 3.06Å; V712-L716 HydrophobicContact CG1-CD1 3.75Å; V712-L716 HydrophobicContact CG1-CG 4.19Å; V712-L716 WeakPolarHBondContact O-CB 3.28Å; V712-L716 VanDerWaalsContact O-CG 3.25Å; V712-L716 WeakPolarHBondContact O-CG 3.45Å; V712-L716 PolarHBondContact O-N 3.44Å; V712-M740 HydrophobicContact CG2-CG 3.87Å; V712-M740 HydrophobicContact CG2-SD 4.41Å; V712-F741 HydrophobicContact CB-CE1 4.42Å; V712-F741 HydrophobicContact CG1-CD1 4.47Å; V712-F741 HydrophobicContact CG1-CE1 3.69Å; V712-F741 HydrophobicContact CG1-CZ 4.18Å; V712-F741 HydrophobicContact CG2-CD1 4.44Å; V712-F741 HydrophobicContact CG2-CE1 4.15Å; V712-F741 HydrophobicContact CG2-CZ 4.35Å; V712-F745 HydrophobicContact CB-CD1 4.42Å; V712-F745 HydrophobicContact CB-CE1 4.48Å; V712-F745 HydrophobicContact CG1-CD1 4.2Å; V712-F745 HydrophobicContact CG2-CD1 3.98Å; V712-F745 HydrophobicContact CG2-CD2 4.26Å; V712-F745 HydrophobicContact CG2-CE1 4.25Å; V712-F745 HydrophobicContact CG2-CG 3.98Å
713	N	90.4	Very high	90.1	Very high	79 Å²	79	70.5 Å²	70.5	42%	0.422	34%	0.337	S	S	.	.	H	α-helix	trans	-58.9	-35.8	177.9	-76.3	-33.4	0	0	0	112.9	E709 E710 R717	E709-N713 PolarHBondContact O-N 3.23Å; E709-N713 PolarHBondContact O-ND2 3.36Å; E710-N713 WeakPolarHBondContact O-CB 3.29Å; E710-N713 PolarHBondContact O-N 2.95Å; N713-R717 WeakPolarHBondContact O-CB 3.5Å; N713-R717 PolarHBondContact O-N 3.16Å
714	V	91.2	Very high	90	Very high	9 Å²	9	68.8 Å²	68.8	6%	0.055	33%	0.328	C	S	.	.	H	α-helix	trans	-72	-46.4	177	174.1	0	0	0	0	112	T695 L698 I699 L702 E710 L711 V712 R717 K718	T695-V714 HydrophobicContact CG2-CG1 3.82Å; L698-V714 HydrophobicContact CD2-CG1 4.18Å; L698-V714 HydrophobicContact CD2-CG2 3.68Å; L698-V714 HydrophobicContact CG-CG2 4.16Å; I699-V714 HydrophobicContact CD1-CG1 4.14Å; I699-V714 HydrophobicContact CG1-CG1 3.8Å; L702-V714 HydrophobicContact CD1-CG2 3.85Å; E710-V714 WeakPolarHBondContact O-CG2 3.41Å; E710-V714 PolarHBondContact O-N 3.34Å; L711-V714 PolarHBondContact O-N 2.77Å; V712-V714 VanDerWaalsContact C-N 3.27Å; V712-V714 PolarHBondContact O-N 2.79Å; V714-R717 WeakPolarHBondContact O-CB 3.44Å; V714-R717 PolarHBondContact O-N 3.49Å; V714-K718 WeakPolarHBondContact O-CB 3.1Å; V714-K718 PolarHBondContact O-N 3.49Å
715	E	90	Very high	89.9	Confident	7 Å²	7	68 Å²	68	3%	0.033	33%	0.326	C	S	.	.	H	α-helix	trans	-68.2	-35.8	176.8	-169.9	80.8	154.3	0	0	111.2	L711 V712 R717 K718 I719 K734 M740 F741	L711-E715 PolarHBondContact O-N 3.25Å; L711-E715 VanDerWaalsContact O-N 3.1Å; V712-E715 PolarHBondContact O-N 3.06Å; E715-R717 PolarHBondContact O-N 2.92Å; E715-K718 WeakPolarHBondContact O-CB 3.49Å; E715-K718 PolarHBondContact O-N 3.47Å; E715-K718 VanDerWaalsContact OE2-CD 3.32Å; E715-K718 WeakPolarHBondContact OE2-CD 3.34Å; E715-K718 WeakPolarHBondContact OE2-CE 3.21Å; E715-K718 IonicContact OE2-NZ 3.96Å; E715-K718 PolarHBondContact OE2-NZ 2.87Å; E715-I719 HydrophobicContact CG-CD1 4.28Å; E715-I719 WeakPolarHBondContact O-CD1 3.49Å; E715-I719 VanDerWaalsContact O-CG1 3.26Å; E715-I719 WeakPolarHBondContact O-CG1 3.38Å; E715-I719 PolarHBondContact O-N 3.32Å; E715-K734 IonicContact OE1-NZ 2.73Å; E715-K734 PolarHBondContact OE1-NZ 2.89Å; E715-M740 HydrophobicContact CB-CE 4.11Å; E715-M740 HydrophobicContact CB-SD 3.58Å; E715-M740 VanDerWaalsContact CB-SD 3.58Å; E715-M740 HydrophobicContact CG-CE 4.4Å; E715-M740 HydrophobicContact CG-SD 4.02Å; E715-F741 HydrophobicContact CG-CE2 4.36Å
716	L	91.7	Very high	89.9	Confident	37 Å²	37	71.5 Å²	71.5	19%	0.194	34%	0.342	C	S	.	.	H	α-helix	trans	-58.9	-44.2	170.6	-74.1	177.7	0	0	0	111.9	V712 I719 K720 F741 L752	V712-L716 HydrophobicContact CG1-CD1 3.75Å; V712-L716 HydrophobicContact CG1-CG 4.19Å; V712-L716 WeakPolarHBondContact O-CB 3.28Å; V712-L716 VanDerWaalsContact O-CG 3.25Å; V712-L716 WeakPolarHBondContact O-CG 3.45Å; V712-L716 PolarHBondContact O-N 3.44Å; L716-I719 PolarHBondContact O-N 3.33Å; L716-K720 WeakPolarHBondContact O-CB 3.44Å; L716-K720 PolarHBondContact O-N 3.27Å; L716-F741 HydrophobicContact CD1-CE1 4.49Å; L716-F741 HydrophobicContact CD2-CE1 3.84Å; L716-F741 HydrophobicContact CD2-CZ 3.93Å; L716-F741 HydrophobicContact CG-CE1 4.01Å; L716-F741 HydrophobicContact CG-CZ 3.99Å; L716-L752 HydrophobicContact CD2-CD1 4.19Å; L716-L752 HydrophobicContact CD2-CD2 3.73Å; L716-L752 HydrophobicContact CD2-CG 4.29Å
717	R	90.7	Very high	90.1	Very high	153 Å²	153	69.7 Å²	69.7	58%	0.577	32%	0.321	S	S	*	.	H	α-helix	trans	-61	-43.9	174.5	-169.2	-176.5	-60.5	-166.6	0.8	111.2	N713 V714 E715 I719 K720 M721	N713-R717 WeakPolarHBondContact O-CB 3.5Å; N713-R717 PolarHBondContact O-N 3.16Å; V714-R717 WeakPolarHBondContact O-CB 3.44Å; V714-R717 PolarHBondContact O-N 3.49Å; E715-R717 PolarHBondContact O-N 2.92Å; R717-I719 PolarHBondContact O-N 2.89Å; R717-K720 PolarHBondContact O-N 2.94Å; R717-M721 WeakPolarHBondContact O-CG 3.33Å; R717-M721 PolarHBondContact O-N 2.82Å
718	K	90.3	Very high	90.4	Very high	48 Å²	48	67.8 Å²	67.8	21%	0.209	31%	0.312	C	S	.	.	H	α-helix	trans	-64.9	-33.7	177.3	176.8	164.1	156.5	-175.7	0	113.4	T695 E696 I699 V714 E715 Q722	T695-K718 HydrophobicContact CG2-CB 4.45Å; T695-K718 HydrophobicContact CG2-CD 3.74Å; E696-K718 WeakPolarHBondContact OE1-CE 3.36Å; E696-K718 IonicContact OE1-NZ 2.69Å; E696-K718 PolarHBondContact OE1-NZ 3.29Å; E696-K718 IonicContact OE2-NZ 3.21Å; E696-K718 PolarHBondContact OE2-NZ 2.91Å; I699-K718 HydrophobicContact CD1-CD 4.25Å; V714-K718 WeakPolarHBondContact O-CB 3.1Å; V714-K718 PolarHBondContact O-N 3.49Å; E715-K718 WeakPolarHBondContact O-CB 3.49Å; E715-K718 PolarHBondContact O-N 3.47Å; E715-K718 VanDerWaalsContact OE2-CD 3.32Å; E715-K718 WeakPolarHBondContact OE2-CD 3.34Å; E715-K718 WeakPolarHBondContact OE2-CE 3.21Å; E715-K718 IonicContact OE2-NZ 3.96Å; E715-K718 PolarHBondContact OE2-NZ 2.87Å; K718-Q722 PolarHBondContact O-NE2 3.31Å
719	I	91.8	Very high	90.7	Very high	7 Å²	7	65.5 Å²	65.5	4%	0.036	30%	0.301	C	S	.	.	H	α-helix	trans	-70.7	-44.4	170	-65.5	160	0	0	0	110.9	E715 L716 R717 M721 Q722 K728 A731 L732 A735 L752	E715-I719 HydrophobicContact CG-CD1 4.28Å; E715-I719 WeakPolarHBondContact O-CD1 3.49Å; E715-I719 VanDerWaalsContact O-CG1 3.26Å; E715-I719 WeakPolarHBondContact O-CG1 3.38Å; E715-I719 PolarHBondContact O-N 3.32Å; L716-I719 PolarHBondContact O-N 3.33Å; R717-I719 PolarHBondContact O-N 2.89Å; I719-M721 VanDerWaalsContact C-N 3.28Å; I719-M721 PolarHBondContact O-N 2.9Å; I719-Q722 WeakPolarHBondContact O-CB 3.45Å; I719-Q722 WeakPolarHBondContact O-CG 3.24Å; I719-Q722 PolarHBondContact O-N 2.96Å; I719-K728 HydrophobicContact CG2-CG 4.45Å; I719-A731 HydrophobicContact CG1-CB 4.03Å; I719-L732 HydrophobicContact CG2-CD2 3.78Å; I719-L732 HydrophobicContact CG2-CG 4Å; I719-A735 HydrophobicContact CD1-CB 3.73Å; I719-L752 HydrophobicContact CD1-CD2 4.46Å
720	K	88.5	Confident	91	Very high	99 Å²	99	65.1 Å²	65.1	43%	0.43	29%	0.294	S	S	.	.	H	α-helix	trans	-61	-34.6	179.7	-173.9	-177.1	173.1	-172	0	112.5	G134 P136 L716 R717 Q722	G134-K720 PolarHBondContact O-NZ 3.49Å; P136-K720 HydrophobicContact CG-CD 4.48Å; L716-K720 WeakPolarHBondContact O-CB 3.44Å; L716-K720 PolarHBondContact O-N 3.27Å; R717-K720 PolarHBondContact O-N 2.94Å; K720-Q722 VanDerWaalsContact C-N 3.3Å; K720-Q722 PolarHBondContact O-N 3.47Å
721	M	88.2	Confident	91.3	Very high	121 Å²	121	63.3 Å²	63.3	60%	0.596	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.2	-5.9	178.8	-67.4	-59.9	99.6	0	0	114.9	R717 I719 R723	R717-M721 WeakPolarHBondContact O-CG 3.33Å; R717-M721 PolarHBondContact O-N 2.82Å; I719-M721 VanDerWaalsContact C-N 3.28Å; I719-M721 PolarHBondContact O-N 2.9Å; M721-R723 PolarHBondContact O-N 3.4Å; M721-R723 VanDerWaalsContact O-N 3.09Å
722	Q	90.9	Very high	91.5	Very high	67 Å²	67	63.2 Å²	63.2	31%	0.313	29%	0.288	S	S	.	.			trans	-69.4	106.6	175.3	-59.3	-53.2	-48.3	0	0	110.9	K718 I719 K720 K728 A731	K718-Q722 PolarHBondContact O-NE2 3.31Å; I719-Q722 WeakPolarHBondContact O-CB 3.45Å; I719-Q722 WeakPolarHBondContact O-CG 3.24Å; I719-Q722 PolarHBondContact O-N 2.96Å; K720-Q722 VanDerWaalsContact C-N 3.3Å; K720-Q722 PolarHBondContact O-N 3.47Å; Q722-K728 HydrophobicContact CB-CB 3.72Å; Q722-K728 HydrophobicContact CB-CG 4.09Å; Q722-A731 HydrophobicContact CG-CB 4.3Å
723	R	86.6	Confident	91.7	Very high	252 Å²	252	69.4 Å²	69.4	95%	0.951	31%	0.311	S	S	*	.			trans	-78.5	-30.6	176.7	-61.7	-176.1	-175.3	177.6	1.5	113.2	M721	M721-R723 PolarHBondContact O-N 3.4Å; M721-R723 VanDerWaalsContact O-N 3.09Å
724	D	89.8	Confident	91.8	Very high	74 Å²	74	71.6 Å²	71.6	40%	0.396	32%	0.317	S	S	.	.	S	Bend	trans	-79.5	127.7	172.6	165.3	37.6	0	0	0	110	E726 A727 K728 R730	D724-E726 VanDerWaalsContact C-N 3.33Å; D724-E726 PolarHBondContact O-N 3.14Å; D724-E726 PolarHBondContact OD1-N 3.47Å; D724-A727 HydrophobicContact CB-CB 3.89Å; D724-A727 PolarHBondContact O-N 2.8Å; D724-A727 VanDerWaalsContact OD2-CB 3.24Å; D724-A727 WeakPolarHBondContact OD2-CB 3.45Å; D724-A727 PolarHBondContact OD2-N 3.28Å; D724-K728 WeakPolarHBondContact O-CB 3.46Å; D724-K728 PolarHBondContact O-N 2.87Å; D724-R730 IonicContact OD2-NH2 3.13Å; D724-R730 PolarHBondContact OD2-NH2 3.19Å
725	S	89.7	Confident	91.9	Very high	32 Å²	32	71.4 Å²	71.4	22%	0.224	32%	0.316	C	S	.	.	H	α-helix	trans	-61.8	-36.5	178	66.1	0	0	0	0	113	K728 I729	S725-K728 PolarHBondContact O-N 3.34Å; S725-I729 WeakPolarHBondContact O-CB 3.43Å; S725-I729 WeakPolarHBondContact O-CG1 3.33Å; S725-I729 PolarHBondContact O-N 3.48Å
726	E	91.7	Very high	92.1	Very high	113 Å²	113	71.9 Å²	71.9	53%	0.528	32%	0.319	S	S	.	.	H	α-helix	trans	-71.4	-41.3	176.9	-63.6	-167.1	168.1	0	0	111.5	D724 K728 I729 R730	D724-E726 VanDerWaalsContact C-N 3.33Å; D724-E726 PolarHBondContact O-N 3.14Å; D724-E726 PolarHBondContact OD1-N 3.47Å; E726-K728 VanDerWaalsContact C-N 3.3Å; E726-K728 PolarHBondContact O-N 3.21Å; E726-I729 PolarHBondContact O-N 2.84Å; E726-R730 WeakPolarHBondContact O-CB 3.41Å; E726-R730 WeakPolarHBondContact O-CG 3.21Å; E726-R730 PolarHBondContact O-N 2.92Å; E726-R730 PolarHBondContact O-NE 3.47Å; E726-R730 IonicContact OE2-CZ 3.12Å; E726-R730 IonicContact OE2-NH1 2.65Å; E726-R730 PolarHBondContact OE2-NH1 3.32Å; E726-R730 IonicContact OE2-NH2 3.63Å
727	A	93.6	Very high	92	Very high	19 Å²	19	73.2 Å²	73.2	16%	0.157	34%	0.342	C	S	.	.	H	α-helix	trans	-61.7	-40.6	174.8	0	0	0	0	0	111.1	D724 R730 A731	D724-A727 HydrophobicContact CB-CB 3.89Å; D724-A727 PolarHBondContact O-N 2.8Å; D724-A727 VanDerWaalsContact OD2-CB 3.24Å; D724-A727 WeakPolarHBondContact OD2-CB 3.45Å; D724-A727 PolarHBondContact OD2-N 3.28Å; A727-R730 VanDerWaalsContact N-NH2 3.12Å; A727-R730 PolarHBondContact O-N 2.95Å; A727-A731 WeakPolarHBondContact O-CB 3.36Å; A727-A731 PolarHBondContact O-N 3.13Å
728	K	94.8	Very high	91.9	Very high	41 Å²	41	67.3 Å²	67.3	18%	0.178	33%	0.328	C	S	.	.	H	α-helix	trans	-62.3	-45.1	173.4	-162.3	170	-177.8	-177.6	0	111.5	I719 Q722 D724 S725 E726 A731 L732 L759	I719-K728 HydrophobicContact CG2-CG 4.45Å; Q722-K728 HydrophobicContact CB-CB 3.72Å; Q722-K728 HydrophobicContact CB-CG 4.09Å; D724-K728 WeakPolarHBondContact O-CB 3.46Å; D724-K728 PolarHBondContact O-N 2.87Å; S725-K728 PolarHBondContact O-N 3.34Å; E726-K728 VanDerWaalsContact C-N 3.3Å; E726-K728 PolarHBondContact O-N 3.21Å; K728-A731 PolarHBondContact O-N 2.96Å; K728-L732 HydrophobicContact CG-CD1 4.21Å; K728-L732 WeakPolarHBondContact O-CB 3.44Å; K728-L732 VanDerWaalsContact O-CG 3.23Å; K728-L732 WeakPolarHBondContact O-CG 3.44Å; K728-L732 PolarHBondContact O-N 2.9Å; K728-L759 HydrophobicContact CB-CD1 4.48Å; K728-L759 HydrophobicContact CD-CD1 4.04Å; K728-L759 HydrophobicContact CG-CD1 4.09Å
729	I	95.4	Very high	91.7	Very high	12 Å²	12	69.1 Å²	69.1	6%	0.062	35%	0.352	C	S	.	.	H	α-helix	trans	-61.1	-43.6	173.7	-76	171.2	0	0	0	111.9	S725 E726 L732 R733 L756 L759 E760 L763	S725-I729 WeakPolarHBondContact O-CB 3.43Å; S725-I729 WeakPolarHBondContact O-CG1 3.33Å; S725-I729 PolarHBondContact O-N 3.48Å; E726-I729 PolarHBondContact O-N 2.84Å; I729-L732 PolarHBondContact O-N 3.22Å; I729-R733 VanDerWaalsContact CG2-CZ 3.48Å; I729-R733 WeakPolarHBondContact O-CB 3.33Å; I729-R733 VanDerWaalsContact O-CG 3.3Å; I729-R733 WeakPolarHBondContact O-CG 3.47Å; I729-R733 PolarHBondContact O-N 2.95Å; I729-L756 HydrophobicContact CB-CD1 4.28Å; I729-L756 HydrophobicContact CG1-CD1 4.1Å; I729-L756 HydrophobicContact CG2-CD1 3.95Å; I729-L759 HydrophobicContact CD1-CB 4.01Å; I729-L759 HydrophobicContact CG1-CB 3.97Å; I729-L759 HydrophobicContact CG1-CD1 4.25Å; I729-E760 HydrophobicContact CD1-CG 4.24Å; I729-L763 HydrophobicContact CD1-CD1 3.43Å; I729-L763 VanDerWaalsContact CD1-CD1 3.43Å
730	R	95.3	Very high	91.3	Very high	134 Å²	134	70.7 Å²	70.7	51%	0.506	36%	0.36	S	S	.	.	H	α-helix	trans	-61.5	-43.7	175.8	-74	179.9	-72.6	-103.6	-0.3	111.5	D724 E726 A727 K734	D724-R730 IonicContact OD2-NH2 3.13Å; D724-R730 PolarHBondContact OD2-NH2 3.19Å; E726-R730 WeakPolarHBondContact O-CB 3.41Å; E726-R730 WeakPolarHBondContact O-CG 3.21Å; E726-R730 PolarHBondContact O-N 2.92Å; E726-R730 PolarHBondContact O-NE 3.47Å; E726-R730 IonicContact OE2-CZ 3.12Å; E726-R730 IonicContact OE2-NH1 2.65Å; E726-R730 PolarHBondContact OE2-NH1 3.32Å; E726-R730 IonicContact OE2-NH2 3.63Å; A727-R730 VanDerWaalsContact N-NH2 3.12Å; A727-R730 PolarHBondContact O-N 2.95Å; R730-K734 WeakPolarHBondContact O-CB 3.33Å; R730-K734 PolarHBondContact O-N 3.44Å
731	A	93.8	Very high	91.2	Very high	20 Å²	20	66 Å²	66	17%	0.165	34%	0.339	C	S	.	.	H	α-helix	trans	-67.5	-44.2	177.9	0	0	0	0	0	112.3	I719 Q722 A727 K728 K734 A735	I719-A731 HydrophobicContact CG1-CB 4.03Å; Q722-A731 HydrophobicContact CG-CB 4.3Å; A727-A731 WeakPolarHBondContact O-CB 3.36Å; A727-A731 PolarHBondContact O-N 3.13Å; K728-A731 PolarHBondContact O-N 2.96Å; A731-K734 WeakPolarHBondContact O-CB 3.45Å; A731-K734 PolarHBondContact O-N 3.01Å; A731-A735 WeakPolarHBondContact O-CB 3.47Å; A731-A735 PolarHBondContact O-N 2.87Å
732	L	95.4	Very high	90.9	Very high	0 Å²	0	62.1 Å²	62.1	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-58.5	-50.4	174.5	-74.8	167	0	0	0	111.5	I719 K728 I729 K734 A735 I736 L752 Q755 L756 L759	I719-L732 HydrophobicContact CG2-CD2 3.78Å; I719-L732 HydrophobicContact CG2-CG 4Å; K728-L732 HydrophobicContact CG-CD1 4.21Å; K728-L732 WeakPolarHBondContact O-CB 3.44Å; K728-L732 VanDerWaalsContact O-CG 3.23Å; K728-L732 WeakPolarHBondContact O-CG 3.44Å; K728-L732 PolarHBondContact O-N 2.9Å; I729-L732 PolarHBondContact O-N 3.22Å; L732-K734 VanDerWaalsContact C-N 3.3Å; L732-K734 PolarHBondContact O-N 3.01Å; L732-A735 PolarHBondContact O-N 2.87Å; L732-A735 VanDerWaalsContact O-N 3.17Å; L732-I736 HydrophobicContact CB-CD1 4.38Å; L732-I736 WeakPolarHBondContact O-CB 3.37Å; L732-I736 WeakPolarHBondContact O-CD1 3.47Å; L732-I736 VanDerWaalsContact O-CG1 3.23Å; L732-I736 WeakPolarHBondContact O-CG1 3.31Å; L732-I736 PolarHBondContact O-N 3.16Å; L732-L752 HydrophobicContact CD2-CB 4.2Å; L732-L752 HydrophobicContact CD2-CD2 3.65Å; L732-L752 HydrophobicContact CD2-CG 4.46Å; L732-Q755 HydrophobicContact CD1-CG 4.1Å; L732-Q755 HydrophobicContact CD2-CG 4.43Å; L732-L756 HydrophobicContact CB-CB 4.32Å; L732-L756 HydrophobicContact CB-CD1 4.13Å; L732-L756 HydrophobicContact CD1-CB 4.29Å; L732-L756 HydrophobicContact CD1-CD1 4.41Å; L732-L759 HydrophobicContact CD1-CD1 3.63Å
733	R	95.5	Very high	90.7	Very high	133 Å²	133	61.9 Å²	61.9	50%	0.502	34%	0.342	S	S	.	.	H	α-helix	trans	-60.5	-37.2	177.2	-71.2	171.9	-179.9	172.7	-3.3	112.4	I729 G737 L756 E760	I729-R733 VanDerWaalsContact CG2-CZ 3.48Å; I729-R733 WeakPolarHBondContact O-CB 3.33Å; I729-R733 VanDerWaalsContact O-CG 3.3Å; I729-R733 WeakPolarHBondContact O-CG 3.47Å; I729-R733 PolarHBondContact O-N 2.95Å; R733-G737 PolarHBondContact O-N 2.86Å; R733-L756 HydrophobicContact CG-CD1 3.92Å; R733-L756 HydrophobicContact CG-CD2 3.58Å; R733-L756 HydrophobicContact CG-CG 4.43Å; R733-E760 IonicContact CZ-OE1 2.92Å; R733-E760 VanDerWaalsContact CZ-OE1 3.23Å; R733-E760 IonicContact NE-OE1 3.43Å; R733-E760 PolarHBondContact NE-OE1 3.34Å; R733-E760 IonicContact NH2-OE1 2.66Å; R733-E760 PolarHBondContact NH2-OE1 2.89Å; R733-E760 IonicContact NH2-OE2 3.26Å; R733-E760 PolarHBondContact NH2-OE2 3.22Å
734	K	93.7	Very high	90.6	Very high	125 Å²	125	55 Å²	55	54%	0.543	33%	0.333	S	S	.	.	H	α-helix	trans	-62.9	-48.2	172.8	-177.3	-153.8	167.6	-151.6	0	111.3	E715 R730 A731 L732 G737 G738	E715-K734 IonicContact OE1-NZ 2.73Å; E715-K734 PolarHBondContact OE1-NZ 2.89Å; R730-K734 WeakPolarHBondContact O-CB 3.33Å; R730-K734 PolarHBondContact O-N 3.44Å; A731-K734 WeakPolarHBondContact O-CB 3.45Å; A731-K734 PolarHBondContact O-N 3.01Å; L732-K734 VanDerWaalsContact C-N 3.3Å; L732-K734 PolarHBondContact O-N 3.01Å; K734-G737 PolarHBondContact O-N 3.31Å; K734-G738 PolarHBondContact O-N 3.39Å
735	A	92.2	Very high	90.6	Very high	5 Å²	5	52.8 Å²	52.8	4%	0.041	32%	0.32	C	S	.	.	H	α-helix	trans	-64.8	-47.2	-179	0	0	0	0	0	112.4	I719 A731 L732 G737 G738 F741 L752	I719-A735 HydrophobicContact CD1-CB 3.73Å; A731-A735 WeakPolarHBondContact O-CB 3.47Å; A731-A735 PolarHBondContact O-N 2.87Å; L732-A735 PolarHBondContact O-N 2.87Å; L732-A735 VanDerWaalsContact O-N 3.17Å; A735-G737 VanDerWaalsContact C-N 3.3Å; A735-G737 PolarHBondContact O-N 3.1Å; A735-G738 PolarHBondContact O-N 2.87Å; A735-F741 HydrophobicContact CB-CD2 3.9Å; A735-F741 HydrophobicContact CB-CE2 3.75Å; A735-L752 HydrophobicContact CB-CD1 4.03Å
736	I	93.8	Very high	90.5	Very high	18 Å²	18	54.4 Å²	54.4	9%	0.092	33%	0.331	C	S	.	.	H	α-helix	trans	-65.1	-33.9	177.3	-62.9	158.1	0	0	0	111.4	L732 R749 L752 Q753 L756	L732-I736 HydrophobicContact CB-CD1 4.38Å; L732-I736 WeakPolarHBondContact O-CB 3.37Å; L732-I736 WeakPolarHBondContact O-CD1 3.47Å; L732-I736 VanDerWaalsContact O-CG1 3.23Å; L732-I736 WeakPolarHBondContact O-CG1 3.31Å; L732-I736 PolarHBondContact O-N 3.16Å; I736-R749 HydrophobicContact CG2-CG 4.42Å; I736-R749 VanDerWaalsContact O-CZ 3.23Å; I736-R749 PolarHBondContact O-NE 2.91Å; I736-R749 PolarHBondContact O-NH2 2.91Å; I736-L752 HydrophobicContact CD1-CB 4.14Å; I736-L752 HydrophobicContact CG1-CB 3.79Å; I736-Q753 HydrophobicContact CD1-CB 4.4Å; I736-L756 HydrophobicContact CD1-CB 3.98Å; I736-L756 HydrophobicContact CD1-CD2 3.66Å; I736-L756 HydrophobicContact CD1-CG 4.46Å
737	G	91.4	Very high	90.3	Very high	65 Å²	65	53.2 Å²	53.2	67%	0.67	33%	0.326	S	S	*	.	H	α-helix	trans	-80.1	-17.5	176.4	0	0	0	0	0	114.8	R733 K734 A735	R733-G737 PolarHBondContact O-N 2.86Å; K734-G737 PolarHBondContact O-N 3.31Å; A735-G737 VanDerWaalsContact C-N 3.3Å; A735-G737 PolarHBondContact O-N 3.1Å
738	G	87.3	Confident	90.1	Very high	28 Å²	28	55.5 Å²	55.5	29%	0.289	33%	0.333	S	S	.	.	S	Bend	trans	-85.3	165.7	-176.2	0	0	0	0	0	114.4	K734 A735 M740	K734-G738 PolarHBondContact O-N 3.39Å; A735-G738 PolarHBondContact O-N 2.87Å; G738-M740 VanDerWaalsContact C-N 3.32Å
739	A	85.5	Confident	90	Very high	87 Å²	87	58.1 Å²	58.1	72%	0.719	34%	0.342	S	S	*	.	S	Bend	trans	-74	-19.7	175.5	0	0	0	0	0	113.7	F741 A742	A739-F741 VanDerWaalsContact C-N 3.29Å; A739-F741 PolarHBondContact O-N 2.77Å; A739-A742 VanDerWaalsContact O-CB 3.28Å; A739-A742 WeakPolarHBondContact O-CB 3.32Å; A739-A742 PolarHBondContact O-N 3.17Å
740	M	84.7	Confident	89.9	Confident	40 Å²	40	62.9 Å²	62.9	20%	0.197	36%	0.359	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-40.2	-175.4	-176.8	-173.8	-67.8	0	0	113	Q708 L711 V712 E715 G738	Q708-M740 PolarHBondContact NE2-O 3.32Å; L711-M740 HydrophobicContact CD1-CE 3.86Å; L711-M740 HydrophobicContact CD2-CE 4.1Å; L711-M740 HydrophobicContact CG-CE 3.71Å; L711-M740 HydrophobicContact CG-SD 4.23Å; V712-M740 HydrophobicContact CG2-CG 3.87Å; V712-M740 HydrophobicContact CG2-SD 4.41Å; E715-M740 HydrophobicContact CB-CE 4.11Å; E715-M740 HydrophobicContact CB-SD 3.58Å; E715-M740 VanDerWaalsContact CB-SD 3.58Å; E715-M740 HydrophobicContact CG-CE 4.4Å; E715-M740 HydrophobicContact CG-SD 4.02Å; G738-M740 VanDerWaalsContact C-N 3.32Å
741	F	86.6	Confident	89.7	Confident	0 Å²	0	59 Å²	59	0%	0	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.6	24.4	179.1	-65.1	-90.4	0	0	0	112.3	V712 E715 L716 A735 A739 F745 E748 R749 L752	V712-F741 HydrophobicContact CB-CE1 4.42Å; V712-F741 HydrophobicContact CG1-CD1 4.47Å; V712-F741 HydrophobicContact CG1-CE1 3.69Å; V712-F741 HydrophobicContact CG1-CZ 4.18Å; V712-F741 HydrophobicContact CG2-CD1 4.44Å; V712-F741 HydrophobicContact CG2-CE1 4.15Å; V712-F741 HydrophobicContact CG2-CZ 4.35Å; E715-F741 HydrophobicContact CG-CE2 4.36Å; L716-F741 HydrophobicContact CD1-CE1 4.49Å; L716-F741 HydrophobicContact CD2-CE1 3.84Å; L716-F741 HydrophobicContact CD2-CZ 3.93Å; L716-F741 HydrophobicContact CG-CE1 4.01Å; L716-F741 HydrophobicContact CG-CZ 3.99Å; A735-F741 HydrophobicContact CB-CD2 3.9Å; A735-F741 HydrophobicContact CB-CE2 3.75Å; A739-F741 VanDerWaalsContact C-N 3.29Å; A739-F741 PolarHBondContact O-N 2.77Å; F741-F745 HydrophobicContact CD1-CB 4.49Å; F741-E748 HydrophobicContact CD1-CB 3.85Å; F741-E748 HydrophobicContact CE1-CB 4.14Å; F741-R749 HydrophobicContact CB-CB 4.06Å; F741-R749 HydrophobicContact CB-CG 4.11Å; F741-R749 WeakPolarHBondContact O-CB 3.37Å; F741-R749 WeakPolarHBondContact O-CD 3.41Å; F741-L752 HydrophobicContact CD1-CD1 3.76Å; F741-L752 HydrophobicContact CD2-CD1 4.2Å; F741-L752 HydrophobicContact CE1-CD1 3.66Å; F741-L752 HydrophobicContact CE2-CD1 4.14Å; F741-L752 HydrophobicContact CG-CD1 4.03Å; F741-L752 HydrophobicContact CZ-CD1 3.88Å
742	A	82.1	Confident	89.7	Confident	40 Å²	40	58.3 Å²	58.3	33%	0.331	34%	0.34	S	S	.	.	S	Bend	trans	-96.1	167.5	173.9	0	0	0	0	0	111.3	A739 S744	A739-A742 VanDerWaalsContact O-CB 3.28Å; A739-A742 WeakPolarHBondContact O-CB 3.32Å; A739-A742 PolarHBondContact O-N 3.17Å; A742-S744 PolarHBondContact O-N 2.94Å
743	G	85	Confident	89.6	Confident	62 Å²	62	62 Å²	62	64%	0.639	36%	0.357	S	S	*	.	G	3₁₀ helix	trans	63.6	-118.8	179.3	0	0	0	0	0	112	F745 S746	G743-F745 PolarHBondContact O-N 2.98Å; G743-S746 WeakPolarHBondContact O-CB 3.48Å; G743-S746 PolarHBondContact O-N 3.45Å; G743-S746 PolarHBondContact O-OG 3.17Å
744	S	86.6	Confident	89.5	Confident	108 Å²	108	58.6 Å²	58.6	76%	0.755	35%	0.346	S	S	*	.	G	3₁₀ helix	trans	-53.3	-39.5	-177.1	-45.4	0	0	0	0	113	A742 S746	A742-S744 PolarHBondContact O-N 2.94Å; S744-S746 PolarHBondContact O-N 3.16Å; S744-S746 VanDerWaalsContact O-N 3.11Å
745	F	88.8	Confident	89.5	Confident	26 Å²	26	54.2 Å²	54.2	11%	0.114	33%	0.328	C	S	.	.	G	3₁₀ helix	trans	-87.8	31.8	-174	-58.1	-81.1	0	0	0	113.9	Q708 E709 V712 F741 G743 E747 E748 R749	Q708-F745 HydrophobicContact CB-CE2 4.04Å; Q708-F745 HydrophobicContact CB-CZ 4.34Å; Q708-F745 HydrophobicContact CG-CD2 4.01Å; Q708-F745 HydrophobicContact CG-CE2 3.34Å; Q708-F745 HydrophobicContact CG-CZ 4.03Å; E709-F745 HydrophobicContact CB-CZ 4.42Å; E709-F745 HydrophobicContact CG-CE1 3.92Å; E709-F745 HydrophobicContact CG-CZ 3.64Å; V712-F745 HydrophobicContact CB-CD1 4.42Å; V712-F745 HydrophobicContact CB-CE1 4.48Å; V712-F745 HydrophobicContact CG1-CD1 4.2Å; V712-F745 HydrophobicContact CG2-CD1 3.98Å; V712-F745 HydrophobicContact CG2-CD2 4.26Å; V712-F745 HydrophobicContact CG2-CE1 4.25Å; V712-F745 HydrophobicContact CG2-CG 3.98Å; F741-F745 HydrophobicContact CD1-CB 4.49Å; G743-F745 PolarHBondContact O-N 2.98Å; F745-E747 VanDerWaalsContact C-N 3.33Å; F745-E748 WeakPolarHBondContact CA-OE2 3.23Å; F745-R749 PolarHBondContact O-N 3.4Å
746	S	87	Confident	89.7	Confident	67 Å²	67	54.4 Å²	54.4	47%	0.469	33%	0.328	S	S	.	.	H	α-helix	trans	-74.1	-22.7	-175.5	52	0	0	0	0	113.5	G743 S744 R750	G743-S746 WeakPolarHBondContact O-CB 3.48Å; G743-S746 PolarHBondContact O-N 3.45Å; G743-S746 PolarHBondContact O-OG 3.17Å; S744-S746 PolarHBondContact O-N 3.16Å; S744-S746 VanDerWaalsContact O-N 3.11Å; S746-R750 PolarHBondContact O-N 3Å; S746-R750 VanDerWaalsContact O-N 3.09Å
747	E	88.5	Confident	89.8	Confident	88 Å²	88	55.2 Å²	55.2	41%	0.411	33%	0.333	S	S	.	.	H	α-helix	trans	-76.7	-43	173.4	-74.7	-61.1	136.7	0	0	111.6	F745 R749 R750 F751	F745-E747 VanDerWaalsContact C-N 3.33Å; E747-R749 VanDerWaalsContact C-N 3.27Å; E747-R749 PolarHBondContact O-N 3.4Å; E747-R750 WeakPolarHBondContact O-CA 3.44Å; E747-R750 VanDerWaalsContact O-CB 3.28Å; E747-R750 WeakPolarHBondContact O-CB 3.26Å; E747-R750 PolarHBondContact O-N 3.41Å; E747-R750 IonicContact OE1-NE 3.01Å; E747-R750 IonicContact OE2-CZ 2.67Å; E747-R750 IonicContact OE2-NE 2.74Å; E747-R750 PolarHBondContact OE2-NE 3.15Å; E747-R750 IonicContact OE2-NH2 2.7Å; E747-R750 PolarHBondContact OE2-NH2 3.13Å; E747-F751 HydrophobicContact CB-CE2 4.39Å; E747-F751 WeakPolarHBondContact O-CD2 3.3Å; E747-F751 PolarHBondContact O-N 2.83Å
748	E	89.9	Confident	90	Very high	67 Å²	67	52.3 Å²	52.3	31%	0.313	30%	0.302	S	S	.	.	H	α-helix	trans	-57.7	-43.9	169.7	-65.8	71	-161.5	0	0	110.1	F741 F745 R750 F751 L752	F741-E748 HydrophobicContact CD1-CB 3.85Å; F741-E748 HydrophobicContact CE1-CB 4.14Å; F745-E748 WeakPolarHBondContact CA-OE2 3.23Å; E748-R750 VanDerWaalsContact C-N 3.27Å; E748-R750 PolarHBondContact O-N 3.33Å; E748-F751 PolarHBondContact O-N 3.46Å; E748-L752 VanDerWaalsContact O-CG 3.31Å; E748-L752 WeakPolarHBondContact O-CG 3.28Å; E748-L752 PolarHBondContact O-N 3.4Å
749	R	92.2	Very high	90.4	Very high	95 Å²	95	51 Å²	51	36%	0.358	29%	0.289	S	S	.	.	H	α-helix	trans	-59	-37.1	174.3	-157.4	-170.2	-169.5	170.6	1.6	112.5	I736 F741 F745 E747 Q753	I736-R749 HydrophobicContact CG2-CG 4.42Å; I736-R749 VanDerWaalsContact O-CZ 3.23Å; I736-R749 PolarHBondContact O-NE 2.91Å; I736-R749 PolarHBondContact O-NH2 2.91Å; F741-R749 HydrophobicContact CB-CB 4.06Å; F741-R749 HydrophobicContact CB-CG 4.11Å; F741-R749 WeakPolarHBondContact O-CB 3.37Å; F741-R749 WeakPolarHBondContact O-CD 3.41Å; F745-R749 PolarHBondContact O-N 3.4Å; E747-R749 VanDerWaalsContact C-N 3.27Å; E747-R749 PolarHBondContact O-N 3.4Å; R749-Q753 WeakPolarHBondContact O-CB 3.48Å; R749-Q753 PolarHBondContact O-N 2.96Å
750	R	91.9	Very high	90.9	Very high	112 Å²	112	49 Å²	49	42%	0.423	26%	0.264	S	S	.	.	H	α-helix	trans	-64.6	-48.3	175.1	179.9	171.4	72.3	102.1	-9	110.9	S746 E747 E748 L752 Q753 E754	S746-R750 PolarHBondContact O-N 3Å; S746-R750 VanDerWaalsContact O-N 3.09Å; E747-R750 WeakPolarHBondContact O-CA 3.44Å; E747-R750 VanDerWaalsContact O-CB 3.28Å; E747-R750 WeakPolarHBondContact O-CB 3.26Å; E747-R750 PolarHBondContact O-N 3.41Å; E747-R750 IonicContact OE1-NE 3.01Å; E747-R750 IonicContact OE2-CZ 2.67Å; E747-R750 IonicContact OE2-NE 2.74Å; E747-R750 PolarHBondContact OE2-NE 3.15Å; E747-R750 IonicContact OE2-NH2 2.7Å; E747-R750 PolarHBondContact OE2-NH2 3.13Å; E748-R750 VanDerWaalsContact C-N 3.27Å; E748-R750 PolarHBondContact O-N 3.33Å; R750-L752 PolarHBondContact O-N 3.28Å; R750-Q753 PolarHBondContact O-N 3.46Å; R750-E754 IonicContact NH1-OE1 3.33Å; R750-E754 WeakPolarHBondContact O-CG 3.41Å; R750-E754 PolarHBondContact O-N 2.93Å
751	F	91.2	Very high	91.3	Very high	52 Å²	52	47.3 Å²	47.3	23%	0.228	26%	0.255	C	S	.	.	H	α-helix	trans	-64.4	-37.6	176.8	-57.7	-51.6	0	0	0	112.7	V137 C138 E747 E748 E754 Q755	V137-F751 HydrophobicContact CG1-CB 3.85Å; C138-F751 HydrophobicContact CB-CD1 4.21Å; E747-F751 HydrophobicContact CB-CE2 4.39Å; E747-F751 WeakPolarHBondContact O-CD2 3.3Å; E747-F751 PolarHBondContact O-N 2.83Å; E748-F751 PolarHBondContact O-N 3.46Å; F751-E754 PolarHBondContact O-N 3.42Å; F751-Q755 WeakPolarHBondContact O-CB 3.21Å; F751-Q755 PolarHBondContact O-N 2.87Å
752	L	93.9	Very high	91.8	Very high	7 Å²	7	47.3 Å²	47.3	4%	0.037	26%	0.256	C	S	.	.	H	α-helix	trans	-63.9	-39.3	173.5	-67.5	-179.6	0	0	0	112.1	L716 I719 L732 A735 I736 F741 E748 R750 Q755 L756	L716-L752 HydrophobicContact CD2-CD1 4.19Å; L716-L752 HydrophobicContact CD2-CD2 3.73Å; L716-L752 HydrophobicContact CD2-CG 4.29Å; I719-L752 HydrophobicContact CD1-CD2 4.46Å; L732-L752 HydrophobicContact CD2-CB 4.2Å; L732-L752 HydrophobicContact CD2-CD2 3.65Å; L732-L752 HydrophobicContact CD2-CG 4.46Å; A735-L752 HydrophobicContact CB-CD1 4.03Å; I736-L752 HydrophobicContact CD1-CB 4.14Å; I736-L752 HydrophobicContact CG1-CB 3.79Å; F741-L752 HydrophobicContact CD1-CD1 3.76Å; F741-L752 HydrophobicContact CD2-CD1 4.2Å; F741-L752 HydrophobicContact CE1-CD1 3.66Å; F741-L752 HydrophobicContact CE2-CD1 4.14Å; F741-L752 HydrophobicContact CG-CD1 4.03Å; F741-L752 HydrophobicContact CZ-CD1 3.88Å; E748-L752 VanDerWaalsContact O-CG 3.31Å; E748-L752 WeakPolarHBondContact O-CG 3.28Å; E748-L752 PolarHBondContact O-N 3.4Å; R750-L752 PolarHBondContact O-N 3.28Å; L752-Q755 PolarHBondContact O-N 3.46Å; L752-L756 WeakPolarHBondContact O-CB 3.38Å; L752-L756 PolarHBondContact O-N 3.4Å
753	Q	94.4	Very high	92.4	Very high	77 Å²	77	48.1 Å²	48.1	36%	0.36	25%	0.254	S	S	.	.	H	α-helix	trans	-65.4	-45.1	174	-175.9	66.8	64.2	0	0	111.6	I736 R749 R750 Q755 L756 D757	I736-Q753 HydrophobicContact CD1-CB 4.4Å; R749-Q753 WeakPolarHBondContact O-CB 3.48Å; R749-Q753 PolarHBondContact O-N 2.96Å; R750-Q753 PolarHBondContact O-N 3.46Å; Q753-Q755 VanDerWaalsContact C-N 3.29Å; Q753-Q755 PolarHBondContact O-N 3.28Å; Q753-L756 WeakPolarHBondContact O-CB 3.41Å; Q753-L756 PolarHBondContact O-N 2.96Å; Q753-L756 VanDerWaalsContact O-N 3.16Å; Q753-D757 PolarHBondContact NE2-OD1 2.85Å; Q753-D757 WeakPolarHBondContact O-CB 3.37Å; Q753-D757 PolarHBondContact O-N 3.44Å
754	E	93.7	Very high	92.9	Very high	61 Å²	61	46.6 Å²	46.6	29%	0.285	23%	0.233	S	C	.	.	H	α-helix	trans	-61.8	-37.4	177.2	-71.5	174	-171.3	0	0	111.9	R750 F751 L758 Y824	R750-E754 IonicContact NH1-OE1 3.33Å; R750-E754 WeakPolarHBondContact O-CG 3.41Å; R750-E754 PolarHBondContact O-N 2.93Å; F751-E754 PolarHBondContact O-N 3.42Å; E754-L758 WeakPolarHBondContact O-CB 3.35Å; E754-L758 PolarHBondContact O-N 3.43Å; E754-Y824 HydrophobicContact CB-CE1 4.37Å
755	Q	93.8	Very high	93.3	Very high	33 Å²	33	41.7 Å²	41.7	15%	0.154	20%	0.198	C	C	.	.	H	α-helix	trans	-70.3	-34.7	173.9	178.1	62.1	97.2	0	0	113.1	L732 F751 L752 Q753 L759	L732-Q755 HydrophobicContact CD1-CG 4.1Å; L732-Q755 HydrophobicContact CD2-CG 4.43Å; F751-Q755 WeakPolarHBondContact O-CB 3.21Å; F751-Q755 PolarHBondContact O-N 2.87Å; L752-Q755 PolarHBondContact O-N 3.46Å; Q753-Q755 VanDerWaalsContact C-N 3.29Å; Q753-Q755 PolarHBondContact O-N 3.28Å; Q755-L759 WeakPolarHBondContact O-CG 3.35Å; Q755-L759 PolarHBondContact O-N 2.83Å; Q755-L759 VanDerWaalsContact O-N 3.17Å
756	L	95.8	Very high	93.6	Very high	9 Å²	9	42 Å²	42	5%	0.047	20%	0.2	C	C	.	.	H	α-helix	trans	-66.1	-52.4	173.2	176.5	62.5	0	0	0	110.7	I729 L732 R733 I736 L752 Q753 L758 L759 E760	I729-L756 HydrophobicContact CB-CD1 4.28Å; I729-L756 HydrophobicContact CG1-CD1 4.1Å; I729-L756 HydrophobicContact CG2-CD1 3.95Å; L732-L756 HydrophobicContact CB-CB 4.32Å; L732-L756 HydrophobicContact CB-CD1 4.13Å; L732-L756 HydrophobicContact CD1-CB 4.29Å; L732-L756 HydrophobicContact CD1-CD1 4.41Å; R733-L756 HydrophobicContact CG-CD1 3.92Å; R733-L756 HydrophobicContact CG-CD2 3.58Å; R733-L756 HydrophobicContact CG-CG 4.43Å; I736-L756 HydrophobicContact CD1-CB 3.98Å; I736-L756 HydrophobicContact CD1-CD2 3.66Å; I736-L756 HydrophobicContact CD1-CG 4.46Å; L752-L756 WeakPolarHBondContact O-CB 3.38Å; L752-L756 PolarHBondContact O-N 3.4Å; Q753-L756 WeakPolarHBondContact O-CB 3.41Å; Q753-L756 PolarHBondContact O-N 2.96Å; Q753-L756 VanDerWaalsContact O-N 3.16Å; L756-L758 PolarHBondContact O-N 2.92Å; L756-L759 PolarHBondContact O-N 2.71Å; L756-L759 VanDerWaalsContact O-N 3.16Å; L756-E760 HydrophobicContact CD1-CG 4.18Å; L756-E760 VanDerWaalsContact CD1-OE1 3.28Å; L756-E760 WeakPolarHBondContact CD1-OE1 3.34Å; L756-E760 WeakPolarHBondContact O-CG 3.49Å; L756-E760 PolarHBondContact O-N 3.25Å
757	D	95.3	Very high	93.9	Very high	35 Å²	35	42.8 Å²	42.8	19%	0.187	20%	0.199	C	C	.	.	H	α-helix	trans	-51.6	-40	174.3	-81.5	27.5	0	0	0	111.6	Q753 R761 Q823	Q753-D757 PolarHBondContact NE2-OD1 2.85Å; Q753-D757 WeakPolarHBondContact O-CB 3.37Å; Q753-D757 PolarHBondContact O-N 3.44Å; D757-R761 VanDerWaalsContact O-CB 3.32Å; D757-R761 WeakPolarHBondContact O-CB 3.23Å; D757-R761 PolarHBondContact O-N 3.08Å; D757-Q823 PolarHBondContact OD2-NE2 3.48Å
758	L	96	Very high	94.2	Very high	4 Å²	4	41.3 Å²	41.3	2%	0.021	20%	0.199	C	C	.	.	H	α-helix	trans	-67.2	-47	179.6	-174.3	62.9	0	0	0	112	E754 L756 R761 Q762 L793 V795 T798 Y824	E754-L758 WeakPolarHBondContact O-CB 3.35Å; E754-L758 PolarHBondContact O-N 3.43Å; L756-L758 PolarHBondContact O-N 2.92Å; L758-R761 PolarHBondContact O-N 3.34Å; L758-Q762 HydrophobicContact CD1-CG 4.31Å; L758-Q762 HydrophobicContact CG-CG 4.35Å; L758-Q762 WeakPolarHBondContact O-CB 3.43Å; L758-Q762 WeakPolarHBondContact O-CG 3.5Å; L758-Q762 PolarHBondContact O-N 3.06Å; L758-L793 WeakPolarHBondContact CD2-O 3.44Å; L758-V795 HydrophobicContact CD1-CG2 4.4Å; L758-V795 HydrophobicContact CD2-CG2 3.94Å; L758-T798 HydrophobicContact CD1-CG2 4.07Å; L758-Y824 WeakPolarHBondContact CA-OH 3.3Å; L758-Y824 WeakPolarHBondContact CB-OH 3.22Å; L758-Y824 HydrophobicContact CD1-CE2 3.98Å; L758-Y824 PolarHBondContact N-OH 2.96Å; L758-Y824 VanDerWaalsContact N-OH 3.11Å
759	L	95.7	Very high	94.4	Very high	2 Å²	2	38.3 Å²	38.3	1%	0.01	19%	0.185	C	C	.	.	H	α-helix	trans	-65.4	-40.2	177.4	-70.1	165.4	0	0	0	111.6	K728 I729 L732 Q755 L756 R761 Q762 L763 V791	K728-L759 HydrophobicContact CB-CD1 4.48Å; K728-L759 HydrophobicContact CD-CD1 4.04Å; K728-L759 HydrophobicContact CG-CD1 4.09Å; I729-L759 HydrophobicContact CD1-CB 4.01Å; I729-L759 HydrophobicContact CG1-CB 3.97Å; I729-L759 HydrophobicContact CG1-CD1 4.25Å; L732-L759 HydrophobicContact CD1-CD1 3.63Å; Q755-L759 WeakPolarHBondContact O-CG 3.35Å; Q755-L759 PolarHBondContact O-N 2.83Å; Q755-L759 VanDerWaalsContact O-N 3.17Å; L756-L759 PolarHBondContact O-N 2.71Å; L756-L759 VanDerWaalsContact O-N 3.16Å; L759-R761 VanDerWaalsContact C-N 3.27Å; L759-R761 PolarHBondContact O-N 2.99Å; L759-Q762 PolarHBondContact O-N 3.17Å; L759-L763 WeakPolarHBondContact O-CG 3.35Å; L759-L763 PolarHBondContact O-N 2.92Å; L759-L763 VanDerWaalsContact O-N 3.09Å; L759-V791 HydrophobicContact CD2-CG1 3.92Å
760	E	95.1	Very high	94.4	Very high	44 Å²	44	36.7 Å²	36.7	21%	0.206	19%	0.185	C	C	.	.	H	α-helix	trans	-66.7	-26.5	176.1	-68.7	-168.6	-160.6	0	0	113	I729 R733 L756 P764	I729-E760 HydrophobicContact CD1-CG 4.24Å; R733-E760 IonicContact CZ-OE1 2.92Å; R733-E760 VanDerWaalsContact CZ-OE1 3.23Å; R733-E760 IonicContact NE-OE1 3.43Å; R733-E760 PolarHBondContact NE-OE1 3.34Å; R733-E760 IonicContact NH2-OE1 2.66Å; R733-E760 PolarHBondContact NH2-OE1 2.89Å; R733-E760 IonicContact NH2-OE2 3.26Å; R733-E760 PolarHBondContact NH2-OE2 3.22Å; L756-E760 HydrophobicContact CD1-CG 4.18Å; L756-E760 VanDerWaalsContact CD1-OE1 3.28Å; L756-E760 WeakPolarHBondContact CD1-OE1 3.34Å; L756-E760 WeakPolarHBondContact O-CG 3.49Å; L756-E760 PolarHBondContact O-N 3.25Å; E760-P764 WeakPolarHBondContact O-CD 3.48Å
761	R	94.9	Very high	94.4	Very high	4 Å²	4	36.3 Å²	36.3	2%	0.015	19%	0.187	C	C	.	.	H	α-helix	trans	-79.1	-41.8	169.7	169.1	179.2	-88.6	170.6	-17.7	113	D757 L758 L759 P764 V765 F814 S819	D757-R761 VanDerWaalsContact O-CB 3.32Å; D757-R761 WeakPolarHBondContact O-CB 3.23Å; D757-R761 PolarHBondContact O-N 3.08Å; L758-R761 PolarHBondContact O-N 3.34Å; L759-R761 VanDerWaalsContact C-N 3.27Å; L759-R761 PolarHBondContact O-N 2.99Å; R761-P764 WeakPolarHBondContact O-CD 3.32Å; R761-V765 WeakPolarHBondContact O-CG2 3.23Å; R761-F814 HydrophobicContact CG-CB 4.23Å; R761-F814 HydrophobicContact CG-CD1 4.38Å; R761-S819 VanDerWaalsContact NH2-C 3.27Å; R761-S819 PolarHBondContact NH2-O 3.27Å; R761-S819 PolarHBondContact NH2-OG 3.36Å
762	Q	96.2	Very high	94.5	Very high	1 Å²	1	34.7 Å²	34.7	1%	0.005	18%	0.183	C	C	.	.	H	α-helix	trans	-66.5	-41	-176.5	-74.8	169.8	-16.7	0	0	111.8	L758 L759 V765 E766 L790 V791 L793 T798	L758-Q762 HydrophobicContact CD1-CG 4.31Å; L758-Q762 HydrophobicContact CG-CG 4.35Å; L758-Q762 WeakPolarHBondContact O-CB 3.43Å; L758-Q762 WeakPolarHBondContact O-CG 3.5Å; L758-Q762 PolarHBondContact O-N 3.06Å; L759-Q762 PolarHBondContact O-N 3.17Å; Q762-V765 PolarHBondContact O-N 3.34Å; Q762-V765 VanDerWaalsContact O-N 3.12Å; Q762-E766 PolarHBondContact O-N 3.42Å; Q762-L790 HydrophobicContact CB-CG 4.32Å; Q762-L790 HydrophobicContact CG-CG 4.08Å; Q762-L790 PolarHBondContact NE2-O 2.89Å; Q762-L790 PolarHBondContact OE1-O 3.14Å; Q762-V791 HydrophobicContact CB-CG2 4.19Å; Q762-L793 PolarHBondContact NE2-O 3.47Å; Q762-T798 HydrophobicContact CG-CG2 4.26Å; Q762-T798 PolarHBondContact NE2-OG1 3.44Å
763	L	95.3	Very high	94.3	Very high	56 Å²	56	37.7 Å²	37.7	29%	0.293	20%	0.199	S	C	.	.	H	α-helix	trans	-59.2	-48.3	-174	-79.7	166.5	0	0	0	114.7	I729 L759 V765 E766 D767 V791	I729-L763 HydrophobicContact CD1-CD1 3.43Å; I729-L763 VanDerWaalsContact CD1-CD1 3.43Å; L759-L763 WeakPolarHBondContact O-CG 3.35Å; L759-L763 PolarHBondContact O-N 2.92Å; L759-L763 VanDerWaalsContact O-N 3.09Å; L763-V765 PolarHBondContact O-N 3.43Å; L763-E766 PolarHBondContact O-N 3.34Å; L763-D767 WeakPolarHBondContact O-CB 3.3Å; L763-D767 PolarHBondContact O-N 2.88Å; L763-V791 HydrophobicContact CD2-CG1 4.31Å; L763-V791 HydrophobicContact CD2-CG2 3.84Å; L763-V791 HydrophobicContact CG-CG2 4.23Å
764	P	94.9	Very high	94.1	Very high	30 Å²	30	39.8 Å²	39.8	20%	0.195	22%	0.216	C	C	.	.	H	α-helix	trans	-63.5	-25.6	175.3	-24.7	34.8	0	0	0	114.6	M355 E760 R761 S768	M355-P764 HydrophobicContact CE-CB 3.98Å; M355-P764 HydrophobicContact SD-CB 4.37Å; E760-P764 WeakPolarHBondContact O-CD 3.48Å; R761-P764 WeakPolarHBondContact O-CD 3.32Å; P764-S768 VanDerWaalsContact O-CB 3.29Å; P764-S768 WeakPolarHBondContact O-CB 3.38Å; P764-S768 PolarHBondContact O-N 3.36Å
765	V	95	Very high	93.9	Very high	6 Å²	6	42.6 Å²	42.6	4%	0.036	23%	0.229	C	C	.	.	H	α-helix	trans	-80.3	-45.8	178	-178.5	0	0	0	0	110	R761 Q762 L763 D767 S768 D769 L790 Y801 F814 A815	R761-V765 WeakPolarHBondContact O-CG2 3.23Å; Q762-V765 PolarHBondContact O-N 3.34Å; Q762-V765 VanDerWaalsContact O-N 3.12Å; L763-V765 PolarHBondContact O-N 3.43Å; V765-D767 VanDerWaalsContact C-N 3.33Å; V765-D767 PolarHBondContact O-N 3.22Å; V765-S768 PolarHBondContact O-N 3.13Å; V765-D769 WeakPolarHBondContact O-CB 3.36Å; V765-D769 VanDerWaalsContact O-CG 3.22Å; V765-D769 PolarHBondContact O-N 3.24Å; V765-L790 HydrophobicContact CB-CD2 3.73Å; V765-L790 HydrophobicContact CG1-CD2 3.49Å; V765-L790 VanDerWaalsContact CG1-CD2 3.49Å; V765-Y801 HydrophobicContact CG1-CE1 4.49Å; V765-F814 HydrophobicContact CG2-CB 4.05Å; V765-A815 HydrophobicContact CB-CB 4.45Å; V765-A815 HydrophobicContact CG1-CB 3.76Å; V765-A815 HydrophobicContact CG2-CB 3.78Å
766	E	94.9	Very high	93.5	Very high	33 Å²	33	43.1 Å²	43.1	15%	0.154	24%	0.244	C	C	.	.	H	α-helix	trans	-56.4	-44.8	174	-176.3	63.5	-132.4	0	0	112.3	Q762 L763 T770 K786 L790 V791	Q762-E766 PolarHBondContact O-N 3.42Å; L763-E766 PolarHBondContact O-N 3.34Å; E766-T770 WeakPolarHBondContact O-CB 3.34Å; E766-T770 PolarHBondContact O-N 2.69Å; E766-T770 PolarHBondContact O-OG1 3.21Å; E766-T770 PolarHBondContact OE1-OG1 2.92Å; E766-K786 IonicContact OE1-NZ 2.66Å; E766-K786 PolarHBondContact OE1-NZ 3.09Å; E766-K786 IonicContact OE2-NZ 2.9Å; E766-K786 PolarHBondContact OE2-NZ 2.84Å; E766-L790 VanDerWaalsContact OE2-CB 3.23Å; E766-L790 WeakPolarHBondContact OE2-CB 3.44Å; E766-L790 PolarHBondContact OE2-N 3.13Å; E766-V791 HydrophobicContact CB-CG2 3.67Å; E766-V791 HydrophobicContact CG-CG2 3.78Å
767	D	94.2	Very high	92.8	Very high	83 Å²	83	47.8 Å²	47.8	44%	0.444	27%	0.265	S	S	.	.	H	α-helix	trans	-65.2	-42.3	176.8	175.7	66.1	0	0	0	112.3	L763 V765 K771	L763-D767 WeakPolarHBondContact O-CB 3.3Å; L763-D767 PolarHBondContact O-N 2.88Å; V765-D767 VanDerWaalsContact C-N 3.33Å; V765-D767 PolarHBondContact O-N 3.22Å; D767-K771 WeakPolarHBondContact O-CB 3.44Å; D767-K771 WeakPolarHBondContact O-CD 3.5Å; D767-K771 VanDerWaalsContact O-CG 3.23Å; D767-K771 WeakPolarHBondContact O-CG 3.43Å; D767-K771 PolarHBondContact O-N 3.11Å; D767-K771 VanDerWaalsContact O-N 3.12Å; D767-K771 WeakPolarHBondContact OD1-CE 3.31Å; D767-K771 IonicContact OD1-NZ 2.69Å; D767-K771 PolarHBondContact OD1-NZ 3.19Å; D767-K771 IonicContact OD2-NZ 3.58Å; D767-K771 PolarHBondContact OD2-NZ 3.17Å
768	S	93.4	Very high	92	Very high	57 Å²	57	47.9 Å²	47.9	40%	0.399	28%	0.275	S	S	.	.	H	α-helix	trans	-63.3	-47.8	175.7	-177.7	0	0	0	0	111.9	P764 V765 K771 A772	P764-S768 VanDerWaalsContact O-CB 3.29Å; P764-S768 WeakPolarHBondContact O-CB 3.38Å; P764-S768 PolarHBondContact O-N 3.36Å; V765-S768 PolarHBondContact O-N 3.13Å; S768-K771 PolarHBondContact O-N 3.16Å; S768-A772 PolarHBondContact O-N 2.98Å
769	D	94.3	Very high	91.3	Very high	4 Å²	4	55.6 Å²	55.6	2%	0.021	31%	0.31	C	S	.	.	H	α-helix	trans	-70.7	-40.6	-176.3	-69	-5.7	0	0	0	111.5	V765 K771 A772 I773 F781 Y801 H806	V765-D769 WeakPolarHBondContact O-CB 3.36Å; V765-D769 VanDerWaalsContact O-CG 3.22Å; V765-D769 PolarHBondContact O-N 3.24Å; D769-K771 VanDerWaalsContact C-N 3.29Å; D769-K771 PolarHBondContact O-N 2.77Å; D769-A772 WeakPolarHBondContact O-CB 3.4Å; D769-A772 PolarHBondContact O-N 2.86Å; D769-I773 VanDerWaalsContact O-CG1 3.28Å; D769-I773 WeakPolarHBondContact O-CG1 3.48Å; D769-I773 PolarHBondContact O-N 2.87Å; D769-F781 HydrophobicContact CB-CE1 4.44Å; D769-F781 HydrophobicContact CB-CE2 4.19Å; D769-F781 HydrophobicContact CB-CZ 3.69Å; D769-Y801 VanDerWaalsContact OD2-CE1 3.25Å; D769-Y801 WeakPolarHBondContact OD2-CE1 3.48Å; D769-Y801 PolarHBondContact OD2-OH 2.77Å; D769-H806 VanDerWaalsContact CG-NE2 3.3Å; D769-H806 IonicContact OD1-CE1 3.64Å; D769-H806 PolarHBondContact OD1-CE1 3.33Å; D769-H806 IonicContact OD1-NE2 2.69Å; D769-H806 PolarHBondContact OD1-NE2 3.11Å; D769-H806 IonicContact OD2-CD2 2.83Å; D769-H806 IonicContact OD2-CE1 3.15Å; D769-H806 IonicContact OD2-NE2 3.01Å; D769-H806 PolarHBondContact OD2-NE2 2.83Å
770	T	92.7	Very high	90.8	Very high	60 Å²	60	58 Å²	58	37%	0.368	32%	0.321	S	S	.	.	H	α-helix	trans	-60.9	-40.5	173.7	-60.3	0	0	0	0	111	E766 V774	E766-T770 WeakPolarHBondContact O-CB 3.34Å; E766-T770 PolarHBondContact O-N 2.69Å; E766-T770 PolarHBondContact O-OG1 3.21Å; E766-T770 PolarHBondContact OE1-OG1 2.92Å; T770-V774 HydrophobicContact CG2-CG2 4.47Å; T770-V774 WeakPolarHBondContact O-CB 3.47Å; T770-V774 VanDerWaalsContact O-CG2 3.27Å; T770-V774 WeakPolarHBondContact O-CG2 3.33Å; T770-V774 PolarHBondContact O-N 3.25Å
771	K	92.7	Very high	90.5	Very high	104 Å²	104	57 Å²	57	45%	0.452	32%	0.316	S	S	.	.	H	α-helix	trans	-66	-39.5	174.6	-75.9	166.6	-174.6	164.1	0	112.4	D767 S768 D769 Q775	D767-K771 WeakPolarHBondContact O-CB 3.44Å; D767-K771 WeakPolarHBondContact O-CD 3.5Å; D767-K771 VanDerWaalsContact O-CG 3.23Å; D767-K771 WeakPolarHBondContact O-CG 3.43Å; D767-K771 PolarHBondContact O-N 3.11Å; D767-K771 VanDerWaalsContact O-N 3.12Å; D767-K771 WeakPolarHBondContact OD1-CE 3.31Å; D767-K771 IonicContact OD1-NZ 2.69Å; D767-K771 PolarHBondContact OD1-NZ 3.19Å; D767-K771 IonicContact OD2-NZ 3.58Å; D767-K771 PolarHBondContact OD2-NZ 3.17Å; S768-K771 PolarHBondContact O-N 3.16Å; D769-K771 VanDerWaalsContact C-N 3.29Å; D769-K771 PolarHBondContact O-N 2.77Å; K771-Q775 WeakPolarHBondContact O-CB 3.25Å; K771-Q775 WeakPolarHBondContact O-CG 3.31Å; K771-Q775 PolarHBondContact O-N 3.43Å
772	A	91.7	Very high	90	Very high	19 Å²	19	63.6 Å²	63.6	16%	0.157	35%	0.345	C	S	.	.	H	α-helix	trans	-61.3	-52.4	175	0	0	0	0	0	110.9	S768 D769 V774 Q775 G776 Q777 F781	S768-A772 PolarHBondContact O-N 2.98Å; D769-A772 WeakPolarHBondContact O-CB 3.4Å; D769-A772 PolarHBondContact O-N 2.86Å; A772-V774 PolarHBondContact O-N 3.38Å; A772-Q775 CarbonylContact O-C 3.57Å; A772-Q775 PolarHBondContact O-N 3.47Å; A772-G776 PolarHBondContact O-N 3.2Å; A772-G776 VanDerWaalsContact O-N 3.12Å; A772-Q777 CarbonylContact C-O 3.55Å; A772-Q777 VanDerWaalsContact C-O 3.3Å; A772-Q777 HydrophobicContact CB-CB 4.29Å; A772-Q777 PolarHBondContact O-N 3.03Å; A772-F781 HydrophobicContact CB-CE2 4.39Å
773	I	91.1	Very high	89.4	Confident	70 Å²	70	70 Å²	70	36%	0.359	37%	0.369	S	S	.	.	H	α-helix	trans	-56.2	-48.5	178.5	-67.3	164	0	0	0	111.3	D769 Q775 G776 F781 K786	D769-I773 VanDerWaalsContact O-CG1 3.28Å; D769-I773 WeakPolarHBondContact O-CG1 3.48Å; D769-I773 PolarHBondContact O-N 2.87Å; I773-Q775 VanDerWaalsContact C-N 3.25Å; I773-Q775 PolarHBondContact O-N 3.48Å; I773-G776 PolarHBondContact O-N 2.84Å; I773-G776 VanDerWaalsContact O-N 3.08Å; I773-F781 HydrophobicContact CD1-CB 4.43Å; I773-F781 HydrophobicContact CD1-CD1 4Å; I773-F781 HydrophobicContact CD1-CD2 4.31Å; I773-F781 HydrophobicContact CD1-CE1 4.35Å; I773-F781 HydrophobicContact CD1-CG 4Å; I773-F781 HydrophobicContact CG1-CB 3.9Å; I773-F781 HydrophobicContact CG1-CD1 4.23Å; I773-F781 HydrophobicContact CG1-CD2 3.74Å; I773-F781 HydrophobicContact CG1-CE2 4.35Å; I773-F781 HydrophobicContact CG1-CG 3.7Å; I773-K786 HydrophobicContact CD1-CB 4.18Å; I773-K786 HydrophobicContact CD1-CD 3.98Å
774	V	89.6	Confident	88.9	Confident	120 Å²	120	69.3 Å²	69.3	73%	0.727	36%	0.364	S	S	*	.	H	α-helix	trans	-65.3	-27.1	179.1	170.2	0	0	0	0	112.7	T770 A772	T770-V774 HydrophobicContact CG2-CG2 4.47Å; T770-V774 WeakPolarHBondContact O-CB 3.47Å; T770-V774 VanDerWaalsContact O-CG2 3.27Å; T770-V774 WeakPolarHBondContact O-CG2 3.33Å; T770-V774 PolarHBondContact O-N 3.25Å; A772-V774 PolarHBondContact O-N 3.38Å
775	Q	90.1	Very high	88.5	Confident	120 Å²	120	72.6 Å²	72.6	56%	0.561	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.4	2.7	175.5	-68.3	174.3	36	0	0	113.6	K771 A772 I773 Q777	K771-Q775 WeakPolarHBondContact O-CB 3.25Å; K771-Q775 WeakPolarHBondContact O-CG 3.31Å; K771-Q775 PolarHBondContact O-N 3.43Å; A772-Q775 CarbonylContact O-C 3.57Å; A772-Q775 PolarHBondContact O-N 3.47Å; I773-Q775 VanDerWaalsContact C-N 3.25Å; I773-Q775 PolarHBondContact O-N 3.48Å; Q775-Q777 VanDerWaalsContact C-N 3.27Å; Q775-Q777 HydrophobicContact CB-CG 4.12Å; Q775-Q777 PolarHBondContact O-N 3.43Å
776	G	85.4	Confident	88.2	Confident	45 Å²	45	74.5 Å²	74.5	46%	0.464	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.9	26.8	-174.8	0	0	0	0	0	113.7	A772 I773 F782	A772-G776 PolarHBondContact O-N 3.2Å; A772-G776 VanDerWaalsContact O-N 3.12Å; I773-G776 PolarHBondContact O-N 2.84Å; I773-G776 VanDerWaalsContact O-N 3.08Å; G776-F782 WeakPolarHBondContact O-CE2 3.37Å
777	Q	80.8	Confident	87.6	Confident	107 Å²	107	78.5 Å²	78.5	50%	0.5	42%	0.424	S	S	.	.			trans	-108	152	-178.7	-65.1	173.9	27.3	0	0	111.3	A772 Q775	A772-Q777 CarbonylContact C-O 3.55Å; A772-Q777 VanDerWaalsContact C-O 3.3Å; A772-Q777 HydrophobicContact CB-CB 4.29Å; A772-Q777 PolarHBondContact O-N 3.03Å; Q775-Q777 VanDerWaalsContact C-N 3.27Å; Q775-Q777 HydrophobicContact CB-CG 4.12Å; Q775-Q777 PolarHBondContact O-N 3.43Å
778	G	79	Confident	87.3	Confident	37 Å²	37	79.3 Å²	79.3	38%	0.381	43%	0.426	S	S	.	.			trans	89.1	84.8	-178.4	0	0	0	0	0	112.1	K780 F781	G778-K780 PolarHBondContact O-N 2.95Å; G778-K780 VanDerWaalsContact O-N 3.1Å; G778-F781 WeakPolarHBondContact O-CB 3.46Å; G778-F781 PolarHBondContact O-N 3.41Å
779	E	81	Confident	87.2	Confident	165 Å²	165	79.4 Å²	79.4	77%	0.771	43%	0.426	S	S	*	.	H	α-helix	trans	-48.9	-37.8	179.2	-172.8	-175.9	162.6	0	0	113.4	F781 F782 R783	E779-F781 PolarHBondContact O-N 2.94Å; E779-F782 PolarHBondContact O-N 3.44Å; E779-R783 PolarHBondContact O-N 2.82Å; E779-R783 VanDerWaalsContact O-N 3.07Å
780	K	85.2	Confident	87.2	Confident	52 Å²	52	79.3 Å²	79.3	23%	0.226	43%	0.426	C	S	.	.	H	α-helix	trans	-60.7	-27.9	177.5	-59.2	-161.3	-171.1	-173.6	0	113.2	G778 F784 L804 Y805 D808	G778-K780 PolarHBondContact O-N 2.95Å; G778-K780 VanDerWaalsContact O-N 3.1Å; K780-F784 WeakPolarHBondContact O-CA 3.4Å; K780-F784 WeakPolarHBondContact O-CB 3.44Å; K780-F784 PolarHBondContact O-N 3.26Å; K780-L804 WeakPolarHBondContact CD-O 3.31Å; K780-Y805 HydrophobicContact CB-CD1 4.14Å; K780-D808 IonicContact NZ-OD2 3.01Å; K780-D808 PolarHBondContact NZ-OD2 2.66Å
781	F	88.7	Confident	87.2	Confident	24 Å²	24	77.8 Å²	77.8	11%	0.105	42%	0.416	C	S	.	.	H	α-helix	trans	-78.1	-19.4	174.5	-61.9	-59	0	0	0	114	D769 A772 I773 G778 E779 F784 P785 Y805	D769-F781 HydrophobicContact CB-CE1 4.44Å; D769-F781 HydrophobicContact CB-CE2 4.19Å; D769-F781 HydrophobicContact CB-CZ 3.69Å; A772-F781 HydrophobicContact CB-CE2 4.39Å; I773-F781 HydrophobicContact CD1-CB 4.43Å; I773-F781 HydrophobicContact CD1-CD1 4Å; I773-F781 HydrophobicContact CD1-CD2 4.31Å; I773-F781 HydrophobicContact CD1-CE1 4.35Å; I773-F781 HydrophobicContact CD1-CG 4Å; I773-F781 HydrophobicContact CG1-CB 3.9Å; I773-F781 HydrophobicContact CG1-CD1 4.23Å; I773-F781 HydrophobicContact CG1-CD2 3.74Å; I773-F781 HydrophobicContact CG1-CE2 4.35Å; I773-F781 HydrophobicContact CG1-CG 3.7Å; G778-F781 WeakPolarHBondContact O-CB 3.46Å; G778-F781 PolarHBondContact O-N 3.41Å; E779-F781 PolarHBondContact O-N 2.94Å; F781-F784 WeakPolarHBondContact CA-O 3.38Å; F781-F784 CarbonylContact O-C 3.48Å; F781-P785 WeakPolarHBondContact O-CA 3.49Å; F781-Y805 AromaticContact CD1-CD1 3.45Å; F781-Y805 HydrophobicContact CD1-CD1 3.45Å; F781-Y805 VanDerWaalsContact CD1-CD1 3.45Å; F781-Y805 AromaticContact CD1-CE1 3.48Å; F781-Y805 HydrophobicContact CD1-CE1 3.48Å; F781-Y805 VanDerWaalsContact CD1-CE1 3.48Å; F781-Y805 HydrophobicContact CD1-CG 4.16Å; F781-Y805 AromaticContact CE1-CD1 3.28Å; F781-Y805 HydrophobicContact CE1-CD1 3.28Å; F781-Y805 HydrophobicContact CE1-CD2 4.04Å; F781-Y805 AromaticContact CE1-CE1 3.68Å; F781-Y805 HydrophobicContact CE1-CE1 3.68Å; F781-Y805 HydrophobicContact CE1-CE2 4.39Å; F781-Y805 AromaticContact CE1-CG 3.49Å; F781-Y805 HydrophobicContact CE1-CG 3.49Å; F781-Y805 VanDerWaalsContact CE1-CG 3.49Å; F781-Y805 HydrophobicContact CG-CD1 4.37Å; F781-Y805 HydrophobicContact CZ-CD1 4.09Å; F781-Y805 HydrophobicContact CZ-CG 4.1Å
782	F	83.5	Confident	87.1	Confident	142 Å²	142	75 Å²	75	62%	0.623	42%	0.417	S	S	*	.	H	α-helix	trans	-81.1	-42.5	170.3	-69.6	-88.3	0	0	0	110.9	G776 E779	G776-F782 WeakPolarHBondContact O-CE2 3.37Å; E779-F782 PolarHBondContact O-N 3.44Å
783	R	83.8	Confident	87.2	Confident	137 Å²	137	75 Å²	75	52%	0.517	41%	0.414	S	S	.	.	H	α-helix	trans	-71.4	-33.6	177.3	-169.4	174.9	174.5	-151.8	-7.9	112.6	E779 Q842 H843	E779-R783 PolarHBondContact O-N 2.82Å; E779-R783 VanDerWaalsContact O-N 3.07Å; R783-Q842 PolarHBondContact NH1-O 3.02Å; R783-Q842 PolarHBondContact NH2-O 3.43Å; R783-H843 PolarHBondContact NH2-CD2 3.02Å; R783-H843 VanDerWaalsContact NH2-CD2 3.27Å
784	F	84.7	Confident	87.4	Confident	41 Å²	41	74.2 Å²	74.2	18%	0.18	42%	0.415	C	S	.	.	S	Bend	trans	-129.5	89.5	176.6	-52.7	-73.2	0	0	0	109.2	K780 F781 K786 L804 Y805 A841 Q842	K780-F784 WeakPolarHBondContact O-CA 3.4Å; K780-F784 WeakPolarHBondContact O-CB 3.44Å; K780-F784 PolarHBondContact O-N 3.26Å; F781-F784 WeakPolarHBondContact CA-O 3.38Å; F781-F784 CarbonylContact O-C 3.48Å; F784-K786 PolarHBondContact O-N 3.14Å; F784-L804 HydrophobicContact CB-CD1 4.48Å; F784-L804 HydrophobicContact CB-CD2 4.39Å; F784-L804 HydrophobicContact CD1-CD1 4.41Å; F784-L804 HydrophobicContact CD2-CD1 3.97Å; F784-L804 HydrophobicContact CE2-CD1 4.34Å; F784-L804 HydrophobicContact CG-CD1 4.01Å; F784-Y805 HydrophobicContact CB-CE1 4Å; F784-Y805 WeakPolarHBondContact O-CE1 3.28Å; F784-Y805 PolarHBondContact O-OH 2.89Å; F784-A841 VanDerWaalsContact CE1-O 3.31Å; F784-A841 WeakPolarHBondContact CE1-O 3.22Å; F784-A841 WeakPolarHBondContact CZ-O 3.31Å; F784-Q842 HydrophobicContact CE2-CG 3.86Å; F784-Q842 HydrophobicContact CZ-CG 4.25Å
785	P	86.1	Confident	87.7	Confident	98 Å²	98	69.9 Å²	69.9	64%	0.636	39%	0.389	S	S	*	.			trans	-59.3	129.8	178.9	-27.2	36.8	0	0	0	112.4	F781 S787	F781-P785 WeakPolarHBondContact O-CA 3.49Å; P785-S787 PolarHBondContact O-N 3.27Å
786	K	89.1	Confident	88	Confident	47 Å²	47	65.7 Å²	65.7	20%	0.204	37%	0.37	C	S	.	.			trans	-63.1	107.3	-179.6	-177.7	173.1	-177.6	171	0	111.1	E766 I773 F784 Q788 Y801	E766-K786 IonicContact OE1-NZ 2.66Å; E766-K786 PolarHBondContact OE1-NZ 3.09Å; E766-K786 IonicContact OE2-NZ 2.9Å; E766-K786 PolarHBondContact OE2-NZ 2.84Å; I773-K786 HydrophobicContact CD1-CB 4.18Å; I773-K786 HydrophobicContact CD1-CD 3.98Å; F784-K786 PolarHBondContact O-N 3.14Å; K786-Q788 WeakPolarHBondContact CE-O 3.28Å; K786-Q788 VanDerWaalsContact CG-O 3.31Å; K786-Q788 WeakPolarHBondContact CG-O 3.48Å; K786-Y801 HydrophobicContact CD-CE2 4.22Å; K786-Y801 WeakPolarHBondContact CE-OH 3.42Å; K786-Y801 HydrophobicContact CG-CE2 4.33Å; K786-Y801 PolarHBondContact NZ-OH 3.31Å; K786-Y801 VanDerWaalsContact NZ-OH 3.1Å
787	S	81.8	Confident	88.4	Confident	117 Å²	117	67.5 Å²	67.5	82%	0.818	37%	0.366	S	S	*	.			trans	-79	-28.7	-177.3	55.1	0	0	0	0	114.3	P785	P785-S787 PolarHBondContact O-N 3.27Å
788	Q	88.3	Confident	89.2	Confident	100 Å²	100	62.5 Å²	62.5	47%	0.467	34%	0.343	S	S	.	.	S	Bend	trans	-147.1	162.9	-177.3	64.2	-177.8	4.4	0	0	113.1	K786 L793	K786-Q788 WeakPolarHBondContact CE-O 3.28Å; K786-Q788 VanDerWaalsContact CG-O 3.31Å; K786-Q788 WeakPolarHBondContact CG-O 3.48Å; Q788-L793 HydrophobicContact CG-CD2 4.47Å
789	S	91.7	Very high	90	Very high	59 Å²	59	60.8 Å²	60.8	41%	0.413	33%	0.325	S	S	.	.			trans	-60.3	141.4	169.5	168.2	0	0	0	0	110.9	V791 L793	S789-V791 PolarHBondContact OG-N 2.83Å; S789-V791 PolarHBondContact OG-O 2.86Å; S789-V791 VanDerWaalsContact OG-O 3.13Å; S789-L793 WeakPolarHBondContact O-CD1 3.43Å; S789-L793 WeakPolarHBondContact O-CG 3.37Å
790	L	93.7	Very high	90.6	Very high	1 Å²	1	55.3 Å²	55.3	1%	0.005	30%	0.3	C	S	.	.	S	Bend	trans	-74.4	-32.7	168.2	178.6	60.8	0	0	0	111.3	Q762 V765 E766 G792 L793 T798 Y801	Q762-L790 HydrophobicContact CB-CG 4.32Å; Q762-L790 HydrophobicContact CG-CG 4.08Å; Q762-L790 PolarHBondContact NE2-O 2.89Å; Q762-L790 PolarHBondContact OE1-O 3.14Å; V765-L790 HydrophobicContact CB-CD2 3.73Å; V765-L790 HydrophobicContact CG1-CD2 3.49Å; V765-L790 VanDerWaalsContact CG1-CD2 3.49Å; E766-L790 VanDerWaalsContact OE2-CB 3.23Å; E766-L790 WeakPolarHBondContact OE2-CB 3.44Å; E766-L790 PolarHBondContact OE2-N 3.13Å; L790-G792 PolarHBondContact O-N 3.32Å; L790-L793 HydrophobicContact CD1-CD1 4.17Å; L790-L793 WeakPolarHBondContact O-CG 3.31Å; L790-L793 PolarHBondContact O-N 3.18Å; L790-T798 HydrophobicContact CD1-CG2 4.02Å; L790-Y801 HydrophobicContact CB-CE1 4.34Å; L790-Y801 HydrophobicContact CB-CE2 4.36Å; L790-Y801 HydrophobicContact CD1-CD1 3.63Å; L790-Y801 HydrophobicContact CD1-CD2 4.21Å; L790-Y801 HydrophobicContact CD1-CE1 4.22Å; L790-Y801 HydrophobicContact CD1-CG 3.64Å; L790-Y801 HydrophobicContact CD2-CD1 3.89Å; L790-Y801 HydrophobicContact CD2-CE1 3.77Å; L790-Y801 HydrophobicContact CG-CD1 4.21Å; L790-Y801 HydrophobicContact CG-CE1 4.32Å
791	V	93.8	Very high	91.1	Very high	29 Å²	29	53.7 Å²	53.7	18%	0.176	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.1	122.6	-179.6	-177.4	0	0	0	0	109.8	L759 Q762 L763 E766 S789	L759-V791 HydrophobicContact CD2-CG1 3.92Å; Q762-V791 HydrophobicContact CB-CG2 4.19Å; L763-V791 HydrophobicContact CD2-CG1 4.31Å; L763-V791 HydrophobicContact CD2-CG2 3.84Å; L763-V791 HydrophobicContact CG-CG2 4.23Å; E766-V791 HydrophobicContact CB-CG2 3.67Å; E766-V791 HydrophobicContact CG-CG2 3.78Å; S789-V791 PolarHBondContact OG-N 2.83Å; S789-V791 PolarHBondContact OG-O 2.86Å; S789-V791 VanDerWaalsContact OG-O 3.13Å
792	G	90.6	Very high	91.4	Very high	45 Å²	45	52.7 Å²	52.7	46%	0.464	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	98.8	-8.2	179.5	0	0	0	0	0	115.2	L790	L790-G792 PolarHBondContact O-N 3.32Å
793	L	93.8	Very high	92	Very high	20 Å²	20	46 Å²	46	11%	0.105	26%	0.259	C	S	.	.			trans	-68.8	157.9	173.4	-59.4	-174.1	0	0	0	111.6	L758 Q762 Q788 S789 L790 E797	L758-L793 WeakPolarHBondContact CD2-O 3.44Å; Q762-L793 PolarHBondContact NE2-O 3.47Å; Q788-L793 HydrophobicContact CG-CD2 4.47Å; S789-L793 WeakPolarHBondContact O-CD1 3.43Å; S789-L793 WeakPolarHBondContact O-CG 3.37Å; L790-L793 HydrophobicContact CD1-CD1 4.17Å; L790-L793 WeakPolarHBondContact O-CG 3.31Å; L790-L793 PolarHBondContact O-N 3.18Å; L793-E797 HydrophobicContact CB-CB 3.87Å; L793-E797 HydrophobicContact CD1-CB 4.23Å; L793-E797 HydrophobicContact CG-CB 4.5Å
794	S	95.1	Very high	92.4	Very high	53 Å²	53	40.9 Å²	40.9	37%	0.371	24%	0.242	S	C	.	.			trans	-68.9	171.6	173.9	69.8	0	0	0	0	112.8	L796 E797 T798	S794-L796 VanDerWaalsContact C-N 3.32Å; S794-L796 PolarHBondContact O-N 2.79Å; S794-E797 WeakPolarHBondContact CB-OE2 3.3Å; S794-E797 PolarHBondContact N-OE2 3.33Å; S794-E797 PolarHBondContact O-N 3.25Å; S794-E797 WeakPolarHBondContact OG-CG 3.32Å; S794-E797 PolarHBondContact OG-N 3.09Å; S794-E797 PolarHBondContact OG-OE2 2.86Å; S794-T798 VanDerWaalsContact O-CB 3.23Å; S794-T798 WeakPolarHBondContact O-CB 3.43Å; S794-T798 PolarHBondContact O-N 3.42Å; S794-T798 PolarHBondContact O-OG1 3Å
795	V	95.6	Very high	92.8	Very high	29 Å²	29	40.1 Å²	40.1	18%	0.176	24%	0.238	C	C	.	.	H	α-helix	trans	-58.7	-40.8	176.6	174.7	0	0	0	0	112.1	L758 L799 Y824 I826	L758-V795 HydrophobicContact CD1-CG2 4.4Å; L758-V795 HydrophobicContact CD2-CG2 3.94Å; V795-L799 WeakPolarHBondContact O-CB 3.34Å; V795-L799 PolarHBondContact O-N 2.72Å; V795-Y824 HydrophobicContact CG1-CD2 3.57Å; V795-Y824 HydrophobicContact CG1-CE2 4.3Å; V795-Y824 HydrophobicContact CG1-CG 3.72Å; V795-Y824 HydrophobicContact CG2-CD1 4.14Å; V795-Y824 HydrophobicContact CG2-CD2 4.19Å; V795-Y824 HydrophobicContact CG2-CE1 4.29Å; V795-Y824 HydrophobicContact CG2-CE2 4.3Å; V795-Y824 HydrophobicContact CG2-CG 4.12Å; V795-I826 HydrophobicContact CG1-CD1 3.74Å; V795-I826 HydrophobicContact CG1-CG1 4.24Å
796	L	95.7	Very high	93.2	Very high	32 Å²	32	36.7 Å²	36.7	17%	0.168	21%	0.213	C	C	.	.	H	α-helix	trans	-76.2	-38.4	-178.2	-65.5	179.6	0	0	0	112.3	W149 S794 T798 L799 E800 I826 Q830	W149-L796 HydrophobicContact CH2-CD1 4.49Å; W149-L796 HydrophobicContact CZ2-CD1 4.45Å; S794-L796 VanDerWaalsContact C-N 3.32Å; S794-L796 PolarHBondContact O-N 2.79Å; L796-T798 VanDerWaalsContact C-N 3.35Å; L796-L799 WeakPolarHBondContact O-CB 3.45Å; L796-L799 PolarHBondContact O-N 3.08Å; L796-E800 PolarHBondContact O-N 3.3Å; L796-I826 HydrophobicContact CD2-CD1 4.49Å; L796-I826 HydrophobicContact CD2-CG2 4.11Å; L796-Q830 HydrophobicContact CD2-CB 4.38Å
797	E	95.1	Very high	93.4	Very high	82 Å²	82	37 Å²	37	38%	0.383	21%	0.213	S	C	.	.	H	α-helix	trans	-66.6	-36.9	172.1	-68.6	164.9	106.9	0	0	111.8	L793 S794 L799 E800 Y801	L793-E797 HydrophobicContact CB-CB 3.87Å; L793-E797 HydrophobicContact CD1-CB 4.23Å; L793-E797 HydrophobicContact CG-CB 4.5Å; S794-E797 WeakPolarHBondContact CB-OE2 3.3Å; S794-E797 PolarHBondContact N-OE2 3.33Å; S794-E797 PolarHBondContact O-N 3.25Å; S794-E797 WeakPolarHBondContact OG-CG 3.32Å; S794-E797 PolarHBondContact OG-N 3.09Å; S794-E797 PolarHBondContact OG-OE2 2.86Å; E797-L799 VanDerWaalsContact C-N 3.33Å; E797-E800 PolarHBondContact O-N 3.4Å; E797-Y801 WeakPolarHBondContact O-CB 3.48Å; E797-Y801 PolarHBondContact O-N 2.81Å
798	T	96.1	Very high	93.8	Very high	3 Å²	3	36.5 Å²	36.5	2%	0.018	20%	0.202	C	C	.	.	H	α-helix	trans	-64.5	-38.5	172.8	-58.5	0	0	0	0	111	L758 Q762 L790 S794 L796 C802 I820	L758-T798 HydrophobicContact CD1-CG2 4.07Å; Q762-T798 HydrophobicContact CG-CG2 4.26Å; Q762-T798 PolarHBondContact NE2-OG1 3.44Å; L790-T798 HydrophobicContact CD1-CG2 4.02Å; S794-T798 VanDerWaalsContact O-CB 3.23Å; S794-T798 WeakPolarHBondContact O-CB 3.43Å; S794-T798 PolarHBondContact O-N 3.42Å; S794-T798 PolarHBondContact O-OG1 3Å; L796-T798 VanDerWaalsContact C-N 3.35Å; T798-C802 VanDerWaalsContact O-CB 3.3Å; T798-C802 WeakPolarHBondContact O-CB 3.23Å; T798-C802 PolarHBondContact O-N 3.17Å; T798-C802 PolarHBondContact O-SG 3.31Å; T798-I820 HydrophobicContact CG2-CD1 4.25Å
799	L	96.8	Very high	94	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-64	-47.1	171.7	179.1	66.2	0	0	0	110.8	V795 L796 E797 C802 C803 P817 I820 I826 F831 I834	V795-L799 WeakPolarHBondContact O-CB 3.34Å; V795-L799 PolarHBondContact O-N 2.72Å; L796-L799 WeakPolarHBondContact O-CB 3.45Å; L796-L799 PolarHBondContact O-N 3.08Å; E797-L799 VanDerWaalsContact C-N 3.33Å; L799-C802 CarbonylContact O-C 3.57Å; L799-C802 PolarHBondContact O-N 2.88Å; L799-C803 WeakPolarHBondContact O-CB 3.34Å; L799-C803 PolarHBondContact O-N 3.23Å; L799-C803 PolarHBondContact O-SG 3.5Å; L799-P817 HydrophobicContact CD1-CB 3.79Å; L799-I820 HydrophobicContact CB-CG2 4.04Å; L799-I820 HydrophobicContact CD1-CB 4.17Å; L799-I820 HydrophobicContact CD1-CG2 4.01Å; L799-I826 HydrophobicContact CB-CD1 4.48Å; L799-I826 HydrophobicContact CD2-CD1 3.91Å; L799-I826 HydrophobicContact CD2-CG2 4.33Å; L799-F831 HydrophobicContact CD1-CD2 4.04Å; L799-F831 HydrophobicContact CD1-CE2 3.94Å; L799-F831 HydrophobicContact CD2-CD2 3.86Å; L799-I834 HydrophobicContact CB-CG2 4.2Å; L799-I834 HydrophobicContact CD2-CB 3.92Å; L799-I834 HydrophobicContact CD2-CG1 4.35Å; L799-I834 HydrophobicContact CD2-CG2 3.84Å; L799-I834 HydrophobicContact CG-CB 4.37Å; L799-I834 HydrophobicContact CG-CG2 3.72Å
800	E	94.6	Very high	94.1	Very high	51 Å²	51	35.8 Å²	35.8	24%	0.238	20%	0.2	C	C	.	.	H	α-helix	trans	-61.1	-47	-179.8	-168.9	174	158.4	0	0	111.9	L796 E797 C802 C803 L804 I834 K837	L796-E800 PolarHBondContact O-N 3.3Å; E797-E800 PolarHBondContact O-N 3.4Å; E800-C802 VanDerWaalsContact C-N 3.33Å; E800-C802 PolarHBondContact O-N 2.81Å; E800-C803 PolarHBondContact O-N 2.97Å; E800-C803 VanDerWaalsContact O-N 3.16Å; E800-L804 WeakPolarHBondContact O-CB 3.36Å; E800-L804 PolarHBondContact O-N 2.88Å; E800-I834 VanDerWaalsContact CA-CG2 3.47Å; E800-I834 HydrophobicContact CB-CG2 3.69Å; E800-I834 HydrophobicContact CG-CG2 4.22Å; E800-K837 WeakPolarHBondContact OE1-CD 3.47Å; E800-K837 WeakPolarHBondContact OE1-CE 3.37Å; E800-K837 IonicContact OE1-NZ 3.43Å; E800-K837 PolarHBondContact OE1-NZ 3.28Å; E800-K837 IonicContact OE2-NZ 3.02Å; E800-K837 PolarHBondContact OE2-NZ 2.73Å
801	Y	95.2	Very high	94	Very high	18 Å²	18	39 Å²	39	7%	0.071	22%	0.223	C	C	.	.	H	α-helix	trans	-55.5	-47.5	172.9	-178.7	-81.5	0	0	0	111.4	V765 D769 K786 L790 E797 C803 L804 Y805	V765-Y801 HydrophobicContact CG1-CE1 4.49Å; D769-Y801 VanDerWaalsContact OD2-CE1 3.25Å; D769-Y801 WeakPolarHBondContact OD2-CE1 3.48Å; D769-Y801 PolarHBondContact OD2-OH 2.77Å; K786-Y801 HydrophobicContact CD-CE2 4.22Å; K786-Y801 WeakPolarHBondContact CE-OH 3.42Å; K786-Y801 HydrophobicContact CG-CE2 4.33Å; K786-Y801 PolarHBondContact NZ-OH 3.31Å; K786-Y801 VanDerWaalsContact NZ-OH 3.1Å; L790-Y801 HydrophobicContact CB-CE1 4.34Å; L790-Y801 HydrophobicContact CB-CE2 4.36Å; L790-Y801 HydrophobicContact CD1-CD1 3.63Å; L790-Y801 HydrophobicContact CD1-CD2 4.21Å; L790-Y801 HydrophobicContact CD1-CE1 4.22Å; L790-Y801 HydrophobicContact CD1-CG 3.64Å; L790-Y801 HydrophobicContact CD2-CD1 3.89Å; L790-Y801 HydrophobicContact CD2-CE1 3.77Å; L790-Y801 HydrophobicContact CG-CD1 4.21Å; L790-Y801 HydrophobicContact CG-CE1 4.32Å; E797-Y801 WeakPolarHBondContact O-CB 3.48Å; E797-Y801 PolarHBondContact O-N 2.81Å; Y801-C803 VanDerWaalsContact C-N 3.35Å; Y801-C803 PolarHBondContact O-N 3.25Å; Y801-L804 PolarHBondContact O-N 3.26Å; Y801-Y805 AromaticContact CD1-CD2 3.85Å; Y801-Y805 HydrophobicContact CD1-CD2 3.85Å; Y801-Y805 AromaticContact CD2-CD2 3.68Å; Y801-Y805 HydrophobicContact CD2-CD2 3.68Å; Y801-Y805 AromaticContact CD2-CE2 3.53Å; Y801-Y805 HydrophobicContact CD2-CE2 3.53Å; Y801-Y805 AromaticContact CE1-CD2 3.75Å; Y801-Y805 HydrophobicContact CE1-CD2 3.75Å; Y801-Y805 HydrophobicContact CE1-CE2 4.49Å; Y801-Y805 AromaticContact CE2-CD2 3.59Å; Y801-Y805 HydrophobicContact CE2-CD2 3.59Å; Y801-Y805 AromaticContact CE2-CE2 3.48Å; Y801-Y805 HydrophobicContact CE2-CE2 3.48Å; Y801-Y805 VanDerWaalsContact CE2-CE2 3.48Å; Y801-Y805 AromaticContact CG-CD2 3.8Å; Y801-Y805 HydrophobicContact CG-CD2 3.8Å; Y801-Y805 HydrophobicContact CG-CE2 4.08Å; Y801-Y805 AromaticContact CZ-CD2 3.62Å; Y801-Y805 AromaticContact CZ-CE2 3.99Å; Y801-Y805 WeakPolarHBondContact O-CD2 3.43Å; Y801-Y805 PolarHBondContact O-N 3.43Å
802	C	95.4	Very high	93.9	Very high	2 Å²	2	43.1 Å²	43.1	1%	0.014	24%	0.244	C	C	.	.	H	α-helix	trans	-68.7	-30.6	178.6	-71.8	0	0	0	0	113	T798 L799 E800 H806 Y807 A815 P817 I820	T798-C802 VanDerWaalsContact O-CB 3.3Å; T798-C802 WeakPolarHBondContact O-CB 3.23Å; T798-C802 PolarHBondContact O-N 3.17Å; T798-C802 PolarHBondContact O-SG 3.31Å; L799-C802 CarbonylContact O-C 3.57Å; L799-C802 PolarHBondContact O-N 2.88Å; E800-C802 VanDerWaalsContact C-N 3.33Å; E800-C802 PolarHBondContact O-N 2.81Å; C802-H806 CarbonylContact O-C 3.57Å; C802-H806 WeakPolarHBondContact O-CA 3.45Å; C802-H806 WeakPolarHBondContact O-CB 3.49Å; C802-H806 PolarHBondContact O-N 3.4Å; C802-Y807 PolarHBondContact O-N 2.74Å; C802-A815 VanDerWaalsContact CB-O 3.28Å; C802-A815 WeakPolarHBondContact CB-O 3.22Å; C802-A815 PolarHBondContact SG-O 3.42Å; C802-P817 HydrophobicContact CB-CG 4.29Å; C802-I820 HydrophobicContact CB-CD1 3.55Å; C802-I820 WeakPolarHBondContact SG-CD1 3.49Å
803	C	94.4	Very high	94	Very high	1 Å²	1	42.6 Å²	42.6	1%	0.007	23%	0.233	C	C	.	.	H	α-helix	trans	-72.3	-28.3	171.2	-66.2	0	0	0	0	112.5	L799 E800 Y801 Y807 P817 A838 Q842	L799-C803 WeakPolarHBondContact O-CB 3.34Å; L799-C803 PolarHBondContact O-N 3.23Å; L799-C803 PolarHBondContact O-SG 3.5Å; E800-C803 PolarHBondContact O-N 2.97Å; E800-C803 VanDerWaalsContact O-N 3.16Å; Y801-C803 VanDerWaalsContact C-N 3.35Å; Y801-C803 PolarHBondContact O-N 3.25Å; C803-Y807 WeakPolarHBondContact O-CB 3.29Å; C803-P817 HydrophobicContact CB-CG 4.4Å; C803-P817 VanDerWaalsContact SG-CG 3.58Å; C803-A838 HydrophobicContact CB-CB 3.34Å; C803-Q842 PolarHBondContact O-NE2 3.36Å
804	L	93.3	Very high	93.8	Very high	31 Å²	31	42 Å²	42	16%	0.162	23%	0.23	C	C	.	.	H	α-helix	trans	-77.9	-46.9	177.4	-177.1	57	0	0	0	112.1	K780 F784 E800 Y801 Q842	K780-L804 WeakPolarHBondContact CD-O 3.31Å; F784-L804 HydrophobicContact CB-CD1 4.48Å; F784-L804 HydrophobicContact CB-CD2 4.39Å; F784-L804 HydrophobicContact CD1-CD1 4.41Å; F784-L804 HydrophobicContact CD2-CD1 3.97Å; F784-L804 HydrophobicContact CE2-CD1 4.34Å; F784-L804 HydrophobicContact CG-CD1 4.01Å; E800-L804 WeakPolarHBondContact O-CB 3.36Å; E800-L804 PolarHBondContact O-N 2.88Å; Y801-L804 PolarHBondContact O-N 3.26Å; L804-Q842 HydrophobicContact CD1-CG 3.89Å; L804-Q842 PolarHBondContact O-OE1 3.47Å
805	Y	93	Very high	93.8	Very high	24 Å²	24	39.7 Å²	39.7	9%	0.094	21%	0.214	C	C	.	.	H	α-helix	trans	-99.5	-29.9	-173.6	-58.6	-67.4	0	0	0	114.2	K780 F781 F784 Y801	K780-Y805 HydrophobicContact CB-CD1 4.14Å; F781-Y805 AromaticContact CD1-CD1 3.45Å; F781-Y805 HydrophobicContact CD1-CD1 3.45Å; F781-Y805 VanDerWaalsContact CD1-CD1 3.45Å; F781-Y805 AromaticContact CD1-CE1 3.48Å; F781-Y805 HydrophobicContact CD1-CE1 3.48Å; F781-Y805 VanDerWaalsContact CD1-CE1 3.48Å; F781-Y805 HydrophobicContact CD1-CG 4.16Å; F781-Y805 AromaticContact CE1-CD1 3.28Å; F781-Y805 HydrophobicContact CE1-CD1 3.28Å; F781-Y805 HydrophobicContact CE1-CD2 4.04Å; F781-Y805 AromaticContact CE1-CE1 3.68Å; F781-Y805 HydrophobicContact CE1-CE1 3.68Å; F781-Y805 HydrophobicContact CE1-CE2 4.39Å; F781-Y805 AromaticContact CE1-CG 3.49Å; F781-Y805 HydrophobicContact CE1-CG 3.49Å; F781-Y805 VanDerWaalsContact CE1-CG 3.49Å; F781-Y805 HydrophobicContact CG-CD1 4.37Å; F781-Y805 HydrophobicContact CZ-CD1 4.09Å; F781-Y805 HydrophobicContact CZ-CG 4.1Å; F784-Y805 HydrophobicContact CB-CE1 4Å; F784-Y805 WeakPolarHBondContact O-CE1 3.28Å; F784-Y805 PolarHBondContact O-OH 2.89Å; Y801-Y805 AromaticContact CD1-CD2 3.85Å; Y801-Y805 HydrophobicContact CD1-CD2 3.85Å; Y801-Y805 AromaticContact CD2-CD2 3.68Å; Y801-Y805 HydrophobicContact CD2-CD2 3.68Å; Y801-Y805 AromaticContact CD2-CE2 3.53Å; Y801-Y805 HydrophobicContact CD2-CE2 3.53Å; Y801-Y805 AromaticContact CE1-CD2 3.75Å; Y801-Y805 HydrophobicContact CE1-CD2 3.75Å; Y801-Y805 HydrophobicContact CE1-CE2 4.49Å; Y801-Y805 AromaticContact CE2-CD2 3.59Å; Y801-Y805 HydrophobicContact CE2-CD2 3.59Å; Y801-Y805 AromaticContact CE2-CE2 3.48Å; Y801-Y805 HydrophobicContact CE2-CE2 3.48Å; Y801-Y805 VanDerWaalsContact CE2-CE2 3.48Å; Y801-Y805 AromaticContact CG-CD2 3.8Å; Y801-Y805 HydrophobicContact CG-CD2 3.8Å; Y801-Y805 HydrophobicContact CG-CE2 4.08Å; Y801-Y805 AromaticContact CZ-CD2 3.62Å; Y801-Y805 AromaticContact CZ-CE2 3.99Å; Y801-Y805 WeakPolarHBondContact O-CD2 3.43Å; Y801-Y805 PolarHBondContact O-N 3.43Å
806	H	94	Very high	93.8	Very high	27 Å²	27	38.3 Å²	38.3	13%	0.125	21%	0.205	C	C	.	.	S	Bend	trans	-129.1	16.8	-162.8	-63.8	-64.8	0	0	0	114.5	D769 C802 D808 L809 A815	D769-H806 VanDerWaalsContact CG-NE2 3.3Å; D769-H806 IonicContact OD1-CE1 3.64Å; D769-H806 PolarHBondContact OD1-CE1 3.33Å; D769-H806 IonicContact OD1-NE2 2.69Å; D769-H806 PolarHBondContact OD1-NE2 3.11Å; D769-H806 IonicContact OD2-CD2 2.83Å; D769-H806 IonicContact OD2-CE1 3.15Å; D769-H806 IonicContact OD2-NE2 3.01Å; D769-H806 PolarHBondContact OD2-NE2 2.83Å; C802-H806 CarbonylContact O-C 3.57Å; C802-H806 WeakPolarHBondContact O-CA 3.45Å; C802-H806 WeakPolarHBondContact O-CB 3.49Å; C802-H806 PolarHBondContact O-N 3.4Å; H806-D808 PolarHBondContact O-N 3.33Å; H806-D808 VanDerWaalsContact O-N 3.11Å; H806-L809 HydrophobicContact CB-CD1 3.83Å; H806-L809 HydrophobicContact CB-CG 4.11Å; H806-L809 WeakPolarHBondContact O-CB 3.39Å; H806-L809 WeakPolarHBondContact O-CG 3.49Å; H806-L809 PolarHBondContact O-N 3.47Å; H806-A815 HydrophobicContact CB-CB 3.89Å; H806-A815 WeakPolarHBondContact CB-O 3.3Å
807	Y	92.7	Very high	93.8	Very high	52 Å²	52	36.9 Å²	36.9	20%	0.204	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-45.7	-47	-174.9	-177.9	-112.9	0	0	0	113.8	C802 C803 L809 V835 L839 M844	C802-Y807 PolarHBondContact O-N 2.74Å; C803-Y807 WeakPolarHBondContact O-CB 3.29Å; Y807-L809 PolarHBondContact O-N 3.16Å; Y807-V835 HydrophobicContact CD2-CG1 4.43Å; Y807-V835 HydrophobicContact CE2-CG1 3.63Å; Y807-L839 HydrophobicContact CD1-CD2 4.07Å; Y807-L839 HydrophobicContact CD2-CD2 4.37Å; Y807-L839 HydrophobicContact CE1-CD2 3.9Å; Y807-L839 HydrophobicContact CE2-CD1 4.42Å; Y807-L839 HydrophobicContact CE2-CD2 4.24Å; Y807-L839 HydrophobicContact CG-CD2 4.31Å; Y807-M844 HydrophobicContact CD1-CE 4.28Å
808	D	91.1	Very high	93.8	Very high	107 Å²	107	37 Å²	37	57%	0.572	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.6	-1.9	-171	-45.8	-84.3	0	0	0	113.2	K780 H806	K780-D808 IonicContact NZ-OD2 3.01Å; K780-D808 PolarHBondContact NZ-OD2 2.66Å; H806-D808 PolarHBondContact O-N 3.33Å; H806-D808 VanDerWaalsContact O-N 3.11Å
809	L	93.3	Very high	93.8	Very high	64 Å²	64	37.2 Å²	37.2	34%	0.335	20%	0.203	S	C	.	.	S	Bend	trans	-75.9	135.2	-178.2	-65.1	-169.5	0	0	0	112.5	H806 Y807 S813 A815 S816	H806-L809 HydrophobicContact CB-CD1 3.83Å; H806-L809 HydrophobicContact CB-CG 4.11Å; H806-L809 WeakPolarHBondContact O-CB 3.39Å; H806-L809 WeakPolarHBondContact O-CG 3.49Å; H806-L809 PolarHBondContact O-N 3.47Å; Y807-L809 PolarHBondContact O-N 3.16Å; L809-S813 WeakPolarHBondContact CD1-OG 3.36Å; L809-A815 HydrophobicContact CD1-CB 4.02Å; L809-S816 VanDerWaalsContact O-CB 3.24Å; L809-S816 WeakPolarHBondContact O-CB 3.36Å; L809-S816 PolarHBondContact O-OG 2.66Å
810	P	93.4	Very high	93.7	Very high	80 Å²	80	37.2 Å²	37.2	52%	0.519	20%	0.203	S	C	.	.			trans	-63.9	152.3	177.7	25.7	-34.3	0	0	0	112.5	N812 S813 S816	P810-N812 WeakPolarHBondContact CG-OD1 3.43Å; P810-N812 PolarHBondContact O-N 3Å; P810-N812 PolarHBondContact O-OD1 2.94Å; P810-S813 WeakPolarHBondContact O-CB 3.41Å; P810-S813 PolarHBondContact O-N 2.98Å; P810-S816 VanDerWaalsContact O-CB 3.27Å; P810-S816 WeakPolarHBondContact O-CB 3.41Å
811	S	91.1	Very high	93.8	Very high	69 Å²	69	38.1 Å²	38.1	48%	0.483	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	2.9	-173.4	-33.1	0	0	0	0	116.1	L818 S819	S811-L818 WeakPolarHBondContact OG-CB 3.4Å; S811-S819 VanDerWaalsContact O-CB 3.31Å; S811-S819 WeakPolarHBondContact O-CB 3.46Å
812	N	90.8	Very high	93.7	Very high	116 Å²	116	41 Å²	41	62%	0.62	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98.1	1	170.9	65.8	0.7	0	0	0	113.3	P810	P810-N812 WeakPolarHBondContact CG-OD1 3.43Å; P810-N812 PolarHBondContact O-N 3Å; P810-N812 PolarHBondContact O-OD1 2.94Å
813	S	92.8	Very high	93.6	Very high	33 Å²	33	43.2 Å²	43.2	23%	0.231	24%	0.242	C	C	.	.	S	Bend	trans	-89.1	142.4	168.2	178.1	0	0	0	0	111.2	L809 P810 A815 S816 S819	L809-S813 WeakPolarHBondContact CD1-OG 3.36Å; P810-S813 WeakPolarHBondContact O-CB 3.41Å; P810-S813 PolarHBondContact O-N 2.98Å; S813-A815 PolarHBondContact O-N 3.12Å; S813-A815 PolarHBondContact OG-N 2.81Å; S813-S816 PolarHBondContact O-N 3.41Å; S813-S819 WeakPolarHBondContact O-CB 3.1Å; S813-S819 PolarHBondContact O-OG 3.28Å
814	F	90.5	Very high	93.5	Very high	8 Å²	8	44.9 Å²	44.9	4%	0.035	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-25.9	172.1	-75	-54.8	0	0	0	113.4	F348 M351 M355 R761 V765	F348-F814 AromaticContact CD1-CE1 3.95Å; F348-F814 HydrophobicContact CD1-CE1 3.95Å; F348-F814 HydrophobicContact CD1-CZ 4.08Å; F348-F814 HydrophobicContact CE1-CE1 4.14Å; M351-F814 HydrophobicContact CB-CE2 3.9Å; M351-F814 HydrophobicContact CB-CZ 3.7Å; M351-F814 HydrophobicContact CE-CE1 4.02Å; M351-F814 HydrophobicContact CE-CZ 4.21Å; M351-F814 HydrophobicContact CG-CE2 4.26Å; M351-F814 HydrophobicContact CG-CZ 4.16Å; M351-F814 HydrophobicContact SD-CD1 4.05Å; M351-F814 HydrophobicContact SD-CD2 4.43Å; M351-F814 HydrophobicContact SD-CE1 3.67Å; M351-F814 HydrophobicContact SD-CE2 4.09Å; M351-F814 HydrophobicContact SD-CG 4.41Å; M351-F814 HydrophobicContact SD-CZ 3.7Å; M355-F814 HydrophobicContact SD-CD2 3.69Å; M355-F814 HydrophobicContact SD-CE2 4.18Å; R761-F814 HydrophobicContact CG-CB 4.23Å; R761-F814 HydrophobicContact CG-CD1 4.38Å; V765-F814 HydrophobicContact CG2-CB 4.05Å
815	A	94.4	Very high	93.5	Very high	4 Å²	4	52.3 Å²	52.3	3%	0.033	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95	5.5	178.6	0	0	0	0	0	114	V765 C802 H806 L809 S813	V765-A815 HydrophobicContact CB-CB 4.45Å; V765-A815 HydrophobicContact CG1-CB 3.76Å; V765-A815 HydrophobicContact CG2-CB 3.78Å; C802-A815 VanDerWaalsContact CB-O 3.28Å; C802-A815 WeakPolarHBondContact CB-O 3.22Å; C802-A815 PolarHBondContact SG-O 3.42Å; H806-A815 HydrophobicContact CB-CB 3.89Å; H806-A815 WeakPolarHBondContact CB-O 3.3Å; L809-A815 HydrophobicContact CD1-CB 4.02Å; S813-A815 PolarHBondContact O-N 3.12Å; S813-A815 PolarHBondContact OG-N 2.81Å
816	S	96.2	Very high	93.5	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	28%	0.277	C	S	.	.			trans	-76.4	127.7	177.3	177.6	0	0	0	0	111.1	L809 P810 S813 L818 S819 I820	L809-S816 VanDerWaalsContact O-CB 3.24Å; L809-S816 WeakPolarHBondContact O-CB 3.36Å; L809-S816 PolarHBondContact O-OG 2.66Å; P810-S816 VanDerWaalsContact O-CB 3.27Å; P810-S816 WeakPolarHBondContact O-CB 3.41Å; S813-S816 PolarHBondContact O-N 3.41Å; S816-L818 PolarHBondContact O-N 3.13Å; S816-L818 VanDerWaalsContact O-N 3.12Å; S816-L818 PolarHBondContact OG-N 3.32Å; S816-S819 PolarHBondContact O-N 2.76Å; S816-S819 PolarHBondContact O-OG 3.36Å; S816-S819 VanDerWaalsContact O-OG 3.11Å; S816-I820 PolarHBondContact O-N 2.77Å; S816-I820 VanDerWaalsContact O-N 3.1Å
817	P	96	Very high	93.4	Very high	2 Å²	2	51.6 Å²	51.6	1%	0.013	28%	0.28	C	S	.	.	H	α-helix	trans	-52.3	-34.6	173.1	-30.8	38.3	0	0	0	113.9	L799 C802 C803 I820 R821 F831	L799-P817 HydrophobicContact CD1-CB 3.79Å; C802-P817 HydrophobicContact CB-CG 4.29Å; C803-P817 HydrophobicContact CB-CG 4.4Å; C803-P817 VanDerWaalsContact SG-CG 3.58Å; P817-I820 PolarHBondContact O-N 3.47Å; P817-R821 WeakPolarHBondContact O-CB 3.06Å; P817-R821 PolarHBondContact O-N 2.98Å; P817-F831 HydrophobicContact CB-CE2 4.03Å; P817-F831 HydrophobicContact CB-CZ 4.37Å
818	L	95.4	Very high	93.1	Very high	85 Å²	85	54.2 Å²	54.2	45%	0.445	30%	0.297	S	S	.	.	H	α-helix	trans	-70.5	-34	178.7	-63.7	176.4	0	0	0	112.5	S811 S816 I820 A822 F831	S811-L818 WeakPolarHBondContact OG-CB 3.4Å; S816-L818 PolarHBondContact O-N 3.13Å; S816-L818 VanDerWaalsContact O-N 3.12Å; S816-L818 PolarHBondContact OG-N 3.32Å; L818-I820 VanDerWaalsContact C-N 3.34Å; L818-A822 VanDerWaalsContact O-CB 3.26Å; L818-A822 WeakPolarHBondContact O-CB 3.36Å; L818-A822 PolarHBondContact O-N 2.92Å; L818-F831 HydrophobicContact CD2-CE1 4.46Å; L818-F831 HydrophobicContact CD2-CZ 3.85Å
819	S	95.4	Very high	92.9	Very high	8 Å²	8	52.1 Å²	52.1	6%	0.056	28%	0.281	C	S	.	.	H	α-helix	trans	-74.7	-28	174.7	86.1	0	0	0	0	111.8	R761 S811 S813 S816 Q823	R761-S819 VanDerWaalsContact NH2-C 3.27Å; R761-S819 PolarHBondContact NH2-O 3.27Å; R761-S819 PolarHBondContact NH2-OG 3.36Å; S811-S819 VanDerWaalsContact O-CB 3.31Å; S811-S819 WeakPolarHBondContact O-CB 3.46Å; S813-S819 WeakPolarHBondContact O-CB 3.1Å; S813-S819 PolarHBondContact O-OG 3.28Å; S816-S819 PolarHBondContact O-N 2.76Å; S816-S819 PolarHBondContact O-OG 3.36Å; S816-S819 VanDerWaalsContact O-OG 3.11Å; S819-Q823 WeakPolarHBondContact O-CB 3.47Å; S819-Q823 PolarHBondContact O-N 3.04Å
820	I	95.5	Very high	92.8	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-69.6	-52.8	173.4	-65.3	166.3	0	0	0	110.4	T798 L799 C802 S816 P817 L818 A822 Q823 Y824 I826	T798-I820 HydrophobicContact CG2-CD1 4.25Å; L799-I820 HydrophobicContact CB-CG2 4.04Å; L799-I820 HydrophobicContact CD1-CB 4.17Å; L799-I820 HydrophobicContact CD1-CG2 4.01Å; C802-I820 HydrophobicContact CB-CD1 3.55Å; C802-I820 WeakPolarHBondContact SG-CD1 3.49Å; S816-I820 PolarHBondContact O-N 2.77Å; S816-I820 VanDerWaalsContact O-N 3.1Å; P817-I820 PolarHBondContact O-N 3.47Å; L818-I820 VanDerWaalsContact C-N 3.34Å; I820-A822 VanDerWaalsContact C-N 3.31Å; I820-A822 PolarHBondContact O-N 3.32Å; I820-Q823 PolarHBondContact O-N 2.9Å; I820-Y824 HydrophobicContact CG2-CD2 4.19Å; I820-Y824 PolarHBondContact O-N 3.31Å; I820-Y824 VanDerWaalsContact O-N 3.13Å; I820-I826 HydrophobicContact CG2-CD1 3.89Å
821	R	95.4	Very high	92.8	Very high	69 Å²	69	47.6 Å²	47.6	26%	0.26	25%	0.251	S	S	.	.	H	α-helix	trans	-52.6	-47.2	173.9	-175.2	-172.2	176.5	177.2	-12.3	112.1	P817 K825 I826 D828 F831	P817-R821 WeakPolarHBondContact O-CB 3.06Å; P817-R821 PolarHBondContact O-N 2.98Å; R821-K825 WeakPolarHBondContact O-CA 3.43Å; R821-K825 PolarHBondContact O-N 3.05Å; R821-I826 HydrophobicContact CG-CB 4.32Å; R821-I826 PolarHBondContact O-N 3.02Å; R821-D828 IonicContact CZ-OD1 2.78Å; R821-D828 IonicContact CZ-OD2 3.87Å; R821-D828 IonicContact NH2-OD1 2.69Å; R821-D828 PolarHBondContact NH2-OD1 3.26Å; R821-D828 IonicContact NH2-OD2 2.73Å; R821-D828 PolarHBondContact NH2-OD2 3.26Å; R821-F831 HydrophobicContact CB-CD2 3.68Å; R821-F831 HydrophobicContact CB-CE2 3.81Å; R821-F831 HydrophobicContact CB-CG 4.46Å; R821-F831 HydrophobicContact CG-CB 4.4Å; R821-F831 HydrophobicContact CG-CD2 3.82Å; R821-F831 HydrophobicContact CG-CE2 4.28Å; R821-F831 HydrophobicContact CG-CG 4.11Å
822	A	93.6	Very high	92.7	Very high	79 Å²	79	44.6 Å²	44.6	65%	0.653	23%	0.232	S	C	*	.	H	α-helix	trans	-68.3	-35.1	-176.8	0	0	0	0	0	114	L818 I820	L818-A822 VanDerWaalsContact O-CB 3.26Å; L818-A822 WeakPolarHBondContact O-CB 3.36Å; L818-A822 PolarHBondContact O-N 2.92Å; I820-A822 VanDerWaalsContact C-N 3.31Å; I820-A822 PolarHBondContact O-N 3.32Å
823	Q	92.3	Very high	92.8	Very high	49 Å²	49	41.1 Å²	41.1	23%	0.229	21%	0.21	C	C	.	.	H	α-helix	trans	-76.7	-42.7	179.3	-176.3	166.2	-13.2	0	0	112.2	D757 S819 I820	D757-Q823 PolarHBondContact OD2-NE2 3.48Å; S819-Q823 WeakPolarHBondContact O-CB 3.47Å; S819-Q823 PolarHBondContact O-N 3.04Å; I820-Q823 PolarHBondContact O-N 2.9Å
824	Y	92.9	Very high	92.8	Very high	35 Å²	35	39.7 Å²	39.7	14%	0.137	20%	0.2	C	C	.	.	H	α-helix	trans	-97	5.4	-175.5	-61.4	-66.1	0	0	0	114.7	E754 L758 V795 I820 I826	E754-Y824 HydrophobicContact CB-CE1 4.37Å; L758-Y824 WeakPolarHBondContact CA-OH 3.3Å; L758-Y824 WeakPolarHBondContact CB-OH 3.22Å; L758-Y824 HydrophobicContact CD1-CE2 3.98Å; L758-Y824 PolarHBondContact N-OH 2.96Å; L758-Y824 VanDerWaalsContact N-OH 3.11Å; V795-Y824 HydrophobicContact CG1-CD2 3.57Å; V795-Y824 HydrophobicContact CG1-CE2 4.3Å; V795-Y824 HydrophobicContact CG1-CG 3.72Å; V795-Y824 HydrophobicContact CG2-CD1 4.14Å; V795-Y824 HydrophobicContact CG2-CD2 4.19Å; V795-Y824 HydrophobicContact CG2-CE1 4.29Å; V795-Y824 HydrophobicContact CG2-CE2 4.3Å; V795-Y824 HydrophobicContact CG2-CG 4.12Å; I820-Y824 HydrophobicContact CG2-CD2 4.19Å; I820-Y824 PolarHBondContact O-N 3.31Å; I820-Y824 VanDerWaalsContact O-N 3.13Å; Y824-I826 PolarHBondContact O-N 2.83Å
825	K	93.1	Very high	93	Very high	187 Å²	187	39.3 Å²	39.3	81%	0.813	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.5	34.1	178.6	-50.7	174.2	-175.1	169.4	0	114	R821 S827	R821-K825 WeakPolarHBondContact O-CA 3.43Å; R821-K825 PolarHBondContact O-N 3.05Å; K825-S827 PolarHBondContact O-N 2.69Å
826	I	93.2	Very high	92.9	Very high	9 Å²	9	39.1 Å²	39.1	5%	0.046	20%	0.197	C	C	.	.			trans	-57.1	131.7	-177.1	-57.1	177.6	0	0	0	109.6	V795 L796 L799 I820 R821 Y824 Q830 F831	V795-I826 HydrophobicContact CG1-CD1 3.74Å; V795-I826 HydrophobicContact CG1-CG1 4.24Å; L796-I826 HydrophobicContact CD2-CD1 4.49Å; L796-I826 HydrophobicContact CD2-CG2 4.11Å; L799-I826 HydrophobicContact CB-CD1 4.48Å; L799-I826 HydrophobicContact CD2-CD1 3.91Å; L799-I826 HydrophobicContact CD2-CG2 4.33Å; I820-I826 HydrophobicContact CG2-CD1 3.89Å; R821-I826 HydrophobicContact CG-CB 4.32Å; R821-I826 PolarHBondContact O-N 3.02Å; Y824-I826 PolarHBondContact O-N 2.83Å; I826-Q830 HydrophobicContact CG2-CB 3.57Å; I826-F831 HydrophobicContact CG2-CB 4.14Å
827	S	91.6	Very high	92.7	Very high	28 Å²	28	41.4 Å²	41.4	20%	0.196	21%	0.206	C	C	.	.			trans	-62.3	151.9	-174.6	87.7	0	0	0	0	111.1	D143 K825 R829 Q830 F831	D143-S827 PolarHBondContact OD1-OG 3.02Å; K825-S827 PolarHBondContact O-N 2.69Å; S827-R829 PolarHBondContact O-N 2.93Å; S827-R829 VanDerWaalsContact O-N 3.13Å; S827-R829 PolarHBondContact OG-N 3.44Å; S827-Q830 VanDerWaalsContact N-OE1 3.13Å; S827-Q830 PolarHBondContact O-N 2.95Å; S827-Q830 WeakPolarHBondContact OG-CG 3.41Å; S827-Q830 PolarHBondContact OG-N 2.72Å; S827-F831 WeakPolarHBondContact O-CB 3.33Å; S827-F831 PolarHBondContact O-N 2.98Å
828	D	87.3	Confident	92.6	Very high	106 Å²	106	41.4 Å²	41.4	57%	0.567	21%	0.207	S	C	*	.	H	α-helix	trans	-57.2	-28.3	175.6	-82.7	55.9	0	0	0	112	R821 G832	R821-D828 IonicContact CZ-OD1 2.78Å; R821-D828 IonicContact CZ-OD2 3.87Å; R821-D828 IonicContact NH2-OD1 2.69Å; R821-D828 PolarHBondContact NH2-OD1 3.26Å; R821-D828 IonicContact NH2-OD2 2.73Å; R821-D828 PolarHBondContact NH2-OD2 3.26Å; D828-G832 PolarHBondContact O-N 2.97Å
829	R	87.1	Confident	92.4	Very high	63 Å²	63	37.4 Å²	37.4	24%	0.238	19%	0.186	C	C	.	.	H	α-helix	trans	-71.8	-53.6	174.7	-172	166.9	-174.1	-143.9	-13.9	112.7	D143 L146 S827 F831 G832 W833 P866	D143-R829 PolarHBondContact O-NH1 3.04Å; L146-R829 HydrophobicContact CD1-CB 4.5Å; L146-R829 HydrophobicContact CD1-CG 3.68Å; S827-R829 PolarHBondContact O-N 2.93Å; S827-R829 VanDerWaalsContact O-N 3.13Å; S827-R829 PolarHBondContact OG-N 3.44Å; R829-F831 PolarHBondContact O-N 3.24Å; R829-G832 PolarHBondContact O-N 3.22Å; R829-W833 WeakPolarHBondContact O-CB 3.31Å; R829-W833 PolarHBondContact O-N 2.96Å; R829-P866 HydrophobicContact CB-CB 3.81Å; R829-P866 HydrophobicContact CB-CG 4.2Å; R829-P866 WeakPolarHBondContact CD-O 3.48Å; R829-P866 HydrophobicContact CG-CB 3.84Å; R829-P866 HydrophobicContact CG-CG 4.29Å; R829-P866 WeakPolarHBondContact CG-O 3.46Å; R829-P866 PolarHBondContact NE-O 2.97Å
830	Q	91.2	Very high	92.4	Very high	35 Å²	35	37 Å²	37	16%	0.164	18%	0.183	C	C	.	.	H	α-helix	trans	-58	-47.2	175.6	-69.8	167	-11.2	0	0	111.4	L141 L146 L796 I826 S827 W833 I834	L141-Q830 PolarHBondContact O-NE2 3.41Å; L141-Q830 VanDerWaalsContact O-NE2 3.1Å; L146-Q830 HydrophobicContact CD1-CG 4.34Å; L796-Q830 HydrophobicContact CD2-CB 4.38Å; I826-Q830 HydrophobicContact CG2-CB 3.57Å; S827-Q830 VanDerWaalsContact N-OE1 3.13Å; S827-Q830 PolarHBondContact O-N 2.95Å; S827-Q830 WeakPolarHBondContact OG-CG 3.41Å; S827-Q830 PolarHBondContact OG-N 2.72Å; Q830-W833 PolarHBondContact O-N 3.19Å; Q830-I834 WeakPolarHBondContact O-CG1 3.43Å; Q830-I834 PolarHBondContact O-N 2.97Å; Q830-I834 VanDerWaalsContact O-N 3.12Å
831	F	92.8	Very high	92.2	Very high	14 Å²	14	38.1 Å²	38.1	6%	0.061	19%	0.192	C	C	.	.	H	α-helix	trans	-65.6	-45.3	179.5	-177.4	-97.6	0	0	0	112	L799 P817 L818 R821 I826 S827 R829 W833 I834 V835	L799-F831 HydrophobicContact CD1-CD2 4.04Å; L799-F831 HydrophobicContact CD1-CE2 3.94Å; L799-F831 HydrophobicContact CD2-CD2 3.86Å; P817-F831 HydrophobicContact CB-CE2 4.03Å; P817-F831 HydrophobicContact CB-CZ 4.37Å; L818-F831 HydrophobicContact CD2-CE1 4.46Å; L818-F831 HydrophobicContact CD2-CZ 3.85Å; R821-F831 HydrophobicContact CB-CD2 3.68Å; R821-F831 HydrophobicContact CB-CE2 3.81Å; R821-F831 HydrophobicContact CB-CG 4.46Å; R821-F831 HydrophobicContact CG-CB 4.4Å; R821-F831 HydrophobicContact CG-CD2 3.82Å; R821-F831 HydrophobicContact CG-CE2 4.28Å; R821-F831 HydrophobicContact CG-CG 4.11Å; I826-F831 HydrophobicContact CG2-CB 4.14Å; S827-F831 WeakPolarHBondContact O-CB 3.33Å; S827-F831 PolarHBondContact O-N 2.98Å; R829-F831 PolarHBondContact O-N 3.24Å; F831-W833 VanDerWaalsContact C-N 3.33Å; F831-W833 PolarHBondContact O-N 3.42Å; F831-I834 PolarHBondContact O-N 2.87Å; F831-V835 HydrophobicContact CD1-CG2 4.09Å; F831-V835 HydrophobicContact CD2-CG2 4.27Å; F831-V835 HydrophobicContact CE1-CG2 3.73Å; F831-V835 HydrophobicContact CE2-CG2 3.93Å; F831-V835 HydrophobicContact CG-CG2 4.36Å; F831-V835 HydrophobicContact CZ-CG2 3.64Å; F831-V835 WeakPolarHBondContact O-CB 3.26Å; F831-V835 VanDerWaalsContact O-CG2 3.27Å; F831-V835 WeakPolarHBondContact O-CG2 3.12Å; F831-V835 PolarHBondContact O-N 3.43Å
832	G	89.9	Confident	92	Very high	7 Å²	7	35 Å²	35	7%	0.072	18%	0.181	C	C	.	.	H	α-helix	trans	-58.6	-43	177.5	0	0	0	0	0	112.5	D828 R829 A836	D828-G832 PolarHBondContact O-N 2.97Å; R829-G832 PolarHBondContact O-N 3.22Å; G832-A836 WeakPolarHBondContact O-CB 3.35Å; G832-A836 PolarHBondContact O-N 2.86Å
833	W	91.6	Very high	91.9	Very high	42 Å²	42	35.5 Å²	35.5	16%	0.159	17%	0.169	C	C	.	.	H	α-helix	trans	-66.3	-48.9	179.1	-179.7	-123.5	0	0	0	112.6	R829 Q830 F831 V835 A836 K837 I867 L875	R829-W833 WeakPolarHBondContact O-CB 3.31Å; R829-W833 PolarHBondContact O-N 2.96Å; Q830-W833 PolarHBondContact O-N 3.19Å; F831-W833 VanDerWaalsContact C-N 3.33Å; F831-W833 PolarHBondContact O-N 3.42Å; W833-V835 PolarHBondContact O-N 2.93Å; W833-A836 PolarHBondContact O-N 2.69Å; W833-K837 WeakPolarHBondContact O-CB 3.42Å; W833-K837 PolarHBondContact O-N 3.44Å; W833-I867 HydrophobicContact CB-CD1 3.94Å; W833-I867 HydrophobicContact CB-CG1 4.1Å; W833-I867 HydrophobicContact CD2-CG1 4.36Å; W833-I867 HydrophobicContact CE3-CB 4.4Å; W833-I867 HydrophobicContact CE3-CD1 4.1Å; W833-I867 HydrophobicContact CE3-CG1 3.8Å; W833-I867 HydrophobicContact CE3-CG2 3.84Å; W833-I867 HydrophobicContact CZ3-CG2 3.8Å; W833-L875 HydrophobicContact CE3-CD2 4.29Å; W833-L875 HydrophobicContact CH2-CB 4.27Å; W833-L875 HydrophobicContact CH2-CD2 4.27Å; W833-L875 HydrophobicContact CZ3-CB 4.29Å; W833-L875 HydrophobicContact CZ3-CD2 3.79Å
834	I	93.8	Very high	91.9	Very high	3 Å²	3	35.3 Å²	35.3	2%	0.015	17%	0.169	C	C	.	.	H	α-helix	trans	-66.4	-39	-178.9	-63.8	-64.7	0	0	0	111.7	L799 E800 Q830 F831 A838	L799-I834 HydrophobicContact CB-CG2 4.2Å; L799-I834 HydrophobicContact CD2-CB 3.92Å; L799-I834 HydrophobicContact CD2-CG1 4.35Å; L799-I834 HydrophobicContact CD2-CG2 3.84Å; L799-I834 HydrophobicContact CG-CB 4.37Å; L799-I834 HydrophobicContact CG-CG2 3.72Å; E800-I834 VanDerWaalsContact CA-CG2 3.47Å; E800-I834 HydrophobicContact CB-CG2 3.69Å; E800-I834 HydrophobicContact CG-CG2 4.22Å; Q830-I834 WeakPolarHBondContact O-CG1 3.43Å; Q830-I834 PolarHBondContact O-N 2.97Å; Q830-I834 VanDerWaalsContact O-N 3.12Å; F831-I834 PolarHBondContact O-N 2.87Å; I834-A838 WeakPolarHBondContact O-CB 3.33Å; I834-A838 PolarHBondContact O-N 2.93Å; I834-A838 VanDerWaalsContact O-N 3.12Å
835	V	93.6	Very high	91.8	Very high	1 Å²	1	35 Å²	35	1%	0.006	17%	0.168	C	C	.	.	H	α-helix	trans	-65.6	-44	172.5	176.9	0	0	0	0	110.8	Y807 F831 W833 K837 A838 L839 L851	Y807-V835 HydrophobicContact CD2-CG1 4.43Å; Y807-V835 HydrophobicContact CE2-CG1 3.63Å; F831-V835 HydrophobicContact CD1-CG2 4.09Å; F831-V835 HydrophobicContact CD2-CG2 4.27Å; F831-V835 HydrophobicContact CE1-CG2 3.73Å; F831-V835 HydrophobicContact CE2-CG2 3.93Å; F831-V835 HydrophobicContact CG-CG2 4.36Å; F831-V835 HydrophobicContact CZ-CG2 3.64Å; F831-V835 WeakPolarHBondContact O-CB 3.26Å; F831-V835 VanDerWaalsContact O-CG2 3.27Å; F831-V835 WeakPolarHBondContact O-CG2 3.12Å; F831-V835 PolarHBondContact O-N 3.43Å; W833-V835 PolarHBondContact O-N 2.93Å; V835-K837 VanDerWaalsContact C-N 3.34Å; V835-K837 PolarHBondContact O-N 3.07Å; V835-A838 PolarHBondContact O-N 3.23Å; V835-L839 HydrophobicContact CG1-CD1 3.67Å; V835-L839 HydrophobicContact CG1-CG 4.01Å; V835-L839 WeakPolarHBondContact O-CB 3.49Å; V835-L839 WeakPolarHBondContact O-CG 3.32Å; V835-L839 PolarHBondContact O-N 3.1Å; V835-L851 HydrophobicContact CB-CD2 4.04Å; V835-L851 HydrophobicContact CG1-CD2 3.63Å
836	A	92.7	Very high	91.7	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-59.2	-44.2	178.8	0	0	0	0	0	112.2	G832 W833 L839 A840 L848 F872 L875	G832-A836 WeakPolarHBondContact O-CB 3.35Å; G832-A836 PolarHBondContact O-N 2.86Å; W833-A836 PolarHBondContact O-N 2.69Å; A836-L839 PolarHBondContact O-N 3.3Å; A836-A840 VanDerWaalsContact O-CB 3.27Å; A836-A840 WeakPolarHBondContact O-CB 3.5Å; A836-A840 PolarHBondContact O-N 3.48Å; A836-L848 HydrophobicContact CB-CD1 3.82Å; A836-F872 HydrophobicContact CB-CD2 4.49Å; A836-F872 HydrophobicContact CB-CE2 4.22Å; A836-L875 HydrophobicContact CB-CD2 4.15Å
837	K	92.8	Very high	91.6	Very high	47 Å²	47	32.8 Å²	32.8	20%	0.204	17%	0.168	C	C	.	.	H	α-helix	trans	-59.4	-49.8	175.6	-172.2	-174.5	177.7	-157.9	0	111.9	E800 W833 V835 A840 A841 L875	E800-K837 WeakPolarHBondContact OE1-CD 3.47Å; E800-K837 WeakPolarHBondContact OE1-CE 3.37Å; E800-K837 IonicContact OE1-NZ 3.43Å; E800-K837 PolarHBondContact OE1-NZ 3.28Å; E800-K837 IonicContact OE2-NZ 3.02Å; E800-K837 PolarHBondContact OE2-NZ 2.73Å; W833-K837 WeakPolarHBondContact O-CB 3.42Å; W833-K837 PolarHBondContact O-N 3.44Å; V835-K837 VanDerWaalsContact C-N 3.34Å; V835-K837 PolarHBondContact O-N 3.07Å; K837-A840 PolarHBondContact O-N 3.43Å; K837-A841 WeakPolarHBondContact O-CB 3.45Å; K837-A841 PolarHBondContact O-N 2.58Å; K837-L875 HydrophobicContact CB-CD1 4.33Å; K837-L875 HydrophobicContact CB-CD2 4.44Å; K837-L875 HydrophobicContact CG-CD1 4.16Å
838	A	92.9	Very high	91.5	Very high	3 Å²	3	31.5 Å²	31.5	3%	0.025	16%	0.159	C	C	.	.	H	α-helix	trans	-68.8	-34	-179.3	0	0	0	0	0	113.8	C803 I834 V835 Q842	C803-A838 HydrophobicContact CB-CB 3.34Å; I834-A838 WeakPolarHBondContact O-CB 3.33Å; I834-A838 PolarHBondContact O-N 2.93Å; I834-A838 VanDerWaalsContact O-N 3.12Å; V835-A838 PolarHBondContact O-N 3.23Å; A838-Q842 WeakPolarHBondContact O-CG 3.15Å; A838-Q842 PolarHBondContact O-N 3.33Å; A838-Q842 VanDerWaalsContact O-N 3.14Å; A838-Q842 PolarHBondContact O-NE2 2.99Å
839	L	92.8	Very high	91.6	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-72.7	-37.4	174.3	-70.4	178.5	0	0	0	111.9	Y807 V835 A836 Q842 H843 M844 E847 L848 L851	Y807-L839 HydrophobicContact CD1-CD2 4.07Å; Y807-L839 HydrophobicContact CD2-CD2 4.37Å; Y807-L839 HydrophobicContact CE1-CD2 3.9Å; Y807-L839 HydrophobicContact CE2-CD1 4.42Å; Y807-L839 HydrophobicContact CE2-CD2 4.24Å; Y807-L839 HydrophobicContact CG-CD2 4.31Å; V835-L839 HydrophobicContact CG1-CD1 3.67Å; V835-L839 HydrophobicContact CG1-CG 4.01Å; V835-L839 WeakPolarHBondContact O-CB 3.49Å; V835-L839 WeakPolarHBondContact O-CG 3.32Å; V835-L839 PolarHBondContact O-N 3.1Å; A836-L839 PolarHBondContact O-N 3.3Å; L839-Q842 CarbonylContact O-C 3.6Å; L839-Q842 PolarHBondContact O-N 3.46Å; L839-H843 PolarHBondContact O-N 3.47Å; L839-H843 VanDerWaalsContact O-N 3.09Å; L839-M844 HydrophobicContact CB-CB 4.39Å; L839-M844 HydrophobicContact CD2-CB 3.87Å; L839-M844 HydrophobicContact CD2-CE 3.99Å; L839-M844 HydrophobicContact CD2-SD 3.96Å; L839-M844 PolarHBondContact O-N 3.43Å; L839-E847 HydrophobicContact CD1-CB 4.21Å; L839-E847 HydrophobicContact CD2-CB 4.4Å; L839-L848 HydrophobicContact CB-CB 4.29Å; L839-L848 HydrophobicContact CB-CD1 4.29Å; L839-L848 HydrophobicContact CD1-CB 4.35Å; L839-L848 HydrophobicContact CD1-CD1 4.32Å; L839-L851 HydrophobicContact CD1-CD2 4.44Å
840	A	93.4	Very high	91.6	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-63.3	-45.3	174	0	0	0	0	0	111.3	A836 K837 Q842 H843 W845 L848 L875 H879	A836-A840 VanDerWaalsContact O-CB 3.27Å; A836-A840 WeakPolarHBondContact O-CB 3.5Å; A836-A840 PolarHBondContact O-N 3.48Å; K837-A840 PolarHBondContact O-N 3.43Å; A840-Q842 VanDerWaalsContact C-N 3.27Å; A840-Q842 PolarHBondContact O-N 3.08Å; A840-H843 WeakPolarHBondContact O-CA 3.41Å; A840-H843 PolarHBondContact O-N 3.1Å; A840-W845 HydrophobicContact CB-CZ3 4.07Å; A840-L848 HydrophobicContact CB-CD2 4.22Å; A840-L875 HydrophobicContact CB-CG 4.3Å; A840-H879 HydrophobicContact CB-CB 4.14Å
841	A	91.7	Very high	91.3	Very high	23 Å²	23	33.5 Å²	33.5	19%	0.19	17%	0.167	C	C	.	.	H	α-helix	trans	-60.9	-32.3	173.2	0	0	0	0	0	113.5	F784 K837 H843	F784-A841 VanDerWaalsContact CE1-O 3.31Å; F784-A841 WeakPolarHBondContact CE1-O 3.22Å; F784-A841 WeakPolarHBondContact CZ-O 3.31Å; K837-A841 WeakPolarHBondContact O-CB 3.45Å; K837-A841 PolarHBondContact O-N 2.58Å; A841-H843 VanDerWaalsContact C-N 3.28Å; A841-H843 PolarHBondContact O-CD2 3.44Å
842	Q	90.9	Very high	91	Very high	5 Å²	5	33 Å²	33	2%	0.023	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-7.2	172.7	-74.8	168	95.3	0	0	113.7	R783 F784 C803 L804 A838 L839 A840 M844	R783-Q842 PolarHBondContact NH1-O 3.02Å; R783-Q842 PolarHBondContact NH2-O 3.43Å; F784-Q842 HydrophobicContact CE2-CG 3.86Å; F784-Q842 HydrophobicContact CZ-CG 4.25Å; C803-Q842 PolarHBondContact O-NE2 3.36Å; L804-Q842 HydrophobicContact CD1-CG 3.89Å; L804-Q842 PolarHBondContact O-OE1 3.47Å; A838-Q842 WeakPolarHBondContact O-CG 3.15Å; A838-Q842 PolarHBondContact O-N 3.33Å; A838-Q842 VanDerWaalsContact O-N 3.14Å; A838-Q842 PolarHBondContact O-NE2 2.99Å; L839-Q842 CarbonylContact O-C 3.6Å; L839-Q842 PolarHBondContact O-N 3.46Å; A840-Q842 VanDerWaalsContact C-N 3.27Å; A840-Q842 PolarHBondContact O-N 3.08Å; Q842-M844 HydrophobicContact CB-CB 4.33Å; Q842-M844 HydrophobicContact CB-CG 3.74Å; Q842-M844 HydrophobicContact CB-SD 3.82Å; Q842-M844 HydrophobicContact CG-SD 4.39Å; Q842-M844 PolarHBondContact O-N 3.49Å
843	H	92.5	Very high	90.8	Very high	88 Å²	88	33.5 Å²	33.5	41%	0.407	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.8	31.9	-168.7	-52.3	-108.9	0	0	0	112.8	R783 L839 A840 A841 W845 H879	R783-H843 PolarHBondContact NH2-CD2 3.02Å; R783-H843 VanDerWaalsContact NH2-CD2 3.27Å; L839-H843 PolarHBondContact O-N 3.47Å; L839-H843 VanDerWaalsContact O-N 3.09Å; A840-H843 WeakPolarHBondContact O-CA 3.41Å; A840-H843 PolarHBondContact O-N 3.1Å; A841-H843 VanDerWaalsContact C-N 3.28Å; A841-H843 PolarHBondContact O-CD2 3.44Å; H843-W845 HydrophobicContact CB-CH2 4.37Å; H843-W845 HydrophobicContact CB-CZ2 3.79Å; H843-W845 AromaticContact CG-CZ2 3.89Å; H843-W845 AromaticContact ND1-CH2 3.95Å; H843-W845 AromaticContact ND1-CZ2 3.41Å; H843-W845 WeakPolarHBondContact ND1-CZ2 3.27Å; H843-W845 PolarHBondContact O-N 3.25Å; H843-H879 PolarHBondContact CE1-O 3.26Å
844	M	91.4	Very high	90.1	Very high	45 Å²	45	33 Å²	33	22%	0.222	17%	0.171	C	C	.	.			trans	-85	55.3	-177.9	-76.1	178.3	66.8	0	0	111.9	Y807 L839 Q842 P846 E847 L848	Y807-M844 HydrophobicContact CD1-CE 4.28Å; L839-M844 HydrophobicContact CB-CB 4.39Å; L839-M844 HydrophobicContact CD2-CB 3.87Å; L839-M844 HydrophobicContact CD2-CE 3.99Å; L839-M844 HydrophobicContact CD2-SD 3.96Å; L839-M844 PolarHBondContact O-N 3.43Å; Q842-M844 HydrophobicContact CB-CB 4.33Å; Q842-M844 HydrophobicContact CB-CG 3.74Å; Q842-M844 HydrophobicContact CB-SD 3.82Å; Q842-M844 HydrophobicContact CG-SD 4.39Å; Q842-M844 PolarHBondContact O-N 3.49Å; M844-P846 VanDerWaalsContact C-CD 3.47Å; M844-E847 HydrophobicContact CE-CB 4.41Å; M844-E847 HydrophobicContact CE-CG 4.1Å; M844-E847 PolarHBondContact O-N 2.93Å; M844-L848 PolarHBondContact O-N 2.66Å; M844-L848 VanDerWaalsContact O-N 3.09Å
845	W	92	Very high	89.4	Confident	29 Å²	29	40.5 Å²	40.5	11%	0.11	20%	0.203	C	C	.	.	H	α-helix	trans	-53.9	-39.8	-173.5	-39.6	129.7	0	0	0	115	A840 H843 E847 L848 Q849 L876 H879 A881 E885	A840-W845 HydrophobicContact CB-CZ3 4.07Å; H843-W845 HydrophobicContact CB-CH2 4.37Å; H843-W845 HydrophobicContact CB-CZ2 3.79Å; H843-W845 AromaticContact CG-CZ2 3.89Å; H843-W845 AromaticContact ND1-CH2 3.95Å; H843-W845 AromaticContact ND1-CZ2 3.41Å; H843-W845 WeakPolarHBondContact ND1-CZ2 3.27Å; H843-W845 PolarHBondContact O-N 3.25Å; W845-E847 PolarHBondContact O-N 3.18Å; W845-L848 HydrophobicContact CE3-CD2 4.19Å; W845-L848 HydrophobicContact CZ3-CD2 4.48Å; W845-L848 WeakPolarHBondContact O-CB 3.34Å; W845-L848 PolarHBondContact O-N 3.34Å; W845-L848 VanDerWaalsContact O-N 3.17Å; W845-Q849 WeakPolarHBondContact O-CG 3.32Å; W845-Q849 PolarHBondContact O-N 3.32Å; W845-L876 HydrophobicContact CE3-CD2 3.95Å; W845-L876 HydrophobicContact CZ3-CD2 3.64Å; W845-H879 HydrophobicContact CH2-CB 4.29Å; W845-A881 HydrophobicContact CH2-CB 3.7Å; W845-A881 HydrophobicContact CZ2-CB 3.92Å; W845-A881 HydrophobicContact CZ3-CB 4.03Å; W845-E885 VanDerWaalsContact CB-CD 3.41Å; W845-E885 HydrophobicContact CB-CG 3.96Å; W845-E885 WeakPolarHBondContact CB-OE2 3.11Å; W845-E885 HydrophobicContact CD2-CG 4.34Å; W845-E885 HydrophobicContact CG-CG 3.81Å
846	P	90.8	Very high	88.2	Confident	93 Å²	93	44 Å²	44	60%	0.604	22%	0.222	S	C	*	.	H	α-helix	trans	-65.3	-38.5	179.6	-24.5	35.9	0	0	0	114.3	M844 L848 K850	M844-P846 VanDerWaalsContact C-CD 3.47Å; P846-L848 VanDerWaalsContact C-N 3.33Å; P846-K850 WeakPolarHBondContact O-CB 3.47Å; P846-K850 PolarHBondContact O-N 3.05Å; P846-K850 VanDerWaalsContact O-N 3.14Å
847	E	90.4	Very high	87.1	Confident	57 Å²	57	52.7 Å²	52.7	27%	0.266	27%	0.267	S	S	.	.	H	α-helix	trans	-71.5	-32.2	174	-76.7	-65.3	128.1	0	0	111.2	L839 M844 W845 K850 L851	L839-E847 HydrophobicContact CD1-CB 4.21Å; L839-E847 HydrophobicContact CD2-CB 4.4Å; M844-E847 HydrophobicContact CE-CB 4.41Å; M844-E847 HydrophobicContact CE-CG 4.1Å; M844-E847 PolarHBondContact O-N 2.93Å; W845-E847 PolarHBondContact O-N 3.18Å; E847-K850 PolarHBondContact O-N 3.23Å; E847-K850 WeakPolarHBondContact OE1-CD 3.5Å; E847-K850 IonicContact OE1-NZ 3.83Å; E847-K850 PolarHBondContact OE1-NZ 2.88Å; E847-K850 IonicContact OE2-NZ 3.14Å; E847-K850 PolarHBondContact OE2-NZ 3.37Å; E847-L851 WeakPolarHBondContact O-CB 3.37Å; E847-L851 PolarHBondContact O-N 3.04Å
848	L	90.5	Very high	86.3	Confident	0 Å²	0	59.4 Å²	59.4	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-69.2	-42.2	175.5	-171.9	54.6	0	0	0	112.3	A836 L839 A840 M844 W845 P846 K850 L851 M852 F872 L876	A836-L848 HydrophobicContact CB-CD1 3.82Å; L839-L848 HydrophobicContact CB-CB 4.29Å; L839-L848 HydrophobicContact CB-CD1 4.29Å; L839-L848 HydrophobicContact CD1-CB 4.35Å; L839-L848 HydrophobicContact CD1-CD1 4.32Å; A840-L848 HydrophobicContact CB-CD2 4.22Å; M844-L848 PolarHBondContact O-N 2.66Å; M844-L848 VanDerWaalsContact O-N 3.09Å; W845-L848 HydrophobicContact CE3-CD2 4.19Å; W845-L848 HydrophobicContact CZ3-CD2 4.48Å; W845-L848 WeakPolarHBondContact O-CB 3.34Å; W845-L848 PolarHBondContact O-N 3.34Å; W845-L848 VanDerWaalsContact O-N 3.17Å; P846-L848 VanDerWaalsContact C-N 3.33Å; L848-K850 VanDerWaalsContact C-N 3.33Å; L848-K850 PolarHBondContact O-N 2.94Å; L848-L851 HydrophobicContact CD1-CD2 4.31Å; L848-L851 PolarHBondContact O-N 3.35Å; L848-M852 HydrophobicContact CD1-CG 3.92Å; L848-M852 HydrophobicContact CG-CG 4.47Å; L848-M852 VanDerWaalsContact O-CB 3.28Å; L848-M852 WeakPolarHBondContact O-CB 3.47Å; L848-M852 WeakPolarHBondContact O-CG 3.26Å; L848-M852 PolarHBondContact O-N 3.1Å; L848-F872 HydrophobicContact CD1-CE2 3.95Å; L848-F872 HydrophobicContact CD1-CZ 4.12Å; L848-F872 HydrophobicContact CD2-CE2 3.93Å; L848-F872 HydrophobicContact CD2-CZ 3.81Å; L848-F872 HydrophobicContact CG-CE2 4.08Å; L848-F872 HydrophobicContact CG-CZ 3.8Å; L848-L876 HydrophobicContact CD2-CD2 3.69Å
849	Q	88.9	Confident	85.2	Confident	49 Å²	49	61.3 Å²	61.3	23%	0.229	32%	0.317	C	S	.	.	H	α-helix	trans	-58.2	-45.8	170.9	-73.9	-175.8	25.7	0	0	111	W845 L851 M852 L853 E885 V888 Y889	W845-Q849 WeakPolarHBondContact O-CG 3.32Å; W845-Q849 PolarHBondContact O-N 3.32Å; Q849-L851 VanDerWaalsContact C-N 3.32Å; Q849-L851 PolarHBondContact O-N 3.39Å; Q849-M852 PolarHBondContact O-N 3.29Å; Q849-L853 HydrophobicContact CB-CD1 4.13Å; Q849-L853 HydrophobicContact CG-CD1 4.36Å; Q849-L853 VanDerWaalsContact O-CB 3.27Å; Q849-L853 WeakPolarHBondContact O-CB 3.29Å; Q849-L853 WeakPolarHBondContact O-CG 3.42Å; Q849-L853 PolarHBondContact O-N 2.91Å; Q849-E885 PolarHBondContact NE2-OE2 2.85Å; Q849-V888 HydrophobicContact CG-CG1 4.41Å; Q849-Y889 WeakPolarHBondContact CA-OH 3.46Å; Q849-Y889 HydrophobicContact CG-CE1 4.46Å; Q849-Y889 WeakPolarHBondContact CG-OH 3.45Å; Q849-Y889 PolarHBondContact N-OH 3.36Å
850	K	87.3	Confident	84.1	Confident	141 Å²	141	69 Å²	69	61%	0.613	35%	0.351	S	S	*	.	H	α-helix	trans	-64.2	-30.8	178.3	171	-171	167.4	-154.2	0	113.6	P846 E847 L848	P846-K850 WeakPolarHBondContact O-CB 3.47Å; P846-K850 PolarHBondContact O-N 3.05Å; P846-K850 VanDerWaalsContact O-N 3.14Å; E847-K850 PolarHBondContact O-N 3.23Å; E847-K850 WeakPolarHBondContact OE1-CD 3.5Å; E847-K850 IonicContact OE1-NZ 3.83Å; E847-K850 PolarHBondContact OE1-NZ 2.88Å; E847-K850 IonicContact OE2-NZ 3.14Å; E847-K850 PolarHBondContact OE2-NZ 3.37Å; L848-K850 VanDerWaalsContact C-N 3.33Å; L848-K850 PolarHBondContact O-N 2.94Å
851	L	85.4	Confident	83.2	Confident	56 Å²	56	73.8 Å²	73.8	29%	0.293	37%	0.373	S	S	.	.	H	α-helix	trans	-73.2	-43.7	172	-180	71.1	0	0	0	111.7	V835 L839 E847 L848 Q849	V835-L851 HydrophobicContact CB-CD2 4.04Å; V835-L851 HydrophobicContact CG1-CD2 3.63Å; L839-L851 HydrophobicContact CD1-CD2 4.44Å; E847-L851 WeakPolarHBondContact O-CB 3.37Å; E847-L851 PolarHBondContact O-N 3.04Å; L848-L851 HydrophobicContact CD1-CD2 4.31Å; L848-L851 PolarHBondContact O-N 3.35Å; Q849-L851 VanDerWaalsContact C-N 3.32Å; Q849-L851 PolarHBondContact O-N 3.39Å
852	M	85.6	Confident	82.4	Confident	3 Å²	3	78.9 Å²	78.9	2%	0.015	39%	0.391	C	S	.	.	H	α-helix	trans	-94.5	-18.8	-165	-66.5	-74.9	-73.5	0	0	114.2	L848 Q849 L863 K864 S865 F872 Y889	L848-M852 HydrophobicContact CD1-CG 3.92Å; L848-M852 HydrophobicContact CG-CG 4.47Å; L848-M852 VanDerWaalsContact O-CB 3.28Å; L848-M852 WeakPolarHBondContact O-CB 3.47Å; L848-M852 WeakPolarHBondContact O-CG 3.26Å; L848-M852 PolarHBondContact O-N 3.1Å; Q849-M852 PolarHBondContact O-N 3.29Å; M852-L863 HydrophobicContact CB-CD1 4.37Å; M852-L863 HydrophobicContact CE-CD1 4.31Å; M852-L863 CarbonylContact O-C 3.56Å; M852-K864 PolarHBondContact O-N 3.42Å; M852-S865 WeakPolarHBondContact CE-OG 3.42Å; M852-F872 HydrophobicContact CE-CB 4.03Å; M852-F872 HydrophobicContact CE-CD1 3.51Å; M852-F872 HydrophobicContact CE-CD2 3.35Å; M852-F872 HydrophobicContact CE-CE1 3.73Å; M852-F872 HydrophobicContact CE-CE2 3.61Å; M852-F872 HydrophobicContact CE-CG 3.3Å; M852-F872 HydrophobicContact CE-CZ 3.79Å; M852-F872 HydrophobicContact CG-CE2 4.28Å; M852-F872 HydrophobicContact CG-CZ 4.07Å; M852-F872 HydrophobicContact SD-CD2 4.5Å; M852-F872 HydrophobicContact SD-CE2 4.39Å; M852-Y889 HydrophobicContact CB-CE1 4Å
853	L	86	Confident	81.9	Confident	18 Å²	18	80.4 Å²	80.4	9%	0.094	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	116.8	-177.8	-56.4	170.4	0	0	0	110.6	Q849 L863 V888 Y889	Q849-L853 HydrophobicContact CB-CD1 4.13Å; Q849-L853 HydrophobicContact CG-CD1 4.36Å; Q849-L853 VanDerWaalsContact O-CB 3.27Å; Q849-L853 WeakPolarHBondContact O-CB 3.29Å; Q849-L853 WeakPolarHBondContact O-CG 3.42Å; Q849-L853 PolarHBondContact O-N 2.91Å; L853-L863 HydrophobicContact CD2-CD1 4.13Å; L853-V888 HydrophobicContact CD1-CG1 3.49Å; L853-V888 VanDerWaalsContact CD1-CG1 3.49Å; L853-Y889 HydrophobicContact CD1-CD1 4.47Å; L853-Y889 HydrophobicContact CD1-CE1 4.17Å; L853-Y889 HydrophobicContact CD2-CD1 3.97Å; L853-Y889 HydrophobicContact CD2-CE1 4.25Å; L853-Y889 HydrophobicContact CG-CD1 4.31Å; L853-Y889 HydrophobicContact CG-CE1 4.08Å
854	A	77.9	Confident	81	Confident	32 Å²	32	83.5 Å²	83.5	26%	0.264	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	146.8	166.1	0	0	0	0	0	110	Q861 K862 K864	A854-Q861 CarbonylContact O-C 3.47Å; A854-Q861 VanDerWaalsContact O-CA 3.31Å; A854-Q861 WeakPolarHBondContact O-CA 3.28Å; A854-K862 PolarHBondContact N-O 3.29Å; A854-K862 PolarHBondContact O-N 2.87Å; A854-K864 HydrophobicContact CB-CB 3.8Å; A854-K864 HydrophobicContact CB-CD 4.07Å; A854-K864 HydrophobicContact CB-CG 4.26Å
855	K	77.5	Confident	79.9	Confident	160 Å²	160	82.6 Å²	82.6	70%	0.696	41%	0.409	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.2	124.1	162.9	-65.6	-175.9	-179.9	-177.1	0	108.3	Q861	K855-Q861 HydrophobicContact CG-CG 4.33Å
856	N	68.7	Low	78.7	Confident	76 Å²	76	83.7 Å²	83.7	41%	0.406	42%	0.42	S	S	.	.	P	Polyproline II helix	trans	-69.4	169.9	169.2	-69.7	11.4	0	0	0	109.9	F858 G859 K860 K862	N856-F858 PolarHBondContact O-N 3.29Å; N856-F858 VanDerWaalsContact O-N 3.09Å; N856-G859 PolarHBondContact O-N 2.9Å; N856-K860 PolarHBondContact N-O 3.47Å; N856-K862 WeakPolarHBondContact OD1-CB 3.19Å
857	L	71	Confident	78	Confident	181 Å²	181	80 Å²	80	95%	0.948	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.9	-34	175.6	-82.9	150.6	0	0	0	113.3	G859	L857-G859 VanDerWaalsContact C-N 3.26Å; L857-G859 PolarHBondContact O-N 3.29Å
858	F	74.9	Confident	77.6	Confident	188 Å²	188	79.6 Å²	79.6	83%	0.825	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.5	16.7	175.8	-55.6	-72.4	0	0	0	114.6	N856 K860	N856-F858 PolarHBondContact O-N 3.29Å; N856-F858 VanDerWaalsContact O-N 3.09Å; F858-K860 PolarHBondContact O-N 3Å
859	G	70.3	Confident	77.4	Confident	44 Å²	44	80.3 Å²	80.3	45%	0.454	40%	0.403	S	S	.	.	S	Bend	trans	72.8	-22.7	178.6	0	0	0	0	0	116.1	N856 L857 Q861	N856-G859 PolarHBondContact O-N 2.9Å; L857-G859 VanDerWaalsContact C-N 3.26Å; L857-G859 PolarHBondContact O-N 3.29Å; G859-Q861 PolarHBondContact O-N 3.29Å
860	K	69.8	Low	77.4	Confident	162 Å²	162	82.5 Å²	82.5	70%	0.704	41%	0.413	S	S	*	.			trans	-53.3	134.6	174.6	-67.3	-174.9	177.7	-178.5	0	111.1	N856 F858	N856-K860 PolarHBondContact N-O 3.47Å; F858-K860 PolarHBondContact O-N 3Å
861	Q	73.5	Confident	77.4	Confident	99 Å²	99	77.3 Å²	77.3	46%	0.463	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	129.6	172.6	-72.6	170.7	-64.2	0	0	110.2	A854 K855 G859	A854-Q861 CarbonylContact O-C 3.47Å; A854-Q861 VanDerWaalsContact O-CA 3.31Å; A854-Q861 WeakPolarHBondContact O-CA 3.28Å; K855-Q861 HydrophobicContact CG-CG 4.33Å; G859-Q861 PolarHBondContact O-N 3.29Å
862	K	75.7	Confident	77.6	Confident	131 Å²	131	74.6 Å²	74.6	57%	0.57	38%	0.377	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.5	138.4	168.5	-174.1	171.8	-179.3	175.4	0	108.5	A854 N856 K864	A854-K862 PolarHBondContact N-O 3.29Å; A854-K862 PolarHBondContact O-N 2.87Å; N856-K862 WeakPolarHBondContact OD1-CB 3.19Å; K862-K864 PolarHBondContact O-N 2.93Å
863	L	80	Confident	77.9	Confident	36 Å²	36	74.5 Å²	74.5	19%	0.188	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.4	108.6	172.3	-170.8	71.9	0	0	0	109	M852 L853 S865 C869 Y889	M852-L863 HydrophobicContact CB-CD1 4.37Å; M852-L863 HydrophobicContact CE-CD1 4.31Å; M852-L863 CarbonylContact O-C 3.56Å; L853-L863 HydrophobicContact CD2-CD1 4.13Å; L863-S865 PolarHBondContact O-N 3.49Å; L863-C869 HydrophobicContact CD2-CB 3.68Å; L863-Y889 HydrophobicContact CD1-CD1 4.01Å
864	K	73.6	Confident	78.2	Confident	154 Å²	154	78.3 Å²	78.3	67%	0.67	39%	0.39	S	S	*	.			trans	-95.7	45.8	176.1	-163.4	-157.9	169.4	-177.2	0	109.9	M852 A854 K862	M852-K864 PolarHBondContact O-N 3.42Å; A854-K864 HydrophobicContact CB-CB 3.8Å; A854-K864 HydrophobicContact CB-CD 4.07Å; A854-K864 HydrophobicContact CB-CG 4.26Å; K862-K864 PolarHBondContact O-N 2.93Å
865	S	68.4	Low	78.9	Confident	26 Å²	26	77 Å²	77	18%	0.182	38%	0.378	C	S	.	.			trans	-95.6	135.2	-179.8	-163.4	0	0	0	0	111.4	M852 L863 I867	M852-S865 WeakPolarHBondContact CE-OG 3.42Å; L863-S865 PolarHBondContact O-N 3.49Å; S865-I867 WeakPolarHBondContact CB-O 3.2Å; S865-I867 PolarHBondContact O-N 2.94Å; S865-I867 PolarHBondContact OG-N 2.87Å; S865-I867 VanDerWaalsContact OG-N 3.15Å; S865-I867 PolarHBondContact OG-O 3.39Å
866	P	66.9	Low	79.6	Confident	52 Å²	52	69.4 Å²	69.4	34%	0.338	35%	0.345	S	S	.	.	S	Bend	trans	-83.5	11.5	164.9	37.2	-37.2	0	0	0	112.4	R829	R829-P866 HydrophobicContact CB-CB 3.81Å; R829-P866 HydrophobicContact CB-CG 4.2Å; R829-P866 WeakPolarHBondContact CD-O 3.48Å; R829-P866 HydrophobicContact CG-CB 3.84Å; R829-P866 HydrophobicContact CG-CG 4.29Å; R829-P866 WeakPolarHBondContact CG-O 3.46Å; R829-P866 PolarHBondContact NE-O 2.97Å
867	I	76	Confident	80.7	Confident	14 Å²	14	68.7 Å²	68.7	7%	0.072	35%	0.347	C	S	.	.	S	Bend	trans	-118.8	150.2	176.2	-57.2	109.6	0	0	0	107.9	W833 S865 Q871	W833-I867 HydrophobicContact CB-CD1 3.94Å; W833-I867 HydrophobicContact CB-CG1 4.1Å; W833-I867 HydrophobicContact CD2-CG1 4.36Å; W833-I867 HydrophobicContact CE3-CB 4.4Å; W833-I867 HydrophobicContact CE3-CD1 4.1Å; W833-I867 HydrophobicContact CE3-CG1 3.8Å; W833-I867 HydrophobicContact CE3-CG2 3.84Å; W833-I867 HydrophobicContact CZ3-CG2 3.8Å; S865-I867 WeakPolarHBondContact CB-O 3.2Å; S865-I867 PolarHBondContact O-N 2.94Å; S865-I867 PolarHBondContact OG-N 2.87Å; S865-I867 VanDerWaalsContact OG-N 3.15Å; S865-I867 PolarHBondContact OG-O 3.39Å; I867-Q871 HydrophobicContact CG2-CB 3.55Å
868	S	82.2	Confident	81.8	Confident	50 Å²	50	65.6 Å²	65.6	35%	0.35	33%	0.329	S	S	.	.			trans	-65	147.2	177	87.5	0	0	0	0	110.8	E870 Q871 F872	S868-E870 PolarHBondContact O-N 2.89Å; S868-E870 VanDerWaalsContact O-N 3.16Å; S868-Q871 PolarHBondContact O-N 3.22Å; S868-Q871 WeakPolarHBondContact OG-CG 3.48Å; S868-Q871 PolarHBondContact OG-N 3.16Å; S868-Q871 PolarHBondContact OG-OE1 3.4Å; S868-F872 WeakPolarHBondContact O-CB 3.24Å; S868-F872 PolarHBondContact O-N 3.37Å
869	C	86.5	Confident	82.6	Confident	14 Å²	14	59 Å²	59	10%	0.095	30%	0.3	C	S	.	.	H	α-helix	trans	-56.7	-33.3	176.6	-169.3	0	0	0	0	111.2	L863 F872 L873 L893	L863-C869 HydrophobicContact CD2-CB 3.68Å; C869-F872 PolarHBondContact O-N 3.3Å; C869-L873 WeakPolarHBondContact O-CB 3.39Å; C869-L873 WeakPolarHBondContact O-CD1 3.38Å; C869-L873 WeakPolarHBondContact O-CG 3.32Å; C869-L873 PolarHBondContact O-N 2.98Å; C869-L893 HydrophobicContact CB-CD2 3.95Å
870	E	88.1	Confident	83.6	Confident	95 Å²	95	59.6 Å²	59.6	44%	0.444	31%	0.306	S	S	.	.	H	α-helix	trans	-69.8	-45.6	179.1	-50.9	-177.3	-179.4	0	0	113.2	S868 F872 L873 R874 L902	S868-E870 PolarHBondContact O-N 2.89Å; S868-E870 VanDerWaalsContact O-N 3.16Å; E870-F872 VanDerWaalsContact C-N 3.26Å; E870-F872 PolarHBondContact O-N 3.48Å; E870-L873 PolarHBondContact O-N 3.49Å; E870-R874 WeakPolarHBondContact O-CB 3.37Å; E870-R874 WeakPolarHBondContact O-CG 3.48Å; E870-R874 PolarHBondContact O-N 2.99Å; E870-L902 HydrophobicContact CG-CD1 4.19Å; E870-L902 HydrophobicContact CG-CD2 4.09Å
871	Q	87.7	Confident	84.7	Confident	32 Å²	32	52.5 Å²	52.5	15%	0.15	28%	0.278	C	S	.	.	H	α-helix	trans	-60.3	-40.2	173.1	-79	170.7	-36	0	0	110.7	I867 S868 R874 L875	I867-Q871 HydrophobicContact CG2-CB 3.55Å; S868-Q871 PolarHBondContact O-N 3.22Å; S868-Q871 WeakPolarHBondContact OG-CG 3.48Å; S868-Q871 PolarHBondContact OG-N 3.16Å; S868-Q871 PolarHBondContact OG-OE1 3.4Å; Q871-R874 PolarHBondContact O-N 3.05Å; Q871-L875 PolarHBondContact O-N 2.96Å
872	F	89.8	Confident	85.5	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-71.2	-40.1	178.5	-179.8	-112.8	0	0	0	113.2	A836 L848 M852 S868 C869 E870 R874 L875 L876 Y889	A836-F872 HydrophobicContact CB-CD2 4.49Å; A836-F872 HydrophobicContact CB-CE2 4.22Å; L848-F872 HydrophobicContact CD1-CE2 3.95Å; L848-F872 HydrophobicContact CD1-CZ 4.12Å; L848-F872 HydrophobicContact CD2-CE2 3.93Å; L848-F872 HydrophobicContact CD2-CZ 3.81Å; L848-F872 HydrophobicContact CG-CE2 4.08Å; L848-F872 HydrophobicContact CG-CZ 3.8Å; M852-F872 HydrophobicContact CE-CB 4.03Å; M852-F872 HydrophobicContact CE-CD1 3.51Å; M852-F872 HydrophobicContact CE-CD2 3.35Å; M852-F872 HydrophobicContact CE-CE1 3.73Å; M852-F872 HydrophobicContact CE-CE2 3.61Å; M852-F872 HydrophobicContact CE-CG 3.3Å; M852-F872 HydrophobicContact CE-CZ 3.79Å; M852-F872 HydrophobicContact CG-CE2 4.28Å; M852-F872 HydrophobicContact CG-CZ 4.07Å; M852-F872 HydrophobicContact SD-CD2 4.5Å; M852-F872 HydrophobicContact SD-CE2 4.39Å; S868-F872 WeakPolarHBondContact O-CB 3.24Å; S868-F872 PolarHBondContact O-N 3.37Å; C869-F872 PolarHBondContact O-N 3.3Å; E870-F872 VanDerWaalsContact C-N 3.26Å; E870-F872 PolarHBondContact O-N 3.48Å; F872-R874 VanDerWaalsContact C-N 3.34Å; F872-L875 HydrophobicContact CD2-CD2 4.24Å; F872-L875 HydrophobicContact CE2-CD2 4.48Å; F872-L875 WeakPolarHBondContact O-CB 3.15Å; F872-L875 PolarHBondContact O-N 3.13Å; F872-L876 HydrophobicContact CD1-CD1 4.06Å; F872-L876 HydrophobicContact CD1-CG 4.49Å; F872-L876 HydrophobicContact CE1-CD1 3.46Å; F872-L876 VanDerWaalsContact CE1-CD1 3.46Å; F872-L876 HydrophobicContact CE1-CG 3.99Å; F872-L876 HydrophobicContact CE2-CD2 4.3Å; F872-L876 HydrophobicContact CE2-CG 4.15Å; F872-L876 HydrophobicContact CZ-CD1 3.72Å; F872-L876 HydrophobicContact CZ-CD2 3.9Å; F872-L876 HydrophobicContact CZ-CG 3.79Å; F872-L876 WeakPolarHBondContact O-CG 3.48Å; F872-L876 PolarHBondContact O-N 2.69Å; F872-Y889 HydrophobicContact CD1-CD1 4.29Å; F872-Y889 HydrophobicContact CD1-CG 4.29Å; F872-Y889 AromaticContact CE1-CD1 3.61Å; F872-Y889 HydrophobicContact CE1-CD1 3.61Å; F872-Y889 AromaticContact CE1-CD2 3.8Å; F872-Y889 HydrophobicContact CE1-CD2 3.8Å; F872-Y889 AromaticContact CE1-CE1 3.55Å; F872-Y889 HydrophobicContact CE1-CE1 3.55Å; F872-Y889 AromaticContact CE1-CE2 3.76Å; F872-Y889 HydrophobicContact CE1-CE2 3.76Å; F872-Y889 AromaticContact CE1-CG 3.73Å; F872-Y889 HydrophobicContact CE1-CG 3.73Å; F872-Y889 AromaticContact CE1-CZ 3.62Å; F872-Y889 HydrophobicContact CZ-CE1 4.1Å; F872-Y889 HydrophobicContact CZ-CE2 4.22Å; F872-Y889 AromaticContact CZ-CZ 3.89Å
873	L	92.3	Very high	86.2	Confident	0 Å²	0	47 Å²	47	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-66.5	-35.6	172.5	-71	163.9	0	0	0	111.5	C869 E870 L876 S877 M886 I890 L902 Y906	C869-L873 WeakPolarHBondContact O-CB 3.39Å; C869-L873 WeakPolarHBondContact O-CD1 3.38Å; C869-L873 WeakPolarHBondContact O-CG 3.32Å; C869-L873 PolarHBondContact O-N 2.98Å; E870-L873 PolarHBondContact O-N 3.49Å; L873-L876 HydrophobicContact CD2-CD1 4.36Å; L873-L876 PolarHBondContact O-N 2.89Å; L873-S877 WeakPolarHBondContact O-CB 3.47Å; L873-S877 PolarHBondContact O-N 2.83Å; L873-M886 HydrophobicContact CB-CE 4.05Å; L873-M886 HydrophobicContact CD2-CB 4.28Å; L873-M886 HydrophobicContact CD2-CE 3.68Å; L873-M886 HydrophobicContact CD2-SD 3.76Å; L873-M886 HydrophobicContact CG-CE 4.49Å; L873-M886 WeakPolarHBondContact O-CE 3.4Å; L873-I890 HydrophobicContact CD1-CD1 4.15Å; L873-I890 HydrophobicContact CD1-CG1 3.63Å; L873-I890 HydrophobicContact CD2-CD1 4.13Å; L873-I890 HydrophobicContact CD2-CG1 3.94Å; L873-I890 HydrophobicContact CG-CG1 4.46Å; L873-L902 HydrophobicContact CD1-CB 4.36Å; L873-L902 HydrophobicContact CD1-CD1 4.12Å; L873-L902 HydrophobicContact CD1-CD2 4.2Å; L873-L902 HydrophobicContact CD1-CG 4.47Å; L873-Y906 HydrophobicContact CB-CD2 4.15Å; L873-Y906 HydrophobicContact CB-CE2 3.47Å; L873-Y906 VanDerWaalsContact CB-CE2 3.47Å; L873-Y906 HydrophobicContact CD1-CD2 4.18Å; L873-Y906 HydrophobicContact CD1-CE2 3.93Å; L873-Y906 HydrophobicContact CG-CE2 4.22Å
874	R	91.9	Very high	86.6	Confident	98 Å²	98	49 Å²	49	37%	0.37	28%	0.282	S	S	.	.	H	α-helix	trans	-58.8	-47.1	170.5	-78.3	-167.6	-78.3	150.3	-13.6	111.2	D150 E870 Q871 F872 S877 M878 Y906	D150-R874 IonicContact OD1-CZ 2.8Å; D150-R874 IonicContact OD1-NH1 2.74Å; D150-R874 PolarHBondContact OD1-NH1 3.09Å; D150-R874 IonicContact OD1-NH2 3.58Å; D150-R874 IonicContact OD2-CZ 2.89Å; D150-R874 IonicContact OD2-NH1 2.66Å; D150-R874 PolarHBondContact OD2-NH1 3.37Å; D150-R874 IonicContact OD2-NH2 2.73Å; D150-R874 PolarHBondContact OD2-NH2 3.28Å; D150-R874 VanDerWaalsContact OD2-NH2 3.14Å; E870-R874 WeakPolarHBondContact O-CB 3.37Å; E870-R874 WeakPolarHBondContact O-CG 3.48Å; E870-R874 PolarHBondContact O-N 2.99Å; Q871-R874 PolarHBondContact O-N 3.05Å; F872-R874 VanDerWaalsContact C-N 3.34Å; R874-S877 PolarHBondContact O-N 3.5Å; R874-M878 WeakPolarHBondContact O-CB 3.39Å; R874-M878 PolarHBondContact O-N 3.19Å; R874-Y906 PolarHBondContact N-OH 3.04Å
875	L	91.9	Very high	87.5	Confident	5 Å²	5	43.1 Å²	43.1	3%	0.026	26%	0.257	C	S	.	.	H	α-helix	trans	-59.7	-46.6	175.8	175	67.6	0	0	0	112.4	W833 A836 K837 A840 Q871 F872 M878 H879	W833-L875 HydrophobicContact CE3-CD2 4.29Å; W833-L875 HydrophobicContact CH2-CB 4.27Å; W833-L875 HydrophobicContact CH2-CD2 4.27Å; W833-L875 HydrophobicContact CZ3-CB 4.29Å; W833-L875 HydrophobicContact CZ3-CD2 3.79Å; A836-L875 HydrophobicContact CB-CD2 4.15Å; K837-L875 HydrophobicContact CB-CD1 4.33Å; K837-L875 HydrophobicContact CB-CD2 4.44Å; K837-L875 HydrophobicContact CG-CD1 4.16Å; A840-L875 HydrophobicContact CB-CG 4.3Å; Q871-L875 PolarHBondContact O-N 2.96Å; F872-L875 HydrophobicContact CD2-CD2 4.24Å; F872-L875 HydrophobicContact CE2-CD2 4.48Å; F872-L875 WeakPolarHBondContact O-CB 3.15Å; F872-L875 PolarHBondContact O-N 3.13Å; L875-M878 HydrophobicContact CD1-CE 3.83Å; L875-M878 PolarHBondContact O-N 2.89Å; L875-H879 PolarHBondContact O-CD2 3.21Å; L875-H879 VanDerWaalsContact O-CD2 3.31Å; L875-H879 PolarHBondContact O-N 3.28Å
876	L	93	Very high	88.6	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-60.9	-45.9	176.6	-75	179.2	0	0	0	112.1	W845 L848 F872 L873 M878 H879 G880 A881 M886 Y889	W845-L876 HydrophobicContact CE3-CD2 3.95Å; W845-L876 HydrophobicContact CZ3-CD2 3.64Å; L848-L876 HydrophobicContact CD2-CD2 3.69Å; F872-L876 HydrophobicContact CD1-CD1 4.06Å; F872-L876 HydrophobicContact CD1-CG 4.49Å; F872-L876 HydrophobicContact CE1-CD1 3.46Å; F872-L876 VanDerWaalsContact CE1-CD1 3.46Å; F872-L876 HydrophobicContact CE1-CG 3.99Å; F872-L876 HydrophobicContact CE2-CD2 4.3Å; F872-L876 HydrophobicContact CE2-CG 4.15Å; F872-L876 HydrophobicContact CZ-CD1 3.72Å; F872-L876 HydrophobicContact CZ-CD2 3.9Å; F872-L876 HydrophobicContact CZ-CG 3.79Å; F872-L876 WeakPolarHBondContact O-CG 3.48Å; F872-L876 PolarHBondContact O-N 2.69Å; L873-L876 HydrophobicContact CD2-CD1 4.36Å; L873-L876 PolarHBondContact O-N 2.89Å; L876-M878 VanDerWaalsContact C-N 3.32Å; L876-M878 PolarHBondContact O-N 3.12Å; L876-H879 CarbonylContact O-C 3.4Å; L876-H879 PolarHBondContact O-N 3.25Å; L876-G880 PolarHBondContact O-N 2.93Å; L876-A881 HydrophobicContact CB-CB 3.76Å; L876-A881 HydrophobicContact CD2-CB 4.11Å; L876-A881 HydrophobicContact CG-CB 4.44Å; L876-A881 VanDerWaalsContact O-CB 3.28Å; L876-A881 WeakPolarHBondContact O-CB 3.15Å; L876-A881 PolarHBondContact O-N 2.89Å; L876-M886 HydrophobicContact CB-CE 4.36Å; L876-M886 HydrophobicContact CB-SD 3.53Å; L876-M886 VanDerWaalsContact CB-SD 3.53Å; L876-M886 HydrophobicContact CD1-SD 3.82Å; L876-M886 HydrophobicContact CG-SD 4.35Å; L876-Y889 HydrophobicContact CD1-CD2 3.57Å; L876-Y889 HydrophobicContact CD1-CE2 3.56Å
877	S	92.2	Very high	89.8	Confident	62 Å²	62	41.8 Å²	41.8	43%	0.434	25%	0.247	S	C	.	.	H	α-helix	trans	-62.8	-38.1	178	-168.8	0	0	0	0	112.2	L873 R874 H879 G880	L873-S877 WeakPolarHBondContact O-CB 3.47Å; L873-S877 PolarHBondContact O-N 2.83Å; R874-S877 PolarHBondContact O-N 3.5Å; S877-H879 VanDerWaalsContact C-N 3.29Å; S877-H879 PolarHBondContact O-N 3.16Å; S877-G880 PolarHBondContact O-N 3.23Å
878	M	93.1	Very high	90.5	Very high	116 Å²	116	42.9 Å²	42.9	57%	0.571	25%	0.254	S	S	*	.	H	α-helix	trans	-65.6	-30.5	176.6	-178.6	172.8	62.3	0	0	112.7	R874 L875 L876	R874-M878 WeakPolarHBondContact O-CB 3.39Å; R874-M878 PolarHBondContact O-N 3.19Å; L875-M878 HydrophobicContact CD1-CE 3.83Å; L875-M878 PolarHBondContact O-N 2.89Å; L876-M878 VanDerWaalsContact C-N 3.32Å; L876-M878 PolarHBondContact O-N 3.12Å
879	H	92.2	Very high	90.9	Very high	49 Å²	49	40.5 Å²	40.5	23%	0.227	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.5	16.9	174.2	-68	-65.1	0	0	0	113.7	A840 H843 W845 L875 L876 S877 A881	A840-H879 HydrophobicContact CB-CB 4.14Å; H843-H879 PolarHBondContact CE1-O 3.26Å; W845-H879 HydrophobicContact CH2-CB 4.29Å; L875-H879 PolarHBondContact O-CD2 3.21Å; L875-H879 VanDerWaalsContact O-CD2 3.31Å; L875-H879 PolarHBondContact O-N 3.28Å; L876-H879 CarbonylContact O-C 3.4Å; L876-H879 PolarHBondContact O-N 3.25Å; S877-H879 VanDerWaalsContact C-N 3.29Å; S877-H879 PolarHBondContact O-N 3.16Å; H879-A881 PolarHBondContact O-N 3.11Å
880	G	91.6	Very high	91.2	Very high	56 Å²	56	39.8 Å²	39.8	58%	0.577	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	65.2	34	173.9	0	0	0	0	0	114.3	L876 S877	L876-G880 PolarHBondContact O-N 2.93Å; S877-G880 PolarHBondContact O-N 3.23Å
881	A	92.2	Very high	91.3	Very high	13 Å²	13	37.7 Å²	37.7	11%	0.107	23%	0.228	C	C	.	.			trans	-62	132.2	172.7	0	0	0	0	0	110.8	W845 L876 H879 E885 M886	W845-A881 HydrophobicContact CH2-CB 3.7Å; W845-A881 HydrophobicContact CZ2-CB 3.92Å; W845-A881 HydrophobicContact CZ3-CB 4.03Å; L876-A881 HydrophobicContact CB-CB 3.76Å; L876-A881 HydrophobicContact CD2-CB 4.11Å; L876-A881 HydrophobicContact CG-CB 4.44Å; L876-A881 VanDerWaalsContact O-CB 3.28Å; L876-A881 WeakPolarHBondContact O-CB 3.15Å; L876-A881 PolarHBondContact O-N 2.89Å; H879-A881 PolarHBondContact O-N 3.11Å; A881-E885 HydrophobicContact CB-CB 4.47Å; A881-M886 HydrophobicContact CB-SD 4.19Å
882	P	91.4	Very high	91.2	Very high	60 Å²	60	37.2 Å²	37.2	39%	0.39	23%	0.228	S	C	.	.			trans	-71	154.9	178.5	30.1	-34.9	0	0	0	111.1	S884 E885 M886	P882-S884 PolarHBondContact O-N 3.16Å; P882-E885 HydrophobicContact CG-CG 4Å; P882-E885 PolarHBondContact O-N 2.88Å; P882-M886 PolarHBondContact O-N 2.83Å
883	S	89.1	Confident	91.1	Very high	56 Å²	56	39.1 Å²	39.1	39%	0.392	24%	0.238	S	C	.	.	H	α-helix	trans	-55.4	-25.4	-178.8	-51.9	0	0	0	0	113.7	E885 M886 V887 K907	S883-E885 VanDerWaalsContact C-N 3.32Å; S883-E885 PolarHBondContact O-N 2.55Å; S883-M886 PolarHBondContact O-N 2.94Å; S883-V887 WeakPolarHBondContact O-CB 3.4Å; S883-V887 VanDerWaalsContact O-CG2 3.22Å; S883-V887 WeakPolarHBondContact O-CG2 3.44Å; S883-V887 PolarHBondContact O-N 3.28Å; S883-K907 PolarHBondContact OG-O 3.09Å
884	S	89.7	Confident	90.7	Very high	77 Å²	77	46 Å²	46	54%	0.538	28%	0.281	S	S	.	.	H	α-helix	trans	-61.2	-35.4	173.1	55.3	0	0	0	0	113.7	P882	P882-S884 PolarHBondContact O-N 3.16Å
885	E	92	Very high	90.5	Very high	31 Å²	31	44.7 Å²	44.7	15%	0.145	28%	0.281	C	S	.	.	H	α-helix	trans	-76.6	-41.5	174.1	-66.5	-62.2	149.8	0	0	110.8	W845 Q849 A881 P882 S883 V887 V888 Y889	W845-E885 VanDerWaalsContact CB-CD 3.41Å; W845-E885 HydrophobicContact CB-CG 3.96Å; W845-E885 WeakPolarHBondContact CB-OE2 3.11Å; W845-E885 HydrophobicContact CD2-CG 4.34Å; W845-E885 HydrophobicContact CG-CG 3.81Å; Q849-E885 PolarHBondContact NE2-OE2 2.85Å; A881-E885 HydrophobicContact CB-CB 4.47Å; P882-E885 HydrophobicContact CG-CG 4Å; P882-E885 PolarHBondContact O-N 2.88Å; S883-E885 VanDerWaalsContact C-N 3.32Å; S883-E885 PolarHBondContact O-N 2.55Å; E885-V887 VanDerWaalsContact C-N 3.29Å; E885-V887 PolarHBondContact O-N 2.92Å; E885-V888 WeakPolarHBondContact O-CB 3.45Å; E885-V888 PolarHBondContact O-N 3.25Å; E885-V888 VanDerWaalsContact O-N 3.11Å; E885-Y889 WeakPolarHBondContact O-CD2 3.29Å; E885-Y889 WeakPolarHBondContact O-CE2 3.29Å
886	M	91.7	Very high	90.3	Very high	4 Å²	4	45.7 Å²	45.7	2%	0.02	29%	0.293	C	S	.	.	H	α-helix	trans	-58.8	-42	177.2	-54.9	-64.7	-89.3	0	0	111.4	L873 L876 A881 P882 S883 V888 Y889 I890 Y906	L873-M886 HydrophobicContact CB-CE 4.05Å; L873-M886 HydrophobicContact CD2-CB 4.28Å; L873-M886 HydrophobicContact CD2-CE 3.68Å; L873-M886 HydrophobicContact CD2-SD 3.76Å; L873-M886 HydrophobicContact CG-CE 4.49Å; L873-M886 WeakPolarHBondContact O-CE 3.4Å; L876-M886 HydrophobicContact CB-CE 4.36Å; L876-M886 HydrophobicContact CB-SD 3.53Å; L876-M886 VanDerWaalsContact CB-SD 3.53Å; L876-M886 HydrophobicContact CD1-SD 3.82Å; L876-M886 HydrophobicContact CG-SD 4.35Å; A881-M886 HydrophobicContact CB-SD 4.19Å; P882-M886 PolarHBondContact O-N 2.83Å; S883-M886 PolarHBondContact O-N 2.94Å; M886-V888 VanDerWaalsContact C-N 3.28Å; M886-V888 PolarHBondContact O-N 2.81Å; M886-Y889 PolarHBondContact O-N 3.39Å; M886-I890 HydrophobicContact CB-CD1 4.27Å; M886-I890 WeakPolarHBondContact O-CG1 3.4Å; M886-I890 PolarHBondContact O-N 3.03Å; M886-Y906 HydrophobicContact CE-CD1 3.31Å; M886-Y906 HydrophobicContact CE-CD2 3.97Å; M886-Y906 HydrophobicContact CE-CE1 3.74Å; M886-Y906 HydrophobicContact CE-CE2 4.34Å; M886-Y906 HydrophobicContact CE-CG 3.45Å; M886-Y906 VanDerWaalsContact CE-CG 3.45Å
887	V	92.2	Very high	90.1	Very high	45 Å²	45	50.1 Å²	50.1	27%	0.273	31%	0.313	S	S	.	.	H	α-helix	trans	-53.9	-39.9	174.8	155.9	0	0	0	0	112.1	S883 E885 Y889 S891 C908 I911	S883-V887 WeakPolarHBondContact O-CB 3.4Å; S883-V887 VanDerWaalsContact O-CG2 3.22Å; S883-V887 WeakPolarHBondContact O-CG2 3.44Å; S883-V887 PolarHBondContact O-N 3.28Å; E885-V887 VanDerWaalsContact C-N 3.29Å; E885-V887 PolarHBondContact O-N 2.92Å; V887-Y889 PolarHBondContact O-N 3.31Å; V887-S891 WeakPolarHBondContact O-CB 3.31Å; V887-S891 PolarHBondContact O-N 3.18Å; V887-S891 PolarHBondContact O-OG 3.21Å; V887-C908 HydrophobicContact CG2-CB 3.84Å; V887-I911 HydrophobicContact CB-CD1 4.14Å; V887-I911 HydrophobicContact CG1-CD1 4.14Å; V887-I911 HydrophobicContact CG2-CD1 3.9Å; V887-I911 HydrophobicContact CG2-CG1 4.29Å
888	V	90.6	Very high	90	Very high	37 Å²	37	54.6 Å²	54.6	22%	0.224	32%	0.321	C	S	.	.	H	α-helix	trans	-61.9	-45	-178.4	175.9	0	0	0	0	111.1	Q849 L853 E885 M886	Q849-V888 HydrophobicContact CG-CG1 4.41Å; L853-V888 HydrophobicContact CD1-CG1 3.49Å; L853-V888 VanDerWaalsContact CD1-CG1 3.49Å; E885-V888 WeakPolarHBondContact O-CB 3.45Å; E885-V888 PolarHBondContact O-N 3.25Å; E885-V888 VanDerWaalsContact O-N 3.11Å; M886-V888 VanDerWaalsContact C-N 3.28Å; M886-V888 PolarHBondContact O-N 2.81Å
889	Y	90.4	Very high	90	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-77.3	-43.8	-177.9	-54.5	-75.2	0	0	0	112.1	Q849 M852 L853 L863 F872 L876 E885 M886 V887 S891 S892	Q849-Y889 WeakPolarHBondContact CA-OH 3.46Å; Q849-Y889 HydrophobicContact CG-CE1 4.46Å; Q849-Y889 WeakPolarHBondContact CG-OH 3.45Å; Q849-Y889 PolarHBondContact N-OH 3.36Å; M852-Y889 HydrophobicContact CB-CE1 4Å; L853-Y889 HydrophobicContact CD1-CD1 4.47Å; L853-Y889 HydrophobicContact CD1-CE1 4.17Å; L853-Y889 HydrophobicContact CD2-CD1 3.97Å; L853-Y889 HydrophobicContact CD2-CE1 4.25Å; L853-Y889 HydrophobicContact CG-CD1 4.31Å; L853-Y889 HydrophobicContact CG-CE1 4.08Å; L863-Y889 HydrophobicContact CD1-CD1 4.01Å; F872-Y889 HydrophobicContact CD1-CD1 4.29Å; F872-Y889 HydrophobicContact CD1-CG 4.29Å; F872-Y889 AromaticContact CE1-CD1 3.61Å; F872-Y889 HydrophobicContact CE1-CD1 3.61Å; F872-Y889 AromaticContact CE1-CD2 3.8Å; F872-Y889 HydrophobicContact CE1-CD2 3.8Å; F872-Y889 AromaticContact CE1-CE1 3.55Å; F872-Y889 HydrophobicContact CE1-CE1 3.55Å; F872-Y889 AromaticContact CE1-CE2 3.76Å; F872-Y889 HydrophobicContact CE1-CE2 3.76Å; F872-Y889 AromaticContact CE1-CG 3.73Å; F872-Y889 HydrophobicContact CE1-CG 3.73Å; F872-Y889 AromaticContact CE1-CZ 3.62Å; F872-Y889 HydrophobicContact CZ-CE1 4.1Å; F872-Y889 HydrophobicContact CZ-CE2 4.22Å; F872-Y889 AromaticContact CZ-CZ 3.89Å; L876-Y889 HydrophobicContact CD1-CD2 3.57Å; L876-Y889 HydrophobicContact CD1-CE2 3.56Å; E885-Y889 WeakPolarHBondContact O-CD2 3.29Å; E885-Y889 WeakPolarHBondContact O-CE2 3.29Å; M886-Y889 PolarHBondContact O-N 3.39Å; V887-Y889 PolarHBondContact O-N 3.31Å; Y889-S891 VanDerWaalsContact C-N 3.26Å; Y889-S891 PolarHBondContact O-N 2.68Å; Y889-S892 WeakPolarHBondContact O-CB 3.29Å; Y889-S892 PolarHBondContact O-N 3.46Å; Y889-S892 VanDerWaalsContact O-N 3.1Å; Y889-S892 PolarHBondContact O-OG 3.41Å
890	I	92.3	Very high	90.1	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-62.1	-35.9	176.9	-64.3	166	0	0	0	110.6	L873 M886 S892 L893 K899 L902 A903 Y906 I911	L873-I890 HydrophobicContact CD1-CD1 4.15Å; L873-I890 HydrophobicContact CD1-CG1 3.63Å; L873-I890 HydrophobicContact CD2-CD1 4.13Å; L873-I890 HydrophobicContact CD2-CG1 3.94Å; L873-I890 HydrophobicContact CG-CG1 4.46Å; M886-I890 HydrophobicContact CB-CD1 4.27Å; M886-I890 WeakPolarHBondContact O-CG1 3.4Å; M886-I890 PolarHBondContact O-N 3.03Å; I890-S892 PolarHBondContact O-N 3.02Å; I890-L893 WeakPolarHBondContact O-CB 3.39Å; I890-L893 PolarHBondContact O-N 3.39Å; I890-K899 HydrophobicContact CG2-CG 3.99Å; I890-K899 WeakPolarHBondContact O-CD 3.2Å; I890-L902 HydrophobicContact CD1-CB 4.4Å; I890-L902 HydrophobicContact CG1-CB 4.3Å; I890-A903 HydrophobicContact CG2-CB 4.12Å; I890-Y906 HydrophobicContact CD1-CD2 4.21Å; I890-I911 HydrophobicContact CB-CD1 3.95Å; I890-I911 HydrophobicContact CG2-CD1 3.76Å; I890-I911 HydrophobicContact CG2-CG2 4.23Å
891	S	89.5	Confident	90.1	Very high	50 Å²	50	49 Å²	49	35%	0.35	28%	0.28	S	S	.	.	H	α-helix	trans	-61.5	-31	175.9	-67.6	0	0	0	0	113.5	V887 Y889 L893 K899 I911	V887-S891 WeakPolarHBondContact O-CB 3.31Å; V887-S891 PolarHBondContact O-N 3.18Å; V887-S891 PolarHBondContact O-OG 3.21Å; Y889-S891 VanDerWaalsContact C-N 3.26Å; Y889-S891 PolarHBondContact O-N 2.68Å; S891-L893 VanDerWaalsContact C-N 3.28Å; S891-L893 PolarHBondContact O-N 2.71Å; S891-K899 PolarHBondContact O-NZ 3.47Å; S891-I911 WeakPolarHBondContact OG-CD1 3.33Å
892	S	86.4	Confident	90.2	Very high	22 Å²	22	49 Å²	49	15%	0.154	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-5.8	-178.3	77.1	0	0	0	0	114.9	Y889 I890	Y889-S892 WeakPolarHBondContact O-CB 3.29Å; Y889-S892 PolarHBondContact O-N 3.46Å; Y889-S892 VanDerWaalsContact O-N 3.1Å; Y889-S892 PolarHBondContact O-OG 3.41Å; I890-S892 PolarHBondContact O-N 3.02Å
893	L	86.6	Confident	90.4	Very high	40 Å²	40	46.1 Å²	46.1	21%	0.209	26%	0.259	C	S	.	.			trans	-73.8	136.7	175.5	-64.1	172.9	0	0	0	111.4	C869 I890 S891 K899 L902	C869-L893 HydrophobicContact CB-CD2 3.95Å; I890-L893 WeakPolarHBondContact O-CB 3.39Å; I890-L893 PolarHBondContact O-N 3.39Å; S891-L893 VanDerWaalsContact C-N 3.28Å; S891-L893 PolarHBondContact O-N 2.71Å; L893-K899 HydrophobicContact CB-CB 4.12Å; L893-K899 HydrophobicContact CB-CD 4.43Å; L893-K899 HydrophobicContact CD1-CB 4.42Å; L893-L902 HydrophobicContact CD1-CD1 3.63Å
894	T	85.5	Confident	90.5	Very high	145 Å²	145	47.7 Å²	47.7	89%	0.89	26%	0.259	S	S	*	.	S	Bend	trans	-86	-37.9	178.2	47.7	0	0	0	0	113.1	G896	T894-G896 PolarHBondContact O-N 2.93Å
895	N	86.7	Confident	90.7	Very high	70 Å²	70	50.4 Å²	50.4	37%	0.374	26%	0.261	S	S	.	.			trans	-74.1	111.2	177.6	-178.7	-60.1	0	0	0	109.9	Q897 R898 K899	N895-Q897 VanDerWaalsContact C-N 3.34Å; N895-Q897 PolarHBondContact O-N 3.4Å; N895-Q897 PolarHBondContact OD1-N 3.07Å; N895-Q897 VanDerWaalsContact OD1-N 3.13Å; N895-R898 HydrophobicContact CB-CB 4.36Å; N895-R898 HydrophobicContact CB-CG 4.48Å; N895-R898 PolarHBondContact OD1-N 3Å; N895-K899 VanDerWaalsContact O-CB 3.26Å; N895-K899 WeakPolarHBondContact O-CB 3.35Å; N895-K899 PolarHBondContact O-N 3.39Å
896	G	88	Confident	90.7	Very high	26 Å²	26	50.1 Å²	50.1	27%	0.268	26%	0.259	S	S	.	.	H	α-helix	trans	-63.4	-33.3	-175.5	0	0	0	0	0	114.3	T894 K899 L900	T894-G896 PolarHBondContact O-N 2.93Å; G896-K899 PolarHBondContact O-N 3.08Å; G896-L900 WeakPolarHBondContact O-CB 3.42Å; G896-L900 PolarHBondContact O-N 2.9Å
897	Q	89.3	Confident	90.7	Very high	94 Å²	94	57.6 Å²	57.6	44%	0.439	29%	0.292	S	S	.	.	H	α-helix	trans	-69.9	-53.4	178.6	-175.3	56.5	42.8	0	0	111.1	N895 K899 L900 D901	N895-Q897 VanDerWaalsContact C-N 3.34Å; N895-Q897 PolarHBondContact O-N 3.4Å; N895-Q897 PolarHBondContact OD1-N 3.07Å; N895-Q897 VanDerWaalsContact OD1-N 3.13Å; Q897-K899 PolarHBondContact O-N 2.89Å; Q897-L900 WeakPolarHBondContact O-CB 3.33Å; Q897-L900 PolarHBondContact O-N 3.37Å; Q897-D901 PolarHBondContact NE2-OD1 2.99Å; Q897-D901 PolarHBondContact NE2-OD2 3.3Å; Q897-D901 PolarHBondContact O-N 3.42Å; Q897-D901 VanDerWaalsContact O-OD2 3.13Å
898	R	89.6	Confident	90.7	Very high	156 Å²	156	55.6 Å²	55.6	59%	0.589	28%	0.28	S	S	*	.	H	α-helix	trans	-58.1	-34.3	175	-65.4	-174.1	-174.1	176.4	4.6	111.9	N895 L902	N895-R898 HydrophobicContact CB-CB 4.36Å; N895-R898 HydrophobicContact CB-CG 4.48Å; N895-R898 PolarHBondContact OD1-N 3Å; R898-L902 WeakPolarHBondContact O-CB 3.2Å; R898-L902 WeakPolarHBondContact O-CD1 3.38Å; R898-L902 VanDerWaalsContact O-CG 3.29Å; R898-L902 WeakPolarHBondContact O-CG 3.41Å; R898-L902 PolarHBondContact O-N 3.4Å
899	K	92.9	Very high	90.8	Very high	29 Å²	29	56 Å²	56	13%	0.126	28%	0.281	C	S	.	.	H	α-helix	trans	-65.6	-44.6	173.8	179.9	167.1	174.2	171.2	0	112.4	I890 S891 L893 N895 G896 Q897 A903 I911 Q915	I890-K899 HydrophobicContact CG2-CG 3.99Å; I890-K899 WeakPolarHBondContact O-CD 3.2Å; S891-K899 PolarHBondContact O-NZ 3.47Å; L893-K899 HydrophobicContact CB-CB 4.12Å; L893-K899 HydrophobicContact CB-CD 4.43Å; L893-K899 HydrophobicContact CD1-CB 4.42Å; N895-K899 VanDerWaalsContact O-CB 3.26Å; N895-K899 WeakPolarHBondContact O-CB 3.35Å; N895-K899 PolarHBondContact O-N 3.39Å; G896-K899 PolarHBondContact O-N 3.08Å; Q897-K899 PolarHBondContact O-N 2.89Å; K899-A903 WeakPolarHBondContact O-CB 3.48Å; K899-A903 PolarHBondContact O-N 3.16Å; K899-I911 HydrophobicContact CD-CG2 4.47Å; K899-I911 HydrophobicContact CG-CG2 3.92Å; K899-Q915 HydrophobicContact CD-CG 4.45Å; K899-Q915 HydrophobicContact CG-CG 4.16Å
900	L	93.6	Very high	90.8	Very high	5 Å²	5	58.1 Å²	58.1	3%	0.026	29%	0.292	C	S	.	.	H	α-helix	trans	-61.6	-45.8	174.4	175.6	63.5	0	0	0	111.7	G896 Q897 A903 K904 V912 Q915 L916 L919	G896-L900 WeakPolarHBondContact O-CB 3.42Å; G896-L900 PolarHBondContact O-N 2.9Å; Q897-L900 WeakPolarHBondContact O-CB 3.33Å; Q897-L900 PolarHBondContact O-N 3.37Å; L900-A903 PolarHBondContact O-N 2.9Å; L900-K904 HydrophobicContact CD1-CD 4.42Å; L900-K904 HydrophobicContact CD1-CG 4.48Å; L900-K904 HydrophobicContact CG-CD 4.36Å; L900-K904 WeakPolarHBondContact O-CG 3.45Å; L900-K904 PolarHBondContact O-N 2.81Å; L900-V912 HydrophobicContact CD1-CB 4.41Å; L900-V912 HydrophobicContact CD1-CG1 3.81Å; L900-Q915 HydrophobicContact CB-CB 4.16Å; L900-Q915 HydrophobicContact CB-CG 4.46Å; L900-Q915 HydrophobicContact CD1-CB 4.03Å; L900-L916 HydrophobicContact CD1-CD2 3.98Å; L900-L916 HydrophobicContact CD1-CG 3.96Å; L900-L916 HydrophobicContact CD2-CD2 3.9Å; L900-L919 HydrophobicContact CD2-CD1 3.84Å
901	D	93.2	Very high	90.9	Very high	68 Å²	68	58.2 Å²	58.2	36%	0.364	29%	0.292	S	S	.	.	H	α-helix	trans	-69.4	-41	-176	-62.9	-35.4	0	0	0	112.2	Q897 K904 K905	Q897-D901 PolarHBondContact NE2-OD1 2.99Å; Q897-D901 PolarHBondContact NE2-OD2 3.3Å; Q897-D901 PolarHBondContact O-N 3.42Å; Q897-D901 VanDerWaalsContact O-OD2 3.13Å; D901-K904 PolarHBondContact O-N 3.39Å; D901-K905 WeakPolarHBondContact O-CB 3.44Å; D901-K905 PolarHBondContact O-N 2.95Å
902	L	93.6	Very high	91.1	Very high	13 Å²	13	55.8 Å²	55.8	7%	0.068	28%	0.276	C	S	.	.	H	α-helix	trans	-68.8	-36	172.7	-68.1	167.5	0	0	0	112.1	E870 L873 I890 L893 R898 K905 Y906	E870-L902 HydrophobicContact CG-CD1 4.19Å; E870-L902 HydrophobicContact CG-CD2 4.09Å; L873-L902 HydrophobicContact CD1-CB 4.36Å; L873-L902 HydrophobicContact CD1-CD1 4.12Å; L873-L902 HydrophobicContact CD1-CD2 4.2Å; L873-L902 HydrophobicContact CD1-CG 4.47Å; I890-L902 HydrophobicContact CD1-CB 4.4Å; I890-L902 HydrophobicContact CG1-CB 4.3Å; L893-L902 HydrophobicContact CD1-CD1 3.63Å; R898-L902 WeakPolarHBondContact O-CB 3.2Å; R898-L902 WeakPolarHBondContact O-CD1 3.38Å; R898-L902 VanDerWaalsContact O-CG 3.29Å; R898-L902 WeakPolarHBondContact O-CG 3.41Å; R898-L902 PolarHBondContact O-N 3.4Å; L902-K905 PolarHBondContact O-N 3.07Å; L902-Y906 HydrophobicContact CD2-CE2 3.95Å; L902-Y906 VanDerWaalsContact O-CD2 3.31Å; L902-Y906 WeakPolarHBondContact O-CD2 2.91Å; L902-Y906 PolarHBondContact O-N 3.07Å
903	A	94.4	Very high	91.4	Very high	0 Å²	0	55 Å²	55	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-64.4	-41	174.7	0	0	0	0	0	112.4	I890 K899 L900 K907 C908 I911 V912	I890-A903 HydrophobicContact CG2-CB 4.12Å; K899-A903 WeakPolarHBondContact O-CB 3.48Å; K899-A903 PolarHBondContact O-N 3.16Å; L900-A903 PolarHBondContact O-N 2.9Å; A903-K907 PolarHBondContact O-N 3.28Å; A903-K907 VanDerWaalsContact O-N 3.17Å; A903-C908 HydrophobicContact CB-CB 4.13Å; A903-C908 PolarHBondContact O-N 2.73Å; A903-I911 HydrophobicContact CB-CB 3.81Å; A903-I911 HydrophobicContact CB-CG2 3.67Å; A903-V912 HydrophobicContact CB-CG2 3.56Å
904	K	93	Very high	91.7	Very high	89 Å²	89	57.6 Å²	57.6	39%	0.387	28%	0.281	S	S	.	.	H	α-helix	trans	-61.4	-50.8	171.3	-73.4	170.3	179.7	169.3	0	110.9	L900 D901 Y906 K907 V912	L900-K904 HydrophobicContact CD1-CD 4.42Å; L900-K904 HydrophobicContact CD1-CG 4.48Å; L900-K904 HydrophobicContact CG-CD 4.36Å; L900-K904 WeakPolarHBondContact O-CG 3.45Å; L900-K904 PolarHBondContact O-N 2.81Å; D901-K904 PolarHBondContact O-N 3.39Å; K904-Y906 VanDerWaalsContact C-N 3.3Å; K904-Y906 PolarHBondContact O-N 3.47Å; K904-K907 PolarHBondContact O-N 3.24Å; K904-V912 HydrophobicContact CG-CG1 4.02Å; K904-V912 HydrophobicContact CG-CG2 3.93Å
905	K	92.4	Very high	92	Very high	134 Å²	134	52.2 Å²	52.2	58%	0.583	25%	0.245	S	C	*	.	H	α-helix	trans	-56.9	-38.6	-177.6	-176.6	170	-177.3	165.8	0	113.5	D901 L902	D901-K905 WeakPolarHBondContact O-CB 3.44Å; D901-K905 PolarHBondContact O-N 2.95Å; L902-K905 PolarHBondContact O-N 3.07Å
906	Y	92.8	Very high	92.3	Very high	25 Å²	25	49 Å²	49	10%	0.098	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.7	20.5	-178	-60.8	-67.9	0	0	0	114	L873 R874 M886 I890 L902 K904 C908	L873-Y906 HydrophobicContact CB-CD2 4.15Å; L873-Y906 HydrophobicContact CB-CE2 3.47Å; L873-Y906 VanDerWaalsContact CB-CE2 3.47Å; L873-Y906 HydrophobicContact CD1-CD2 4.18Å; L873-Y906 HydrophobicContact CD1-CE2 3.93Å; L873-Y906 HydrophobicContact CG-CE2 4.22Å; R874-Y906 PolarHBondContact N-OH 3.04Å; M886-Y906 HydrophobicContact CE-CD1 3.31Å; M886-Y906 HydrophobicContact CE-CD2 3.97Å; M886-Y906 HydrophobicContact CE-CE1 3.74Å; M886-Y906 HydrophobicContact CE-CE2 4.34Å; M886-Y906 HydrophobicContact CE-CG 3.45Å; M886-Y906 VanDerWaalsContact CE-CG 3.45Å; I890-Y906 HydrophobicContact CD1-CD2 4.21Å; L902-Y906 HydrophobicContact CD2-CE2 3.95Å; L902-Y906 VanDerWaalsContact O-CD2 3.31Å; L902-Y906 WeakPolarHBondContact O-CD2 2.91Å; L902-Y906 PolarHBondContact O-N 3.07Å; K904-Y906 VanDerWaalsContact C-N 3.3Å; K904-Y906 PolarHBondContact O-N 3.47Å; Y906-C908 VanDerWaalsContact C-N 3.34Å; Y906-C908 PolarHBondContact O-N 3.36Å; Y906-C908 PolarHBondContact O-SG 2.91Å; Y906-C908 VanDerWaalsContact O-SG 3.38Å
907	K	90.7	Very high	92.4	Very high	162 Å²	162	49.5 Å²	49.5	70%	0.704	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	48.4	53.2	175.6	-56.8	-174.3	-179	-175.2	0	112.8	S883 A903 K904	S883-K907 PolarHBondContact OG-O 3.09Å; A903-K907 PolarHBondContact O-N 3.28Å; A903-K907 VanDerWaalsContact O-N 3.17Å; K904-K907 PolarHBondContact O-N 3.24Å
908	C	92.6	Very high	92.4	Very high	3 Å²	3	48.6 Å²	48.6	2%	0.02	24%	0.235	C	C	.	.			trans	-101.4	58.5	178.5	-65.9	0	0	0	0	109.8	V887 A903 Y906 N910 I911 V912	V887-C908 HydrophobicContact CG2-CB 3.84Å; A903-C908 HydrophobicContact CB-CB 4.13Å; A903-C908 PolarHBondContact O-N 2.73Å; Y906-C908 VanDerWaalsContact C-N 3.34Å; Y906-C908 PolarHBondContact O-N 3.36Å; Y906-C908 PolarHBondContact O-SG 2.91Å; Y906-C908 VanDerWaalsContact O-SG 3.38Å; C908-N910 VanDerWaalsContact C-N 3.28Å; C908-N910 PolarHBondContact O-N 2.85Å; C908-N910 VanDerWaalsContact O-N 3.08Å; C908-I911 HydrophobicContact CB-CD1 4.37Å; C908-I911 WeakPolarHBondContact O-CB 3.47Å; C908-I911 PolarHBondContact O-N 3.2Å; C908-V912 PolarHBondContact O-N 3.18Å
909	D	92.8	Very high	92.4	Very high	46 Å²	46	45.8 Å²	45.8	25%	0.246	23%	0.231	C	C	.	.	H	α-helix	trans	-50.3	-40.1	-163.1	-49.9	-11.7	0	0	0	114.8	I911 V912 V913 Y928 L932 S938	D909-I911 VanDerWaalsContact C-N 3.3Å; D909-I911 PolarHBondContact O-N 2.85Å; D909-V912 PolarHBondContact O-N 3.4Å; D909-V912 VanDerWaalsContact O-N 3.1Å; D909-V913 WeakPolarHBondContact O-CG2 3.43Å; D909-V913 PolarHBondContact O-N 3.46Å; D909-Y928 HydrophobicContact CB-CE1 4.34Å; D909-Y928 PolarHBondContact OD1-OH 3.18Å; D909-Y928 VanDerWaalsContact OD1-OH 3.11Å; D909-L932 HydrophobicContact CB-CD2 3.79Å; D909-L932 WeakPolarHBondContact OD2-CD2 3.29Å; D909-S938 VanDerWaalsContact CB-CB 3.49Å; D909-S938 WeakPolarHBondContact CB-OG 3.5Å
910	N	91.8	Very high	92.1	Very high	43 Å²	43	50.7 Å²	50.7	23%	0.23	25%	0.248	C	C	.	.	H	α-helix	trans	-55.5	-43.8	175.9	-85.9	-33.8	0	0	0	111.8	C908 E914 E937 K941	C908-N910 VanDerWaalsContact C-N 3.28Å; C908-N910 PolarHBondContact O-N 2.85Å; C908-N910 VanDerWaalsContact O-N 3.08Å; N910-E914 WeakPolarHBondContact O-CB 3.49Å; N910-E914 VanDerWaalsContact O-CG 3.24Å; N910-E914 WeakPolarHBondContact O-CG 3.36Å; N910-E914 PolarHBondContact O-N 2.73Å; N910-E937 PolarHBondContact ND2-OE2 3.47Å; N910-K941 VanDerWaalsContact CG-NZ 3.33Å; N910-K941 WeakPolarHBondContact OD1-CD 3.43Å; N910-K941 PolarHBondContact OD1-NZ 3.03Å
911	I	92.9	Very high	92	Very high	2 Å²	2	53.6 Å²	53.6	1%	0.01	26%	0.264	C	S	.	.	H	α-helix	trans	-68.6	-38.9	176.6	-59.6	179.1	0	0	0	110.6	V887 I890 S891 K899 A903 C908 D909 E914 Q915	V887-I911 HydrophobicContact CB-CD1 4.14Å; V887-I911 HydrophobicContact CG1-CD1 4.14Å; V887-I911 HydrophobicContact CG2-CD1 3.9Å; V887-I911 HydrophobicContact CG2-CG1 4.29Å; I890-I911 HydrophobicContact CB-CD1 3.95Å; I890-I911 HydrophobicContact CG2-CD1 3.76Å; I890-I911 HydrophobicContact CG2-CG2 4.23Å; S891-I911 WeakPolarHBondContact OG-CD1 3.33Å; K899-I911 HydrophobicContact CD-CG2 4.47Å; K899-I911 HydrophobicContact CG-CG2 3.92Å; A903-I911 HydrophobicContact CB-CB 3.81Å; A903-I911 HydrophobicContact CB-CG2 3.67Å; C908-I911 HydrophobicContact CB-CD1 4.37Å; C908-I911 WeakPolarHBondContact O-CB 3.47Å; C908-I911 PolarHBondContact O-N 3.2Å; D909-I911 VanDerWaalsContact C-N 3.3Å; D909-I911 PolarHBondContact O-N 2.85Å; I911-E914 PolarHBondContact O-N 3.08Å; I911-Q915 HydrophobicContact CG2-CG 4.03Å; I911-Q915 WeakPolarHBondContact O-CB 3.38Å; I911-Q915 WeakPolarHBondContact O-CG 3.44Å; I911-Q915 PolarHBondContact O-N 2.93Å
912	V	94.1	Very high	91.8	Very high	0 Å²	0	56 Å²	56	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-61.7	-46.9	178.2	-178.5	0	0	0	0	110.4	L900 A903 K904 C908 D909 Q915 L916 Y928	L900-V912 HydrophobicContact CD1-CB 4.41Å; L900-V912 HydrophobicContact CD1-CG1 3.81Å; A903-V912 HydrophobicContact CB-CG2 3.56Å; K904-V912 HydrophobicContact CG-CG1 4.02Å; K904-V912 HydrophobicContact CG-CG2 3.93Å; C908-V912 PolarHBondContact O-N 3.18Å; D909-V912 PolarHBondContact O-N 3.4Å; D909-V912 VanDerWaalsContact O-N 3.1Å; V912-Q915 PolarHBondContact O-N 3.47Å; V912-L916 HydrophobicContact CG1-CD1 3.8Å; V912-L916 HydrophobicContact CG1-CG 4.28Å; V912-L916 WeakPolarHBondContact O-CB 3.1Å; V912-L916 VanDerWaalsContact O-CG 3.26Å; V912-L916 WeakPolarHBondContact O-CG 3.49Å; V912-L916 PolarHBondContact O-N 2.98Å; V912-Y928 HydrophobicContact CB-CD1 4.19Å; V912-Y928 HydrophobicContact CB-CE1 3.52Å; V912-Y928 HydrophobicContact CB-CE2 4.5Å; V912-Y928 HydrophobicContact CG1-CD1 3.59Å; V912-Y928 HydrophobicContact CG1-CD2 4.04Å; V912-Y928 HydrophobicContact CG1-CE1 3.36Å; V912-Y928 HydrophobicContact CG1-CE2 3.87Å; V912-Y928 HydrophobicContact CG1-CG 3.92Å; V912-Y928 HydrophobicContact CG2-CE1 4.22Å
913	V	93	Very high	91.6	Very high	4 Å²	4	58.7 Å²	58.7	2%	0.024	29%	0.293	C	S	.	.	H	α-helix	trans	-60.4	-49.1	175.3	172.2	0	0	0	0	110.9	D909 Q915 L916 V917 L925 Y928 L932 K941 A942	D909-V913 WeakPolarHBondContact O-CG2 3.43Å; D909-V913 PolarHBondContact O-N 3.46Å; V913-Q915 VanDerWaalsContact C-N 3.35Å; V913-Q915 PolarHBondContact O-N 2.85Å; V913-L916 PolarHBondContact O-N 2.92Å; V913-V917 HydrophobicContact CG1-CG2 4.42Å; V913-V917 WeakPolarHBondContact O-CB 3.44Å; V913-V917 VanDerWaalsContact O-CG2 3.26Å; V913-V917 WeakPolarHBondContact O-CG2 3.46Å; V913-V917 PolarHBondContact O-N 3.48Å; V913-L925 HydrophobicContact CB-CD1 4.46Å; V913-L925 HydrophobicContact CG1-CD1 4.25Å; V913-L925 HydrophobicContact CG2-CD1 4.22Å; V913-Y928 HydrophobicContact CG2-CD1 4.43Å; V913-L932 HydrophobicContact CG2-CD1 4.32Å; V913-K941 HydrophobicContact CG1-CB 4.23Å; V913-A942 HydrophobicContact CG1-CB 3.83Å; V913-A942 HydrophobicContact CG2-CB 3.91Å
914	E	92.1	Very high	91.5	Very high	96 Å²	96	59.6 Å²	59.6	45%	0.449	30%	0.3	S	S	.	.	H	α-helix	trans	-58.2	-41.6	177.5	-76.1	168	-157.7	0	0	113	N910 I911 A918	N910-E914 WeakPolarHBondContact O-CB 3.49Å; N910-E914 VanDerWaalsContact O-CG 3.24Å; N910-E914 WeakPolarHBondContact O-CG 3.36Å; N910-E914 PolarHBondContact O-N 2.73Å; I911-E914 PolarHBondContact O-N 3.08Å; E914-A918 VanDerWaalsContact O-CB 3.3Å; E914-A918 WeakPolarHBondContact O-CB 3.45Å; E914-A918 PolarHBondContact O-N 3.01Å
915	Q	92.7	Very high	91.4	Very high	31 Å²	31	55.4 Å²	55.4	15%	0.145	28%	0.282	C	S	.	.	H	α-helix	trans	-73.8	-40.2	178.6	-65.5	-49.3	-101.2	0	0	112.6	K899 L900 I911 V912 V913 V917 A918 L919	K899-Q915 HydrophobicContact CD-CG 4.45Å; K899-Q915 HydrophobicContact CG-CG 4.16Å; L900-Q915 HydrophobicContact CB-CB 4.16Å; L900-Q915 HydrophobicContact CB-CG 4.46Å; L900-Q915 HydrophobicContact CD1-CB 4.03Å; I911-Q915 HydrophobicContact CG2-CG 4.03Å; I911-Q915 WeakPolarHBondContact O-CB 3.38Å; I911-Q915 WeakPolarHBondContact O-CG 3.44Å; I911-Q915 PolarHBondContact O-N 2.93Å; V912-Q915 PolarHBondContact O-N 3.47Å; V913-Q915 VanDerWaalsContact C-N 3.35Å; V913-Q915 PolarHBondContact O-N 2.85Å; Q915-V917 VanDerWaalsContact C-N 3.33Å; Q915-V917 PolarHBondContact O-N 3.28Å; Q915-A918 PolarHBondContact O-N 2.89Å; Q915-L919 WeakPolarHBondContact O-CB 3.41Å; Q915-L919 VanDerWaalsContact O-CG 3.26Å; Q915-L919 WeakPolarHBondContact O-CG 3.16Å; Q915-L919 PolarHBondContact O-N 3.07Å
916	L	91.9	Very high	91.3	Very high	3 Å²	3	52.7 Å²	52.7	2%	0.016	27%	0.273	C	S	.	.	H	α-helix	trans	-65.9	-36.6	176.5	-68.2	176.3	0	0	0	112	L900 V912 V913 R920 D921 A924 L925 Y928	L900-L916 HydrophobicContact CD1-CD2 3.98Å; L900-L916 HydrophobicContact CD1-CG 3.96Å; L900-L916 HydrophobicContact CD2-CD2 3.9Å; V912-L916 HydrophobicContact CG1-CD1 3.8Å; V912-L916 HydrophobicContact CG1-CG 4.28Å; V912-L916 WeakPolarHBondContact O-CB 3.1Å; V912-L916 VanDerWaalsContact O-CG 3.26Å; V912-L916 WeakPolarHBondContact O-CG 3.49Å; V912-L916 PolarHBondContact O-N 2.98Å; V913-L916 PolarHBondContact O-N 2.92Å; L916-R920 PolarHBondContact O-N 3.25Å; L916-R920 VanDerWaalsContact O-N 3.11Å; L916-D921 HydrophobicContact CD2-CB 4.45Å; L916-D921 PolarHBondContact O-N 3.23Å; L916-A924 HydrophobicContact CD1-CB 4.35Å; L916-A924 HydrophobicContact CD2-CB 3.81Å; L916-L925 HydrophobicContact CB-CB 4.25Å; L916-L925 HydrophobicContact CB-CD1 4.21Å; L916-L925 HydrophobicContact CD1-CB 4.47Å; L916-L925 HydrophobicContact CD1-CD1 4.33Å; L916-Y928 HydrophobicContact CD1-CG 4.43Å
917	V	91.5	Very high	91.3	Very high	37 Å²	37	58.5 Å²	58.5	22%	0.224	30%	0.301	C	S	.	.	H	α-helix	trans	-64.9	-44.5	170.8	169	0	0	0	0	111.3	V913 Q915 L919 R920 L925 A945 T951 F952	V913-V917 HydrophobicContact CG1-CG2 4.42Å; V913-V917 WeakPolarHBondContact O-CB 3.44Å; V913-V917 VanDerWaalsContact O-CG2 3.26Å; V913-V917 WeakPolarHBondContact O-CG2 3.46Å; V913-V917 PolarHBondContact O-N 3.48Å; Q915-V917 VanDerWaalsContact C-N 3.33Å; Q915-V917 PolarHBondContact O-N 3.28Å; V917-L919 VanDerWaalsContact C-N 3.35Å; V917-L919 PolarHBondContact O-N 3.48Å; V917-R920 PolarHBondContact O-N 2.91Å; V917-L925 HydrophobicContact CG2-CD2 3.82Å; V917-A945 HydrophobicContact CG1-CB 4.49Å; V917-A945 HydrophobicContact CG2-CB 3.58Å; V917-T951 HydrophobicContact CG1-CG2 3.69Å; V917-F952 HydrophobicContact CG2-CZ 4.41Å
918	A	89.5	Confident	91.3	Very high	75 Å²	75	53.2 Å²	53.2	62%	0.62	28%	0.277	S	S	*	.	H	α-helix	trans	-65	-35.6	177.8	0	0	0	0	0	113.3	E914 Q915 R920	E914-A918 VanDerWaalsContact O-CB 3.3Å; E914-A918 WeakPolarHBondContact O-CB 3.45Å; E914-A918 PolarHBondContact O-N 3.01Å; Q915-A918 PolarHBondContact O-N 2.89Å; A918-R920 PolarHBondContact O-N 3.21Å
919	L	88.9	Confident	91.2	Very high	96 Å²	96	54.8 Å²	54.8	50%	0.503	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-8.6	172.7	-68.9	168.7	0	0	0	113.2	L900 Q915 V917 D921	L900-L919 HydrophobicContact CD2-CD1 3.84Å; Q915-L919 WeakPolarHBondContact O-CB 3.41Å; Q915-L919 VanDerWaalsContact O-CG 3.26Å; Q915-L919 WeakPolarHBondContact O-CG 3.16Å; Q915-L919 PolarHBondContact O-N 3.07Å; V917-L919 VanDerWaalsContact C-N 3.35Å; V917-L919 PolarHBondContact O-N 3.48Å; L919-D921 PolarHBondContact O-N 3.1Å
920	R	87.6	Confident	91	Very high	132 Å²	132	57.6 Å²	57.6	50%	0.498	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.7	22	-171.8	-60.1	176.7	167.3	-166	-7.3	114.3	L916 V917 A918 R922 F952 L954	L916-R920 PolarHBondContact O-N 3.25Å; L916-R920 VanDerWaalsContact O-N 3.11Å; V917-R920 PolarHBondContact O-N 2.91Å; A918-R920 PolarHBondContact O-N 3.21Å; R920-R922 VanDerWaalsContact C-N 3.33Å; R920-R922 PolarHBondContact O-N 2.89Å; R920-F952 HydrophobicContact CB-CD1 4.3Å; R920-L954 PolarHBondContact NH1-O 3.03Å
921	D	89.9	Confident	90.8	Very high	67 Å²	67	58.9 Å²	58.9	36%	0.358	33%	0.332	S	S	.	.			trans	-79.4	83.5	178.4	-170.6	-11.6	0	0	0	111	L916 L919 A923 A924 L925	L916-D921 HydrophobicContact CD2-CB 4.45Å; L916-D921 PolarHBondContact O-N 3.23Å; L919-D921 PolarHBondContact O-N 3.1Å; D921-A923 PolarHBondContact O-N 2.91Å; D921-A923 PolarHBondContact OD1-N 3.32Å; D921-A924 HydrophobicContact CB-CB 4.3Å; D921-A924 VanDerWaalsContact CG-CB 3.43Å; D921-A924 PolarHBondContact OD1-N 2.97Å; D921-A924 WeakPolarHBondContact OD2-CB 3.45Å; D921-L925 WeakPolarHBondContact O-CB 3.2Å; D921-L925 PolarHBondContact O-N 2.9Å
922	R	89	Confident	90.6	Very high	117 Å²	117	59.5 Å²	59.5	44%	0.442	34%	0.335	S	S	.	.	H	α-helix	trans	-61.3	-28.8	175.8	-169.7	174.5	178.3	-80.8	-4.3	112.7	R920 L926 L946 F952	R920-R922 VanDerWaalsContact C-N 3.33Å; R920-R922 PolarHBondContact O-N 2.89Å; R922-L926 HydrophobicContact CG-CD1 4.25Å; R922-L926 WeakPolarHBondContact O-CB 3.28Å; R922-L926 WeakPolarHBondContact O-CD1 3.27Å; R922-L926 VanDerWaalsContact O-CG 3.3Å; R922-L926 WeakPolarHBondContact O-CG 3.5Å; R922-L926 PolarHBondContact O-N 3.13Å; R922-L926 VanDerWaalsContact O-N 3.16Å; R922-L946 HydrophobicContact CG-CD2 3.66Å; R922-F952 HydrophobicContact CB-CD1 3.8Å; R922-F952 HydrophobicContact CB-CE1 3.86Å; R922-F952 HydrophobicContact CB-CG 4.35Å; R922-F952 HydrophobicContact CB-CZ 4.46Å; R922-F952 HydrophobicContact CG-CD1 4.4Å; R922-F952 HydrophobicContact CG-CE1 4.5Å; R922-F952 HydrophobicContact CG-CG 4.49Å
923	A	91.1	Very high	90.2	Very high	71 Å²	71	64.6 Å²	64.6	59%	0.587	37%	0.366	S	S	*	.	H	α-helix	trans	-76.6	-51	-176.5	0	0	0	0	0	110.8	D921 L925 L926 Q927	D921-A923 PolarHBondContact O-N 2.91Å; D921-A923 PolarHBondContact OD1-N 3.32Å; A923-L925 VanDerWaalsContact C-N 3.3Å; A923-L925 PolarHBondContact O-N 2.7Å; A923-L926 PolarHBondContact O-N 3.25Å; A923-Q927 PolarHBondContact O-N 3.23Å
924	A	91.3	Very high	89.7	Confident	19 Å²	19	69.4 Å²	69.4	16%	0.157	40%	0.398	C	S	.	.	H	α-helix	trans	-65.4	-32.3	174.7	0	0	0	0	0	112.2	L916 D921 Q927 Y928	L916-A924 HydrophobicContact CD1-CB 4.35Å; L916-A924 HydrophobicContact CD2-CB 3.81Å; D921-A924 HydrophobicContact CB-CB 4.3Å; D921-A924 VanDerWaalsContact CG-CB 3.43Å; D921-A924 PolarHBondContact OD1-N 2.97Å; D921-A924 WeakPolarHBondContact OD2-CB 3.45Å; A924-Q927 PolarHBondContact O-N 3.48Å; A924-Y928 VanDerWaalsContact O-CB 3.26Å; A924-Y928 WeakPolarHBondContact O-CB 3.45Å; A924-Y928 PolarHBondContact O-N 2.73Å
925	L	91.5	Very high	89.2	Confident	0 Å²	0	72 Å²	72	0%	0	42%	0.415	C	S	.	.	H	α-helix	trans	-64	-47.2	174.3	-174.6	61.7	0	0	0	111.8	V913 L916 V917 D921 A923 Q927 Y928 I929 A942 L946 F952	V913-L925 HydrophobicContact CB-CD1 4.46Å; V913-L925 HydrophobicContact CG1-CD1 4.25Å; V913-L925 HydrophobicContact CG2-CD1 4.22Å; L916-L925 HydrophobicContact CB-CB 4.25Å; L916-L925 HydrophobicContact CB-CD1 4.21Å; L916-L925 HydrophobicContact CD1-CB 4.47Å; L916-L925 HydrophobicContact CD1-CD1 4.33Å; V917-L925 HydrophobicContact CG2-CD2 3.82Å; D921-L925 WeakPolarHBondContact O-CB 3.2Å; D921-L925 PolarHBondContact O-N 2.9Å; A923-L925 VanDerWaalsContact C-N 3.3Å; A923-L925 PolarHBondContact O-N 2.7Å; L925-Q927 VanDerWaalsContact C-N 3.34Å; L925-Q927 PolarHBondContact O-N 2.81Å; L925-Y928 PolarHBondContact O-N 3.43Å; L925-I929 HydrophobicContact CG-CD1 4.17Å; L925-I929 WeakPolarHBondContact O-CD1 3.32Å; L925-I929 VanDerWaalsContact O-CG1 3.28Å; L925-I929 WeakPolarHBondContact O-CG1 3.26Å; L925-I929 PolarHBondContact O-N 3.38Å; L925-A942 HydrophobicContact CD1-CB 3.95Å; L925-L946 HydrophobicContact CD2-CD1 4.48Å; L925-L946 HydrophobicContact CD2-CD2 4.1Å; L925-L946 HydrophobicContact CD2-CG 3.96Å; L925-F952 HydrophobicContact CD2-CE2 4.24Å; L925-F952 HydrophobicContact CD2-CZ 3.74Å
926	L	90.7	Very high	89.1	Confident	77 Å²	77	71.8 Å²	71.8	40%	0.403	42%	0.416	S	S	.	.	H	α-helix	trans	-61.3	-41.6	175.4	-77.6	167.9	0	0	0	112.2	R922 A923 L946	R922-L926 HydrophobicContact CG-CD1 4.25Å; R922-L926 WeakPolarHBondContact O-CB 3.28Å; R922-L926 WeakPolarHBondContact O-CD1 3.27Å; R922-L926 VanDerWaalsContact O-CG 3.3Å; R922-L926 WeakPolarHBondContact O-CG 3.5Å; R922-L926 PolarHBondContact O-N 3.13Å; R922-L926 VanDerWaalsContact O-N 3.16Å; A923-L926 PolarHBondContact O-N 3.25Å; L926-L946 HydrophobicContact CD2-CD1 3.61Å; L926-L946 HydrophobicContact CD2-CD2 4.4Å; L926-L946 HydrophobicContact CG-CD1 4.18Å; L926-L946 HydrophobicContact CG-CD2 4.27Å
927	Q	91.7	Very high	88.9	Confident	148 Å²	148	77.3 Å²	77.3	69%	0.692	44%	0.442	S	S	*	.	H	α-helix	trans	-61.7	-46.9	174.2	-170.2	-179.8	15.2	0	0	110.9	A923 A924 L925 I929 S930	A923-Q927 PolarHBondContact O-N 3.23Å; A924-Q927 PolarHBondContact O-N 3.48Å; L925-Q927 VanDerWaalsContact C-N 3.34Å; L925-Q927 PolarHBondContact O-N 2.81Å; Q927-I929 PolarHBondContact O-N 3.08Å; Q927-S930 PolarHBondContact O-N 3.37Å; Q927-S930 PolarHBondContact O-OG 3.44Å
928	Y	91.5	Very high	88.8	Confident	50 Å²	50	75.9 Å²	75.9	20%	0.196	43%	0.434	C	S	.	.	H	α-helix	trans	-65.4	-37.8	-177.8	-167.4	-112.6	0	0	0	113.3	D909 V912 V913 L916 A924 L925 S930 G931 L932	D909-Y928 HydrophobicContact CB-CE1 4.34Å; D909-Y928 PolarHBondContact OD1-OH 3.18Å; D909-Y928 VanDerWaalsContact OD1-OH 3.11Å; V912-Y928 HydrophobicContact CB-CD1 4.19Å; V912-Y928 HydrophobicContact CB-CE1 3.52Å; V912-Y928 HydrophobicContact CB-CE2 4.5Å; V912-Y928 HydrophobicContact CG1-CD1 3.59Å; V912-Y928 HydrophobicContact CG1-CD2 4.04Å; V912-Y928 HydrophobicContact CG1-CE1 3.36Å; V912-Y928 HydrophobicContact CG1-CE2 3.87Å; V912-Y928 HydrophobicContact CG1-CG 3.92Å; V912-Y928 HydrophobicContact CG2-CE1 4.22Å; V913-Y928 HydrophobicContact CG2-CD1 4.43Å; L916-Y928 HydrophobicContact CD1-CG 4.43Å; A924-Y928 VanDerWaalsContact O-CB 3.26Å; A924-Y928 WeakPolarHBondContact O-CB 3.45Å; A924-Y928 PolarHBondContact O-N 2.73Å; L925-Y928 PolarHBondContact O-N 3.43Å; Y928-S930 PolarHBondContact O-N 3.19Å; Y928-G931 PolarHBondContact O-N 2.95Å; Y928-L932 HydrophobicContact CD1-CD1 4.29Å; Y928-L932 HydrophobicContact CD1-CD2 4.28Å; Y928-L932 HydrophobicContact CD1-CG 4.33Å; Y928-L932 HydrophobicContact CE1-CD1 4.37Å; Y928-L932 HydrophobicContact CE1-CD2 3.75Å; Y928-L932 HydrophobicContact CE1-CG 4.29Å
929	I	90	Very high	88.8	Confident	37 Å²	37	72.6 Å²	72.6	19%	0.19	41%	0.407	C	S	.	.	H	α-helix	trans	-54.9	-36.9	175.8	-72.4	160.7	0	0	0	112	L925 Q927 G931 L932 A942 L946	L925-I929 HydrophobicContact CG-CD1 4.17Å; L925-I929 WeakPolarHBondContact O-CD1 3.32Å; L925-I929 VanDerWaalsContact O-CG1 3.28Å; L925-I929 WeakPolarHBondContact O-CG1 3.26Å; L925-I929 PolarHBondContact O-N 3.38Å; Q927-I929 PolarHBondContact O-N 3.08Å; I929-G931 PolarHBondContact O-N 3.38Å; I929-G931 VanDerWaalsContact O-N 3.16Å; I929-L932 WeakPolarHBondContact O-CB 3.24Å; I929-L932 PolarHBondContact O-N 3.07Å; I929-A942 HydrophobicContact CD1-CB 3.68Å; I929-A942 HydrophobicContact CG1-CB 3.56Å; I929-L946 HydrophobicContact CD1-CD1 3.34Å
930	S	87.8	Confident	88.9	Confident	104 Å²	104	72.2 Å²	72.2	73%	0.727	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-20.2	179.1	72	0	0	0	0	114.3	Q927 Y928	Q927-S930 PolarHBondContact O-N 3.37Å; Q927-S930 PolarHBondContact O-OG 3.44Å; Y928-S930 PolarHBondContact O-N 3.19Å
931	G	87.3	Confident	89.1	Confident	70 Å²	70	69.2 Å²	69.2	72%	0.722	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.7	-3.4	173.6	0	0	0	0	0	115	Y928 I929	Y928-G931 PolarHBondContact O-N 2.95Å; I929-G931 PolarHBondContact O-N 3.38Å; I929-G931 VanDerWaalsContact O-N 3.16Å
932	L	88.8	Confident	89.1	Confident	16 Å²	16	66 Å²	66	8%	0.084	38%	0.376	C	S	.	.	S	Bend	trans	-86.5	145.4	178.5	-64.1	-177.9	0	0	0	111.5	D909 V913 Y928 I929 P934 A939	D909-L932 HydrophobicContact CB-CD2 3.79Å; D909-L932 WeakPolarHBondContact OD2-CD2 3.29Å; V913-L932 HydrophobicContact CG2-CD1 4.32Å; Y928-L932 HydrophobicContact CD1-CD1 4.29Å; Y928-L932 HydrophobicContact CD1-CD2 4.28Å; Y928-L932 HydrophobicContact CD1-CG 4.33Å; Y928-L932 HydrophobicContact CE1-CD1 4.37Å; Y928-L932 HydrophobicContact CE1-CD2 3.75Å; Y928-L932 HydrophobicContact CE1-CG 4.29Å; I929-L932 WeakPolarHBondContact O-CB 3.24Å; I929-L932 PolarHBondContact O-N 3.07Å; L932-P934 WeakPolarHBondContact O-CD 3.35Å; L932-A939 HydrophobicContact CB-CB 4.18Å; L932-A939 HydrophobicContact CD1-CB 4.24Å
933	T	86.7	Confident	89.1	Confident	106 Å²	106	63.9 Å²	63.9	65%	0.65	37%	0.372	S	S	*	.	P	Polyproline II helix	trans	-61.1	124.5	172.8	-55.4	0	0	0	0	110.1	N935 S936	T933-N935 PolarHBondContact O-N 3Å; T933-S936 WeakPolarHBondContact O-CB 3.45Å; T933-S936 PolarHBondContact O-N 3.18Å; T933-S936 PolarHBondContact O-OG 2.97Å
934	P	81.2	Confident	89.1	Confident	106 Å²	106	64.6 Å²	64.6	69%	0.688	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	133.6	176.4	-27.6	35.9	0	0	0	111.8	L932	L932-P934 WeakPolarHBondContact O-CD 3.35Å
935	N	82.9	Confident	89	Confident	151 Å²	151	64.4 Å²	64.4	81%	0.807	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.3	17.4	-173	-36.9	-82.5	0	0	0	115.9	T933	T933-N935 PolarHBondContact O-N 3Å
936	S	89.5	Confident	88.9	Confident	25 Å²	25	65.6 Å²	65.6	18%	0.175	37%	0.37	C	S	.	.			trans	-68.7	156.1	165.5	75.4	0	0	0	0	111.6	T933 S938 A939 Q940	T933-S936 WeakPolarHBondContact O-CB 3.45Å; T933-S936 PolarHBondContact O-N 3.18Å; T933-S936 PolarHBondContact O-OG 2.97Å; S936-S938 PolarHBondContact O-N 2.96Å; S936-S938 PolarHBondContact OG-OG 3.49Å; S936-A939 PolarHBondContact O-N 2.79Å; S936-A939 VanDerWaalsContact OG-CB 3.29Å; S936-A939 WeakPolarHBondContact OG-CB 3.23Å; S936-A939 PolarHBondContact OG-N 2.89Å; S936-Q940 PolarHBondContact O-N 3.24Å
937	E	89.6	Confident	88.7	Confident	119 Å²	119	68.4 Å²	68.4	56%	0.556	39%	0.386	S	S	*	.	H	α-helix	trans	-56.9	-39.5	172.8	-168.2	-154.9	-178.8	0	0	111.6	N910 Q940 K941	N910-E937 PolarHBondContact ND2-OE2 3.47Å; E937-Q940 PolarHBondContact O-N 3.45Å; E937-K941 WeakPolarHBondContact O-CG 3.45Å; E937-K941 PolarHBondContact O-N 3.05Å; E937-K941 WeakPolarHBondContact OE1-CE 3.16Å; E937-K941 IonicContact OE1-NZ 2.68Å; E937-K941 PolarHBondContact OE1-NZ 3.34Å; E937-K941 IonicContact OE2-NZ 3.75Å
938	S	88.6	Confident	88.4	Confident	8 Å²	8	64.9 Å²	64.9	6%	0.056	37%	0.371	C	S	.	.	H	α-helix	trans	-65	-42.1	176.2	47.3	0	0	0	0	112.3	D909 S936 A942	D909-S938 VanDerWaalsContact CB-CB 3.49Å; D909-S938 WeakPolarHBondContact CB-OG 3.5Å; S936-S938 PolarHBondContact O-N 2.96Å; S936-S938 PolarHBondContact OG-OG 3.49Å; S938-A942 VanDerWaalsContact O-CB 3.28Å; S938-A942 WeakPolarHBondContact O-CB 3.4Å; S938-A942 PolarHBondContact O-N 3.32Å
939	A	89.3	Confident	87.7	Confident	6 Å²	6	66.3 Å²	66.3	5%	0.05	39%	0.387	C	S	.	.	H	α-helix	trans	-66.2	-42	176.5	0	0	0	0	0	111.5	L932 S936 A942 M943	L932-A939 HydrophobicContact CB-CB 4.18Å; L932-A939 HydrophobicContact CD1-CB 4.24Å; S936-A939 PolarHBondContact O-N 2.79Å; S936-A939 VanDerWaalsContact OG-CB 3.29Å; S936-A939 WeakPolarHBondContact OG-CB 3.23Å; S936-A939 PolarHBondContact OG-N 2.89Å; A939-A942 PolarHBondContact O-N 2.98Å; A939-M943 WeakPolarHBondContact O-CG 3.39Å; A939-M943 PolarHBondContact O-N 3.45Å
940	Q	90.9	Very high	87.2	Confident	88 Å²	88	68.9 Å²	68.9	41%	0.411	40%	0.404	S	S	.	.	H	α-helix	trans	-62.5	-50.6	177.1	-170.2	61.4	51.1	0	0	111.4	S936 E937 A942 M943 D944	S936-Q940 PolarHBondContact O-N 3.24Å; E937-Q940 PolarHBondContact O-N 3.45Å; Q940-A942 PolarHBondContact O-N 3.45Å; Q940-M943 PolarHBondContact O-N 3.4Å; Q940-M943 VanDerWaalsContact O-N 3.1Å; Q940-D944 PolarHBondContact NE2-OD1 3.37Å; Q940-D944 PolarHBondContact O-N 2.91Å
941	K	91	Very high	86.7	Confident	68 Å²	68	65.2 Å²	65.2	30%	0.296	38%	0.377	S	S	.	.	H	α-helix	trans	-56.1	-37.2	175.5	-73.1	171.6	-175.6	166.6	0	112.8	N910 V913 E937 A945	N910-K941 VanDerWaalsContact CG-NZ 3.33Å; N910-K941 WeakPolarHBondContact OD1-CD 3.43Å; N910-K941 PolarHBondContact OD1-NZ 3.03Å; V913-K941 HydrophobicContact CG1-CB 4.23Å; E937-K941 WeakPolarHBondContact O-CG 3.45Å; E937-K941 PolarHBondContact O-N 3.05Å; E937-K941 WeakPolarHBondContact OE1-CE 3.16Å; E937-K941 IonicContact OE1-NZ 2.68Å; E937-K941 PolarHBondContact OE1-NZ 3.34Å; E937-K941 IonicContact OE2-NZ 3.75Å; K941-A945 VanDerWaalsContact O-CB 3.26Å; K941-A945 WeakPolarHBondContact O-CB 3.38Å; K941-A945 PolarHBondContact O-N 2.94Å
942	A	90.4	Very high	86.2	Confident	0 Å²	0	63.3 Å²	63.3	0%	0	35%	0.349	C	S	.	.	H	α-helix	trans	-70.5	-38.1	179	0	0	0	0	0	112.2	V913 L925 I929 S938 A939 Q940 L946	V913-A942 HydrophobicContact CG1-CB 3.83Å; V913-A942 HydrophobicContact CG2-CB 3.91Å; L925-A942 HydrophobicContact CD1-CB 3.95Å; I929-A942 HydrophobicContact CD1-CB 3.68Å; I929-A942 HydrophobicContact CG1-CB 3.56Å; S938-A942 VanDerWaalsContact O-CB 3.28Å; S938-A942 WeakPolarHBondContact O-CB 3.4Å; S938-A942 PolarHBondContact O-N 3.32Å; A939-A942 PolarHBondContact O-N 2.98Å; Q940-A942 PolarHBondContact O-N 3.45Å; A942-L946 VanDerWaalsContact O-CG 3.27Å; A942-L946 WeakPolarHBondContact O-CG 3.38Å; A942-L946 PolarHBondContact O-N 2.86Å
943	M	89.9	Confident	85.2	Confident	73 Å²	73	69.9 Å²	69.9	36%	0.36	38%	0.378	S	S	.	.	H	α-helix	trans	-67.6	-48.9	171.7	-67.7	-177.2	-62	0	0	111.4	A939 Q940 A945 L946 D947	A939-M943 WeakPolarHBondContact O-CG 3.39Å; A939-M943 PolarHBondContact O-N 3.45Å; Q940-M943 PolarHBondContact O-N 3.4Å; Q940-M943 VanDerWaalsContact O-N 3.1Å; M943-A945 PolarHBondContact O-N 3.5Å; M943-L946 PolarHBondContact O-N 3.44Å; M943-D947 PolarHBondContact O-N 3.34Å
944	D	90.2	Very high	83.6	Confident	85 Å²	85	69.6 Å²	69.6	46%	0.455	37%	0.371	S	S	.	.	H	α-helix	trans	-55.1	-38.8	177.3	-62.1	-20.9	0	0	0	111.9	Q940 N948	Q940-D944 PolarHBondContact NE2-OD1 3.37Å; Q940-D944 PolarHBondContact O-N 2.91Å; D944-N948 WeakPolarHBondContact O-CB 3.35Å; D944-N948 PolarHBondContact O-N 2.87Å
945	A	89.7	Confident	81.8	Confident	15 Å²	15	74.6 Å²	74.6	12%	0.124	40%	0.4	C	S	.	.	H	α-helix	trans	-70.6	-34.9	177	0	0	0	0	0	113.3	V917 K941 M943 T951 F952	V917-A945 HydrophobicContact CG1-CB 4.49Å; V917-A945 HydrophobicContact CG2-CB 3.58Å; K941-A945 VanDerWaalsContact O-CB 3.26Å; K941-A945 WeakPolarHBondContact O-CB 3.38Å; K941-A945 PolarHBondContact O-N 2.94Å; M943-A945 PolarHBondContact O-N 3.5Å; A945-T951 HydrophobicContact CB-CG2 4.43Å; A945-T951 VanDerWaalsContact O-CB 3.22Å; A945-T951 WeakPolarHBondContact O-CB 3.26Å; A945-T951 PolarHBondContact O-OG1 3.42Å; A945-F952 WeakPolarHBondContact O-CE2 3.33Å
946	L	88.3	Confident	81.7	Confident	25 Å²	25	70.8 Å²	70.8	13%	0.131	38%	0.379	C	S	.	.	H	α-helix	trans	-75.2	-37.2	177.6	-76.3	169.7	0	0	0	113	R922 L925 L926 I929 A942 M943 F952	R922-L946 HydrophobicContact CG-CD2 3.66Å; L925-L946 HydrophobicContact CD2-CD1 4.48Å; L925-L946 HydrophobicContact CD2-CD2 4.1Å; L925-L946 HydrophobicContact CD2-CG 3.96Å; L926-L946 HydrophobicContact CD2-CD1 3.61Å; L926-L946 HydrophobicContact CD2-CD2 4.4Å; L926-L946 HydrophobicContact CG-CD1 4.18Å; L926-L946 HydrophobicContact CG-CD2 4.27Å; I929-L946 HydrophobicContact CD1-CD1 3.34Å; A942-L946 VanDerWaalsContact O-CG 3.27Å; A942-L946 WeakPolarHBondContact O-CG 3.38Å; A942-L946 PolarHBondContact O-N 2.86Å; M943-L946 PolarHBondContact O-N 3.44Å; L946-F952 HydrophobicContact CD2-CD2 4.4Å; L946-F952 HydrophobicContact CD2-CE2 3.87Å; L946-F952 HydrophobicContact CD2-CZ 4.34Å; L946-F952 HydrophobicContact CG-CE2 4.41Å
947	D	87.9	Confident	81.3	Confident	136 Å²	136	73.2 Å²	73.2	73%	0.727	39%	0.39	S	S	*	.	H	α-helix	trans	-77.1	-25.5	179.3	-75.4	-15.2	0	0	0	112.3	M943 P949	M943-D947 PolarHBondContact O-N 3.34Å; D947-P949 VanDerWaalsContact O-CD 3.27Å; D947-P949 WeakPolarHBondContact O-CD 3.49Å
948	N	85.6	Confident	80.8	Confident	74 Å²	74	70.7 Å²	70.7	40%	0.396	38%	0.381	S	S	.	.			trans	-72.8	112	172.2	177.5	2.2	0	0	0	110.9	D944 V950 T951	D944-N948 WeakPolarHBondContact O-CB 3.35Å; D944-N948 PolarHBondContact O-N 2.87Å; N948-V950 PolarHBondContact O-N 2.99Å; N948-V950 WeakPolarHBondContact OD1-CB 3.33Å; N948-V950 PolarHBondContact OD1-N 3.01Å; N948-T951 WeakPolarHBondContact CB-OG1 3.18Å; N948-T951 PolarHBondContact ND2-OG1 3.16Å; N948-T951 WeakPolarHBondContact O-CB 3.32Å; N948-T951 PolarHBondContact O-N 3.32Å; N948-T951 PolarHBondContact O-OG1 2.99Å; N948-T951 VanDerWaalsContact O-OG1 3.13Å
949	P	75.6	Confident	80.4	Confident	81 Å²	81	74.4 Å²	74.4	53%	0.526	40%	0.4	S	S	.	.	H	α-helix	trans	-65.5	-27.7	-175.8	27.3	-35.2	0	0	0	112.8	D947 T951 F953	D947-P949 VanDerWaalsContact O-CD 3.27Å; D947-P949 WeakPolarHBondContact O-CD 3.49Å; P949-T951 PolarHBondContact O-N 3.45Å; P949-F953 WeakPolarHBondContact O-CB 3.2Å; P949-F953 PolarHBondContact O-N 3.48Å
950	V	80.2	Confident	79.8	Confident	91 Å²	91	78.6 Å²	78.6	55%	0.552	42%	0.422	S	S	*	.	H	α-helix	trans	-67.2	-26.7	-176.8	-171.6	0	0	0	0	111.7	N948 L954	N948-V950 PolarHBondContact O-N 2.99Å; N948-V950 WeakPolarHBondContact OD1-CB 3.33Å; N948-V950 PolarHBondContact OD1-N 3.01Å; V950-L954 HydrophobicContact CG1-CD1 3.8Å
951	T	77.1	Confident	79.1	Confident	26 Å²	26	78 Å²	78	16%	0.16	42%	0.423	C	S	.	.	H	α-helix	trans	-63.6	-43	-177.8	-43.4	0	0	0	0	112.5	V917 A945 N948 P949	V917-T951 HydrophobicContact CG1-CG2 3.69Å; A945-T951 HydrophobicContact CB-CG2 4.43Å; A945-T951 VanDerWaalsContact O-CB 3.22Å; A945-T951 WeakPolarHBondContact O-CB 3.26Å; A945-T951 PolarHBondContact O-OG1 3.42Å; N948-T951 WeakPolarHBondContact CB-OG1 3.18Å; N948-T951 PolarHBondContact ND2-OG1 3.16Å; N948-T951 WeakPolarHBondContact O-CB 3.32Å; N948-T951 PolarHBondContact O-N 3.32Å; N948-T951 PolarHBondContact O-OG1 2.99Å; N948-T951 VanDerWaalsContact O-OG1 3.13Å; P949-T951 PolarHBondContact O-N 3.45Å
952	F	77.9	Confident	78.2	Confident	30 Å²	30	78.7 Å²	78.7	13%	0.132	43%	0.432	C	S	.	.	H	α-helix	trans	-121.1	-15.7	-168.6	-65.8	-75.2	0	0	0	114.8	V917 R920 R922 L925 A945 L946	V917-F952 HydrophobicContact CG2-CZ 4.41Å; R920-F952 HydrophobicContact CB-CD1 4.3Å; R922-F952 HydrophobicContact CB-CD1 3.8Å; R922-F952 HydrophobicContact CB-CE1 3.86Å; R922-F952 HydrophobicContact CB-CG 4.35Å; R922-F952 HydrophobicContact CB-CZ 4.46Å; R922-F952 HydrophobicContact CG-CD1 4.4Å; R922-F952 HydrophobicContact CG-CE1 4.5Å; R922-F952 HydrophobicContact CG-CG 4.49Å; L925-F952 HydrophobicContact CD2-CE2 4.24Å; L925-F952 HydrophobicContact CD2-CZ 3.74Å; A945-F952 WeakPolarHBondContact O-CE2 3.33Å; L946-F952 HydrophobicContact CD2-CD2 4.4Å; L946-F952 HydrophobicContact CD2-CE2 3.87Å; L946-F952 HydrophobicContact CD2-CZ 4.34Å; L946-F952 HydrophobicContact CG-CE2 4.41Å
953	F	67.1	Low	77.3	Confident	155 Å²	155	84.8 Å²	84.8	68%	0.68	47%	0.465	S	S	*	.			trans	-107.7	34.9	-175.4	-65.4	-87.4	0	0	0	114.6	P949	P949-F953 WeakPolarHBondContact O-CB 3.2Å; P949-F953 PolarHBondContact O-N 3.48Å
954	L	53.8	Low	76.3	Confident	99 Å²	99	85.8 Å²	85.8	52%	0.518	47%	0.474	S	S	.	.			trans	-114	94.1	169.4	-78.3	178	0	0	0	111.6	R920 V950	R920-L954 PolarHBondContact NH1-O 3.03Å; V950-L954 HydrophobicContact CG1-CD1 3.8Å
955	V	41.8	Very low	75	Confident	212 Å²	212	85.8 Å²	85.8	100%	1.285	48%	0.475	S	S	*	.			trans	-112.2	0	160.3	177.2	0	0	0	0	107.2

Retrieved 955 of 955 residues in 454.4 ms (Link to these results)

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