A0A3Q0KSR7_SCHMA Loading...

SANT domain-containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KSR7, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,202 aa.

						>A0A3Q0KSR7_SCHMA|A0A3Q0KSR7
MKTRSAEMEAPNIAAIVKARHHARVLGPPSGHSLGNTPNQSISPGIYESSESGCNLNNFYSASGTSGQILCDDVKISVDDKPHKSRSDNAPRLLRGTWSADDRRLFFQAVRMYGRNFSEITRFIRSRGHRTSIDHQTGPSSGNIELTLNSLHPGNNFVSSNSLSSALIPSNISAPCPSNISQPNVGMSTPYTSSSDLNTPCGGRTREQVRFFYQQTWHKVRRYTKFPEEVPQHVREVYAIVNYSVLRTRIKKPLDHRLGEKLNELVHCGTTVIKHNGRRFLLRTPVCPALKQLNNISAPTHEFLLPEDVWIELVPRTQTDAWRVIEAEQNPRLRLRVDINRQLSDVIFLVENKWQLAAERMRTLLGFPAVHESPVPSVMLNLCYRQAIDGAIRIQEVARIRSGDIGLRAYLDRMDTKLPKSRMQSNVCPTEKQNAVHDDPVESPNLVNSNLSTNLTSSSLRASDLRNSEITNSLPITTSTSNAELDLRDLGKQLSIGVTREMAREIKLVTIYLALGCPDRIRFEYQFFCTKDKGSQKQSSSSYSDLLICPPLDPDGDGISNGLRRLLHLNASDYLLHRDWVSRHSIRSNTPVSTSCHSSQAILSVNNPTVATVTATQSCTSTLLPKTLTGNHFSQVSELPVMVTTQQPSIVTTSISAKLPTVMMYSQPNTIQVLINGQPSIFQLNPTFSSPNPVISSLLTTNSLMRPPIASVQSPKLVLLQQPVGQKVQVPIVERQLDHERLVTSTVAISQGSYIPLLPKQSTVPIQVSVKTSTPLTSTFVSSSSIHSTSTSTVESENNSPVTSSLESLKAFNARRRTSIISQVNKRLTENSILTKELQSKPSTITPISNNLPPSYITSANPCTTKSSNSSIQLLQAIDNQTLTTIKGDEASVNNIHSKSITLSTPSNSNNLWSSIKVSNNEPIITTSIVFNDHLPQVHSISSLLSSPNLSSVQSNNVMSFISLSKNSSNTDVNMDDLMLVSTETNQCSLSSSFSNDTLASLLNTLCPRYPLSSTHDNQNILTESSTRLTDSTPSPLIGLSTPDLHKTTFSTPTNNDVHVSLKIEENAKKSFDFRTIDSVCSYPPGSPSIGDISFTDSMAAAVMDVHHMELDHSDGEQSTDVQSESLNLISSNLIIQPDIYPIRPSYESLVEHQDIKTKGISTSEYNCITNVEVFLRMNTPQSSRNSVDLNSTLKTSTTLSN
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.4	Very low	41	Very low	250 Å²	250	166 Å²	166	100%	1.232	88%	0.881	S	S	*	*				0	143.1	0	-73	172.8	165.4	0	0	108.4
2	K	30	Very low	42.1	Very low	208 Å²	208	161.8 Å²	161.8	90%	0.904	86%	0.859	S	S	*	*			trans	-149.3	92.6	-162.7	-167.9	179.5	-173.4	179.5	0	112.6
3	T	37.5	Very low	42.8	Very low	138 Å²	138	159.4 Å²	159.4	85%	0.847	84%	0.844	S	S	*	*			trans	-150.9	91.1	169.1	30.3	0	0	0	0	107.1
4	R	37.1	Very low	43	Very low	247 Å²	247	152.6 Å²	152.6	93%	0.932	82%	0.822	S	S	*	*				71.9	84.1	80.1	-160.4	179.4	-152.2	-141.7	5	111.9
5	S	38.6	Very low	43.5	Very low	119 Å²	119	146.5 Å²	146.5	83%	0.832	80%	0.801	S	S	*	*			trans	-62.8	152.8	158.6	-49.7	0	0	0	0	110
6	A	43.8	Very low	44.1	Very low	97 Å²	97	143.2 Å²	143.2	80%	0.802	78%	0.781	S	S	*	*			trans	-121.3	130.2	159.5	0	0	0	0	0	106.9
7	E	40.4	Very low	44.6	Very low	203 Å²	203	140.3 Å²	140.3	95%	0.949	77%	0.768	S	S	*	*			trans	-75.7	146.1	168.3	-80.1	166	125.1	0	0	109.4
8	M	45.2	Very low	44.8	Very low	180 Å²	180	141.8 Å²	141.8	89%	0.887	77%	0.766	S	S	*	*			trans	-127.8	110.7	178.5	-170.9	178.8	76.5	0	0	106.8
9	E	42.9	Very low	44.9	Very low	188 Å²	188	138 Å²	138	88%	0.879	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-65.6	147.7	-171.1	-159.6	175	158.2	0	0	112.1
10	A	48.5	Very low	45.2	Very low	86 Å²	86	140.6 Å²	140.6	71%	0.711	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-88.3	133.3	-175.9	0	0	0	0	0	111.3	N12	A10-N12 PolarHBondContact O-N 3.21Å
11	P	52.5	Low	45.2	Very low	110 Å²	110	140.5 Å²	140.5	71%	0.714	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-68.8	127.7	-175.8	27	-34.4	0	0	0	112.1	I13	P11-I13 PolarHBondContact O-N 3.32Å
12	N	54.9	Low	45.9	Very low	115 Å²	115	135.8 Å²	135.8	62%	0.615	72%	0.723	S	S	*	*			trans	-66.2	112.9	-177.3	-174.1	-21	0	0	0	112.1	A10 A14 A15	A10-N12 PolarHBondContact O-N 3.21Å; N12-A14 VanDerWaalsContact C-N 3.27Å; N12-A14 PolarHBondContact O-N 2.94Å; N12-A14 WeakPolarHBondContact OD1-CB 3.13Å; N12-A14 PolarHBondContact OD1-N 3.37Å; N12-A15 PolarHBondContact O-N 2.84Å
13	I	51.3	Low	46.7	Very low	131 Å²	131	130.2 Å²	130.2	67%	0.672	72%	0.716	S	S	*	*	H	α-helix	trans	-64	-30.4	-175.9	-60.6	174.6	0	0	0	112.1	P11 A15 I16 V17	P11-I13 PolarHBondContact O-N 3.32Å; I13-A15 VanDerWaalsContact C-N 3.33Å; I13-A15 PolarHBondContact O-N 3.47Å; I13-I16 PolarHBondContact O-N 3.21Å; I13-V17 PolarHBondContact O-N 2.82Å
14	A	44.9	Very low	47.1	Very low	65 Å²	65	134.2 Å²	134.2	54%	0.537	72%	0.716	S	S	.	*	H	α-helix	trans	-65.6	-34.7	-178.6	0	0	0	0	0	112.6	N12 I16 V17 K18	N12-A14 VanDerWaalsContact C-N 3.27Å; N12-A14 PolarHBondContact O-N 2.94Å; N12-A14 WeakPolarHBondContact OD1-CB 3.13Å; N12-A14 PolarHBondContact OD1-N 3.37Å; A14-I16 VanDerWaalsContact C-N 3.33Å; A14-I16 PolarHBondContact O-N 2.81Å; A14-V17 PolarHBondContact O-N 3.11Å; A14-K18 PolarHBondContact O-N 3.13Å
15	A	50.2	Low	47.4	Very low	61 Å²	61	127.2 Å²	127.2	50%	0.504	70%	0.7	S	S	.	*	H	α-helix	trans	-62.5	-40.6	176.2	0	0	0	0	0	111.8	N12 I13 V17 K18 A19	N12-A15 PolarHBondContact O-N 2.84Å; I13-A15 VanDerWaalsContact C-N 3.33Å; I13-A15 PolarHBondContact O-N 3.47Å; A15-V17 VanDerWaalsContact C-N 3.28Å; A15-V17 PolarHBondContact O-N 3.32Å; A15-K18 PolarHBondContact O-N 3.49Å; A15-A19 WeakPolarHBondContact O-CB 3.33Å; A15-A19 PolarHBondContact O-N 3.23Å
16	I	54	Low	47.3	Very low	93 Å²	93	129.1 Å²	129.1	48%	0.477	70%	0.7	S	S	.	*	H	α-helix	trans	-66	-31.3	179.4	-59.6	172.6	0	0	0	111.5	I13 A14	I13-I16 PolarHBondContact O-N 3.21Å; A14-I16 VanDerWaalsContact C-N 3.33Å; A14-I16 PolarHBondContact O-N 2.81Å
17	V	51.3	Low	47	Very low	94 Å²	94	127.7 Å²	127.7	57%	0.57	70%	0.695	S	S	*	*	H	α-helix	trans	-79.3	-46.7	176	179.4	0	0	0	0	111.3	I13 A14 A15 A19 R20 H21	I13-V17 PolarHBondContact O-N 2.82Å; A14-V17 PolarHBondContact O-N 3.11Å; A15-V17 VanDerWaalsContact C-N 3.28Å; A15-V17 PolarHBondContact O-N 3.32Å; V17-A19 PolarHBondContact O-N 3.29Å; V17-R20 PolarHBondContact O-N 3.05Å; V17-R20 VanDerWaalsContact O-N 3.13Å; V17-H21 PolarHBondContact O-N 3.21Å
18	K	49.5	Very low	47.3	Very low	168 Å²	168	124 Å²	124	73%	0.73	69%	0.689	S	S	*	*	H	α-helix	trans	-64.5	-40.1	-177.3	-158.9	170.2	-175.3	178.4	0	112	A14 A15 R20 H21 H22	A14-K18 PolarHBondContact O-N 3.13Å; A15-K18 PolarHBondContact O-N 3.49Å; K18-R20 VanDerWaalsContact C-N 3.28Å; K18-R20 PolarHBondContact O-N 3Å; K18-H21 PolarHBondContact O-N 3.04Å; K18-H21 VanDerWaalsContact O-N 3.14Å; K18-H22 PolarHBondContact O-N 3.28Å
19	A	47.1	Very low	47	Very low	69 Å²	69	121.6 Å²	121.6	57%	0.57	69%	0.687	S	S	*	*	H	α-helix	trans	-60.1	-34.6	174	0	0	0	0	0	113.3	A15 V17 H21	A15-A19 WeakPolarHBondContact O-CB 3.33Å; A15-A19 PolarHBondContact O-N 3.23Å; V17-A19 PolarHBondContact O-N 3.29Å; A19-H21 VanDerWaalsContact C-N 3.35Å
20	R	50.5	Low	46.6	Very low	190 Å²	190	118 Å²	118	72%	0.717	68%	0.682	S	S	*	*	H	α-helix	trans	-74.9	-19.3	177	-86	179.5	163.2	161.6	-3	114.5	V17 K18	V17-R20 PolarHBondContact O-N 3.05Å; V17-R20 VanDerWaalsContact O-N 3.13Å; K18-R20 VanDerWaalsContact C-N 3.28Å; K18-R20 PolarHBondContact O-N 3Å
21	H	44	Very low	46.1	Very low	138 Å²	138	117.8 Å²	117.8	64%	0.639	69%	0.688	S	S	*	*	H	α-helix	trans	-90.6	-34.3	179.7	-153.2	-55.7	0	0	0	112.6	V17 K18 A19	V17-H21 PolarHBondContact O-N 3.21Å; K18-H21 PolarHBondContact O-N 3.04Å; K18-H21 VanDerWaalsContact O-N 3.14Å; A19-H21 VanDerWaalsContact C-N 3.35Å
22	H	50.3	Low	45.2	Very low	151 Å²	151	121.3 Å²	121.3	70%	0.699	69%	0.694	S	S	*	*	H	α-helix	trans	-72	-35.9	-179.4	-135.8	-102.9	0	0	0	112.5	K18 R24 V25	K18-H22 PolarHBondContact O-N 3.28Å; H22-R24 PolarHBondContact O-N 3.42Å; H22-V25 PolarHBondContact O-N 3.31Å
23	A	45.2	Very low	44.2	Very low	92 Å²	92	121.3 Å²	121.3	76%	0.76	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.8	13.9	178.1	0	0	0	0	0	115.2
24	R	45.9	Very low	43.4	Very low	222 Å²	222	123 Å²	123	84%	0.838	71%	0.713	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120.7	-5.2	179.2	-76.2	-176.6	170.1	-177	-3.8	114.7	H22	H22-R24 PolarHBondContact O-N 3.42Å
25	V	44	Very low	42.8	Very low	100 Å²	100	123.6 Å²	123.6	61%	0.606	73%	0.725	S	S	*	*	S	Bend	trans	-108.1	-13.8	-163.5	-179.2	0	0	0	0	113.7	H22	H22-V25 PolarHBondContact O-N 3.31Å
26	L	37.1	Very low	42	Very low	159 Å²	159	127.7 Å²	127.7	83%	0.832	74%	0.738	S	S	*	*			trans	-124.3	98.3	178.6	-66.4	175	0	0	0	111.4
27	G	37.6	Very low	41	Very low	67 Å²	67	129.4 Å²	129.4	69%	0.691	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-97.4	147.3	162.4	0	0	0	0	0	110.6
28	P	45.3	Very low	40.3	Very low	125 Å²	125	129.9 Å²	129.9	81%	0.812	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-74.2	148.4	-174.6	30.1	-35.4	0	0	0	112.9
29	P	39.4	Very low	39.4	Very low	130 Å²	130	128.4 Å²	128.4	84%	0.844	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-77.7	139.4	179.8	31.5	-34.8	0	0	0	112.6
30	S	34.6	Very low	38.8	Very low	113 Å²	113	133.4 Å²	133.4	79%	0.79	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-85.6	116.8	176.2	54.5	0	0	0	0	112.3
31	G	38	Very low	37.8	Very low	80 Å²	80	128.4 Å²	128.4	83%	0.825	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-103	127.1	169.2	0	0	0	0	0	112
32	H	34.2	Very low	37.3	Very low	184 Å²	184	129.4 Å²	129.4	85%	0.852	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-90.5	144	175	-69.3	-102.4	0	0	0	111.9
33	S	34.1	Very low	36.4	Very low	116 Å²	116	127.3 Å²	127.3	81%	0.811	78%	0.775	S	S	*	*				-163.4	168.1	125.9	-153.1	0	0	0	0	113
34	L	34.3	Very low	36.2	Very low	167 Å²	167	129.2 Å²	129.2	87%	0.874	78%	0.78	S	S	*	*			trans	-75.1	166.2	-167	-69.2	58.4	0	0	0	114.1
35	G	32.3	Very low	35.7	Very low	76 Å²	76	121.8 Å²	121.8	78%	0.784	77%	0.772	S	S	*	*			trans	-170.7	-2.3	176.9	0	0	0	0	0	123.7
36	N	33.2	Very low	35.4	Very low	147 Å²	147	124.4 Å²	124.4	79%	0.786	78%	0.781	S	S	*	*			trans	40.3	106.1	164.2	-90.1	22.4	0	0	0	123
37	T	33.4	Very low	35.4	Very low	129 Å²	129	126.3 Å²	126.3	79%	0.791	78%	0.779	S	S	*	*				70.2	158.2	127.5	52.4	0	0	0	0	122.9
38	P	36.8	Very low	35.3	Very low	104 Å²	104	130.3 Å²	130.3	68%	0.675	78%	0.779	S	S	*	*			trans	-121.5	173.2	-159.6	43.6	-32.1	0	0	0	116.2
39	N	30.6	Very low	34.9	Very low	137 Å²	137	128.5 Å²	128.5	73%	0.733	77%	0.769	S	S	*	*				168.2	162.5	128.6	-96.8	-50.9	0	0	0	115.5
40	Q	33.8	Very low	34.8	Very low	175 Å²	175	126.9 Å²	126.9	82%	0.818	76%	0.761	S	S	*	*			trans	66.8	150.7	156.2	-74.5	172	87.6	0	0	119.3
41	S	29	Very low	34.8	Very low	84 Å²	84	129.8 Å²	129.8	59%	0.587	76%	0.762	S	S	*	*			cis	-175.2	179.7	-19.6	54.1	0	0	0	0	110.6
42	I	34.9	Very low	34.7	Very low	159 Å²	159	130.4 Å²	130.4	82%	0.815	75%	0.754	S	S	*	*			trans	85.3	126.4	158.8	-61.2	157.9	0	0	0	119.2
43	S	30.8	Very low	34.5	Very low	108 Å²	108	125.3 Å²	125.3	76%	0.755	75%	0.751	S	S	*	*			trans	-113.4	-155	170.6	-42.8	0	0	0	0	108.7
44	P	40.3	Very low	34.3	Very low	132 Å²	132	125.2 Å²	125.2	86%	0.857	75%	0.749	S	S	*	*			cis	-133.8	-168.9	-16.9	41.8	-24.2	0	0	0	113.7
45	G	35.6	Very low	34.1	Very low	65 Å²	65	124.2 Å²	124.2	67%	0.67	75%	0.745	S	S	*	*			trans	168.7	107.6	155.8	0	0	0	0	0	121.3
46	I	37.3	Very low	34.1	Very low	156 Å²	156	127.2 Å²	127.2	80%	0.8	74%	0.742	S	S	*	*			trans	83.1	111.7	130.6	-66.3	168.3	0	0	0	121.8
47	Y	37.7	Very low	34	Very low	199 Å²	199	126 Å²	126	78%	0.78	74%	0.736	S	S	*	*			trans	66.2	139.5	145.8	-79.5	-131.1	0	0	0	118.8
48	E	36.2	Very low	33.8	Very low	151 Å²	151	125.2 Å²	125.2	71%	0.706	73%	0.726	S	S	*	*			cis	-167.6	175.6	-3.7	-128.2	-162.7	125.8	0	0	108.6
49	S	36.3	Very low	33.4	Very low	86 Å²	86	127.4 Å²	127.4	60%	0.601	73%	0.726	S	S	*	*			cis	-157.6	-153.1	-2	-155.5	0	0	0	0	112.7
50	S	36.9	Very low	33.3	Very low	96 Å²	96	129.7 Å²	129.7	67%	0.671	73%	0.725	S	S	*	*			trans	-78.6	-176.6	179.7	57.3	0	0	0	0	115.8
51	E	35	Very low	33.1	Very low	174 Å²	174	126.3 Å²	126.3	81%	0.813	72%	0.721	S	S	*	*			cis	-174.6	177.6	-23.9	-100.8	-158.5	-107.9	0	0	107.7
52	S	35.7	Very low	33.2	Very low	94 Å²	94	126 Å²	126	66%	0.657	72%	0.723	S	S	*	*			cis	-168	165.8	-36.5	63.7	0	0	0	0	110.8
53	G	30.5	Very low	33	Very low	76 Å²	76	124.6 Å²	124.6	78%	0.784	73%	0.728	S	S	*	*			trans	71.4	168.8	169.9	0	0	0	0	0	117.9
54	C	29.6	Very low	33.1	Very low	115 Å²	115	123.3 Å²	123.3	78%	0.777	73%	0.731	S	S	*	*			cis	-160.8	150.4	-23.5	61.9	0	0	0	0	112.8
55	N	30.4	Very low	32.6	Very low	146 Å²	146	123.8 Å²	123.8	78%	0.781	73%	0.732	S	S	*	*			trans	61.4	150.1	143.2	-82.9	-23.3	0	0	0	126.3
56	L	32.9	Very low	32.5	Very low	139 Å²	139	126.6 Å²	126.6	73%	0.728	74%	0.742	S	S	*	*			trans	89.7	103.1	143.8	-105.2	72.7	0	0	0	123
57	N	29.7	Very low	32.4	Very low	121 Å²	121	122.3 Å²	122.3	65%	0.647	74%	0.736	S	S	*	*				66.5	120.7	117.1	-74	8.9	0	0	0	124.2
58	N	29.1	Very low	32	Very low	112 Å²	112	121.4 Å²	121.4	60%	0.599	74%	0.739	S	S	*	*				91.6	124.8	116.5	-74.6	-7.6	0	0	0	124.2
59	F	28.8	Very low	31.7	Very low	150 Å²	150	120.6 Å²	120.6	66%	0.658	74%	0.738	S	S	*	*				88.6	123.4	124.6	-77.6	-40.8	0	0	0	123.8
60	Y	29.3	Very low	31.4	Very low	186 Å²	186	123.5 Å²	123.5	73%	0.729	75%	0.746	S	S	*	*			trans	76.2	118.9	132.1	-78.4	-50.1	0	0	0	122.7
61	S	29.2	Very low	31.2	Very low	104 Å²	104	123.5 Å²	123.5	73%	0.727	75%	0.745	S	S	*	*				78.9	156.7	125	-66.2	0	0	0	0	120.5
62	A	30.6	Very low	31.1	Very low	77 Å²	77	121.9 Å²	121.9	64%	0.636	74%	0.742	S	S	*	*			cis	-173.2	161.9	-28.4	0	0	0	0	0	109.6
63	S	30.7	Very low	30.9	Very low	130 Å²	130	124.6 Å²	124.6	91%	0.909	75%	0.749	S	S	*	*			trans	69.1	151	158.3	-54.3	0	0	0	0	118
64	G	33.7	Very low	31.4	Very low	80 Å²	80	127.6 Å²	127.6	83%	0.825	75%	0.751	S	S	*	*			trans	157.9	46.4	178.2	0	0	0	0	0	117.3
65	T	30.5	Very low	31.6	Very low	142 Å²	142	131.6 Å²	131.6	87%	0.871	76%	0.756	S	S	*	*			trans	-44.8	142.9	177.5	47.8	0	0	0	0	117.9
66	S	33.2	Very low	32	Very low	125 Å²	125	131.6 Å²	131.6	87%	0.874	75%	0.754	S	S	*	*				147.6	162.9	120.9	-162	0	0	0	0	115.1
67	G	33.4	Very low	31.9	Very low	66 Å²	66	130.1 Å²	130.1	68%	0.68	76%	0.755	S	S	*	*			trans	70.7	117.2	166.4	0	0	0	0	0	116.4
68	Q	30.8	Very low	32.5	Very low	179 Å²	179	130.3 Å²	130.3	84%	0.836	76%	0.761	S	S	*	*			cis	72.9	121.9	38.8	-76.6	-156.6	-2	0	0	118.3
69	I	30.3	Very low	32.9	Very low	134 Å²	134	132.3 Å²	132.3	69%	0.687	77%	0.771	S	S	*	*			trans	80.9	98.4	138.4	-68	175.4	0	0	0	119.7
70	L	29.8	Very low	33.6	Very low	148 Å²	148	132.9 Å²	132.9	78%	0.775	78%	0.781	S	S	*	*				76.2	134.3	110.8	-155.6	105	0	0	0	121.7
71	C	31.1	Very low	33.9	Very low	95 Å²	95	132.9 Å²	132.9	64%	0.642	79%	0.785	S	S	*	*			trans	69	154.3	156.9	-80	0	0	0	0	118.1
72	D	34	Very low	34.3	Very low	141 Å²	141	132.4 Å²	132.4	75%	0.754	78%	0.78	S	S	*	*			cis	-146.3	177.1	3.6	-113.7	-27.9	0	0	0	113
73	D	32.4	Very low	34.4	Very low	151 Å²	151	137.5 Å²	137.5	81%	0.807	79%	0.79	S	S	*	*			trans	-62.8	142.7	-177.7	-78.7	-69.7	0	0	0	116.5
74	V	40.7	Very low	34.7	Very low	138 Å²	138	141.5 Å²	141.5	84%	0.836	79%	0.791	S	S	*	*			trans	-136.4	139.2	151.8	-179.3	0	0	0	0	110.1
75	K	32.6	Very low	34.6	Very low	199 Å²	199	142.6 Å²	142.6	87%	0.865	79%	0.786	S	S	*	*			trans	-129.5	103.8	-163.1	168.4	-141.6	171.8	-173	0	112.6
76	I	38.4	Very low	34.7	Very low	146 Å²	146	146.3 Å²	146.3	75%	0.749	78%	0.784	S	S	*	*			trans	-147.6	114.4	169.8	-31.4	179.4	0	0	0	105.8
77	S	32.6	Very low	34.8	Very low	108 Å²	108	145.8 Å²	145.8	76%	0.755	78%	0.78	S	S	*	*				52	127.4	77.8	-124.5	0	0	0	0	112
78	V	42.4	Very low	34.9	Very low	125 Å²	125	148.1 Å²	148.1	76%	0.758	78%	0.777	S	S	*	*			cis	-144.2	173.5	26	169.6	0	0	0	0	109.8
79	D	36.2	Very low	34.8	Very low	154 Å²	154	147.4 Å²	147.4	82%	0.824	78%	0.779	S	S	*	*			trans	-43.4	142.3	170.2	-66	-107	0	0	0	116
80	D	43.1	Very low	34.9	Very low	162 Å²	162	145.4 Å²	145.4	87%	0.866	78%	0.783	S	S	*	*				-160.7	175.8	113.4	-134.5	-36.6	0	0	0	113.6
81	K	36.1	Very low	35	Very low	186 Å²	186	143.2 Å²	143.2	81%	0.809	78%	0.777	S	S	*	*			trans	-131.6	173.7	-175.7	-95.7	-175.3	179.3	175.4	0	111.1
82	P	38.6	Very low	35.2	Very low	95 Å²	95	150.8 Å²	150.8	62%	0.617	79%	0.792	S	S	*	*			cis	-135	-175.8	-34.6	35.1	-16.2	0	0	0	113
83	H	33	Very low	35.1	Very low	183 Å²	183	150.9 Å²	150.9	85%	0.847	79%	0.792	S	S	*	*			trans	59.4	105.1	161.1	-57	-60.5	0	0	0	120.5
84	K	36.3	Very low	35.4	Very low	215 Å²	215	151.5 Å²	151.5	94%	0.935	80%	0.795	S	S	*	*				-149.8	168.1	126.6	-139.3	161.1	-175.4	173.2	0	112.5
85	S	31.4	Very low	35.7	Very low	102 Å²	102	152.4 Å²	152.4	71%	0.713	78%	0.783	S	S	*	*			trans	-97.7	155.1	-155.9	55.4	0	0	0	0	116.2
86	R	31.7	Very low	36.8	Very low	221 Å²	221	145.5 Å²	145.5	83%	0.834	77%	0.768	S	S	*	*			trans	77.4	96.8	138.6	-168.9	-176.8	-172.7	169.4	3.2	119.9	D88	R86-D88 WeakPolarHBondContact CG-OD2 3.48Å; R86-D88 IonicContact NE-OD2 2.75Å
87	S	37	Very low	38.6	Very low	114 Å²	114	144.6 Å²	144.6	80%	0.797	77%	0.769	S	S	*	*				-153.1	126.8	128.4	50.7	0	0	0	0	106.7
88	D	33.8	Very low	41.2	Very low	115 Å²	115	141.1 Å²	141.1	62%	0.615	74%	0.74	S	S	*	*				78.5	110.3	53.1	-68.6	-51.4	0	0	0	113.8	R86	R86-D88 WeakPolarHBondContact CG-OD2 3.48Å; R86-D88 IonicContact NE-OD2 2.75Å
89	N	30.2	Very low	43.4	Very low	164 Å²	164	137.7 Å²	137.7	88%	0.877	72%	0.721	S	S	*	*			trans	59.2	86.9	160.8	-61.3	-38.6	0	0	0	120.4
90	A	32	Very low	45.8	Very low	92 Å²	92	133.5 Å²	133.5	76%	0.76	71%	0.708	S	S	*	*			trans	-129.1	140.2	148.1	0	0	0	0	0	110.2
91	P	31.6	Very low	48	Very low	102 Å²	102	129 Å²	129	66%	0.662	68%	0.684	S	S	*	*			trans	-69.7	157.2	-175.5	28	-34.8	0	0	0	112.8	L93	P91-L93 HydrophobicContact CG-CD1 4.2Å; P91-L93 HydrophobicContact CG-CG 4.27Å; P91-L93 PolarHBondContact O-N 2.92Å
92	R	35.5	Very low	50.7	Low	253 Å²	253	121 Å²	121	96%	0.955	65%	0.65	S	S	*	*			trans	-71.8	48.6	-173.8	-61	175.3	178.8	158.5	-1.6	114.4
93	L	31	Very low	53.2	Low	144 Å²	144	120 Å²	120	75%	0.754	63%	0.634	S	S	*	*			trans	-70.1	153.4	174	-62.4	174.7	0	0	0	110.4	P91	P91-L93 HydrophobicContact CG-CD1 4.2Å; P91-L93 HydrophobicContact CG-CG 4.27Å; P91-L93 PolarHBondContact O-N 2.92Å
94	L	39.9	Very low	56.1	Low	164 Å²	164	119.8 Å²	119.8	86%	0.859	63%	0.626	S	S	*	*			trans	56.5	65.8	-179.4	-59.6	177.7	0	0	0	116.1	G96	L94-G96 PolarHBondContact O-N 3.28Å
95	R	46.1	Very low	58.8	Low	157 Å²	157	111 Å²	111	59%	0.592	59%	0.589	S	S	*	*			trans	-69.4	46.2	148.2	-152.9	-178.4	-158.7	-156.1	11.7	110.9	T97 G202 R204	R95-T97 PolarHBondContact O-N 3.26Å; R95-G202 PolarHBondContact NH1-O 3.43Å; R95-R204 PolarHBondContact O-NH1 3.17Å
96	G	56.9	Low	61.9	Low	53 Å²	53	106.1 Å²	106.1	55%	0.546	56%	0.555	S	S	.	*			trans	-73.8	-31.1	-152.9	0	0	0	0	0	115.5	L94	L94-G96 PolarHBondContact O-N 3.28Å
97	T	76	Confident	64.9	Low	127 Å²	127	96.4 Å²	96.4	78%	0.779	52%	0.519	S	S	*	.	S	Bend	trans	-84.7	134.6	178.4	27	0	0	0	0	111.8	R95 R204	R95-T97 PolarHBondContact O-N 3.26Å; T97-R204 PolarHBondContact O-NH2 3.14Å
98	W	86.1	Confident	67.7	Low	36 Å²	36	94.8 Å²	94.8	14%	0.136	50%	0.498	C	S	.	.	P	Polyproline II helix	trans	-78.4	120.5	172.6	-83.9	75.5	0	0	0	110.4	D102 R103 F106 I124 R204 V209 F212	W98-D102 HydrophobicContact CD2-CB 4.48Å; W98-D102 HydrophobicContact CE3-CB 3.57Å; W98-D102 HydrophobicContact CZ3-CB 4Å; W98-R103 HydrophobicContact CB-CG 3.88Å; W98-R103 HydrophobicContact CE3-CG 4.12Å; W98-R103 PolarHBondContact O-NE 2.64Å; W98-R103 PolarHBondContact O-NH2 3.42Å; W98-F106 HydrophobicContact CH2-CD2 4.36Å; W98-F106 HydrophobicContact CZ3-CB 3.97Å; W98-F106 HydrophobicContact CZ3-CD2 4.47Å; W98-F106 HydrophobicContact CZ3-CG 4.42Å; W98-I124 HydrophobicContact CH2-CD1 4.33Å; W98-I124 HydrophobicContact CZ3-CD1 4.37Å; W98-R204 HydrophobicContact CH2-CG 4.14Å; W98-R204 HydrophobicContact CZ2-CG 4.45Å; W98-R204 HydrophobicContact CZ3-CG 4.46Å; W98-V209 HydrophobicContact CH2-CG2 4.19Å; W98-F212 HydrophobicContact CB-CE2 4.37Å; W98-F212 AromaticContact CD1-CD2 3.74Å; W98-F212 HydrophobicContact CD2-CB 4.34Å; W98-F212 HydrophobicContact CD2-CD1 4.14Å; W98-F212 AromaticContact CD2-CD2 3.8Å; W98-F212 HydrophobicContact CD2-CD2 3.8Å; W98-F212 HydrophobicContact CD2-CE1 4.46Å; W98-F212 HydrophobicContact CD2-CE2 4.15Å; W98-F212 AromaticContact CD2-CG 3.81Å; W98-F212 HydrophobicContact CD2-CG 3.81Å; W98-F212 HydrophobicContact CD2-CZ 4.48Å; W98-F212 AromaticContact CE2-CD2 3.74Å; W98-F212 AromaticContact CE2-CG 3.51Å; W98-F212 HydrophobicContact CE3-CD1 4.07Å; W98-F212 HydrophobicContact CE3-CD2 4.49Å; W98-F212 HydrophobicContact CE3-CE1 4.24Å; W98-F212 HydrophobicContact CE3-CG 4.22Å; W98-F212 AromaticContact CG-CD2 3.84Å; W98-F212 HydrophobicContact CG-CD2 3.84Å; W98-F212 AromaticContact CG-CE2 4Å; W98-F212 HydrophobicContact CG-CE2 4Å; W98-F212 HydrophobicContact CG-CG 4.34Å; W98-F212 HydrophobicContact CH2-CB 4.09Å; W98-F212 HydrophobicContact CH2-CD1 4.09Å; W98-F212 HydrophobicContact CH2-CG 4.17Å; W98-F212 HydrophobicContact CZ2-CB 3.39Å; W98-F212 HydrophobicContact CZ2-CD1 4.12Å; W98-F212 HydrophobicContact CZ2-CD2 4.41Å; W98-F212 AromaticContact CZ2-CG 3.72Å; W98-F212 HydrophobicContact CZ2-CG 3.72Å; W98-F212 HydrophobicContact CZ3-CD1 4.07Å; W98-F212 HydrophobicContact CZ3-CG 4.4Å; W98-F212 AromaticContact NE1-CD2 3.65Å; W98-F212 AromaticContact NE1-CG 3.82Å
99	S	88.5	Confident	70.6	Confident	52 Å²	52	89.3 Å²	89.3	36%	0.364	47%	0.469	S	S	.	.	P	Polyproline II helix	trans	-66.9	171.2	-177.7	79.5	0	0	0	0	112.2	D101 D102 R103	S99-D101 VanDerWaalsContact C-N 3.32Å; S99-D101 PolarHBondContact OG-N 3.35Å; S99-D102 PolarHBondContact N-OD2 3.44Å; S99-D102 VanDerWaalsContact N-OD2 3.1Å; S99-D102 WeakPolarHBondContact OG-CB 3.41Å; S99-D102 PolarHBondContact OG-N 3.11Å; S99-D102 PolarHBondContact OG-OD1 2.93Å; S99-D102 PolarHBondContact OG-OD2 3.46Å; S99-R103 WeakPolarHBondContact O-CG 3.42Å; S99-R103 PolarHBondContact O-N 2.86Å; S99-R103 PolarHBondContact O-NE 3.19Å; S99-R103 PolarHBondContact O-NH2 2.85Å
100	A	88	Confident	73.7	Confident	66 Å²	66	81.5 Å²	81.5	55%	0.545	43%	0.427	S	S	.	.	H	α-helix	trans	-59.5	-46.3	173.8	0	0	0	0	0	111	R103 R104	A100-R103 PolarHBondContact O-N 3.32Å; A100-R104 PolarHBondContact O-N 3.23Å; A100-R104 VanDerWaalsContact O-N 3.07Å
101	D	88.6	Confident	76.7	Confident	67 Å²	67	79.4 Å²	79.4	36%	0.358	40%	0.4	S	S	.	.	H	α-helix	trans	-79.9	-30.7	-176.2	-63.7	-77.9	0	0	0	113.9	S99 R103 R104 L105	S99-D101 VanDerWaalsContact C-N 3.32Å; S99-D101 PolarHBondContact OG-N 3.35Å; D101-R103 PolarHBondContact O-N 2.67Å; D101-R104 WeakPolarHBondContact O-CB 3.31Å; D101-R104 PolarHBondContact O-N 3.18Å; D101-R104 VanDerWaalsContact O-N 3.11Å; D101-R104 IonicContact OD1-NH1 3.94Å; D101-L105 WeakPolarHBondContact O-CB 3.48Å; D101-L105 WeakPolarHBondContact O-CG 3.3Å; D101-L105 PolarHBondContact O-N 3.38Å
102	D	91.6	Very high	79.7	Confident	19 Å²	19	77.9 Å²	77.9	10%	0.102	38%	0.384	C	S	.	.	H	α-helix	trans	-55.2	-43.8	168.1	-71.8	-26.3	0	0	0	110.4	W98 S99 F106 R204	W98-D102 HydrophobicContact CD2-CB 4.48Å; W98-D102 HydrophobicContact CE3-CB 3.57Å; W98-D102 HydrophobicContact CZ3-CB 4Å; S99-D102 PolarHBondContact N-OD2 3.44Å; S99-D102 VanDerWaalsContact N-OD2 3.1Å; S99-D102 WeakPolarHBondContact OG-CB 3.41Å; S99-D102 PolarHBondContact OG-N 3.11Å; S99-D102 PolarHBondContact OG-OD1 2.93Å; S99-D102 PolarHBondContact OG-OD2 3.46Å; D102-F106 VanDerWaalsContact O-CB 3.27Å; D102-F106 WeakPolarHBondContact O-CB 3.25Å; D102-F106 PolarHBondContact O-N 2.62Å; D102-R204 IonicContact OD2-CZ 3.13Å; D102-R204 VanDerWaalsContact OD2-CZ 3.32Å; D102-R204 IonicContact OD2-NE 3.71Å; D102-R204 PolarHBondContact OD2-NE 2.93Å; D102-R204 VanDerWaalsContact OD2-NE 3.13Å; D102-R204 IonicContact OD2-NH2 3.84Å; D102-R204 PolarHBondContact OD2-NH2 3.09Å
103	R	92.5	Very high	82.5	Confident	73 Å²	73	69.6 Å²	69.6	28%	0.275	35%	0.354	S	S	.	.	H	α-helix	trans	-70.7	-36.5	178.9	-68.3	175.9	-72	-172.8	-5.9	111.2	W98 S99 A100 D101 F107 F212	W98-R103 HydrophobicContact CB-CG 3.88Å; W98-R103 HydrophobicContact CE3-CG 4.12Å; W98-R103 PolarHBondContact O-NE 2.64Å; W98-R103 PolarHBondContact O-NH2 3.42Å; S99-R103 WeakPolarHBondContact O-CG 3.42Å; S99-R103 PolarHBondContact O-N 2.86Å; S99-R103 PolarHBondContact O-NE 3.19Å; S99-R103 PolarHBondContact O-NH2 2.85Å; A100-R103 PolarHBondContact O-N 3.32Å; D101-R103 PolarHBondContact O-N 2.67Å; R103-F107 HydrophobicContact CB-CE2 4.48Å; R103-F107 WeakPolarHBondContact O-CD2 3.3Å; R103-F107 PolarHBondContact O-N 3.43Å; R103-F212 HydrophobicContact CG-CE1 4.24Å; R103-F212 HydrophobicContact CG-CE2 4.44Å; R103-F212 HydrophobicContact CG-CZ 3.75Å
104	R	93.1	Very high	85.5	Confident	180 Å²	180	63 Å²	63	68%	0.679	32%	0.321	S	S	*	.	H	α-helix	trans	-63.1	-47.5	173.6	-176.2	-176.1	174.9	-170.6	-0.8	111.4	A100 D101 F107 Q108	A100-R104 PolarHBondContact O-N 3.23Å; A100-R104 VanDerWaalsContact O-N 3.07Å; D101-R104 WeakPolarHBondContact O-CB 3.31Å; D101-R104 PolarHBondContact O-N 3.18Å; D101-R104 VanDerWaalsContact O-N 3.11Å; D101-R104 IonicContact OD1-NH1 3.94Å; R104-F107 PolarHBondContact O-N 3.43Å; R104-Q108 WeakPolarHBondContact O-CB 3.48Å; R104-Q108 PolarHBondContact O-N 3.37Å
105	L	93.9	Very high	88	Confident	30 Å²	30	60.4 Å²	60.4	16%	0.157	30%	0.3	C	S	.	.	H	α-helix	trans	-63.1	-45.5	176.5	-70.5	175.5	0	0	0	111.1	D101 Q108 A109 F123 I124 R127	D101-L105 WeakPolarHBondContact O-CB 3.48Å; D101-L105 WeakPolarHBondContact O-CG 3.3Å; D101-L105 PolarHBondContact O-N 3.38Å; L105-Q108 PolarHBondContact O-N 3.5Å; L105-A109 VanDerWaalsContact O-CB 3.32Å; L105-A109 WeakPolarHBondContact O-CB 3.16Å; L105-A109 PolarHBondContact O-N 3.09Å; L105-F123 HydrophobicContact CB-CE1 4.43Å; L105-F123 HydrophobicContact CD2-CE1 3.98Å; L105-F123 WeakPolarHBondContact O-CE1 3.41Å; L105-I124 HydrophobicContact CB-CG1 4.1Å; L105-R127 HydrophobicContact CD1-CB 4.19Å; L105-R127 HydrophobicContact CD2-CB 3.74Å
106	F	95.6	Very high	90.3	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-56.6	-52.2	174.5	172	-91.3	0	0	0	112.4	W98 D102 Q108 A109 V110 I120 I124 V209 F212 Y213 I240	W98-F106 HydrophobicContact CH2-CD2 4.36Å; W98-F106 HydrophobicContact CZ3-CB 3.97Å; W98-F106 HydrophobicContact CZ3-CD2 4.47Å; W98-F106 HydrophobicContact CZ3-CG 4.42Å; D102-F106 VanDerWaalsContact O-CB 3.27Å; D102-F106 WeakPolarHBondContact O-CB 3.25Å; D102-F106 PolarHBondContact O-N 2.62Å; F106-Q108 VanDerWaalsContact C-N 3.29Å; F106-Q108 PolarHBondContact O-N 3Å; F106-A109 PolarHBondContact O-N 3.35Å; F106-A109 VanDerWaalsContact O-N 3.17Å; F106-V110 HydrophobicContact CD1-CG2 4.35Å; F106-V110 HydrophobicContact CD2-CG2 4.47Å; F106-V110 HydrophobicContact CE1-CG2 3.88Å; F106-V110 HydrophobicContact CE2-CG2 4.02Å; F106-V110 HydrophobicContact CZ-CG2 3.69Å; F106-V110 WeakPolarHBondContact O-CG2 3.49Å; F106-V110 PolarHBondContact O-N 2.94Å; F106-I120 HydrophobicContact CD2-CG2 3.94Å; F106-I120 HydrophobicContact CE2-CG2 4.32Å; F106-I124 HydrophobicContact CB-CD1 4.05Å; F106-I124 HydrophobicContact CD2-CD1 4.35Å; F106-V209 HydrophobicContact CD2-CG1 4.48Å; F106-V209 HydrophobicContact CE2-CG1 4.33Å; F106-F212 AromaticContact CD1-CD1 3.77Å; F106-F212 HydrophobicContact CD1-CD1 3.77Å; F106-F212 AromaticContact CD1-CE1 3.54Å; F106-F212 HydrophobicContact CD1-CE1 3.54Å; F106-F212 AromaticContact CD2-CD1 3.89Å; F106-F212 HydrophobicContact CD2-CD1 3.89Å; F106-F212 HydrophobicContact CD2-CE1 4.46Å; F106-F212 AromaticContact CE1-CD1 3.8Å; F106-F212 HydrophobicContact CE1-CD1 3.8Å; F106-F212 AromaticContact CE1-CE1 3.77Å; F106-F212 HydrophobicContact CE1-CE1 3.77Å; F106-F212 AromaticContact CE2-CD1 3.92Å; F106-F212 HydrophobicContact CE2-CD1 3.92Å; F106-F212 AromaticContact CG-CD1 3.82Å; F106-F212 HydrophobicContact CG-CD1 3.82Å; F106-F212 AromaticContact CG-CE1 3.92Å; F106-F212 HydrophobicContact CG-CE1 3.92Å; F106-F212 AromaticContact CZ-CD1 3.88Å; F106-F212 HydrophobicContact CZ-CD1 3.88Å; F106-F212 HydrophobicContact CZ-CE1 4.33Å; F106-Y213 HydrophobicContact CE2-CD2 4.38Å; F106-Y213 AromaticContact CZ-CD2 3.89Å; F106-Y213 HydrophobicContact CZ-CD2 3.89Å; F106-Y213 HydrophobicContact CZ-CG 4.22Å; F106-I240 HydrophobicContact CE1-CG2 4.46Å
107	F	95.8	Very high	92.2	Very high	17 Å²	17	55.5 Å²	55.5	8%	0.075	27%	0.271	C	S	.	.	H	α-helix	trans	-67.3	-30.2	-179.4	-74.6	-56.6	0	0	0	112.8	R103 R104 R111 T216 I240 Y243 S244	R103-F107 HydrophobicContact CB-CE2 4.48Å; R103-F107 WeakPolarHBondContact O-CD2 3.3Å; R103-F107 PolarHBondContact O-N 3.43Å; R104-F107 PolarHBondContact O-N 3.43Å; F107-R111 WeakPolarHBondContact O-CG 3.4Å; F107-R111 PolarHBondContact O-N 2.94Å; F107-T216 HydrophobicContact CE1-CG2 4.19Å; F107-T216 HydrophobicContact CZ-CG2 4.29Å; F107-I240 HydrophobicContact CD1-CG2 4.23Å; F107-I240 HydrophobicContact CE1-CG2 3.99Å; F107-Y243 HydrophobicContact CE1-CD1 4.25Å; F107-Y243 HydrophobicContact CZ-CD1 4.2Å; F107-Y243 HydrophobicContact CZ-CE1 4.08Å; F107-S244 VanDerWaalsContact CD1-CB 3.45Å
108	Q	94.3	Very high	93.1	Very high	79 Å²	79	52.6 Å²	52.6	37%	0.369	26%	0.256	S	S	.	.	H	α-helix	trans	-70.3	-40.1	171.9	-172.1	61.9	15.4	0	0	111.6	R104 L105 F106 R111 M112 F123	R104-Q108 WeakPolarHBondContact O-CB 3.48Å; R104-Q108 PolarHBondContact O-N 3.37Å; L105-Q108 PolarHBondContact O-N 3.5Å; F106-Q108 VanDerWaalsContact C-N 3.29Å; F106-Q108 PolarHBondContact O-N 3Å; Q108-R111 WeakPolarHBondContact O-CB 3.36Å; Q108-R111 PolarHBondContact O-N 3.4Å; Q108-R111 VanDerWaalsContact OE1-NH1 3.14Å; Q108-M112 WeakPolarHBondContact O-CG 3.29Å; Q108-M112 PolarHBondContact O-N 3.31Å; Q108-F123 HydrophobicContact CB-CE1 4.27Å; Q108-F123 HydrophobicContact CB-CZ 4.2Å; Q108-F123 HydrophobicContact CG-CE1 4.38Å; Q108-F123 HydrophobicContact CG-CZ 3.81Å
109	A	95.5	Very high	93.4	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-65.4	-41.7	176.8	0	0	0	0	0	112.5	L105 F106 R111 M112 Y113 I120 F123	L105-A109 VanDerWaalsContact O-CB 3.32Å; L105-A109 WeakPolarHBondContact O-CB 3.16Å; L105-A109 PolarHBondContact O-N 3.09Å; F106-A109 PolarHBondContact O-N 3.35Å; F106-A109 VanDerWaalsContact O-N 3.17Å; A109-R111 VanDerWaalsContact C-N 3.25Å; A109-R111 PolarHBondContact O-N 2.89Å; A109-M112 PolarHBondContact O-N 3.1Å; A109-Y113 HydrophobicContact CB-CD2 4.35Å; A109-Y113 VanDerWaalsContact O-CD2 3.3Å; A109-Y113 WeakPolarHBondContact O-CD2 3.37Å; A109-Y113 PolarHBondContact O-N 2.91Å; A109-I120 HydrophobicContact CB-CB 4.11Å; A109-I120 HydrophobicContact CB-CG1 3.91Å; A109-I120 HydrophobicContact CB-CG2 3.85Å; A109-F123 HydrophobicContact CB-CB 4.12Å; A109-F123 HydrophobicContact CB-CD1 3.63Å; A109-F123 HydrophobicContact CB-CE1 4.11Å; A109-F123 HydrophobicContact CB-CG 3.9Å
110	V	96.1	Very high	93.7	Very high	1 Å²	1	51.2 Å²	51.2	1%	0.006	25%	0.245	C	C	.	.	H	α-helix	trans	-61	-33.3	175	171.8	0	0	0	0	111.8	F106 M112 G114 I120 Y213 I240 V241 A289	F106-V110 HydrophobicContact CD1-CG2 4.35Å; F106-V110 HydrophobicContact CD2-CG2 4.47Å; F106-V110 HydrophobicContact CE1-CG2 3.88Å; F106-V110 HydrophobicContact CE2-CG2 4.02Å; F106-V110 HydrophobicContact CZ-CG2 3.69Å; F106-V110 WeakPolarHBondContact O-CG2 3.49Å; F106-V110 PolarHBondContact O-N 2.94Å; V110-M112 VanDerWaalsContact C-N 3.31Å; V110-M112 PolarHBondContact O-N 3.02Å; V110-G114 VanDerWaalsContact O-CA 3.27Å; V110-G114 WeakPolarHBondContact O-CA 3.43Å; V110-G114 PolarHBondContact O-N 2.95Å; V110-I120 HydrophobicContact CG2-CD1 3.76Å; V110-I120 HydrophobicContact CG2-CG1 4.46Å; V110-Y213 HydrophobicContact CG2-CD2 4.17Å; V110-Y213 HydrophobicContact CG2-CE2 4.4Å; V110-I240 HydrophobicContact CG1-CG2 3.94Å; V110-V241 HydrophobicContact CG1-CG2 3.99Å; V110-A289 WeakPolarHBondContact O-CB 3.36Å
111	R	95	Very high	94	Very high	47 Å²	47	48.2 Å²	48.2	18%	0.177	22%	0.22	C	C	.	.	H	α-helix	trans	-67.9	-29.1	173.4	-70.6	169.5	-169.9	167.3	-0.6	113.3	F107 Q108 A109 V241 S244 C287 P288 A289	F107-R111 WeakPolarHBondContact O-CG 3.4Å; F107-R111 PolarHBondContact O-N 2.94Å; Q108-R111 WeakPolarHBondContact O-CB 3.36Å; Q108-R111 PolarHBondContact O-N 3.4Å; Q108-R111 VanDerWaalsContact OE1-NH1 3.14Å; A109-R111 VanDerWaalsContact C-N 3.25Å; A109-R111 PolarHBondContact O-N 2.89Å; R111-V241 HydrophobicContact CG-CG1 4.19Å; R111-V241 HydrophobicContact CG-CG2 4.39Å; R111-S244 PolarHBondContact NE-OG 3.26Å; R111-S244 PolarHBondContact NH2-OG 2.98Å; R111-C287 HydrophobicContact CB-CB 3.85Å; R111-C287 HydrophobicContact CG-CB 4.41Å; R111-C287 WeakPolarHBondContact O-CB 3.45Å; R111-C287 PolarHBondContact O-SG 3.34Å; R111-P288 WeakPolarHBondContact O-CD 3.43Å; R111-A289 VanDerWaalsContact O-CB 3.29Å; R111-A289 WeakPolarHBondContact O-CB 3.33Å; R111-A289 PolarHBondContact O-N 3.42Å; R111-A289 VanDerWaalsContact O-N 3.08Å
112	M	93	Very high	94.3	Very high	70 Å²	70	53.3 Å²	53.3	35%	0.345	23%	0.234	S	C	.	.	H	α-helix	trans	-83.4	-48.2	178	-62.5	-58.6	-64.2	0	0	111.9	Q108 A109 V110 P288	Q108-M112 WeakPolarHBondContact O-CG 3.29Å; Q108-M112 PolarHBondContact O-N 3.31Å; A109-M112 PolarHBondContact O-N 3.1Å; V110-M112 VanDerWaalsContact C-N 3.31Å; V110-M112 PolarHBondContact O-N 3.02Å; M112-P288 HydrophobicContact CE-CG 3.94Å; M112-P288 HydrophobicContact SD-CG 3.98Å
113	Y	94.9	Very high	94.3	Very high	80 Å²	80	53 Å²	53	31%	0.314	23%	0.233	S	C	.	.	H	α-helix	trans	-118.8	4.5	-165.6	-46.3	-74.8	0	0	0	114.9	A109 R115 N116 E119 F123	A109-Y113 HydrophobicContact CB-CD2 4.35Å; A109-Y113 VanDerWaalsContact O-CD2 3.3Å; A109-Y113 WeakPolarHBondContact O-CD2 3.37Å; A109-Y113 PolarHBondContact O-N 2.91Å; Y113-R115 PolarHBondContact O-N 3.47Å; Y113-N116 WeakPolarHBondContact O-CB 3.33Å; Y113-N116 PolarHBondContact O-N 3.04Å; Y113-E119 HydrophobicContact CD1-CB 3.69Å; Y113-E119 HydrophobicContact CD1-CG 4.16Å; Y113-E119 HydrophobicContact CD2-CB 3.92Å; Y113-E119 HydrophobicContact CE1-CB 4.04Å; Y113-E119 HydrophobicContact CE1-CG 4.36Å; Y113-E119 HydrophobicContact CE2-CB 4.28Å; Y113-E119 HydrophobicContact CG-CB 3.61Å; Y113-F123 HydrophobicContact CE2-CB 3.96Å; Y113-F123 AromaticContact CE2-CD2 3.74Å; Y113-F123 HydrophobicContact CE2-CD2 3.74Å; Y113-F123 HydrophobicContact CE2-CG 4.15Å
114	G	94	Very high	94.3	Very high	6 Å²	6	49.8 Å²	49.8	6%	0.062	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.3	-109.2	175.2	0	0	0	0	0	113.2	V110	V110-G114 VanDerWaalsContact O-CA 3.27Å; V110-G114 WeakPolarHBondContact O-CA 3.43Å; V110-G114 PolarHBondContact O-N 2.95Å
115	R	93.3	Very high	94.1	Very high	109 Å²	109	44.7 Å²	44.7	41%	0.411	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.6	9.2	-178.7	-158	-178	-164.1	-132.7	15.9	113.6	Y113 F117 Y213 E236 V237	Y113-R115 PolarHBondContact O-N 3.47Å; R115-F117 HydrophobicContact CG-CE2 4.35Å; R115-F117 HydrophobicContact CG-CZ 4.01Å; R115-F117 PolarHBondContact O-N 2.97Å; R115-F117 VanDerWaalsContact O-N 3.11Å; R115-Y213 HydrophobicContact CG-CE1 4.46Å; R115-E236 IonicContact CZ-OE1 2.69Å; R115-E236 IonicContact CZ-OE2 2.86Å; R115-E236 IonicContact NE-OE1 3.32Å; R115-E236 IonicContact NE-OE2 3.8Å; R115-E236 PolarHBondContact NE-OE2 2.9Å; R115-E236 IonicContact NH2-OE1 3.89Å; R115-E236 PolarHBondContact NH2-OE1 2.91Å; R115-E236 IonicContact NH2-OE2 2.68Å; R115-E236 PolarHBondContact NH2-OE2 3.23Å; R115-E236 VanDerWaalsContact NH2-OE2 3.14Å; R115-V237 HydrophobicContact CB-CG2 4.25Å
116	N	94.3	Very high	93.9	Very high	74 Å²	74	47.4 Å²	47.4	40%	0.396	22%	0.223	S	C	.	.			trans	-79.4	93.9	178	-174.2	-22.5	0	0	0	111.2	Y113 S118 E119 I120	Y113-N116 WeakPolarHBondContact O-CB 3.33Å; Y113-N116 PolarHBondContact O-N 3.04Å; N116-S118 VanDerWaalsContact C-N 3.27Å; N116-S118 PolarHBondContact O-N 3.41Å; N116-S118 WeakPolarHBondContact OD1-CB 3.3Å; N116-S118 PolarHBondContact OD1-N 3.23Å; N116-S118 VanDerWaalsContact OD1-N 3.09Å; N116-E119 HydrophobicContact CB-CB 4.41Å; N116-E119 PolarHBondContact O-N 3.03Å; N116-E119 PolarHBondContact OD1-N 3.22Å; N116-I120 WeakPolarHBondContact O-CD1 3.19Å; N116-I120 VanDerWaalsContact O-CG1 3.26Å; N116-I120 WeakPolarHBondContact O-CG1 3.37Å; N116-I120 PolarHBondContact O-N 2.79Å
117	F	95.5	Very high	93.2	Very high	32 Å²	32	54 Å²	54	14%	0.14	25%	0.248	C	C	.	.	H	α-helix	trans	-61.7	-31.3	179.9	-54.7	-62.7	0	0	0	113.6	R115 T121 R206 V209 R210 Y213	R115-F117 HydrophobicContact CG-CE2 4.35Å; R115-F117 HydrophobicContact CG-CZ 4.01Å; R115-F117 PolarHBondContact O-N 2.97Å; R115-F117 VanDerWaalsContact O-N 3.11Å; F117-T121 WeakPolarHBondContact O-CB 3.25Å; F117-T121 PolarHBondContact O-N 3.36Å; F117-T121 PolarHBondContact O-OG1 3.32Å; F117-R206 HydrophobicContact CB-CG 4.07Å; F117-V209 HydrophobicContact CD1-CG1 4.35Å; F117-R210 HydrophobicContact CD1-CB 4.07Å; F117-R210 HydrophobicContact CD1-CG 4.42Å; F117-R210 HydrophobicContact CD2-CB 4.48Å; F117-R210 HydrophobicContact CD2-CG 4.3Å; F117-R210 HydrophobicContact CE1-CB 4.29Å; F117-R210 HydrophobicContact CE1-CG 4.24Å; F117-R210 HydrophobicContact CE2-CG 4.11Å; F117-R210 HydrophobicContact CG-CB 4.18Å; F117-R210 HydrophobicContact CG-CG 4.46Å; F117-R210 HydrophobicContact CZ-CG 4.09Å; F117-Y213 AromaticContact CE1-CD1 3.86Å; F117-Y213 HydrophobicContact CE1-CD1 3.86Å; F117-Y213 AromaticContact CE1-CD2 3.99Å; F117-Y213 HydrophobicContact CE1-CD2 3.99Å; F117-Y213 HydrophobicContact CE1-CE1 4.36Å; F117-Y213 HydrophobicContact CE1-CE2 4.46Å; F117-Y213 AromaticContact CE1-CG 3.67Å; F117-Y213 HydrophobicContact CE1-CG 3.67Å; F117-Y213 HydrophobicContact CZ-CD1 4.18Å; F117-Y213 HydrophobicContact CZ-CE1 4.41Å; F117-Y213 HydrophobicContact CZ-CG 4.44Å
118	S	94.6	Very high	91.7	Very high	66 Å²	66	54.5 Å²	54.5	46%	0.462	26%	0.258	S	S	.	.	H	α-helix	trans	-67.2	-49.1	179.7	-60.1	0	0	0	0	110.9	N116 T121 R122	N116-S118 VanDerWaalsContact C-N 3.27Å; N116-S118 PolarHBondContact O-N 3.41Å; N116-S118 WeakPolarHBondContact OD1-CB 3.3Å; N116-S118 PolarHBondContact OD1-N 3.23Å; N116-S118 VanDerWaalsContact OD1-N 3.09Å; S118-T121 WeakPolarHBondContact O-CB 3.47Å; S118-T121 PolarHBondContact O-N 3.35Å; S118-T121 VanDerWaalsContact O-N 3.16Å; S118-R122 PolarHBondContact O-N 2.8Å
119	E	94.1	Very high	89.7	Confident	59 Å²	59	56 Å²	56	28%	0.276	27%	0.265	S	S	.	.	H	α-helix	trans	-69.3	-36.1	177.4	-72.8	-51.8	116.2	0	0	113	Y113 N116 T121 R122 F123	Y113-E119 HydrophobicContact CD1-CB 3.69Å; Y113-E119 HydrophobicContact CD1-CG 4.16Å; Y113-E119 HydrophobicContact CD2-CB 3.92Å; Y113-E119 HydrophobicContact CE1-CB 4.04Å; Y113-E119 HydrophobicContact CE1-CG 4.36Å; Y113-E119 HydrophobicContact CE2-CB 4.28Å; Y113-E119 HydrophobicContact CG-CB 3.61Å; N116-E119 HydrophobicContact CB-CB 4.41Å; N116-E119 PolarHBondContact O-N 3.03Å; N116-E119 PolarHBondContact OD1-N 3.22Å; E119-T121 PolarHBondContact O-N 3.01Å; E119-R122 PolarHBondContact O-N 3.28Å; E119-F123 VanDerWaalsContact O-CB 3.28Å; E119-F123 WeakPolarHBondContact O-CB 3.36Å; E119-F123 PolarHBondContact O-N 3.31Å
120	I	94.9	Very high	87.5	Confident	0 Å²	0	67.2 Å²	67.2	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-59.3	-39.7	171.1	-66.4	161.8	0	0	0	110.8	F106 A109 V110 N116 I124 V209	F106-I120 HydrophobicContact CD2-CG2 3.94Å; F106-I120 HydrophobicContact CE2-CG2 4.32Å; A109-I120 HydrophobicContact CB-CB 4.11Å; A109-I120 HydrophobicContact CB-CG1 3.91Å; A109-I120 HydrophobicContact CB-CG2 3.85Å; V110-I120 HydrophobicContact CG2-CD1 3.76Å; V110-I120 HydrophobicContact CG2-CG1 4.46Å; N116-I120 WeakPolarHBondContact O-CD1 3.19Å; N116-I120 VanDerWaalsContact O-CG1 3.26Å; N116-I120 WeakPolarHBondContact O-CG1 3.37Å; N116-I120 PolarHBondContact O-N 2.79Å; I120-I124 HydrophobicContact CG2-CD1 3.78Å; I120-I124 WeakPolarHBondContact O-CD1 3.35Å; I120-I124 VanDerWaalsContact O-CG1 3.26Å; I120-I124 WeakPolarHBondContact O-CG1 3.14Å; I120-I124 PolarHBondContact O-N 2.9Å; I120-V209 HydrophobicContact CB-CG1 3.94Å; I120-V209 HydrophobicContact CG2-CG1 3.41Å; I120-V209 VanDerWaalsContact CG2-CG1 3.41Å; I120-V209 HydrophobicContact CG2-CG2 4.49Å
121	T	94.2	Very high	85	Confident	4 Å²	4	72.2 Å²	72.2	3%	0.025	34%	0.337	C	S	.	.	H	α-helix	trans	-70.2	-43.4	178	-55.1	0	0	0	0	111.6	F117 S118 E119 F123 I124 R125 R204 R206	F117-T121 WeakPolarHBondContact O-CB 3.25Å; F117-T121 PolarHBondContact O-N 3.36Å; F117-T121 PolarHBondContact O-OG1 3.32Å; S118-T121 WeakPolarHBondContact O-CB 3.47Å; S118-T121 PolarHBondContact O-N 3.35Å; S118-T121 VanDerWaalsContact O-N 3.16Å; E119-T121 PolarHBondContact O-N 3.01Å; T121-F123 VanDerWaalsContact C-N 3.34Å; T121-F123 PolarHBondContact O-N 2.98Å; T121-I124 PolarHBondContact O-N 3.16Å; T121-R125 WeakPolarHBondContact O-CB 3.47Å; T121-R125 VanDerWaalsContact O-CG 3.26Å; T121-R125 WeakPolarHBondContact O-CG 3.29Å; T121-R125 PolarHBondContact O-N 3.16Å; T121-R204 WeakPolarHBondContact CG2-O 3.49Å; T121-R206 WeakPolarHBondContact OG1-CA 3.36Å
122	R	93.3	Very high	82.3	Confident	173 Å²	173	74.2 Å²	74.2	65%	0.653	36%	0.359	S	S	*	.	H	α-helix	trans	-57.3	-46	174.4	-168.6	-178.7	-177.7	106.5	3.3	111.1	S118 E119 R125 S126	S118-R122 PolarHBondContact O-N 2.8Å; E119-R122 PolarHBondContact O-N 3.28Å; R122-R125 PolarHBondContact O-N 2.96Å; R122-S126 WeakPolarHBondContact O-CB 3.22Å; R122-S126 PolarHBondContact O-N 3.48Å; R122-S126 PolarHBondContact O-OG 2.96Å
123	F	92.9	Very high	79.7	Confident	14 Å²	14	78 Å²	78	6%	0.061	38%	0.379	C	S	.	.	H	α-helix	trans	-65.7	-42.3	178.6	-176.7	-79.1	0	0	0	113.6	L105 Q108 A109 Y113 E119 T121 S126 R127	L105-F123 HydrophobicContact CB-CE1 4.43Å; L105-F123 HydrophobicContact CD2-CE1 3.98Å; L105-F123 WeakPolarHBondContact O-CE1 3.41Å; Q108-F123 HydrophobicContact CB-CE1 4.27Å; Q108-F123 HydrophobicContact CB-CZ 4.2Å; Q108-F123 HydrophobicContact CG-CE1 4.38Å; Q108-F123 HydrophobicContact CG-CZ 3.81Å; A109-F123 HydrophobicContact CB-CB 4.12Å; A109-F123 HydrophobicContact CB-CD1 3.63Å; A109-F123 HydrophobicContact CB-CE1 4.11Å; A109-F123 HydrophobicContact CB-CG 3.9Å; Y113-F123 HydrophobicContact CE2-CB 3.96Å; Y113-F123 AromaticContact CE2-CD2 3.74Å; Y113-F123 HydrophobicContact CE2-CD2 3.74Å; Y113-F123 HydrophobicContact CE2-CG 4.15Å; E119-F123 VanDerWaalsContact O-CB 3.28Å; E119-F123 WeakPolarHBondContact O-CB 3.36Å; E119-F123 PolarHBondContact O-N 3.31Å; T121-F123 VanDerWaalsContact C-N 3.34Å; T121-F123 PolarHBondContact O-N 2.98Å; F123-S126 PolarHBondContact O-OG 3.37Å; F123-R127 VanDerWaalsContact CZ-NH1 3.29Å; F123-R127 PolarHBondContact O-N 3.44Å
124	I	92.1	Very high	76.7	Confident	4 Å²	4	80.4 Å²	80.4	2%	0.021	40%	0.397	C	S	.	.	H	α-helix	trans	-66.4	-43.5	177	-68.9	164.7	0	0	0	109.9	W98 L105 F106 I120 T121 R127 G128 R204 V209	W98-I124 HydrophobicContact CH2-CD1 4.33Å; W98-I124 HydrophobicContact CZ3-CD1 4.37Å; L105-I124 HydrophobicContact CB-CG1 4.1Å; F106-I124 HydrophobicContact CB-CD1 4.05Å; F106-I124 HydrophobicContact CD2-CD1 4.35Å; I120-I124 HydrophobicContact CG2-CD1 3.78Å; I120-I124 WeakPolarHBondContact O-CD1 3.35Å; I120-I124 VanDerWaalsContact O-CG1 3.26Å; I120-I124 WeakPolarHBondContact O-CG1 3.14Å; I120-I124 PolarHBondContact O-N 2.9Å; T121-I124 PolarHBondContact O-N 3.16Å; I124-R127 PolarHBondContact O-N 3.2Å; I124-G128 WeakPolarHBondContact O-CA 3.44Å; I124-G128 PolarHBondContact O-N 3.45Å; I124-R204 HydrophobicContact CG2-CB 4.19Å; I124-R204 HydrophobicContact CG2-CG 4.04Å; I124-V209 HydrophobicContact CD1-CG2 3.86Å
125	R	89.6	Confident	74	Confident	73 Å²	73	88.7 Å²	88.7	28%	0.275	43%	0.434	S	S	.	.	H	α-helix	trans	-61.5	-46.3	176.7	-72	170.1	177.4	-174.2	-10.7	112	T121 R122 R127 R204	T121-R125 WeakPolarHBondContact O-CB 3.47Å; T121-R125 VanDerWaalsContact O-CG 3.26Å; T121-R125 WeakPolarHBondContact O-CG 3.29Å; T121-R125 PolarHBondContact O-N 3.16Å; R122-R125 PolarHBondContact O-N 2.96Å; R125-R127 PolarHBondContact O-N 2.72Å; R125-R204 PolarHBondContact NE-O 3.42Å
126	S	88.7	Confident	71.3	Confident	87 Å²	87	92.8 Å²	92.8	61%	0.608	46%	0.457	S	S	*	.	H	α-helix	trans	-70.7	-11.5	-177.2	67.4	0	0	0	0	115.1	R122 F123	R122-S126 WeakPolarHBondContact O-CB 3.22Å; R122-S126 PolarHBondContact O-N 3.48Å; R122-S126 PolarHBondContact O-OG 2.96Å; F123-S126 PolarHBondContact O-OG 3.37Å
127	R	81.5	Confident	68.7	Low	139 Å²	139	96.2 Å²	96.2	53%	0.525	48%	0.482	S	S	.	.	H	α-helix	trans	-123.5	-18.3	-178.8	-68.8	-177.1	167.2	167.4	-4.4	115	L105 F123 I124 R125 H129	L105-R127 HydrophobicContact CD1-CB 4.19Å; L105-R127 HydrophobicContact CD2-CB 3.74Å; F123-R127 VanDerWaalsContact CZ-NH1 3.29Å; F123-R127 PolarHBondContact O-N 3.44Å; I124-R127 PolarHBondContact O-N 3.2Å; R125-R127 PolarHBondContact O-N 2.72Å; R127-H129 PolarHBondContact O-N 2.98Å
128	G	63.5	Low	65.6	Low	28 Å²	28	98.3 Å²	98.3	29%	0.289	51%	0.512	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-9.5	-178.6	0	0	0	0	0	115.9	I124	I124-G128 WeakPolarHBondContact O-CA 3.44Å; I124-G128 PolarHBondContact O-N 3.45Å
129	H	53.2	Low	62.9	Low	111 Å²	111	101.5 Å²	101.5	51%	0.514	53%	0.531	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.1	-8	-180	-80.2	-82.2	0	0	0	114.9	R127 T131	R127-H129 PolarHBondContact O-N 2.98Å; H129-T131 VanDerWaalsContact C-N 3.27Å; H129-T131 PolarHBondContact O-N 2.85Å
130	R	47.8	Very low	60.1	Low	235 Å²	235	104.3 Å²	104.3	89%	0.887	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.2	7.6	-176.5	-82.2	-170	170.7	-123.2	-0.8	115.7
131	T	43.7	Very low	57.2	Low	105 Å²	105	110.5 Å²	110.5	64%	0.644	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-136.8	40	-173.7	63.7	0	0	0	0	112.3	H129	H129-T131 VanDerWaalsContact C-N 3.27Å; H129-T131 PolarHBondContact O-N 2.85Å
132	S	38.1	Very low	54.3	Low	89 Å²	89	113.6 Å²	113.6	62%	0.622	63%	0.633	S	S	*	*			trans	-154.5	31.2	-173.1	-170.7	0	0	0	0	113.1
133	I	39.8	Very low	51.4	Low	150 Å²	150	113.2 Å²	113.2	77%	0.769	64%	0.644	S	S	*	*	S	Bend	trans	-107.4	-26.7	178.3	-73.5	174.7	0	0	0	111.2
134	D	32.4	Very low	48.7	Very low	130 Å²	130	119.8 Å²	119.8	70%	0.695	68%	0.679	S	S	*	*	S	Bend	trans	-79.3	144	170.2	-42.9	-72.7	0	0	0	110.7
135	H	35.5	Very low	45.6	Very low	181 Å²	181	127.3 Å²	127.3	84%	0.838	71%	0.713	S	S	*	*	S	Bend	trans	76.6	56.7	-175.4	-45.1	-57.5	0	0	0	117.6
136	Q	38.6	Very low	42.9	Very low	194 Å²	194	131.7 Å²	131.7	91%	0.907	74%	0.742	S	S	*	*			trans	-152.7	122.7	138.2	-121.9	146.6	112.8	0	0	111.3
137	T	38	Very low	40	Very low	147 Å²	147	131.8 Å²	131.8	90%	0.902	74%	0.739	S	S	*	*			trans	-122.1	130.3	-176.5	48.5	0	0	0	0	110.5
138	G	32.1	Very low	37.6	Very low	76 Å²	76	133 Å²	133	78%	0.784	76%	0.755	S	S	*	*			trans	116.6	145.9	167.6	0	0	0	0	0	114.1
139	P	36.9	Very low	35.9	Very low	132 Å²	132	138.2 Å²	138.2	86%	0.857	78%	0.776	S	S	*	*			trans	-126.3	159.9	-153.2	38.6	-22	0	0	0	115.8
140	S	36.1	Very low	34.8	Very low	119 Å²	119	138.4 Å²	138.4	83%	0.832	79%	0.79	S	S	*	*			trans	-154.3	133.7	158.1	61.3	0	0	0	0	111.7
141	S	33.8	Very low	34	Very low	130 Å²	130	134.9 Å²	134.9	91%	0.909	79%	0.788	S	S	*	*			trans	-62.9	162	-174.3	-43.1	0	0	0	0	115.4
142	G	33.5	Very low	33.3	Very low	69 Å²	69	138.4 Å²	138.4	71%	0.711	80%	0.796	S	S	*	*			trans	173.3	64.5	171.8	0	0	0	0	0	114.6	I144	G142-I144 PolarHBondContact O-N 2.76Å
143	N	30.6	Very low	33	Very low	164 Å²	164	140 Å²	140	88%	0.877	81%	0.805	S	S	*	*			trans	-70.4	123.6	177	-68.9	-2.5	0	0	0	111
144	I	36.8	Very low	32.5	Very low	153 Å²	153	136.4 Å²	136.4	79%	0.785	81%	0.805	S	S	*	*			trans	-127.8	105	154	-62	-178.3	0	0	0	106.7	G142 L146	G142-I144 PolarHBondContact O-N 2.76Å; I144-L146 HydrophobicContact CG2-CG 4.41Å
145	E	27.2	Very low	32.4	Very low	161 Å²	161	135.3 Å²	135.3	75%	0.752	80%	0.799	S	S	*	*			trans	-83.4	115.3	174.6	-174	-174.6	146.4	0	0	108.9	T147	E145-T147 WeakPolarHBondContact CG-OG1 3.15Å; E145-T147 PolarHBondContact OE1-OG1 3.02Å
146	L	33.3	Very low	32.1	Very low	166 Å²	166	133.3 Å²	133.3	87%	0.869	79%	0.794	S	S	*	*			trans	-108.8	76.3	168.3	-81.9	176.1	0	0	0	109.8	I144 L148	I144-L146 HydrophobicContact CG2-CG 4.41Å; L146-L148 PolarHBondContact O-N 3.44Å
147	T	27.4	Very low	31.7	Very low	89 Å²	89	134 Å²	134	55%	0.546	80%	0.795	S	S	.	*			trans	-70.3	113.6	168.6	-71.3	0	0	0	0	109.8	E145	E145-T147 WeakPolarHBondContact CG-OG1 3.15Å; E145-T147 PolarHBondContact OE1-OG1 3.02Å
148	L	31.8	Very low	31.3	Very low	164 Å²	164	132.2 Å²	132.2	86%	0.859	78%	0.783	S	S	*	*			trans	-154.5	120.1	156.6	-117.6	172.4	0	0	0	111.5	L146	L146-L148 PolarHBondContact O-N 3.44Å
149	N	27.1	Very low	31.1	Very low	137 Å²	137	133.8 Å²	133.8	73%	0.733	78%	0.782	S	S	*	*			trans	-82.9	137	-177.4	-53.5	-60.5	0	0	0	111.3
150	S	29.3	Very low	30.8	Very low	116 Å²	116	132.2 Å²	132.2	81%	0.811	77%	0.774	S	S	*	*			trans	-170.8	145.8	152.2	-93.2	0	0	0	0	115.1
151	L	31.6	Very low	30.5	Very low	161 Å²	161	133.1 Å²	133.1	84%	0.843	77%	0.77	S	S	*	*			trans	67.9	68.9	153.2	-62.4	166.1	0	0	0	118.9
152	H	29.4	Very low	30.4	Very low	178 Å²	178	132.4 Å²	132.4	82%	0.824	77%	0.765	S	S	*	*				27	139	125.7	-85	-95	0	0	0	122.3
153	P	31.9	Very low	30.3	Very low	123 Å²	123	137.3 Å²	137.3	80%	0.799	77%	0.774	S	S	*	*			trans	-78.4	154.2	160.2	35.5	-34.1	0	0	0	112.2
154	G	29.7	Very low	30.3	Very low	74 Å²	74	134.4 Å²	134.4	76%	0.763	77%	0.766	S	S	*	*			trans	-164.7	106.2	178.2	0	0	0	0	0	115.9
155	N	30.6	Very low	30	Very low	108 Å²	108	132.9 Å²	132.9	58%	0.578	77%	0.769	S	S	*	*			trans	13.3	159	151.9	-64.3	-17.1	0	0	0	124	D1092	N155-D1092 PolarHBondContact ND2-OD1 3.22Å; N155-D1092 PolarHBondContact ND2-OD2 3.24Å
156	N	28.4	Very low	30.2	Very low	138 Å²	138	129.3 Å²	129.3	74%	0.738	77%	0.767	S	S	*	*			trans	80.3	136.5	173.3	-50	-43.6	0	0	0	114.9
157	F	31.1	Very low	30.2	Very low	209 Å²	209	128.5 Å²	128.5	92%	0.917	76%	0.763	S	S	*	*			cis	-111	164.9	27.2	-98.2	-100.9	0	0	0	117.4
158	V	28.5	Very low	30.5	Very low	109 Å²	109	131.6 Å²	131.6	66%	0.661	78%	0.775	S	S	*	*			trans	-119.5	144.9	-174.9	163	0	0	0	0	110.3
159	S	28.7	Very low	30.9	Very low	110 Å²	110	129 Å²	129	77%	0.769	77%	0.768	S	S	*	*			trans	66.2	157.1	167.7	-68.3	0	0	0	0	116
160	S	29.9	Very low	31.2	Very low	98 Å²	98	127.6 Å²	127.6	69%	0.685	77%	0.769	S	S	*	*			cis	-155.2	156.5	32.2	53.3	0	0	0	0	116.1
161	N	30.9	Very low	31.4	Very low	139 Å²	139	128.5 Å²	128.5	74%	0.743	77%	0.765	S	S	*	*			trans	53	109	140.3	-59.1	1.4	0	0	0	120.7
162	S	30	Very low	31.4	Very low	115 Å²	115	127.5 Å²	127.5	80%	0.804	76%	0.759	S	S	*	*			trans	-40.5	136.7	134.4	51.9	0	0	0	0	113.8
163	L	32.4	Very low	31.6	Very low	171 Å²	171	123.8 Å²	123.8	90%	0.895	75%	0.753	S	S	*	*			trans	-147.7	153.5	149.7	-108.9	170.5	0	0	0	109
164	S	30.8	Very low	31.8	Very low	103 Å²	103	122.2 Å²	122.2	72%	0.72	75%	0.75	S	S	*	*			trans	-116.8	149.2	-170.1	-61.9	0	0	0	0	112.9
165	S	31	Very low	32.1	Very low	121 Å²	121	124.8 Å²	124.8	85%	0.846	75%	0.753	S	S	*	*			trans	75.5	147.2	150.4	-58.1	0	0	0	0	120.9
166	A	29.9	Very low	32.2	Very low	86 Å²	86	125.1 Å²	125.1	71%	0.711	76%	0.763	S	S	*	*			trans	91.1	109.1	147.3	0	0	0	0	0	121.5
167	L	32.8	Very low	32.7	Very low	149 Å²	149	123.8 Å²	123.8	78%	0.78	76%	0.761	S	S	*	*				72.9	98	128.6	-61.1	171.5	0	0	0	122
168	I	34.6	Very low	32.9	Very low	155 Å²	155	118.8 Å²	118.8	80%	0.795	75%	0.752	S	S	*	*				74.2	147.7	117.9	-75.5	178.4	0	0	0	119.3
169	P	40.8	Very low	33.1	Very low	110 Å²	110	120.2 Å²	120.2	71%	0.714	76%	0.756	S	S	*	*			trans	-130.7	-157.9	-142.4	45.8	-30.1	0	0	0	115.8
170	S	33.4	Very low	33.3	Very low	107 Å²	107	121.6 Å²	121.6	75%	0.748	75%	0.754	S	S	*	*			trans	87.7	149.9	176.1	83.2	0	0	0	0	114.8
171	N	32.6	Very low	33.7	Very low	135 Å²	135	122.6 Å²	122.6	72%	0.722	76%	0.761	S	S	*	*			cis	-157.6	159.7	13.6	-132.3	-7	0	0	0	112.2
172	I	32.2	Very low	33.9	Very low	140 Å²	140	125 Å²	125	72%	0.718	77%	0.767	S	S	*	*			trans	51.5	139.1	142.8	-67.9	165.5	0	0	0	119.6
173	S	33.7	Very low	34.3	Very low	100 Å²	100	124.7 Å²	124.7	70%	0.699	76%	0.763	S	S	*	*			cis	-162.9	148.5	-6.9	-99.3	0	0	0	0	107.4
174	A	35.1	Very low	34.3	Very low	90 Å²	90	124 Å²	124	74%	0.744	76%	0.76	S	S	*	*				54.3	142.8	79.4	0	0	0	0	0	116.6
175	P	37.5	Very low	34.4	Very low	127 Å²	127	125.4 Å²	125.4	83%	0.825	76%	0.764	S	S	*	*			cis	-136.4	-159.2	-7.6	42	-21.1	0	0	0	115.8
176	C	31.6	Very low	34.3	Very low	116 Å²	116	122.6 Å²	122.6	78%	0.784	75%	0.754	S	S	*	*			trans	-85.3	-165.7	-177.9	-43.8	0	0	0	0	113.2
177	P	38.3	Very low	34.3	Very low	109 Å²	109	127.1 Å²	127.1	71%	0.708	76%	0.763	S	S	*	*			cis	-150.2	-178.6	12	46	-25.2	0	0	0	120.5
178	S	36.4	Very low	34.1	Very low	104 Å²	104	125 Å²	125	73%	0.727	76%	0.76	S	S	*	*			trans	73.1	157.6	149.6	84.5	0	0	0	0	119
179	N	31.9	Very low	33.9	Very low	139 Å²	139	121.6 Å²	121.6	74%	0.743	75%	0.747	S	S	*	*			cis	-161.6	161.3	-11.3	-129.3	-8.7	0	0	0	113.2
180	I	33.2	Very low	33.5	Very low	139 Å²	139	123 Å²	123	71%	0.713	76%	0.756	S	S	*	*			trans	59.5	106.8	151.1	-59.4	158.8	0	0	0	120.3
181	S	38.3	Very low	33.2	Very low	119 Å²	119	126.5 Å²	126.5	83%	0.832	75%	0.754	S	S	*	*				172.4	153.9	123.2	-76.7	0	0	0	0	113.5
182	Q	35.4	Very low	33.1	Very low	190 Å²	190	126.5 Å²	126.5	89%	0.888	76%	0.759	S	S	*	*			trans	-121.9	-174.7	177.8	-65.2	-174	-51.1	0	0	110.1
183	P	39.1	Very low	33	Very low	108 Å²	108	124.9 Å²	124.9	70%	0.701	76%	0.76	S	S	*	*			cis	-130.8	176.1	-13.2	26.3	-4.1	0	0	0	115.3
184	N	31.6	Very low	32.9	Very low	158 Å²	158	126.6 Å²	126.6	85%	0.845	77%	0.772	S	S	*	*			trans	67.3	148.1	156.7	-101.9	-2.9	0	0	0	117.4
185	V	33.2	Very low	32.8	Very low	131 Å²	131	125.6 Å²	125.6	79%	0.794	76%	0.76	S	S	*	*			cis	-139.1	142.9	9.2	-180	0	0	0	0	110.4
186	G	28.7	Very low	32.4	Very low	62 Å²	62	125.4 Å²	125.4	64%	0.639	75%	0.752	S	S	*	*			trans	101.2	143.2	144.6	0	0	0	0	0	119.7
187	M	30.8	Very low	32.9	Very low	182 Å²	182	126.1 Å²	126.1	90%	0.897	75%	0.747	S	S	*	*			trans	66.4	143.8	166.7	-105.8	70.9	90	0	0	121.1
188	S	28.3	Very low	32.9	Very low	105 Å²	105	127.9 Å²	127.9	73%	0.734	75%	0.75	S	S	*	*			trans	85.8	150.7	160.1	83.2	0	0	0	0	120.7
189	T	30.1	Very low	33.1	Very low	82 Å²	82	128.2 Å²	128.2	50%	0.503	75%	0.748	S	S	.	*			trans	69.7	116.6	166.7	65.7	0	0	0	0	120.3	Y191	T189-Y191 VanDerWaalsContact CB-CE2 3.41Å; T189-Y191 HydrophobicContact CG2-CD2 4.41Å; T189-Y191 HydrophobicContact CG2-CE2 3.71Å; T189-Y191 WeakPolarHBondContact OG1-CD2 3.49Å; T189-Y191 WeakPolarHBondContact OG1-CE2 3.37Å
190	P	31.7	Very low	33.4	Very low	139 Å²	139	127.7 Å²	127.7	90%	0.903	75%	0.753	S	S	*	*			trans	-90.7	88.3	156.1	34	-28.9	0	0	0	110.5
191	Y	26.8	Very low	33.7	Very low	181 Å²	181	126.3 Å²	126.3	71%	0.71	75%	0.754	S	S	*	*			trans	-78.9	137.8	168.5	-69.8	-76.2	0	0	0	111.6	T189	T189-Y191 VanDerWaalsContact CB-CE2 3.41Å; T189-Y191 HydrophobicContact CG2-CD2 4.41Å; T189-Y191 HydrophobicContact CG2-CE2 3.71Å; T189-Y191 WeakPolarHBondContact OG1-CD2 3.49Å; T189-Y191 WeakPolarHBondContact OG1-CE2 3.37Å
192	T	30.9	Very low	34.5	Very low	136 Å²	136	122.4 Å²	122.4	83%	0.834	73%	0.733	S	S	*	*			trans	33.8	98.6	149.8	58.6	0	0	0	0	119.1
193	S	29.6	Very low	36.1	Very low	106 Å²	106	114.8 Å²	114.8	74%	0.741	71%	0.705	S	S	*	*			trans	-119.2	102.5	159.4	45.6	0	0	0	0	111.4	S195	S193-S195 VanDerWaalsContact C-N 3.28Å; S193-S195 PolarHBondContact O-N 3.28Å; S193-S195 VanDerWaalsContact O-N 3.12Å
194	S	33.3	Very low	38.2	Very low	135 Å²	135	110 Å²	110	94%	0.944	67%	0.673	S	S	*	*			trans	-85.5	62.9	177.1	172.9	0	0	0	0	111.3
195	S	32.2	Very low	41	Very low	70 Å²	70	104.9 Å²	104.9	49%	0.49	65%	0.647	S	S	.	*			trans	-137	175.5	-176.4	55.9	0	0	0	0	113.2	S193 L197	S193-S195 VanDerWaalsContact C-N 3.28Å; S193-S195 PolarHBondContact O-N 3.28Å; S193-S195 VanDerWaalsContact O-N 3.12Å; S195-L197 PolarHBondContact O-N 3.09Å
196	D	29.7	Very low	43.8	Very low	122 Å²	122	104 Å²	104	65%	0.652	63%	0.63	S	S	*	*			trans	70.3	28.1	157.9	-45.1	-43.2	0	0	0	119.7	N198	D196-N198 PolarHBondContact O-N 3.19Å
197	L	41.2	Very low	46.9	Very low	131 Å²	131	103.5 Å²	103.5	69%	0.686	61%	0.611	S	S	*	*			trans	-90.4	34	156.5	-79.3	176.5	0	0	0	113.6	S195	S195-L197 PolarHBondContact O-N 3.09Å
198	N	38.7	Very low	49.8	Very low	146 Å²	146	98.3 Å²	98.3	78%	0.781	58%	0.584	S	S	*	*			trans	-114.6	16.1	-172.9	-75.7	-24.2	0	0	0	115	D196	D196-N198 PolarHBondContact O-N 3.19Å
199	T	39.9	Very low	53	Low	112 Å²	112	93.3 Å²	93.3	69%	0.687	55%	0.549	S	S	*	.	S	Bend	trans	-91.3	137.1	180	-42.4	0	0	0	0	111.2	C201	T199-C201 VanDerWaalsContact C-N 3.34Å; T199-C201 PolarHBondContact O-N 3.38Å
200	P	38	Very low	56.1	Low	128 Å²	128	94 Å²	94	83%	0.831	54%	0.542	S	S	*	.			trans	-82.5	46.2	-154.3	32.8	-38.8	0	0	0	117.5	G202	P200-G202 PolarHBondContact O-N 3.42Å
201	C	41	Very low	59.1	Low	109 Å²	109	92.7 Å²	92.7	74%	0.736	52%	0.523	S	S	*	.			trans	-79.7	83.5	173	-72.6	0	0	0	0	113	T199 G203	T199-C201 VanDerWaalsContact C-N 3.34Å; T199-C201 PolarHBondContact O-N 3.38Å; C201-G203 PolarHBondContact O-N 2.85Å
202	G	54.4	Low	62.3	Low	38 Å²	38	85.3 Å²	85.3	39%	0.392	50%	0.495	S	S	.	.	S	Bend	trans	64.1	-16.3	147.4	0	0	0	0	0	121.1	R95 P200	R95-G202 PolarHBondContact NH1-O 3.43Å; P200-G202 PolarHBondContact O-N 3.42Å
203	G	68.7	Low	65.5	Low	29 Å²	29	78.9 Å²	78.9	30%	0.299	46%	0.455	S	S	.	.	S	Bend	trans	-106.9	173.7	-169.3	0	0	0	0	0	115.9	C201	C201-G203 PolarHBondContact O-N 2.85Å
204	R	84.3	Confident	68.6	Low	9 Å²	9	77 Å²	77	3%	0.034	44%	0.435	C	S	.	.			trans	-68.7	149.6	170.1	-60.7	-67.1	174.5	-177.2	-3.7	110.6	R95 T97 W98 D102 T121 I124 R125 V209	R95-R204 PolarHBondContact O-NH1 3.17Å; T97-R204 PolarHBondContact O-NH2 3.14Å; W98-R204 HydrophobicContact CH2-CG 4.14Å; W98-R204 HydrophobicContact CZ2-CG 4.45Å; W98-R204 HydrophobicContact CZ3-CG 4.46Å; D102-R204 IonicContact OD2-CZ 3.13Å; D102-R204 VanDerWaalsContact OD2-CZ 3.32Å; D102-R204 IonicContact OD2-NE 3.71Å; D102-R204 PolarHBondContact OD2-NE 2.93Å; D102-R204 VanDerWaalsContact OD2-NE 3.13Å; D102-R204 IonicContact OD2-NH2 3.84Å; D102-R204 PolarHBondContact OD2-NH2 3.09Å; T121-R204 WeakPolarHBondContact CG2-O 3.49Å; I124-R204 HydrophobicContact CG2-CB 4.19Å; I124-R204 HydrophobicContact CG2-CG 4.04Å; R125-R204 PolarHBondContact NE-O 3.42Å; R204-V209 HydrophobicContact CB-CG2 4.24Å
205	T	89.2	Confident	71.5	Confident	50 Å²	50	76.6 Å²	76.6	31%	0.307	42%	0.418	S	S	.	.			trans	-92.4	161.1	177.2	73.2	0	0	0	0	112.3	E207 Q208 V209	T205-E207 PolarHBondContact O-N 2.97Å; T205-Q208 VanDerWaalsContact N-OE1 3.16Å; T205-Q208 PolarHBondContact O-N 3.33Å; T205-Q208 VanDerWaalsContact OG1-CG 3.3Å; T205-Q208 WeakPolarHBondContact OG1-CG 3.04Å; T205-Q208 PolarHBondContact OG1-N 3.38Å; T205-V209 WeakPolarHBondContact O-CG2 3.49Å; T205-V209 PolarHBondContact O-N 3.44Å
206	R	93	Very high	74.5	Confident	112 Å²	112	73.8 Å²	73.8	42%	0.423	40%	0.398	S	S	.	.	H	α-helix	trans	-55.9	-38.4	178.3	-166.6	-172.4	59.1	54.9	3.1	112.2	F117 T121 R210	F117-R206 HydrophobicContact CB-CG 4.07Å; T121-R206 WeakPolarHBondContact OG1-CA 3.36Å; R206-R210 WeakPolarHBondContact O-CB 3.39Å; R206-R210 PolarHBondContact O-N 3.12Å
207	E	92.3	Very high	77.6	Confident	51 Å²	51	69.1 Å²	69.1	24%	0.238	37%	0.371	C	S	.	.	H	α-helix	trans	-79.5	-35.5	-178.6	-148.6	57.3	-150.1	0	0	112.3	T205 V209 R210 F211	T205-E207 PolarHBondContact O-N 2.97Å; E207-V209 VanDerWaalsContact C-N 3.3Å; E207-V209 PolarHBondContact O-N 3.38Å; E207-R210 PolarHBondContact O-N 2.79Å; E207-R210 VanDerWaalsContact OE1-CD 3.3Å; E207-R210 WeakPolarHBondContact OE1-CD 3.35Å; E207-R210 IonicContact OE1-CZ 2.67Å; E207-R210 IonicContact OE1-NE 3.7Å; E207-R210 IonicContact OE1-NH1 3.77Å; E207-R210 PolarHBondContact OE1-NH1 3.23Å; E207-R210 IonicContact OE2-NH1 3.57Å; E207-F211 HydrophobicContact CG-CD2 4.15Å; E207-F211 HydrophobicContact CG-CE2 3.75Å; E207-F211 HydrophobicContact CG-CZ 4.36Å; E207-F211 WeakPolarHBondContact O-CB 3.48Å; E207-F211 WeakPolarHBondContact O-CD2 3.48Å; E207-F211 WeakPolarHBondContact O-CG 3.22Å; E207-F211 PolarHBondContact O-N 2.91Å
208	Q	92.8	Very high	80.1	Confident	74 Å²	74	67.2 Å²	67.2	35%	0.346	36%	0.359	S	S	.	.	H	α-helix	trans	-59	-41.7	168.8	-74.5	171.2	1.8	0	0	111.9	T205 F212	T205-Q208 VanDerWaalsContact N-OE1 3.16Å; T205-Q208 PolarHBondContact O-N 3.33Å; T205-Q208 VanDerWaalsContact OG1-CG 3.3Å; T205-Q208 WeakPolarHBondContact OG1-CG 3.04Å; T205-Q208 PolarHBondContact OG1-N 3.38Å; Q208-F212 WeakPolarHBondContact O-CB 3.46Å; Q208-F212 PolarHBondContact O-N 2.97Å
209	V	95	Very high	82.7	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-63.2	-45	175.1	165.4	0	0	0	0	111.2	W98 F106 F117 I120 I124 R204 T205 E207 F212 Y213	W98-V209 HydrophobicContact CH2-CG2 4.19Å; F106-V209 HydrophobicContact CD2-CG1 4.48Å; F106-V209 HydrophobicContact CE2-CG1 4.33Å; F117-V209 HydrophobicContact CD1-CG1 4.35Å; I120-V209 HydrophobicContact CB-CG1 3.94Å; I120-V209 HydrophobicContact CG2-CG1 3.41Å; I120-V209 VanDerWaalsContact CG2-CG1 3.41Å; I120-V209 HydrophobicContact CG2-CG2 4.49Å; I124-V209 HydrophobicContact CD1-CG2 3.86Å; R204-V209 HydrophobicContact CB-CG2 4.24Å; T205-V209 WeakPolarHBondContact O-CG2 3.49Å; T205-V209 PolarHBondContact O-N 3.44Å; E207-V209 VanDerWaalsContact C-N 3.3Å; E207-V209 PolarHBondContact O-N 3.38Å; V209-F212 PolarHBondContact O-N 2.87Å; V209-Y213 WeakPolarHBondContact O-CB 3.24Å; V209-Y213 PolarHBondContact O-N 2.89Å
210	R	95.3	Very high	85.4	Confident	95 Å²	95	60.2 Å²	60.2	36%	0.358	31%	0.312	S	S	.	.	H	α-helix	trans	-62.8	-46.4	176.7	-178.2	169.6	173.9	-133.5	11.4	112.1	F117 R206 E207 Y213 Q214	F117-R210 HydrophobicContact CD1-CB 4.07Å; F117-R210 HydrophobicContact CD1-CG 4.42Å; F117-R210 HydrophobicContact CD2-CB 4.48Å; F117-R210 HydrophobicContact CD2-CG 4.3Å; F117-R210 HydrophobicContact CE1-CB 4.29Å; F117-R210 HydrophobicContact CE1-CG 4.24Å; F117-R210 HydrophobicContact CE2-CG 4.11Å; F117-R210 HydrophobicContact CG-CB 4.18Å; F117-R210 HydrophobicContact CG-CG 4.46Å; F117-R210 HydrophobicContact CZ-CG 4.09Å; R206-R210 WeakPolarHBondContact O-CB 3.39Å; R206-R210 PolarHBondContact O-N 3.12Å; E207-R210 PolarHBondContact O-N 2.79Å; E207-R210 VanDerWaalsContact OE1-CD 3.3Å; E207-R210 WeakPolarHBondContact OE1-CD 3.35Å; E207-R210 IonicContact OE1-CZ 2.67Å; E207-R210 IonicContact OE1-NE 3.7Å; E207-R210 IonicContact OE1-NH1 3.77Å; E207-R210 PolarHBondContact OE1-NH1 3.23Å; E207-R210 IonicContact OE2-NH1 3.57Å; R210-Y213 PolarHBondContact O-N 2.82Å; R210-Q214 WeakPolarHBondContact O-CB 3.48Å; R210-Q214 WeakPolarHBondContact O-CG 3.44Å; R210-Q214 PolarHBondContact O-N 2.93Å
211	F	94.6	Very high	88	Confident	112 Å²	112	59.7 Å²	59.7	49%	0.491	29%	0.293	S	S	.	.	H	α-helix	trans	-61.2	-44.8	175	-76.3	-53.7	0	0	0	112.2	E207 Y213 Q214 Q215	E207-F211 HydrophobicContact CG-CD2 4.15Å; E207-F211 HydrophobicContact CG-CE2 3.75Å; E207-F211 HydrophobicContact CG-CZ 4.36Å; E207-F211 WeakPolarHBondContact O-CB 3.48Å; E207-F211 WeakPolarHBondContact O-CD2 3.48Å; E207-F211 WeakPolarHBondContact O-CG 3.22Å; E207-F211 PolarHBondContact O-N 2.91Å; F211-Y213 PolarHBondContact O-N 3.08Å; F211-Q214 PolarHBondContact O-N 3.04Å; F211-Q215 WeakPolarHBondContact O-CB 3.43Å; F211-Q215 WeakPolarHBondContact O-CG 3.42Å; F211-Q215 PolarHBondContact O-N 3.21Å
212	F	95.1	Very high	90.4	Very high	27 Å²	27	64.7 Å²	64.7	12%	0.118	30%	0.296	C	S	.	.	H	α-helix	trans	-66	-38.1	179	-175.2	-105.2	0	0	0	112.7	W98 R103 F106 Q208 V209 T216	W98-F212 HydrophobicContact CB-CE2 4.37Å; W98-F212 AromaticContact CD1-CD2 3.74Å; W98-F212 HydrophobicContact CD2-CB 4.34Å; W98-F212 HydrophobicContact CD2-CD1 4.14Å; W98-F212 AromaticContact CD2-CD2 3.8Å; W98-F212 HydrophobicContact CD2-CD2 3.8Å; W98-F212 HydrophobicContact CD2-CE1 4.46Å; W98-F212 HydrophobicContact CD2-CE2 4.15Å; W98-F212 AromaticContact CD2-CG 3.81Å; W98-F212 HydrophobicContact CD2-CG 3.81Å; W98-F212 HydrophobicContact CD2-CZ 4.48Å; W98-F212 AromaticContact CE2-CD2 3.74Å; W98-F212 AromaticContact CE2-CG 3.51Å; W98-F212 HydrophobicContact CE3-CD1 4.07Å; W98-F212 HydrophobicContact CE3-CD2 4.49Å; W98-F212 HydrophobicContact CE3-CE1 4.24Å; W98-F212 HydrophobicContact CE3-CG 4.22Å; W98-F212 AromaticContact CG-CD2 3.84Å; W98-F212 HydrophobicContact CG-CD2 3.84Å; W98-F212 AromaticContact CG-CE2 4Å; W98-F212 HydrophobicContact CG-CE2 4Å; W98-F212 HydrophobicContact CG-CG 4.34Å; W98-F212 HydrophobicContact CH2-CB 4.09Å; W98-F212 HydrophobicContact CH2-CD1 4.09Å; W98-F212 HydrophobicContact CH2-CG 4.17Å; W98-F212 HydrophobicContact CZ2-CB 3.39Å; W98-F212 HydrophobicContact CZ2-CD1 4.12Å; W98-F212 HydrophobicContact CZ2-CD2 4.41Å; W98-F212 AromaticContact CZ2-CG 3.72Å; W98-F212 HydrophobicContact CZ2-CG 3.72Å; W98-F212 HydrophobicContact CZ3-CD1 4.07Å; W98-F212 HydrophobicContact CZ3-CG 4.4Å; W98-F212 AromaticContact NE1-CD2 3.65Å; W98-F212 AromaticContact NE1-CG 3.82Å; R103-F212 HydrophobicContact CG-CE1 4.24Å; R103-F212 HydrophobicContact CG-CE2 4.44Å; R103-F212 HydrophobicContact CG-CZ 3.75Å; F106-F212 AromaticContact CD1-CD1 3.77Å; F106-F212 HydrophobicContact CD1-CD1 3.77Å; F106-F212 AromaticContact CD1-CE1 3.54Å; F106-F212 HydrophobicContact CD1-CE1 3.54Å; F106-F212 AromaticContact CD2-CD1 3.89Å; F106-F212 HydrophobicContact CD2-CD1 3.89Å; F106-F212 HydrophobicContact CD2-CE1 4.46Å; F106-F212 AromaticContact CE1-CD1 3.8Å; F106-F212 HydrophobicContact CE1-CD1 3.8Å; F106-F212 AromaticContact CE1-CE1 3.77Å; F106-F212 HydrophobicContact CE1-CE1 3.77Å; F106-F212 AromaticContact CE2-CD1 3.92Å; F106-F212 HydrophobicContact CE2-CD1 3.92Å; F106-F212 AromaticContact CG-CD1 3.82Å; F106-F212 HydrophobicContact CG-CD1 3.82Å; F106-F212 AromaticContact CG-CE1 3.92Å; F106-F212 HydrophobicContact CG-CE1 3.92Å; F106-F212 AromaticContact CZ-CD1 3.88Å; F106-F212 HydrophobicContact CZ-CD1 3.88Å; F106-F212 HydrophobicContact CZ-CE1 4.33Å; Q208-F212 WeakPolarHBondContact O-CB 3.46Å; Q208-F212 PolarHBondContact O-N 2.97Å; V209-F212 PolarHBondContact O-N 2.87Å; F212-T216 WeakPolarHBondContact O-CB 3.5Å; F212-T216 PolarHBondContact O-N 2.98Å; F212-T216 PolarHBondContact O-OG1 3.11Å
213	Y	96.9	Very high	92.3	Very high	0 Å²	0	65.8 Å²	65.8	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-60.7	-48.5	170.8	-178.2	-75.1	0	0	0	111.1	F106 V110 R115 F117 V209 R210 F211 T216 W217 E236 I240	F106-Y213 HydrophobicContact CE2-CD2 4.38Å; F106-Y213 AromaticContact CZ-CD2 3.89Å; F106-Y213 HydrophobicContact CZ-CD2 3.89Å; F106-Y213 HydrophobicContact CZ-CG 4.22Å; V110-Y213 HydrophobicContact CG2-CD2 4.17Å; V110-Y213 HydrophobicContact CG2-CE2 4.4Å; R115-Y213 HydrophobicContact CG-CE1 4.46Å; F117-Y213 AromaticContact CE1-CD1 3.86Å; F117-Y213 HydrophobicContact CE1-CD1 3.86Å; F117-Y213 AromaticContact CE1-CD2 3.99Å; F117-Y213 HydrophobicContact CE1-CD2 3.99Å; F117-Y213 HydrophobicContact CE1-CE1 4.36Å; F117-Y213 HydrophobicContact CE1-CE2 4.46Å; F117-Y213 AromaticContact CE1-CG 3.67Å; F117-Y213 HydrophobicContact CE1-CG 3.67Å; F117-Y213 HydrophobicContact CZ-CD1 4.18Å; F117-Y213 HydrophobicContact CZ-CE1 4.41Å; F117-Y213 HydrophobicContact CZ-CG 4.44Å; V209-Y213 WeakPolarHBondContact O-CB 3.24Å; V209-Y213 PolarHBondContact O-N 2.89Å; R210-Y213 PolarHBondContact O-N 2.82Å; F211-Y213 PolarHBondContact O-N 3.08Å; Y213-T216 WeakPolarHBondContact O-CB 3.33Å; Y213-T216 PolarHBondContact O-N 3.47Å; Y213-W217 PolarHBondContact O-N 3.39Å; Y213-E236 HydrophobicContact CE1-CB 4.23Å; Y213-E236 VanDerWaalsContact CE1-OE2 3.24Å; Y213-E236 WeakPolarHBondContact CE1-OE2 3.44Å; Y213-E236 WeakPolarHBondContact OH-CB 3.27Å; Y213-E236 PolarHBondContact OH-OE2 2.85Å; Y213-I240 HydrophobicContact CD1-CD1 3.9Å; Y213-I240 HydrophobicContact CD2-CD1 3.85Å; Y213-I240 HydrophobicContact CE1-CD1 3.62Å; Y213-I240 HydrophobicContact CE2-CD1 3.59Å; Y213-I240 HydrophobicContact CG-CD1 4Å; Y213-I240 VanDerWaalsContact CZ-CD1 3.47Å
214	Q	95.4	Very high	93.4	Very high	67 Å²	67	64.9 Å²	64.9	31%	0.313	28%	0.278	S	S	.	.	H	α-helix	trans	-64	-43.2	179.2	-75.3	174.9	-19.6	0	0	112.5	R210 F211 T216 W217 H218	R210-Q214 WeakPolarHBondContact O-CB 3.48Å; R210-Q214 WeakPolarHBondContact O-CG 3.44Å; R210-Q214 PolarHBondContact O-N 2.93Å; F211-Q214 PolarHBondContact O-N 3.04Å; Q214-T216 VanDerWaalsContact C-N 3.32Å; Q214-T216 PolarHBondContact O-N 3.48Å; Q214-W217 WeakPolarHBondContact O-CB 3.47Å; Q214-W217 PolarHBondContact O-N 3.38Å; Q214-H218 PolarHBondContact O-N 3.5Å; Q214-H218 PolarHBondContact O-ND1 3.19Å
215	Q	94.3	Very high	93.7	Very high	126 Å²	126	72.6 Å²	72.6	59%	0.589	31%	0.311	S	S	*	.	H	α-helix	trans	-61	-41.9	174.1	-73.4	175.9	2.3	0	0	111.3	F211 H218 K219	F211-Q215 WeakPolarHBondContact O-CB 3.43Å; F211-Q215 WeakPolarHBondContact O-CG 3.42Å; F211-Q215 PolarHBondContact O-N 3.21Å; Q215-H218 PolarHBondContact O-N 3.24Å; Q215-K219 PolarHBondContact O-N 2.84Å
216	T	94.8	Very high	93.8	Very high	12 Å²	12	71.9 Å²	71.9	7%	0.074	30%	0.304	C	S	.	.	H	α-helix	trans	-62.6	-44.4	175.3	-59.6	0	0	0	0	111.2	F107 F212 Y213 Q214 K219 V220 I240 Y243	F107-T216 HydrophobicContact CE1-CG2 4.19Å; F107-T216 HydrophobicContact CZ-CG2 4.29Å; F212-T216 WeakPolarHBondContact O-CB 3.5Å; F212-T216 PolarHBondContact O-N 2.98Å; F212-T216 PolarHBondContact O-OG1 3.11Å; Y213-T216 WeakPolarHBondContact O-CB 3.33Å; Y213-T216 PolarHBondContact O-N 3.47Å; Q214-T216 VanDerWaalsContact C-N 3.32Å; Q214-T216 PolarHBondContact O-N 3.48Å; T216-K219 PolarHBondContact O-N 3.11Å; T216-V220 WeakPolarHBondContact O-CG2 3.39Å; T216-V220 PolarHBondContact O-N 2.96Å; T216-I240 HydrophobicContact CG2-CG1 4.25Å; T216-I240 HydrophobicContact CG2-CG2 4.35Å; T216-Y243 HydrophobicContact CG2-CD1 3.82Å; T216-Y243 HydrophobicContact CG2-CE1 3.81Å
217	W	95.2	Very high	93.6	Very high	23 Å²	23	68.6 Å²	68.6	9%	0.087	30%	0.298	C	S	.	.	H	α-helix	trans	-59.6	-48.2	173.6	173	-132.2	0	0	0	112.3	Y213 Q214 K219 V220 R221 F226 R235 E236 A239 I240	Y213-W217 PolarHBondContact O-N 3.39Å; Q214-W217 WeakPolarHBondContact O-CB 3.47Å; Q214-W217 PolarHBondContact O-N 3.38Å; W217-K219 PolarHBondContact O-N 3.02Å; W217-V220 PolarHBondContact O-N 3.41Å; W217-V220 VanDerWaalsContact O-N 3.08Å; W217-R221 HydrophobicContact CD2-CB 3.89Å; W217-R221 HydrophobicContact CE3-CB 3.79Å; W217-R221 HydrophobicContact CH2-CB 3.67Å; W217-R221 HydrophobicContact CZ2-CB 3.77Å; W217-R221 HydrophobicContact CZ3-CB 3.67Å; W217-R221 WeakPolarHBondContact O-CB 3.44Å; W217-R221 PolarHBondContact O-N 2.83Å; W217-F226 HydrophobicContact CH2-CE2 4.06Å; W217-F226 HydrophobicContact CZ3-CE2 4.21Å; W217-R235 HydrophobicContact CH2-CB 4.06Å; W217-E236 HydrophobicContact CD2-CB 4.4Å; W217-E236 HydrophobicContact CD2-CG 3.67Å; W217-E236 HydrophobicContact CE3-CB 4.46Å; W217-E236 HydrophobicContact CE3-CG 4.17Å; W217-E236 HydrophobicContact CG-CG 3.93Å; W217-E236 HydrophobicContact CH2-CG 4.49Å; W217-E236 HydrophobicContact CZ2-CG 4.02Å; W217-A239 HydrophobicContact CE3-CB 4.01Å; W217-A239 HydrophobicContact CZ3-CB 3.6Å; W217-I240 HydrophobicContact CB-CD1 4.28Å
218	H	94.1	Very high	93.3	Very high	92 Å²	92	74 Å²	74	43%	0.426	32%	0.323	S	S	.	.	H	α-helix	trans	-61.5	-30.6	179.3	-78	78.7	0	0	0	113.1	Q214 Q215 R221	Q214-H218 PolarHBondContact O-N 3.5Å; Q214-H218 PolarHBondContact O-ND1 3.19Å; Q215-H218 PolarHBondContact O-N 3.24Å; H218-R221 PolarHBondContact CD2-NH1 3.43Å; H218-R221 PolarHBondContact NE2-NH1 2.94Å
219	K	93.1	Very high	93	Very high	111 Å²	111	76.7 Å²	76.7	48%	0.483	34%	0.335	S	S	.	.	H	α-helix	trans	-74.9	-36.1	173.3	-177.3	162.6	-175.3	155.4	0	113.2	Q215 T216 W217	Q215-K219 PolarHBondContact O-N 2.84Å; T216-K219 PolarHBondContact O-N 3.11Å; W217-K219 PolarHBondContact O-N 3.02Å
220	V	94.8	Very high	92.8	Very high	0 Å²	0	76.7 Å²	76.7	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-86.2	-39.2	-176.1	177	0	0	0	0	112.7	T216 W217 R222 Y223 T224 A239 Y243 L254 L262	T216-V220 WeakPolarHBondContact O-CG2 3.39Å; T216-V220 PolarHBondContact O-N 2.96Å; W217-V220 PolarHBondContact O-N 3.41Å; W217-V220 VanDerWaalsContact O-N 3.08Å; V220-R222 PolarHBondContact O-N 3.1Å; V220-Y223 PolarHBondContact O-N 3.13Å; V220-T224 HydrophobicContact CG1-CG2 3.94Å; V220-A239 HydrophobicContact CG1-CB 3.78Å; V220-Y243 HydrophobicContact CG2-CD1 3.7Å; V220-Y243 HydrophobicContact CG2-CD2 3.81Å; V220-Y243 HydrophobicContact CG2-CE1 4.14Å; V220-Y243 HydrophobicContact CG2-CE2 4.26Å; V220-Y243 HydrophobicContact CG2-CG 3.5Å; V220-L254 HydrophobicContact CG2-CD2 4.1Å; V220-L262 HydrophobicContact CG1-CD2 3.61Å
221	R	93.9	Very high	92.7	Very high	117 Å²	117	74.5 Å²	74.5	44%	0.442	33%	0.334	S	S	.	.	G	3₁₀ helix	trans	-55.9	-28	-169.1	77.5	-179.7	-165.5	-157.4	1.2	114.8	W217 H218 Y223 T224	W217-R221 HydrophobicContact CD2-CB 3.89Å; W217-R221 HydrophobicContact CE3-CB 3.79Å; W217-R221 HydrophobicContact CH2-CB 3.67Å; W217-R221 HydrophobicContact CZ2-CB 3.77Å; W217-R221 HydrophobicContact CZ3-CB 3.67Å; W217-R221 WeakPolarHBondContact O-CB 3.44Å; W217-R221 PolarHBondContact O-N 2.83Å; H218-R221 PolarHBondContact CD2-NH1 3.43Å; H218-R221 PolarHBondContact NE2-NH1 2.94Å; R221-Y223 PolarHBondContact O-N 3.32Å; R221-T224 PolarHBondContact O-N 3.08Å; R221-T224 PolarHBondContact O-OG1 3.4Å
222	R	92.2	Very high	92.6	Very high	213 Å²	213	74.2 Å²	74.2	80%	0.804	33%	0.334	S	S	*	.	G	3₁₀ helix	trans	-65.2	-17.3	178.6	-56.9	-172.5	-173	-146.2	1.7	113.4	V220	V220-R222 PolarHBondContact O-N 3.1Å
223	Y	93	Very high	92.5	Very high	62 Å²	62	77 Å²	77	24%	0.243	35%	0.347	C	S	.	.	G	3₁₀ helix	trans	-111.3	-9.9	-174.5	-61	-64.5	0	0	0	113.9	V220 R221 L254	V220-Y223 PolarHBondContact O-N 3.13Å; R221-Y223 PolarHBondContact O-N 3.32Å; Y223-L254 HydrophobicContact CD2-CD2 3.41Å; Y223-L254 VanDerWaalsContact CD2-CD2 3.41Å; Y223-L254 HydrophobicContact CD2-CG 3.63Å; Y223-L254 HydrophobicContact CE2-CB 4.25Å; Y223-L254 HydrophobicContact CE2-CD2 3.74Å; Y223-L254 HydrophobicContact CE2-CG 3.63Å; Y223-L254 WeakPolarHBondContact CE2-O 3.5Å; Y223-L254 HydrophobicContact CG-CD2 4.37Å; Y223-L254 HydrophobicContact CG-CG 4.4Å; Y223-L254 VanDerWaalsContact CZ-O 3.23Å; Y223-L254 PolarHBondContact OH-O 2.88Å
224	T	91.7	Very high	92.4	Very high	9 Å²	9	77 Å²	77	6%	0.055	35%	0.347	C	S	.	.			trans	-113.3	107.3	-175.7	50.7	0	0	0	0	109.7	V220 R221 F226 A239 L262 N263 V266	V220-T224 HydrophobicContact CG1-CG2 3.94Å; R221-T224 PolarHBondContact O-N 3.08Å; R221-T224 PolarHBondContact O-OG1 3.4Å; T224-F226 WeakPolarHBondContact O-CD2 3.4Å; T224-F226 WeakPolarHBondContact OG1-CE2 3.27Å; T224-A239 HydrophobicContact CG2-CB 4.31Å; T224-L262 HydrophobicContact CG2-CD2 4.37Å; T224-L262 HydrophobicContact CG2-CG 4.16Å; T224-N263 WeakPolarHBondContact CA-OD1 3.46Å; T224-V266 HydrophobicContact CG2-CG2 4.36Å
225	K	91.2	Very high	92.3	Very high	171 Å²	171	77 Å²	77	74%	0.743	34%	0.344	S	S	*	.			trans	-78.7	128.4	172.1	-61.3	-175.6	-178.9	-176.7	0	108.4	N263 H267	K225-N263 PolarHBondContact N-OD1 3.41Å; K225-N263 PolarHBondContact O-OD1 2.95Å; K225-H267 PolarHBondContact O-NE2 3Å
226	F	91.1	Very high	92.4	Very high	35 Å²	35	71.3 Å²	71.3	15%	0.154	32%	0.317	C	S	.	.			trans	-125.4	143.1	173.4	-68.8	-87.4	0	0	0	107.9	W217 T224 R235 A239 V266 L407	W217-F226 HydrophobicContact CH2-CE2 4.06Å; W217-F226 HydrophobicContact CZ3-CE2 4.21Å; T224-F226 WeakPolarHBondContact O-CD2 3.4Å; T224-F226 WeakPolarHBondContact OG1-CE2 3.27Å; F226-R235 HydrophobicContact CB-CG 3.99Å; F226-R235 HydrophobicContact CD1-CB 3.94Å; F226-R235 HydrophobicContact CD1-CG 3.76Å; F226-R235 HydrophobicContact CD2-CB 3.88Å; F226-R235 HydrophobicContact CD2-CG 4.11Å; F226-R235 HydrophobicContact CE1-CB 3.92Å; F226-R235 HydrophobicContact CE1-CG 4.24Å; F226-R235 HydrophobicContact CE2-CB 3.83Å; F226-R235 HydrophobicContact CG-CB 3.94Å; F226-R235 HydrophobicContact CG-CG 3.71Å; F226-R235 HydrophobicContact CZ-CB 3.87Å; F226-R235 WeakPolarHBondContact CZ-O 3.22Å; F226-A239 HydrophobicContact CE2-CB 4.39Å; F226-A239 HydrophobicContact CZ-CB 4.16Å; F226-V266 HydrophobicContact CE1-CG1 3.88Å; F226-V266 HydrophobicContact CZ-CG1 4.09Å; F226-L407 HydrophobicContact CD1-CD1 4.28Å; F226-L407 HydrophobicContact CD1-CD2 3.45Å; F226-L407 VanDerWaalsContact CD1-CD2 3.45Å; F226-L407 HydrophobicContact CE1-CD1 4.32Å; F226-L407 HydrophobicContact CE1-CD2 3.73Å
227	P	89.2	Confident	92.5	Very high	44 Å²	44	70.9 Å²	70.9	29%	0.286	32%	0.315	S	S	.	.			trans	-74	161.5	169.6	39	-37.2	0	0	0	109.2	E229 V230 L411	P227-E229 VanDerWaalsContact CB-OE2 3.23Å; P227-E229 WeakPolarHBondContact CB-OE2 3.49Å; P227-V230 HydrophobicContact CG-CG2 3.95Å; P227-L411 HydrophobicContact CG-CD1 4.01Å; P227-L411 HydrophobicContact CG-CD2 3.99Å
228	E	85	Confident	92.5	Very high	164 Å²	164	69.8 Å²	69.8	77%	0.766	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.1	-27.7	-159.5	-173.7	149.6	-152.3	0	0	113.8	V230 R235	E228-V230 PolarHBondContact O-N 3.33Å; E228-R235 PolarHBondContact O-NH2 3.49Å
229	E	87.9	Confident	92.7	Very high	130 Å²	130	65.4 Å²	65.4	61%	0.607	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-21.8	-179	-41.4	74.8	-166	0	0	112.2	P227 P231	P227-E229 VanDerWaalsContact CB-OE2 3.23Å; P227-E229 WeakPolarHBondContact CB-OE2 3.49Å; E229-P231 WeakPolarHBondContact O-CD 3.42Å
230	V	90.9	Very high	92.8	Very high	1 Å²	1	60.1 Å²	60.1	1%	0.006	27%	0.268	C	S	.	.	S	Bend	trans	-73.3	122.5	-179	-179.2	0	0	0	0	110	P227 E228 V234 R235 L407 Y410 L411	P227-V230 HydrophobicContact CG-CG2 3.95Å; E228-V230 PolarHBondContact O-N 3.33Å; V230-V234 HydrophobicContact CG1-CB 3.8Å; V230-V234 HydrophobicContact CG1-CG1 3.71Å; V230-R235 HydrophobicContact CB-CG 4.11Å; V230-R235 HydrophobicContact CG1-CG 3.66Å; V230-R235 VanDerWaalsContact O-CZ 3.29Å; V230-R235 PolarHBondContact O-NE 3.26Å; V230-R235 PolarHBondContact O-NH2 3.17Å; V230-L407 HydrophobicContact CG1-CD1 4.27Å; V230-L407 HydrophobicContact CG2-CD1 4.35Å; V230-Y410 HydrophobicContact CG1-CE1 4.04Å; V230-Y410 HydrophobicContact CG2-CE1 4.34Å; V230-L411 HydrophobicContact CG2-CD2 3.59Å
231	P	92.4	Very high	92.9	Very high	49 Å²	49	60.2 Å²	60.2	32%	0.318	27%	0.268	S	S	.	.			trans	-59.6	140.7	178.5	-25.4	34.9	0	0	0	112.7	E229 H233 V234 R235	E229-P231 WeakPolarHBondContact O-CD 3.42Å; P231-H233 PolarHBondContact O-N 2.86Å; P231-H233 VanDerWaalsContact O-N 3.08Å; P231-V234 HydrophobicContact CB-CG2 4.17Å; P231-V234 HydrophobicContact CG-CG2 4.36Å; P231-V234 WeakPolarHBondContact O-CA 3.25Å; P231-V234 VanDerWaalsContact O-CB 3.32Å; P231-V234 WeakPolarHBondContact O-CB 3.38Å; P231-V234 PolarHBondContact O-N 3.4Å; P231-R235 PolarHBondContact O-N 3.27Å
232	Q	92	Very high	93	Very high	106 Å²	106	54.6 Å²	54.6	50%	0.495	25%	0.247	S	C	.	.	H	α-helix	trans	-53.3	-38.2	-175.3	178.5	179.3	-23.7	0	0	113.4	V234 R235 E236	Q232-V234 VanDerWaalsContact C-N 3.26Å; Q232-V234 PolarHBondContact O-N 3.08Å; Q232-R235 PolarHBondContact O-N 3.38Å; Q232-E236 HydrophobicContact CG-CG 4.22Å; Q232-E236 WeakPolarHBondContact CG-OE1 3.47Å; Q232-E236 PolarHBondContact NE2-OE1 3.44Å; Q232-E236 WeakPolarHBondContact O-CG 3.38Å; Q232-E236 PolarHBondContact O-N 3.36Å
233	H	93.1	Very high	93.2	Very high	84 Å²	84	45.7 Å²	45.7	39%	0.389	21%	0.213	S	C	.	.	H	α-helix	trans	-63	-33.1	179.1	71.3	-99	0	0	0	112.6	P231 V237	P231-H233 PolarHBondContact O-N 2.86Å; P231-H233 VanDerWaalsContact O-N 3.08Å; H233-V237 WeakPolarHBondContact O-CG2 3.3Å; H233-V237 PolarHBondContact O-N 3.33Å
234	V	94.3	Very high	93.3	Very high	1 Å²	1	42.8 Å²	42.8	1%	0.006	20%	0.202	C	C	.	.	H	α-helix	trans	-69.3	-48.4	175.1	179.2	0	0	0	0	109.9	V230 P231 Q232 E236 V237 Y238 L293 Y410	V230-V234 HydrophobicContact CG1-CB 3.8Å; V230-V234 HydrophobicContact CG1-CG1 3.71Å; P231-V234 HydrophobicContact CB-CG2 4.17Å; P231-V234 HydrophobicContact CG-CG2 4.36Å; P231-V234 WeakPolarHBondContact O-CA 3.25Å; P231-V234 VanDerWaalsContact O-CB 3.32Å; P231-V234 WeakPolarHBondContact O-CB 3.38Å; P231-V234 PolarHBondContact O-N 3.4Å; Q232-V234 VanDerWaalsContact C-N 3.26Å; Q232-V234 PolarHBondContact O-N 3.08Å; V234-E236 VanDerWaalsContact C-N 3.35Å; V234-E236 PolarHBondContact O-N 3.38Å; V234-V237 PolarHBondContact O-N 3.31Å; V234-Y238 HydrophobicContact CG1-CD2 3.56Å; V234-Y238 HydrophobicContact CG1-CE2 3.71Å; V234-Y238 WeakPolarHBondContact O-CB 3.32Å; V234-Y238 WeakPolarHBondContact O-CD2 3.28Å; V234-Y238 PolarHBondContact O-N 3.32Å; V234-L293 HydrophobicContact CG1-CD1 4.34Å; V234-L293 HydrophobicContact CG2-CD1 4.48Å; V234-L293 HydrophobicContact CG2-CD2 4.18Å; V234-Y410 HydrophobicContact CG1-CD1 4.13Å; V234-Y410 HydrophobicContact CG1-CE1 3.76Å; V234-Y410 HydrophobicContact CG1-CE2 4.2Å; V234-Y410 HydrophobicContact CG1-CG 4.49Å
235	R	95	Very high	93.4	Very high	67 Å²	67	43.4 Å²	43.4	25%	0.253	21%	0.206	S	C	.	.	H	α-helix	trans	-55.3	-48.7	177.3	-54.1	-175	-143.8	176.7	2.5	111.9	W217 F226 E228 V230 P231 Q232 A239	W217-R235 HydrophobicContact CH2-CB 4.06Å; F226-R235 HydrophobicContact CB-CG 3.99Å; F226-R235 HydrophobicContact CD1-CB 3.94Å; F226-R235 HydrophobicContact CD1-CG 3.76Å; F226-R235 HydrophobicContact CD2-CB 3.88Å; F226-R235 HydrophobicContact CD2-CG 4.11Å; F226-R235 HydrophobicContact CE1-CB 3.92Å; F226-R235 HydrophobicContact CE1-CG 4.24Å; F226-R235 HydrophobicContact CE2-CB 3.83Å; F226-R235 HydrophobicContact CG-CB 3.94Å; F226-R235 HydrophobicContact CG-CG 3.71Å; F226-R235 HydrophobicContact CZ-CB 3.87Å; F226-R235 WeakPolarHBondContact CZ-O 3.22Å; E228-R235 PolarHBondContact O-NH2 3.49Å; V230-R235 HydrophobicContact CB-CG 4.11Å; V230-R235 HydrophobicContact CG1-CG 3.66Å; V230-R235 VanDerWaalsContact O-CZ 3.29Å; V230-R235 PolarHBondContact O-NE 3.26Å; V230-R235 PolarHBondContact O-NH2 3.17Å; P231-R235 PolarHBondContact O-N 3.27Å; Q232-R235 PolarHBondContact O-N 3.38Å; R235-A239 VanDerWaalsContact O-CB 3.29Å; R235-A239 WeakPolarHBondContact O-CB 3.44Å; R235-A239 PolarHBondContact O-N 3.49Å
236	E	95.7	Very high	93.5	Very high	6 Å²	6	35.4 Å²	35.4	3%	0.028	17%	0.171	C	C	.	.	H	α-helix	trans	-60.3	-50.2	179.8	-72.8	174.6	-171.6	0	0	112.3	R115 Y213 W217 Q232 V234 A239 I240	R115-E236 IonicContact CZ-OE1 2.69Å; R115-E236 IonicContact CZ-OE2 2.86Å; R115-E236 IonicContact NE-OE1 3.32Å; R115-E236 IonicContact NE-OE2 3.8Å; R115-E236 PolarHBondContact NE-OE2 2.9Å; R115-E236 IonicContact NH2-OE1 3.89Å; R115-E236 PolarHBondContact NH2-OE1 2.91Å; R115-E236 IonicContact NH2-OE2 2.68Å; R115-E236 PolarHBondContact NH2-OE2 3.23Å; R115-E236 VanDerWaalsContact NH2-OE2 3.14Å; Y213-E236 HydrophobicContact CE1-CB 4.23Å; Y213-E236 VanDerWaalsContact CE1-OE2 3.24Å; Y213-E236 WeakPolarHBondContact CE1-OE2 3.44Å; Y213-E236 WeakPolarHBondContact OH-CB 3.27Å; Y213-E236 PolarHBondContact OH-OE2 2.85Å; W217-E236 HydrophobicContact CD2-CB 4.4Å; W217-E236 HydrophobicContact CD2-CG 3.67Å; W217-E236 HydrophobicContact CE3-CB 4.46Å; W217-E236 HydrophobicContact CE3-CG 4.17Å; W217-E236 HydrophobicContact CG-CG 3.93Å; W217-E236 HydrophobicContact CH2-CG 4.49Å; W217-E236 HydrophobicContact CZ2-CG 4.02Å; Q232-E236 HydrophobicContact CG-CG 4.22Å; Q232-E236 WeakPolarHBondContact CG-OE1 3.47Å; Q232-E236 PolarHBondContact NE2-OE1 3.44Å; Q232-E236 WeakPolarHBondContact O-CG 3.38Å; Q232-E236 PolarHBondContact O-N 3.36Å; V234-E236 VanDerWaalsContact C-N 3.35Å; V234-E236 PolarHBondContact O-N 3.38Å; E236-A239 PolarHBondContact O-N 3.03Å; E236-I240 WeakPolarHBondContact O-CB 3.45Å; E236-I240 VanDerWaalsContact O-CG1 3.25Å; E236-I240 WeakPolarHBondContact O-CG1 3.31Å; E236-I240 PolarHBondContact O-N 3.3Å
237	V	96.1	Very high	93.5	Very high	4 Å²	4	38.3 Å²	38.3	2%	0.024	18%	0.181	C	C	.	.	H	α-helix	trans	-64.9	-44.3	-178.4	172.9	0	0	0	0	110.6	R115 H233 V234 A239 I240 V241 A289 L290 L293	R115-V237 HydrophobicContact CB-CG2 4.25Å; H233-V237 WeakPolarHBondContact O-CG2 3.3Å; H233-V237 PolarHBondContact O-N 3.33Å; V234-V237 PolarHBondContact O-N 3.31Å; V237-A239 PolarHBondContact O-N 3.09Å; V237-I240 PolarHBondContact O-N 2.98Å; V237-V241 HydrophobicContact CG1-CG2 4Å; V237-V241 VanDerWaalsContact O-CB 3.28Å; V237-V241 WeakPolarHBondContact O-CB 3.34Å; V237-V241 VanDerWaalsContact O-CG2 3.25Å; V237-V241 WeakPolarHBondContact O-CG2 3.48Å; V237-V241 PolarHBondContact O-N 3.45Å; V237-A289 HydrophobicContact CG1-CB 4.4Å; V237-L290 HydrophobicContact CG1-CD2 3.93Å; V237-L293 HydrophobicContact CB-CD1 3.94Å; V237-L293 HydrophobicContact CG1-CD1 3.88Å
238	Y	96.6	Very high	93.5	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-57.4	-46.7	176	-97.5	-64	0	0	0	113.1	V234 N242 L290 N294 I405 G406 L407 Y410	V234-Y238 HydrophobicContact CG1-CD2 3.56Å; V234-Y238 HydrophobicContact CG1-CE2 3.71Å; V234-Y238 WeakPolarHBondContact O-CB 3.32Å; V234-Y238 WeakPolarHBondContact O-CD2 3.28Å; V234-Y238 PolarHBondContact O-N 3.32Å; Y238-N242 WeakPolarHBondContact O-CB 3.47Å; Y238-N242 PolarHBondContact O-N 3.06Å; Y238-N242 PolarHBondContact O-ND2 3.27Å; Y238-L290 HydrophobicContact CD1-CD2 3.99Å; Y238-L290 HydrophobicContact CE1-CD1 4.39Å; Y238-L290 HydrophobicContact CE1-CD2 3.98Å; Y238-L290 HydrophobicContact CG-CD2 4.32Å; Y238-N294 PolarHBondContact OH-ND2 2.83Å; Y238-N294 PolarHBondContact OH-OD1 3.33Å; Y238-I405 WeakPolarHBondContact CE1-O 3.26Å; Y238-I405 PolarHBondContact OH-O 3.47Å; Y238-G406 PolarHBondContact OH-O 3.24Å; Y238-L407 HydrophobicContact CD2-CD1 3.89Å; Y238-L407 HydrophobicContact CE2-CD1 3.93Å; Y238-Y410 HydrophobicContact CE2-CG 4.28Å
239	A	96.6	Very high	93.5	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-64.7	-48.5	179.7	0	0	0	0	0	111.9	W217 V220 T224 F226 R235 E236 V237 Y243	W217-A239 HydrophobicContact CE3-CB 4.01Å; W217-A239 HydrophobicContact CZ3-CB 3.6Å; V220-A239 HydrophobicContact CG1-CB 3.78Å; T224-A239 HydrophobicContact CG2-CB 4.31Å; F226-A239 HydrophobicContact CE2-CB 4.39Å; F226-A239 HydrophobicContact CZ-CB 4.16Å; R235-A239 VanDerWaalsContact O-CB 3.29Å; R235-A239 WeakPolarHBondContact O-CB 3.44Å; R235-A239 PolarHBondContact O-N 3.49Å; E236-A239 PolarHBondContact O-N 3.03Å; V237-A239 PolarHBondContact O-N 3.09Å; A239-Y243 WeakPolarHBondContact O-CB 3.04Å; A239-Y243 PolarHBondContact O-N 3.29Å
240	I	97	Very high	93.5	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-70.6	-40.8	-175.9	-64.7	169	0	0	0	111.4	F106 F107 V110 Y213 T216 W217 E236 V237 S244	F106-I240 HydrophobicContact CE1-CG2 4.46Å; F107-I240 HydrophobicContact CD1-CG2 4.23Å; F107-I240 HydrophobicContact CE1-CG2 3.99Å; V110-I240 HydrophobicContact CG1-CG2 3.94Å; Y213-I240 HydrophobicContact CD1-CD1 3.9Å; Y213-I240 HydrophobicContact CD2-CD1 3.85Å; Y213-I240 HydrophobicContact CE1-CD1 3.62Å; Y213-I240 HydrophobicContact CE2-CD1 3.59Å; Y213-I240 HydrophobicContact CG-CD1 4Å; Y213-I240 VanDerWaalsContact CZ-CD1 3.47Å; T216-I240 HydrophobicContact CG2-CG1 4.25Å; T216-I240 HydrophobicContact CG2-CG2 4.35Å; W217-I240 HydrophobicContact CB-CD1 4.28Å; E236-I240 WeakPolarHBondContact O-CB 3.45Å; E236-I240 VanDerWaalsContact O-CG1 3.25Å; E236-I240 WeakPolarHBondContact O-CG1 3.31Å; E236-I240 PolarHBondContact O-N 3.3Å; V237-I240 PolarHBondContact O-N 2.98Å; I240-S244 PolarHBondContact O-N 3.39Å
241	V	96.6	Very high	93.2	Very high	1 Å²	1	43 Å²	43	1%	0.006	20%	0.196	C	C	.	.	H	α-helix	trans	-63.6	-46.2	177.7	170.8	0	0	0	0	110.8	V110 R111 V237 S244 V245 P285 L290	V110-V241 HydrophobicContact CG1-CG2 3.99Å; R111-V241 HydrophobicContact CG-CG1 4.19Å; R111-V241 HydrophobicContact CG-CG2 4.39Å; V237-V241 HydrophobicContact CG1-CG2 4Å; V237-V241 VanDerWaalsContact O-CB 3.28Å; V237-V241 WeakPolarHBondContact O-CB 3.34Å; V237-V241 VanDerWaalsContact O-CG2 3.25Å; V237-V241 WeakPolarHBondContact O-CG2 3.48Å; V237-V241 PolarHBondContact O-N 3.45Å; V241-S244 WeakPolarHBondContact O-CB 3.47Å; V241-S244 PolarHBondContact O-N 3.32Å; V241-S244 PolarHBondContact O-OG 3.01Å; V241-V245 PolarHBondContact O-N 2.92Å; V241-P285 HydrophobicContact CG1-CG 3.39Å; V241-L290 HydrophobicContact CB-CD1 4.33Å; V241-L290 HydrophobicContact CG1-CD1 3.72Å; V241-L290 HydrophobicContact CG1-CG 4.3Å
242	N	96	Very high	92.8	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-71.8	-37.3	179.1	-73.5	-57	0	0	0	112.7	Y238 S244 V245 L246 L262 L265 V266 T284	Y238-N242 WeakPolarHBondContact O-CB 3.47Å; Y238-N242 PolarHBondContact O-N 3.06Å; Y238-N242 PolarHBondContact O-ND2 3.27Å; N242-S244 PolarHBondContact O-N 3.15Å; N242-V245 PolarHBondContact O-N 2.85Å; N242-V245 VanDerWaalsContact O-N 3.14Å; N242-L246 WeakPolarHBondContact O-CB 3.48Å; N242-L246 PolarHBondContact O-N 3.2Å; N242-L262 HydrophobicContact CB-CD1 3.86Å; N242-L265 HydrophobicContact CB-CD2 4.04Å; N242-L265 HydrophobicContact CB-CG 4.12Å; N242-V266 HydrophobicContact CB-CG2 3.86Å; N242-T284 WeakPolarHBondContact OD1-CA 3.27Å; N242-T284 WeakPolarHBondContact OD1-CB 3.49Å; N242-T284 PolarHBondContact OD1-OG1 2.89Å
243	Y	96.1	Very high	92.4	Very high	25 Å²	25	45 Å²	45	10%	0.098	21%	0.206	C	C	.	.	H	α-helix	trans	-58.3	-35.6	170.9	174	-115.2	0	0	0	112	F107 T216 V220 A239 V245 L246 R247 L254 L262	F107-Y243 HydrophobicContact CE1-CD1 4.25Å; F107-Y243 HydrophobicContact CZ-CD1 4.2Å; F107-Y243 HydrophobicContact CZ-CE1 4.08Å; T216-Y243 HydrophobicContact CG2-CD1 3.82Å; T216-Y243 HydrophobicContact CG2-CE1 3.81Å; V220-Y243 HydrophobicContact CG2-CD1 3.7Å; V220-Y243 HydrophobicContact CG2-CD2 3.81Å; V220-Y243 HydrophobicContact CG2-CE1 4.14Å; V220-Y243 HydrophobicContact CG2-CE2 4.26Å; V220-Y243 HydrophobicContact CG2-CG 3.5Å; A239-Y243 WeakPolarHBondContact O-CB 3.04Å; A239-Y243 PolarHBondContact O-N 3.29Å; Y243-V245 PolarHBondContact O-N 2.85Å; Y243-L246 PolarHBondContact O-N 3.43Å; Y243-R247 HydrophobicContact CE2-CB 4.49Å; Y243-R247 VanDerWaalsContact O-CB 3.27Å; Y243-R247 WeakPolarHBondContact O-CB 3.35Å; Y243-R247 PolarHBondContact O-N 2.99Å; Y243-L254 HydrophobicContact CD2-CD2 4.06Å; Y243-L254 HydrophobicContact CE2-CB 4.31Å; Y243-L254 HydrophobicContact CE2-CD2 3.96Å; Y243-L262 HydrophobicContact CD2-CD2 4.23Å
244	S	94.4	Very high	92.2	Very high	1 Å²	1	41.4 Å²	41.4	1%	0.007	19%	0.19	C	C	.	.	H	α-helix	trans	-62.6	-40.1	176	83.1	0	0	0	0	113	F107 R111 I240 V241 N242 T248	F107-S244 VanDerWaalsContact CD1-CB 3.45Å; R111-S244 PolarHBondContact NE-OG 3.26Å; R111-S244 PolarHBondContact NH2-OG 2.98Å; I240-S244 PolarHBondContact O-N 3.39Å; V241-S244 WeakPolarHBondContact O-CB 3.47Å; V241-S244 PolarHBondContact O-N 3.32Å; V241-S244 PolarHBondContact O-OG 3.01Å; N242-S244 PolarHBondContact O-N 3.15Å; S244-T248 WeakPolarHBondContact O-CB 3.42Å; S244-T248 PolarHBondContact O-N 3.27Å; S244-T248 VanDerWaalsContact O-N 3.16Å; S244-T248 PolarHBondContact O-OG1 3.32Å
245	V	93.9	Very high	92	Very high	23 Å²	23	45.2 Å²	45.2	14%	0.139	21%	0.21	C	C	.	.	H	α-helix	trans	-70.8	-45.5	178	175.6	0	0	0	0	110.2	V241 N242 Y243 T248 R249 P285	V241-V245 PolarHBondContact O-N 2.92Å; N242-V245 PolarHBondContact O-N 2.85Å; N242-V245 VanDerWaalsContact O-N 3.14Å; Y243-V245 PolarHBondContact O-N 2.85Å; V245-T248 PolarHBondContact O-N 3.17Å; V245-R249 PolarHBondContact O-N 3.36Å; V245-P285 HydrophobicContact CG2-CB 4.3Å; V245-P285 HydrophobicContact CG2-CG 3.86Å
246	L	93.7	Very high	91.8	Very high	2 Å²	2	48.3 Å²	48.3	1%	0.01	23%	0.227	C	C	.	.	H	α-helix	trans	-54.3	-54.5	175.7	-177.4	61.4	0	0	0	111.3	N242 Y243 T248 R249 I250 L254 L258 L262 I273 L282	N242-L246 WeakPolarHBondContact O-CB 3.48Å; N242-L246 PolarHBondContact O-N 3.2Å; Y243-L246 PolarHBondContact O-N 3.43Å; L246-T248 VanDerWaalsContact C-N 3.26Å; L246-T248 PolarHBondContact O-N 3.28Å; L246-R249 PolarHBondContact O-N 2.92Å; L246-I250 HydrophobicContact CD1-CB 4.45Å; L246-I250 HydrophobicContact CD1-CG1 3.99Å; L246-I250 WeakPolarHBondContact O-CB 3.49Å; L246-I250 PolarHBondContact O-N 3.48Å; L246-L254 HydrophobicContact CD2-CD1 4.05Å; L246-L258 HydrophobicContact CD1-CD1 3.88Å; L246-L258 HydrophobicContact CD1-CG 4.32Å; L246-L258 HydrophobicContact CD2-CG 4.19Å; L246-L258 HydrophobicContact CG-CG 4.47Å; L246-L262 HydrophobicContact CD2-CB 3.69Å; L246-L262 HydrophobicContact CD2-CD1 3.89Å; L246-L262 HydrophobicContact CD2-CD2 4.05Å; L246-L262 HydrophobicContact CD2-CG 4.07Å; L246-I273 HydrophobicContact CD1-CD1 3.43Å; L246-I273 VanDerWaalsContact CD1-CD1 3.43Å; L246-L282 HydrophobicContact CD1-CD1 3.44Å; L246-L282 VanDerWaalsContact CD1-CD1 3.44Å
247	R	91.2	Very high	91.6	Very high	96 Å²	96	58.1 Å²	58.1	36%	0.362	26%	0.264	S	S	.	.	H	α-helix	trans	-64.6	-24.8	179.4	-173.6	175	-177.9	-97.9	-5.2	113.9	Y243	Y243-R247 HydrophobicContact CE2-CB 4.49Å; Y243-R247 VanDerWaalsContact O-CB 3.27Å; Y243-R247 WeakPolarHBondContact O-CB 3.35Å; Y243-R247 PolarHBondContact O-N 2.99Å
248	T	89	Confident	91.4	Very high	88 Å²	88	58.8 Å²	58.8	54%	0.54	27%	0.267	S	S	.	.	H	α-helix	trans	-74.3	-33.8	176.4	-59.5	0	0	0	0	112	S244 V245 L246	S244-T248 WeakPolarHBondContact O-CB 3.42Å; S244-T248 PolarHBondContact O-N 3.27Å; S244-T248 VanDerWaalsContact O-N 3.16Å; S244-T248 PolarHBondContact O-OG1 3.32Å; V245-T248 PolarHBondContact O-N 3.17Å; L246-T248 VanDerWaalsContact C-N 3.26Å; L246-T248 PolarHBondContact O-N 3.28Å
249	R	85.8	Confident	91.3	Very high	154 Å²	154	58.8 Å²	58.8	58%	0.581	27%	0.267	S	S	*	.	H	α-helix	trans	-94.7	-38.9	179.7	-60.9	-57.9	-167.8	-159.6	1.8	112.9	V245 L246 L282	V245-R249 PolarHBondContact O-N 3.36Å; L246-R249 PolarHBondContact O-N 2.92Å; R249-L282 HydrophobicContact CB-CD2 3.69Å; R249-L282 HydrophobicContact CG-CD2 3.59Å
250	I	87.8	Confident	91.1	Very high	3 Å²	3	63.9 Å²	63.9	2%	0.015	29%	0.291	C	S	.	.			trans	-108.5	98.5	-176	-48.3	-57.4	0	0	0	108.3	L246 K252 L258 I273 H275 F280 L282	L246-I250 HydrophobicContact CD1-CB 4.45Å; L246-I250 HydrophobicContact CD1-CG1 3.99Å; L246-I250 WeakPolarHBondContact O-CB 3.49Å; L246-I250 PolarHBondContact O-N 3.48Å; I250-K252 HydrophobicContact CG2-CB 4.21Å; I250-K252 PolarHBondContact O-N 3.26Å; I250-L258 HydrophobicContact CG2-CD1 4.01Å; I250-L258 HydrophobicContact CG2-CD2 4.07Å; I250-I273 HydrophobicContact CD1-CB 4.39Å; I250-I273 HydrophobicContact CD1-CG2 4.14Å; I250-I273 HydrophobicContact CG1-CD1 4.45Å; I250-I273 HydrophobicContact CG1-CG2 4.45Å; I250-H275 HydrophobicContact CD1-CB 3.78Å; I250-F280 HydrophobicContact CD1-CD2 4.08Å; I250-F280 HydrophobicContact CD1-CG 4.39Å; I250-L282 HydrophobicContact CG1-CD1 4.47Å
251	K	83.8	Confident	91	Very high	193 Å²	193	67.2 Å²	67.2	84%	0.839	31%	0.306	S	S	*	.			trans	-78.3	44.1	-178.1	-63.9	-174.4	178.7	-178.9	0	113
252	K	84.5	Confident	91	Very high	117 Å²	117	67.2 Å²	67.2	51%	0.509	31%	0.305	S	S	.	.	S	Bend	trans	-114.9	161.1	178.2	-77.1	-168.2	174.3	-163.8	0	112.1	I250 L258 H275	I250-K252 HydrophobicContact CG2-CB 4.21Å; I250-K252 PolarHBondContact O-N 3.26Å; K252-L258 HydrophobicContact CB-CD2 4.48Å; K252-H275 WeakPolarHBondContact CE-NE2 3.33Å
253	P	84.2	Confident	90.9	Very high	80 Å²	80	68.9 Å²	68.9	52%	0.519	31%	0.314	S	S	.	.			trans	-56.4	162.9	161.6	25.9	-34.7	0	0	0	111.7	D255 L258	P253-D255 WeakPolarHBondContact CG-OD1 3.33Å; P253-D255 PolarHBondContact O-N 2.85Å; P253-L258 VanDerWaalsContact O-CD2 3.25Å; P253-L258 WeakPolarHBondContact O-CD2 3.39Å
254	L	89	Confident	90.9	Very high	8 Å²	8	70.8 Å²	70.8	4%	0.042	32%	0.324	C	S	.	.			trans	-89.8	88.8	178.8	-171.7	62.9	0	0	0	109.1	V220 Y223 Y243 L246 L258 L262	V220-L254 HydrophobicContact CG2-CD2 4.1Å; Y223-L254 HydrophobicContact CD2-CD2 3.41Å; Y223-L254 VanDerWaalsContact CD2-CD2 3.41Å; Y223-L254 HydrophobicContact CD2-CG 3.63Å; Y223-L254 HydrophobicContact CE2-CB 4.25Å; Y223-L254 HydrophobicContact CE2-CD2 3.74Å; Y223-L254 HydrophobicContact CE2-CG 3.63Å; Y223-L254 WeakPolarHBondContact CE2-O 3.5Å; Y223-L254 HydrophobicContact CG-CD2 4.37Å; Y223-L254 HydrophobicContact CG-CG 4.4Å; Y223-L254 VanDerWaalsContact CZ-O 3.23Å; Y223-L254 PolarHBondContact OH-O 2.88Å; Y243-L254 HydrophobicContact CD2-CD2 4.06Å; Y243-L254 HydrophobicContact CE2-CB 4.31Å; Y243-L254 HydrophobicContact CE2-CD2 3.96Å; L246-L254 HydrophobicContact CD2-CD1 4.05Å; L254-L258 HydrophobicContact CD1-CB 4.22Å; L254-L258 HydrophobicContact CD1-CD2 4.26Å; L254-L258 HydrophobicContact CD1-CG 4.1Å; L254-L262 HydrophobicContact CD1-CD2 4.15Å; L254-L262 HydrophobicContact CD2-CD2 4.08Å
255	D	89.7	Confident	90.9	Very high	81 Å²	81	70.7 Å²	70.7	43%	0.433	32%	0.324	S	S	.	.			trans	-87.6	164.6	177.6	-43.9	-36	0	0	0	110.6	P253 R257 L258 G259	P253-D255 WeakPolarHBondContact CG-OD1 3.33Å; P253-D255 PolarHBondContact O-N 2.85Å; D255-R257 PolarHBondContact O-N 2.94Å; D255-L258 CarbonylContact O-C 3.56Å; D255-L258 WeakPolarHBondContact O-CA 3.44Å; D255-L258 WeakPolarHBondContact O-CB 3.15Å; D255-L258 PolarHBondContact O-N 2.88Å; D255-G259 PolarHBondContact O-N 2.89Å
256	H	91.2	Very high	91	Very high	133 Å²	133	69.6 Å²	69.6	62%	0.616	32%	0.317	S	S	*	.	H	α-helix	trans	-51.3	-51.8	-176.4	-167.4	84.2	0	0	0	113.8	L258 G259 E260	H256-L258 PolarHBondContact O-N 3.11Å; H256-G259 CarbonylContact O-C 3.57Å; H256-G259 VanDerWaalsContact O-CA 3.32Å; H256-G259 WeakPolarHBondContact O-CA 3.46Å; H256-G259 PolarHBondContact O-N 2.98Å; H256-E260 PolarHBondContact O-N 2.59Å
257	R	91	Very high	91	Very high	211 Å²	211	71.3 Å²	71.3	80%	0.796	33%	0.325	S	S	*	.	H	α-helix	trans	-59.6	-30.7	176.2	-71.8	179.1	172.6	171.9	-2.7	114.1	D255 E260	D255-R257 PolarHBondContact O-N 2.94Å; R257-E260 WeakPolarHBondContact CA-OE2 3.35Å
258	L	92.1	Very high	91	Very high	19 Å²	19	69.1 Å²	69.1	10%	0.099	32%	0.324	C	S	.	.	H	α-helix	trans	-80.7	-28.8	176.5	-164.7	64.4	0	0	0	111.1	L246 I250 K252 P253 L254 D255 H256 L262 I273	L246-L258 HydrophobicContact CD1-CD1 3.88Å; L246-L258 HydrophobicContact CD1-CG 4.32Å; L246-L258 HydrophobicContact CD2-CG 4.19Å; L246-L258 HydrophobicContact CG-CG 4.47Å; I250-L258 HydrophobicContact CG2-CD1 4.01Å; I250-L258 HydrophobicContact CG2-CD2 4.07Å; K252-L258 HydrophobicContact CB-CD2 4.48Å; P253-L258 VanDerWaalsContact O-CD2 3.25Å; P253-L258 WeakPolarHBondContact O-CD2 3.39Å; L254-L258 HydrophobicContact CD1-CB 4.22Å; L254-L258 HydrophobicContact CD1-CD2 4.26Å; L254-L258 HydrophobicContact CD1-CG 4.1Å; D255-L258 CarbonylContact O-C 3.56Å; D255-L258 WeakPolarHBondContact O-CA 3.44Å; D255-L258 WeakPolarHBondContact O-CB 3.15Å; D255-L258 PolarHBondContact O-N 2.88Å; H256-L258 PolarHBondContact O-N 3.11Å; L258-L262 PolarHBondContact O-N 3.46Å; L258-I273 HydrophobicContact CD1-CD1 3.87Å; L258-I273 HydrophobicContact CD1-CG2 4.35Å
259	G	93.6	Very high	91.2	Very high	0 Å²	0	65 Å²	65	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-64.6	-44.4	169.7	0	0	0	0	0	113.6	D255 H256 K261 L262 N263	D255-G259 PolarHBondContact O-N 2.89Å; H256-G259 CarbonylContact O-C 3.57Å; H256-G259 VanDerWaalsContact O-CA 3.32Å; H256-G259 WeakPolarHBondContact O-CA 3.46Å; H256-G259 PolarHBondContact O-N 2.98Å; G259-K261 VanDerWaalsContact C-N 3.3Å; G259-K261 PolarHBondContact O-N 3.33Å; G259-L262 CarbonylContact O-C 3.49Å; G259-L262 WeakPolarHBondContact O-CA 3.46Å; G259-L262 WeakPolarHBondContact O-CB 3.46Å; G259-L262 PolarHBondContact O-N 3.01Å; G259-N263 PolarHBondContact O-N 3.05Å
260	E	93.7	Very high	91.6	Very high	107 Å²	107	60.1 Å²	60.1	50%	0.5	29%	0.286	S	S	.	.	H	α-helix	trans	-56.1	-44.9	173.7	-65.8	175.4	122	0	0	111.5	H256 R257 L262 N263 E264	H256-E260 PolarHBondContact O-N 2.59Å; R257-E260 WeakPolarHBondContact CA-OE2 3.35Å; E260-L262 VanDerWaalsContact C-N 3.34Å; E260-L262 PolarHBondContact O-N 2.84Å; E260-N263 WeakPolarHBondContact O-CB 3.5Å; E260-N263 PolarHBondContact O-N 3.48Å; E260-E264 PolarHBondContact O-N 3.12Å
261	K	94.3	Very high	91.9	Very high	70 Å²	70	60 Å²	60	30%	0.304	29%	0.286	S	S	.	.	H	α-helix	trans	-71.2	-26.4	176.5	-64.8	-70.9	160.7	-166.4	0	113.2	G259 E264 L265 T271 I273	G259-K261 VanDerWaalsContact C-N 3.3Å; G259-K261 PolarHBondContact O-N 3.33Å; K261-E264 IonicContact NZ-OE1 3.1Å; K261-E264 IonicContact NZ-OE2 3.28Å; K261-E264 PolarHBondContact NZ-OE2 3.44Å; K261-L265 WeakPolarHBondContact O-CB 3.39Å; K261-L265 PolarHBondContact O-N 2.66Å; K261-T271 VanDerWaalsContact CD-OG1 3.26Å; K261-T271 WeakPolarHBondContact CD-OG1 3.46Å; K261-I273 HydrophobicContact CB-CD1 3.62Å; K261-I273 HydrophobicContact CB-CG1 3.97Å; K261-I273 HydrophobicContact CD-CG1 4.47Å; K261-I273 HydrophobicContact CG-CD1 4.28Å; K261-I273 HydrophobicContact CG-CG1 4.15Å
262	L	95.4	Very high	92.4	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-68.7	-39.6	168.4	-177.4	52.8	0	0	0	111.6	V220 T224 N242 Y243 L246 L254 L258 G259 E260 L265 V266	V220-L262 HydrophobicContact CG1-CD2 3.61Å; T224-L262 HydrophobicContact CG2-CD2 4.37Å; T224-L262 HydrophobicContact CG2-CG 4.16Å; N242-L262 HydrophobicContact CB-CD1 3.86Å; Y243-L262 HydrophobicContact CD2-CD2 4.23Å; L246-L262 HydrophobicContact CD2-CB 3.69Å; L246-L262 HydrophobicContact CD2-CD1 3.89Å; L246-L262 HydrophobicContact CD2-CD2 4.05Å; L246-L262 HydrophobicContact CD2-CG 4.07Å; L254-L262 HydrophobicContact CD1-CD2 4.15Å; L254-L262 HydrophobicContact CD2-CD2 4.08Å; L258-L262 PolarHBondContact O-N 3.46Å; G259-L262 CarbonylContact O-C 3.49Å; G259-L262 WeakPolarHBondContact O-CA 3.46Å; G259-L262 WeakPolarHBondContact O-CB 3.46Å; G259-L262 PolarHBondContact O-N 3.01Å; E260-L262 VanDerWaalsContact C-N 3.34Å; E260-L262 PolarHBondContact O-N 2.84Å; L262-L265 PolarHBondContact O-N 2.94Å; L262-V266 HydrophobicContact CD1-CG2 4.36Å; L262-V266 WeakPolarHBondContact O-CG2 3.33Å; L262-V266 PolarHBondContact O-N 3.35Å
263	N	95.5	Very high	92.8	Very high	36 Å²	36	48.7 Å²	48.7	19%	0.193	24%	0.241	C	C	.	.	H	α-helix	trans	-63.5	-47.8	174.8	-166.9	73.1	0	0	0	111.2	T224 K225 G259 E260 L265 V266 H267	T224-N263 WeakPolarHBondContact CA-OD1 3.46Å; K225-N263 PolarHBondContact N-OD1 3.41Å; K225-N263 PolarHBondContact O-OD1 2.95Å; G259-N263 PolarHBondContact O-N 3.05Å; E260-N263 WeakPolarHBondContact O-CB 3.5Å; E260-N263 PolarHBondContact O-N 3.48Å; N263-L265 VanDerWaalsContact C-N 3.31Å; N263-L265 PolarHBondContact O-N 3.43Å; N263-V266 PolarHBondContact O-N 3.22Å; N263-H267 PolarHBondContact O-CD2 2.94Å; N263-H267 VanDerWaalsContact O-CD2 3.3Å; N263-H267 PolarHBondContact O-N 2.72Å
264	E	94.7	Very high	93.1	Very high	64 Å²	64	52.7 Å²	52.7	30%	0.299	25%	0.251	S	S	.	.	H	α-helix	trans	-54.2	-46.2	173.1	-174	-176.6	118.3	0	0	111.8	E260 K261 H267 C268 T271	E260-E264 PolarHBondContact O-N 3.12Å; K261-E264 IonicContact NZ-OE1 3.1Å; K261-E264 IonicContact NZ-OE2 3.28Å; K261-E264 PolarHBondContact NZ-OE2 3.44Å; E264-H267 PolarHBondContact O-N 2.82Å; E264-C268 VanDerWaalsContact O-CB 3.31Å; E264-C268 WeakPolarHBondContact O-CB 3.23Å; E264-C268 PolarHBondContact O-N 2.91Å; E264-T271 VanDerWaalsContact CD-OG1 3.25Å; E264-T271 WeakPolarHBondContact OE1-CA 3.42Å; E264-T271 WeakPolarHBondContact OE1-CB 3.29Å; E264-T271 PolarHBondContact OE1-OG1 3.38Å
265	L	95.6	Very high	93	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-62.7	-42.6	176.9	-178.2	57.3	0	0	0	112.9	N242 K261 L262 N263 G269 T271 L282 T284	N242-L265 HydrophobicContact CB-CD2 4.04Å; N242-L265 HydrophobicContact CB-CG 4.12Å; K261-L265 WeakPolarHBondContact O-CB 3.39Å; K261-L265 PolarHBondContact O-N 2.66Å; L262-L265 PolarHBondContact O-N 2.94Å; N263-L265 VanDerWaalsContact C-N 3.31Å; N263-L265 PolarHBondContact O-N 3.43Å; L265-G269 VanDerWaalsContact O-CA 3.3Å; L265-G269 WeakPolarHBondContact O-CA 3.32Å; L265-G269 PolarHBondContact O-N 2.92Å; L265-G269 VanDerWaalsContact O-N 3.09Å; L265-T271 HydrophobicContact CB-CG2 3.77Å; L265-T271 HydrophobicContact CD1-CG2 4.25Å; L265-T271 HydrophobicContact CD2-CG2 4.37Å; L265-T271 HydrophobicContact CG-CG2 4.35Å; L265-L282 HydrophobicContact CD1-CB 4.34Å; L265-L282 HydrophobicContact CD2-CB 4.23Å; L265-T284 PolarHBondContact O-OG1 3.48Å
266	V	95.6	Very high	92.9	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-63.9	-46.5	177.5	166.4	0	0	0	0	111	T224 F226 N242 L262 N263 L407	T224-V266 HydrophobicContact CG2-CG2 4.36Å; F226-V266 HydrophobicContact CE1-CG1 3.88Å; F226-V266 HydrophobicContact CZ-CG1 4.09Å; N242-V266 HydrophobicContact CB-CG2 3.86Å; L262-V266 HydrophobicContact CD1-CG2 4.36Å; L262-V266 WeakPolarHBondContact O-CG2 3.33Å; L262-V266 PolarHBondContact O-N 3.35Å; N263-V266 PolarHBondContact O-N 3.22Å; V266-L407 HydrophobicContact CG1-CB 4.06Å; V266-L407 HydrophobicContact CG1-CD2 4.12Å; V266-L407 VanDerWaalsContact O-CB 3.3Å; V266-L407 WeakPolarHBondContact O-CB 3.47Å; V266-L407 PolarHBondContact O-N 3.46Å
267	H	94	Very high	92.8	Very high	37 Å²	37	53 Å²	53	17%	0.171	27%	0.27	C	S	.	.	H	α-helix	trans	-73.8	-54.1	-177.1	-82.7	-91.5	0	0	0	113.4	K225 N263 E264 R408	K225-H267 PolarHBondContact O-NE2 3Å; N263-H267 PolarHBondContact O-CD2 2.94Å; N263-H267 VanDerWaalsContact O-CD2 3.3Å; N263-H267 PolarHBondContact O-N 2.72Å; E264-H267 PolarHBondContact O-N 2.82Å; H267-R408 WeakPolarHBondContact O-CB 3.15Å; H267-R408 PolarHBondContact O-N 2.7Å
268	C	91.8	Very high	92.7	Very high	51 Å²	51	51.5 Å²	51.5	35%	0.345	26%	0.264	S	S	.	.	H	α-helix	trans	-92.2	-2	-170.6	-59	0	0	0	0	113.8	E264 T270 R408	E264-C268 VanDerWaalsContact O-CB 3.31Å; E264-C268 WeakPolarHBondContact O-CB 3.23Å; E264-C268 PolarHBondContact O-N 2.91Å; C268-T270 PolarHBondContact O-N 3.07Å; C268-R408 PolarHBondContact SG-NH1 2.84Å
269	G	92.8	Very high	92.7	Very high	0 Å²	0	59.5 Å²	59.5	0%	0	29%	0.294	C	S	.	.	S	Bend	trans	71.1	-6.3	-177.7	0	0	0	0	0	115	L265 R283 T284 S402	L265-G269 VanDerWaalsContact O-CA 3.3Å; L265-G269 WeakPolarHBondContact O-CA 3.32Å; L265-G269 PolarHBondContact O-N 2.92Å; L265-G269 VanDerWaalsContact O-N 3.09Å; G269-R283 CarbonylContact O-C 3.6Å; G269-R283 WeakPolarHBondContact O-CA 3.41Å; G269-T284 WeakPolarHBondContact CA-OG1 3.39Å; G269-T284 PolarHBondContact O-N 3.47Å; G269-T284 PolarHBondContact O-OG1 3.48Å; G269-S402 VanDerWaalsContact CA-O 3.24Å; G269-S402 WeakPolarHBondContact CA-O 3.16Å; G269-S402 VanDerWaalsContact O-CB 3.26Å; G269-S402 WeakPolarHBondContact O-CB 3.25Å
270	T	93.7	Very high	92.5	Very high	52 Å²	52	62.1 Å²	62.1	32%	0.319	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	155.3	-179.8	70	0	0	0	0	111.2	C268 L282 R283	C268-T270 PolarHBondContact O-N 3.07Å; T270-L282 VanDerWaalsContact CA-O 3.32Å; T270-L282 WeakPolarHBondContact CA-O 3.49Å; T270-R283 HydrophobicContact CG2-CG 3.98Å
271	T	94.9	Very high	92.5	Very high	2 Å²	2	61.6 Å²	61.6	1%	0.012	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.5	160.7	169.6	-175.6	0	0	0	0	110.7	K261 E264 L265 I273 L282	K261-T271 VanDerWaalsContact CD-OG1 3.26Å; K261-T271 WeakPolarHBondContact CD-OG1 3.46Å; E264-T271 VanDerWaalsContact CD-OG1 3.25Å; E264-T271 WeakPolarHBondContact OE1-CA 3.42Å; E264-T271 WeakPolarHBondContact OE1-CB 3.29Å; E264-T271 PolarHBondContact OE1-OG1 3.38Å; L265-T271 HydrophobicContact CB-CG2 3.77Å; L265-T271 HydrophobicContact CD1-CG2 4.25Å; L265-T271 HydrophobicContact CD2-CG2 4.37Å; L265-T271 HydrophobicContact CG-CG2 4.35Å; T271-I273 HydrophobicContact CG2-CD1 4.25Å; T271-I273 HydrophobicContact CG2-CG1 4.16Å; T271-L282 HydrophobicContact CG2-CB 3.82Å; T271-L282 HydrophobicContact CG2-CD1 4.12Å; T271-L282 HydrophobicContact CG2-CG 4.3Å; T271-L282 PolarHBondContact N-O 3.28Å; T271-L282 PolarHBondContact O-N 3.26Å
272	V	93.2	Very high	92.5	Very high	57 Å²	57	58.4 Å²	58.4	35%	0.345	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	126.2	172.9	-178.6	0	0	0	0	111	R279 F280 L281	V272-R279 HydrophobicContact CG1-CB 4.26Å; V272-F280 WeakPolarHBondContact CA-O 3.34Å; V272-L281 HydrophobicContact CG2-CD1 3.74Å
273	I	92.9	Very high	92.4	Very high	15 Å²	15	65.3 Å²	65.3	8%	0.077	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	130.3	-177.6	-52.3	-171.3	0	0	0	110.2	L246 I250 L258 K261 T271 F280 L282	L246-I273 HydrophobicContact CD1-CD1 3.43Å; L246-I273 VanDerWaalsContact CD1-CD1 3.43Å; I250-I273 HydrophobicContact CD1-CB 4.39Å; I250-I273 HydrophobicContact CD1-CG2 4.14Å; I250-I273 HydrophobicContact CG1-CD1 4.45Å; I250-I273 HydrophobicContact CG1-CG2 4.45Å; L258-I273 HydrophobicContact CD1-CD1 3.87Å; L258-I273 HydrophobicContact CD1-CG2 4.35Å; K261-I273 HydrophobicContact CB-CD1 3.62Å; K261-I273 HydrophobicContact CB-CG1 3.97Å; K261-I273 HydrophobicContact CD-CG1 4.47Å; K261-I273 HydrophobicContact CG-CD1 4.28Å; K261-I273 HydrophobicContact CG-CG1 4.15Å; T271-I273 HydrophobicContact CG2-CD1 4.25Å; T271-I273 HydrophobicContact CG2-CG1 4.16Å; I273-F280 PolarHBondContact N-O 2.86Å; I273-F280 PolarHBondContact O-N 3.11Å; I273-L282 HydrophobicContact CD1-CD1 3.56Å; I273-L282 HydrophobicContact CG1-CD1 4.12Å
274	K	90.9	Very high	92.4	Very high	164 Å²	164	63.6 Å²	63.6	71%	0.713	31%	0.308	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.1	124.3	171.6	-169.2	178.6	-179.1	-179.7	0	109.5	G277 R278	K274-G277 VanDerWaalsContact CE-O 3.3Å; K274-G277 WeakPolarHBondContact CE-O 3.22Å; K274-R278 CarbonylContact C-O 3.55Å; K274-R278 WeakPolarHBondContact CA-O 3.33Å
275	H	87.7	Confident	92.2	Very high	28 Å²	28	61.9 Å²	61.9	13%	0.13	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	131.2	-178	-177.2	-88.1	0	0	0	110.1	I250 K252 G277 R278 F280	I250-H275 HydrophobicContact CD1-CB 3.78Å; K252-H275 WeakPolarHBondContact CE-NE2 3.33Å; H275-G277 VanDerWaalsContact C-N 3.34Å; H275-G277 PolarHBondContact O-N 3.02Å; H275-R278 PolarHBondContact N-O 2.85Å; H275-R278 PolarHBondContact O-N 3.15Å; H275-R278 VanDerWaalsContact O-O 3.1Å; H275-F280 HydrophobicContact CB-CD2 4.1Å; H275-F280 HydrophobicContact CB-CE2 4.05Å
276	N	87.6	Confident	92	Very high	138 Å²	138	64.9 Å²	64.9	74%	0.738	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.4	55	-173.8	-62.2	11.6	0	0	0	111.9	R278	N276-R278 PolarHBondContact O-N 2.86Å
277	G	87.6	Confident	91.8	Very high	61 Å²	61	65.3 Å²	65.3	63%	0.629	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.6	-44.9	-175.2	0	0	0	0	0	114.9	K274 H275	K274-G277 VanDerWaalsContact CE-O 3.3Å; K274-G277 WeakPolarHBondContact CE-O 3.22Å; H275-G277 VanDerWaalsContact C-N 3.34Å; H275-G277 PolarHBondContact O-N 3.02Å
278	R	90.1	Very high	91.6	Very high	180 Å²	180	66.2 Å²	66.2	68%	0.679	33%	0.333	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.3	143.2	-172.4	-168.3	170.4	-174.9	162.1	3.2	113.1	K274 H275 N276 F280	K274-R278 CarbonylContact C-O 3.55Å; K274-R278 WeakPolarHBondContact CA-O 3.33Å; H275-R278 PolarHBondContact N-O 2.85Å; H275-R278 PolarHBondContact O-N 3.15Å; H275-R278 VanDerWaalsContact O-O 3.1Å; N276-R278 PolarHBondContact O-N 2.86Å; R278-F280 HydrophobicContact CB-CE2 3.95Å; R278-F280 HydrophobicContact CB-CZ 4.26Å; R278-F280 HydrophobicContact CG-CE2 4.23Å; R278-F280 HydrophobicContact CG-CZ 4.24Å
279	R	90.4	Very high	91.6	Very high	188 Å²	188	63.9 Å²	63.9	71%	0.709	32%	0.317	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.9	130.8	167.5	-65.7	175.5	75.9	-176.8	4.5	109.7	V272	V272-R279 HydrophobicContact CG1-CB 4.26Å
280	F	90.8	Very high	91.7	Very high	54 Å²	54	63.9 Å²	63.9	24%	0.237	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	119	173.8	-66.1	-89.1	0	0	0	109.4	I250 V272 I273 H275 R278 L282	I250-F280 HydrophobicContact CD1-CD2 4.08Å; I250-F280 HydrophobicContact CD1-CG 4.39Å; V272-F280 WeakPolarHBondContact CA-O 3.34Å; I273-F280 PolarHBondContact N-O 2.86Å; I273-F280 PolarHBondContact O-N 3.11Å; H275-F280 HydrophobicContact CB-CD2 4.1Å; H275-F280 HydrophobicContact CB-CE2 4.05Å; R278-F280 HydrophobicContact CB-CE2 3.95Å; R278-F280 HydrophobicContact CB-CZ 4.26Å; R278-F280 HydrophobicContact CG-CE2 4.23Å; R278-F280 HydrophobicContact CG-CZ 4.24Å; F280-L282 HydrophobicContact CB-CD2 4.28Å
281	L	93.1	Very high	91.5	Very high	96 Å²	96	62.4 Å²	62.4	50%	0.503	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	117.6	164.6	176.4	62.6	0	0	0	108.2	V272 R283	V272-L281 HydrophobicContact CG2-CD1 3.74Å; L281-R283 HydrophobicContact CG-CG 4.28Å
282	L	93.5	Very high	91.2	Very high	3 Å²	3	69.2 Å²	69.2	2%	0.016	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	148.5	172.7	-53	-175.8	0	0	0	109.2	L246 R249 I250 L265 T270 T271 I273 F280	L246-L282 HydrophobicContact CD1-CD1 3.44Å; L246-L282 VanDerWaalsContact CD1-CD1 3.44Å; R249-L282 HydrophobicContact CB-CD2 3.69Å; R249-L282 HydrophobicContact CG-CD2 3.59Å; I250-L282 HydrophobicContact CG1-CD1 4.47Å; L265-L282 HydrophobicContact CD1-CB 4.34Å; L265-L282 HydrophobicContact CD2-CB 4.23Å; T270-L282 VanDerWaalsContact CA-O 3.32Å; T270-L282 WeakPolarHBondContact CA-O 3.49Å; T271-L282 HydrophobicContact CG2-CB 3.82Å; T271-L282 HydrophobicContact CG2-CD1 4.12Å; T271-L282 HydrophobicContact CG2-CG 4.3Å; T271-L282 PolarHBondContact N-O 3.28Å; T271-L282 PolarHBondContact O-N 3.26Å; I273-L282 HydrophobicContact CD1-CD1 3.56Å; I273-L282 HydrophobicContact CG1-CD1 4.12Å; F280-L282 HydrophobicContact CB-CD2 4.28Å
283	R	94.1	Very high	91.1	Very high	146 Å²	146	68 Å²	68	55%	0.551	33%	0.329	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-144	141.1	-176.4	-64.6	-166.6	170.9	161.1	-4.5	109.9	G269 T270 L281 S402	G269-R283 CarbonylContact O-C 3.6Å; G269-R283 WeakPolarHBondContact O-CA 3.41Å; T270-R283 HydrophobicContact CG2-CG 3.98Å; L281-R283 HydrophobicContact CG-CG 4.28Å; R283-S402 WeakPolarHBondContact CB-OG 3.44Å
284	T	95.1	Very high	90.9	Very high	0 Å²	0	67.4 Å²	67.4	0%	0	33%	0.326	C	S	.	.			trans	-61.4	129.2	172.3	-64.9	0	0	0	0	109.2	N242 L265 G269 L290 S402 I405	N242-T284 WeakPolarHBondContact OD1-CA 3.27Å; N242-T284 WeakPolarHBondContact OD1-CB 3.49Å; N242-T284 PolarHBondContact OD1-OG1 2.89Å; L265-T284 PolarHBondContact O-OG1 3.48Å; G269-T284 WeakPolarHBondContact CA-OG1 3.39Å; G269-T284 PolarHBondContact O-N 3.47Å; G269-T284 PolarHBondContact O-OG1 3.48Å; T284-L290 HydrophobicContact CG2-CD1 3.61Å; T284-S402 WeakPolarHBondContact O-CB 3.4Å; T284-S402 PolarHBondContact O-OG 3.33Å; T284-I405 HydrophobicContact CG2-CG2 4.08Å
285	P	91.9	Very high	90.7	Very high	28 Å²	28	64.8 Å²	64.8	18%	0.182	32%	0.32	C	S	.	.			trans	-77.3	135.1	-173	31.5	-32.9	0	0	0	110.3	V241 V245 C287	V241-P285 HydrophobicContact CG1-CG 3.39Å; V245-P285 HydrophobicContact CG2-CB 4.3Å; V245-P285 HydrophobicContact CG2-CG 3.86Å; P285-C287 PolarHBondContact O-N 3.47Å
286	V	90	Very high	90.3	Very high	62 Å²	62	65 Å²	65	38%	0.376	32%	0.322	S	S	.	.			trans	-71.7	92.2	170.5	-178.5	0	0	0	0	107.8	K291 I400 I405	V286-K291 VanDerWaalsContact CG1-CE 3.45Å; V286-I400 WeakPolarHBondContact CG2-O 3.3Å; V286-I405 HydrophobicContact CB-CD1 4Å; V286-I405 HydrophobicContact CG1-CD1 3.85Å; V286-I405 HydrophobicContact CG2-CD1 3.8Å
287	C	91.1	Very high	89.1	Confident	9 Å²	9	63.8 Å²	63.8	6%	0.061	32%	0.324	C	S	.	.			trans	-130.3	154.4	-176.8	74.4	0	0	0	0	112.7	R111 P285 A289 L290 K291	R111-C287 HydrophobicContact CB-CB 3.85Å; R111-C287 HydrophobicContact CG-CB 4.41Å; R111-C287 WeakPolarHBondContact O-CB 3.45Å; R111-C287 PolarHBondContact O-SG 3.34Å; P285-C287 PolarHBondContact O-N 3.47Å; C287-A289 VanDerWaalsContact C-N 3.32Å; C287-A289 PolarHBondContact O-N 3.06Å; C287-L290 PolarHBondContact O-N 3.17Å; C287-K291 PolarHBondContact O-N 2.79Å
288	P	90.2	Very high	87.4	Confident	57 Å²	57	63.1 Å²	63.1	37%	0.37	31%	0.313	S	S	.	.	H	α-helix	trans	-54	-43.1	-172.4	-29.3	36.8	0	0	0	114.2	R111 M112 L290 K291 Q292	R111-P288 WeakPolarHBondContact O-CD 3.43Å; M112-P288 HydrophobicContact CE-CG 3.94Å; M112-P288 HydrophobicContact SD-CG 3.98Å; P288-L290 VanDerWaalsContact C-N 3.32Å; P288-L290 PolarHBondContact O-N 3.15Å; P288-K291 PolarHBondContact O-N 2.82Å; P288-Q292 WeakPolarHBondContact O-CB 3.37Å; P288-Q292 PolarHBondContact O-N 3.45Å
289	A	92.9	Very high	85.6	Confident	2 Å²	2	57.5 Å²	57.5	2%	0.017	30%	0.299	C	S	.	.	H	α-helix	trans	-58.4	-41	178.2	0	0	0	0	0	113	V110 R111 V237 C287 L293	V110-A289 WeakPolarHBondContact O-CB 3.36Å; R111-A289 VanDerWaalsContact O-CB 3.29Å; R111-A289 WeakPolarHBondContact O-CB 3.33Å; R111-A289 PolarHBondContact O-N 3.42Å; R111-A289 VanDerWaalsContact O-N 3.08Å; V237-A289 HydrophobicContact CG1-CB 4.4Å; C287-A289 VanDerWaalsContact C-N 3.32Å; C287-A289 PolarHBondContact O-N 3.06Å; A289-L293 WeakPolarHBondContact O-CG 3.36Å; A289-L293 PolarHBondContact O-N 2.9Å
290	L	93.7	Very high	83.8	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-80	-31.7	178	-64.2	-175.8	0	0	0	112.6	V237 Y238 V241 T284 C287 P288 Q292 L293 N294 I405	V237-L290 HydrophobicContact CG1-CD2 3.93Å; Y238-L290 HydrophobicContact CD1-CD2 3.99Å; Y238-L290 HydrophobicContact CE1-CD1 4.39Å; Y238-L290 HydrophobicContact CE1-CD2 3.98Å; Y238-L290 HydrophobicContact CG-CD2 4.32Å; V241-L290 HydrophobicContact CB-CD1 4.33Å; V241-L290 HydrophobicContact CG1-CD1 3.72Å; V241-L290 HydrophobicContact CG1-CG 4.3Å; T284-L290 HydrophobicContact CG2-CD1 3.61Å; C287-L290 PolarHBondContact O-N 3.17Å; P288-L290 VanDerWaalsContact C-N 3.32Å; P288-L290 PolarHBondContact O-N 3.15Å; L290-Q292 VanDerWaalsContact C-N 3.33Å; L290-L293 HydrophobicContact CD2-CD1 4.37Å; L290-L293 PolarHBondContact O-N 3Å; L290-N294 PolarHBondContact O-N 3.33Å; L290-N294 VanDerWaalsContact O-N 3.11Å; L290-N294 PolarHBondContact O-ND2 3.33Å; L290-I405 HydrophobicContact CB-CG2 3.51Å; L290-I405 HydrophobicContact CD1-CG2 3.9Å; L290-I405 HydrophobicContact CG-CG2 4.33Å
291	K	89.9	Confident	81.8	Confident	21 Å²	21	60.1 Å²	60.1	9%	0.091	33%	0.331	C	S	.	.	H	α-helix	trans	-58.5	-46.9	169.9	-70.6	-169.9	-176.1	-176.6	0	110.5	V286 C287 P288 N294 N295 I296 A298 I400	V286-K291 VanDerWaalsContact CG1-CE 3.45Å; C287-K291 PolarHBondContact O-N 2.79Å; P288-K291 PolarHBondContact O-N 2.82Å; K291-N294 PolarHBondContact O-N 3.46Å; K291-N295 PolarHBondContact O-N 3.19Å; K291-I296 PolarHBondContact O-N 2.66Å; K291-A298 HydrophobicContact CD-CB 3.66Å; K291-I400 HydrophobicContact CD-CD1 4.35Å
292	Q	89.2	Confident	80.1	Confident	144 Å²	144	62.4 Å²	62.4	67%	0.673	34%	0.339	S	S	*	.	H	α-helix	trans	-59.1	-50.3	178.1	-171.3	179.9	22	0	0	112	P288 L290 N294 N295	P288-Q292 WeakPolarHBondContact O-CB 3.37Å; P288-Q292 PolarHBondContact O-N 3.45Å; L290-Q292 VanDerWaalsContact C-N 3.33Å; Q292-N294 VanDerWaalsContact C-N 3.27Å; Q292-N294 PolarHBondContact O-N 3.28Å; Q292-N295 PolarHBondContact O-N 3.41Å
293	L	90.4	Very high	78.6	Confident	31 Å²	31	67.7 Å²	67.7	16%	0.162	36%	0.362	C	S	.	.	H	α-helix	trans	-62	-32.7	178.6	-67.6	-177.1	0	0	0	113.2	V234 V237 A289 L290 N295 Y410	V234-L293 HydrophobicContact CG1-CD1 4.34Å; V234-L293 HydrophobicContact CG2-CD1 4.48Å; V234-L293 HydrophobicContact CG2-CD2 4.18Å; V237-L293 HydrophobicContact CB-CD1 3.94Å; V237-L293 HydrophobicContact CG1-CD1 3.88Å; A289-L293 WeakPolarHBondContact O-CG 3.36Å; A289-L293 PolarHBondContact O-N 2.9Å; L290-L293 HydrophobicContact CD2-CD1 4.37Å; L290-L293 PolarHBondContact O-N 3Å; L293-N295 VanDerWaalsContact C-N 3.27Å; L293-N295 PolarHBondContact O-N 2.8Å; L293-Y410 WeakPolarHBondContact O-CD2 3.45Å; L293-Y410 VanDerWaalsContact O-CE2 3.3Å; L293-Y410 WeakPolarHBondContact O-CE2 3.3Å
294	N	89.1	Confident	77.7	Confident	3 Å²	3	67.5 Å²	67.5	2%	0.016	37%	0.371	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.7	-1.7	176.6	-76	-88	0	0	0	113.8	Y238 L290 K291 Q292 I296 R413	Y238-N294 PolarHBondContact OH-ND2 2.83Å; Y238-N294 PolarHBondContact OH-OD1 3.33Å; L290-N294 PolarHBondContact O-N 3.33Å; L290-N294 VanDerWaalsContact O-N 3.11Å; L290-N294 PolarHBondContact O-ND2 3.33Å; K291-N294 PolarHBondContact O-N 3.46Å; Q292-N294 VanDerWaalsContact C-N 3.27Å; Q292-N294 PolarHBondContact O-N 3.28Å; N294-I296 HydrophobicContact CB-CD1 3.64Å; N294-I296 HydrophobicContact CB-CG1 3.7Å; N294-I296 PolarHBondContact O-N 3.1Å; N294-R413 PolarHBondContact OD1-NH1 2.94Å
295	N	85.4	Confident	77.1	Confident	110 Å²	110	71.3 Å²	71.3	59%	0.588	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.7	27.2	-170	-49.3	-92.1	0	0	0	113.2	K291 Q292 L293 S297 K417	K291-N295 PolarHBondContact O-N 3.19Å; Q292-N295 PolarHBondContact O-N 3.41Å; L293-N295 VanDerWaalsContact C-N 3.27Å; L293-N295 PolarHBondContact O-N 2.8Å; N295-S297 PolarHBondContact O-N 2.9Å; N295-K417 PolarHBondContact ND2-NZ 3.46Å
296	I	80	Confident	76.9	Confident	33 Å²	33	72.1 Å²	72.1	17%	0.169	40%	0.396	C	S	.	.			trans	-83	113.2	175.8	-58.9	166.5	0	0	0	107.1	K291 N294 A298 I400 I405	K291-I296 PolarHBondContact O-N 2.66Å; N294-I296 HydrophobicContact CB-CD1 3.64Å; N294-I296 HydrophobicContact CB-CG1 3.7Å; N294-I296 PolarHBondContact O-N 3.1Å; I296-A298 PolarHBondContact O-N 3.03Å; I296-I400 HydrophobicContact CD1-CG2 4.07Å; I296-I400 HydrophobicContact CG2-CD1 3.68Å; I296-I400 HydrophobicContact CG2-CG1 4.32Å; I296-I405 HydrophobicContact CD1-CG1 4.09Å
297	S	62.7	Low	76.9	Confident	111 Å²	111	76.8 Å²	76.8	78%	0.776	41%	0.414	S	S	*	.			trans	-48.5	109.8	171.6	-59.5	0	0	0	0	109.5	N295 P299	N295-S297 PolarHBondContact O-N 2.9Å; S297-P299 WeakPolarHBondContact O-CD 3.43Å
298	A	51.8	Low	77	Confident	47 Å²	47	78.4 Å²	78.4	39%	0.388	42%	0.422	S	S	.	.			trans	-74.5	119.7	174.5	0	0	0	0	0	107.5	K291 I296 T300	K291-A298 HydrophobicContact CD-CB 3.66Å; I296-A298 PolarHBondContact O-N 3.03Å; A298-T300 PolarHBondContact O-N 2.82Å
299	P	52.6	Low	77.2	Confident	62 Å²	62	75.9 Å²	75.9	40%	0.403	41%	0.406	S	S	.	.			trans	-55.1	115.6	153.5	24.9	-32.6	0	0	0	105.8	S297 H301	S297-P299 WeakPolarHBondContact O-CD 3.43Å; P299-H301 PolarHBondContact O-N 2.9Å
300	T	51.3	Low	77.3	Confident	150 Å²	150	80.6 Å²	80.6	92%	0.92	42%	0.423	S	S	*	.	S	Bend	trans	-66.9	-19.2	-170.6	35.9	0	0	0	0	112.2	A298	A298-T300 PolarHBondContact O-N 2.82Å
301	H	50.4	Low	77.4	Confident	148 Å²	148	80.7 Å²	80.7	69%	0.685	42%	0.423	S	S	*	.	S	Bend	trans	-130.2	139.5	166.5	-154.9	29	0	0	0	108.4	P299 F303	P299-H301 PolarHBondContact O-N 2.9Å; H301-F303 VanDerWaalsContact C-N 3.31Å; H301-F303 PolarHBondContact O-N 3.26Å; H301-F303 VanDerWaalsContact O-N 3.1Å
302	E	56	Low	77.6	Confident	144 Å²	144	80 Å²	80	67%	0.673	42%	0.421	S	S	*	.			trans	-75.1	94.3	159.5	-75	-176.4	-177.4	0	0	106.1	L304	E302-L304 PolarHBondContact O-N 3.43Å
303	F	63.5	Low	78	Confident	113 Å²	113	73.2 Å²	73.2	50%	0.496	39%	0.389	S	S	.	.			trans	-64	108	178.4	177.7	-102	0	0	0	109.3	H301 L305 Y512 L513 C517	H301-F303 VanDerWaalsContact C-N 3.31Å; H301-F303 PolarHBondContact O-N 3.26Å; H301-F303 VanDerWaalsContact O-N 3.1Å; F303-L305 HydrophobicContact CE1-CD2 3.7Å; F303-L305 HydrophobicContact CE1-CG 4.1Å; F303-L305 HydrophobicContact CZ-CD2 4.08Å; F303-Y512 HydrophobicContact CZ-CE1 4.39Å; F303-L513 HydrophobicContact CE1-CD2 4.25Å; F303-C517 HydrophobicContact CZ-CB 4.42Å; F303-C517 VanDerWaalsContact CZ-SG 3.51Å
304	L	74.3	Confident	78.1	Confident	142 Å²	142	72.5 Å²	72.5	74%	0.743	39%	0.386	S	S	*	.	P	Polyproline II helix	trans	-94.9	128	169	-59.7	178	0	0	0	107.1	E302	E302-L304 PolarHBondContact O-N 3.43Å
305	L	83.5	Confident	78.4	Confident	80 Å²	80	73.8 Å²	73.8	42%	0.419	39%	0.394	S	S	.	.	P	Polyproline II helix	trans	-59	138	166.1	-71.9	165.8	0	0	0	108.7	F303 I339 V509 Y512 L513	F303-L305 HydrophobicContact CE1-CD2 3.7Å; F303-L305 HydrophobicContact CE1-CG 4.1Å; F303-L305 HydrophobicContact CZ-CD2 4.08Å; L305-I339 HydrophobicContact CB-CD1 4.42Å; L305-I339 HydrophobicContact CD2-CD1 4.04Å; L305-V509 HydrophobicContact CD1-CG2 3.95Å; L305-V509 HydrophobicContact CD2-CG2 4.15Å; L305-Y512 HydrophobicContact CD2-CD1 4.37Å; L305-Y512 HydrophobicContact CD2-CE1 4.48Å; L305-L513 HydrophobicContact CD2-CD2 4.03Å; L305-L513 HydrophobicContact CD2-CG 4.34Å
306	P	86.9	Confident	78.7	Confident	45 Å²	45	74.8 Å²	74.8	29%	0.292	39%	0.39	S	S	.	.	P	Polyproline II helix	trans	-67.1	152.1	171.4	32	-35.1	0	0	0	109.7	V309 I339 Y512	P306-V309 HydrophobicContact CG-CG1 4.32Å; P306-I339 HydrophobicContact CG-CD1 4.12Å; P306-I339 VanDerWaalsContact O-CG2 3.27Å; P306-I339 WeakPolarHBondContact O-CG2 3.46Å; P306-Y512 HydrophobicContact CG-CE1 4.03Å; P306-Y512 HydrophobicContact CG-CE2 4.38Å
307	E	89.2	Confident	79.3	Confident	160 Å²	160	76.3 Å²	76.3	75%	0.748	40%	0.401	S	S	*	.	S	Bend	trans	-70.8	-39.7	-179.5	-166.4	159.4	-152.3	0	0	111.1	D338 I339	E307-D338 WeakPolarHBondContact O-CA 3.32Å; E307-I339 PolarHBondContact O-N 3.01Å
308	D	94	Very high	80.7	Confident	43 Å²	43	76.4 Å²	76.4	23%	0.23	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	155.8	173.1	-53.6	-69.8	0	0	0	111.9	R336 V337 D338	D308-R336 HydrophobicContact CB-CG 3.63Å; D308-R336 IonicContact OD2-CZ 2.67Å; D308-R336 IonicContact OD2-NE 2.82Å; D308-R336 PolarHBondContact OD2-NE 3.47Å; D308-R336 IonicContact OD2-NH2 3.64Å; D308-R336 PolarHBondContact OD2-NH2 3.07Å; D308-V337 CarbonylContact C-O 3.51Å; D308-V337 WeakPolarHBondContact CA-O 3.29Å; D308-D338 WeakPolarHBondContact OD1-CA 3.27Å; D308-D338 PolarHBondContact OD1-N 2.96Å
309	V	94.1	Very high	82.6	Confident	5 Å²	5	79.4 Å²	79.4	3%	0.03	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	151.2	167.2	-66.8	0	0	0	0	110.8	P306 V337 I339 L508 Y512 I521	P306-V309 HydrophobicContact CG-CG1 4.32Å; V309-V337 PolarHBondContact N-O 3.38Å; V309-V337 PolarHBondContact O-N 3.29Å; V309-I339 HydrophobicContact CG1-CB 4.15Å; V309-I339 HydrophobicContact CG1-CD1 3.78Å; V309-I339 HydrophobicContact CG1-CG1 3.7Å; V309-L508 HydrophobicContact CG2-CB 4.33Å; V309-L508 HydrophobicContact CG2-CD1 4.36Å; V309-Y512 HydrophobicContact CB-CD2 4.39Å; V309-Y512 HydrophobicContact CG1-CD2 3.45Å; V309-Y512 VanDerWaalsContact CG1-CD2 3.45Å; V309-Y512 HydrophobicContact CG1-CE2 3.81Å; V309-Y512 HydrophobicContact CG1-CG 3.93Å; V309-I521 HydrophobicContact CG2-CD1 4.46Å
310	W	95.5	Very high	84.5	Confident	101 Å²	101	76.9 Å²	76.9	38%	0.383	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	133.3	170.7	-71.9	101.9	0	0	0	110.9	L335 R336 R520 I521	W310-L335 WeakPolarHBondContact CA-O 3.44Å; W310-R336 HydrophobicContact CD2-CB 4.3Å; W310-R336 HydrophobicContact CE3-CB 3.95Å; W310-R336 HydrophobicContact CH2-CB 4.01Å; W310-R336 HydrophobicContact CZ2-CB 4.33Å; W310-R336 HydrophobicContact CZ3-CB 3.81Å; W310-R520 HydrophobicContact CB-CB 3.99Å; W310-R520 CarbonylContact O-C 3.56Å; W310-R520 VanDerWaalsContact O-CA 3.32Å; W310-R520 WeakPolarHBondContact O-CA 3.26Å; W310-I521 PolarHBondContact O-N 3.22Å
311	I	95.5	Very high	86.5	Confident	1 Å²	1	70 Å²	70	1%	0.005	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	129.6	174.4	-61.1	178	0	0	0	108.4	L313 R334 L335 V337 V346 L508 I521 F523	I311-L313 HydrophobicContact CG2-CD2 3.66Å; I311-L313 HydrophobicContact CG2-CG 4.22Å; I311-R334 WeakPolarHBondContact O-CA 3.34Å; I311-L335 HydrophobicContact CB-CB 4.5Å; I311-L335 PolarHBondContact N-O 3.44Å; I311-L335 PolarHBondContact O-N 2.93Å; I311-V337 HydrophobicContact CD1-CB 4.29Å; I311-V337 HydrophobicContact CD1-CG2 4Å; I311-V346 HydrophobicContact CD1-CG1 4.38Å; I311-V346 HydrophobicContact CD1-CG2 3.88Å; I311-L508 HydrophobicContact CD1-CD1 3.88Å; I311-L508 HydrophobicContact CD1-CD2 3.73Å; I311-L508 HydrophobicContact CD1-CG 4.47Å; I311-I521 CarbonylContact C-O 3.59Å; I311-I521 WeakPolarHBondContact CA-O 3.26Å; I311-F523 HydrophobicContact CG2-CD2 3.73Å; I311-F523 HydrophobicContact CG2-CE2 3.98Å
312	E	95.1	Very high	88.4	Confident	8 Å²	8	70.2 Å²	70.2	4%	0.037	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	120.9	169.6	-173	173.8	139.5	0	0	109.7	V314 R332 R334 R520 I521 R522 F523	E312-V314 HydrophobicContact CG-CG2 4.06Å; E312-R332 IonicContact OE1-CZ 3.21Å; E312-R332 IonicContact OE1-NE 2.72Å; E312-R332 IonicContact OE1-NH2 2.66Å; E312-R332 PolarHBondContact OE1-NH2 2.9Å; E312-R334 HydrophobicContact CB-CG 4.32Å; E312-R334 HydrophobicContact CG-CG 4.06Å; E312-R334 IonicContact OE1-NH2 2.73Å; E312-R334 IonicContact OE2-CZ 2.68Å; E312-R334 VanDerWaalsContact OE2-CZ 3.25Å; E312-R334 IonicContact OE2-NE 3.61Å; E312-R334 PolarHBondContact OE2-NE 2.95Å; E312-R334 IonicContact OE2-NH2 3.84Å; E312-R334 PolarHBondContact OE2-NH2 3.09Å; E312-R520 IonicContact OE2-NH1 2.59Å; E312-I521 PolarHBondContact N-O 2.97Å; E312-R522 HydrophobicContact CB-CG 4.39Å; E312-R522 WeakPolarHBondContact O-CA 3.33Å; E312-F523 PolarHBondContact O-N 3.12Å
313	L	95.9	Very high	90.1	Very high	0 Å²	0	65.1 Å²	65.1	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	132.5	174.8	-52.2	-179.1	0	0	0	109.4	I311 R332 L333 L335 V350 W354 L380 F523 Y525	I311-L313 HydrophobicContact CG2-CD2 3.66Å; I311-L313 HydrophobicContact CG2-CG 4.22Å; L313-R332 WeakPolarHBondContact O-CA 3.45Å; L313-L333 HydrophobicContact CB-CB 4.35Å; L313-L333 HydrophobicContact CD1-CB 4.48Å; L313-L333 HydrophobicContact CD1-CD2 4.31Å; L313-L333 PolarHBondContact N-O 2.95Å; L313-L333 PolarHBondContact O-N 3.02Å; L313-L333 VanDerWaalsContact O-N 3.16Å; L313-L335 HydrophobicContact CD1-CD1 4.34Å; L313-V350 HydrophobicContact CD1-CG1 4.4Å; L313-V350 HydrophobicContact CD1-CG2 3.39Å; L313-W354 HydrophobicContact CB-CH2 4.5Å; L313-W354 HydrophobicContact CD1-CH2 4.43Å; L313-L380 HydrophobicContact CD2-CD1 4.39Å; L313-L380 HydrophobicContact CD2-CD2 4.22Å; L313-F523 WeakPolarHBondContact CA-O 3.49Å; L313-F523 HydrophobicContact CD2-CB 3.87Å; L313-F523 HydrophobicContact CD2-CD2 3.96Å; L313-F523 HydrophobicContact CD2-CG 4.39Å; L313-Y525 HydrophobicContact CB-CD1 4.17Å
314	V	94.3	Very high	91.4	Very high	16 Å²	16	59.8 Å²	59.8	10%	0.097	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	141	-179	-176.2	0	0	0	0	109.5	E312 R332 F523 E524 Y525	E312-V314 HydrophobicContact CG-CG2 4.06Å; V314-R332 HydrophobicContact CG1-CG 4.41Å; V314-R332 HydrophobicContact CG2-CG 4.46Å; V314-F523 PolarHBondContact N-O 3.2Å; V314-E524 CarbonylContact O-C 3.54Å; V314-E524 VanDerWaalsContact O-CA 3.23Å; V314-E524 WeakPolarHBondContact O-CA 3.23Å; V314-Y525 WeakPolarHBondContact O-CD1 3.25Å; V314-Y525 PolarHBondContact O-N 2.9Å
315	P	95.1	Very high	92.2	Very high	31 Å²	31	56 Å²	56	20%	0.201	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.8	138.7	178.5	23.3	-35.3	0	0	0	111.2	D320 A321 P331 Y525	P315-D320 HydrophobicContact CB-CB 4.08Å; P315-A321 HydrophobicContact CB-CB 3.79Å; P315-A321 HydrophobicContact CG-CB 3.69Å; P315-P331 WeakPolarHBondContact CD-O 3.34Å; P315-P331 HydrophobicContact CG-CB 4.49Å; P315-Y525 HydrophobicContact CB-CE1 4.08Å; P315-Y525 HydrophobicContact CB-CE2 4.11Å
316	R	91.5	Very high	92.6	Very high	131 Å²	131	58.6 Å²	58.6	49%	0.494	28%	0.28	S	S	.	.	S	Bend	trans	-77.7	-37.5	173.2	-164.5	-179.8	-174.4	-132.9	-6.6	111.7	E524 Y525 Q526	R316-E524 HydrophobicContact CB-CB 4.21Å; R316-E524 HydrophobicContact CG-CB 4.32Å; R316-Y525 WeakPolarHBondContact CB-O 3.39Å; R316-Y525 PolarHBondContact N-O 2.81Å; R316-Q526 HydrophobicContact CB-CB 4.24Å
317	T	91.3	Very high	92.6	Very high	65 Å²	65	56.4 Å²	56.4	40%	0.399	27%	0.266	S	S	.	.	S	Bend	trans	-123.7	160.1	173.9	77.1	0	0	0	0	111.9	T319 D320 A321	T317-T319 PolarHBondContact O-N 3.48Å; T317-T319 PolarHBondContact OG1-N 3.18Å; T317-D320 VanDerWaalsContact CB-OD2 3.3Å; T317-D320 WeakPolarHBondContact CB-OD2 3.37Å; T317-D320 WeakPolarHBondContact CG2-OD2 3.48Å; T317-D320 PolarHBondContact N-OD2 3.19Å; T317-D320 WeakPolarHBondContact O-CB 3.41Å; T317-D320 PolarHBondContact O-N 3.14Å; T317-D320 VanDerWaalsContact O-N 3.17Å; T317-D320 VanDerWaalsContact OG1-CG 3.28Å; T317-D320 PolarHBondContact OG1-N 3.42Å; T317-D320 PolarHBondContact OG1-OD2 2.86Å; T317-A321 PolarHBondContact O-N 3.26Å
318	Q	92.5	Very high	92.6	Very high	113 Å²	113	56.5 Å²	56.5	53%	0.528	27%	0.266	S	S	.	.	H	α-helix	trans	-63	-25.9	173.6	-175.4	55.6	49.5	0	0	112.3	A321 W322	Q318-A321 WeakPolarHBondContact O-CB 3.31Å; Q318-A321 PolarHBondContact O-N 2.82Å; Q318-W322 VanDerWaalsContact NE2-NE1 3.16Å; Q318-W322 PolarHBondContact O-N 2.81Å
319	T	91.5	Very high	92.4	Very high	109 Å²	109	57 Å²	57	67%	0.669	27%	0.267	S	S	*	.	H	α-helix	trans	-67.1	-41.8	173.9	-47.7	0	0	0	0	111.5	T317 A321 W322 R323	T317-T319 PolarHBondContact O-N 3.48Å; T317-T319 PolarHBondContact OG1-N 3.18Å; T319-A321 VanDerWaalsContact C-N 3.28Å; T319-A321 PolarHBondContact O-N 2.9Å; T319-W322 PolarHBondContact O-N 3.45Å; T319-R323 PolarHBondContact O-N 3.31Å
320	D	93.5	Very high	92.1	Very high	10 Å²	10	60.1 Å²	60.1	5%	0.053	28%	0.284	C	S	.	.	H	α-helix	trans	-63.8	-35.9	174.1	-55.4	-63.8	0	0	0	111.6	P315 T317 V324 Y525 Q526 F527	P315-D320 HydrophobicContact CB-CB 4.08Å; T317-D320 VanDerWaalsContact CB-OD2 3.3Å; T317-D320 WeakPolarHBondContact CB-OD2 3.37Å; T317-D320 WeakPolarHBondContact CG2-OD2 3.48Å; T317-D320 PolarHBondContact N-OD2 3.19Å; T317-D320 WeakPolarHBondContact O-CB 3.41Å; T317-D320 PolarHBondContact O-N 3.14Å; T317-D320 VanDerWaalsContact O-N 3.17Å; T317-D320 VanDerWaalsContact OG1-CG 3.28Å; T317-D320 PolarHBondContact OG1-N 3.42Å; T317-D320 PolarHBondContact OG1-OD2 2.86Å; D320-V324 WeakPolarHBondContact O-CG2 3.4Å; D320-V324 PolarHBondContact O-N 3.14Å; D320-Y525 HydrophobicContact CB-CD2 4.13Å; D320-Y525 HydrophobicContact CB-CE2 3.77Å; D320-Q526 VanDerWaalsContact OD1-CA 3.27Å; D320-Q526 WeakPolarHBondContact OD1-CA 3.46Å; D320-F527 HydrophobicContact CB-CD2 4.16Å; D320-F527 HydrophobicContact CB-CE2 4.45Å; D320-F527 PolarHBondContact OD1-N 3.43Å
321	A	92.2	Very high	92	Very high	5 Å²	5	56.3 Å²	56.3	4%	0.041	27%	0.272	C	S	.	.	H	α-helix	trans	-64.4	-46.8	174.3	0	0	0	0	0	111.5	P315 T317 Q318 T319 V324 I325 P331	P315-A321 HydrophobicContact CB-CB 3.79Å; P315-A321 HydrophobicContact CG-CB 3.69Å; T317-A321 PolarHBondContact O-N 3.26Å; Q318-A321 WeakPolarHBondContact O-CB 3.31Å; Q318-A321 PolarHBondContact O-N 2.82Å; T319-A321 VanDerWaalsContact C-N 3.28Å; T319-A321 PolarHBondContact O-N 2.9Å; A321-V324 PolarHBondContact O-N 3.2Å; A321-I325 WeakPolarHBondContact O-CG1 3.33Å; A321-I325 PolarHBondContact O-N 3.1Å; A321-I325 VanDerWaalsContact O-N 3.11Å; A321-P331 HydrophobicContact CB-CB 4.25Å
322	W	91.9	Very high	91.9	Very high	153 Å²	153	60.8 Å²	60.8	58%	0.58	29%	0.289	S	S	*	.	H	α-helix	trans	-62.9	-41.5	179.7	-76.7	125.5	0	0	0	112.9	Q318 T319 V324 I325 E326	Q318-W322 VanDerWaalsContact NE2-NE1 3.16Å; Q318-W322 PolarHBondContact O-N 2.81Å; T319-W322 PolarHBondContact O-N 3.45Å; W322-V324 VanDerWaalsContact C-N 3.27Å; W322-V324 PolarHBondContact O-N 3.25Å; W322-I325 HydrophobicContact CE3-CB 4.38Å; W322-I325 HydrophobicContact CE3-CD1 3.86Å; W322-I325 HydrophobicContact CE3-CG2 4.33Å; W322-I325 HydrophobicContact CZ3-CD1 4.1Å; W322-I325 HydrophobicContact CZ3-CG2 4.42Å; W322-I325 WeakPolarHBondContact O-CB 3.2Å; W322-I325 PolarHBondContact O-N 2.77Å; W322-I325 VanDerWaalsContact O-N 3.15Å; W322-E326 WeakPolarHBondContact O-CB 3.41Å; W322-E326 PolarHBondContact O-N 3.04Å
323	R	91.1	Very high	91.9	Very high	37 Å²	37	60.7 Å²	60.7	14%	0.14	29%	0.289	C	S	.	.	H	α-helix	trans	-59.9	-37.8	177	-165.8	-172.4	-168.3	117.7	10	112.4	T319 E326 A327 L356 E359 F527	T319-R323 PolarHBondContact O-N 3.31Å; R323-E326 PolarHBondContact O-N 2.84Å; R323-A327 PolarHBondContact O-N 3.16Å; R323-A327 VanDerWaalsContact O-N 3.08Å; R323-L356 HydrophobicContact CG-CD2 4.46Å; R323-E359 IonicContact CZ-OE1 3.81Å; R323-E359 IonicContact NH2-OE1 3.6Å; R323-E359 PolarHBondContact NH2-OE1 2.84Å; R323-F527 HydrophobicContact CB-CD2 4.3Å; R323-F527 HydrophobicContact CB-CE2 3.99Å; R323-F527 HydrophobicContact CG-CE2 4.31Å; R323-F527 HydrophobicContact CG-CZ 4.47Å
324	V	91.4	Very high	91.8	Very high	0 Å²	0	62.9 Å²	62.9	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-72.9	-34.2	178.4	-179.8	0	0	0	0	111.7	D320 A321 W322 A327 Q329 P331 W354 Y525 F527	D320-V324 WeakPolarHBondContact O-CG2 3.4Å; D320-V324 PolarHBondContact O-N 3.14Å; A321-V324 PolarHBondContact O-N 3.2Å; W322-V324 VanDerWaalsContact C-N 3.27Å; W322-V324 PolarHBondContact O-N 3.25Å; V324-A327 PolarHBondContact O-N 3.27Å; V324-Q329 CarbonylContact C-O 3.49Å; V324-Q329 HydrophobicContact CG1-CB 3.72Å; V324-Q329 WeakPolarHBondContact O-CB 3.4Å; V324-Q329 PolarHBondContact O-N 3.48Å; V324-Q329 VanDerWaalsContact O-O 3.14Å; V324-P331 HydrophobicContact CB-CB 4.23Å; V324-P331 HydrophobicContact CG1-CB 4.32Å; V324-W354 HydrophobicContact CB-CD2 4.37Å; V324-W354 HydrophobicContact CG1-CD2 3.87Å; V324-W354 HydrophobicContact CG1-CG 3.97Å; V324-W354 HydrophobicContact CG1-CZ2 4.08Å; V324-W354 HydrophobicContact CG2-CB 4.43Å; V324-W354 HydrophobicContact CG2-CD2 3.5Å; V324-W354 HydrophobicContact CG2-CE3 3.52Å; V324-W354 HydrophobicContact CG2-CG 3.93Å; V324-W354 HydrophobicContact CG2-CH2 4.37Å; V324-W354 HydrophobicContact CG2-CZ2 4.32Å; V324-W354 HydrophobicContact CG2-CZ3 3.98Å; V324-Y525 HydrophobicContact CG2-CE2 3.84Å; V324-Y525 WeakPolarHBondContact CG2-OH 3.47Å; V324-F527 HydrophobicContact CG2-CE2 3.81Å; V324-F527 HydrophobicContact CG2-CZ 3.79Å
325	I	91.3	Very high	91.7	Very high	64 Å²	64	62.2 Å²	62.2	33%	0.328	29%	0.293	S	S	.	.	H	α-helix	trans	-65.3	-40.4	171.3	-66.1	164	0	0	0	110.8	A321 W322 A327 E328 P331	A321-I325 WeakPolarHBondContact O-CG1 3.33Å; A321-I325 PolarHBondContact O-N 3.1Å; A321-I325 VanDerWaalsContact O-N 3.11Å; W322-I325 HydrophobicContact CE3-CB 4.38Å; W322-I325 HydrophobicContact CE3-CD1 3.86Å; W322-I325 HydrophobicContact CE3-CG2 4.33Å; W322-I325 HydrophobicContact CZ3-CD1 4.1Å; W322-I325 HydrophobicContact CZ3-CG2 4.42Å; W322-I325 WeakPolarHBondContact O-CB 3.2Å; W322-I325 PolarHBondContact O-N 2.77Å; W322-I325 VanDerWaalsContact O-N 3.15Å; I325-A327 VanDerWaalsContact C-N 3.27Å; I325-A327 PolarHBondContact O-N 3Å; I325-E328 WeakPolarHBondContact O-CA 3.35Å; I325-E328 PolarHBondContact O-N 2.91Å; I325-P331 HydrophobicContact CD1-CG 4.23Å; I325-P331 HydrophobicContact CG1-CG 4.05Å
326	E	89.9	Confident	91.7	Very high	133 Å²	133	65.7 Å²	65.7	62%	0.621	30%	0.302	S	S	*	.	H	α-helix	trans	-65.8	-26.6	175.5	-165.6	-171.1	174.8	0	0	112.8	W322 R323 E328 L356	W322-E326 WeakPolarHBondContact O-CB 3.41Å; W322-E326 PolarHBondContact O-N 3.04Å; R323-E326 PolarHBondContact O-N 2.84Å; E326-E328 PolarHBondContact O-N 2.85Å; E326-L356 HydrophobicContact CB-CD2 3.84Å; E326-L356 HydrophobicContact CG-CD2 3.79Å
327	A	87.4	Confident	91.9	Very high	0 Å²	0	59.8 Å²	59.8	0%	0	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.6	3.2	168.6	0	0	0	0	0	113.8	R323 V324 I325 Q329 L356 R360	R323-A327 PolarHBondContact O-N 3.16Å; R323-A327 VanDerWaalsContact O-N 3.08Å; V324-A327 PolarHBondContact O-N 3.27Å; I325-A327 VanDerWaalsContact C-N 3.27Å; I325-A327 PolarHBondContact O-N 3Å; A327-Q329 VanDerWaalsContact C-N 3.35Å; A327-Q329 HydrophobicContact CB-CG 4.09Å; A327-Q329 WeakPolarHBondContact O-CG 3.21Å; A327-Q329 PolarHBondContact O-NE2 3.24Å; A327-Q329 VanDerWaalsContact O-NE2 3.11Å; A327-L356 HydrophobicContact CB-CD2 4.14Å; A327-R360 PolarHBondContact O-NH2 3.33Å
328	E	89.7	Confident	92	Very high	161 Å²	161	59.2 Å²	59.2	75%	0.752	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.5	32.1	-174	-54.6	175.3	146.6	0	0	113.4	I325 E326	I325-E328 WeakPolarHBondContact O-CA 3.35Å; I325-E328 PolarHBondContact O-N 2.91Å; E326-E328 PolarHBondContact O-N 2.85Å
329	Q	88.7	Confident	92.1	Very high	53 Å²	53	54 Å²	54	25%	0.248	25%	0.25	C	S	.	.	S	Bend	trans	-120.2	153.6	-174.6	-52.5	-56.6	-54.4	0	0	112.5	V324 A327 P331	V324-Q329 CarbonylContact C-O 3.49Å; V324-Q329 HydrophobicContact CG1-CB 3.72Å; V324-Q329 WeakPolarHBondContact O-CB 3.4Å; V324-Q329 PolarHBondContact O-N 3.48Å; V324-Q329 VanDerWaalsContact O-O 3.14Å; A327-Q329 VanDerWaalsContact C-N 3.35Å; A327-Q329 HydrophobicContact CB-CG 4.09Å; A327-Q329 WeakPolarHBondContact O-CG 3.21Å; A327-Q329 PolarHBondContact O-NE2 3.24Å; A327-Q329 VanDerWaalsContact O-NE2 3.11Å; Q329-P331 WeakPolarHBondContact O-CD 3.23Å
330	N	89.7	Confident	92.2	Very high	71 Å²	71	53.7 Å²	53.7	38%	0.38	25%	0.245	S	C	.	.			trans	-68.1	122	171.7	-173.9	-16.4	0	0	0	109.8	R332 D1139	N330-R332 PolarHBondContact O-N 3.02Å; N330-R332 PolarHBondContact OD1-N 3.17Å; N330-R332 PolarHBondContact OD1-O 2.84Å; N330-D1139 PolarHBondContact ND2-O 3.27Å
331	P	92.8	Very high	92.2	Very high	22 Å²	22	56.4 Å²	56.4	14%	0.143	25%	0.254	C	S	.	.	S	Bend	trans	-67.8	-13	178	28.7	-36.2	0	0	0	113.6	P315 A321 V324 I325 Q329 Y525	P315-P331 WeakPolarHBondContact CD-O 3.34Å; P315-P331 HydrophobicContact CG-CB 4.49Å; A321-P331 HydrophobicContact CB-CB 4.25Å; V324-P331 HydrophobicContact CB-CB 4.23Å; V324-P331 HydrophobicContact CG1-CB 4.32Å; I325-P331 HydrophobicContact CD1-CG 4.23Å; I325-P331 HydrophobicContact CG1-CG 4.05Å; Q329-P331 WeakPolarHBondContact O-CD 3.23Å; P331-Y525 WeakPolarHBondContact CA-OH 3.08Å; P331-Y525 WeakPolarHBondContact CB-OH 3.41Å; P331-Y525 VanDerWaalsContact O-CE1 3.26Å; P331-Y525 WeakPolarHBondContact O-CE1 3.15Å; P331-Y525 PolarHBondContact O-OH 3.04Å
332	R	93.7	Very high	92.4	Very high	94 Å²	94	59.6 Å²	59.6	36%	0.355	27%	0.269	S	S	.	.	S	Bend	trans	-110.9	110.8	171.5	-67	-176.6	69	-175.2	0.9	109.7	E312 L313 V314 N330	E312-R332 IonicContact OE1-CZ 3.21Å; E312-R332 IonicContact OE1-NE 2.72Å; E312-R332 IonicContact OE1-NH2 2.66Å; E312-R332 PolarHBondContact OE1-NH2 2.9Å; L313-R332 WeakPolarHBondContact O-CA 3.45Å; V314-R332 HydrophobicContact CG1-CG 4.41Å; V314-R332 HydrophobicContact CG2-CG 4.46Å; N330-R332 PolarHBondContact O-N 3.02Å; N330-R332 PolarHBondContact OD1-N 3.17Å; N330-R332 PolarHBondContact OD1-O 2.84Å
333	L	93.6	Very high	92.6	Very high	7 Å²	7	52.3 Å²	52.3	4%	0.037	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	125.9	-174.5	-172.7	62.1	0	0	0	110.4	L313 L335 V350 K353 W354 I1136	L313-L333 HydrophobicContact CB-CB 4.35Å; L313-L333 HydrophobicContact CD1-CB 4.48Å; L313-L333 HydrophobicContact CD1-CD2 4.31Å; L313-L333 PolarHBondContact N-O 2.95Å; L313-L333 PolarHBondContact O-N 3.02Å; L313-L333 VanDerWaalsContact O-N 3.16Å; L333-L335 HydrophobicContact CD1-CD2 4.2Å; L333-L335 HydrophobicContact CD2-CD1 4.24Å; L333-L335 HydrophobicContact CD2-CD2 3.98Å; L333-L335 HydrophobicContact CD2-CG 4.21Å; L333-L335 HydrophobicContact CG-CD2 3.88Å; L333-L335 HydrophobicContact CG-CG 4.03Å; L333-V350 HydrophobicContact CD2-CG2 4.31Å; L333-K353 HydrophobicContact CD2-CD 4.22Å; L333-W354 HydrophobicContact CB-CZ2 4.11Å; L333-W354 HydrophobicContact CD2-CZ2 4.18Å; L333-I1136 HydrophobicContact CD1-CG2 3.83Å
334	R	93.9	Very high	92.8	Very high	46 Å²	46	50.9 Å²	50.9	17%	0.174	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	127.4	170.4	-74.1	179.1	173.6	149.1	5.6	109.5	I311 E312 D1139 Y1141	I311-R334 WeakPolarHBondContact O-CA 3.34Å; E312-R334 HydrophobicContact CB-CG 4.32Å; E312-R334 HydrophobicContact CG-CG 4.06Å; E312-R334 IonicContact OE1-NH2 2.73Å; E312-R334 IonicContact OE2-CZ 2.68Å; E312-R334 VanDerWaalsContact OE2-CZ 3.25Å; E312-R334 IonicContact OE2-NE 3.61Å; E312-R334 PolarHBondContact OE2-NE 2.95Å; E312-R334 IonicContact OE2-NH2 3.84Å; E312-R334 PolarHBondContact OE2-NH2 3.09Å; R334-D1139 WeakPolarHBondContact CD-OD2 3.23Å; R334-D1139 IonicContact CZ-OD2 3.58Å; R334-D1139 IonicContact NE-OD2 3.04Å; R334-D1139 IonicContact NH1-OD2 2.63Å; R334-D1139 PolarHBondContact NH1-OD2 3.2Å; R334-Y1141 PolarHBondContact NH1-OH 3.21Å; R334-Y1141 PolarHBondContact NH2-OH 2.67Å
335	L	94	Very high	93	Very high	1 Å²	1	53.7 Å²	53.7	1%	0.005	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	136.6	-178.5	-59.8	176	0	0	0	109.7	W310 I311 L313 L333 V337 V346 L349 L1134 I1136	W310-L335 WeakPolarHBondContact CA-O 3.44Å; I311-L335 HydrophobicContact CB-CB 4.5Å; I311-L335 PolarHBondContact N-O 3.44Å; I311-L335 PolarHBondContact O-N 2.93Å; L313-L335 HydrophobicContact CD1-CD1 4.34Å; L333-L335 HydrophobicContact CD1-CD2 4.2Å; L333-L335 HydrophobicContact CD2-CD1 4.24Å; L333-L335 HydrophobicContact CD2-CD2 3.98Å; L333-L335 HydrophobicContact CD2-CG 4.21Å; L333-L335 HydrophobicContact CG-CD2 3.88Å; L333-L335 HydrophobicContact CG-CG 4.03Å; L335-V337 HydrophobicContact CB-CG2 3.79Å; L335-V346 HydrophobicContact CD1-CG1 3.98Å; L335-L349 HydrophobicContact CD1-CD2 4.15Å; L335-L349 HydrophobicContact CD2-CD2 4.39Å; L335-L1134 HydrophobicContact CD2-CD2 4.21Å; L335-I1136 HydrophobicContact CD2-CG1 4.01Å
336	R	95.1	Very high	93.1	Very high	105 Å²	105	50.9 Å²	50.9	40%	0.396	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	126.2	162.2	-179.9	174.2	167.8	177.2	-4.8	108.1	D308 W310	D308-R336 HydrophobicContact CB-CG 3.63Å; D308-R336 IonicContact OD2-CZ 2.67Å; D308-R336 IonicContact OD2-NE 2.82Å; D308-R336 PolarHBondContact OD2-NE 3.47Å; D308-R336 IonicContact OD2-NH2 3.64Å; D308-R336 PolarHBondContact OD2-NH2 3.07Å; W310-R336 HydrophobicContact CD2-CB 4.3Å; W310-R336 HydrophobicContact CE3-CB 3.95Å; W310-R336 HydrophobicContact CH2-CB 4.01Å; W310-R336 HydrophobicContact CZ2-CB 4.33Å; W310-R336 HydrophobicContact CZ3-CB 3.81Å
337	V	93.8	Very high	93.3	Very high	7 Å²	7	44.6 Å²	44.6	4%	0.042	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	132.5	-171.1	-170.2	0	0	0	0	110.5	D308 V309 I311 L335 I339 R341 V346 L508 L1134	D308-V337 CarbonylContact C-O 3.51Å; D308-V337 WeakPolarHBondContact CA-O 3.29Å; V309-V337 PolarHBondContact N-O 3.38Å; V309-V337 PolarHBondContact O-N 3.29Å; I311-V337 HydrophobicContact CD1-CB 4.29Å; I311-V337 HydrophobicContact CD1-CG2 4Å; L335-V337 HydrophobicContact CB-CG2 3.79Å; V337-I339 PolarHBondContact O-N 2.88Å; V337-R341 HydrophobicContact CG1-CB 4.14Å; V337-R341 HydrophobicContact CG1-CG 4.44Å; V337-V346 HydrophobicContact CG1-CG2 4.39Å; V337-L508 HydrophobicContact CB-CD1 4.01Å; V337-L508 HydrophobicContact CG1-CD1 3.54Å; V337-L1134 HydrophobicContact CG2-CD2 4.14Å
338	D	95	Very high	93.6	Very high	52 Å²	52	47.5 Å²	47.5	28%	0.278	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-48.1	126.1	172.6	178.2	-27.9	0	0	0	110.8	E307 D308 N340 R341	E307-D338 WeakPolarHBondContact O-CA 3.32Å; D308-D338 WeakPolarHBondContact OD1-CA 3.27Å; D308-D338 PolarHBondContact OD1-N 2.96Å; D338-N340 PolarHBondContact O-N 2.87Å; D338-N340 VanDerWaalsContact OD1-CB 3.27Å; D338-N340 WeakPolarHBondContact OD1-CB 3.35Å; D338-N340 PolarHBondContact OD1-N 3.17Å; D338-N340 PolarHBondContact OD1-ND2 2.91Å; D338-R341 HydrophobicContact CB-CG 4.14Å; D338-R341 WeakPolarHBondContact O-CB 3.38Å; D338-R341 PolarHBondContact O-N 2.88Å; D338-R341 VanDerWaalsContact O-N 3.1Å
339	I	93.9	Very high	93.7	Very high	3 Å²	3	41.4 Å²	41.4	2%	0.015	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-21.6	-174.8	-160.6	172.8	0	0	0	113.3	L305 P306 E307 V309 V337 V509 Y512	L305-I339 HydrophobicContact CB-CD1 4.42Å; L305-I339 HydrophobicContact CD2-CD1 4.04Å; P306-I339 HydrophobicContact CG-CD1 4.12Å; P306-I339 VanDerWaalsContact O-CG2 3.27Å; P306-I339 WeakPolarHBondContact O-CG2 3.46Å; E307-I339 PolarHBondContact O-N 3.01Å; V309-I339 HydrophobicContact CG1-CB 4.15Å; V309-I339 HydrophobicContact CG1-CD1 3.78Å; V309-I339 HydrophobicContact CG1-CG1 3.7Å; V337-I339 PolarHBondContact O-N 2.88Å; I339-V509 HydrophobicContact CD1-CB 4.33Å; I339-V509 HydrophobicContact CD1-CG2 4.12Å; I339-V509 HydrophobicContact CG1-CB 3.86Å; I339-V509 HydrophobicContact CG1-CG2 4.19Å; I339-V509 WeakPolarHBondContact O-CB 3.47Å; I339-V509 PolarHBondContact O-N 3.33Å; I339-Y512 HydrophobicContact CD1-CD1 3.7Å; I339-Y512 HydrophobicContact CD1-CE1 4.22Å; I339-Y512 HydrophobicContact CD1-CG 3.98Å
340	N	93.7	Very high	93.9	Very high	104 Å²	104	38.9 Å²	38.9	56%	0.556	18%	0.181	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.7	-12.1	-176.9	-55.5	-85.3	0	0	0	113.5	D338	D338-N340 PolarHBondContact O-N 2.87Å; D338-N340 VanDerWaalsContact OD1-CB 3.27Å; D338-N340 WeakPolarHBondContact OD1-CB 3.35Å; D338-N340 PolarHBondContact OD1-N 3.17Å; D338-N340 PolarHBondContact OD1-ND2 2.91Å
341	R	94.3	Very high	93.9	Very high	66 Å²	66	37 Å²	37	25%	0.249	17%	0.17	C	C	.	.	S	Bend	trans	-66.8	161.9	179	-79	174.3	172.3	-107	11.3	112.9	V337 D338 D345 L508	V337-R341 HydrophobicContact CG1-CB 4.14Å; V337-R341 HydrophobicContact CG1-CG 4.44Å; D338-R341 HydrophobicContact CB-CG 4.14Å; D338-R341 WeakPolarHBondContact O-CB 3.38Å; D338-R341 PolarHBondContact O-N 2.88Å; D338-R341 VanDerWaalsContact O-N 3.1Å; R341-D345 WeakPolarHBondContact CB-OD2 3.41Å; R341-L508 HydrophobicContact CB-CD1 4.23Å; R341-L508 PolarHBondContact O-N 3.29Å
342	Q	95.9	Very high	93.6	Very high	73 Å²	73	39.4 Å²	39.4	34%	0.341	18%	0.182	S	C	.	.	B	Isolated β-bridge	trans	-86.5	150.7	175.6	-65.8	174	-18.4	0	0	110.2	S344 D345 R504 I506	Q342-S344 VanDerWaalsContact CB-OG 3.24Å; Q342-S344 WeakPolarHBondContact CB-OG 3.32Å; Q342-S344 PolarHBondContact O-N 2.67Å; Q342-S344 PolarHBondContact OE1-OG 2.79Å; Q342-D345 PolarHBondContact N-OD2 3.17Å; Q342-D345 WeakPolarHBondContact O-CB 3.22Å; Q342-D345 PolarHBondContact O-N 3.27Å; Q342-D345 VanDerWaalsContact O-N 3.09Å; Q342-R504 PolarHBondContact NE2-O 3.32Å; Q342-R504 PolarHBondContact OE1-O 3.13Å; Q342-I506 WeakPolarHBondContact CA-O 3.25Å
343	L	95.9	Very high	93.4	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-64.5	-27.5	173.1	-177	62.3	0	0	0	111.1	D345 V346 I347 L380 L494 V498 A503 I506 L508 I511 F523	L343-D345 VanDerWaalsContact C-N 3.25Å; L343-D345 PolarHBondContact O-N 2.88Å; L343-V346 HydrophobicContact CD1-CB 4.39Å; L343-V346 WeakPolarHBondContact O-CB 3.33Å; L343-V346 PolarHBondContact O-N 3.07Å; L343-V346 VanDerWaalsContact O-N 3.15Å; L343-I347 WeakPolarHBondContact O-CG1 3.08Å; L343-I347 PolarHBondContact O-N 3.4Å; L343-L380 HydrophobicContact CD1-CD1 3.91Å; L343-L380 HydrophobicContact CG-CD1 4.48Å; L343-L494 HydrophobicContact CD2-CD2 3.9Å; L343-V498 HydrophobicContact CD2-CG2 3.62Å; L343-A503 HydrophobicContact CB-CB 4.01Å; L343-A503 HydrophobicContact CD2-CB 4.39Å; L343-A503 HydrophobicContact CG-CB 4.12Å; L343-I506 HydrophobicContact CB-CB 4.37Å; L343-I506 HydrophobicContact CB-CG2 4.37Å; L343-I506 HydrophobicContact CD2-CG2 4.37Å; L343-I506 PolarHBondContact N-O 2.87Å; L343-L508 HydrophobicContact CB-CD2 4.49Å; L343-L508 HydrophobicContact CD1-CD2 4.09Å; L343-I511 HydrophobicContact CD2-CD1 4Å; L343-F523 HydrophobicContact CD1-CD2 4.49Å; L343-F523 HydrophobicContact CD1-CE1 4.34Å; L343-F523 HydrophobicContact CD1-CE2 3.8Å; L343-F523 HydrophobicContact CD1-CZ 3.71Å; L343-F523 HydrophobicContact CD2-CE1 4.27Å; L343-F523 HydrophobicContact CD2-CZ 4.28Å
344	S	95.6	Very high	93.3	Very high	7 Å²	7	37.4 Å²	37.4	5%	0.049	18%	0.176	C	C	.	.	H	α-helix	trans	-61	-28.1	171.5	51.3	0	0	0	0	114.2	Q342 V346 F348 R500 A503	Q342-S344 VanDerWaalsContact CB-OG 3.24Å; Q342-S344 WeakPolarHBondContact CB-OG 3.32Å; Q342-S344 PolarHBondContact O-N 2.67Å; Q342-S344 PolarHBondContact OE1-OG 2.79Å; S344-V346 VanDerWaalsContact C-N 3.35Å; S344-F348 WeakPolarHBondContact O-CB 3.27Å; S344-F348 PolarHBondContact O-N 3.36Å; S344-R500 WeakPolarHBondContact CB-O 3.41Å; S344-A503 PolarHBondContact N-O 3.04Å
345	D	94	Very high	92.9	Very high	59 Å²	59	37.9 Å²	37.9	32%	0.316	18%	0.179	S	C	.	.	H	α-helix	trans	-68.4	-39.1	175.3	-58.4	-37.7	0	0	0	110.6	R341 Q342 L343 L349	R341-D345 WeakPolarHBondContact CB-OD2 3.41Å; Q342-D345 PolarHBondContact N-OD2 3.17Å; Q342-D345 WeakPolarHBondContact O-CB 3.22Å; Q342-D345 PolarHBondContact O-N 3.27Å; Q342-D345 VanDerWaalsContact O-N 3.09Å; L343-D345 VanDerWaalsContact C-N 3.25Å; L343-D345 PolarHBondContact O-N 2.88Å; D345-L349 WeakPolarHBondContact O-CB 3.44Å; D345-L349 PolarHBondContact O-N 2.84Å; D345-L349 VanDerWaalsContact O-N 3.11Å
346	V	94.5	Very high	92.5	Very high	5 Å²	5	38.9 Å²	38.9	3%	0.03	19%	0.185	C	C	.	.	H	α-helix	trans	-68.1	-46.4	177.4	-173.8	0	0	0	0	109.9	I311 L335 V337 L343 S344 F348 L349 V350 L508	I311-V346 HydrophobicContact CD1-CG1 4.38Å; I311-V346 HydrophobicContact CD1-CG2 3.88Å; L335-V346 HydrophobicContact CD1-CG1 3.98Å; V337-V346 HydrophobicContact CG1-CG2 4.39Å; L343-V346 HydrophobicContact CD1-CB 4.39Å; L343-V346 WeakPolarHBondContact O-CB 3.33Å; L343-V346 PolarHBondContact O-N 3.07Å; L343-V346 VanDerWaalsContact O-N 3.15Å; S344-V346 VanDerWaalsContact C-N 3.35Å; V346-F348 PolarHBondContact O-N 2.9Å; V346-L349 PolarHBondContact O-N 3.37Å; V346-V350 WeakPolarHBondContact O-CB 3.48Å; V346-V350 WeakPolarHBondContact O-CG2 3.04Å; V346-V350 PolarHBondContact O-N 2.89Å; V346-V350 VanDerWaalsContact O-N 3.1Å; V346-L508 HydrophobicContact CG2-CD1 4.24Å
347	I	94.8	Very high	91.9	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-59.7	-48	176.8	-63.5	175.9	0	0	0	110.5	L343 L349 V350 E351 V378 L380 R500 A503	L343-I347 WeakPolarHBondContact O-CG1 3.08Å; L343-I347 PolarHBondContact O-N 3.4Å; I347-L349 PolarHBondContact O-N 3.18Å; I347-V350 PolarHBondContact O-N 3.1Å; I347-V350 VanDerWaalsContact O-N 3.13Å; I347-E351 HydrophobicContact CG2-CG 4.07Å; I347-E351 WeakPolarHBondContact O-CB 3.43Å; I347-E351 WeakPolarHBondContact O-CG 3.25Å; I347-E351 PolarHBondContact O-N 2.98Å; I347-V378 HydrophobicContact CG2-CB 4.22Å; I347-L380 HydrophobicContact CD1-CD1 4.15Å; I347-L380 HydrophobicContact CD1-CG 4.17Å; I347-L380 HydrophobicContact CG1-CD1 3.5Å; I347-L380 VanDerWaalsContact CG1-CD1 3.5Å; I347-L380 HydrophobicContact CG1-CG 3.82Å; I347-R500 HydrophobicContact CB-CB 4.35Å; I347-R500 HydrophobicContact CG2-CB 3.75Å; I347-R500 HydrophobicContact CG2-CG 4.33Å; I347-A503 HydrophobicContact CD1-CB 3.65Å
348	F	93.1	Very high	91.3	Very high	62 Å²	62	37.2 Å²	37.2	27%	0.272	19%	0.194	S	C	.	.	H	α-helix	trans	-59.5	-43.4	179.4	179	-139.6	0	0	0	113.4	S344 V346 V350 E351 N352 R500 I1130	S344-F348 WeakPolarHBondContact O-CB 3.27Å; S344-F348 PolarHBondContact O-N 3.36Å; V346-F348 PolarHBondContact O-N 2.9Å; F348-V350 VanDerWaalsContact C-N 3.28Å; F348-V350 PolarHBondContact O-N 2.98Å; F348-E351 PolarHBondContact O-N 3.32Å; F348-N352 WeakPolarHBondContact CD2-ND2 3.11Å; F348-N352 WeakPolarHBondContact CE2-ND2 3.43Å; F348-N352 VanDerWaalsContact CE2-OD1 3.3Å; F348-N352 WeakPolarHBondContact CE2-OD1 3.49Å; F348-N352 VanDerWaalsContact CZ-ND2 3.25Å; F348-N352 WeakPolarHBondContact CZ-ND2 3.44Å; F348-N352 WeakPolarHBondContact O-CB 3.4Å; F348-N352 PolarHBondContact O-N 3.29Å; F348-N352 PolarHBondContact O-ND2 2.69Å; F348-R500 VanDerWaalsContact CG-NH2 3.3Å; F348-I1130 HydrophobicContact CE1-CD1 4.45Å
349	L	91	Very high	90.6	Very high	33 Å²	33	36.1 Å²	36.1	17%	0.173	19%	0.187	C	C	.	.	H	α-helix	trans	-60.9	-41.1	176.7	177.2	145.3	0	0	0	111.5	L335 D345 V346 I347 K353 L1134	L335-L349 HydrophobicContact CD1-CD2 4.15Å; L335-L349 HydrophobicContact CD2-CD2 4.39Å; D345-L349 WeakPolarHBondContact O-CB 3.44Å; D345-L349 PolarHBondContact O-N 2.84Å; D345-L349 VanDerWaalsContact O-N 3.11Å; V346-L349 PolarHBondContact O-N 3.37Å; I347-L349 PolarHBondContact O-N 3.18Å; L349-K353 WeakPolarHBondContact O-CB 3.44Å; L349-K353 PolarHBondContact O-N 2.77Å; L349-L1134 HydrophobicContact CD1-CD1 3.48Å; L349-L1134 VanDerWaalsContact CD1-CD1 3.48Å; L349-L1134 HydrophobicContact CD1-CD2 3.66Å; L349-L1134 HydrophobicContact CD1-CG 4.05Å
350	V	92.4	Very high	90	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-71.1	-44.8	-178.7	172.7	0	0	0	0	111	L313 L333 V346 I347 F348 N352 K353 W354 V378	L313-V350 HydrophobicContact CD1-CG1 4.4Å; L313-V350 HydrophobicContact CD1-CG2 3.39Å; L333-V350 HydrophobicContact CD2-CG2 4.31Å; V346-V350 WeakPolarHBondContact O-CB 3.48Å; V346-V350 WeakPolarHBondContact O-CG2 3.04Å; V346-V350 PolarHBondContact O-N 2.89Å; V346-V350 VanDerWaalsContact O-N 3.1Å; I347-V350 PolarHBondContact O-N 3.1Å; I347-V350 VanDerWaalsContact O-N 3.13Å; F348-V350 VanDerWaalsContact C-N 3.28Å; F348-V350 PolarHBondContact O-N 2.98Å; V350-N352 VanDerWaalsContact C-N 3.33Å; V350-N352 PolarHBondContact O-N 2.97Å; V350-K353 PolarHBondContact O-N 3.21Å; V350-W354 HydrophobicContact CG1-CD2 3.64Å; V350-W354 HydrophobicContact CG1-CE3 3.19Å; V350-W354 HydrophobicContact CG1-CG 4.49Å; V350-W354 HydrophobicContact CG1-CH2 3.68Å; V350-W354 HydrophobicContact CG1-CZ2 4.11Å; V350-W354 HydrophobicContact CG1-CZ3 3.2Å; V350-W354 WeakPolarHBondContact O-CB 3.33Å; V350-W354 PolarHBondContact O-N 2.91Å; V350-V378 HydrophobicContact CG1-CG1 4.38Å
351	E	90.8	Very high	89.3	Confident	30 Å²	30	39.1 Å²	39.1	14%	0.14	20%	0.195	C	C	.	.	H	α-helix	trans	-55.5	-45.5	172.8	-74.6	175.7	160.2	0	0	111.7	I347 F348 Q355 V378 R500	I347-E351 HydrophobicContact CG2-CG 4.07Å; I347-E351 WeakPolarHBondContact O-CB 3.43Å; I347-E351 WeakPolarHBondContact O-CG 3.25Å; I347-E351 PolarHBondContact O-N 2.98Å; F348-E351 PolarHBondContact O-N 3.32Å; E351-Q355 WeakPolarHBondContact O-CG 3.05Å; E351-V378 HydrophobicContact CG-CB 3.85Å; E351-V378 HydrophobicContact CG-CG2 3.75Å; E351-V378 PolarHBondContact OE1-N 3.22Å; E351-V378 VanDerWaalsContact OE1-N 3.09Å; E351-R500 WeakPolarHBondContact OE2-CD 3.41Å; E351-R500 IonicContact OE2-NH1 3.53Å
352	N	86.9	Confident	88.6	Confident	73 Å²	73	42.2 Å²	42.2	39%	0.39	21%	0.206	S	C	.	.	H	α-helix	trans	-68.2	-39.3	176.8	-66.2	-22.4	0	0	0	112.7	F348 V350	F348-N352 WeakPolarHBondContact CD2-ND2 3.11Å; F348-N352 WeakPolarHBondContact CE2-ND2 3.43Å; F348-N352 VanDerWaalsContact CE2-OD1 3.3Å; F348-N352 WeakPolarHBondContact CE2-OD1 3.49Å; F348-N352 VanDerWaalsContact CZ-ND2 3.25Å; F348-N352 WeakPolarHBondContact CZ-ND2 3.44Å; F348-N352 WeakPolarHBondContact O-CB 3.4Å; F348-N352 PolarHBondContact O-N 3.29Å; F348-N352 PolarHBondContact O-ND2 2.69Å; V350-N352 VanDerWaalsContact C-N 3.33Å; V350-N352 PolarHBondContact O-N 2.97Å
353	K	88.2	Confident	87.7	Confident	56 Å²	56	43.8 Å²	43.8	24%	0.243	22%	0.221	C	C	.	.	H	α-helix	trans	-74	-27.2	-176.4	-169.5	179.1	-169.7	-60.9	0	113	L333 L349 V350	L333-K353 HydrophobicContact CD2-CD 4.22Å; L349-K353 WeakPolarHBondContact O-CB 3.44Å; L349-K353 PolarHBondContact O-N 2.77Å; V350-K353 PolarHBondContact O-N 3.21Å
354	W	91.4	Very high	86.9	Confident	4 Å²	4	51 Å²	51	2%	0.015	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104	14.8	-176.5	-64	-15.4	0	0	0	113.9	L313 V324 L333 V350 L356 Y525 F527	L313-W354 HydrophobicContact CB-CH2 4.5Å; L313-W354 HydrophobicContact CD1-CH2 4.43Å; V324-W354 HydrophobicContact CB-CD2 4.37Å; V324-W354 HydrophobicContact CG1-CD2 3.87Å; V324-W354 HydrophobicContact CG1-CG 3.97Å; V324-W354 HydrophobicContact CG1-CZ2 4.08Å; V324-W354 HydrophobicContact CG2-CB 4.43Å; V324-W354 HydrophobicContact CG2-CD2 3.5Å; V324-W354 HydrophobicContact CG2-CE3 3.52Å; V324-W354 HydrophobicContact CG2-CG 3.93Å; V324-W354 HydrophobicContact CG2-CH2 4.37Å; V324-W354 HydrophobicContact CG2-CZ2 4.32Å; V324-W354 HydrophobicContact CG2-CZ3 3.98Å; L333-W354 HydrophobicContact CB-CZ2 4.11Å; L333-W354 HydrophobicContact CD2-CZ2 4.18Å; V350-W354 HydrophobicContact CG1-CD2 3.64Å; V350-W354 HydrophobicContact CG1-CE3 3.19Å; V350-W354 HydrophobicContact CG1-CG 4.49Å; V350-W354 HydrophobicContact CG1-CH2 3.68Å; V350-W354 HydrophobicContact CG1-CZ2 4.11Å; V350-W354 HydrophobicContact CG1-CZ3 3.2Å; V350-W354 WeakPolarHBondContact O-CB 3.33Å; V350-W354 PolarHBondContact O-N 2.91Å; W354-L356 PolarHBondContact O-N 3.39Å; W354-Y525 HydrophobicContact CE3-CD2 4.4Å; W354-Y525 HydrophobicContact CE3-CE2 4.22Å; W354-Y525 AromaticContact CH2-CD1 3.54Å; W354-Y525 HydrophobicContact CH2-CD1 3.54Å; W354-Y525 HydrophobicContact CH2-CD2 4.13Å; W354-Y525 AromaticContact CH2-CE1 3.28Å; W354-Y525 HydrophobicContact CH2-CE1 3.28Å; W354-Y525 AromaticContact CH2-CE2 3.92Å; W354-Y525 HydrophobicContact CH2-CE2 3.92Å; W354-Y525 AromaticContact CH2-CG 3.96Å; W354-Y525 HydrophobicContact CH2-CG 3.96Å; W354-Y525 AromaticContact CH2-CZ 3.51Å; W354-Y525 HydrophobicContact CZ2-CE1 4.24Å; W354-Y525 AromaticContact CZ3-CD1 3.75Å; W354-Y525 HydrophobicContact CZ3-CD1 3.75Å; W354-Y525 AromaticContact CZ3-CD2 3.5Å; W354-Y525 HydrophobicContact CZ3-CD2 3.5Å; W354-Y525 AromaticContact CZ3-CE1 3.72Å; W354-Y525 HydrophobicContact CZ3-CE1 3.72Å; W354-Y525 AromaticContact CZ3-CE2 3.48Å; W354-Y525 HydrophobicContact CZ3-CE2 3.48Å; W354-Y525 VanDerWaalsContact CZ3-CE2 3.48Å; W354-Y525 AromaticContact CZ3-CG 3.64Å; W354-Y525 HydrophobicContact CZ3-CG 3.64Å; W354-Y525 AromaticContact CZ3-CZ 3.6Å; W354-F527 HydrophobicContact CB-CZ 4.33Å; W354-F527 HydrophobicContact CE3-CE1 4.49Å; W354-F527 AromaticContact CE3-CZ 3.79Å; W354-F527 HydrophobicContact CE3-CZ 3.79Å
355	Q	86.1	Confident	86.2	Confident	55 Å²	55	55.8 Å²	55.8	26%	0.257	28%	0.284	S	S	.	.			trans	-63.5	130.7	169.3	-60.3	-174.7	-1.2	0	0	110.7	E351 E359 R360	E351-Q355 WeakPolarHBondContact O-CG 3.05Å; Q355-E359 HydrophobicContact CB-CB 4.49Å; Q355-R360 HydrophobicContact CB-CG 3.68Å; Q355-R360 PolarHBondContact O-NE 3.45Å; Q355-R360 PolarHBondContact O-NH2 2.89Å
356	L	85.6	Confident	85.2	Confident	23 Å²	23	55.8 Å²	55.8	12%	0.12	30%	0.298	C	S	.	.			trans	-62.7	152.6	173.6	-62.8	174.1	0	0	0	110.3	R323 E326 A327 W354 A358 E359 R360	R323-L356 HydrophobicContact CG-CD2 4.46Å; E326-L356 HydrophobicContact CB-CD2 3.84Å; E326-L356 HydrophobicContact CG-CD2 3.79Å; A327-L356 HydrophobicContact CB-CD2 4.14Å; W354-L356 PolarHBondContact O-N 3.39Å; L356-A358 PolarHBondContact O-N 3.31Å; L356-E359 HydrophobicContact CB-CB 4.4Å; L356-E359 HydrophobicContact CB-CG 4.03Å; L356-E359 PolarHBondContact N-OE2 2.9Å; L356-E359 WeakPolarHBondContact O-CB 3.29Å; L356-E359 PolarHBondContact O-N 2.83Å; L356-R360 PolarHBondContact O-N 2.87Å
357	A	82.8	Confident	83.9	Confident	49 Å²	49	61.7 Å²	61.7	41%	0.405	32%	0.323	S	S	.	.	H	α-helix	trans	-56.1	-37.7	179.1	0	0	0	0	0	112.2	R360 M361	A357-R360 PolarHBondContact O-N 3.41Å; A357-M361 WeakPolarHBondContact O-CB 3.46Å; A357-M361 WeakPolarHBondContact O-CG 3.3Å; A357-M361 PolarHBondContact O-N 2.76Å
358	A	81.6	Confident	82.1	Confident	28 Å²	28	66.5 Å²	66.5	23%	0.231	35%	0.354	C	S	.	.	H	α-helix	trans	-66.2	-35.7	174.4	0	0	0	0	0	113.6	L356 R362 L1006	L356-A358 PolarHBondContact O-N 3.31Å; A358-R362 VanDerWaalsContact O-CG 3.3Å; A358-R362 WeakPolarHBondContact O-CG 3.44Å; A358-R362 PolarHBondContact O-N 2.71Å; A358-L1006 HydrophobicContact CB-CD2 4.37Å
359	E	80.2	Confident	80.4	Confident	28 Å²	28	67.8 Å²	67.8	13%	0.131	38%	0.376	C	S	.	.	H	α-helix	trans	-69.9	-43.1	176.6	-65.5	166.5	166.4	0	0	110.6	R323 Q355 L356 R362 T363	R323-E359 IonicContact CZ-OE1 3.81Å; R323-E359 IonicContact NH2-OE1 3.6Å; R323-E359 PolarHBondContact NH2-OE1 2.84Å; Q355-E359 HydrophobicContact CB-CB 4.49Å; L356-E359 HydrophobicContact CB-CB 4.4Å; L356-E359 HydrophobicContact CB-CG 4.03Å; L356-E359 PolarHBondContact N-OE2 2.9Å; L356-E359 WeakPolarHBondContact O-CB 3.29Å; L356-E359 PolarHBondContact O-N 2.83Å; E359-R362 PolarHBondContact O-N 3.27Å; E359-T363 WeakPolarHBondContact O-CB 3.31Å; E359-T363 PolarHBondContact O-N 3.29Å; E359-T363 VanDerWaalsContact O-N 3.1Å; E359-T363 PolarHBondContact O-OG1 3.34Å
360	R	80.8	Confident	78.6	Confident	97 Å²	97	72.3 Å²	72.3	37%	0.366	41%	0.405	S	S	.	.	H	α-helix	trans	-59.6	-46.9	172	-74.8	-178.5	-93.4	147.5	-8.3	112	A327 Q355 L356 A357 T363 L364	A327-R360 PolarHBondContact O-NH2 3.33Å; Q355-R360 HydrophobicContact CB-CG 3.68Å; Q355-R360 PolarHBondContact O-NE 3.45Å; Q355-R360 PolarHBondContact O-NH2 2.89Å; L356-R360 PolarHBondContact O-N 2.87Å; A357-R360 PolarHBondContact O-N 3.41Å; R360-T363 PolarHBondContact O-N 2.9Å; R360-L364 WeakPolarHBondContact O-CB 3.38Å; R360-L364 PolarHBondContact O-N 3.39Å
361	M	79.7	Confident	76.6	Confident	73 Å²	73	80 Å²	80	36%	0.36	44%	0.441	S	S	.	.	H	α-helix	trans	-64.1	-42.7	178.5	-76.2	-172.9	-70	0	0	112.9	A357 T363 L364 L365 L1006	A357-M361 WeakPolarHBondContact O-CB 3.46Å; A357-M361 WeakPolarHBondContact O-CG 3.3Å; A357-M361 PolarHBondContact O-N 2.76Å; M361-T363 VanDerWaalsContact C-N 3.3Å; M361-T363 PolarHBondContact O-N 2.86Å; M361-L364 PolarHBondContact O-N 2.73Å; M361-L365 VanDerWaalsContact O-CB 3.29Å; M361-L365 WeakPolarHBondContact O-CB 3.5Å; M361-L365 VanDerWaalsContact O-CG 3.3Å; M361-L365 WeakPolarHBondContact O-CG 3.35Å; M361-L365 PolarHBondContact O-N 3.16Å; M361-L1006 HydrophobicContact CE-CD1 3.95Å; M361-L1006 HydrophobicContact CE-CD2 3.84Å; M361-L1006 HydrophobicContact SD-CD1 4.24Å
362	R	79.3	Confident	74.5	Confident	131 Å²	131	87.7 Å²	87.7	49%	0.494	48%	0.476	S	S	.	.	H	α-helix	trans	-58.5	-43.9	174.3	-73.3	173.7	-163.9	132.2	2.4	111.7	A358 E359 G366 F367	A358-R362 VanDerWaalsContact O-CG 3.3Å; A358-R362 WeakPolarHBondContact O-CG 3.44Å; A358-R362 PolarHBondContact O-N 2.71Å; E359-R362 PolarHBondContact O-N 3.27Å; R362-G366 PolarHBondContact O-N 3.41Å; R362-F367 PolarHBondContact O-N 3.5Å
363	T	76.9	Confident	72.8	Confident	106 Å²	106	87.6 Å²	87.6	65%	0.65	48%	0.482	S	S	*	.	H	α-helix	trans	-65.5	-46	179.8	-52.8	0	0	0	0	111.6	E359 R360 M361 G366	E359-T363 WeakPolarHBondContact O-CB 3.31Å; E359-T363 PolarHBondContact O-N 3.29Å; E359-T363 VanDerWaalsContact O-N 3.1Å; E359-T363 PolarHBondContact O-OG1 3.34Å; R360-T363 PolarHBondContact O-N 2.9Å; M361-T363 VanDerWaalsContact C-N 3.3Å; M361-T363 PolarHBondContact O-N 2.86Å; T363-G366 PolarHBondContact O-N 3.04Å
364	L	78.1	Confident	71.6	Confident	151 Å²	151	86.8 Å²	86.8	79%	0.791	48%	0.482	S	S	*	.	H	α-helix	trans	-68.8	-38.6	-178.9	-177	64.5	0	0	0	113	R360 M361 G366	R360-L364 WeakPolarHBondContact O-CB 3.38Å; R360-L364 PolarHBondContact O-N 3.39Å; M361-L364 PolarHBondContact O-N 2.73Å; L364-G366 PolarHBondContact O-N 3.29Å
365	L	81.6	Confident	70.5	Confident	109 Å²	109	91.8 Å²	91.8	57%	0.571	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.7	0	-179.4	-63.8	172.3	0	0	0	113.1	M361 F367	M361-L365 VanDerWaalsContact O-CB 3.29Å; M361-L365 WeakPolarHBondContact O-CB 3.5Å; M361-L365 VanDerWaalsContact O-CG 3.3Å; M361-L365 WeakPolarHBondContact O-CG 3.35Å; M361-L365 PolarHBondContact O-N 3.16Å; L365-F367 HydrophobicContact CB-CD2 3.7Å; L365-F367 HydrophobicContact CB-CE2 3.64Å; L365-F367 HydrophobicContact CB-CG 4.46Å; L365-F367 HydrophobicContact CB-CZ 4.34Å; L365-F367 HydrophobicContact CD1-CD2 4.29Å; L365-F367 HydrophobicContact CD1-CE2 3.59Å; L365-F367 HydrophobicContact CD1-CZ 4.37Å; L365-F367 HydrophobicContact CG-CE2 4.26Å; L365-F367 PolarHBondContact O-N 3.46Å
366	G	73.5	Confident	70.1	Confident	59 Å²	59	90.2 Å²	90.2	61%	0.608	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.4	22.2	176.2	0	0	0	0	0	114.3	R362 T363 L364	R362-G366 PolarHBondContact O-N 3.41Å; T363-G366 PolarHBondContact O-N 3.04Å; L364-G366 PolarHBondContact O-N 3.29Å
367	F	66.9	Low	70.1	Confident	129 Å²	129	90 Å²	90	57%	0.566	51%	0.508	S	S	*	.			trans	-65.3	130.1	-179.1	-74.5	-56.6	0	0	0	110.3	R362 L365	R362-F367 PolarHBondContact O-N 3.5Å; L365-F367 HydrophobicContact CB-CD2 3.7Å; L365-F367 HydrophobicContact CB-CE2 3.64Å; L365-F367 HydrophobicContact CB-CG 4.46Å; L365-F367 HydrophobicContact CB-CZ 4.34Å; L365-F367 HydrophobicContact CD1-CD2 4.29Å; L365-F367 HydrophobicContact CD1-CE2 3.59Å; L365-F367 HydrophobicContact CD1-CZ 4.37Å; L365-F367 HydrophobicContact CG-CE2 4.26Å; L365-F367 PolarHBondContact O-N 3.46Å
368	P	58	Low	70.5	Confident	100 Å²	100	87.7 Å²	87.7	65%	0.649	49%	0.489	S	S	*	.			trans	-61.5	149.7	172.3	25.7	-32.4	0	0	0	110.3	V370	P368-V370 HydrophobicContact CG-CG2 4.08Å; P368-V370 PolarHBondContact O-N 2.81Å
369	A	55.8	Low	71.1	Confident	89 Å²	89	87.7 Å²	87.7	74%	0.736	48%	0.484	S	S	*	.			trans	-74	74.2	177.7	0	0	0	0	0	111.1	H371	A369-H371 CarbonylContact O-C 3.59Å; A369-H371 PolarHBondContact O-N 3.28Å; A369-H371 VanDerWaalsContact O-N 3.11Å
370	V	53.4	Low	71.8	Confident	128 Å²	128	86.4 Å²	86.4	78%	0.776	48%	0.478	S	S	*	.	S	Bend	trans	-65.5	-10	180	179.8	0	0	0	0	112.6	P368	P368-V370 HydrophobicContact CG-CG2 4.08Å; P368-V370 PolarHBondContact O-N 2.81Å
371	H	51.7	Low	72.4	Confident	163 Å²	163	81.9 Å²	81.9	76%	0.755	46%	0.461	S	S	*	.	S	Bend	trans	-125.9	138.4	157	-109.1	-104.3	0	0	0	109.1	A369 S373	A369-H371 CarbonylContact O-C 3.59Å; A369-H371 PolarHBondContact O-N 3.28Å; A369-H371 VanDerWaalsContact O-N 3.11Å; H371-S373 PolarHBondContact O-N 2.83Å
372	E	46.5	Very low	72.9	Confident	190 Å²	190	79 Å²	79	89%	0.888	45%	0.447	S	S	*	.			trans	-71	67.5	168	-65.8	-174.5	140.2	0	0	110.7	P374	E372-P374 WeakPolarHBondContact O-CD 3.35Å
373	S	51.7	Low	73.1	Confident	72 Å²	72	73.5 Å²	73.5	50%	0.503	43%	0.429	S	S	.	.			trans	-80.1	102.3	162.4	-176.4	0	0	0	0	107.1	H371 V375	H371-S373 PolarHBondContact O-N 2.83Å; S373-V375 PolarHBondContact O-N 2.95Å
374	P	62.4	Low	72.9	Confident	38 Å²	38	79.3 Å²	79.3	25%	0.247	44%	0.44	C	S	.	.			trans	-59.2	135	178.8	25.7	-35.1	0	0	0	109.8	E372 C529 T530	E372-P374 WeakPolarHBondContact O-CD 3.35Å; P374-C529 HydrophobicContact CB-CB 4.28Å; P374-C529 HydrophobicContact CG-CB 3.61Å; P374-T530 WeakPolarHBondContact CB-O 3.4Å
375	V	68.1	Low	72.6	Confident	110 Å²	110	83.5 Å²	83.5	67%	0.667	45%	0.446	S	S	*	.			trans	-61.1	129.1	-179.1	178.7	0	0	0	0	108.9	S373 S377	S373-V375 PolarHBondContact O-N 2.95Å; V375-S377 PolarHBondContact O-N 3.27Å; V375-S377 PolarHBondContact O-OG 3.33Å
376	P	76.9	Confident	72.4	Confident	21 Å²	21	80.2 Å²	80.2	14%	0.136	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62	110.8	-179.7	28.7	-38.5	0	0	0	109.9	F527	P376-F527 HydrophobicContact CB-CD1 4.1Å
377	S	86.1	Confident	72.4	Confident	19 Å²	19	80.3 Å²	80.3	13%	0.133	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	143.3	177.7	-59	0	0	0	0	109.1	V375 F527 F528	V375-S377 PolarHBondContact O-N 3.27Å; V375-S377 PolarHBondContact O-OG 3.33Å; S377-F527 WeakPolarHBondContact O-CA 3.21Å; S377-F528 PolarHBondContact N-O 3.04Å; S377-F528 WeakPolarHBondContact O-CD1 3.44Å; S377-F528 WeakPolarHBondContact O-CE1 3.32Å; S377-F528 PolarHBondContact O-N 2.81Å
378	V	91.9	Very high	73.1	Confident	1 Å²	1	74.5 Å²	74.5	1%	0.006	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	129.7	179.1	174.2	0	0	0	0	109.8	I347 V350 E351 L380 F527	I347-V378 HydrophobicContact CG2-CB 4.22Å; V350-V378 HydrophobicContact CG1-CG1 4.38Å; E351-V378 HydrophobicContact CG-CB 3.85Å; E351-V378 HydrophobicContact CG-CG2 3.75Å; E351-V378 PolarHBondContact OE1-N 3.22Å; E351-V378 VanDerWaalsContact OE1-N 3.09Å; V378-L380 HydrophobicContact CG1-CD2 4.07Å; V378-F527 HydrophobicContact CG2-CD1 3.82Å; V378-F527 HydrophobicContact CG2-CE1 3.61Å; V378-F527 HydrophobicContact CG2-CZ 4.42Å
379	M	93.8	Very high	73.4	Confident	28 Å²	28	76.2 Å²	76.2	14%	0.138	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	134.1	170.6	-165.5	167.8	73.8	0	0	109.6	I496 G497 V498 T499 Y525 Q526 F528	M379-I496 WeakPolarHBondContact CE-O 3.37Å; M379-G497 VanDerWaalsContact CG-C 3.49Å; M379-V498 WeakPolarHBondContact CA-O 3.32Å; M379-T499 HydrophobicContact CG-CG2 4.42Å; M379-T499 HydrophobicContact SD-CG2 4.42Å; M379-Y525 WeakPolarHBondContact O-CA 3.33Å; M379-Q526 HydrophobicContact CB-CG 4.12Å; M379-Q526 HydrophobicContact CE-CG 4.04Å; M379-Q526 PolarHBondContact N-O 2.77Å; M379-Q526 PolarHBondContact O-N 2.96Å; M379-F528 HydrophobicContact CB-CD1 3.85Å; M379-F528 HydrophobicContact CB-CE1 3.86Å
380	L	95	Very high	73.9	Confident	0 Å²	0	74 Å²	74	0%	0	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	130.5	176.8	-64.1	-175.9	0	0	0	111.1	L313 L343 I347 V378 G497 V498 F523	L313-L380 HydrophobicContact CD2-CD1 4.39Å; L313-L380 HydrophobicContact CD2-CD2 4.22Å; L343-L380 HydrophobicContact CD1-CD1 3.91Å; L343-L380 HydrophobicContact CG-CD1 4.48Å; I347-L380 HydrophobicContact CD1-CD1 4.15Å; I347-L380 HydrophobicContact CD1-CG 4.17Å; I347-L380 HydrophobicContact CG1-CD1 3.5Å; I347-L380 VanDerWaalsContact CG1-CD1 3.5Å; I347-L380 HydrophobicContact CG1-CG 3.82Å; V378-L380 HydrophobicContact CG1-CD2 4.07Å; L380-G497 WeakPolarHBondContact O-CA 3.42Å; L380-V498 PolarHBondContact N-O 3.03Å; L380-V498 PolarHBondContact O-N 3.38Å; L380-F523 HydrophobicContact CB-CB 4.28Å; L380-F523 HydrophobicContact CB-CD1 4.32Å; L380-F523 HydrophobicContact CB-CG 4.36Å; L380-F523 HydrophobicContact CD1-CD2 4.49Å; L380-F523 HydrophobicContact CD1-CG 4.44Å; L380-F523 HydrophobicContact CD2-CB 4.29Å
381	N	93	Very high	74.5	Confident	2 Å²	2	69.8 Å²	69.8	1%	0.011	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	142.9	177.3	-67.6	61.7	0	0	0	109.4	L494 S495 I496 G497 F523 E524	N381-L494 CarbonylContact C-O 3.59Å; N381-L494 VanDerWaalsContact CA-O 3.25Å; N381-L494 WeakPolarHBondContact CA-O 3.32Å; N381-S495 PolarHBondContact ND2-O 3.4Å; N381-I496 PolarHBondContact ND2-O 3.33Å; N381-G497 VanDerWaalsContact CG-CA 3.46Å; N381-G497 WeakPolarHBondContact ND2-CA 3.38Å; N381-G497 PolarHBondContact ND2-N 3.25Å; N381-G497 WeakPolarHBondContact OD1-CA 3.35Å; N381-F523 CarbonylContact O-C 3.58Å; N381-F523 WeakPolarHBondContact O-CA 3.48Å; N381-F523 WeakPolarHBondContact O-CB 3.32Å; N381-E524 HydrophobicContact CB-CB 4.42Å; N381-E524 PolarHBondContact N-O 2.72Å; N381-E524 PolarHBondContact O-N 3.41Å
382	L	90.8	Very high	75.5	Confident	13 Å²	13	64 Å²	64	7%	0.068	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	134.6	162.1	-79.2	174.4	0	0	0	109.3	Q386 I388 L494 I511 L515 I521 F523	L382-Q386 HydrophobicContact CD2-CB 4.32Å; L382-I388 HydrophobicContact CD1-CD1 3.61Å; L382-I388 HydrophobicContact CD1-CG1 4.23Å; L382-L494 HydrophobicContact CB-CB 4.44Å; L382-L494 HydrophobicContact CD1-CB 3.76Å; L382-L494 HydrophobicContact CD1-CD1 3.76Å; L382-L494 HydrophobicContact CD1-CG 4.35Å; L382-L494 HydrophobicContact CG-CB 3.99Å; L382-L494 HydrophobicContact CG-CD1 4.4Å; L382-L494 PolarHBondContact N-O 2.85Å; L382-I511 HydrophobicContact CD2-CG2 4.46Å; L382-L515 HydrophobicContact CD1-CD2 4.39Å; L382-L515 HydrophobicContact CD2-CD1 4.04Å; L382-I521 HydrophobicContact CD2-CG2 4.15Å; L382-F523 HydrophobicContact CD2-CD1 3.84Å; L382-F523 HydrophobicContact CD2-CE1 3.58Å; L382-F523 HydrophobicContact CD2-CZ 4.33Å; L382-F523 HydrophobicContact CG-CD1 4.23Å; L382-F523 HydrophobicContact CG-CE1 3.99Å
383	C	82.2	Confident	76.4	Confident	16 Å²	16	63.7 Å²	63.7	11%	0.108	33%	0.33	C	S	.	.			trans	-56.9	143.6	172.6	179.8	0	0	0	0	110.2	R385 Q386 E524	C383-R385 PolarHBondContact O-N 3.33Å; C383-Q386 PolarHBondContact O-N 3.37Å; C383-E524 WeakPolarHBondContact CA-OE1 3.44Å; C383-E524 HydrophobicContact CB-CG 4.41Å; C383-E524 WeakPolarHBondContact CB-OE1 3.26Å; C383-E524 PolarHBondContact SG-OE1 3.09Å
384	Y	72.9	Confident	77.1	Confident	228 Å²	228	64.1 Å²	64.1	89%	0.894	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-18.1	-175.9	-164	-90	0	0	0	114.6	Q386	Y384-Q386 VanDerWaalsContact C-N 3.33Å
385	R	71.9	Confident	77	Confident	238 Å²	238	67.9 Å²	67.9	90%	0.898	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.3	-3.5	173.3	-62.4	-171.7	179.6	-155	-0.1	114.7	C383	C383-R385 PolarHBondContact O-N 3.33Å
386	Q	76.9	Confident	76.3	Confident	41 Å²	41	68.3 Å²	68.3	19%	0.192	34%	0.335	C	S	.	.	S	Bend	trans	-121.9	59.7	-177.8	-68.5	-164.5	-31.3	0	0	110.1	L382 C383 Y384 L515 R522	L382-Q386 HydrophobicContact CD2-CB 4.32Å; C383-Q386 PolarHBondContact O-N 3.37Å; Y384-Q386 VanDerWaalsContact C-N 3.33Å; Q386-L515 HydrophobicContact CB-CD1 4.31Å; Q386-L515 HydrophobicContact CB-CD2 3.81Å; Q386-R522 PolarHBondContact OE1-O 2.93Å
387	A	74.8	Confident	75.3	Confident	60 Å²	60	71.5 Å²	71.5	50%	0.496	35%	0.354	S	S	.	.			trans	-75.2	149.1	176.8	0	0	0	0	0	112.4
388	I	80.7	Confident	73.9	Confident	8 Å²	8	72.8 Å²	72.8	4%	0.041	37%	0.365	C	S	.	.			trans	-121.6	80.6	176.1	-60.2	168.7	0	0	0	107.7	L382 L487 L494 A514 L515	L382-I388 HydrophobicContact CD1-CD1 3.61Å; L382-I388 HydrophobicContact CD1-CG1 4.23Å; I388-L487 HydrophobicContact CG2-CB 3.84Å; I388-L494 HydrophobicContact CD1-CD1 4.06Å; I388-A514 HydrophobicContact CD1-CB 3.73Å; I388-A514 HydrophobicContact CG1-CB 3.98Å; I388-A514 HydrophobicContact CG2-CB 3.84Å; I388-L515 HydrophobicContact CD1-CD2 4.17Å; I388-L515 HydrophobicContact CD1-CG 4.44Å; I388-L515 HydrophobicContact CG1-CD2 3.72Å; I388-L515 HydrophobicContact CG1-CG 4.41Å
389	D	64	Low	72.7	Confident	136 Å²	136	83.5 Å²	83.5	73%	0.727	41%	0.406	S	S	*	.			trans	-97.5	-0	-172.1	-59.4	-32.6	0	0	0	113.5
390	G	67.1	Low	71.9	Confident	42 Å²	42	83.9 Å²	83.9	43%	0.433	41%	0.408	S	S	.	.	S	Bend	trans	-127.2	164.6	-171.2	0	0	0	0	0	115
391	A	66.7	Low	71.4	Confident	39 Å²	39	92.9 Å²	92.9	32%	0.322	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	142.5	170.5	0	0	0	0	0	111	E484 L485	A391-E484 HydrophobicContact CB-CG 3.65Å; A391-L485 CarbonylContact C-O 3.52Å; A391-L485 WeakPolarHBondContact CA-O 3.38Å; A391-L485 WeakPolarHBondContact CB-O 3.48Å
392	I	72.9	Confident	71	Confident	42 Å²	42	93.7 Å²	93.7	22%	0.215	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	114.6	174.4	-50.9	-177.9	0	0	0	109	I394 L485 L487 L513 A514	I392-I394 HydrophobicContact CG2-CG1 3.97Å; I392-I394 PolarHBondContact O-N 3.12Å; I392-L485 PolarHBondContact N-O 2.91Å; I392-L485 PolarHBondContact O-N 2.97Å; I392-L487 HydrophobicContact CD1-CD1 3.5Å; I392-L487 HydrophobicContact CG1-CD1 3.76Å; I392-L513 HydrophobicContact CD1-CB 3.79Å; I392-A514 HydrophobicContact CD1-CB 4.29Å
393	R	65.4	Low	70.7	Confident	184 Å²	184	94.5 Å²	94.5	69%	0.694	46%	0.46	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.7	98.3	169.4	-71.9	-173.7	-72.7	-89.6	3	110.5	Q395 E484	R393-Q395 PolarHBondContact O-N 3.38Å; R393-E484 VanDerWaalsContact CD-OE1 3.23Å; R393-E484 WeakPolarHBondContact CD-OE1 3.3Å; R393-E484 HydrophobicContact CG-CB 4.04Å; R393-E484 HydrophobicContact CG-CG 3.8Å; R393-E484 WeakPolarHBondContact CG-OE1 3.4Å; R393-E484 IonicContact CZ-OE1 3.86Å; R393-E484 IonicContact NE-OE1 2.71Å; R393-E484 IonicContact NH1-OE1 3.81Å; R393-E484 PolarHBondContact NH1-OE1 2.83Å
394	I	65.8	Low	70.8	Confident	81 Å²	81	96.6 Å²	96.6	42%	0.415	47%	0.469	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	99.5	170.8	-56.4	-176	0	0	0	108.1	I392 A483 L485	I392-I394 HydrophobicContact CG2-CG1 3.97Å; I392-I394 PolarHBondContact O-N 3.12Å; I394-A483 PolarHBondContact N-O 3.23Å; I394-A483 PolarHBondContact O-N 2.78Å; I394-L485 HydrophobicContact CD1-CD1 3.61Å; I394-L485 HydrophobicContact CD1-CG 4.43Å; I394-L485 HydrophobicContact CG1-CD1 4.39Å
395	Q	59.2	Low	71.6	Confident	117 Å²	117	85.7 Å²	85.7	55%	0.547	43%	0.427	S	S	.	.			trans	-79.3	122.1	165.2	178.6	165.4	70.9	0	0	109.1	R393 V397	R393-Q395 PolarHBondContact O-N 3.38Å; Q395-V397 PolarHBondContact O-N 2.91Å
396	E	54.2	Low	72.5	Confident	118 Å²	118	74.4 Å²	74.4	55%	0.551	38%	0.384	S	S	*	.			trans	-67.7	95	168.4	-169.1	-165.8	172	0	0	109.3	A398 T480	E396-A398 VanDerWaalsContact C-N 3.3Å; E396-A398 PolarHBondContact O-N 2.82Å; E396-T480 WeakPolarHBondContact O-CG2 3.31Å
397	V	57	Low	73.3	Confident	88 Å²	88	72.4 Å²	72.4	53%	0.533	38%	0.375	S	S	.	.			trans	-71	91.8	171.3	-176.4	0	0	0	0	108.4	Q395 R399	Q395-V397 PolarHBondContact O-N 2.91Å; V397-R399 PolarHBondContact O-N 2.97Å; V397-R399 VanDerWaalsContact O-N 3.11Å
398	A	55.5	Low	74.2	Confident	46 Å²	46	75.4 Å²	75.4	38%	0.38	37%	0.373	S	S	.	.			trans	-47.9	119.5	177	0	0	0	0	0	110.1	E396 I400	E396-A398 VanDerWaalsContact C-N 3.3Å; E396-A398 PolarHBondContact O-N 2.82Å; A398-I400 PolarHBondContact O-N 3.04Å
399	R	66.8	Low	74.6	Confident	227 Å²	227	75.6 Å²	75.6	86%	0.857	38%	0.376	S	S	*	.			trans	-60.7	102.1	-174.1	-70	-167.7	-174.9	101.6	3.9	110.4	V397 R401	V397-R399 PolarHBondContact O-N 2.97Å; V397-R399 VanDerWaalsContact O-N 3.11Å; R399-R401 WeakPolarHBondContact O-CG 3.21Å; R399-R401 PolarHBondContact O-N 2.67Å
400	I	77.6	Confident	76	Confident	36 Å²	36	70.2 Å²	70.2	19%	0.185	35%	0.346	C	S	.	.			trans	-51.4	113.9	-174	-45.3	158.5	0	0	0	109.4	V286 K291 I296 A398 D404 I405	V286-I400 WeakPolarHBondContact CG2-O 3.3Å; K291-I400 HydrophobicContact CD-CD1 4.35Å; I296-I400 HydrophobicContact CD1-CG2 4.07Å; I296-I400 HydrophobicContact CG2-CD1 3.68Å; I296-I400 HydrophobicContact CG2-CG1 4.32Å; A398-I400 PolarHBondContact O-N 3.04Å; I400-D404 HydrophobicContact CG2-CB 4.02Å; I400-I405 HydrophobicContact CB-CD1 4.46Å; I400-I405 HydrophobicContact CG2-CD1 3.64Å; I400-I405 HydrophobicContact CG2-CG1 3.59Å
401	R	83.3	Confident	77.2	Confident	188 Å²	188	69.8 Å²	69.8	71%	0.709	33%	0.333	S	S	*	.			trans	-84.1	158.9	-176.6	-50.3	174.8	177.9	172.7	0.8	109	R399 G403 D404 I405	R399-R401 WeakPolarHBondContact O-CG 3.21Å; R399-R401 PolarHBondContact O-N 2.67Å; R401-G403 PolarHBondContact O-N 2.87Å; R401-D404 WeakPolarHBondContact CB-OD2 3.4Å; R401-D404 WeakPolarHBondContact CG-OD2 3.43Å; R401-D404 PolarHBondContact N-OD2 2.97Å; R401-D404 WeakPolarHBondContact O-CB 3.24Å; R401-D404 PolarHBondContact O-N 3.11Å; R401-D404 VanDerWaalsContact O-N 3.08Å; R401-I405 PolarHBondContact O-N 3.07Å
402	S	84.7	Confident	78.2	Confident	19 Å²	19	71.9 Å²	71.9	13%	0.133	34%	0.339	C	S	.	.	S	Bend	trans	-63.7	-24.8	178.5	-57.6	0	0	0	0	113.6	G269 R283 T284 G406	G269-S402 VanDerWaalsContact CA-O 3.24Å; G269-S402 WeakPolarHBondContact CA-O 3.16Å; G269-S402 VanDerWaalsContact O-CB 3.26Å; G269-S402 WeakPolarHBondContact O-CB 3.25Å; R283-S402 WeakPolarHBondContact CB-OG 3.44Å; T284-S402 WeakPolarHBondContact O-CB 3.4Å; T284-S402 PolarHBondContact O-OG 3.33Å; S402-G406 PolarHBondContact O-N 3.38Å
403	G	84.4	Confident	78.9	Confident	31 Å²	31	73.4 Å²	73.4	32%	0.32	34%	0.342	S	S	.	.	G	3₁₀ helix	trans	-65.2	-46.1	170.7	0	0	0	0	0	111.9	R401 I405 G406 A409	R401-G403 PolarHBondContact O-N 2.87Å; G403-I405 PolarHBondContact O-N 3.32Å; G403-G406 PolarHBondContact O-N 2.8Å; G403-A409 WeakPolarHBondContact O-CB 3.44Å
404	D	84.5	Confident	79.8	Confident	59 Å²	59	67.1 Å²	67.1	32%	0.316	32%	0.322	S	S	.	.	G	3₁₀ helix	trans	-63.9	-8.2	179	-33.6	-16	0	0	0	113.5	I400 R401 R413	I400-D404 HydrophobicContact CG2-CB 4.02Å; R401-D404 WeakPolarHBondContact CB-OD2 3.4Å; R401-D404 WeakPolarHBondContact CG-OD2 3.43Å; R401-D404 PolarHBondContact N-OD2 2.97Å; R401-D404 WeakPolarHBondContact O-CB 3.24Å; R401-D404 PolarHBondContact O-N 3.11Å; R401-D404 VanDerWaalsContact O-N 3.08Å; D404-R413 VanDerWaalsContact O-CZ 3.3Å; D404-R413 PolarHBondContact O-NH1 3.41Å; D404-R413 PolarHBondContact O-NH2 3.13Å
405	I	89.9	Confident	80.6	Confident	0 Å²	0	68.1 Å²	68.1	0%	0	33%	0.328	C	S	.	.	G	3₁₀ helix	trans	-115.6	-7.5	175.2	-58.8	-176.6	0	0	0	111.4	Y238 T284 V286 L290 I296 I400 R401 G403	Y238-I405 WeakPolarHBondContact CE1-O 3.26Å; Y238-I405 PolarHBondContact OH-O 3.47Å; T284-I405 HydrophobicContact CG2-CG2 4.08Å; V286-I405 HydrophobicContact CB-CD1 4Å; V286-I405 HydrophobicContact CG1-CD1 3.85Å; V286-I405 HydrophobicContact CG2-CD1 3.8Å; L290-I405 HydrophobicContact CB-CG2 3.51Å; L290-I405 HydrophobicContact CD1-CG2 3.9Å; L290-I405 HydrophobicContact CG-CG2 4.33Å; I296-I405 HydrophobicContact CD1-CG1 4.09Å; I400-I405 HydrophobicContact CB-CD1 4.46Å; I400-I405 HydrophobicContact CG2-CD1 3.64Å; I400-I405 HydrophobicContact CG2-CG1 3.59Å; R401-I405 PolarHBondContact O-N 3.07Å; G403-I405 PolarHBondContact O-N 3.32Å
406	G	92.2	Very high	81.2	Confident	0 Å²	0	67 Å²	67	0%	0	33%	0.329	C	S	.	.	S	Bend	trans	-61.9	161.3	174.6	0	0	0	0	0	112.5	Y238 S402 G403 R408 A409 Y410	Y238-G406 PolarHBondContact OH-O 3.24Å; S402-G406 PolarHBondContact O-N 3.38Å; G403-G406 PolarHBondContact O-N 2.8Å; G406-R408 PolarHBondContact O-N 3.06Å; G406-A409 PolarHBondContact O-N 3.03Å; G406-Y410 PolarHBondContact O-N 2.94Å
407	L	93.5	Very high	81.7	Confident	0 Å²	0	67.6 Å²	67.6	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-59.5	-31.5	-179.4	179.8	72	0	0	0	112.2	F226 V230 Y238 V266 Y410 L411	F226-L407 HydrophobicContact CD1-CD1 4.28Å; F226-L407 HydrophobicContact CD1-CD2 3.45Å; F226-L407 VanDerWaalsContact CD1-CD2 3.45Å; F226-L407 HydrophobicContact CE1-CD1 4.32Å; F226-L407 HydrophobicContact CE1-CD2 3.73Å; V230-L407 HydrophobicContact CG1-CD1 4.27Å; V230-L407 HydrophobicContact CG2-CD1 4.35Å; Y238-L407 HydrophobicContact CD2-CD1 3.89Å; Y238-L407 HydrophobicContact CE2-CD1 3.93Å; V266-L407 HydrophobicContact CG1-CB 4.06Å; V266-L407 HydrophobicContact CG1-CD2 4.12Å; V266-L407 VanDerWaalsContact O-CB 3.3Å; V266-L407 WeakPolarHBondContact O-CB 3.47Å; V266-L407 PolarHBondContact O-N 3.46Å; L407-Y410 HydrophobicContact CD1-CD1 4Å; L407-Y410 WeakPolarHBondContact O-CB 3.18Å; L407-Y410 PolarHBondContact O-N 3.4Å; L407-Y410 VanDerWaalsContact O-N 3.12Å; L407-L411 HydrophobicContact CG-CD1 4.28Å; L407-L411 WeakPolarHBondContact O-CG 3.49Å; L407-L411 PolarHBondContact O-N 3.29Å
408	R	92.6	Very high	81.3	Confident	123 Å²	123	69.1 Å²	69.1	46%	0.464	33%	0.334	S	S	.	.	H	α-helix	trans	-58	-51.4	172.5	-175.2	175.6	-68.1	107.1	-0.3	111.2	H267 C268 G406 Y410 L411 D412	H267-R408 WeakPolarHBondContact O-CB 3.15Å; H267-R408 PolarHBondContact O-N 2.7Å; C268-R408 PolarHBondContact SG-NH1 2.84Å; G406-R408 PolarHBondContact O-N 3.06Å; R408-Y410 PolarHBondContact O-N 2.82Å; R408-Y410 VanDerWaalsContact O-N 3.09Å; R408-L411 WeakPolarHBondContact O-CA 3.45Å; R408-L411 WeakPolarHBondContact O-CB 3.49Å; R408-L411 PolarHBondContact O-N 2.75Å; R408-D412 PolarHBondContact O-N 2.68Å; R408-D412 VanDerWaalsContact O-OD2 3.14Å
409	A	90.1	Very high	80.5	Confident	12 Å²	12	72.1 Å²	72.1	10%	0.099	35%	0.35	C	S	.	.	H	α-helix	trans	-65.9	-12.5	176.7	0	0	0	0	0	114.2	G403 G406 D412 R413	G403-A409 WeakPolarHBondContact O-CB 3.44Å; G406-A409 PolarHBondContact O-N 3.03Å; A409-D412 WeakPolarHBondContact CA-OD2 3.43Å; A409-R413 VanDerWaalsContact O-CD 3.26Å; A409-R413 WeakPolarHBondContact O-CD 3.34Å; A409-R413 WeakPolarHBondContact O-CG 3.41Å; A409-R413 PolarHBondContact O-NH1 3.1Å
410	Y	92.9	Very high	79.5	Confident	23 Å²	23	71 Å²	71	9%	0.09	35%	0.351	C	S	.	.	H	α-helix	trans	-82.2	-43.7	167.2	171.4	-96.3	0	0	0	111.5	V230 V234 Y238 L293 G406 L407 R408 R413 M414	V230-Y410 HydrophobicContact CG1-CE1 4.04Å; V230-Y410 HydrophobicContact CG2-CE1 4.34Å; V234-Y410 HydrophobicContact CG1-CD1 4.13Å; V234-Y410 HydrophobicContact CG1-CE1 3.76Å; V234-Y410 HydrophobicContact CG1-CE2 4.2Å; V234-Y410 HydrophobicContact CG1-CG 4.49Å; Y238-Y410 HydrophobicContact CE2-CG 4.28Å; L293-Y410 WeakPolarHBondContact O-CD2 3.45Å; L293-Y410 VanDerWaalsContact O-CE2 3.3Å; L293-Y410 WeakPolarHBondContact O-CE2 3.3Å; G406-Y410 PolarHBondContact O-N 2.94Å; L407-Y410 HydrophobicContact CD1-CD1 4Å; L407-Y410 WeakPolarHBondContact O-CB 3.18Å; L407-Y410 PolarHBondContact O-N 3.4Å; L407-Y410 VanDerWaalsContact O-N 3.12Å; R408-Y410 PolarHBondContact O-N 2.82Å; R408-Y410 VanDerWaalsContact O-N 3.09Å; Y410-R413 CarbonylContact O-C 3.59Å; Y410-R413 PolarHBondContact O-N 2.59Å; Y410-M414 HydrophobicContact CD1-SD 4.09Å; Y410-M414 HydrophobicContact CE1-CG 4.1Å; Y410-M414 HydrophobicContact CE1-SD 3.26Å; Y410-M414 WeakPolarHBondContact CE1-SD 3.32Å; Y410-M414 VanDerWaalsContact CZ-SD 3.52Å; Y410-M414 PolarHBondContact O-N 2.99Å; Y410-M414 PolarHBondContact OH-SD 3.45Å
411	L	91.8	Very high	77.5	Confident	32 Å²	32	74.1 Å²	74.1	17%	0.168	38%	0.376	C	S	.	.	H	α-helix	trans	-63	-48	175.3	-68.5	166.1	0	0	0	111.6	P227 V230 L407 R408 R413 M414 D415	P227-L411 HydrophobicContact CG-CD1 4.01Å; P227-L411 HydrophobicContact CG-CD2 3.99Å; V230-L411 HydrophobicContact CG2-CD2 3.59Å; L407-L411 HydrophobicContact CG-CD1 4.28Å; L407-L411 WeakPolarHBondContact O-CG 3.49Å; L407-L411 PolarHBondContact O-N 3.29Å; R408-L411 WeakPolarHBondContact O-CA 3.45Å; R408-L411 WeakPolarHBondContact O-CB 3.49Å; R408-L411 PolarHBondContact O-N 2.75Å; L411-R413 PolarHBondContact O-N 3.31Å; L411-M414 WeakPolarHBondContact O-CA 3.41Å; L411-M414 WeakPolarHBondContact O-CB 3.42Å; L411-M414 PolarHBondContact O-N 3.27Å; L411-D415 PolarHBondContact O-N 2.82Å
412	D	88.9	Confident	75.1	Confident	84 Å²	84	76 Å²	76	45%	0.449	38%	0.383	S	S	.	.	H	α-helix	trans	-53.8	-33.5	175.6	-52.4	-30.2	0	0	0	111.2	R408 A409 T416	R408-D412 PolarHBondContact O-N 2.68Å; R408-D412 VanDerWaalsContact O-OD2 3.14Å; A409-D412 WeakPolarHBondContact CA-OD2 3.43Å; D412-T416 WeakPolarHBondContact O-CG2 3.32Å; D412-T416 PolarHBondContact O-N 3.04Å; D412-T416 PolarHBondContact O-OG1 2.82Å; D412-T416 VanDerWaalsContact O-OG1 3.09Å
413	R	87.1	Confident	72.6	Confident	73 Å²	73	83.9 Å²	83.9	28%	0.275	42%	0.42	S	S	.	.	H	α-helix	trans	-85.8	-11.8	177	-70.5	179.1	-169.6	116.9	-4.2	114.8	N294 D404 A409 Y410 L411 T416 K417	N294-R413 PolarHBondContact OD1-NH1 2.94Å; D404-R413 VanDerWaalsContact O-CZ 3.3Å; D404-R413 PolarHBondContact O-NH1 3.41Å; D404-R413 PolarHBondContact O-NH2 3.13Å; A409-R413 VanDerWaalsContact O-CD 3.26Å; A409-R413 WeakPolarHBondContact O-CD 3.34Å; A409-R413 WeakPolarHBondContact O-CG 3.41Å; A409-R413 PolarHBondContact O-NH1 3.1Å; Y410-R413 CarbonylContact O-C 3.59Å; Y410-R413 PolarHBondContact O-N 2.59Å; L411-R413 PolarHBondContact O-N 3.31Å; R413-T416 WeakPolarHBondContact CA-OG1 3.37Å; R413-K417 WeakPolarHBondContact O-CD 3.35Å; R413-K417 WeakPolarHBondContact O-CG 3.26Å
414	M	84.6	Confident	70.5	Confident	53 Å²	53	90.6 Å²	90.6	26%	0.261	44%	0.443	S	S	.	.	H	α-helix	trans	-83.5	-47.6	167.1	-74.9	-174.9	62.8	0	0	110.1	Y410 L411 T416 K417 L418	Y410-M414 HydrophobicContact CD1-SD 4.09Å; Y410-M414 HydrophobicContact CE1-CG 4.1Å; Y410-M414 HydrophobicContact CE1-SD 3.26Å; Y410-M414 WeakPolarHBondContact CE1-SD 3.32Å; Y410-M414 VanDerWaalsContact CZ-SD 3.52Å; Y410-M414 PolarHBondContact O-N 2.99Å; Y410-M414 PolarHBondContact OH-SD 3.45Å; L411-M414 WeakPolarHBondContact O-CA 3.41Å; L411-M414 WeakPolarHBondContact O-CB 3.42Å; L411-M414 PolarHBondContact O-N 3.27Å; M414-T416 VanDerWaalsContact C-N 3.27Å; M414-T416 PolarHBondContact O-N 2.77Å; M414-K417 WeakPolarHBondContact O-CB 3.17Å; M414-K417 PolarHBondContact O-N 3.41Å; M414-L418 PolarHBondContact O-N 3.28Å
415	D	80.9	Confident	68.1	Low	102 Å²	102	92.1 Å²	92.1	55%	0.545	46%	0.458	S	S	.	.	H	α-helix	trans	-62	-35.5	-177.5	-64.4	-17.3	0	0	0	111.9	L411 K417	L411-D415 PolarHBondContact O-N 2.82Å; D415-K417 VanDerWaalsContact C-N 3.25Å; D415-K417 PolarHBondContact O-N 3Å
416	T	73.8	Confident	65.6	Low	92 Å²	92	99.2 Å²	99.2	56%	0.564	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.1	-9.1	173.5	54.1	0	0	0	0	114.8	D412 R413 M414	D412-T416 WeakPolarHBondContact O-CG2 3.32Å; D412-T416 PolarHBondContact O-N 3.04Å; D412-T416 PolarHBondContact O-OG1 2.82Å; D412-T416 VanDerWaalsContact O-OG1 3.09Å; R413-T416 WeakPolarHBondContact CA-OG1 3.37Å; M414-T416 VanDerWaalsContact C-N 3.27Å; M414-T416 PolarHBondContact O-N 2.77Å
417	K	63.9	Low	63.1	Low	132 Å²	132	105.5 Å²	105.5	57%	0.574	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.1	-12.3	178.2	-74.7	-178	176.9	-170.6	0	113.6	N295 R413 M414 D415	N295-K417 PolarHBondContact ND2-NZ 3.46Å; R413-K417 WeakPolarHBondContact O-CD 3.35Å; R413-K417 WeakPolarHBondContact O-CG 3.26Å; M414-K417 WeakPolarHBondContact O-CB 3.17Å; M414-K417 PolarHBondContact O-N 3.41Å; D415-K417 VanDerWaalsContact C-N 3.25Å; D415-K417 PolarHBondContact O-N 3Å
418	L	47.6	Very low	60.2	Low	120 Å²	120	111.2 Å²	111.2	63%	0.628	57%	0.573	S	S	*	*	S	Bend	trans	-87.3	121.4	172.1	-82	146.6	0	0	0	109.4	M414 K420	M414-L418 PolarHBondContact O-N 3.28Å; L418-K420 PolarHBondContact O-N 3.09Å
419	P	39.5	Very low	57.6	Low	109 Å²	109	110.7 Å²	110.7	71%	0.708	59%	0.586	S	S	*	*			trans	-66.9	119.2	175.3	27.3	-32.7	0	0	0	109.6	S421	P419-S421 PolarHBondContact O-N 3.22Å
420	K	44.6	Very low	55	Low	204 Å²	204	116.5 Å²	116.5	89%	0.887	62%	0.62	S	S	*	*			trans	-73.7	68.7	176.4	-69.1	-176	177.2	-179.8	0	111.4	L418	L418-K420 PolarHBondContact O-N 3.09Å
421	S	35.8	Very low	52.2	Low	100 Å²	100	122 Å²	122	70%	0.699	65%	0.646	S	S	*	*			trans	-83.8	130.4	174.3	58.9	0	0	0	0	111.9	P419	P419-S421 PolarHBondContact O-N 3.22Å
422	R	33	Very low	49.3	Very low	228 Å²	228	127.4 Å²	127.4	86%	0.86	67%	0.669	S	S	*	*			trans	67.5	77	152.8	-153.5	174.9	-160.8	164.4	5.3	118.6
423	M	32.8	Very low	46.8	Very low	185 Å²	185	130.8 Å²	130.8	91%	0.911	68%	0.682	S	S	*	*			trans	-129.9	78.1	154.3	-89.7	-85.7	87.7	0	0	111.3
424	Q	39.5	Very low	44.1	Very low	171 Å²	171	133.6 Å²	133.6	80%	0.799	70%	0.702	S	S	*	*			trans	-177.6	107.4	164.9	-101.5	160.2	3.3	0	0	104.9
425	S	34.7	Very low	41.7	Very low	92 Å²	92	135.5 Å²	135.5	64%	0.643	73%	0.727	S	S	*	*				95.6	101.9	62.1	65.2	0	0	0	0	112.4
426	N	38.8	Very low	39.6	Very low	149 Å²	149	136.7 Å²	136.7	80%	0.797	74%	0.737	S	S	*	*				172.7	133.5	128.9	-84.4	-9.9	0	0	0	113.3
427	V	39	Very low	37.9	Very low	131 Å²	131	140 Å²	140	79%	0.794	75%	0.746	S	S	*	*			trans	40.1	133	132.1	-171.5	0	0	0	0	119.4
428	C	33	Very low	36.7	Very low	120 Å²	120	140.4 Å²	140.4	81%	0.811	75%	0.754	S	S	*	*			cis	-163.3	167.8	-19.6	-118.9	0	0	0	0	108.7
429	P	36.3	Very low	36.1	Very low	113 Å²	113	142 Å²	142	73%	0.734	76%	0.764	S	S	*	*			trans	-116.9	147.8	-164.1	39.8	-30.6	0	0	0	118
430	T	36.3	Very low	36.4	Very low	134 Å²	134	141.7 Å²	141.7	82%	0.822	76%	0.762	S	S	*	*			trans	-170	153.2	159.5	28.4	0	0	0	0	108.7
431	E	34	Very low	36	Very low	138 Å²	138	138.1 Å²	138.1	65%	0.645	76%	0.757	S	S	*	*			cis	-157.2	153.5	-29.8	-132	-164.9	157	0	0	110
432	K	32.2	Very low	36.1	Very low	146 Å²	146	142.1 Å²	142.1	64%	0.635	76%	0.764	S	S	*	*			trans	42.3	125	151.8	-74.9	166.8	-177	149.2	0	122.9
433	Q	35.4	Very low	36.3	Very low	154 Å²	154	136.1 Å²	136.1	72%	0.72	76%	0.757	S	S	*	*				94.4	115.6	126.7	-74.7	176.3	-9.6	0	0	122.4
434	N	31	Very low	36.8	Very low	132 Å²	132	132.3 Å²	132.3	71%	0.706	75%	0.746	S	S	*	*				77.1	114.2	126.3	-61.5	-0.2	0	0	0	121.9
435	A	33.6	Very low	36.7	Very low	94 Å²	94	130.1 Å²	130.1	78%	0.777	74%	0.74	S	S	*	*				76.5	152.3	123.2	0	0	0	0	0	118.2
436	V	36.3	Very low	36.8	Very low	126 Å²	126	132.7 Å²	132.7	76%	0.764	75%	0.746	S	S	*	*			cis	-164.9	152.6	-12.3	118.4	0	0	0	0	109.9
437	H	38.1	Very low	36.8	Very low	161 Å²	161	130.7 Å²	130.7	75%	0.745	74%	0.739	S	S	*	*			trans	69.5	156.6	160.9	-102.8	-90.4	0	0	0	123.2
438	D	38.7	Very low	36.6	Very low	142 Å²	142	130.9 Å²	130.9	76%	0.759	74%	0.735	S	S	*	*			trans	80.3	96.6	151.8	-59.5	-31.2	0	0	0	124.1
439	D	36.4	Very low	36.8	Very low	153 Å²	153	129.9 Å²	129.9	82%	0.818	73%	0.73	S	S	*	*			trans	-58	-178.2	143.9	-90	-51.1	0	0	0	114.3
440	P	45.1	Very low	36.7	Very low	103 Å²	103	131.7 Å²	131.7	67%	0.669	73%	0.733	S	S	*	*			cis	-138.6	-161.5	-32.4	32.1	-9.2	0	0	0	113.4
441	V	35.5	Very low	36.6	Very low	129 Å²	129	133.1 Å²	133.1	78%	0.782	74%	0.735	S	S	*	*			trans	77.8	124.5	163.4	-169.5	0	0	0	0	114.8
442	E	38.4	Very low	36.4	Very low	183 Å²	183	131 Å²	131	86%	0.855	74%	0.736	S	S	*	*				-155.7	172.3	66.9	-161.6	159	-146.7	0	0	114.3
443	S	37	Very low	36.4	Very low	103 Å²	103	130 Å²	130	72%	0.72	74%	0.741	S	S	*	*			trans	-114.1	-156.3	-176.9	-49.8	0	0	0	0	109.9
444	P	42.9	Very low	36.2	Very low	104 Å²	104	130 Å²	130	68%	0.675	75%	0.746	S	S	*	*			cis	-139.6	-162.7	-13.4	27.2	-0.8	0	0	0	114.4
445	N	38.4	Very low	36.3	Very low	126 Å²	126	130.9 Å²	130.9	67%	0.674	75%	0.75	S	S	*	*			trans	101.9	121.8	132.4	-86.1	-9	0	0	0	123.9
446	L	37.2	Very low	36.2	Very low	146 Å²	146	131.7 Å²	131.7	76%	0.764	75%	0.746	S	S	*	*			trans	72.1	144.7	135.4	-57.6	169.8	0	0	0	118.7
447	V	38.3	Very low	36	Very low	106 Å²	106	130.7 Å²	130.7	64%	0.642	75%	0.745	S	S	*	*			cis	-157.6	163.2	-8.2	104.1	0	0	0	0	112.8
448	N	34.6	Very low	35.9	Very low	136 Å²	136	128.9 Å²	128.9	73%	0.727	75%	0.75	S	S	*	*			trans	-8.7	162.5	159.8	-41	-20.4	0	0	0	120.2
449	S	37.3	Very low	35.6	Very low	99 Å²	99	127.1 Å²	127.1	69%	0.692	75%	0.749	S	S	*	*			cis	-161.4	156.5	27.6	-37.7	0	0	0	0	114.6
450	N	34.6	Very low	35.7	Very low	150 Å²	150	127.2 Å²	127.2	80%	0.802	75%	0.748	S	S	*	*			trans	5.6	145	135.3	-46.1	-21.1	0	0	0	118.3
451	L	33.8	Very low	35.1	Very low	164 Å²	164	133.6 Å²	133.6	86%	0.859	76%	0.759	S	S	*	*				-163	168.9	52	-162.2	66	0	0	0	114.1
452	S	29.3	Very low	35	Very low	95 Å²	95	131.8 Å²	131.8	66%	0.664	76%	0.758	S	S	*	*			trans	-66	170.9	-170.3	-44.8	0	0	0	0	120
453	T	33.5	Very low	35	Very low	123 Å²	123	128 Å²	128	76%	0.755	75%	0.752	S	S	*	*			trans	112.1	98.8	148.3	66.8	0	0	0	0	121.2
454	N	30.5	Very low	34.9	Very low	154 Å²	154	129.7 Å²	129.7	82%	0.824	75%	0.753	S	S	*	*				68.2	149.7	121.7	-69.7	-10.1	0	0	0	124.7
455	L	33.9	Very low	34.6	Very low	151 Å²	151	131.2 Å²	131.2	79%	0.791	76%	0.755	S	S	*	*			trans	88.3	92.6	154.6	-72	166.5	0	0	0	121.9
456	T	29.8	Very low	34.5	Very low	112 Å²	112	136.5 Å²	136.5	69%	0.687	77%	0.765	S	S	*	*				69.3	117.1	123.2	52.3	0	0	0	0	123.9
457	S	32.5	Very low	34.1	Very low	105 Å²	105	137.1 Å²	137.1	73%	0.734	77%	0.769	S	S	*	*				91.5	149.8	121.7	-65.1	0	0	0	0	122
458	S	35.7	Very low	34	Very low	123 Å²	123	137.6 Å²	137.6	86%	0.86	78%	0.777	S	S	*	*			trans	69.8	155.7	175	77.7	0	0	0	0	115.9
459	S	33.1	Very low	33.8	Very low	104 Å²	104	140 Å²	140	73%	0.727	78%	0.784	S	S	*	*			cis	-173.9	-174.8	-28.1	-173.6	0	0	0	0	107.2
460	L	38.6	Very low	33.7	Very low	155 Å²	155	143.2 Å²	143.2	81%	0.812	79%	0.792	S	S	*	*			trans	82.8	123.4	-175.8	-51.4	163.3	0	0	0	112.8
461	R	32.7	Very low	33.5	Very low	237 Å²	237	141.9 Å²	141.9	89%	0.894	79%	0.789	S	S	*	*			cis	67.2	141.2	44.3	-65.7	-165.8	175.3	-158.8	0.8	114.7
462	A	33.9	Very low	33.5	Very low	91 Å²	91	141 Å²	141	75%	0.752	79%	0.785	S	S	*	*			cis	174.1	100.5	-36.7	0	0	0	0	0	108.8
463	S	37.1	Very low	33.5	Very low	105 Å²	105	141.6 Å²	141.6	73%	0.734	79%	0.789	S	S	*	*			trans	172.7	151.6	176.2	48.6	0	0	0	0	108.4
464	D	35.9	Very low	33.6	Very low	137 Å²	137	143.2 Å²	143.2	73%	0.733	79%	0.793	S	S	*	*			cis	-160.3	160.2	-12.5	-119.3	-43.7	0	0	0	112.4
465	L	36.4	Very low	33.7	Very low	137 Å²	137	140.9 Å²	140.9	72%	0.717	79%	0.786	S	S	*	*			trans	28.3	110	146.7	-69.8	161.1	0	0	0	121.6
466	R	35	Very low	33.8	Very low	236 Å²	236	140.9 Å²	140.9	89%	0.891	79%	0.785	S	S	*	*				173.9	158.7	102.7	-97.5	162.4	-172.6	-161	1.2	116.2
467	N	30.7	Very low	34.1	Very low	160 Å²	160	140.9 Å²	140.9	86%	0.856	79%	0.785	S	S	*	*			trans	-63.6	142.8	-170.9	-47.1	-9.3	0	0	0	115.3
468	S	35.4	Very low	34.5	Very low	115 Å²	115	140.2 Å²	140.2	80%	0.804	78%	0.776	S	S	*	*			trans	-143.7	152.7	130.1	66.7	0	0	0	0	109.8
469	E	29.3	Very low	34.4	Very low	187 Å²	187	140.2 Å²	140.2	87%	0.874	78%	0.776	S	S	*	*			trans	-81.9	139.6	177.1	-61.3	166	111	0	0	110.4
470	I	36.8	Very low	34.8	Very low	167 Å²	167	136.9 Å²	136.9	86%	0.856	75%	0.752	S	S	*	*			trans	-161.2	130.8	144.9	-100.3	144.3	0	0	0	108.5
471	T	29.7	Very low	34.8	Very low	121 Å²	121	133.6 Å²	133.6	74%	0.742	74%	0.742	S	S	*	*			trans	-77.3	138.5	179.4	52.5	0	0	0	0	112
472	N	33.7	Very low	35.8	Very low	146 Å²	146	127.2 Å²	127.2	78%	0.781	73%	0.726	S	S	*	*			trans	-168.3	139.2	138.7	-100.8	-41.6	0	0	0	114.9
473	S	30.5	Very low	37	Very low	107 Å²	107	125.2 Å²	125.2	75%	0.748	71%	0.709	S	S	*	*			trans	32.1	104.1	156.4	60.9	0	0	0	0	120.4
474	L	34.9	Very low	38.3	Very low	158 Å²	158	125.3 Å²	125.3	83%	0.827	70%	0.698	S	S	*	*			trans	-114	153.4	145.1	-94.2	84.6	0	0	0	110.1
475	P	32.6	Very low	40.1	Very low	104 Å²	104	122.6 Å²	122.6	68%	0.675	68%	0.683	S	S	*	*			trans	-67.2	156.5	174.9	30.4	-36	0	0	0	111.2	T477	P475-T477 PolarHBondContact O-N 3.18Å
476	I	36	Very low	42.2	Very low	151 Å²	151	119.8 Å²	119.8	77%	0.774	67%	0.669	S	S	*	*			trans	-73.8	78.4	176.5	-51.5	176.2	0	0	0	109.9	T478	I476-T478 PolarHBondContact O-N 3.47Å
477	T	36.9	Very low	44.6	Very low	112 Å²	112	109.3 Å²	109.3	69%	0.687	63%	0.63	S	S	*	*			trans	-66.8	111.1	151.1	38.3	0	0	0	0	107.6	P475 S479	P475-T477 PolarHBondContact O-N 3.18Å; T477-S479 PolarHBondContact O-N 3.08Å
478	T	40	Very low	47.2	Very low	91 Å²	91	108.1 Å²	108.1	56%	0.558	61%	0.614	S	S	*	*			trans	-49.6	133.9	156.5	47	0	0	0	0	108	I476 T480	I476-T478 PolarHBondContact O-N 3.47Å; T478-T480 PolarHBondContact O-N 3.07Å
479	S	32.5	Very low	49.6	Very low	123 Å²	123	107.2 Å²	107.2	86%	0.86	60%	0.6	S	S	*	*			trans	-68.7	76.3	-171.7	57	0	0	0	0	112.5	T477 S481	T477-S479 PolarHBondContact O-N 3.08Å; S479-S481 PolarHBondContact O-N 3Å
480	T	41.6	Very low	52.4	Low	34 Å²	34	99.5 Å²	99.5	21%	0.209	57%	0.565	C	S	.	*			trans	-73	115.5	173.2	57.3	0	0	0	0	108.3	E396 T478 N482	E396-T480 WeakPolarHBondContact O-CG2 3.31Å; T478-T480 PolarHBondContact O-N 3.07Å; T480-N482 PolarHBondContact O-N 2.87Å; T480-N482 PolarHBondContact OG1-OD1 2.89Å
481	S	40.1	Very low	54.9	Low	86 Å²	86	92 Å²	92	60%	0.601	53%	0.529	S	S	*	.			trans	-65.8	98.6	171	52.9	0	0	0	0	108.8	S479 A483	S479-S481 PolarHBondContact O-N 3Å; S481-A483 VanDerWaalsContact C-N 3.34Å; S481-A483 PolarHBondContact O-N 2.99Å
482	N	52.8	Low	57.6	Low	104 Å²	104	91.7 Å²	91.7	56%	0.556	52%	0.517	S	S	*	.			trans	-71.4	91.7	175.5	-65.3	-29.4	0	0	0	108	T480 E484	T480-N482 PolarHBondContact O-N 2.87Å; T480-N482 PolarHBondContact OG1-OD1 2.89Å; N482-E484 PolarHBondContact O-N 2.84Å
483	A	59.2	Low	60.3	Low	49 Å²	49	88.9 Å²	88.9	41%	0.405	50%	0.499	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	107.6	177.1	0	0	0	0	0	108.9	I394 S481	I394-A483 PolarHBondContact N-O 3.23Å; I394-A483 PolarHBondContact O-N 2.78Å; S481-A483 VanDerWaalsContact C-N 3.34Å; S481-A483 PolarHBondContact O-N 2.99Å
484	E	65.3	Low	63.2	Low	107 Å²	107	83.8 Å²	83.8	50%	0.5	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	107.4	168.9	-172.6	150.5	-129.7	0	0	108.9	A391 R393 N482 D486	A391-E484 HydrophobicContact CB-CG 3.65Å; R393-E484 VanDerWaalsContact CD-OE1 3.23Å; R393-E484 WeakPolarHBondContact CD-OE1 3.3Å; R393-E484 HydrophobicContact CG-CB 4.04Å; R393-E484 HydrophobicContact CG-CG 3.8Å; R393-E484 WeakPolarHBondContact CG-OE1 3.4Å; R393-E484 IonicContact CZ-OE1 3.86Å; R393-E484 IonicContact NE-OE1 2.71Å; R393-E484 IonicContact NH1-OE1 3.81Å; R393-E484 PolarHBondContact NH1-OE1 2.83Å; N482-E484 PolarHBondContact O-N 2.84Å; E484-D486 PolarHBondContact O-N 3.09Å
485	L	73.3	Confident	65.8	Low	80 Å²	80	79.8 Å²	79.8	42%	0.419	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	103	174.4	-64.1	180	0	0	0	108.5	A391 I392 I394 L487	A391-L485 CarbonylContact C-O 3.52Å; A391-L485 WeakPolarHBondContact CA-O 3.38Å; A391-L485 WeakPolarHBondContact CB-O 3.48Å; I392-L485 PolarHBondContact N-O 2.91Å; I392-L485 PolarHBondContact O-N 2.97Å; I394-L485 HydrophobicContact CD1-CD1 3.61Å; I394-L485 HydrophobicContact CD1-CG 4.43Å; I394-L485 HydrophobicContact CG1-CD1 4.39Å; L485-L487 HydrophobicContact CB-CD2 4.3Å; L485-L487 PolarHBondContact O-N 2.73Å
486	D	80.6	Confident	68.5	Low	78 Å²	78	80.7 Å²	80.7	42%	0.417	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	116	169.3	-170.9	-3	0	0	0	109.7	E484 R488	E484-D486 PolarHBondContact O-N 3.09Å; D486-R488 WeakPolarHBondContact OD1-CB 3.38Å; D486-R488 WeakPolarHBondContact OD1-CG 3.43Å; D486-R488 IonicContact OD1-CZ 2.76Å; D486-R488 PolarHBondContact OD1-N 3.26Å; D486-R488 IonicContact OD1-NE 3.69Å; D486-R488 PolarHBondContact OD1-NE 2.98Å; D486-R488 IonicContact OD1-NH2 3.25Å; D486-R488 IonicContact OD2-CZ 2.87Å; D486-R488 VanDerWaalsContact OD2-CZ 3.28Å; D486-R488 IonicContact OD2-NE 3.7Å; D486-R488 PolarHBondContact OD2-NE 2.94Å; D486-R488 VanDerWaalsContact OD2-NE 3.1Å; D486-R488 IonicContact OD2-NH2 3.94Å; D486-R488 PolarHBondContact OD2-NH2 3.4Å
487	L	85.6	Confident	71.1	Confident	16 Å²	16	73.7 Å²	73.7	8%	0.084	41%	0.411	C	S	.	.			trans	-109.5	9.2	-179.3	-59.1	-173.8	0	0	0	112.6	I388 I392 L485 D489 L490 G491 T510 A514	I388-L487 HydrophobicContact CG2-CB 3.84Å; I392-L487 HydrophobicContact CD1-CD1 3.5Å; I392-L487 HydrophobicContact CG1-CD1 3.76Å; L485-L487 HydrophobicContact CB-CD2 4.3Å; L485-L487 PolarHBondContact O-N 2.73Å; L487-D489 VanDerWaalsContact C-N 3.28Å; L487-D489 PolarHBondContact O-N 3.09Å; L487-L490 HydrophobicContact CB-CB 4.5Å; L487-L490 HydrophobicContact CD2-CD2 4.26Å; L487-L490 CarbonylContact O-C 3.56Å; L487-L490 WeakPolarHBondContact O-CB 3.13Å; L487-L490 PolarHBondContact O-N 3.3Å; L487-L490 VanDerWaalsContact O-N 3.11Å; L487-G491 PolarHBondContact O-N 3.38Å; L487-T510 HydrophobicContact CD1-CG2 4.16Å; L487-T510 HydrophobicContact CD2-CG2 4.14Å; L487-A514 HydrophobicContact CD1-CB 3.63Å
488	R	84.6	Confident	73.8	Confident	135 Å²	135	68.3 Å²	68.3	51%	0.509	38%	0.379	S	S	.	.	H	α-helix	trans	-61	-35.4	-177.3	-68.1	176	-64.2	171.2	1.8	112.6	D486 G491 K492	D486-R488 WeakPolarHBondContact OD1-CB 3.38Å; D486-R488 WeakPolarHBondContact OD1-CG 3.43Å; D486-R488 IonicContact OD1-CZ 2.76Å; D486-R488 PolarHBondContact OD1-N 3.26Å; D486-R488 IonicContact OD1-NE 3.69Å; D486-R488 PolarHBondContact OD1-NE 2.98Å; D486-R488 IonicContact OD1-NH2 3.25Å; D486-R488 IonicContact OD2-CZ 2.87Å; D486-R488 VanDerWaalsContact OD2-CZ 3.28Å; D486-R488 IonicContact OD2-NE 3.7Å; D486-R488 PolarHBondContact OD2-NE 2.94Å; D486-R488 VanDerWaalsContact OD2-NE 3.1Å; D486-R488 IonicContact OD2-NH2 3.94Å; D486-R488 PolarHBondContact OD2-NH2 3.4Å; R488-G491 PolarHBondContact O-N 2.95Å; R488-K492 VanDerWaalsContact O-CG 3.31Å; R488-K492 WeakPolarHBondContact O-CG 3.3Å; R488-K492 PolarHBondContact O-N 3.06Å
489	D	85.9	Confident	76.4	Confident	95 Å²	95	64.9 Å²	64.9	51%	0.508	36%	0.357	S	S	.	.	H	α-helix	trans	-75.6	-32.2	176.6	-68.2	-29	0	0	0	112.6	L487 K492 Q493	L487-D489 VanDerWaalsContact C-N 3.28Å; L487-D489 PolarHBondContact O-N 3.09Å; D489-K492 PolarHBondContact O-N 3.31Å; D489-K492 WeakPolarHBondContact OD1-CE 3.4Å; D489-K492 IonicContact OD1-NZ 2.76Å; D489-K492 PolarHBondContact OD1-NZ 3.36Å; D489-Q493 WeakPolarHBondContact O-CG 3.46Å; D489-Q493 PolarHBondContact O-N 3.47Å
490	L	88.4	Confident	79.2	Confident	26 Å²	26	62.5 Å²	62.5	14%	0.136	33%	0.33	C	S	.	.	H	α-helix	trans	-64.8	-40.6	168.4	177.1	63	0	0	0	111	L487 Q493 L494 I506 T510	L487-L490 HydrophobicContact CB-CB 4.5Å; L487-L490 HydrophobicContact CD2-CD2 4.26Å; L487-L490 CarbonylContact O-C 3.56Å; L487-L490 WeakPolarHBondContact O-CB 3.13Å; L487-L490 PolarHBondContact O-N 3.3Å; L487-L490 VanDerWaalsContact O-N 3.11Å; L490-Q493 PolarHBondContact O-N 2.9Å; L490-L494 HydrophobicContact CD1-CD1 3.85Å; L490-L494 HydrophobicContact CD1-CG 4.04Å; L490-L494 HydrophobicContact CG-CD1 3.87Å; L490-L494 HydrophobicContact CG-CG 4.43Å; L490-L494 WeakPolarHBondContact O-CB 3.41Å; L490-L494 VanDerWaalsContact O-CG 3.32Å; L490-L494 WeakPolarHBondContact O-CG 3.44Å; L490-L494 PolarHBondContact O-N 2.85Å; L490-I506 HydrophobicContact CD1-CD1 3.67Å; L490-I506 HydrophobicContact CD1-CG1 3.83Å; L490-I506 HydrophobicContact CD1-CG2 3.94Å; L490-T510 HydrophobicContact CD2-CG2 3.75Å
491	G	88.6	Confident	81.6	Confident	10 Å²	10	65.7 Å²	65.7	10%	0.103	34%	0.342	C	S	.	.	H	α-helix	trans	-60.5	-43.6	174.3	0	0	0	0	0	112.9	L487 R488 L494 S495	L487-G491 PolarHBondContact O-N 3.38Å; R488-G491 PolarHBondContact O-N 2.95Å; G491-L494 PolarHBondContact O-N 3.38Å; G491-S495 WeakPolarHBondContact O-CB 3.41Å; G491-S495 PolarHBondContact O-N 3.38Å; G491-S495 PolarHBondContact O-OG 2.84Å
492	K	87.8	Confident	84	Confident	114 Å²	114	66 Å²	66	50%	0.496	34%	0.335	S	S	.	.	H	α-helix	trans	-62.8	-44.9	173.1	-67.6	166.3	-158.4	165.7	0	112.4	R488 D489 S495 I496	R488-K492 VanDerWaalsContact O-CG 3.31Å; R488-K492 WeakPolarHBondContact O-CG 3.3Å; R488-K492 PolarHBondContact O-N 3.06Å; D489-K492 PolarHBondContact O-N 3.31Å; D489-K492 WeakPolarHBondContact OD1-CE 3.4Å; D489-K492 IonicContact OD1-NZ 2.76Å; D489-K492 PolarHBondContact OD1-NZ 3.36Å; K492-S495 PolarHBondContact O-N 2.88Å; K492-S495 PolarHBondContact O-OG 3.21Å; K492-S495 VanDerWaalsContact O-OG 3.12Å; K492-I496 WeakPolarHBondContact O-CB 3.41Å; K492-I496 VanDerWaalsContact O-CG1 3.28Å; K492-I496 WeakPolarHBondContact O-CG1 3.48Å; K492-I496 PolarHBondContact O-N 3.34Å
493	Q	89.3	Confident	86	Confident	87 Å²	87	61 Å²	61	41%	0.407	31%	0.308	S	S	.	.	H	α-helix	trans	-61.6	-45.8	177.2	-73.7	174.1	16	0	0	111	D489 L490 S495 G497 V498	D489-Q493 WeakPolarHBondContact O-CG 3.46Å; D489-Q493 PolarHBondContact O-N 3.47Å; L490-Q493 PolarHBondContact O-N 2.9Å; Q493-S495 PolarHBondContact O-N 3.18Å; Q493-G497 CarbonylContact O-C 3.56Å; Q493-G497 WeakPolarHBondContact O-CA 3.46Å; Q493-G497 PolarHBondContact O-N 3.43Å; Q493-V498 HydrophobicContact CB-CG1 4Å
494	L	92.2	Very high	87.6	Confident	0 Å²	0	65.2 Å²	65.2	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-71.3	-25.6	-179.9	-69.1	173.3	0	0	0	113.5	L343 N381 L382 I388 L490 G491 V498 I506 I511	L343-L494 HydrophobicContact CD2-CD2 3.9Å; N381-L494 CarbonylContact C-O 3.59Å; N381-L494 VanDerWaalsContact CA-O 3.25Å; N381-L494 WeakPolarHBondContact CA-O 3.32Å; L382-L494 HydrophobicContact CB-CB 4.44Å; L382-L494 HydrophobicContact CD1-CB 3.76Å; L382-L494 HydrophobicContact CD1-CD1 3.76Å; L382-L494 HydrophobicContact CD1-CG 4.35Å; L382-L494 HydrophobicContact CG-CB 3.99Å; L382-L494 HydrophobicContact CG-CD1 4.4Å; L382-L494 PolarHBondContact N-O 2.85Å; I388-L494 HydrophobicContact CD1-CD1 4.06Å; L490-L494 HydrophobicContact CD1-CD1 3.85Å; L490-L494 HydrophobicContact CD1-CG 4.04Å; L490-L494 HydrophobicContact CG-CD1 3.87Å; L490-L494 HydrophobicContact CG-CG 4.43Å; L490-L494 WeakPolarHBondContact O-CB 3.41Å; L490-L494 VanDerWaalsContact O-CG 3.32Å; L490-L494 WeakPolarHBondContact O-CG 3.44Å; L490-L494 PolarHBondContact O-N 2.85Å; G491-L494 PolarHBondContact O-N 3.38Å; L494-V498 HydrophobicContact CD2-CG1 4.07Å; L494-V498 HydrophobicContact CD2-CG2 3.71Å; L494-I506 HydrophobicContact CD2-CD1 4.28Å; L494-I511 HydrophobicContact CD1-CD1 3.98Å; L494-I511 HydrophobicContact CD1-CG1 4.01Å; L494-I511 HydrophobicContact CD2-CD1 4.35Å
495	S	89	Confident	88.7	Confident	73 Å²	73	68.9 Å²	68.9	51%	0.51	33%	0.331	S	S	.	.	H	α-helix	trans	-80.6	-37.6	174.5	64.5	0	0	0	0	112.9	N381 G491 K492 Q493	N381-S495 PolarHBondContact ND2-O 3.4Å; G491-S495 WeakPolarHBondContact O-CB 3.41Å; G491-S495 PolarHBondContact O-N 3.38Å; G491-S495 PolarHBondContact O-OG 2.84Å; K492-S495 PolarHBondContact O-N 2.88Å; K492-S495 PolarHBondContact O-OG 3.21Å; K492-S495 VanDerWaalsContact O-OG 3.12Å; Q493-S495 PolarHBondContact O-N 3.18Å
496	I	88.6	Confident	89.7	Confident	123 Å²	123	65.5 Å²	65.5	63%	0.631	31%	0.313	S	S	*	.	H	α-helix	trans	-68	-39.4	172.3	-66.6	167.9	0	0	0	111	M379 N381 K492	M379-I496 WeakPolarHBondContact CE-O 3.37Å; N381-I496 PolarHBondContact ND2-O 3.33Å; K492-I496 WeakPolarHBondContact O-CB 3.41Å; K492-I496 VanDerWaalsContact O-CG1 3.28Å; K492-I496 WeakPolarHBondContact O-CG1 3.48Å; K492-I496 PolarHBondContact O-N 3.34Å
497	G	91.6	Very high	90.3	Very high	4 Å²	4	66.7 Å²	66.7	4%	0.041	32%	0.315	C	S	.	.			trans	119.9	140.2	178.6	0	0	0	0	0	112.3	M379 L380 N381 Q493	M379-G497 VanDerWaalsContact CG-C 3.49Å; L380-G497 WeakPolarHBondContact O-CA 3.42Å; N381-G497 VanDerWaalsContact CG-CA 3.46Å; N381-G497 WeakPolarHBondContact ND2-CA 3.38Å; N381-G497 PolarHBondContact ND2-N 3.25Å; N381-G497 WeakPolarHBondContact OD1-CA 3.35Å; Q493-G497 CarbonylContact O-C 3.56Å; Q493-G497 WeakPolarHBondContact O-CA 3.46Å; Q493-G497 PolarHBondContact O-N 3.43Å
498	V	93.3	Very high	90.8	Very high	0 Å²	0	65.9 Å²	65.9	0%	0	31%	0.311	C	S	.	.	B	Isolated β-bridge	trans	-114.9	131.4	179	-64.7	0	0	0	0	112.1	L343 M379 L380 Q493 L494 M502 A503 I506	L343-V498 HydrophobicContact CD2-CG2 3.62Å; M379-V498 WeakPolarHBondContact CA-O 3.32Å; L380-V498 PolarHBondContact N-O 3.03Å; L380-V498 PolarHBondContact O-N 3.38Å; Q493-V498 HydrophobicContact CB-CG1 4Å; L494-V498 HydrophobicContact CD2-CG1 4.07Å; L494-V498 HydrophobicContact CD2-CG2 3.71Å; V498-M502 HydrophobicContact CB-CB 4.21Å; V498-M502 HydrophobicContact CG1-CB 4.34Å; V498-A503 HydrophobicContact CG2-CB 4.35Å; V498-I506 HydrophobicContact CB-CD1 4.42Å; V498-I506 HydrophobicContact CG1-CD1 3.9Å; V498-I506 HydrophobicContact CG2-CD1 4.41Å
499	T	93.4	Very high	91.1	Very high	18 Å²	18	60.7 Å²	60.7	11%	0.11	29%	0.294	C	S	.	.			trans	-83.3	171.3	171.8	78.1	0	0	0	0	110	M379 E501 M502 A503 F528	M379-T499 HydrophobicContact CG-CG2 4.42Å; M379-T499 HydrophobicContact SD-CG2 4.42Å; T499-E501 WeakPolarHBondContact CB-OE2 3.45Å; T499-E501 PolarHBondContact O-N 3.45Å; T499-E501 VanDerWaalsContact O-N 3.12Å; T499-E501 PolarHBondContact OG1-N 3.14Å; T499-E501 PolarHBondContact OG1-OE2 2.95Å; T499-M502 HydrophobicContact CG2-CE 3.86Å; T499-M502 PolarHBondContact O-N 2.85Å; T499-A503 WeakPolarHBondContact O-CB 3.42Å; T499-A503 PolarHBondContact O-N 3.26Å; T499-F528 HydrophobicContact CG2-CE1 3.7Å; T499-F528 HydrophobicContact CG2-CE2 4.16Å; T499-F528 HydrophobicContact CG2-CZ 3.29Å
500	R	93.2	Very high	91.4	Very high	74 Å²	74	58.3 Å²	58.3	28%	0.279	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.3	-30.8	176.6	-172.8	170	166.9	-162	0.7	114.1	S344 I347 F348 E351 R504	S344-R500 WeakPolarHBondContact CB-O 3.41Å; I347-R500 HydrophobicContact CB-CB 4.35Å; I347-R500 HydrophobicContact CG2-CB 3.75Å; I347-R500 HydrophobicContact CG2-CG 4.33Å; F348-R500 VanDerWaalsContact CG-NH2 3.3Å; E351-R500 WeakPolarHBondContact OE2-CD 3.41Å; E351-R500 IonicContact OE2-NH1 3.53Å; R500-R504 VanDerWaalsContact O-CG 3.29Å; R500-R504 WeakPolarHBondContact O-CG 3.25Å
501	E	91.2	Very high	91.6	Very high	100 Å²	100	57 Å²	57	47%	0.467	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-50.5	179.9	-65.5	55.5	-116.7	0	0	110.7	T499 A503 R504	T499-E501 WeakPolarHBondContact CB-OE2 3.45Å; T499-E501 PolarHBondContact O-N 3.45Å; T499-E501 VanDerWaalsContact O-N 3.12Å; T499-E501 PolarHBondContact OG1-N 3.14Å; T499-E501 PolarHBondContact OG1-OE2 2.95Å; E501-A503 VanDerWaalsContact C-N 3.27Å; E501-A503 PolarHBondContact O-N 3.33Å; E501-R504 WeakPolarHBondContact O-CG 3.28Å; E501-R504 PolarHBondContact O-N 3.42Å; E501-R504 IonicContact OE1-NH2 3.83Å
502	M	91	Very high	91.7	Very high	92 Å²	92	58 Å²	58	45%	0.453	28%	0.277	S	S	.	.	G	3₁₀ helix	trans	-67.2	-32.1	178.3	-65.1	-167.4	-82.8	0	0	111.4	V498 T499 R504	V498-M502 HydrophobicContact CB-CB 4.21Å; V498-M502 HydrophobicContact CG1-CB 4.34Å; T499-M502 HydrophobicContact CG2-CE 3.86Å; T499-M502 PolarHBondContact O-N 2.85Å; M502-R504 PolarHBondContact O-N 3.18Å
503	A	93.7	Very high	91.8	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-72.8	-6.6	179.8	0	0	0	0	0	115.2	L343 S344 I347 V498 T499 E501 E505 I506	L343-A503 HydrophobicContact CB-CB 4.01Å; L343-A503 HydrophobicContact CD2-CB 4.39Å; L343-A503 HydrophobicContact CG-CB 4.12Å; S344-A503 PolarHBondContact N-O 3.04Å; I347-A503 HydrophobicContact CD1-CB 3.65Å; V498-A503 HydrophobicContact CG2-CB 4.35Å; T499-A503 WeakPolarHBondContact O-CB 3.42Å; T499-A503 PolarHBondContact O-N 3.26Å; E501-A503 VanDerWaalsContact C-N 3.27Å; E501-A503 PolarHBondContact O-N 3.33Å; A503-E505 VanDerWaalsContact C-N 3.31Å; A503-E505 PolarHBondContact O-N 2.95Å; A503-I506 PolarHBondContact O-N 2.8Å
504	R	92.6	Very high	91.8	Very high	138 Å²	138	52.1 Å²	52.1	52%	0.521	26%	0.256	S	S	.	.	G	3₁₀ helix	trans	-65.8	-29.5	-178.6	-63.8	-176.2	-171.4	-167.9	5.7	113.7	Q342 R500 E501 M502	Q342-R504 PolarHBondContact NE2-O 3.32Å; Q342-R504 PolarHBondContact OE1-O 3.13Å; R500-R504 VanDerWaalsContact O-CG 3.29Å; R500-R504 WeakPolarHBondContact O-CG 3.25Å; E501-R504 WeakPolarHBondContact O-CG 3.28Å; E501-R504 PolarHBondContact O-N 3.42Å; E501-R504 IonicContact OE1-NH2 3.83Å; M502-R504 PolarHBondContact O-N 3.18Å
505	E	89.9	Confident	91.6	Very high	183 Å²	183	53.6 Å²	53.6	86%	0.855	26%	0.264	S	S	*	.	S	Bend	trans	-95.2	-10.3	179.4	-59.4	-168.8	170	0	0	112.4	A503	A503-E505 VanDerWaalsContact C-N 3.31Å; A503-E505 PolarHBondContact O-N 2.95Å
506	I	93.5	Very high	91.4	Very high	10 Å²	10	53 Å²	53	5%	0.051	27%	0.27	C	S	.	.			trans	-91.1	110.3	-175.3	-53	177.2	0	0	0	110	Q342 L343 L490 L494 V498 A503 I511	Q342-I506 WeakPolarHBondContact CA-O 3.25Å; L343-I506 HydrophobicContact CB-CB 4.37Å; L343-I506 HydrophobicContact CB-CG2 4.37Å; L343-I506 HydrophobicContact CD2-CG2 4.37Å; L343-I506 PolarHBondContact N-O 2.87Å; L490-I506 HydrophobicContact CD1-CD1 3.67Å; L490-I506 HydrophobicContact CD1-CG1 3.83Å; L490-I506 HydrophobicContact CD1-CG2 3.94Å; L494-I506 HydrophobicContact CD2-CD1 4.28Å; V498-I506 HydrophobicContact CB-CD1 4.42Å; V498-I506 HydrophobicContact CG1-CD1 3.9Å; V498-I506 HydrophobicContact CG2-CD1 4.41Å; A503-I506 PolarHBondContact O-N 2.8Å; I506-I511 HydrophobicContact CG2-CD1 3.73Å; I506-I511 HydrophobicContact CG2-CG1 3.95Å
507	K	94.1	Very high	91.4	Very high	102 Å²	102	49 Å²	49	44%	0.443	25%	0.253	S	S	.	.	B	Isolated β-bridge	trans	-90.1	145.9	174.3	-60.6	-172.2	-179.1	-175.4	0	112.2	V509 T510 I511	K507-V509 VanDerWaalsContact C-N 3.3Å; K507-V509 HydrophobicContact CB-CG1 3.94Å; K507-V509 HydrophobicContact CD-CG1 4.5Å; K507-V509 PolarHBondContact O-N 2.55Å; K507-T510 WeakPolarHBondContact O-CB 3.29Å; K507-T510 PolarHBondContact O-N 2.63Å; K507-I511 PolarHBondContact O-N 2.93Å
508	L	94.2	Very high	91.3	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-61	-36.9	178.5	-64.6	175	0	0	0	112.4	V309 I311 V337 R341 L343 V346 T510 I511 Y512	V309-L508 HydrophobicContact CG2-CB 4.33Å; V309-L508 HydrophobicContact CG2-CD1 4.36Å; I311-L508 HydrophobicContact CD1-CD1 3.88Å; I311-L508 HydrophobicContact CD1-CD2 3.73Å; I311-L508 HydrophobicContact CD1-CG 4.47Å; V337-L508 HydrophobicContact CB-CD1 4.01Å; V337-L508 HydrophobicContact CG1-CD1 3.54Å; R341-L508 HydrophobicContact CB-CD1 4.23Å; R341-L508 PolarHBondContact O-N 3.29Å; L343-L508 HydrophobicContact CB-CD2 4.49Å; L343-L508 HydrophobicContact CD1-CD2 4.09Å; V346-L508 HydrophobicContact CG2-CD1 4.24Å; L508-T510 PolarHBondContact O-N 2.85Å; L508-I511 PolarHBondContact O-N 3.38Å; L508-Y512 WeakPolarHBondContact O-CB 3.45Å; L508-Y512 PolarHBondContact O-N 3.02Å
509	V	92.6	Very high	91	Very high	26 Å²	26	57.5 Å²	57.5	16%	0.158	30%	0.299	C	S	.	.	H	α-helix	trans	-56.1	-35.8	173.5	68.1	0	0	0	0	113.2	L305 I339 K507 L513	L305-V509 HydrophobicContact CD1-CG2 3.95Å; L305-V509 HydrophobicContact CD2-CG2 4.15Å; I339-V509 HydrophobicContact CD1-CB 4.33Å; I339-V509 HydrophobicContact CD1-CG2 4.12Å; I339-V509 HydrophobicContact CG1-CB 3.86Å; I339-V509 HydrophobicContact CG1-CG2 4.19Å; I339-V509 WeakPolarHBondContact O-CB 3.47Å; I339-V509 PolarHBondContact O-N 3.33Å; K507-V509 VanDerWaalsContact C-N 3.3Å; K507-V509 HydrophobicContact CB-CG1 3.94Å; K507-V509 HydrophobicContact CD-CG1 4.5Å; K507-V509 PolarHBondContact O-N 2.55Å; V509-L513 HydrophobicContact CG2-CD1 4.07Å; V509-L513 WeakPolarHBondContact O-CB 3.27Å; V509-L513 VanDerWaalsContact O-CG 3.31Å; V509-L513 WeakPolarHBondContact O-CG 3.5Å; V509-L513 PolarHBondContact O-N 3.39Å
510	T	91.5	Very high	90.9	Very high	44 Å²	44	63 Å²	63	27%	0.27	32%	0.317	S	S	.	.	H	α-helix	trans	-68.6	-45	178.6	-50.3	0	0	0	0	110.4	L487 L490 K507 L508 A514	L487-T510 HydrophobicContact CD1-CG2 4.16Å; L487-T510 HydrophobicContact CD2-CG2 4.14Å; L490-T510 HydrophobicContact CD2-CG2 3.75Å; K507-T510 WeakPolarHBondContact O-CB 3.29Å; K507-T510 PolarHBondContact O-N 2.63Å; L508-T510 PolarHBondContact O-N 2.85Å; T510-A514 WeakPolarHBondContact O-CB 3.47Å; T510-A514 PolarHBondContact O-N 3.17Å
511	I	92.3	Very high	90.9	Very high	0 Å²	0	59.5 Å²	59.5	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-66.3	-43.7	177.3	-53.9	179.2	0	0	0	110.7	L343 L382 L494 I506 K507 L508 L513 A514 L515 I521 F523	L343-I511 HydrophobicContact CD2-CD1 4Å; L382-I511 HydrophobicContact CD2-CG2 4.46Å; L494-I511 HydrophobicContact CD1-CD1 3.98Å; L494-I511 HydrophobicContact CD1-CG1 4.01Å; L494-I511 HydrophobicContact CD2-CD1 4.35Å; I506-I511 HydrophobicContact CG2-CD1 3.73Å; I506-I511 HydrophobicContact CG2-CG1 3.95Å; K507-I511 PolarHBondContact O-N 2.93Å; L508-I511 PolarHBondContact O-N 3.38Å; I511-L513 PolarHBondContact O-N 3.44Å; I511-A514 PolarHBondContact O-N 2.77Å; I511-L515 HydrophobicContact CG2-CD1 3.77Å; I511-L515 HydrophobicContact CG2-CG 4.2Å; I511-L515 WeakPolarHBondContact O-CB 3.42Å; I511-L515 WeakPolarHBondContact O-CG 3.23Å; I511-L515 PolarHBondContact O-N 3.17Å; I511-I521 HydrophobicContact CB-CD1 4.37Å; I511-I521 HydrophobicContact CG2-CD1 4.17Å; I511-I521 HydrophobicContact CG2-CG2 4Å; I511-F523 HydrophobicContact CD1-CE1 4.24Å; I511-F523 HydrophobicContact CD1-CZ 3.83Å
512	Y	92	Very high	91.1	Very high	29 Å²	29	59 Å²	59	11%	0.114	30%	0.298	C	S	.	.	H	α-helix	trans	-58.1	-46.3	178.5	-177.6	-100.6	0	0	0	112	F303 L305 P306 V309 I339 L508 C517 P518 I521	F303-Y512 HydrophobicContact CZ-CE1 4.39Å; L305-Y512 HydrophobicContact CD2-CD1 4.37Å; L305-Y512 HydrophobicContact CD2-CE1 4.48Å; P306-Y512 HydrophobicContact CG-CE1 4.03Å; P306-Y512 HydrophobicContact CG-CE2 4.38Å; V309-Y512 HydrophobicContact CB-CD2 4.39Å; V309-Y512 HydrophobicContact CG1-CD2 3.45Å; V309-Y512 VanDerWaalsContact CG1-CD2 3.45Å; V309-Y512 HydrophobicContact CG1-CE2 3.81Å; V309-Y512 HydrophobicContact CG1-CG 3.93Å; I339-Y512 HydrophobicContact CD1-CD1 3.7Å; I339-Y512 HydrophobicContact CD1-CE1 4.22Å; I339-Y512 HydrophobicContact CD1-CG 3.98Å; L508-Y512 WeakPolarHBondContact O-CB 3.45Å; L508-Y512 PolarHBondContact O-N 3.02Å; Y512-C517 HydrophobicContact CD1-CB 4.27Å; Y512-C517 HydrophobicContact CE1-CB 3.55Å; Y512-C517 HydrophobicContact CE2-CB 4.4Å; Y512-C517 WeakPolarHBondContact O-CA 3.43Å; Y512-C517 PolarHBondContact O-N 2.95Å; Y512-P518 VanDerWaalsContact CE2-O 3.25Å; Y512-P518 WeakPolarHBondContact CE2-O 3.37Å; Y512-I521 HydrophobicContact CD2-CD1 4.49Å
513	L	89.7	Confident	91.3	Very high	55 Å²	55	54.6 Å²	54.6	29%	0.288	28%	0.276	S	S	.	.	H	α-helix	trans	-68.3	-39.6	175.6	-71.8	171.4	0	0	0	112.2	F303 L305 I392 V509 I511 L515 G516	F303-L513 HydrophobicContact CE1-CD2 4.25Å; L305-L513 HydrophobicContact CD2-CD2 4.03Å; L305-L513 HydrophobicContact CD2-CG 4.34Å; I392-L513 HydrophobicContact CD1-CB 3.79Å; V509-L513 HydrophobicContact CG2-CD1 4.07Å; V509-L513 WeakPolarHBondContact O-CB 3.27Å; V509-L513 VanDerWaalsContact O-CG 3.31Å; V509-L513 WeakPolarHBondContact O-CG 3.5Å; V509-L513 PolarHBondContact O-N 3.39Å; I511-L513 PolarHBondContact O-N 3.44Å; L513-L515 VanDerWaalsContact C-N 3.34Å; L513-L515 PolarHBondContact O-N 2.84Å; L513-G516 PolarHBondContact O-N 3.19Å; L513-G516 VanDerWaalsContact O-N 3.16Å
514	A	88.2	Confident	91.4	Very high	23 Å²	23	56.9 Å²	56.9	19%	0.19	29%	0.287	C	S	.	.	H	α-helix	trans	-64.5	-36.1	179.7	0	0	0	0	0	113.4	I388 I392 L487 T510 I511 G516	I388-A514 HydrophobicContact CD1-CB 3.73Å; I388-A514 HydrophobicContact CG1-CB 3.98Å; I388-A514 HydrophobicContact CG2-CB 3.84Å; I392-A514 HydrophobicContact CD1-CB 4.29Å; L487-A514 HydrophobicContact CD1-CB 3.63Å; T510-A514 WeakPolarHBondContact O-CB 3.47Å; T510-A514 PolarHBondContact O-N 3.17Å; I511-A514 PolarHBondContact O-N 2.77Å; A514-G516 PolarHBondContact O-N 3.22Å
515	L	88.3	Confident	91.5	Very high	31 Å²	31	50.3 Å²	50.3	16%	0.162	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.9	9.2	176.2	-64.2	178.8	0	0	0	113.6	L382 Q386 I388 I511 L513 P518 I521	L382-L515 HydrophobicContact CD1-CD2 4.39Å; L382-L515 HydrophobicContact CD2-CD1 4.04Å; Q386-L515 HydrophobicContact CB-CD1 4.31Å; Q386-L515 HydrophobicContact CB-CD2 3.81Å; I388-L515 HydrophobicContact CD1-CD2 4.17Å; I388-L515 HydrophobicContact CD1-CG 4.44Å; I388-L515 HydrophobicContact CG1-CD2 3.72Å; I388-L515 HydrophobicContact CG1-CG 4.41Å; I511-L515 HydrophobicContact CG2-CD1 3.77Å; I511-L515 HydrophobicContact CG2-CG 4.2Å; I511-L515 WeakPolarHBondContact O-CB 3.42Å; I511-L515 WeakPolarHBondContact O-CG 3.23Å; I511-L515 PolarHBondContact O-N 3.17Å; L513-L515 VanDerWaalsContact C-N 3.34Å; L513-L515 PolarHBondContact O-N 2.84Å; L515-P518 HydrophobicContact CB-CG 3.87Å; L515-P518 HydrophobicContact CD1-CG 4.48Å; L515-I521 HydrophobicContact CD1-CG1 4.46Å; L515-I521 HydrophobicContact CD1-CG2 4.01Å
516	G	85.5	Confident	91.7	Very high	62 Å²	62	43.3 Å²	43.3	64%	0.639	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	76.4	28.9	176.6	0	0	0	0	0	114.9	L513 A514	L513-G516 PolarHBondContact O-N 3.19Å; L513-G516 VanDerWaalsContact O-N 3.16Å; A514-G516 PolarHBondContact O-N 3.22Å
517	C	87	Confident	91.6	Very high	39 Å²	39	44.4 Å²	44.4	26%	0.264	23%	0.234	S	C	.	.	S	Bend	trans	62.6	54.9	179.6	-53.2	0	0	0	0	114.8	F303 Y512	F303-C517 HydrophobicContact CZ-CB 4.42Å; F303-C517 VanDerWaalsContact CZ-SG 3.51Å; Y512-C517 HydrophobicContact CD1-CB 4.27Å; Y512-C517 HydrophobicContact CE1-CB 3.55Å; Y512-C517 HydrophobicContact CE2-CB 4.4Å; Y512-C517 WeakPolarHBondContact O-CA 3.43Å; Y512-C517 PolarHBondContact O-N 2.95Å
518	P	89.7	Confident	91.2	Very high	30 Å²	30	42.1 Å²	42.1	20%	0.195	22%	0.224	C	C	.	.			trans	-72.4	153.2	-177	33.3	-37.2	0	0	0	112.5	Y512 L515 R520 I521	Y512-P518 VanDerWaalsContact CE2-O 3.25Å; Y512-P518 WeakPolarHBondContact CE2-O 3.37Å; L515-P518 HydrophobicContact CB-CG 3.87Å; L515-P518 HydrophobicContact CD1-CG 4.48Å; P518-R520 PolarHBondContact O-N 2.99Å; P518-I521 HydrophobicContact CG-CG1 4.32Å
519	D	87.1	Confident	90.4	Very high	152 Å²	152	45.1 Å²	45.1	81%	0.813	25%	0.245	S	C	*	.	S	Bend	trans	-55.7	-28.3	175.7	-60.5	-42.2	0	0	0	113.5
520	R	91.1	Very high	89	Confident	132 Å²	132	47.5 Å²	47.5	50%	0.498	26%	0.259	S	S	.	.			trans	-153.4	139.5	178	53.1	-176.2	153.6	-162.6	-14.8	111.5	W310 E312 P518	W310-R520 HydrophobicContact CB-CB 3.99Å; W310-R520 CarbonylContact O-C 3.56Å; W310-R520 VanDerWaalsContact O-CA 3.32Å; W310-R520 WeakPolarHBondContact O-CA 3.26Å; E312-R520 IonicContact OE2-NH1 2.59Å; P518-R520 PolarHBondContact O-N 2.99Å
521	I	94.5	Very high	87.3	Confident	1 Å²	1	51 Å²	51	1%	0.005	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	136.5	170.5	-55.2	173.8	0	0	0	107.5	V309 W310 I311 E312 L382 I511 Y512 L515 P518 F523	V309-I521 HydrophobicContact CG2-CD1 4.46Å; W310-I521 PolarHBondContact O-N 3.22Å; I311-I521 CarbonylContact C-O 3.59Å; I311-I521 WeakPolarHBondContact CA-O 3.26Å; E312-I521 PolarHBondContact N-O 2.97Å; L382-I521 HydrophobicContact CD2-CG2 4.15Å; I511-I521 HydrophobicContact CB-CD1 4.37Å; I511-I521 HydrophobicContact CG2-CD1 4.17Å; I511-I521 HydrophobicContact CG2-CG2 4Å; Y512-I521 HydrophobicContact CD2-CD1 4.49Å; L515-I521 HydrophobicContact CD1-CG1 4.46Å; L515-I521 HydrophobicContact CD1-CG2 4.01Å; P518-I521 HydrophobicContact CG-CG1 4.32Å; I521-F523 HydrophobicContact CB-CE2 4.49Å; I521-F523 HydrophobicContact CG2-CD2 4.3Å; I521-F523 HydrophobicContact CG2-CE1 4.27Å; I521-F523 HydrophobicContact CG2-CE2 3.6Å; I521-F523 HydrophobicContact CG2-CZ 3.57Å
522	R	94.7	Very high	85.1	Confident	90 Å²	90	58.9 Å²	58.9	34%	0.34	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	117.2	-178.1	-175.4	177.2	173.5	-165.3	-6.6	111.4	E312 Q386	E312-R522 HydrophobicContact CB-CG 4.39Å; E312-R522 WeakPolarHBondContact O-CA 3.33Å; Q386-R522 PolarHBondContact OE1-O 2.93Å
523	F	95.7	Very high	82.3	Confident	0 Å²	0	67.7 Å²	67.7	0%	0	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	141.8	172.8	-57.2	-78.5	0	0	0	111.3	I311 E312 L313 V314 L343 L380 N381 L382 I511 I521	I311-F523 HydrophobicContact CG2-CD2 3.73Å; I311-F523 HydrophobicContact CG2-CE2 3.98Å; E312-F523 PolarHBondContact O-N 3.12Å; L313-F523 WeakPolarHBondContact CA-O 3.49Å; L313-F523 HydrophobicContact CD2-CB 3.87Å; L313-F523 HydrophobicContact CD2-CD2 3.96Å; L313-F523 HydrophobicContact CD2-CG 4.39Å; V314-F523 PolarHBondContact N-O 3.2Å; L343-F523 HydrophobicContact CD1-CD2 4.49Å; L343-F523 HydrophobicContact CD1-CE1 4.34Å; L343-F523 HydrophobicContact CD1-CE2 3.8Å; L343-F523 HydrophobicContact CD1-CZ 3.71Å; L343-F523 HydrophobicContact CD2-CE1 4.27Å; L343-F523 HydrophobicContact CD2-CZ 4.28Å; L380-F523 HydrophobicContact CB-CB 4.28Å; L380-F523 HydrophobicContact CB-CD1 4.32Å; L380-F523 HydrophobicContact CB-CG 4.36Å; L380-F523 HydrophobicContact CD1-CD2 4.49Å; L380-F523 HydrophobicContact CD1-CG 4.44Å; L380-F523 HydrophobicContact CD2-CB 4.29Å; N381-F523 CarbonylContact O-C 3.58Å; N381-F523 WeakPolarHBondContact O-CA 3.48Å; N381-F523 WeakPolarHBondContact O-CB 3.32Å; L382-F523 HydrophobicContact CD2-CD1 3.84Å; L382-F523 HydrophobicContact CD2-CE1 3.58Å; L382-F523 HydrophobicContact CD2-CZ 4.33Å; L382-F523 HydrophobicContact CG-CD1 4.23Å; L382-F523 HydrophobicContact CG-CE1 3.99Å; I511-F523 HydrophobicContact CD1-CE1 4.24Å; I511-F523 HydrophobicContact CD1-CZ 3.83Å; I521-F523 HydrophobicContact CB-CE2 4.49Å; I521-F523 HydrophobicContact CG2-CD2 4.3Å; I521-F523 HydrophobicContact CG2-CE1 4.27Å; I521-F523 HydrophobicContact CG2-CE2 3.6Å; I521-F523 HydrophobicContact CG2-CZ 3.57Å
524	E	94.7	Very high	79.6	Confident	47 Å²	47	68.5 Å²	68.5	22%	0.22	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	134.5	160.2	-72.4	166.3	-155.4	0	0	107.9	V314 R316 N381 C383	V314-E524 CarbonylContact O-C 3.54Å; V314-E524 VanDerWaalsContact O-CA 3.23Å; V314-E524 WeakPolarHBondContact O-CA 3.23Å; R316-E524 HydrophobicContact CB-CB 4.21Å; R316-E524 HydrophobicContact CG-CB 4.32Å; N381-E524 HydrophobicContact CB-CB 4.42Å; N381-E524 PolarHBondContact N-O 2.72Å; N381-E524 PolarHBondContact O-N 3.41Å; C383-E524 WeakPolarHBondContact CA-OE1 3.44Å; C383-E524 HydrophobicContact CB-CG 4.41Å; C383-E524 WeakPolarHBondContact CB-OE1 3.26Å; C383-E524 PolarHBondContact SG-OE1 3.09Å
525	Y	95.3	Very high	77	Confident	0 Å²	0	73.1 Å²	73.1	0%	0	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	146.3	177.9	70.2	-98.3	0	0	0	111.8	L313 V314 P315 R316 D320 V324 P331 W354 M379 F527	L313-Y525 HydrophobicContact CB-CD1 4.17Å; V314-Y525 WeakPolarHBondContact O-CD1 3.25Å; V314-Y525 PolarHBondContact O-N 2.9Å; P315-Y525 HydrophobicContact CB-CE1 4.08Å; P315-Y525 HydrophobicContact CB-CE2 4.11Å; R316-Y525 WeakPolarHBondContact CB-O 3.39Å; R316-Y525 PolarHBondContact N-O 2.81Å; D320-Y525 HydrophobicContact CB-CD2 4.13Å; D320-Y525 HydrophobicContact CB-CE2 3.77Å; V324-Y525 HydrophobicContact CG2-CE2 3.84Å; V324-Y525 WeakPolarHBondContact CG2-OH 3.47Å; P331-Y525 WeakPolarHBondContact CA-OH 3.08Å; P331-Y525 WeakPolarHBondContact CB-OH 3.41Å; P331-Y525 VanDerWaalsContact O-CE1 3.26Å; P331-Y525 WeakPolarHBondContact O-CE1 3.15Å; P331-Y525 PolarHBondContact O-OH 3.04Å; W354-Y525 HydrophobicContact CE3-CD2 4.4Å; W354-Y525 HydrophobicContact CE3-CE2 4.22Å; W354-Y525 AromaticContact CH2-CD1 3.54Å; W354-Y525 HydrophobicContact CH2-CD1 3.54Å; W354-Y525 HydrophobicContact CH2-CD2 4.13Å; W354-Y525 AromaticContact CH2-CE1 3.28Å; W354-Y525 HydrophobicContact CH2-CE1 3.28Å; W354-Y525 AromaticContact CH2-CE2 3.92Å; W354-Y525 HydrophobicContact CH2-CE2 3.92Å; W354-Y525 AromaticContact CH2-CG 3.96Å; W354-Y525 HydrophobicContact CH2-CG 3.96Å; W354-Y525 AromaticContact CH2-CZ 3.51Å; W354-Y525 HydrophobicContact CZ2-CE1 4.24Å; W354-Y525 AromaticContact CZ3-CD1 3.75Å; W354-Y525 HydrophobicContact CZ3-CD1 3.75Å; W354-Y525 AromaticContact CZ3-CD2 3.5Å; W354-Y525 HydrophobicContact CZ3-CD2 3.5Å; W354-Y525 AromaticContact CZ3-CE1 3.72Å; W354-Y525 HydrophobicContact CZ3-CE1 3.72Å; W354-Y525 AromaticContact CZ3-CE2 3.48Å; W354-Y525 HydrophobicContact CZ3-CE2 3.48Å; W354-Y525 VanDerWaalsContact CZ3-CE2 3.48Å; W354-Y525 AromaticContact CZ3-CG 3.64Å; W354-Y525 HydrophobicContact CZ3-CG 3.64Å; W354-Y525 AromaticContact CZ3-CZ 3.6Å; M379-Y525 WeakPolarHBondContact O-CA 3.33Å; Y525-F527 HydrophobicContact CD2-CE2 4.3Å; Y525-F527 AromaticContact CE2-CE2 3.99Å; Y525-F527 HydrophobicContact CE2-CE2 3.99Å
526	Q	93.7	Very high	74.2	Confident	37 Å²	37	81.2 Å²	81.2	17%	0.173	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	149.3	167.6	57.8	166.7	83.5	0	0	111.7	R316 D320 M379	R316-Q526 HydrophobicContact CB-CB 4.24Å; D320-Q526 VanDerWaalsContact OD1-CA 3.27Å; D320-Q526 WeakPolarHBondContact OD1-CA 3.46Å; M379-Q526 HydrophobicContact CB-CG 4.12Å; M379-Q526 HydrophobicContact CE-CG 4.04Å; M379-Q526 PolarHBondContact N-O 2.77Å; M379-Q526 PolarHBondContact O-N 2.96Å
527	F	91.5	Very high	71.6	Confident	33 Å²	33	87.7 Å²	87.7	15%	0.145	45%	0.452	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	146.1	170.5	-64.8	-85.2	0	0	0	110.9	D320 R323 V324 W354 P376 S377 V378 Y525	D320-F527 HydrophobicContact CB-CD2 4.16Å; D320-F527 HydrophobicContact CB-CE2 4.45Å; D320-F527 PolarHBondContact OD1-N 3.43Å; R323-F527 HydrophobicContact CB-CD2 4.3Å; R323-F527 HydrophobicContact CB-CE2 3.99Å; R323-F527 HydrophobicContact CG-CE2 4.31Å; R323-F527 HydrophobicContact CG-CZ 4.47Å; V324-F527 HydrophobicContact CG2-CE2 3.81Å; V324-F527 HydrophobicContact CG2-CZ 3.79Å; W354-F527 HydrophobicContact CB-CZ 4.33Å; W354-F527 HydrophobicContact CE3-CE1 4.49Å; W354-F527 AromaticContact CE3-CZ 3.79Å; W354-F527 HydrophobicContact CE3-CZ 3.79Å; P376-F527 HydrophobicContact CB-CD1 4.1Å; S377-F527 WeakPolarHBondContact O-CA 3.21Å; V378-F527 HydrophobicContact CG2-CD1 3.82Å; V378-F527 HydrophobicContact CG2-CE1 3.61Å; V378-F527 HydrophobicContact CG2-CZ 4.42Å; Y525-F527 HydrophobicContact CD2-CE2 4.3Å; Y525-F527 AromaticContact CE2-CE2 3.99Å; Y525-F527 HydrophobicContact CE2-CE2 3.99Å
528	F	85.7	Confident	68.8	Low	54 Å²	54	95.5 Å²	95.5	24%	0.237	48%	0.484	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	160.9	171.5	72.6	-77.4	0	0	0	111.4	S377 M379 T499 T530	S377-F528 PolarHBondContact N-O 3.04Å; S377-F528 WeakPolarHBondContact O-CD1 3.44Å; S377-F528 WeakPolarHBondContact O-CE1 3.32Å; S377-F528 PolarHBondContact O-N 2.81Å; M379-F528 HydrophobicContact CB-CD1 3.85Å; M379-F528 HydrophobicContact CB-CE1 3.86Å; T499-F528 HydrophobicContact CG2-CE1 3.7Å; T499-F528 HydrophobicContact CG2-CE2 4.16Å; T499-F528 HydrophobicContact CG2-CZ 3.29Å; F528-T530 HydrophobicContact CD2-CG2 4.45Å; F528-T530 HydrophobicContact CE2-CG2 3.67Å; F528-T530 HydrophobicContact CZ-CG2 4.36Å
529	C	77	Confident	65.9	Low	63 Å²	63	98.7 Å²	98.7	43%	0.426	51%	0.507	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	120.6	-179.7	-69.9	0	0	0	0	110.1	P374 K531	P374-C529 HydrophobicContact CB-CB 4.28Å; P374-C529 HydrophobicContact CG-CB 3.61Å; C529-K531 PolarHBondContact O-N 3.23Å; C529-K531 VanDerWaalsContact O-N 3.11Å
530	T	64.1	Low	63	Low	76 Å²	76	97.7 Å²	97.7	47%	0.466	51%	0.512	S	S	.	.			trans	-74.5	94.1	172.2	40.9	0	0	0	0	110.4	P374 F528	P374-T530 WeakPolarHBondContact CB-O 3.4Å; F528-T530 HydrophobicContact CD2-CG2 4.45Å; F528-T530 HydrophobicContact CE2-CG2 3.67Å; F528-T530 HydrophobicContact CZ-CG2 4.36Å
531	K	55.6	Low	60.1	Low	118 Å²	118	95.6 Å²	95.6	51%	0.513	52%	0.518	S	S	.	.			trans	-85.8	139.8	163.9	-73.5	-170.3	177.6	179.5	0	110.3	C529 Y543	C529-K531 PolarHBondContact O-N 3.23Å; C529-K531 VanDerWaalsContact O-N 3.11Å; K531-Y543 HydrophobicContact CD-CE1 4.43Å; K531-Y543 WeakPolarHBondContact CD-OH 3.27Å; K531-Y543 PolarHBondContact NZ-OH 2.97Å
532	D	45.3	Very low	56.9	Low	164 Å²	164	99.2 Å²	99.2	88%	0.877	54%	0.543	S	S	*	.			trans	-67	154.4	-174	-107.5	-48.7	0	0	0	113.8	G534	D532-G534 VanDerWaalsContact C-N 3.31Å; D532-G534 PolarHBondContact O-N 3.11Å
533	K	34.5	Very low	53.8	Low	215 Å²	215	103.5 Å²	103.5	94%	0.935	56%	0.561	S	S	*	*	S	Bend	trans	-76.6	75	-171.6	-69.6	-176.7	177.2	178	0	112.3
534	G	31.6	Very low	50.7	Low	72 Å²	72	107.4 Å²	107.4	74%	0.742	59%	0.588	S	S	*	*			trans	-102.6	-24.5	-173.3	0	0	0	0	0	117.7	D532	D532-G534 VanDerWaalsContact C-N 3.31Å; D532-G534 PolarHBondContact O-N 3.11Å
535	S	33.3	Very low	47.7	Very low	119 Å²	119	109.1 Å²	109.1	83%	0.832	60%	0.599	S	S	*	*			trans	-165.7	134.7	177.5	53.1	0	0	0	0	113.7
536	Q	29.7	Very low	44.9	Very low	202 Å²	202	116 Å²	116	94%	0.944	64%	0.635	S	S	*	*			trans	-91.2	112.4	160.7	-92.2	-163.7	-12.4	0	0	109.9
537	K	30.9	Very low	42.1	Very low	198 Å²	198	119.6 Å²	119.6	86%	0.861	65%	0.654	S	S	*	*			trans	-143.5	136.6	151.1	-120.2	178	-179	179.8	0	108.5	S539	K537-S539 PolarHBondContact O-N 3.49Å
538	Q	28.3	Very low	39.3	Very low	202 Å²	202	125.6 Å²	125.6	94%	0.944	69%	0.686	S	S	*	*			trans	-77.8	119.8	179.8	-68.6	170.8	-20.2	0	0	109.3
539	S	30	Very low	36.6	Very low	97 Å²	97	128.4 Å²	128.4	68%	0.678	71%	0.711	S	S	*	*			trans	-148.2	118.6	169	56.5	0	0	0	0	109.9	K537 S541	K537-S539 PolarHBondContact O-N 3.49Å; S539-S541 PolarHBondContact O-N 3.33Å
540	S	26.4	Very low	34.4	Very low	132 Å²	132	127.8 Å²	127.8	92%	0.923	71%	0.707	S	S	*	*			trans	-81.9	98.3	178.9	51.4	0	0	0	0	110.9
541	S	28.8	Very low	32.8	Very low	88 Å²	88	129.9 Å²	129.9	62%	0.615	72%	0.722	S	S	*	*			trans	-151.8	138.2	175.1	57.2	0	0	0	0	112.9	S539	S539-S541 PolarHBondContact O-N 3.33Å
542	S	27.5	Very low	31.7	Very low	77 Å²	77	132.1 Å²	132.1	54%	0.538	74%	0.738	S	S	.	*			trans	-20.8	134	171.8	-174.5	0	0	0	0	117.2	S544 D545	S542-S544 WeakPolarHBondContact OG-CB 3.43Å; S542-S544 PolarHBondContact OG-N 3.04Å; S542-S544 PolarHBondContact OG-OG 2.9Å; S542-D545 PolarHBondContact OG-OD1 3.23Å
543	Y	30.9	Very low	31.3	Very low	179 Å²	179	129 Å²	129	70%	0.702	72%	0.722	S	S	*	*			trans	-112.3	70.6	158.6	-102	-93.3	0	0	0	109.3	K531	K531-Y543 HydrophobicContact CD-CE1 4.43Å; K531-Y543 WeakPolarHBondContact CD-OH 3.27Å; K531-Y543 PolarHBondContact NZ-OH 2.97Å
544	S	30	Very low	31.9	Very low	82 Å²	82	124.7 Å²	124.7	57%	0.573	72%	0.715	S	S	*	*			trans	-122.5	-3.8	-179.6	-44.8	0	0	0	0	114.1	S542	S542-S544 WeakPolarHBondContact OG-CB 3.43Å; S542-S544 PolarHBondContact OG-N 3.04Å; S542-S544 PolarHBondContact OG-OG 2.9Å
545	D	32	Very low	32.4	Very low	84 Å²	84	127.7 Å²	127.7	45%	0.449	72%	0.715	S	S	.	*	S	Bend	trans	-113.6	9.7	-151.4	-59.8	27.4	0	0	0	114.6	S542 P550	S542-D545 PolarHBondContact OG-OD1 3.23Å; D545-P550 HydrophobicContact CB-CB 4.44Å; D545-P550 HydrophobicContact CB-CG 4.29Å
546	L	36.7	Very low	32.5	Very low	144 Å²	144	124.2 Å²	124.2	75%	0.754	70%	0.698	S	S	*	*	S	Bend	trans	-128	1.6	-174.9	-73	175.2	0	0	0	115.8
547	L	35.3	Very low	33.2	Very low	112 Å²	112	119.7 Å²	119.7	59%	0.586	68%	0.68	S	S	*	*	S	Bend	trans	-142.9	119.9	160.4	-73.1	177.7	0	0	0	106.4
548	I	32	Very low	33.4	Very low	159 Å²	159	111.8 Å²	111.8	82%	0.815	65%	0.654	S	S	*	*	S	Bend	trans	71.1	137	-155.5	-49.5	170.8	0	0	0	111.1
549	C	28.8	Very low	34.1	Very low	113 Å²	113	109 Å²	109	76%	0.764	65%	0.645	S	S	*	*			trans	-68.6	141.6	179.3	-55.7	0	0	0	0	111.1
550	P	30	Very low	34.8	Very low	50 Å²	50	108.4 Å²	108.4	33%	0.325	64%	0.641	S	S	.	*			trans	-61.6	150.1	164.5	27.2	-32.3	0	0	0	110	D545 L552	D545-P550 HydrophobicContact CB-CB 4.44Å; D545-P550 HydrophobicContact CB-CG 4.29Å; P550-L552 VanDerWaalsContact C-N 3.34Å; P550-L552 PolarHBondContact O-N 3.06Å
551	P	31.7	Very low	35.6	Very low	121 Å²	121	104.3 Å²	104.3	79%	0.786	61%	0.608	S	S	*	*			trans	-70.4	90	177.3	29.4	-33.9	0	0	0	110.3	D553	P551-D553 PolarHBondContact O-N 3.24Å
552	L	32.6	Very low	36.8	Very low	165 Å²	165	101.4 Å²	101.4	86%	0.864	59%	0.592	S	S	*	*			trans	-74.1	53.9	166.5	-88.2	161.6	0	0	0	111	P550	P550-L552 VanDerWaalsContact C-N 3.34Å; P550-L552 PolarHBondContact O-N 3.06Å
553	D	36.6	Very low	38.1	Very low	99 Å²	99	102.4 Å²	102.4	53%	0.529	59%	0.591	S	S	.	*			trans	-156.1	123.4	163.5	-110.1	-37.2	0	0	0	109.2	P551 D555	P551-D553 PolarHBondContact O-N 3.24Å; D553-D555 PolarHBondContact O-N 3.46Å
554	P	46.5	Very low	39.1	Very low	123 Å²	123	100.9 Å²	100.9	80%	0.799	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.2	-18.2	172.3	30.2	-33.6	0	0	0	112.3
555	D	42.1	Very low	40.4	Very low	136 Å²	136	103.8 Å²	103.8	73%	0.727	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.5	22.2	-171	-62.4	-53.1	0	0	0	114.5	D553 D557	D553-D555 PolarHBondContact O-N 3.46Å; D555-D557 VanDerWaalsContact C-N 3.34Å; D555-D557 PolarHBondContact O-N 3.03Å
556	G	35.9	Very low	41.6	Very low	46 Å²	46	103.2 Å²	103.2	47%	0.474	58%	0.579	S	S	.	*	S	Bend	trans	73.4	-7.7	152	0	0	0	0	0	120.2	G558 N561	G556-G558 VanDerWaalsContact C-N 3.3Å; G556-G558 PolarHBondContact O-N 3.31Å; G556-N561 PolarHBondContact O-ND2 2.99Å
557	D	44.9	Very low	42.9	Very low	106 Å²	106	102.9 Å²	102.9	57%	0.567	58%	0.577	S	S	*	*			trans	-85.9	13.9	-175	-104.8	-39.2	0	0	0	115.3	D555 R565	D555-D557 VanDerWaalsContact C-N 3.34Å; D555-D557 PolarHBondContact O-N 3.03Å; D557-R565 IonicContact OD1-CZ 2.67Å; D557-R565 IonicContact OD1-NH1 3.9Å; D557-R565 PolarHBondContact OD1-NH1 2.67Å; D557-R565 IonicContact OD1-NH2 3.15Å; D557-R565 PolarHBondContact OD1-NH2 3.2Å
558	G	35.6	Very low	44.1	Very low	32 Å²	32	105.2 Å²	105.2	33%	0.33	59%	0.585	S	S	.	*			trans	-59.7	162.6	-177.1	0	0	0	0	0	116.2	G556 S560 N561	G556-G558 VanDerWaalsContact C-N 3.3Å; G556-G558 PolarHBondContact O-N 3.31Å; G558-S560 PolarHBondContact O-N 3.2Å; G558-N561 PolarHBondContact O-N 3.24Å
559	I	41.8	Very low	45.4	Very low	145 Å²	145	100.3 Å²	100.3	74%	0.744	56%	0.56	S	S	*	*	H	α-helix	trans	-48.8	-28.9	-169.2	-64.3	166.3	0	0	0	114.8	N561 G562 L563	I559-N561 VanDerWaalsContact C-N 3.34Å; I559-N561 PolarHBondContact O-N 3.26Å; I559-G562 CarbonylContact O-C 3.58Å; I559-G562 WeakPolarHBondContact O-CA 3.14Å; I559-G562 PolarHBondContact O-N 3.46Å; I559-G562 VanDerWaalsContact O-N 3.08Å; I559-L563 HydrophobicContact CG2-CD1 4.25Å; I559-L563 HydrophobicContact CG2-CG 4.42Å; I559-L563 PolarHBondContact O-N 2.8Å
560	S	44.2	Very low	46.8	Very low	84 Å²	84	99.8 Å²	99.8	59%	0.587	55%	0.55	S	S	*	.	H	α-helix	trans	-63.4	-35.6	175.1	56.5	0	0	0	0	113.3	G558 R564	G558-S560 PolarHBondContact O-N 3.2Å; S560-R564 VanDerWaalsContact O-CB 3.25Å; S560-R564 WeakPolarHBondContact O-CB 3.35Å; S560-R564 PolarHBondContact O-N 2.88Å
561	N	45	Very low	47.7	Very low	46 Å²	46	100.9 Å²	100.9	25%	0.246	56%	0.562	C	S	.	*	H	α-helix	trans	-73.6	-30.7	169.8	-86.4	-26.4	0	0	0	111.8	G556 G558 I559 R564 R565	G556-N561 PolarHBondContact O-ND2 2.99Å; G558-N561 PolarHBondContact O-N 3.24Å; I559-N561 VanDerWaalsContact C-N 3.34Å; I559-N561 PolarHBondContact O-N 3.26Å; N561-R564 PolarHBondContact O-N 3.28Å; N561-R564 PolarHBondContact OD1-NH1 3.44Å; N561-R565 WeakPolarHBondContact O-CB 3.49Å; N561-R565 VanDerWaalsContact O-CG 3.27Å; N561-R565 WeakPolarHBondContact O-CG 3.03Å; N561-R565 PolarHBondContact O-N 3Å
562	G	53.3	Low	48.6	Very low	27 Å²	27	97.7 Å²	97.7	28%	0.278	54%	0.543	S	S	.	.	H	α-helix	trans	-59.7	-51.4	168.2	0	0	0	0	0	112.3	I559 R565 L566	I559-G562 CarbonylContact O-C 3.58Å; I559-G562 WeakPolarHBondContact O-CA 3.14Å; I559-G562 PolarHBondContact O-N 3.46Å; I559-G562 VanDerWaalsContact O-N 3.08Å; G562-R565 PolarHBondContact O-N 3.19Å; G562-L566 WeakPolarHBondContact O-CD1 3.45Å; G562-L566 PolarHBondContact O-N 3.16Å
563	L	55.3	Low	49.7	Very low	97 Å²	97	92.8 Å²	92.8	51%	0.508	52%	0.518	S	S	.	.	H	α-helix	trans	-64.4	-38.4	175.8	-74.6	169.9	0	0	0	112.5	I559 L566 L567	I559-L563 HydrophobicContact CG2-CD1 4.25Å; I559-L563 HydrophobicContact CG2-CG 4.42Å; I559-L563 PolarHBondContact O-N 2.8Å; L563-L566 HydrophobicContact CD2-CD2 4.48Å; L563-L566 WeakPolarHBondContact O-CB 3.32Å; L563-L566 PolarHBondContact O-N 3.2Å; L563-L567 WeakPolarHBondContact O-CB 3.29Å; L563-L567 WeakPolarHBondContact O-CG 3.34Å; L563-L567 PolarHBondContact O-N 3.49Å
564	R	51.2	Low	50.3	Low	147 Å²	147	93.7 Å²	93.7	56%	0.555	52%	0.515	S	S	*	.	H	α-helix	trans	-63.8	-40	173.6	-174.4	-179.9	-75.2	145.4	-11.5	111.7	S560 N561 H568	S560-R564 VanDerWaalsContact O-CB 3.25Å; S560-R564 WeakPolarHBondContact O-CB 3.35Å; S560-R564 PolarHBondContact O-N 2.88Å; N561-R564 PolarHBondContact O-N 3.28Å; N561-R564 PolarHBondContact OD1-NH1 3.44Å; R564-H568 PolarHBondContact O-CD2 2.9Å; R564-H568 PolarHBondContact O-N 3.36Å
565	R	57.5	Low	50.6	Low	144 Å²	144	92.7 Å²	92.7	54%	0.543	50%	0.502	S	S	.	.	H	α-helix	trans	-63.4	-48.4	170.5	-73.1	171	-176.7	149.2	5.5	110.1	D557 N561 G562 L567 H568 L569	D557-R565 IonicContact OD1-CZ 2.67Å; D557-R565 IonicContact OD1-NH1 3.9Å; D557-R565 PolarHBondContact OD1-NH1 2.67Å; D557-R565 IonicContact OD1-NH2 3.15Å; D557-R565 PolarHBondContact OD1-NH2 3.2Å; N561-R565 WeakPolarHBondContact O-CB 3.49Å; N561-R565 VanDerWaalsContact O-CG 3.27Å; N561-R565 WeakPolarHBondContact O-CG 3.03Å; N561-R565 PolarHBondContact O-N 3Å; G562-R565 PolarHBondContact O-N 3.19Å; R565-L567 VanDerWaalsContact C-N 3.31Å; R565-L567 PolarHBondContact O-N 3.05Å; R565-H568 CarbonylContact O-C 3.34Å; R565-H568 PolarHBondContact O-N 2.94Å; R565-L569 VanDerWaalsContact O-CG 3.29Å; R565-L569 WeakPolarHBondContact O-CG 3.25Å; R565-L569 PolarHBondContact O-N 3.3Å
566	L	57.5	Low	51.3	Low	71 Å²	71	92.1 Å²	92.1	37%	0.372	50%	0.499	S	S	.	.	H	α-helix	trans	-54.9	-39.5	176	-100.6	67.2	0	0	0	114.1	G562 L563 H568 L569 Y574	G562-L566 WeakPolarHBondContact O-CD1 3.45Å; G562-L566 PolarHBondContact O-N 3.16Å; L563-L566 HydrophobicContact CD2-CD2 4.48Å; L563-L566 WeakPolarHBondContact O-CB 3.32Å; L563-L566 PolarHBondContact O-N 3.2Å; L566-H568 VanDerWaalsContact C-N 3.28Å; L566-H568 PolarHBondContact O-N 2.87Å; L566-L569 HydrophobicContact CD1-CD1 4.49Å; L566-Y574 HydrophobicContact CD2-CE2 3.83Å; L566-Y574 HydrophobicContact CG-CD2 4.1Å; L566-Y574 HydrophobicContact CG-CE2 3.88Å
567	L	63.9	Low	52.1	Low	138 Å²	138	94 Å²	94	72%	0.723	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.1	-8.8	178.4	-70.4	167.5	0	0	0	113.9	L563 R565	L563-L567 WeakPolarHBondContact O-CB 3.29Å; L563-L567 WeakPolarHBondContact O-CG 3.34Å; L563-L567 PolarHBondContact O-N 3.49Å; R565-L567 VanDerWaalsContact C-N 3.31Å; R565-L567 PolarHBondContact O-N 3.05Å
568	H	60	Low	52.2	Low	161 Å²	161	96.3 Å²	96.3	75%	0.745	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.6	-10	176.2	-74.8	-56.8	0	0	0	114	R564 R565 L566	R564-H568 PolarHBondContact O-CD2 2.9Å; R564-H568 PolarHBondContact O-N 3.36Å; R565-H568 CarbonylContact O-C 3.34Å; R565-H568 PolarHBondContact O-N 2.94Å; L566-H568 VanDerWaalsContact C-N 3.28Å; L566-H568 PolarHBondContact O-N 2.87Å
569	L	60	Low	52.7	Low	55 Å²	55	98.6 Å²	98.6	29%	0.288	50%	0.5	S	S	.	.	S	Bend	trans	-70.2	137.3	171.2	-77.7	165.6	0	0	0	109.8	R565 L566 D573	R565-L569 VanDerWaalsContact O-CG 3.29Å; R565-L569 WeakPolarHBondContact O-CG 3.25Å; R565-L569 PolarHBondContact O-N 3.3Å; L566-L569 HydrophobicContact CD1-CD1 4.49Å; L569-D573 HydrophobicContact CB-CB 4.17Å; L569-D573 HydrophobicContact CD2-CB 3.49Å; L569-D573 VanDerWaalsContact CD2-CB 3.49Å; L569-D573 HydrophobicContact CG-CB 4.38Å
570	N	56.8	Low	52.6	Low	103 Å²	103	98.7 Å²	98.7	55%	0.551	49%	0.491	S	S	*	.			trans	-68.2	160.3	170.1	-169.2	12.4	0	0	0	109.5	S572 D573 Y574	N570-S572 PolarHBondContact ND2-OG 3.44Å; N570-S572 PolarHBondContact O-N 3.14Å; N570-S572 VanDerWaalsContact O-N 3.14Å; N570-D573 VanDerWaalsContact CB-OD2 3.23Å; N570-D573 WeakPolarHBondContact CB-OD2 3.42Å; N570-D573 PolarHBondContact N-OD2 2.61Å; N570-D573 PolarHBondContact O-N 3.46Å; N570-Y574 PolarHBondContact O-N 2.86Å
571	A	50.3	Low	52.8	Low	72 Å²	72	98.5 Å²	98.5	60%	0.595	49%	0.487	S	S	*	.	H	α-helix	trans	-58.7	-30.5	-179.2	0	0	0	0	0	112.8	D573 L575	A571-D573 VanDerWaalsContact C-N 3.35Å; A571-L575 WeakPolarHBondContact O-CG 3.42Å
572	S	50.2	Low	52.7	Low	55 Å²	55	99.5 Å²	99.5	39%	0.385	50%	0.497	S	S	.	.	H	α-helix	trans	-59.2	-42.5	169.5	45.7	0	0	0	0	113.1	N570 L575 L576	N570-S572 PolarHBondContact ND2-OG 3.44Å; N570-S572 PolarHBondContact O-N 3.14Å; N570-S572 VanDerWaalsContact O-N 3.14Å; S572-L575 PolarHBondContact O-N 3.3Å; S572-L576 PolarHBondContact O-N 3.39Å
573	D	55.4	Low	52.1	Low	62 Å²	62	107.3 Å²	107.3	33%	0.332	52%	0.518	S	S	.	.	H	α-helix	trans	-83.8	-33	-167.1	-40.1	-22.6	0	0	0	110	L569 N570 A571 L575 L576 H577	L569-D573 HydrophobicContact CB-CB 4.17Å; L569-D573 HydrophobicContact CD2-CB 3.49Å; L569-D573 VanDerWaalsContact CD2-CB 3.49Å; L569-D573 HydrophobicContact CG-CB 4.38Å; N570-D573 VanDerWaalsContact CB-OD2 3.23Å; N570-D573 WeakPolarHBondContact CB-OD2 3.42Å; N570-D573 PolarHBondContact N-OD2 2.61Å; N570-D573 PolarHBondContact O-N 3.46Å; A571-D573 VanDerWaalsContact C-N 3.35Å; D573-L575 VanDerWaalsContact C-N 3.32Å; D573-L575 PolarHBondContact O-N 2.81Å; D573-L576 PolarHBondContact O-N 2.94Å; D573-H577 WeakPolarHBondContact O-CB 3.3Å; D573-H577 PolarHBondContact O-N 3.19Å
574	Y	48.3	Very low	51.5	Low	117 Å²	117	108.7 Å²	108.7	46%	0.459	52%	0.522	S	S	.	.	H	α-helix	trans	-57.7	-43.1	169.5	-175.2	-92.5	0	0	0	112	L566 N570 H577 R578	L566-Y574 HydrophobicContact CD2-CE2 3.83Å; L566-Y574 HydrophobicContact CG-CD2 4.1Å; L566-Y574 HydrophobicContact CG-CE2 3.88Å; N570-Y574 PolarHBondContact O-N 2.86Å; Y574-H577 PolarHBondContact O-N 3.2Å; Y574-R578 PolarHBondContact O-N 3.28Å; Y574-R578 VanDerWaalsContact O-N 3.08Å
575	L	54.3	Low	50.9	Low	102 Å²	102	106.7 Å²	106.7	53%	0.534	53%	0.53	S	S	.	.	H	α-helix	trans	-65.7	-46.3	177.3	-69.6	170	0	0	0	111.6	A571 S572 D573 H577 R578 D579	A571-L575 WeakPolarHBondContact O-CG 3.42Å; S572-L575 PolarHBondContact O-N 3.3Å; D573-L575 VanDerWaalsContact C-N 3.32Å; D573-L575 PolarHBondContact O-N 2.81Å; L575-H577 VanDerWaalsContact C-N 3.29Å; L575-H577 PolarHBondContact O-N 2.9Å; L575-R578 WeakPolarHBondContact O-CB 3.28Å; L575-R578 PolarHBondContact O-N 3.42Å; L575-D579 PolarHBondContact O-N 3.31Å
576	L	56.1	Low	50	Low	125 Å²	125	106.8 Å²	106.8	65%	0.654	54%	0.54	S	S	*	.	H	α-helix	trans	-59	-39	174.7	-71.6	169.1	0	0	0	112.3	S572 D573 R578 D579 W580	S572-L576 PolarHBondContact O-N 3.39Å; D573-L576 PolarHBondContact O-N 2.94Å; L576-R578 VanDerWaalsContact C-N 3.34Å; L576-R578 PolarHBondContact O-N 3.42Å; L576-D579 PolarHBondContact O-N 3.01Å; L576-W580 PolarHBondContact O-N 3.29Å
577	H	53.7	Low	48.7	Very low	85 Å²	85	114.8 Å²	114.8	39%	0.394	57%	0.565	S	S	.	*	H	α-helix	trans	-70.2	-30.2	178.9	-152.7	-42	0	0	0	112.7	D573 Y574 L575 W580 V581	D573-H577 WeakPolarHBondContact O-CB 3.3Å; D573-H577 PolarHBondContact O-N 3.19Å; Y574-H577 PolarHBondContact O-N 3.2Å; L575-H577 VanDerWaalsContact C-N 3.29Å; L575-H577 PolarHBondContact O-N 2.9Å; H577-W580 AromaticContact CE1-CE3 3.78Å; H577-W580 PolarHBondContact O-N 3.31Å; H577-V581 PolarHBondContact O-N 2.79Å
578	R	45	Very low	47.2	Very low	154 Å²	154	113.7 Å²	113.7	58%	0.581	57%	0.569	S	S	*	*	H	α-helix	trans	-67.6	-38.1	174.8	-156.5	-176.1	76.7	158.8	4.7	111.9	Y574 L575 L576 W580 S582	Y574-R578 PolarHBondContact O-N 3.28Å; Y574-R578 VanDerWaalsContact O-N 3.08Å; L575-R578 WeakPolarHBondContact O-CB 3.28Å; L575-R578 PolarHBondContact O-N 3.42Å; L576-R578 VanDerWaalsContact C-N 3.34Å; L576-R578 PolarHBondContact O-N 3.42Å; R578-W580 VanDerWaalsContact C-N 3.25Å; R578-W580 PolarHBondContact O-N 3.47Å; R578-S582 WeakPolarHBondContact O-CB 3.41Å; R578-S582 PolarHBondContact O-N 3.4Å; R578-S582 VanDerWaalsContact O-N 3.09Å; R578-S582 PolarHBondContact O-OG 3.19Å
579	D	46.9	Very low	45.8	Very low	80 Å²	80	114 Å²	114	43%	0.428	58%	0.576	S	S	.	*	H	α-helix	trans	-72.4	-16.8	175.8	-82.1	10	0	0	0	113.4	L575 L576 R583	L575-D579 PolarHBondContact O-N 3.31Å; L576-D579 PolarHBondContact O-N 3.01Å; D579-R583 PolarHBondContact O-NE 3.26Å; D579-R583 PolarHBondContact O-NH2 3.08Å
580	W	40.3	Very low	44.5	Very low	147 Å²	147	117.3 Å²	117.3	56%	0.557	60%	0.599	S	S	*	*	H	α-helix	trans	-79.8	-53.8	170.6	-174.7	77.2	0	0	0	111.3	L576 H577 R578 S582 R583 H584	L576-W580 PolarHBondContact O-N 3.29Å; H577-W580 AromaticContact CE1-CE3 3.78Å; H577-W580 PolarHBondContact O-N 3.31Å; R578-W580 VanDerWaalsContact C-N 3.25Å; R578-W580 PolarHBondContact O-N 3.47Å; W580-S582 VanDerWaalsContact C-N 3.27Å; W580-S582 PolarHBondContact O-N 3.2Å; W580-R583 PolarHBondContact O-N 3.41Å; W580-H584 AromaticContact CD1-CD2 3.88Å; W580-H584 AromaticContact CD1-NE2 3.87Å; W580-H584 AromaticContact CE2-CD2 3.62Å; W580-H584 AromaticContact CE2-NE2 3.84Å; W580-H584 AromaticContact NE1-CD2 3.51Å; W580-H584 AromaticContact NE1-NE2 3.33Å; W580-H584 PolarHBondContact NE1-NE2 2.93Å; W580-H584 PolarHBondContact O-CD2 2.92Å; W580-H584 PolarHBondContact O-N 3.28Å
581	V	47.5	Very low	43.4	Very low	81 Å²	81	118.7 Å²	118.7	49%	0.491	61%	0.614	S	S	.	*	H	α-helix	trans	-57.7	-41.4	179.2	176.5	0	0	0	0	111.4	H577 R583 H584 S585	H577-V581 PolarHBondContact O-N 2.79Å; V581-R583 PolarHBondContact O-N 2.98Å; V581-H584 PolarHBondContact O-N 3.35Å; V581-S585 PolarHBondContact O-N 3.3Å
582	S	43.5	Very low	42.6	Very low	67 Å²	67	121.7 Å²	121.7	47%	0.469	62%	0.624	S	S	.	*	H	α-helix	trans	-62.5	-26	178.6	-55.5	0	0	0	0	113.7	R578 W580	R578-S582 WeakPolarHBondContact O-CB 3.41Å; R578-S582 PolarHBondContact O-N 3.4Å; R578-S582 VanDerWaalsContact O-N 3.09Å; R578-S582 PolarHBondContact O-OG 3.19Å; W580-S582 VanDerWaalsContact C-N 3.27Å; W580-S582 PolarHBondContact O-N 3.2Å
583	R	39.7	Very low	41.7	Very low	190 Å²	190	124.2 Å²	124.2	72%	0.717	64%	0.642	S	S	*	*	H	α-helix	trans	-88.2	-17.8	179.1	-83.5	-177	-86.7	-158.1	-7.2	114.2	D579 W580 V581	D579-R583 PolarHBondContact O-NE 3.26Å; D579-R583 PolarHBondContact O-NH2 3.08Å; W580-R583 PolarHBondContact O-N 3.41Å; V581-R583 PolarHBondContact O-N 2.98Å
584	H	43.6	Very low	40.4	Very low	127 Å²	127	127.5 Å²	127.5	59%	0.588	67%	0.665	S	S	*	*	H	α-helix	trans	-99.7	-13.4	-179.6	-74	-71.5	0	0	0	114.6	W580 V581 I586	W580-H584 AromaticContact CD1-CD2 3.88Å; W580-H584 AromaticContact CD1-NE2 3.87Å; W580-H584 AromaticContact CE2-CD2 3.62Å; W580-H584 AromaticContact CE2-NE2 3.84Å; W580-H584 AromaticContact NE1-CD2 3.51Å; W580-H584 AromaticContact NE1-NE2 3.33Å; W580-H584 PolarHBondContact NE1-NE2 2.93Å; W580-H584 PolarHBondContact O-CD2 2.92Å; W580-H584 PolarHBondContact O-N 3.28Å; V581-H584 PolarHBondContact O-N 3.35Å; H584-I586 VanDerWaalsContact C-N 3.31Å; H584-I586 PolarHBondContact O-N 2.98Å
585	S	38.7	Very low	39.7	Very low	105 Å²	105	127 Å²	127	73%	0.734	68%	0.678	S	S	*	*	S	Bend	trans	-76.6	-6.8	-179	-159.3	0	0	0	0	115.3	V581	V581-S585 PolarHBondContact O-N 3.3Å
586	I	38.1	Very low	38.3	Very low	145 Å²	145	127.3 Å²	127.3	74%	0.744	69%	0.687	S	S	*	*	S	Bend	trans	-110.8	44.5	-170.1	-38.5	-178.4	0	0	0	112.4	H584	H584-I586 VanDerWaalsContact C-N 3.31Å; H584-I586 PolarHBondContact O-N 2.98Å
587	R	31.3	Very low	37.2	Very low	239 Å²	239	129.4 Å²	129.4	90%	0.902	69%	0.693	S	S	*	*			trans	-157.8	54.5	176.9	-143.1	179.2	-174	-165.8	0.5	119.5
588	S	31.8	Very low	36	Very low	116 Å²	116	130.3 Å²	130.3	81%	0.811	71%	0.71	S	S	*	*			trans	-162.9	88.5	163.2	40.8	0	0	0	0	113.7
589	N	30.2	Very low	35.4	Very low	166 Å²	166	128 Å²	128	89%	0.888	72%	0.717	S	S	*	*			trans	-152.8	60.3	173.2	-131.1	-4.2	0	0	0	113.5
590	T	33.9	Very low	34.6	Very low	126 Å²	126	133.3 Å²	133.3	77%	0.773	74%	0.739	S	S	*	*			trans	-153.2	119.9	172.2	43.7	0	0	0	0	110.7
591	P	31.6	Very low	34.1	Very low	132 Å²	132	130.2 Å²	130.2	86%	0.857	75%	0.745	S	S	*	*			trans	-86	133.7	170.6	33.4	-31.3	0	0	0	111.1
592	V	34.3	Very low	33.3	Very low	135 Å²	135	134 Å²	134	82%	0.818	76%	0.761	S	S	*	*			trans	-139.3	134.8	172.4	-177.8	0	0	0	0	109.3
593	S	32.4	Very low	32.6	Very low	107 Å²	107	138 Å²	138	75%	0.748	78%	0.776	S	S	*	*			trans	-90.5	140.1	-175.5	-56.6	0	0	0	0	113.2
594	T	28.3	Very low	32.3	Very low	132 Å²	132	134 Å²	134	81%	0.81	78%	0.777	S	S	*	*			trans	17.3	113.2	146.8	56	0	0	0	0	119.7
595	S	31.6	Very low	31.9	Very low	106 Å²	106	133.2 Å²	133.2	74%	0.741	78%	0.781	S	S	*	*				-176.8	116.1	116.6	60.8	0	0	0	0	114.9
596	C	25.2	Very low	31.7	Very low	108 Å²	108	134.6 Å²	134.6	73%	0.73	78%	0.78	S	S	*	*			trans	56.7	150.3	132.1	-48.1	0	0	0	0	124.7
597	H	33.8	Very low	31.4	Very low	169 Å²	169	134.3 Å²	134.3	78%	0.782	78%	0.78	S	S	*	*			trans	88.6	84.8	150.7	-58.7	-52.7	0	0	0	123
598	S	28.5	Very low	31.8	Very low	105 Å²	105	127.3 Å²	127.3	73%	0.734	77%	0.766	S	S	*	*				76	151.3	113.6	65.5	0	0	0	0	124.1
599	S	33.4	Very low	32.1	Very low	104 Å²	104	127.8 Å²	127.8	73%	0.727	76%	0.764	S	S	*	*			trans	78.9	114	165.2	-55.1	0	0	0	0	116.4
600	Q	30	Very low	32.4	Very low	192 Å²	192	126.1 Å²	126.1	90%	0.897	76%	0.759	S	S	*	*				67.3	134.1	66.1	-68.4	-168.6	6.8	0	0	112.4
601	A	28.2	Very low	32.4	Very low	83 Å²	83	124.1 Å²	124.1	69%	0.686	76%	0.756	S	S	*	*			cis	-160.5	-164.7	17.3	0	0	0	0	0	112.7
602	I	31.8	Very low	32.4	Very low	160 Å²	160	124 Å²	124	82%	0.821	75%	0.753	S	S	*	*			trans	80.8	144.5	162.9	-50.5	169.5	0	0	0	116.1
603	L	27.9	Very low	32.3	Very low	151 Å²	151	123.4 Å²	123.4	79%	0.791	75%	0.749	S	S	*	*				177.4	161.7	-50.5	-108.1	164.9	0	0	0	109.6
604	S	34.1	Very low	32.4	Very low	106 Å²	106	124.8 Å²	124.8	74%	0.741	75%	0.753	S	S	*	*			trans	80.3	144.7	160.4	-60.9	0	0	0	0	120.2
605	V	34.6	Very low	32.5	Very low	110 Å²	110	122.1 Å²	122.1	67%	0.667	74%	0.744	S	S	*	*			cis	-159.7	138.7	-16.8	122.9	0	0	0	0	110.6
606	N	35	Very low	32.4	Very low	134 Å²	134	123.1 Å²	123.1	72%	0.717	75%	0.747	S	S	*	*			trans	23.7	162.9	142.8	-32.1	-22.5	0	0	0	121.6
607	N	31	Very low	32.9	Very low	140 Å²	140	127 Å²	127	75%	0.749	75%	0.754	S	S	*	*			cis	-172	-164	10.5	-135.7	8	0	0	0	109.6
608	P	41.1	Very low	32.6	Very low	92 Å²	92	123.8 Å²	123.8	60%	0.597	75%	0.751	S	S	*	*			cis	-139.6	160.3	-8.6	37.1	-16.7	0	0	0	119.5
609	T	36.8	Very low	32.6	Very low	126 Å²	126	124 Å²	124	77%	0.773	75%	0.751	S	S	*	*			trans	65.9	153.9	145.9	51.4	0	0	0	0	120.2
610	V	36.6	Very low	32.3	Very low	130 Å²	130	124.8 Å²	124.8	79%	0.788	75%	0.751	S	S	*	*			cis	-136	135.6	23.5	175.7	0	0	0	0	113.6
611	A	34.6	Very low	32.2	Very low	84 Å²	84	120.5 Å²	120.5	69%	0.694	74%	0.743	S	S	*	*			trans	7.7	162	145.1	0	0	0	0	0	123.4
612	T	32.2	Very low	32.1	Very low	131 Å²	131	122.3 Å²	122.3	80%	0.804	75%	0.745	S	S	*	*			cis	176.2	157.2	-12.8	-87.6	0	0	0	0	108.6
613	V	31.8	Very low	32	Very low	122 Å²	122	122.3 Å²	122.3	74%	0.739	75%	0.746	S	S	*	*			cis	-163.7	135.1	-35.5	157.9	0	0	0	0	106.2
614	T	33.7	Very low	32	Very low	135 Å²	135	122.6 Å²	122.6	83%	0.828	75%	0.748	S	S	*	*			trans	-176.4	150.2	161.4	12.4	0	0	0	0	108.1
615	A	31.5	Very low	32.1	Very low	76 Å²	76	122.6 Å²	122.6	63%	0.628	75%	0.745	S	S	*	*			cis	90.6	124.9	8.2	0	0	0	0	0	116.1
616	T	28.6	Very low	31.8	Very low	128 Å²	128	126.1 Å²	126.1	79%	0.785	75%	0.752	S	S	*	*			cis	-163.2	169.3	1.2	-2.4	0	0	0	0	113.8
617	Q	35.2	Very low	31.4	Very low	189 Å²	189	125.4 Å²	125.4	88%	0.883	75%	0.752	S	S	*	*			trans	84.1	129.6	154.3	-77.4	175.2	15.5	0	0	121.9
618	S	27.3	Very low	31.3	Very low	102 Å²	102	125.8 Å²	125.8	71%	0.713	75%	0.753	S	S	*	*			trans	-85.1	164	167.2	51.8	0	0	0	0	113.2
619	C	29.3	Very low	30.8	Very low	110 Å²	110	127.7 Å²	127.7	74%	0.743	76%	0.763	S	S	*	*			trans	166.4	104.8	139.7	-92.3	0	0	0	0	109.8
620	T	27	Very low	30.5	Very low	120 Å²	120	124.6 Å²	124.6	74%	0.736	76%	0.756	S	S	*	*				78.3	130.8	88.7	56.8	0	0	0	0	117.6
621	S	27.5	Very low	30.3	Very low	102 Å²	102	125.4 Å²	125.4	71%	0.713	76%	0.756	S	S	*	*			trans	89.3	102	143.9	-59.9	0	0	0	0	122.9
622	T	25.8	Very low	30.2	Very low	121 Å²	121	127.9 Å²	127.9	74%	0.742	75%	0.753	S	S	*	*				62.9	128.6	117.3	-29.5	0	0	0	0	122.2
623	L	30.4	Very low	30	Very low	160 Å²	160	130 Å²	130	84%	0.838	75%	0.751	S	S	*	*				146.5	156	129.5	-77.8	171.9	0	0	0	114.9
624	L	28.1	Very low	30	Very low	157 Å²	157	128.1 Å²	128.1	82%	0.822	74%	0.744	S	S	*	*			trans	-98.2	-169.7	177.6	-65.5	77.2	0	0	0	110
625	P	36.1	Very low	29.7	Very low	106 Å²	106	130.1 Å²	130.1	69%	0.688	74%	0.744	S	S	*	*				-128.7	-156.8	-58.7	33.2	-13.1	0	0	0	112
626	K	28.1	Very low	29.6	Very low	184 Å²	184	132.2 Å²	132.2	80%	0.8	75%	0.749	S	S	*	*			trans	90.8	111.6	156.8	-73.4	171.3	178.4	-179.5	0	121.2
627	T	27.4	Very low	29.6	Very low	118 Å²	118	130.2 Å²	130.2	72%	0.724	74%	0.74	S	S	*	*				28.4	132	126.2	59.6	0	0	0	0	122.2
628	L	28.6	Very low	29.4	Very low	149 Å²	149	129 Å²	129	78%	0.78	73%	0.734	S	S	*	*				-175.4	118.9	121.6	-117.5	71.8	0	0	0	109.8
629	T	29.3	Very low	29.6	Very low	132 Å²	132	131.3 Å²	131.3	81%	0.81	74%	0.738	S	S	*	*				76.6	135.2	98.3	59.9	0	0	0	0	119.5
630	G	32.3	Very low	29.9	Very low	60 Å²	60	131.3 Å²	131.3	62%	0.619	74%	0.736	S	S	*	*			trans	160.2	99	164.5	0	0	0	0	0	111.2
631	N	31.5	Very low	30.1	Very low	147 Å²	147	132.5 Å²	132.5	79%	0.786	74%	0.743	S	S	*	*				81.5	139.9	98.1	-69.1	4.9	0	0	0	113.2
632	H	33.5	Very low	30	Very low	136 Å²	136	135.5 Å²	135.5	63%	0.63	75%	0.748	S	S	*	*			cis	-164.7	145.1	10.4	-130.2	-147	0	0	0	111.6
633	F	27.9	Very low	30.2	Very low	176 Å²	176	136.6 Å²	136.6	77%	0.772	75%	0.754	S	S	*	*			trans	59.8	150.2	145.7	-74.9	-133.5	0	0	0	119.8
634	S	30.6	Very low	30.1	Very low	83 Å²	83	134.1 Å²	134.1	58%	0.58	75%	0.745	S	S	*	*			cis	-157	142.8	-8.8	-95	0	0	0	0	109.3
635	Q	28.2	Very low	30.3	Very low	176 Å²	176	132.3 Å²	132.3	82%	0.822	74%	0.741	S	S	*	*				59.9	125	96.6	-140.7	177.6	5.6	0	0	114.2
636	V	29	Very low	30	Very low	121 Å²	121	136.1 Å²	136.1	73%	0.733	75%	0.75	S	S	*	*				-159.6	132.3	66.2	164.9	0	0	0	0	107.8
637	S	28	Very low	30.3	Very low	86 Å²	86	134.9 Å²	134.9	60%	0.601	75%	0.747	S	S	*	*				54.4	148	93.4	-96.5	0	0	0	0	115.7
638	E	31.8	Very low	30.7	Very low	164 Å²	164	135.2 Å²	135.2	77%	0.766	75%	0.751	S	S	*	*			cis	-164.4	173.9	10.2	-114.1	140.8	-126.9	0	0	107.2
639	L	31	Very low	30.6	Very low	150 Å²	150	132.1 Å²	132.1	79%	0.785	74%	0.742	S	S	*	*			cis	-173.7	151.6	-26.5	-178.1	151.3	0	0	0	107.6
640	P	36.5	Very low	30.6	Very low	109 Å²	109	134 Å²	134	71%	0.708	75%	0.745	S	S	*	*			trans	-102	172.9	-160.4	40.2	-36.4	0	0	0	116.6
641	V	30.3	Very low	30.3	Very low	146 Å²	146	136.9 Å²	136.9	89%	0.885	75%	0.75	S	S	*	*			trans	-134.4	147.8	167.8	-176.8	0	0	0	0	111.3
642	M	25.4	Very low	30.1	Very low	164 Å²	164	135.2 Å²	135.2	81%	0.808	75%	0.746	S	S	*	*			trans	-86.8	168.3	-176.3	-53.8	168.9	-76.3	0	0	113.6
643	V	30.9	Very low	29.9	Very low	145 Å²	145	134.8 Å²	134.8	88%	0.879	75%	0.753	S	S	*	*				-162.3	158.3	118.8	141	0	0	0	0	109.4
644	T	27	Very low	29.9	Very low	107 Å²	107	131.9 Å²	131.9	66%	0.656	75%	0.754	S	S	*	*			trans	-115.1	-171.1	-163	52.7	0	0	0	0	113.8
645	T	32.7	Very low	29.8	Very low	119 Å²	119	135.9 Å²	135.9	73%	0.73	77%	0.768	S	S	*	*			trans	90.6	143.3	167.7	76.2	0	0	0	0	117.6
646	Q	30.8	Very low	29.8	Very low	187 Å²	187	132.5 Å²	132.5	87%	0.874	76%	0.763	S	S	*	*			cis	-153.7	173.5	-22.8	-121.1	174	13.1	0	0	111.8
647	Q	34.9	Very low	29.9	Very low	158 Å²	158	131.4 Å²	131.4	74%	0.738	77%	0.767	S	S	*	*			trans	-76	179	177	-122.3	-170.4	-40.1	0	0	112.1	S649	Q647-S649 PolarHBondContact NE2-OG 2.84Å
648	P	34.9	Very low	30.1	Very low	125 Å²	125	136.1 Å²	136.1	81%	0.812	78%	0.777	S	S	*	*			cis	-135.8	176	39.2	38.9	-18.4	0	0	0	117.5
649	S	27.2	Very low	30.1	Very low	83 Å²	83	135.5 Å²	135.5	58%	0.58	78%	0.778	S	S	*	*			trans	-113.7	155.4	-178.6	-43.1	0	0	0	0	110.9	Q647	Q647-S649 PolarHBondContact NE2-OG 2.84Å
650	I	29.1	Very low	30	Very low	172 Å²	172	133.5 Å²	133.5	88%	0.882	77%	0.774	S	S	*	*			trans	-128.1	143.9	162.7	-64.4	-176.6	0	0	0	109.2
651	V	25.6	Very low	29.6	Very low	120 Å²	120	133.5 Å²	133.5	73%	0.727	77%	0.772	S	S	*	*			trans	-121.1	175.5	-171.5	-177.3	0	0	0	0	108.3
652	T	27.8	Very low	29.5	Very low	112 Å²	112	132.8 Å²	132.8	69%	0.687	77%	0.767	S	S	*	*			trans	143.2	97.2	133.4	-59.9	0	0	0	0	115.8
653	T	28.1	Very low	29.6	Very low	128 Å²	128	130.1 Å²	130.1	79%	0.785	76%	0.755	S	S	*	*			trans	63.5	151.9	141.3	63.2	0	0	0	0	123.8
654	S	27.3	Very low	29.3	Very low	114 Å²	114	131.6 Å²	131.6	80%	0.797	75%	0.754	S	S	*	*			trans	-93.9	146.8	163.8	46.7	0	0	0	0	112.5
655	I	28.7	Very low	29.4	Very low	168 Å²	168	134.9 Å²	134.9	86%	0.862	76%	0.756	S	S	*	*			trans	-138.2	148.6	159.4	-66.2	-173.1	0	0	0	108.8
656	S	27.9	Very low	29.2	Very low	104 Å²	104	134.7 Å²	134.7	73%	0.727	76%	0.759	S	S	*	*			trans	-91	144.1	-178.7	179.8	0	0	0	0	113.1
657	A	32.1	Very low	29.1	Very low	99 Å²	99	134.2 Å²	134.2	82%	0.818	76%	0.757	S	S	*	*			trans	-128.5	153.9	162.8	0	0	0	0	0	109.9
658	K	31.4	Very low	28.9	Very low	185 Å²	185	131.6 Å²	131.6	80%	0.804	75%	0.754	S	S	*	*			trans	-119.4	164.7	-163.6	-65	-179.7	176.2	175.6	0	114.2
659	L	32.1	Very low	28.7	Very low	150 Å²	150	133 Å²	133	79%	0.785	75%	0.754	S	S	*	*			trans	71.6	158.3	161.9	-92.8	67	0	0	0	116.9
660	P	29.1	Very low	28.9	Very low	109 Å²	109	134.9 Å²	134.9	71%	0.708	76%	0.762	S	S	*	*			cis	-104.9	110.1	-1.8	35.3	-25.7	0	0	0	113.8	V662	P660-V662 PolarHBondContact O-N 3.24Å; P660-V662 VanDerWaalsContact O-N 3.14Å
661	T	28.8	Very low	28.9	Very low	109 Å²	109	134.1 Å²	134.1	67%	0.669	76%	0.759	S	S	*	*			trans	-76.3	95.9	165.7	-58.9	0	0	0	0	109.6	M663	T661-M663 HydrophobicContact CG2-CB 4.24Å; T661-M663 HydrophobicContact CG2-CE 3.81Å; T661-M663 HydrophobicContact CG2-CG 3.75Å; T661-M663 HydrophobicContact CG2-SD 4.46Å; T661-M663 PolarHBondContact O-N 2.93Å
662	V	26.7	Very low	29.1	Very low	130 Å²	130	136.4 Å²	136.4	79%	0.788	76%	0.761	S	S	*	*			trans	-79.7	72.7	170.4	-173.3	0	0	0	0	109.4	P660 M664	P660-V662 PolarHBondContact O-N 3.24Å; P660-V662 VanDerWaalsContact O-N 3.14Å; V662-M664 PolarHBondContact O-N 2.95Å
663	M	27.9	Very low	29.2	Very low	109 Å²	109	136.3 Å²	136.3	54%	0.537	76%	0.76	S	S	.	*			trans	-81.3	107.6	165.3	-89.1	-167.7	-67.9	0	0	109.5	T661 Y665	T661-M663 HydrophobicContact CG2-CB 4.24Å; T661-M663 HydrophobicContact CG2-CE 3.81Å; T661-M663 HydrophobicContact CG2-CG 3.75Å; T661-M663 HydrophobicContact CG2-SD 4.46Å; T661-M663 PolarHBondContact O-N 2.93Å; M663-Y665 HydrophobicContact CB-CD2 3.93Å; M663-Y665 HydrophobicContact CB-CE2 3.96Å; M663-Y665 HydrophobicContact CE-CE2 3.52Å; M663-Y665 WeakPolarHBondContact CE-OH 3.16Å; M663-Y665 HydrophobicContact CG-CE2 4.5Å; M663-Y665 PolarHBondContact O-N 3.07Å; M663-Y665 HydrophobicContact SD-CE1 4.35Å; M663-Y665 HydrophobicContact SD-CE2 3.76Å
664	M	25	Very low	29.4	Very low	175 Å²	175	136.5 Å²	136.5	86%	0.862	76%	0.756	S	S	*	*			trans	-72.2	80.7	160	-76.8	-66.1	-64	0	0	109	V662 S666	V662-M664 PolarHBondContact O-N 2.95Å; M664-S666 PolarHBondContact O-N 3.11Å; M664-S666 VanDerWaalsContact O-N 3.16Å
665	Y	29.1	Very low	29.9	Very low	177 Å²	177	137 Å²	137	69%	0.694	75%	0.748	S	S	*	*			trans	-66.8	105.7	163.3	-78.9	-73.5	0	0	0	108.9	M663 Q667	M663-Y665 HydrophobicContact CB-CD2 3.93Å; M663-Y665 HydrophobicContact CB-CE2 3.96Å; M663-Y665 HydrophobicContact CE-CE2 3.52Å; M663-Y665 WeakPolarHBondContact CE-OH 3.16Å; M663-Y665 HydrophobicContact CG-CE2 4.5Å; M663-Y665 PolarHBondContact O-N 3.07Å; M663-Y665 HydrophobicContact SD-CE1 4.35Å; M663-Y665 HydrophobicContact SD-CE2 3.76Å; Y665-Q667 VanDerWaalsContact C-N 3.33Å; Y665-Q667 PolarHBondContact O-N 2.96Å; Y665-Q667 VanDerWaalsContact O-N 3.16Å
666	S	27.6	Very low	30.4	Very low	114 Å²	114	136.6 Å²	136.6	80%	0.797	75%	0.748	S	S	*	*			trans	-77	89.2	157.8	55.4	0	0	0	0	108.2	M664	M664-S666 PolarHBondContact O-N 3.11Å; M664-S666 VanDerWaalsContact O-N 3.16Å
667	Q	30.6	Very low	30.8	Very low	177 Å²	177	133.9 Å²	133.9	83%	0.827	74%	0.736	S	S	*	*			trans	-63.2	132	164.7	-74.2	-174.4	-56	0	0	108.8	Y665	Y665-Q667 VanDerWaalsContact C-N 3.33Å; Y665-Q667 PolarHBondContact O-N 2.96Å; Y665-Q667 VanDerWaalsContact O-N 3.16Å
668	P	29	Very low	31	Very low	104 Å²	104	136.3 Å²	136.3	68%	0.675	73%	0.73	S	S	*	*			trans	-71	170.9	157.7	33.9	-34	0	0	0	109.7
669	N	32.2	Very low	31.1	Very low	153 Å²	153	132.3 Å²	132.3	82%	0.818	72%	0.724	S	S	*	*			trans	75.8	76.9	172.1	-49.3	-10.4	0	0	0	116.5
670	T	30.2	Very low	31.2	Very low	123 Å²	123	129.8 Å²	129.8	76%	0.755	72%	0.718	S	S	*	*			trans	-152.2	114.5	134.3	-68.8	0	0	0	0	108.1	Q672	T670-Q672 HydrophobicContact CG2-CG 4.1Å
671	I	29.9	Very low	31.4	Very low	157 Å²	157	132.3 Å²	132.3	81%	0.805	72%	0.724	S	S	*	*			trans	-89.9	117.4	168.9	-56.6	176.3	0	0	0	106.8	V673	I671-V673 HydrophobicContact CG2-CG2 3.8Å; I671-V673 PolarHBondContact O-N 2.99Å
672	Q	29.8	Very low	31.5	Very low	168 Å²	168	136.7 Å²	136.7	79%	0.785	73%	0.734	S	S	*	*			trans	-90.8	92.5	170.5	-70.5	-169.3	-14.9	0	0	109.4	T670	T670-Q672 HydrophobicContact CG2-CG 4.1Å
673	V	30.6	Very low	31.5	Very low	110 Å²	110	138 Å²	138	67%	0.667	73%	0.732	S	S	*	*			trans	-79.6	122.3	168.5	-175.3	0	0	0	0	108.6	I671 I675	I671-V673 HydrophobicContact CG2-CG2 3.8Å; I671-V673 PolarHBondContact O-N 2.99Å; V673-I675 HydrophobicContact CG1-CG1 4.04Å; V673-I675 PolarHBondContact O-N 3.37Å
674	L	31.9	Very low	31.7	Very low	131 Å²	131	141.1 Å²	141.1	69%	0.686	75%	0.75	S	S	*	*			trans	-84.1	90.3	179	-164.7	78.8	0	0	0	110.4
675	I	36.5	Very low	31.7	Very low	124 Å²	124	138.7 Å²	138.7	64%	0.636	74%	0.74	S	S	*	*	S	Bend	trans	-89.7	123.4	169.7	-54.7	-179.3	0	0	0	108.2	V673 G677	V673-I675 HydrophobicContact CG1-CG1 4.04Å; V673-I675 PolarHBondContact O-N 3.37Å; I675-G677 PolarHBondContact O-N 3.3Å
676	N	39.4	Very low	31.9	Very low	160 Å²	160	136.5 Å²	136.5	86%	0.856	75%	0.748	S	S	*	*	T	Hydrogen-bonded Turn	trans	51	28.7	177.4	-62.2	1.3	0	0	0	116	Q678	N676-Q678 PolarHBondContact O-N 3.38Å
677	G	37.4	Very low	32	Very low	47 Å²	47	136.5 Å²	136.5	49%	0.485	74%	0.743	S	S	.	*	T	Hydrogen-bonded Turn	trans	76.1	8.6	165.7	0	0	0	0	0	117.4	I675	I675-G677 PolarHBondContact O-N 3.3Å
678	Q	35	Very low	32.1	Very low	150 Å²	150	137.4 Å²	137.4	70%	0.701	75%	0.745	S	S	*	*			trans	-127	117	-178	-78.9	-83.2	-60.6	0	0	111.6	N676	N676-Q678 PolarHBondContact O-N 3.38Å
679	P	34.2	Very low	32.3	Very low	102 Å²	102	137 Å²	137	66%	0.662	74%	0.744	S	S	*	*			trans	-77.4	125.8	170.1	31.1	-31.7	0	0	0	110.4
680	S	34.9	Very low	32.3	Very low	96 Å²	96	133.6 Å²	133.6	67%	0.671	73%	0.732	S	S	*	*			trans	-124.7	145.5	176.5	-70.8	0	0	0	0	111.3
681	I	32	Very low	32.7	Very low	162 Å²	162	131 Å²	131	83%	0.831	72%	0.717	S	S	*	*			trans	-120.6	132	-177.9	-58.7	174.4	0	0	0	108.9
682	F	30.8	Very low	32.9	Very low	202 Å²	202	129.3 Å²	129.3	89%	0.886	71%	0.71	S	S	*	*			trans	-128.8	145.9	169.3	-77.2	-83.8	0	0	0	110.2
683	Q	28.3	Very low	33.5	Very low	158 Å²	158	126.7 Å²	126.7	74%	0.738	71%	0.708	S	S	*	*			trans	-135.8	137.1	-175.6	177.4	-177.8	-11.5	0	0	109.7
684	L	30.8	Very low	33.5	Very low	173 Å²	173	127.6 Å²	127.6	91%	0.906	71%	0.713	S	S	*	*			trans	-139	130.6	172.4	-68.4	173.9	0	0	0	110.3
685	N	26.1	Very low	33.4	Very low	125 Å²	125	128.4 Å²	128.4	67%	0.668	72%	0.717	S	S	*	*			trans	-102.1	159	164.7	-59.3	-11.4	0	0	0	108.1
686	P	32.6	Very low	33.1	Very low	131 Å²	131	128.4 Å²	128.4	85%	0.851	73%	0.728	S	S	*	*				-147.8	-160.7	101.6	38.5	-20.5	0	0	0	114.2
687	T	30.4	Very low	32.6	Very low	113 Å²	113	125.7 Å²	125.7	69%	0.693	72%	0.721	S	S	*	*			trans	-137.9	162.9	-155.5	52.4	0	0	0	0	116.2
688	F	32.3	Very low	32.2	Very low	197 Å²	197	130.7 Å²	130.7	86%	0.864	74%	0.736	S	S	*	*			trans	77.4	173.8	159.8	-69.9	-64.3	0	0	0	119.6
689	S	32.3	Very low	32	Very low	94 Å²	94	131.3 Å²	131.3	66%	0.657	74%	0.744	S	S	*	*			trans	-154.5	143.2	-131.1	54.8	0	0	0	0	118
690	S	32.8	Very low	31.8	Very low	82 Å²	82	131.8 Å²	131.8	57%	0.573	74%	0.744	S	S	*	*			trans	60.4	174.1	146.6	71.9	0	0	0	0	119.7
691	P	38.3	Very low	31.6	Very low	68 Å²	68	133.9 Å²	133.9	44%	0.442	75%	0.753	S	S	.	*				-138.5	-177	-68	41.9	-26.8	0	0	0	116.4	N957	P691-N957 HydrophobicContact CG-CB 3.69Å
692	N	34.3	Very low	31.5	Very low	122 Å²	122	133.9 Å²	133.9	65%	0.652	76%	0.755	S	S	*	*			trans	88	155.3	155.1	-80.4	8.1	0	0	0	121.3
693	P	42.3	Very low	31.6	Very low	114 Å²	114	129.9 Å²	129.9	74%	0.74	75%	0.752	S	S	*	*			trans	-126.6	176.5	-153.9	43.9	-30.2	0	0	0	115.8
694	V	31.9	Very low	31.7	Very low	129 Å²	129	129.2 Å²	129.2	78%	0.782	75%	0.753	S	S	*	*			trans	-169.1	139.5	142.6	129.4	0	0	0	0	113
695	I	29	Very low	31.9	Very low	147 Å²	147	129.6 Å²	129.6	75%	0.754	75%	0.753	S	S	*	*			trans	27	124.5	154.5	-54.4	167.1	0	0	0	120.2
696	S	31.2	Very low	32.2	Very low	124 Å²	124	134.2 Å²	134.2	87%	0.867	76%	0.761	S	S	*	*				-165.6	149.4	123.5	-82.5	0	0	0	0	112.4
697	S	28.2	Very low	32.4	Very low	104 Å²	104	132.3 Å²	132.3	73%	0.727	75%	0.748	S	S	*	*			trans	-121.4	166.2	-177.2	54.5	0	0	0	0	112
698	L	28.6	Very low	32.5	Very low	152 Å²	152	132.9 Å²	132.9	80%	0.796	75%	0.754	S	S	*	*			trans	137.1	162.9	149.8	-73.8	165.5	0	0	0	113.7
699	L	31.6	Very low	32.4	Very low	163 Å²	163	131.1 Å²	131.1	85%	0.853	75%	0.752	S	S	*	*			trans	69.5	93.9	179.8	-51.6	174.5	0	0	0	113
700	T	28.4	Very low	32.4	Very low	111 Å²	111	131.3 Å²	131.3	68%	0.681	76%	0.759	S	S	*	*			cis	74.1	100.6	29.2	-36.9	0	0	0	0	114.8
701	T	32.4	Very low	32.2	Very low	140 Å²	140	132.6 Å²	132.6	86%	0.859	77%	0.768	S	S	*	*				179.2	161.1	124.2	26.2	0	0	0	0	111.7
702	N	29.2	Very low	31.8	Very low	163 Å²	163	135.2 Å²	135.2	87%	0.872	78%	0.782	S	S	*	*			trans	-94.4	155	-175	-53	-70.8	0	0	0	112.7
703	S	33	Very low	31.7	Very low	118 Å²	118	138.1 Å²	138.1	83%	0.825	79%	0.792	S	S	*	*			trans	-155	155.4	137.2	-160.7	0	0	0	0	112.6
704	L	30.6	Very low	30.8	Very low	143 Å²	143	137.6 Å²	137.6	75%	0.749	79%	0.791	S	S	*	*			trans	-81.9	148.6	179.1	-78.5	56.6	0	0	0	111
705	M	33.5	Very low	31	Very low	182 Å²	182	137.5 Å²	137.5	90%	0.897	79%	0.793	S	S	*	*			trans	-155.9	158.8	132.4	-97.1	-47.3	103.5	0	0	111
706	R	33.2	Very low	31.1	Very low	222 Å²	222	139.9 Å²	139.9	84%	0.838	80%	0.798	S	S	*	*			trans	-148.4	176.8	-174.5	-155.1	-157.2	176.5	-171.4	0.8	109
707	P	37.1	Very low	30.7	Very low	90 Å²	90	142.3 Å²	142.3	58%	0.584	80%	0.8	S	S	*	*				-85	-156.7	-96.4	35.2	-16.3	0	0	0	111.8
708	P	32.6	Very low	30.9	Very low	126 Å²	126	143.1 Å²	143.1	82%	0.818	80%	0.801	S	S	*	*				-136.5	160.2	86.1	37.3	-24.9	0	0	0	114.5
709	I	29.3	Very low	30.7	Very low	160 Å²	160	143.9 Å²	143.9	82%	0.821	80%	0.804	S	S	*	*			trans	-95.3	134.2	168.1	-64.1	167.7	0	0	0	107.6
710	A	32.9	Very low	30.7	Very low	97 Å²	97	143.8 Å²	143.8	80%	0.802	80%	0.804	S	S	*	*			trans	-136.3	134.4	163.9	0	0	0	0	0	109.1
711	S	28.7	Very low	30.8	Very low	110 Å²	110	146.3 Å²	146.3	77%	0.769	81%	0.808	S	S	*	*			trans	-88.8	166.9	169.2	53.4	0	0	0	0	110.4
712	V	30.1	Very low	30.6	Very low	123 Å²	123	147.1 Å²	147.1	75%	0.745	80%	0.802	S	S	*	*			trans	161.3	108.6	137.8	157.3	0	0	0	0	110.2
713	Q	31.2	Very low	30.8	Very low	183 Å²	183	145.5 Å²	145.5	86%	0.855	80%	0.8	S	S	*	*			trans	61.6	131.6	133.4	-151.2	162.1	18.9	0	0	121.3
714	S	23.8	Very low	30.5	Very low	103 Å²	103	145.7 Å²	145.7	72%	0.72	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-86.3	149.4	175.5	47.6	0	0	0	0	113.5
715	P	36.4	Very low	30.5	Very low	127 Å²	127	142 Å²	142	83%	0.825	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-77.6	140.3	169.7	30.6	-31	0	0	0	111.5
716	K	31.3	Very low	30.5	Very low	196 Å²	196	142.9 Å²	142.9	85%	0.852	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-80.8	153.3	175.1	-75.7	179.8	173.4	178.6	0	111.9
717	L	23.2	Very low	30.2	Very low	176 Å²	176	142 Å²	142	92%	0.921	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-64.1	140.7	156.8	-66.2	171.4	0	0	0	110.3
718	V	32.1	Very low	30	Very low	121 Å²	121	143.8 Å²	143.8	73%	0.733	81%	0.807	S	S	*	*			trans	-134.8	120.9	163.1	177.5	0	0	0	0	107.6	L720	V718-L720 HydrophobicContact CG1-CD1 4.42Å; V718-L720 HydrophobicContact CG1-CG 4.46Å
719	L	24.3	Very low	29.9	Very low	167 Å²	167	146.6 Å²	146.6	87%	0.874	81%	0.809	S	S	*	*			trans	-89	130.2	172.3	-165.3	79.7	0	0	0	108.6
720	L	31.5	Very low	29.7	Very low	162 Å²	162	145.1 Å²	145.1	85%	0.848	81%	0.807	S	S	*	*			trans	-138.7	141.4	172.3	-96.8	168.4	0	0	0	110.2	V718	V718-L720 HydrophobicContact CG1-CD1 4.42Å; V718-L720 HydrophobicContact CG1-CG 4.46Å
721	Q	29.5	Very low	29.8	Very low	164 Å²	164	146 Å²	146	77%	0.766	80%	0.804	S	S	*	*			trans	-124.5	114.4	-158.6	174.3	-179.5	2.2	0	0	112.1
722	Q	28.2	Very low	29.7	Very low	156 Å²	156	148.4 Å²	148.4	73%	0.729	81%	0.807	S	S	*	*			trans	59.9	156.9	155	-108.4	171.5	6.7	0	0	117.6
723	P	33.7	Very low	29.8	Very low	129 Å²	129	148.1 Å²	148.1	84%	0.838	81%	0.805	S	S	*	*				-140	-172.5	67.9	37.2	-17.1	0	0	0	115.1
724	V	28	Very low	29.6	Very low	122 Å²	122	147.4 Å²	147.4	74%	0.739	80%	0.802	S	S	*	*			trans	-105.7	133.7	-165.7	172.8	0	0	0	0	113.3
725	G	30	Very low	29.9	Very low	67 Å²	67	152.5 Å²	152.5	69%	0.691	81%	0.805	S	S	*	*			trans	80.1	111.5	135.9	0	0	0	0	0	120.4
726	Q	32.9	Very low	29.6	Very low	199 Å²	199	153.6 Å²	153.6	93%	0.93	80%	0.799	S	S	*	*			trans	-134.4	157.7	146.4	-80.1	-167.9	-9.4	0	0	110.2
727	K	28.4	Very low	29.8	Very low	205 Å²	205	151.5 Å²	151.5	89%	0.891	80%	0.797	S	S	*	*			trans	-139.9	105.9	-161.7	176.2	-173.2	178.2	-178.8	0	110.9
728	V	32.4	Very low	30.3	Very low	127 Å²	127	148 Å²	148	77%	0.77	78%	0.779	S	S	*	*			trans	-136.2	117.4	-179.4	-177.7	0	0	0	0	112.5
729	Q	30.4	Very low	30.5	Very low	185 Å²	185	149.4 Å²	149.4	86%	0.864	78%	0.777	S	S	*	*			trans	33.4	135	150.7	-62.2	178.7	-11.6	0	0	122.9
730	V	24.3	Very low	31	Very low	129 Å²	129	148.3 Å²	148.3	78%	0.782	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-94.7	138.2	165.7	173.5	0	0	0	0	110.2	I732	V730-I732 HydrophobicContact CG1-CG1 4.3Å
731	P	34.7	Very low	31.1	Very low	114 Å²	114	150.4 Å²	150.4	74%	0.74	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-99	119	159.3	33.4	-25.6	0	0	0	111.4
732	I	28	Very low	31.4	Very low	161 Å²	161	149.3 Å²	149.3	83%	0.826	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-92	116.2	160.7	-64.9	172.9	0	0	0	107	V730	V730-I732 HydrophobicContact CG1-CG1 4.3Å
733	V	31.2	Very low	31.7	Very low	118 Å²	118	147.7 Å²	147.7	72%	0.715	76%	0.764	S	S	*	*			trans	-138.9	137.8	164.7	-174.8	0	0	0	0	109.9
734	E	27	Very low	31.6	Very low	168 Å²	168	147.5 Å²	147.5	79%	0.785	76%	0.76	S	S	*	*			trans	-95.6	172.2	-174.2	176.2	179.4	-146.9	0	0	112.1
735	R	31.1	Very low	31.9	Very low	210 Å²	210	146.2 Å²	146.2	79%	0.792	76%	0.756	S	S	*	*			trans	117.3	157.6	163.3	-65.8	159.3	-160.1	140.6	3.7	113.5
736	Q	29.8	Very low	31.9	Very low	149 Å²	149	149.1 Å²	149.1	70%	0.696	76%	0.761	S	S	*	*			cis	-179.2	172.1	-30.1	-178.6	160.3	-14	0	0	105.3
737	L	34.7	Very low	31.8	Very low	152 Å²	152	146.1 Å²	146.1	80%	0.796	76%	0.756	S	S	*	*			trans	98.1	141.5	167.6	-54.7	164.9	0	0	0	116
738	D	33.5	Very low	31.7	Very low	104 Å²	104	140.5 Å²	140.5	56%	0.556	75%	0.748	S	S	*	*				-167	177.2	-52.3	-119.3	-61	0	0	0	110.4
739	H	37.9	Very low	31.7	Very low	150 Å²	150	142.3 Å²	142.3	69%	0.694	75%	0.751	S	S	*	*			trans	81.2	114.1	159.7	-53.4	-53.9	0	0	0	120.9
740	E	34.9	Very low	31.8	Very low	144 Å²	144	137.6 Å²	137.6	67%	0.673	74%	0.739	S	S	*	*			trans	66.2	121.9	134.3	-66	-162	-171.5	0	0	119
741	R	32.6	Very low	32.1	Very low	205 Å²	205	140.9 Å²	140.9	77%	0.774	75%	0.746	S	S	*	*			cis	-155.8	171	22.3	-107.7	163.9	-147.9	-158.9	4	109.5
742	L	35	Very low	32	Very low	141 Å²	141	139.1 Å²	139.1	74%	0.738	75%	0.748	S	S	*	*			cis	-149	142.4	11.1	-119.7	172.9	0	0	0	108.9
743	V	34.4	Very low	32	Very low	123 Å²	123	136.9 Å²	136.9	75%	0.745	75%	0.747	S	S	*	*			trans	29.3	128.3	137.8	166.5	0	0	0	0	120
744	T	33.5	Very low	32	Very low	124 Å²	124	142.3 Å²	142.3	76%	0.761	76%	0.756	S	S	*	*			cis	-158.9	155.6	-1.5	-100.4	0	0	0	0	113.3
745	S	32.3	Very low	32.1	Very low	95 Å²	95	141.5 Å²	141.5	66%	0.664	76%	0.756	S	S	*	*			trans	-49.7	149.6	174.7	-66.8	0	0	0	0	116.6
746	T	30.4	Very low	32.3	Very low	129 Å²	129	136.6 Å²	136.6	79%	0.791	75%	0.751	S	S	*	*				70.5	130.3	59.1	-36.4	0	0	0	0	114.4
747	V	31.3	Very low	32.4	Very low	135 Å²	135	137.5 Å²	137.5	82%	0.818	76%	0.76	S	S	*	*			trans	167.8	143.1	132.3	154.6	0	0	0	0	109.4
748	A	27.1	Very low	32.4	Very low	87 Å²	87	136.8 Å²	136.8	72%	0.719	76%	0.756	S	S	*	*			trans	-123.1	163.7	171.6	0	0	0	0	0	109.2
749	I	32.2	Very low	32.6	Very low	165 Å²	165	137.6 Å²	137.6	85%	0.846	77%	0.767	S	S	*	*			trans	-164.8	152	154.6	-106.9	149.9	0	0	0	113.3
750	S	31	Very low	32.5	Very low	87 Å²	87	138.8 Å²	138.8	61%	0.608	77%	0.77	S	S	*	*			trans	-2	136.2	174.4	67.3	0	0	0	0	124
751	Q	31.8	Very low	32.6	Very low	197 Å²	197	141 Å²	141	92%	0.921	78%	0.78	S	S	*	*				45.4	133.2	121.3	-52.4	178	8	0	0	121.2
752	G	31.6	Very low	32.7	Very low	77 Å²	77	136 Å²	136	79%	0.794	78%	0.777	S	S	*	*			trans	165.7	115	159.5	0	0	0	0	0	113.6
753	S	29	Very low	32.7	Very low	114 Å²	114	135.7 Å²	135.7	80%	0.797	78%	0.781	S	S	*	*			trans	-79.4	143.2	169.2	-53.8	0	0	0	0	110.4
754	Y	30.6	Very low	32.8	Very low	233 Å²	233	136 Å²	136	91%	0.914	78%	0.783	S	S	*	*				175.7	151	123.8	-105.7	-82.3	0	0	0	111.6
755	I	29.8	Very low	33	Very low	150 Å²	150	135.3 Å²	135.3	77%	0.769	78%	0.781	S	S	*	*			trans	-101.8	163.4	165.8	-4.9	175	0	0	0	106.2
756	P	35.6	Very low	33.1	Very low	107 Å²	107	138.9 Å²	138.9	70%	0.695	79%	0.791	S	S	*	*			cis	-159.3	-166	44.5	45.1	-21.8	0	0	0	118.7
757	L	32.2	Very low	33.1	Very low	168 Å²	168	141.3 Å²	141.3	88%	0.88	79%	0.793	S	S	*	*			trans	90.6	164	147	-78	174.5	0	0	0	122.2
758	L	33.4	Very low	33.2	Very low	138 Å²	138	141.9 Å²	141.9	72%	0.723	80%	0.797	S	S	*	*			trans	-151.2	153	-153	-171.4	106.4	0	0	0	110.3
759	P	37.9	Very low	33.3	Very low	120 Å²	120	142.9 Å²	142.9	78%	0.779	80%	0.798	S	S	*	*			trans	-126.9	128.5	140.7	33.5	-21.9	0	0	0	111.2
760	K	36.6	Very low	33.3	Very low	175 Å²	175	140.1 Å²	140.1	76%	0.761	79%	0.789	S	S	*	*				78.3	99.2	58.6	-80.7	-166	173.1	-175.9	0	115.4
761	Q	37.6	Very low	33.3	Very low	190 Å²	190	144.5 Å²	144.5	89%	0.888	80%	0.797	S	S	*	*				170.7	126.8	125.1	-91.6	165.5	75.5	0	0	107.5
762	S	33.9	Very low	33.2	Very low	102 Å²	102	141.3 Å²	141.3	71%	0.713	79%	0.791	S	S	*	*			cis	95	107.9	32.7	-173.8	0	0	0	0	113.7
763	T	35.2	Very low	33.4	Very low	133 Å²	133	143.2 Å²	143.2	82%	0.816	79%	0.792	S	S	*	*				-176	167.1	113.2	-69	0	0	0	0	109
764	V	35.1	Very low	33.7	Very low	129 Å²	129	144.1 Å²	144.1	78%	0.782	79%	0.793	S	S	*	*			trans	-119	-160.2	-157.7	-147.1	0	0	0	0	112.2
765	P	38.5	Very low	34.2	Very low	110 Å²	110	138 Å²	138	71%	0.714	78%	0.782	S	S	*	*				-110.5	-173.3	-125.2	43.8	-29.2	0	0	0	114.6
766	I	33.7	Very low	34.4	Very low	171 Å²	171	138.1 Å²	138.1	88%	0.877	78%	0.783	S	S	*	*			trans	-163.2	157.6	137.8	-105.4	153.9	0	0	0	110.7
767	Q	31	Very low	34.3	Very low	179 Å²	179	138.7 Å²	138.7	84%	0.836	79%	0.785	S	S	*	*			trans	-88	157.5	175.9	-57.5	167.9	-89.9	0	0	111.4
768	V	33.1	Very low	34.5	Very low	148 Å²	148	136.3 Å²	136.3	90%	0.897	78%	0.782	S	S	*	*				-179.1	156	121.6	146.8	0	0	0	0	111
769	S	28.9	Very low	34.5	Very low	107 Å²	107	133.3 Å²	133.3	75%	0.748	77%	0.77	S	S	*	*			trans	-87.7	-169.8	-171.1	-174.8	0	0	0	0	113.7
770	V	33.3	Very low	34.3	Very low	107 Å²	107	137.8 Å²	137.8	65%	0.648	78%	0.777	S	S	*	*			trans	102.9	89.7	153.9	-168.2	0	0	0	0	118.9
771	K	30.8	Very low	34.2	Very low	180 Å²	180	135 Å²	135	78%	0.783	78%	0.775	S	S	*	*			trans	76	137.4	131.5	-64.3	177.7	-173.1	173.8	0	124.4
772	T	30.7	Very low	34.1	Very low	129 Å²	129	131 Å²	131	79%	0.791	77%	0.767	S	S	*	*			trans	81.5	151.5	134.5	45.1	0	0	0	0	124
773	S	35.2	Very low	34.3	Very low	117 Å²	117	131 Å²	131	82%	0.818	77%	0.768	S	S	*	*			trans	87.9	105.3	157.1	-44.5	0	0	0	0	119.8
774	T	33.8	Very low	34.3	Very low	134 Å²	134	130.3 Å²	130.3	82%	0.822	77%	0.768	S	S	*	*			trans	-89.9	-173.5	150.8	49.1	0	0	0	0	109.8
775	P	41.3	Very low	34.2	Very low	104 Å²	104	129.6 Å²	129.6	68%	0.675	77%	0.769	S	S	*	*			cis	-124.1	-168.1	-46.2	34	-16.3	0	0	0	111.3
776	L	34.1	Very low	34.1	Very low	153 Å²	153	132 Å²	132	80%	0.801	77%	0.774	S	S	*	*				168.3	116.9	125	-89.6	165.7	0	0	0	115.8
777	T	33.5	Very low	34.2	Very low	119 Å²	119	131.5 Å²	131.5	73%	0.73	77%	0.768	S	S	*	*			trans	19.3	128.3	133.3	-42.9	0	0	0	0	122.8
778	S	36.6	Very low	34.2	Very low	118 Å²	118	127.6 Å²	127.6	83%	0.825	76%	0.76	S	S	*	*				179.2	175.4	112.2	50.5	0	0	0	0	113.4
779	T	32.9	Very low	34.1	Very low	75 Å²	75	126.4 Å²	126.4	46%	0.46	75%	0.753	S	S	.	*			trans	-138.4	146.8	-156.7	-45.7	0	0	0	0	112.1	N920	T779-N920 PolarHBondContact OG1-ND2 3.48Å
780	F	34.2	Very low	34.2	Very low	213 Å²	213	126.2 Å²	126.2	93%	0.934	75%	0.752	S	S	*	*			trans	-143.7	169.7	156.1	-95.1	-70.5	0	0	0	112.2
781	V	35.5	Very low	34.1	Very low	118 Å²	118	127 Å²	127	72%	0.715	76%	0.758	S	S	*	*			trans	-142.4	145	-152.4	-172.5	0	0	0	0	111
782	S	35.7	Very low	34.2	Very low	104 Å²	104	123.2 Å²	123.2	73%	0.727	75%	0.753	S	S	*	*				158.2	146	127.6	-70.7	0	0	0	0	117.8
783	S	36.5	Very low	34.2	Very low	103 Å²	103	123 Å²	123	72%	0.72	75%	0.753	S	S	*	*			trans	69.1	115.6	137.3	60	0	0	0	0	124.3
784	S	36.9	Very low	34	Very low	119 Å²	119	123.9 Å²	123.9	83%	0.832	75%	0.753	S	S	*	*				92.1	146.8	126.1	68.2	0	0	0	0	121.4
785	S	31.3	Very low	33.9	Very low	113 Å²	113	126 Å²	126	79%	0.79	75%	0.753	S	S	*	*			trans	-110.2	167.5	-166.6	-32	0	0	0	0	112.2
786	I	36.4	Very low	33.3	Very low	160 Å²	160	126 Å²	126	82%	0.821	76%	0.756	S	S	*	*			trans	-173	135.9	134.5	-100.9	156.5	0	0	0	113.8
787	H	36.7	Very low	33.3	Very low	161 Å²	161	127.5 Å²	127.5	75%	0.745	76%	0.758	S	S	*	*			trans	25.9	118.1	158.5	-69.6	-68	0	0	0	126.1
788	S	30.4	Very low	33.2	Very low	97 Å²	97	129.2 Å²	129.2	68%	0.678	76%	0.763	S	S	*	*				80.2	145.7	114	-55.8	0	0	0	0	124
789	T	32	Very low	33.1	Very low	123 Å²	123	130.9 Å²	130.9	76%	0.755	76%	0.763	S	S	*	*			trans	102.8	77.7	145.2	-25	0	0	0	0	120.6
790	S	30.5	Very low	33.1	Very low	103 Å²	103	132.7 Å²	132.7	72%	0.72	78%	0.779	S	S	*	*				74.5	157.8	124.9	-54.2	0	0	0	0	124.2
791	T	30.9	Very low	33.2	Very low	125 Å²	125	128 Å²	128	77%	0.767	77%	0.769	S	S	*	*			trans	76.2	105.3	155.4	29.6	0	0	0	0	121.6
792	S	32	Very low	33.3	Very low	99 Å²	99	129.6 Å²	129.6	69%	0.692	78%	0.779	S	S	*	*				57.5	138	130	59.1	0	0	0	0	121
793	T	31	Very low	33.4	Very low	126 Å²	126	129.1 Å²	129.1	77%	0.773	77%	0.772	S	S	*	*			cis	-169.7	156	7.2	8.4	0	0	0	0	111.2
794	V	31.8	Very low	34.1	Very low	135 Å²	135	127.2 Å²	127.2	82%	0.818	76%	0.759	S	S	*	*			trans	57.9	143.1	169.9	-108.4	0	0	0	0	116.3
795	E	31.1	Very low	35.2	Very low	177 Å²	177	126.6 Å²	126.6	83%	0.827	75%	0.754	S	S	*	*			cis	-141.6	150.8	19.2	-62	-171.3	134	0	0	115.1
796	S	29.8	Very low	36.9	Very low	105 Å²	105	125.9 Å²	125.9	73%	0.734	74%	0.741	S	S	*	*			trans	43.7	92.6	138.8	-159.7	0	0	0	0	122.2
797	E	33	Very low	38.6	Very low	184 Å²	184	122.4 Å²	122.4	86%	0.86	72%	0.721	S	S	*	*			trans	-136.9	151.3	143.8	-85.2	-144.8	131.2	0	0	111.9
798	N	31.9	Very low	40.2	Very low	156 Å²	156	118 Å²	118	83%	0.834	71%	0.709	S	S	*	*			trans	-98.7	114.2	-173.3	-80	-90.3	0	0	0	112.5
799	N	35.4	Very low	41.8	Very low	153 Å²	153	117.7 Å²	117.7	82%	0.818	70%	0.699	S	S	*	*			trans	-130.2	124.7	165.2	-89	-62	0	0	0	111.3
800	S	31.7	Very low	44	Very low	113 Å²	113	116.7 Å²	116.7	79%	0.79	68%	0.684	S	S	*	*			trans	-90.5	128.1	-174.7	59.6	0	0	0	0	112.4
801	P	36.1	Very low	46.2	Very low	114 Å²	114	113.5 Å²	113.5	74%	0.74	66%	0.664	S	S	*	*			trans	-73.9	151.8	-177.7	30.1	-35.6	0	0	0	113.1	T803	P801-T803 PolarHBondContact O-N 2.99Å; P801-T803 VanDerWaalsContact O-N 3.09Å
802	V	37.4	Very low	48.2	Very low	152 Å²	152	113.3 Å²	113.3	92%	0.921	65%	0.653	S	S	*	*			trans	-71.4	100.7	175.8	179.4	0	0	0	0	109.9
803	T	39.2	Very low	50.1	Low	93 Å²	93	112.3 Å²	112.3	57%	0.571	64%	0.64	S	S	*	*			trans	-72.9	134.4	177.6	58.4	0	0	0	0	111.7	P801	P801-T803 PolarHBondContact O-N 2.99Å; P801-T803 VanDerWaalsContact O-N 3.09Å
804	S	49.8	Very low	52.1	Low	64 Å²	64	108.8 Å²	108.8	45%	0.448	62%	0.623	S	S	.	*			trans	-61.9	160.2	177.9	70	0	0	0	0	113.1	L806 E807 S808	S804-L806 PolarHBondContact O-N 2.83Å; S804-E807 PolarHBondContact O-N 3.36Å; S804-E807 PolarHBondContact OG-N 3.23Å; S804-S808 PolarHBondContact O-N 2.93Å; S804-S808 VanDerWaalsContact O-N 3.14Å
805	S	60.6	Low	54.2	Low	105 Å²	105	111 Å²	111	73%	0.734	62%	0.617	S	S	*	*	H	α-helix	trans	-58.6	-31.6	175	56	0	0	0	0	112.5	S808 L809	S805-S808 PolarHBondContact O-N 3.47Å; S805-L809 WeakPolarHBondContact O-CB 3.42Å; S805-L809 PolarHBondContact O-N 2.96Å
806	L	67.9	Low	56.1	Low	98 Å²	98	109.7 Å²	109.7	51%	0.513	60%	0.604	S	S	.	*	H	α-helix	trans	-65.6	-44	176.6	-175.9	63.4	0	0	0	112	S804 S808 L809 K810	S804-L806 PolarHBondContact O-N 2.83Å; L806-S808 VanDerWaalsContact C-N 3.35Å; L806-L809 PolarHBondContact O-N 3.39Å; L806-K810 HydrophobicContact CG-CD 4.36Å; L806-K810 WeakPolarHBondContact O-CB 3.44Å; L806-K810 WeakPolarHBondContact O-CG 3.39Å; L806-K810 PolarHBondContact O-N 3.17Å
807	E	70.6	Confident	58	Low	88 Å²	88	113.8 Å²	113.8	41%	0.411	60%	0.603	S	S	.	*	H	α-helix	trans	-68	-37	177	-121.9	52.8	-138.1	0	0	111.6	S804 L809 K810 A811	S804-E807 PolarHBondContact O-N 3.36Å; S804-E807 PolarHBondContact OG-N 3.23Å; E807-L809 VanDerWaalsContact C-N 3.34Å; E807-L809 PolarHBondContact O-N 3.03Å; E807-K810 WeakPolarHBondContact OE1-CD 3.34Å; E807-K810 WeakPolarHBondContact OE1-CE 3.33Å; E807-K810 IonicContact OE1-NZ 2.77Å; E807-K810 PolarHBondContact OE1-NZ 3.48Å; E807-K810 IonicContact OE2-NZ 2.69Å; E807-K810 PolarHBondContact OE2-NZ 3.23Å; E807-A811 VanDerWaalsContact O-CB 3.23Å; E807-A811 WeakPolarHBondContact O-CB 3.38Å; E807-A811 PolarHBondContact O-N 2.96Å
808	S	71.1	Confident	59.8	Low	68 Å²	68	109.2 Å²	109.2	48%	0.476	59%	0.588	S	S	.	*	H	α-helix	trans	-62.2	-38.3	169.9	-71	0	0	0	0	112.8	S804 S805 L806 F812	S804-S808 PolarHBondContact O-N 2.93Å; S804-S808 VanDerWaalsContact O-N 3.14Å; S805-S808 PolarHBondContact O-N 3.47Å; L806-S808 VanDerWaalsContact C-N 3.35Å; S808-F812 VanDerWaalsContact O-CB 3.32Å; S808-F812 WeakPolarHBondContact O-CB 3.26Å; S808-F812 PolarHBondContact O-N 3.05Å
809	L	64.2	Low	61.6	Low	91 Å²	91	104.5 Å²	104.5	48%	0.476	57%	0.568	S	S	.	*	H	α-helix	trans	-73.5	-42.6	178.1	-177.7	59.8	0	0	0	112.3	S805 L806 E807 F812 N813	S805-L809 WeakPolarHBondContact O-CB 3.42Å; S805-L809 PolarHBondContact O-N 2.96Å; L806-L809 PolarHBondContact O-N 3.39Å; E807-L809 VanDerWaalsContact C-N 3.34Å; E807-L809 PolarHBondContact O-N 3.03Å; L809-F812 PolarHBondContact O-N 2.91Å; L809-N813 WeakPolarHBondContact O-CB 3.47Å; L809-N813 VanDerWaalsContact O-CG 3.32Å; L809-N813 PolarHBondContact O-N 2.85Å
810	K	77.5	Confident	62.9	Low	102 Å²	102	101.2 Å²	101.2	44%	0.443	55%	0.549	S	S	.	.	H	α-helix	trans	-56.2	-49.8	170.3	-73.8	163.9	173.4	172.1	0	110.5	L806 E807 F812 N813 A814	L806-K810 HydrophobicContact CG-CD 4.36Å; L806-K810 WeakPolarHBondContact O-CB 3.44Å; L806-K810 WeakPolarHBondContact O-CG 3.39Å; L806-K810 PolarHBondContact O-N 3.17Å; E807-K810 WeakPolarHBondContact OE1-CD 3.34Å; E807-K810 WeakPolarHBondContact OE1-CE 3.33Å; E807-K810 IonicContact OE1-NZ 2.77Å; E807-K810 PolarHBondContact OE1-NZ 3.48Å; E807-K810 IonicContact OE2-NZ 2.69Å; E807-K810 PolarHBondContact OE2-NZ 3.23Å; K810-F812 VanDerWaalsContact C-N 3.34Å; K810-F812 PolarHBondContact O-N 3.19Å; K810-N813 PolarHBondContact O-N 3.21Å; K810-A814 WeakPolarHBondContact O-CB 3.35Å; K810-A814 PolarHBondContact O-N 2.99Å
811	A	76.6	Confident	64.4	Low	35 Å²	35	100.5 Å²	100.5	29%	0.289	54%	0.535	S	S	.	.	H	α-helix	trans	-63.7	-36.3	177.9	0	0	0	0	0	112.7	E807 R815	E807-A811 VanDerWaalsContact O-CB 3.23Å; E807-A811 WeakPolarHBondContact O-CB 3.38Å; E807-A811 PolarHBondContact O-N 2.96Å; A811-R815 WeakPolarHBondContact O-CB 3.35Å; A811-R815 WeakPolarHBondContact O-CD 3.35Å; A811-R815 WeakPolarHBondContact O-CG 3.5Å; A811-R815 PolarHBondContact O-N 3.17Å
812	F	74	Confident	65.7	Low	122 Å²	122	98.6 Å²	98.6	54%	0.535	53%	0.525	S	S	.	.	H	α-helix	trans	-65.8	-45.7	173.2	178.6	-97.4	0	0	0	111.9	S808 L809 K810 R815 R816	S808-F812 VanDerWaalsContact O-CB 3.32Å; S808-F812 WeakPolarHBondContact O-CB 3.26Å; S808-F812 PolarHBondContact O-N 3.05Å; L809-F812 PolarHBondContact O-N 2.91Å; K810-F812 VanDerWaalsContact C-N 3.34Å; K810-F812 PolarHBondContact O-N 3.19Å; F812-R815 PolarHBondContact O-N 2.74Å; F812-R816 WeakPolarHBondContact O-CB 3.42Å; F812-R816 PolarHBondContact O-N 3.25Å
813	N	71.3	Confident	66.7	Low	78 Å²	78	97.2 Å²	97.2	42%	0.417	51%	0.509	S	S	.	.	H	α-helix	trans	-67.3	-38.8	178.9	-72.1	-17.8	0	0	0	112	L809 K810 R816 R817	L809-N813 WeakPolarHBondContact O-CB 3.47Å; L809-N813 VanDerWaalsContact O-CG 3.32Å; L809-N813 PolarHBondContact O-N 2.85Å; K810-N813 PolarHBondContact O-N 3.21Å; N813-R816 PolarHBondContact O-N 3.21Å; N813-R817 PolarHBondContact O-N 3.03Å
814	A	73.7	Confident	67.5	Low	52 Å²	52	96.2 Å²	96.2	43%	0.43	50%	0.502	S	S	.	.	H	α-helix	trans	-61.5	-49.6	171.9	0	0	0	0	0	111.3	K810 R816 R817 T818	K810-A814 WeakPolarHBondContact O-CB 3.35Å; K810-A814 PolarHBondContact O-N 2.99Å; A814-R816 VanDerWaalsContact C-N 3.26Å; A814-R816 PolarHBondContact O-N 3.34Å; A814-R817 PolarHBondContact O-N 3.05Å; A814-T818 PolarHBondContact O-N 3.44Å; A814-T818 PolarHBondContact O-OG1 3.26Å
815	R	75.9	Confident	67.5	Low	180 Å²	180	97.3 Å²	97.3	68%	0.679	50%	0.503	S	S	*	.	H	α-helix	trans	-61.6	-31.6	174.7	-71	169.9	-163.9	178.6	7.8	112.8	A811 F812 T818 S819	A811-R815 WeakPolarHBondContact O-CB 3.35Å; A811-R815 WeakPolarHBondContact O-CD 3.35Å; A811-R815 WeakPolarHBondContact O-CG 3.5Å; A811-R815 PolarHBondContact O-N 3.17Å; F812-R815 PolarHBondContact O-N 2.74Å; R815-T818 PolarHBondContact O-OG1 2.76Å; R815-S819 WeakPolarHBondContact O-CB 3.26Å; R815-S819 PolarHBondContact O-N 3.19Å
816	R	71	Confident	67.4	Low	151 Å²	151	97.4 Å²	97.4	57%	0.57	49%	0.49	S	S	*	.	H	α-helix	trans	-70.9	-44	174	-172.3	173	179.4	169.1	-0.6	111.2	F812 N813 A814 S819 I820	F812-R816 WeakPolarHBondContact O-CB 3.42Å; F812-R816 PolarHBondContact O-N 3.25Å; N813-R816 PolarHBondContact O-N 3.21Å; A814-R816 VanDerWaalsContact C-N 3.26Å; A814-R816 PolarHBondContact O-N 3.34Å; R816-S819 PolarHBondContact O-N 2.78Å; R816-I820 HydrophobicContact CG-CD1 3.98Å; R816-I820 VanDerWaalsContact O-CG1 3.29Å; R816-I820 WeakPolarHBondContact O-CG1 3.32Å; R816-I820 PolarHBondContact O-N 3.38Å
817	R	68.7	Low	66.3	Low	190 Å²	190	101.6 Å²	101.6	72%	0.717	50%	0.499	S	S	*	.	H	α-helix	trans	-60.2	-50.5	173.6	-77.7	-177.8	170.7	178.2	-3.9	111.4	N813 A814 S819 I820 I821	N813-R817 PolarHBondContact O-N 3.03Å; A814-R817 PolarHBondContact O-N 3.05Å; R817-S819 VanDerWaalsContact C-N 3.33Å; R817-S819 PolarHBondContact O-N 2.9Å; R817-I820 PolarHBondContact O-N 3.08Å; R817-I821 WeakPolarHBondContact O-CG1 3.27Å; R817-I821 PolarHBondContact O-N 3.21Å
818	T	71.3	Confident	65.2	Low	88 Å²	88	100.5 Å²	100.5	54%	0.54	50%	0.496	S	S	.	.	H	α-helix	trans	-67.1	-30.9	178	60	0	0	0	0	113	A814 R815 S822	A814-T818 PolarHBondContact O-N 3.44Å; A814-T818 PolarHBondContact O-OG1 3.26Å; R815-T818 PolarHBondContact O-OG1 2.76Å; T818-S822 WeakPolarHBondContact O-CB 3.37Å; T818-S822 PolarHBondContact O-N 2.9Å
819	S	69.6	Low	64.1	Low	58 Å²	58	101.4 Å²	101.4	41%	0.406	50%	0.498	S	S	.	.	H	α-helix	trans	-72.1	-29.4	172.6	-175.1	0	0	0	0	113.4	R815 R816 R817 Q823	R815-S819 WeakPolarHBondContact O-CB 3.26Å; R815-S819 PolarHBondContact O-N 3.19Å; R816-S819 PolarHBondContact O-N 2.78Å; R817-S819 VanDerWaalsContact C-N 3.33Å; R817-S819 PolarHBondContact O-N 2.9Å; S819-Q823 WeakPolarHBondContact O-CB 3.35Å; S819-Q823 VanDerWaalsContact O-CG 3.25Å; S819-Q823 WeakPolarHBondContact O-CG 3.5Å; S819-Q823 PolarHBondContact O-N 3.41Å; S819-Q823 VanDerWaalsContact O-N 3.12Å
820	I	61.6	Low	63.1	Low	83 Å²	83	102.9 Å²	102.9	43%	0.426	50%	0.503	S	S	.	.	H	α-helix	trans	-74.3	-50	173.4	-70.8	165.9	0	0	0	109.1	R816 R817 S822 Q823 V824	R816-I820 HydrophobicContact CG-CD1 3.98Å; R816-I820 VanDerWaalsContact O-CG1 3.29Å; R816-I820 WeakPolarHBondContact O-CG1 3.32Å; R816-I820 PolarHBondContact O-N 3.38Å; R817-I820 PolarHBondContact O-N 3.08Å; I820-S822 VanDerWaalsContact C-N 3.29Å; I820-S822 PolarHBondContact O-N 2.79Å; I820-Q823 CarbonylContact O-C 3.59Å; I820-Q823 WeakPolarHBondContact O-CA 3.4Å; I820-Q823 PolarHBondContact O-N 3.08Å; I820-V824 HydrophobicContact CG2-CG2 4.36Å; I820-V824 WeakPolarHBondContact O-CG2 3.42Å; I820-V824 PolarHBondContact O-N 2.79Å
821	I	63.2	Low	61.3	Low	98 Å²	98	104.2 Å²	104.2	50%	0.503	52%	0.515	S	S	.	.	H	α-helix	trans	-56.8	-43.6	175.1	-65.2	163.9	0	0	0	110.3	R817 Q823 V824 N825	R817-I821 WeakPolarHBondContact O-CG1 3.27Å; R817-I821 PolarHBondContact O-N 3.21Å; I821-Q823 VanDerWaalsContact C-N 3.32Å; I821-Q823 PolarHBondContact O-N 3.3Å; I821-V824 PolarHBondContact O-N 3.46Å; I821-N825 VanDerWaalsContact O-CB 3.27Å; I821-N825 WeakPolarHBondContact O-CB 3.33Å; I821-N825 VanDerWaalsContact O-CG 3.28Å; I821-N825 PolarHBondContact O-N 3.21Å; I821-N825 PolarHBondContact O-OD1 2.87Å
822	S	63.6	Low	59.5	Low	74 Å²	74	105.8 Å²	105.8	52%	0.517	52%	0.524	S	S	.	.	H	α-helix	trans	-66.7	-28	175.7	177.6	0	0	0	0	113.5	T818 I820 K826	T818-S822 WeakPolarHBondContact O-CB 3.37Å; T818-S822 PolarHBondContact O-N 2.9Å; I820-S822 VanDerWaalsContact C-N 3.29Å; I820-S822 PolarHBondContact O-N 2.79Å; S822-K826 WeakPolarHBondContact O-CB 3.48Å; S822-K826 PolarHBondContact O-N 3.23Å
823	Q	58.9	Low	57.7	Low	124 Å²	124	106.9 Å²	106.9	58%	0.579	53%	0.534	S	S	*	.	H	α-helix	trans	-80.4	-34.1	173.9	-79.1	176.9	3.9	0	0	112.8	S819 I820 I821 R827	S819-Q823 WeakPolarHBondContact O-CB 3.35Å; S819-Q823 VanDerWaalsContact O-CG 3.25Å; S819-Q823 WeakPolarHBondContact O-CG 3.5Å; S819-Q823 PolarHBondContact O-N 3.41Å; S819-Q823 VanDerWaalsContact O-N 3.12Å; I820-Q823 CarbonylContact O-C 3.59Å; I820-Q823 WeakPolarHBondContact O-CA 3.4Å; I820-Q823 PolarHBondContact O-N 3.08Å; I821-Q823 VanDerWaalsContact C-N 3.32Å; I821-Q823 PolarHBondContact O-N 3.3Å; Q823-R827 WeakPolarHBondContact O-CB 3.26Å; Q823-R827 WeakPolarHBondContact O-CG 3.24Å; Q823-R827 PolarHBondContact O-N 3.05Å; Q823-R827 VanDerWaalsContact O-N 3.09Å
824	V	57.3	Low	56	Low	72 Å²	72	110.9 Å²	110.9	44%	0.436	55%	0.554	S	S	.	*	H	α-helix	trans	-67.4	-58.3	171.9	172.2	0	0	0	0	109.1	I820 I821 K826 R827 L828	I820-V824 HydrophobicContact CG2-CG2 4.36Å; I820-V824 WeakPolarHBondContact O-CG2 3.42Å; I820-V824 PolarHBondContact O-N 2.79Å; I821-V824 PolarHBondContact O-N 3.46Å; V824-K826 VanDerWaalsContact C-N 3.26Å; V824-K826 PolarHBondContact O-N 3.27Å; V824-R827 CarbonylContact O-C 3.45Å; V824-R827 WeakPolarHBondContact O-CA 3.46Å; V824-R827 WeakPolarHBondContact O-CB 3.35Å; V824-R827 PolarHBondContact O-N 2.87Å; V824-L828 HydrophobicContact CG1-CD1 3.86Å; V824-L828 HydrophobicContact CG1-CG 4.36Å; V824-L828 WeakPolarHBondContact O-CG 3.41Å; V824-L828 PolarHBondContact O-N 2.85Å
825	N	49.8	Very low	54	Low	87 Å²	87	114 Å²	114	47%	0.465	57%	0.568	S	S	.	*	H	α-helix	trans	-56.6	-39.3	177.8	-68.2	31.3	0	0	0	111.8	I821 R827 L828 T829	I821-N825 VanDerWaalsContact O-CB 3.27Å; I821-N825 WeakPolarHBondContact O-CB 3.33Å; I821-N825 VanDerWaalsContact O-CG 3.28Å; I821-N825 PolarHBondContact O-N 3.21Å; I821-N825 PolarHBondContact O-OD1 2.87Å; N825-R827 PolarHBondContact O-N 3.43Å; N825-L828 PolarHBondContact O-N 2.98Å; N825-T829 WeakPolarHBondContact O-CG2 3.44Å; N825-T829 PolarHBondContact O-N 2.82Å; N825-T829 PolarHBondContact O-OG1 3.24Å; N825-T829 VanDerWaalsContact O-OG1 3.04Å
826	K	58.1	Low	52.1	Low	107 Å²	107	115.3 Å²	115.3	47%	0.465	58%	0.579	S	S	.	*	H	α-helix	trans	-65.4	-38.4	175.8	-174.2	168.1	-174.2	-68.2	0	112.4	S822 V824 T829 E830	S822-K826 WeakPolarHBondContact O-CB 3.48Å; S822-K826 PolarHBondContact O-N 3.23Å; V824-K826 VanDerWaalsContact C-N 3.26Å; V824-K826 PolarHBondContact O-N 3.27Å; K826-T829 WeakPolarHBondContact CA-OG1 3.4Å; K826-T829 PolarHBondContact O-OG1 3.16Å; K826-T829 VanDerWaalsContact O-OG1 3.13Å; K826-E830 HydrophobicContact CG-CG 4.43Å; K826-E830 IonicContact NZ-OE1 3.14Å; K826-E830 PolarHBondContact NZ-OE1 3.34Å; K826-E830 IonicContact NZ-OE2 3.34Å; K826-E830 PolarHBondContact NZ-OE2 2.93Å; K826-E830 VanDerWaalsContact O-CB 3.31Å; K826-E830 WeakPolarHBondContact O-CB 3.32Å; K826-E830 VanDerWaalsContact O-CG 3.3Å; K826-E830 WeakPolarHBondContact O-CG 3.43Å; K826-E830 PolarHBondContact O-N 3.01Å
827	R	44.9	Very low	50.2	Low	186 Å²	186	117.1 Å²	117.1	70%	0.702	59%	0.594	S	S	*	*	H	α-helix	trans	-67.7	-35.3	172.9	-78.8	176.3	169	-169.5	-4.4	112.7	Q823 V824 N825 N831	Q823-R827 WeakPolarHBondContact O-CB 3.26Å; Q823-R827 WeakPolarHBondContact O-CG 3.24Å; Q823-R827 PolarHBondContact O-N 3.05Å; Q823-R827 VanDerWaalsContact O-N 3.09Å; V824-R827 CarbonylContact O-C 3.45Å; V824-R827 WeakPolarHBondContact O-CA 3.46Å; V824-R827 WeakPolarHBondContact O-CB 3.35Å; V824-R827 PolarHBondContact O-N 2.87Å; N825-R827 PolarHBondContact O-N 3.43Å; R827-N831 WeakPolarHBondContact O-CB 3.48Å; R827-N831 PolarHBondContact O-N 3.46Å; R827-N831 PolarHBondContact O-ND2 3.32Å; R827-N831 PolarHBondContact O-OD1 2.98Å
828	L	47	Very low	48.4	Very low	65 Å²	65	116 Å²	116	34%	0.34	60%	0.601	S	S	.	*	H	α-helix	trans	-68.5	-49.6	174	-64.3	171.9	0	0	0	110.4	V824 N825 E830 N831 S832	V824-L828 HydrophobicContact CG1-CD1 3.86Å; V824-L828 HydrophobicContact CG1-CG 4.36Å; V824-L828 WeakPolarHBondContact O-CG 3.41Å; V824-L828 PolarHBondContact O-N 2.85Å; N825-L828 PolarHBondContact O-N 2.98Å; L828-E830 VanDerWaalsContact C-N 3.28Å; L828-E830 PolarHBondContact O-N 3.26Å; L828-N831 CarbonylContact O-C 3.47Å; L828-N831 WeakPolarHBondContact O-CA 3.47Å; L828-N831 PolarHBondContact O-N 3.01Å; L828-S832 WeakPolarHBondContact O-CB 3.33Å; L828-S832 PolarHBondContact O-N 3.39Å
829	T	47	Very low	46.6	Very low	86 Å²	86	120.5 Å²	120.5	53%	0.528	62%	0.616	S	S	.	*	H	α-helix	trans	-66.1	-24.7	177.1	57.7	0	0	0	0	114.3	N825 K826 N831 I833	N825-T829 WeakPolarHBondContact O-CG2 3.44Å; N825-T829 PolarHBondContact O-N 2.82Å; N825-T829 PolarHBondContact O-OG1 3.24Å; N825-T829 VanDerWaalsContact O-OG1 3.04Å; K826-T829 WeakPolarHBondContact CA-OG1 3.4Å; K826-T829 PolarHBondContact O-OG1 3.16Å; K826-T829 VanDerWaalsContact O-OG1 3.13Å; T829-N831 VanDerWaalsContact C-N 3.32Å; T829-I833 VanDerWaalsContact O-CD1 3.29Å; T829-I833 WeakPolarHBondContact O-CD1 3.3Å; T829-I833 WeakPolarHBondContact O-CG1 3.44Å
830	E	43.3	Very low	44.9	Very low	123 Å²	123	122.7 Å²	122.7	58%	0.575	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.5	-9.7	172	-73.1	179.1	144	0	0	112.9	K826 L828	K826-E830 HydrophobicContact CG-CG 4.43Å; K826-E830 IonicContact NZ-OE1 3.14Å; K826-E830 PolarHBondContact NZ-OE1 3.34Å; K826-E830 IonicContact NZ-OE2 3.34Å; K826-E830 PolarHBondContact NZ-OE2 2.93Å; K826-E830 VanDerWaalsContact O-CB 3.31Å; K826-E830 WeakPolarHBondContact O-CB 3.32Å; K826-E830 VanDerWaalsContact O-CG 3.3Å; K826-E830 WeakPolarHBondContact O-CG 3.43Å; K826-E830 PolarHBondContact O-N 3.01Å; L828-E830 VanDerWaalsContact C-N 3.28Å; L828-E830 PolarHBondContact O-N 3.26Å
831	N	39.8	Very low	43.5	Very low	129 Å²	129	128.3 Å²	128.3	69%	0.69	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.6	-20.8	174.8	-70.2	-3.9	0	0	0	113.7	R827 L828 T829 I833	R827-N831 WeakPolarHBondContact O-CB 3.48Å; R827-N831 PolarHBondContact O-N 3.46Å; R827-N831 PolarHBondContact O-ND2 3.32Å; R827-N831 PolarHBondContact O-OD1 2.98Å; L828-N831 CarbonylContact O-C 3.47Å; L828-N831 WeakPolarHBondContact O-CA 3.47Å; L828-N831 PolarHBondContact O-N 3.01Å; T829-N831 VanDerWaalsContact C-N 3.32Å; N831-I833 VanDerWaalsContact C-N 3.35Å; N831-I833 PolarHBondContact O-N 3.46Å
832	S	40.1	Very low	42.1	Very low	69 Å²	69	129.2 Å²	129.2	48%	0.483	67%	0.665	S	S	.	*	T	Hydrogen-bonded Turn	trans	-86.9	8.1	-170.7	-168.5	0	0	0	0	114.6	L828	L828-S832 WeakPolarHBondContact O-CB 3.33Å; L828-S832 PolarHBondContact O-N 3.39Å
833	I	36.6	Very low	40.7	Very low	144 Å²	144	130 Å²	130	74%	0.738	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97	11.4	-174.2	-59.4	176.2	0	0	0	112.2	T829 N831	T829-I833 VanDerWaalsContact O-CD1 3.29Å; T829-I833 WeakPolarHBondContact O-CD1 3.3Å; T829-I833 WeakPolarHBondContact O-CG1 3.44Å; N831-I833 VanDerWaalsContact C-N 3.35Å; N831-I833 PolarHBondContact O-N 3.46Å
834	L	33.9	Very low	39.3	Very low	162 Å²	162	130.4 Å²	130.4	85%	0.848	68%	0.681	S	S	*	*	S	Bend	trans	-125.3	37.7	-172.4	-77.1	172.8	0	0	0	115.5
835	T	32.4	Very low	38.1	Very low	118 Å²	118	133.8 Å²	133.8	72%	0.724	70%	0.696	S	S	*	*			trans	-140.9	42.5	175.9	45	0	0	0	0	114.7
836	K	35	Very low	37.1	Very low	207 Å²	207	135.3 Å²	135.3	90%	0.9	71%	0.708	S	S	*	*			trans	-143	72.8	169.1	-73.4	-164.6	177.1	179.7	0	114.9
837	E	32.3	Very low	36.1	Very low	190 Å²	190	135.2 Å²	135.2	89%	0.888	72%	0.719	S	S	*	*			trans	-166.9	157	140.9	-116.7	-173.5	167.7	0	0	112
838	L	31.6	Very low	35.4	Very low	166 Å²	166	134 Å²	134	87%	0.869	72%	0.724	S	S	*	*			trans	98.7	78.1	173.4	-61.8	170.8	0	0	0	119.3
839	Q	32	Very low	34.7	Very low	183 Å²	183	135.5 Å²	135.5	86%	0.855	74%	0.74	S	S	*	*			trans	177	150.9	135.5	-100	-179.3	7.9	0	0	108.9
840	S	34.9	Very low	34	Very low	104 Å²	104	137.3 Å²	137.3	73%	0.727	75%	0.747	S	S	*	*			cis	-160	150.4	-47.3	42	0	0	0	0	108.9
841	K	32.3	Very low	33.6	Very low	200 Å²	200	138 Å²	138	87%	0.87	75%	0.754	S	S	*	*			trans	-34.5	154.8	174.3	-108.9	171.7	-176.4	173.3	0	116.6
842	P	34	Very low	33.4	Very low	117 Å²	117	139 Å²	139	76%	0.76	76%	0.759	S	S	*	*				-149.5	163.4	83.3	40.8	-23.3	0	0	0	120.1
843	S	32.7	Very low	33.3	Very low	91 Å²	91	140.9 Å²	140.9	64%	0.636	77%	0.769	S	S	*	*			trans	67.6	98	142.9	56.4	0	0	0	0	125.1
844	T	29.6	Very low	33.4	Very low	132 Å²	132	139.2 Å²	139.2	81%	0.81	77%	0.768	S	S	*	*				80	151.2	113.7	-32.7	0	0	0	0	122.8
845	I	32.3	Very low	33.3	Very low	143 Å²	143	136.9 Å²	136.9	73%	0.733	77%	0.766	S	S	*	*			trans	93.9	76.8	163.5	-44.9	-176.2	0	0	0	118.5
846	T	30.5	Very low	33.1	Very low	119 Å²	119	141 Å²	141	73%	0.73	77%	0.769	S	S	*	*				17.3	167	116.5	46.6	0	0	0	0	122.6
847	P	35.4	Very low	33	Very low	106 Å²	106	139.3 Å²	139.3	69%	0.688	77%	0.768	S	S	*	*			cis	-139.7	-163	-2.3	23.9	3.9	0	0	0	115.3
848	I	31.4	Very low	32.8	Very low	159 Å²	159	136 Å²	136	82%	0.815	76%	0.761	S	S	*	*			trans	78.8	126.4	156.3	-50.2	-172.3	0	0	0	116.8
849	S	31	Very low	32.6	Very low	97 Å²	97	133.7 Å²	133.7	68%	0.678	76%	0.759	S	S	*	*			cis	-166	176.6	-17.8	-164.9	0	0	0	0	111.7
850	N	33.6	Very low	32.7	Very low	124 Å²	124	129.5 Å²	129.5	66%	0.663	76%	0.756	S	S	*	*			trans	85.5	97.2	156	-61.6	-4.6	0	0	0	119.8
851	N	34.8	Very low	32.4	Very low	137 Å²	137	132.2 Å²	132.2	73%	0.733	76%	0.762	S	S	*	*				70.6	145.5	125	-52.5	-14.7	0	0	0	120.7
852	L	34.5	Very low	32.6	Very low	151 Å²	151	128.7 Å²	128.7	79%	0.791	76%	0.759	S	S	*	*			cis	-170.2	129.9	-35.6	-143.2	82.8	0	0	0	106.8
853	P	39.1	Very low	32.3	Very low	108 Å²	108	128.5 Å²	128.5	70%	0.701	76%	0.759	S	S	*	*			trans	-91.3	-160.9	157.2	41.3	-35.3	0	0	0	108.3
854	P	38.1	Very low	32.1	Very low	110 Å²	110	130.2 Å²	130.2	71%	0.714	77%	0.767	S	S	*	*			cis	-127	-165.4	-14.5	42.2	-26.4	0	0	0	111.8
855	S	32.8	Very low	32	Very low	113 Å²	113	129.4 Å²	129.4	79%	0.79	76%	0.761	S	S	*	*				174.7	155.5	119	59.6	0	0	0	0	115.2
856	Y	27.3	Very low	31.8	Very low	205 Å²	205	131.4 Å²	131.4	80%	0.804	77%	0.765	S	S	*	*			trans	-65	164.1	177.8	-57.6	-102.8	0	0	0	115.3
857	I	32.8	Very low	31.8	Very low	170 Å²	170	130.8 Å²	130.8	87%	0.872	77%	0.765	S	S	*	*				-172.8	164.5	113.2	-94.6	159.3	0	0	0	111
858	T	27.7	Very low	31.7	Very low	122 Å²	122	131 Å²	131	75%	0.748	77%	0.769	S	S	*	*			trans	-114.9	161.1	-158.7	-45.5	0	0	0	0	113.8
859	S	28.7	Very low	31.9	Very low	116 Å²	116	130.5 Å²	130.5	81%	0.811	77%	0.768	S	S	*	*			trans	97.7	170.6	150	84.8	0	0	0	0	120.1
860	A	34.4	Very low	32	Very low	96 Å²	96	131.2 Å²	131.2	79%	0.793	77%	0.773	S	S	*	*			trans	80.3	109.2	178.3	0	0	0	0	0	119.6
861	N	28	Very low	32	Very low	161 Å²	161	130.6 Å²	130.6	86%	0.861	78%	0.779	S	S	*	*			trans	-77.9	167.9	149.6	-85.9	-30.9	0	0	0	109
862	P	35.5	Very low	31.9	Very low	125 Å²	125	131 Å²	131	81%	0.812	78%	0.78	S	S	*	*			cis	-145.2	-160.3	34.6	42.9	-20.8	0	0	0	116.5
863	C	27.9	Very low	31.9	Very low	113 Å²	113	131.8 Å²	131.8	76%	0.764	78%	0.779	S	S	*	*			trans	-60.1	147.3	-176.2	-52.2	0	0	0	0	115.6
864	T	29	Very low	31.5	Very low	128 Å²	128	133 Å²	133	79%	0.785	78%	0.779	S	S	*	*				-179.4	148.7	109.7	27.5	0	0	0	0	114.8
865	T	28.1	Very low	31.1	Very low	114 Å²	114	134.9 Å²	134.9	70%	0.699	78%	0.782	S	S	*	*			trans	48	130.6	148	57	0	0	0	0	124.9
866	K	28	Very low	31.1	Very low	186 Å²	186	138.6 Å²	138.6	81%	0.809	79%	0.787	S	S	*	*				76.8	105.8	129.7	-73.3	177.5	179.7	178.3	0	122.6
867	S	29.6	Very low	31.5	Very low	106 Å²	106	133 Å²	133	74%	0.741	78%	0.783	S	S	*	*				54.3	121.9	122.9	65.8	0	0	0	0	123.3
868	S	34.8	Very low	31.5	Very low	109 Å²	109	132.1 Å²	132.1	76%	0.762	78%	0.778	S	S	*	*			trans	173.7	158.2	137.3	39.4	0	0	0	0	110.1
869	N	34.6	Very low	31.8	Very low	149 Å²	149	132.7 Å²	132.7	80%	0.797	78%	0.777	S	S	*	*			cis	-162.4	172.1	-23.1	-103.9	-15.9	0	0	0	111
870	S	33.5	Very low	32.2	Very low	113 Å²	113	132.9 Å²	132.9	79%	0.79	77%	0.769	S	S	*	*			trans	73.3	145.4	161.4	74.1	0	0	0	0	119.1
871	S	33.2	Very low	32.1	Very low	111 Å²	111	135.9 Å²	135.9	78%	0.776	77%	0.766	S	S	*	*			cis	-159.8	165.3	-23.4	-78.8	0	0	0	0	106.2
872	I	33	Very low	32.3	Very low	146 Å²	146	134.1 Å²	134.1	75%	0.749	76%	0.762	S	S	*	*			cis	-154.1	145.8	38.4	-72.6	175.5	0	0	0	110.1
873	Q	33.9	Very low	32	Very low	167 Å²	167	135.3 Å²	135.3	78%	0.78	76%	0.761	S	S	*	*			trans	6.8	161.8	145.1	-45.2	172.9	-7.4	0	0	121.6
874	L	30.9	Very low	32.3	Very low	134 Å²	134	135.8 Å²	135.8	70%	0.702	76%	0.76	S	S	*	*			cis	-161.2	131.8	21.2	-164.2	69.4	0	0	0	115.4
875	L	29	Very low	32.3	Very low	149 Å²	149	135.7 Å²	135.7	78%	0.78	76%	0.76	S	S	*	*			trans	40.9	160.4	146.1	-57.7	173.2	0	0	0	127.6
876	Q	34.1	Very low	32.7	Very low	191 Å²	191	138.6 Å²	138.6	89%	0.893	77%	0.769	S	S	*	*			trans	84.9	140.3	159.2	-56.8	-172.8	-18.2	0	0	119.7
877	A	34.1	Very low	32.8	Very low	87 Å²	87	137.4 Å²	137.4	72%	0.719	76%	0.764	S	S	*	*			cis	-162.6	134	-24.9	0	0	0	0	0	113.4
878	I	32.5	Very low	33.2	Very low	151 Å²	151	135.9 Å²	135.9	77%	0.774	77%	0.765	S	S	*	*			trans	27.1	120.8	138.2	-54.2	168.4	0	0	0	121.8
879	D	35.8	Very low	33	Very low	135 Å²	135	136.4 Å²	136.4	72%	0.722	76%	0.759	S	S	*	*				173.2	127	122.1	-99.2	-32.2	0	0	0	109.8
880	N	35.5	Very low	33	Very low	120 Å²	120	138 Å²	138	64%	0.642	76%	0.762	S	S	*	*				65.9	142.4	80.5	-74.6	-38.7	0	0	0	116
881	Q	33	Very low	33	Very low	158 Å²	158	135.9 Å²	135.9	74%	0.738	75%	0.751	S	S	*	*			cis	-172.4	-177.5	-31.7	-126.8	-169.8	93.1	0	0	108.6
882	T	31.5	Very low	32.7	Very low	124 Å²	124	135.9 Å²	135.9	76%	0.761	75%	0.751	S	S	*	*			trans	65.6	158.5	166.8	56.8	0	0	0	0	120.3
883	L	30.8	Very low	32.6	Very low	151 Å²	151	134.4 Å²	134.4	79%	0.791	75%	0.748	S	S	*	*			cis	-166.5	179.6	-38.6	-154.6	62.1	0	0	0	110.7
884	T	34.2	Very low	32.5	Very low	123 Å²	123	133.1 Å²	133.1	76%	0.755	75%	0.747	S	S	*	*			trans	72	105.4	155.1	48.4	0	0	0	0	122.6
885	T	28.2	Very low	32.2	Very low	126 Å²	126	133.8 Å²	133.8	77%	0.773	75%	0.751	S	S	*	*			trans	-36.1	146	143.5	-47.3	0	0	0	0	117
886	I	37.3	Very low	32.4	Very low	174 Å²	174	134.8 Å²	134.8	89%	0.892	76%	0.755	S	S	*	*			trans	-131.9	144.9	142.8	-64.8	-175.9	0	0	0	108.4
887	K	28.7	Very low	32.1	Very low	161 Å²	161	133.7 Å²	133.7	70%	0.7	75%	0.75	S	S	*	*			trans	-124.5	149.7	178.9	-169.2	-174.8	-175.6	-99.6	0	109	D889	K887-D889 IonicContact NZ-OD1 2.9Å; K887-D889 PolarHBondContact NZ-OD1 2.86Å; K887-D889 IonicContact NZ-OD2 3.36Å; K887-D889 PolarHBondContact NZ-OD2 2.86Å
888	G	37.5	Very low	31.9	Very low	74 Å²	74	134.7 Å²	134.7	76%	0.763	75%	0.752	S	S	*	*			trans	-162.1	121	174	0	0	0	0	0	111.2
889	D	31.7	Very low	31.8	Very low	120 Å²	120	136.3 Å²	136.3	64%	0.642	75%	0.753	S	S	*	*			trans	-98.8	165.4	178	-57	-81.2	0	0	0	110	K887	K887-D889 IonicContact NZ-OD1 2.9Å; K887-D889 PolarHBondContact NZ-OD1 2.86Å; K887-D889 IonicContact NZ-OD2 3.36Å; K887-D889 PolarHBondContact NZ-OD2 2.86Å
890	E	34	Very low	31.3	Very low	184 Å²	184	134.3 Å²	134.3	86%	0.86	75%	0.75	S	S	*	*			trans	171.7	170.3	138.2	-97	-54.6	143.1	0	0	114.2
891	A	33.9	Very low	30.9	Very low	68 Å²	68	135.8 Å²	135.8	56%	0.562	76%	0.756	S	S	*	*			trans	-29.4	144.4	-177.2	0	0	0	0	0	118.9
892	S	26.5	Very low	30.7	Very low	110 Å²	110	133.9 Å²	133.9	77%	0.769	76%	0.755	S	S	*	*			cis	82.8	162.5	33.1	94.8	0	0	0	0	116.1
893	V	31.6	Very low	30.4	Very low	115 Å²	115	134.9 Å²	134.9	70%	0.697	76%	0.756	S	S	*	*			trans	89.3	105.9	172.4	-167.9	0	0	0	0	119.7
894	N	31.5	Very low	30.2	Very low	141 Å²	141	132.1 Å²	132.1	75%	0.754	75%	0.749	S	S	*	*			trans	63.9	121.8	141.7	-59.2	-9.2	0	0	0	125.9
895	N	25.5	Very low	29.9	Very low	148 Å²	148	133 Å²	133	79%	0.791	75%	0.754	S	S	*	*				4.6	140	121.5	-67.5	-32.9	0	0	0	119.7
896	I	33.1	Very low	30.2	Very low	169 Å²	169	133 Å²	133	87%	0.867	76%	0.756	S	S	*	*				-171.1	158.8	110.8	-98.9	160.2	0	0	0	112.8
897	H	28.1	Very low	29.9	Very low	169 Å²	169	130.5 Å²	130.5	78%	0.782	75%	0.754	S	S	*	*			trans	-71.4	149.8	176.9	-86.9	58.6	0	0	0	114.6
898	S	29.8	Very low	29.9	Very low	108 Å²	108	130.3 Å²	130.3	76%	0.755	76%	0.761	S	S	*	*				164.1	115.7	124.1	-77.7	0	0	0	0	111
899	K	29.1	Very low	29.7	Very low	184 Å²	184	131.4 Å²	131.4	80%	0.8	76%	0.757	S	S	*	*				77.3	105.8	84.2	-80.4	-171.4	175.4	-178.3	0	116.1
900	S	25.9	Very low	29.8	Very low	94 Å²	94	132.3 Å²	132.3	66%	0.657	76%	0.762	S	S	*	*				73.3	142.8	129.4	66.7	0	0	0	0	122.8
901	I	27.5	Very low	29.7	Very low	150 Å²	150	129.7 Å²	129.7	77%	0.769	75%	0.754	S	S	*	*			trans	75.3	140.5	158	-62.4	150.9	0	0	0	112.7
902	T	28.6	Very low	29.5	Very low	118 Å²	118	132.7 Å²	132.7	72%	0.724	76%	0.759	S	S	*	*			cis	-144.7	170.6	27.1	-17.7	0	0	0	0	115
903	L	25.7	Very low	29.5	Very low	146 Å²	146	138.3 Å²	138.3	76%	0.764	76%	0.764	S	S	*	*			trans	-21.6	136	153	-81.4	70.1	0	0	0	115.8
904	S	25.8	Very low	29.4	Very low	93 Å²	93	138.1 Å²	138.1	65%	0.65	77%	0.768	S	S	*	*				84.9	124.1	52.6	83.3	0	0	0	0	116.3
905	T	28.2	Very low	29.2	Very low	142 Å²	142	136.3 Å²	136.3	87%	0.871	77%	0.766	S	S	*	*			trans	-178.3	154	130.5	22.2	0	0	0	0	111.7
906	P	33.7	Very low	29.4	Very low	125 Å²	125	136.5 Å²	136.5	81%	0.812	77%	0.766	S	S	*	*			trans	-108.7	175.9	175.6	40.9	-33.5	0	0	0	113.1
907	S	32.6	Very low	29	Very low	121 Å²	121	137.7 Å²	137.7	85%	0.846	76%	0.764	S	S	*	*			trans	-131.7	137.2	166.9	52.3	0	0	0	0	113
908	N	27.8	Very low	29.1	Very low	157 Å²	157	136.9 Å²	136.9	84%	0.84	77%	0.771	S	S	*	*			trans	-81.7	159.1	-178.1	-85.1	-31	0	0	0	112.7
909	S	33.4	Very low	29	Very low	98 Å²	98	136.4 Å²	136.4	69%	0.685	77%	0.768	S	S	*	*				177.3	131.9	106.6	41.4	0	0	0	0	115
910	N	33.5	Very low	29.2	Very low	139 Å²	139	132.6 Å²	132.6	74%	0.743	76%	0.756	S	S	*	*			trans	58.5	149.2	133.1	-55.5	-7.2	0	0	0	121.6
911	N	32.4	Very low	29.6	Very low	129 Å²	129	135 Å²	135	69%	0.69	76%	0.762	S	S	*	*			cis	-167.8	154.5	-32.5	-113	-19.5	0	0	0	110.7
912	L	29.2	Very low	29.9	Very low	130 Å²	130	135.7 Å²	135.7	68%	0.681	76%	0.762	S	S	*	*			trans	53.3	105.8	146.3	-62	170.3	0	0	0	122.5
913	W	26.1	Very low	30	Very low	229 Å²	229	134.7 Å²	134.7	87%	0.867	76%	0.757	S	S	*	*				77.1	143.4	118.4	-79.4	29.7	0	0	0	123.8
914	S	30.3	Very low	30.1	Very low	110 Å²	110	135 Å²	135	77%	0.769	76%	0.758	S	S	*	*			trans	71.6	154.4	157.1	79.7	0	0	0	0	118.4
915	S	28.1	Very low	30.3	Very low	103 Å²	103	138.6 Å²	138.6	72%	0.72	77%	0.768	S	S	*	*			cis	-167.9	152.7	-26.8	-100.1	0	0	0	0	111.1
916	I	28.2	Very low	30.2	Very low	153 Å²	153	136.6 Å²	136.6	79%	0.785	76%	0.756	S	S	*	*			trans	75.2	112.4	159.2	-60.9	155	0	0	0	119.8
917	K	25.8	Very low	29.9	Very low	193 Å²	193	137.4 Å²	137.4	84%	0.839	76%	0.759	S	S	*	*			trans	28	133.9	144.1	-60.7	-179.3	175.6	-179.6	0	122.8
918	V	29.5	Very low	29.6	Very low	152 Å²	152	136.1 Å²	136.1	92%	0.921	75%	0.75	S	S	*	*				-167.9	165.5	109	144.4	0	0	0	0	109.7
919	S	28.5	Very low	29.7	Very low	99 Å²	99	135.6 Å²	135.6	69%	0.692	75%	0.746	S	S	*	*			trans	-112.7	169.9	-160.8	54.8	0	0	0	0	116.4
920	N	31.9	Very low	29.3	Very low	103 Å²	103	137.4 Å²	137.4	55%	0.551	75%	0.752	S	S	*	*			trans	-168.7	127	143.2	-97.8	-12.3	0	0	0	113	T779	T779-N920 PolarHBondContact OG1-ND2 3.48Å
921	N	34.4	Very low	29.1	Very low	145 Å²	145	139.8 Å²	139.8	78%	0.775	76%	0.756	S	S	*	*			trans	47.2	149.6	142.3	-57.6	5.5	0	0	0	122.3
922	E	33.8	Very low	28.9	Very low	164 Å²	164	140.1 Å²	140.1	77%	0.766	76%	0.758	S	S	*	*			cis	177.5	163	-18.4	-106.3	-85.9	96.6	0	0	106.5
923	P	30.3	Very low	28.9	Very low	97 Å²	97	139.8 Å²	139.8	63%	0.63	76%	0.757	S	S	*	*			cis	-113.7	162.9	-33.9	36.8	-25.7	0	0	0	112.3
924	I	28.4	Very low	29.2	Very low	153 Å²	153	136.7 Å²	136.7	79%	0.785	75%	0.752	S	S	*	*			trans	-125.7	119.7	164.9	-63.9	179.1	0	0	0	109.3	T926	I924-T926 PolarHBondContact O-N 3.29Å; I924-T926 PolarHBondContact O-OG1 3.14Å
925	I	30.6	Very low	29	Very low	168 Å²	168	138.3 Å²	138.3	86%	0.862	75%	0.751	S	S	*	*			trans	-67.3	125	-177.4	-63.8	177.3	0	0	0	110.2
926	T	25.8	Very low	29.1	Very low	100 Å²	100	139 Å²	139	61%	0.613	75%	0.753	S	S	*	*			trans	-120.3	137.5	-173.8	-64	0	0	0	0	110.4	I924	I924-T926 PolarHBondContact O-N 3.29Å; I924-T926 PolarHBondContact O-OG1 3.14Å
927	T	27.1	Very low	29	Very low	143 Å²	143	139.4 Å²	139.4	88%	0.877	75%	0.752	S	S	*	*			trans	-139.6	83.4	156.8	54.9	0	0	0	0	110.1
928	S	27.3	Very low	29	Very low	94 Å²	94	135.8 Å²	135.8	66%	0.657	75%	0.745	S	S	*	*			trans	-134.2	101.8	167.6	54.5	0	0	0	0	107.9
929	I	28.2	Very low	28.9	Very low	146 Å²	146	135.6 Å²	135.6	75%	0.749	73%	0.734	S	S	*	*			trans	-96.6	112.4	177.5	-62.8	176.7	0	0	0	107.9	F931	I929-F931 HydrophobicContact CG2-CD2 3.52Å; I929-F931 HydrophobicContact CG2-CE2 4.01Å
930	V	26.6	Very low	28.9	Very low	135 Å²	135	136.3 Å²	136.3	82%	0.818	74%	0.739	S	S	*	*			trans	-105.3	122.2	157.8	175.9	0	0	0	0	105.7
931	F	29.6	Very low	28.7	Very low	190 Å²	190	137.6 Å²	137.6	83%	0.833	75%	0.745	S	S	*	*			trans	-115.3	121.3	164	-97.6	-70.8	0	0	0	108.2	I929	I929-F931 HydrophobicContact CG2-CD2 3.52Å; I929-F931 HydrophobicContact CG2-CE2 4.01Å
932	N	26.6	Very low	28.4	Very low	135 Å²	135	135.7 Å²	135.7	72%	0.722	74%	0.743	S	S	*	*			trans	-123.2	175.9	160.9	-147.6	70	0	0	0	107
933	D	30.8	Very low	28.2	Very low	123 Å²	123	132.6 Å²	132.6	66%	0.658	74%	0.739	S	S	*	*			trans	78.5	98.4	166.7	-52.1	-15	0	0	0	118.6
934	H	31.2	Very low	28.1	Very low	165 Å²	165	134.8 Å²	134.8	76%	0.764	75%	0.745	S	S	*	*			trans	63.1	107.3	132.5	-63.5	-75.1	0	0	0	123.2
935	L	25.8	Very low	28.1	Very low	143 Å²	143	134.7 Å²	134.7	75%	0.749	75%	0.745	S	S	*	*				19.6	136.5	125.6	-81.5	148	0	0	0	119.7	Q937	L935-Q937 HydrophobicContact CD2-CB 4.09Å
936	P	30.4	Very low	28	Very low	119 Å²	119	131.4 Å²	131.4	77%	0.773	74%	0.737	S	S	*	*				-124.3	153.2	64.5	35.6	-25.4	0	0	0	113.7
937	Q	25.5	Very low	28.2	Very low	161 Å²	161	131.7 Å²	131.7	75%	0.752	74%	0.743	S	S	*	*				77.2	142.3	50.2	-155.1	-175.7	45.4	0	0	114.2	L935	L935-Q937 HydrophobicContact CD2-CB 4.09Å
938	V	26.8	Very low	28.6	Very low	116 Å²	116	130 Å²	130	70%	0.703	74%	0.735	S	S	*	*			trans	104.8	90.6	171.4	-173.6	0	0	0	0	117.5
939	H	27.5	Very low	28.5	Very low	148 Å²	148	132.3 Å²	132.3	69%	0.685	74%	0.74	S	S	*	*			trans	31.7	121.7	134.6	-54.2	-77.5	0	0	0	122.9	I941	H939-I941 HydrophobicContact CB-CD1 4.14Å; H939-I941 HydrophobicContact CB-CG1 4.44Å
940	S	29.2	Very low	28.5	Very low	114 Å²	114	132.4 Å²	132.4	80%	0.797	74%	0.741	S	S	*	*				-158.7	112	112.7	-78.5	0	0	0	0	108.6
941	I	26.4	Very low	28.5	Very low	131 Å²	131	131.3 Å²	131.3	67%	0.672	74%	0.739	S	S	*	*				89.9	125	60.3	-71.5	164.3	0	0	0	111.8	H939	H939-I941 HydrophobicContact CB-CD1 4.14Å; H939-I941 HydrophobicContact CB-CG1 4.44Å
942	S	27.6	Very low	28.3	Very low	105 Å²	105	126.9 Å²	126.9	73%	0.734	73%	0.732	S	S	*	*			trans	65.8	155.7	172.3	-61	0	0	0	0	116.4
943	S	29.6	Very low	28.3	Very low	99 Å²	99	125.8 Å²	125.8	69%	0.692	73%	0.73	S	S	*	*			cis	-147	125.6	0.8	-3.7	0	0	0	0	108.8
944	L	28.8	Very low	28.3	Very low	142 Å²	142	128.4 Å²	128.4	74%	0.743	74%	0.738	S	S	*	*				89	122.1	91.3	-77.1	178	0	0	0	114.3
945	L	28.2	Very low	28.1	Very low	151 Å²	151	124.4 Å²	124.4	79%	0.791	73%	0.729	S	S	*	*			trans	65.2	151.7	147.7	-52.4	164.1	0	0	0	117.3
946	S	28.7	Very low	28.1	Very low	99 Å²	99	123.4 Å²	123.4	69%	0.692	72%	0.724	S	S	*	*			cis	-163.4	159.4	-23.1	-101.4	0	0	0	0	109.4
947	S	30	Very low	27.9	Very low	106 Å²	106	122 Å²	122	74%	0.741	71%	0.71	S	S	*	*			trans	-57.3	158.6	159.4	-30.1	0	0	0	0	110.5
948	P	35.3	Very low	28	Very low	109 Å²	109	118.6 Å²	118.6	71%	0.708	70%	0.7	S	S	*	*				-155.5	156.8	71	42.5	-22.7	0	0	0	118.9
949	N	26.7	Very low	27.9	Very low	141 Å²	141	121.3 Å²	121.3	75%	0.754	71%	0.707	S	S	*	*			trans	44.8	136.3	130.3	-59.9	-17.1	0	0	0	124.8
950	L	26.9	Very low	27.8	Very low	149 Å²	149	118 Å²	118	78%	0.78	70%	0.701	S	S	*	*			trans	86.9	128.3	131.8	-106.4	70.9	0	0	0	121.7
951	S	26.5	Very low	27.6	Very low	112 Å²	112	120.9 Å²	120.9	78%	0.783	70%	0.699	S	S	*	*			trans	69	148.6	148.3	80.2	0	0	0	0	116.5
952	S	26.1	Very low	27.5	Very low	97 Å²	97	121.1 Å²	121.1	68%	0.678	70%	0.701	S	S	*	*			cis	-161.7	159.7	16.4	57.6	0	0	0	0	112.5
953	V	27.3	Very low	27.5	Very low	112 Å²	112	121.6 Å²	121.6	68%	0.679	70%	0.704	S	S	*	*			trans	68.9	125.9	136.8	165.2	0	0	0	0	121.1
954	Q	29.1	Very low	27.3	Very low	177 Å²	177	124.5 Å²	124.5	83%	0.827	71%	0.711	S	S	*	*			trans	64.1	161.7	153.7	-75.7	162.6	-5.2	0	0	121
955	S	27.1	Very low	27.3	Very low	81 Å²	81	123.3 Å²	123.3	57%	0.566	71%	0.714	S	S	*	*			cis	-169.9	136.6	-47.6	52.2	0	0	0	0	111.9
956	N	26.1	Very low	27.2	Very low	123 Å²	123	125.2 Å²	125.2	66%	0.658	72%	0.716	S	S	*	*			trans	58.1	138.5	141.9	-61.5	-6.9	0	0	0	123.1
957	N	27.1	Very low	27.2	Very low	88 Å²	88	128.7 Å²	128.7	47%	0.471	73%	0.727	S	S	.	*			trans	88.5	125.9	133	-80.3	4.4	0	0	0	123.1	P691	P691-N957 HydrophobicContact CG-CB 3.69Å
958	V	26.8	Very low	27.1	Very low	91 Å²	91	128.4 Å²	128.4	55%	0.552	73%	0.725	S	S	*	*			trans	83.8	92.8	130.1	174.5	0	0	0	0	118.7
959	M	25	Very low	26.9	Very low	173 Å²	173	128.2 Å²	128.2	85%	0.852	73%	0.726	S	S	*	*				65	154.7	108.2	-140.3	172.8	-177.9	0	0	121
960	S	24.8	Very low	26.9	Very low	78 Å²	78	128 Å²	128	55%	0.545	73%	0.725	S	S	.	*			trans	97.1	155	135	77.1	0	0	0	0	122.2
961	F	25.9	Very low	27.2	Very low	175 Å²	175	126.7 Å²	126.7	77%	0.768	72%	0.724	S	S	*	*			trans	64.5	99.3	162.2	-52.5	-56	0	0	0	121.8
962	I	24	Very low	27.3	Very low	136 Å²	136	128.4 Å²	128.4	70%	0.697	72%	0.724	S	S	*	*				24.4	125.5	108.2	-54.4	172.9	0	0	0	115.8	L964	I962-L964 HydrophobicContact CG2-CD1 3.94Å
963	S	27.1	Very low	27.4	Very low	114 Å²	114	130.5 Å²	130.5	80%	0.797	73%	0.732	S	S	*	*			trans	-143.8	112.4	150	-76.9	0	0	0	0	110.1
964	L	24.9	Very low	27.6	Very low	160 Å²	160	132.4 Å²	132.4	84%	0.838	74%	0.739	S	S	*	*			trans	-69.2	132.9	163.1	-84.8	69.2	0	0	0	107.9	I962	I962-L964 HydrophobicContact CG2-CD1 3.94Å
965	S	29.6	Very low	27.4	Very low	117 Å²	117	131.6 Å²	131.6	82%	0.818	74%	0.737	S	S	*	*			trans	-130.3	111.8	161.6	46.9	0	0	0	0	109.3
966	K	27.1	Very low	27.6	Very low	192 Å²	192	134.3 Å²	134.3	84%	0.835	75%	0.745	S	S	*	*			trans	-77	131.6	162.8	-68	178.9	176.8	-178.9	0	107.5
967	N	28.7	Very low	27.8	Very low	171 Å²	171	132.9 Å²	132.9	91%	0.914	74%	0.737	S	S	*	*				-169.8	156.3	123.1	-98	-7.6	0	0	0	112.1
968	S	26.9	Very low	27.8	Very low	101 Å²	101	136.9 Å²	136.9	71%	0.706	76%	0.758	S	S	*	*			trans	-91.5	147.8	-178.1	176.5	0	0	0	0	111.8
969	S	30.4	Very low	27.9	Very low	104 Å²	104	140.3 Å²	140.3	73%	0.727	77%	0.77	S	S	*	*				-175.6	108.9	123.7	58.8	0	0	0	0	114.1
970	N	28.2	Very low	28	Very low	136 Å²	136	140.4 Å²	140.4	73%	0.727	77%	0.773	S	S	*	*			trans	56.9	152.2	132.5	-55.1	-6	0	0	0	123.9
971	T	33.1	Very low	28	Very low	123 Å²	123	141.5 Å²	141.5	76%	0.755	78%	0.776	S	S	*	*			trans	68.8	139.4	162.3	66.5	0	0	0	0	118.9
972	D	28.3	Very low	28.1	Very low	147 Å²	147	138.4 Å²	138.4	79%	0.786	78%	0.776	S	S	*	*			cis	-155.9	138.3	-20.8	-97	-28.8	0	0	0	108.1
973	V	29	Very low	28.3	Very low	142 Å²	142	138 Å²	138	86%	0.861	78%	0.78	S	S	*	*			trans	-138.8	125.3	169.8	-177.2	0	0	0	0	109.4
974	N	29.7	Very low	28.3	Very low	152 Å²	152	141.1 Å²	141.1	81%	0.813	78%	0.782	S	S	*	*			trans	-65.2	148.2	-177.5	-168.2	29.4	0	0	0	112.4
975	M	26.2	Very low	28.6	Very low	159 Å²	159	139.4 Å²	139.4	78%	0.783	78%	0.778	S	S	*	*			trans	-124.2	99.9	-165.6	-159.7	-67.2	-161.1	0	0	110.8
976	D	30.5	Very low	28.7	Very low	139 Å²	139	141.1 Å²	141.1	74%	0.743	78%	0.778	S	S	*	*			trans	-154.4	156.3	171.4	-90.9	-50.5	0	0	0	108.5
977	D	30.3	Very low	28.6	Very low	92 Å²	92	139.7 Å²	139.7	49%	0.492	77%	0.774	S	S	.	*			trans	70.8	56.6	-179.5	-76.9	-19.1	0	0	0	118.5
978	L	27.4	Very low	28.5	Very low	172 Å²	172	138.2 Å²	138.2	90%	0.901	78%	0.776	S	S	*	*			trans	-132.7	99.2	148.8	-87.5	-178.9	0	0	0	112.2
979	M	27.9	Very low	28.3	Very low	164 Å²	164	138 Å²	138	81%	0.808	78%	0.775	S	S	*	*			trans	-132.5	106.2	173.4	-93.8	-76.8	-81	0	0	110.5
980	L	28	Very low	28.2	Very low	175 Å²	175	141.6 Å²	141.6	92%	0.916	79%	0.785	S	S	*	*			trans	-152.1	107.3	158.3	-123.3	173.1	0	0	0	111.3
981	V	25.4	Very low	28	Very low	100 Å²	100	140.7 Å²	140.7	61%	0.606	79%	0.789	S	S	*	*			trans	-78.7	141.3	-178.4	172.4	0	0	0	0	111.4	T983	V981-T983 HydrophobicContact CG1-CG2 4.48Å
982	S	27.1	Very low	27.7	Very low	110 Å²	110	139.2 Å²	139.2	77%	0.769	78%	0.784	S	S	*	*			trans	-166.9	79.5	142.5	-79.9	0	0	0	0	113.4
983	T	29	Very low	27.6	Very low	127 Å²	127	138.1 Å²	138.1	78%	0.779	79%	0.788	S	S	*	*			trans	39.3	121.8	136	57.5	0	0	0	0	121.4	V981	V981-T983 HydrophobicContact CG1-CG2 4.48Å
984	E	26	Very low	27.8	Very low	181 Å²	181	139.6 Å²	139.6	85%	0.846	78%	0.783	S	S	*	*			trans	-84.5	162.5	163.9	-52.5	178.4	136.9	0	0	113.3
985	T	31	Very low	28.1	Very low	124 Å²	124	135.3 Å²	135.3	76%	0.761	77%	0.765	S	S	*	*			trans	-155.7	142.5	149.6	53.1	0	0	0	0	108.1
986	N	31.7	Very low	28.6	Very low	152 Å²	152	134.3 Å²	134.3	81%	0.813	76%	0.762	S	S	*	*			cis	-151.3	159.2	-10	-102	-14.6	0	0	0	108.9
987	Q	25.3	Very low	29.1	Very low	162 Å²	162	132.9 Å²	132.9	76%	0.757	76%	0.755	S	S	*	*			trans	-80.5	159.2	-178	-58.3	175	11.2	0	0	113.3
988	C	26.3	Very low	29.8	Very low	140 Å²	140	131.4 Å²	131.4	95%	0.946	75%	0.749	S	S	*	*			trans	-146.5	110.5	150.9	-118.6	0	0	0	0	109.3
989	S	23	Very low	30.3	Very low	98 Å²	98	128.1 Å²	128.1	69%	0.685	73%	0.732	S	S	*	*			trans	-92.6	138	-171.3	-50.3	0	0	0	0	112.2
990	L	29.5	Very low	31	Very low	178 Å²	178	122.4 Å²	122.4	93%	0.932	71%	0.711	S	S	*	*			trans	-146.4	126.2	157.2	-103.5	175.7	0	0	0	110.3
991	S	23.4	Very low	31.6	Very low	117 Å²	117	117.5 Å²	117.5	82%	0.818	69%	0.691	S	S	*	*			trans	-113.6	117.1	-176.5	47.6	0	0	0	0	111.2
992	S	27.2	Very low	32.2	Very low	93 Å²	93	117.4 Å²	117.4	65%	0.65	69%	0.687	S	S	*	*			trans	-151.5	131.8	165.6	49.1	0	0	0	0	112.4	F994	S992-F994 PolarHBondContact O-N 2.68Å
993	S	25.9	Very low	32.9	Very low	123 Å²	123	116.6 Å²	116.6	86%	0.86	67%	0.674	S	S	*	*			trans	-41.5	120.8	173.4	48.8	0	0	0	0	115.3
994	F	32.6	Very low	33.5	Very low	174 Å²	174	116.2 Å²	116.2	76%	0.763	67%	0.666	S	S	*	*			trans	-87.5	144	161.2	-71	-84.2	0	0	0	110.6	S992 T998	S992-F994 PolarHBondContact O-N 2.68Å; F994-T998 HydrophobicContact CD1-CG2 4.12Å
995	S	36.9	Very low	34.5	Very low	61 Å²	61	113 Å²	113	43%	0.427	66%	0.66	S	S	.	*			trans	-83.1	164.1	177.7	74.8	0	0	0	0	111.9	D997 T998	S995-D997 VanDerWaalsContact CB-OD2 3.25Å; S995-D997 WeakPolarHBondContact CB-OD2 3.45Å; S995-D997 PolarHBondContact O-N 2.77Å; S995-D997 VanDerWaalsContact O-N 3.09Å; S995-D997 PolarHBondContact OG-N 3.43Å; S995-D997 PolarHBondContact OG-OD2 3.32Å; S995-T998 PolarHBondContact O-N 2.86Å
996	N	36.4	Very low	34.7	Very low	138 Å²	138	110.5 Å²	110.5	74%	0.738	64%	0.641	S	S	*	*	H	α-helix	trans	-57	-24.4	175.2	-69	-31.3	0	0	0	112.6	L999 A1000	N996-L999 WeakPolarHBondContact O-CB 3.34Å; N996-L999 PolarHBondContact O-N 3.11Å; N996-A1000 PolarHBondContact O-N 3.05Å
997	D	41.2	Very low	34.8	Very low	110 Å²	110	107.4 Å²	107.4	59%	0.588	63%	0.631	S	S	*	*	H	α-helix	trans	-71.5	-31.3	-177.9	-37.8	-74.9	0	0	0	112.5	S995 L999 S1001	S995-D997 VanDerWaalsContact CB-OD2 3.25Å; S995-D997 WeakPolarHBondContact CB-OD2 3.45Å; S995-D997 PolarHBondContact O-N 2.77Å; S995-D997 VanDerWaalsContact O-N 3.09Å; S995-D997 PolarHBondContact OG-N 3.43Å; S995-D997 PolarHBondContact OG-OD2 3.32Å; D997-L999 VanDerWaalsContact C-N 3.34Å; D997-S1001 WeakPolarHBondContact O-CB 3.12Å; D997-S1001 PolarHBondContact O-N 3.49Å; D997-S1001 PolarHBondContact O-OG 2.71Å
998	T	45.4	Very low	35.4	Very low	60 Å²	60	104.3 Å²	104.3	37%	0.368	63%	0.625	S	S	.	*	H	α-helix	trans	-67.4	-39.7	171.2	-43.3	0	0	0	0	110.5	F994 S995 S1001 L1002	F994-T998 HydrophobicContact CD1-CG2 4.12Å; S995-T998 PolarHBondContact O-N 2.86Å; T998-S1001 PolarHBondContact O-N 3.06Å; T998-L1002 PolarHBondContact O-N 3.09Å
999	L	37.3	Very low	35.8	Very low	103 Å²	103	109.1 Å²	109.1	54%	0.539	62%	0.623	S	S	.	*	H	α-helix	trans	-67.5	-40.7	176.2	-130	171	0	0	0	111.5	N996 D997 S1001 L1002 L1003	N996-L999 WeakPolarHBondContact O-CB 3.34Å; N996-L999 PolarHBondContact O-N 3.11Å; D997-L999 VanDerWaalsContact C-N 3.34Å; L999-S1001 VanDerWaalsContact C-N 3.34Å; L999-S1001 PolarHBondContact O-N 2.64Å; L999-L1002 PolarHBondContact O-N 3.1Å; L999-L1003 HydrophobicContact CD2-CD1 4.01Å; L999-L1003 HydrophobicContact CD2-CG 4.23Å; L999-L1003 WeakPolarHBondContact O-CB 3.47Å; L999-L1003 WeakPolarHBondContact O-CG 3.16Å; L999-L1003 PolarHBondContact O-N 2.69Å
1000	A	42.6	Very low	36.1	Very low	45 Å²	45	113.9 Å²	113.9	37%	0.372	63%	0.627	S	S	.	*	H	α-helix	trans	-63.6	-37.9	173.3	0	0	0	0	0	112.3	N996 L1003 N1004	N996-A1000 PolarHBondContact O-N 3.05Å; A1000-L1003 PolarHBondContact O-N 2.81Å; A1000-N1004 WeakPolarHBondContact O-CB 3.33Å; A1000-N1004 PolarHBondContact O-N 3.19Å; A1000-N1004 PolarHBondContact O-ND2 3.13Å
1001	S	41.3	Very low	36.3	Very low	71 Å²	71	110.8 Å²	110.8	50%	0.497	62%	0.618	S	S	.	*	H	α-helix	trans	-64.1	-48.1	174	-61.5	0	0	0	0	111.3	D997 T998 L999 L1003 N1004 T1005	D997-S1001 WeakPolarHBondContact O-CB 3.12Å; D997-S1001 PolarHBondContact O-N 3.49Å; D997-S1001 PolarHBondContact O-OG 2.71Å; T998-S1001 PolarHBondContact O-N 3.06Å; L999-S1001 VanDerWaalsContact C-N 3.34Å; L999-S1001 PolarHBondContact O-N 2.64Å; S1001-L1003 VanDerWaalsContact C-N 3.35Å; S1001-L1003 PolarHBondContact O-N 3.37Å; S1001-N1004 PolarHBondContact O-N 2.88Å; S1001-T1005 PolarHBondContact O-N 3.47Å; S1001-T1005 PolarHBondContact O-OG1 2.81Å; S1001-T1005 VanDerWaalsContact O-OG1 3.04Å
1002	L	37.2	Very low	36.5	Very low	99 Å²	99	113.4 Å²	113.4	52%	0.518	62%	0.622	S	S	.	*	H	α-helix	trans	-57.1	-44.1	174.9	-98	161.6	0	0	0	112.8	T998 L999 T1005 L1006	T998-L1002 PolarHBondContact O-N 3.09Å; L999-L1002 PolarHBondContact O-N 3.1Å; L1002-T1005 PolarHBondContact O-N 2.97Å; L1002-L1006 WeakPolarHBondContact O-CG 3.5Å; L1002-L1006 PolarHBondContact O-N 3.06Å
1003	L	41	Very low	36.6	Very low	93 Å²	93	114.6 Å²	114.6	49%	0.487	63%	0.63	S	S	.	*	H	α-helix	trans	-65.1	-37.3	177.1	-73.4	167.5	0	0	0	112.4	L999 A1000 S1001 L1006 C1007	L999-L1003 HydrophobicContact CD2-CD1 4.01Å; L999-L1003 HydrophobicContact CD2-CG 4.23Å; L999-L1003 WeakPolarHBondContact O-CB 3.47Å; L999-L1003 WeakPolarHBondContact O-CG 3.16Å; L999-L1003 PolarHBondContact O-N 2.69Å; A1000-L1003 PolarHBondContact O-N 2.81Å; S1001-L1003 VanDerWaalsContact C-N 3.35Å; S1001-L1003 PolarHBondContact O-N 3.37Å; L1003-L1006 PolarHBondContact O-N 2.75Å; L1003-C1007 PolarHBondContact O-N 3.13Å
1004	N	42.6	Very low	36.7	Very low	118 Å²	118	113.7 Å²	113.7	63%	0.631	62%	0.624	S	S	*	*	H	α-helix	trans	-68.9	-37.9	173.8	-75.6	-42.6	0	0	0	112.3	A1000 S1001 L1006 C1007	A1000-N1004 WeakPolarHBondContact O-CB 3.33Å; A1000-N1004 PolarHBondContact O-N 3.19Å; A1000-N1004 PolarHBondContact O-ND2 3.13Å; S1001-N1004 PolarHBondContact O-N 2.88Å; N1004-L1006 VanDerWaalsContact C-N 3.3Å; N1004-L1006 PolarHBondContact O-N 2.78Å; N1004-C1007 CarbonylContact O-C 3.52Å; N1004-C1007 PolarHBondContact O-N 3.23Å
1005	T	46.1	Very low	36.7	Very low	115 Å²	115	112.2 Å²	112.2	71%	0.706	63%	0.629	S	S	*	*	H	α-helix	trans	-65	-33.1	174.4	-51.3	0	0	0	0	112.2	S1001 L1002 C1007	S1001-T1005 PolarHBondContact O-N 3.47Å; S1001-T1005 PolarHBondContact O-OG1 2.81Å; S1001-T1005 VanDerWaalsContact O-OG1 3.04Å; L1002-T1005 PolarHBondContact O-N 2.97Å; T1005-C1007 VanDerWaalsContact C-N 3.33Å
1006	L	35.5	Very low	36.5	Very low	70 Å²	70	117.6 Å²	117.6	37%	0.366	65%	0.647	S	S	.	*	T	Hydrogen-bonded Turn	trans	-80.8	-7.1	177.4	-70.5	168.5	0	0	0	114.2	A358 M361 L1002 L1003 N1004	A358-L1006 HydrophobicContact CB-CD2 4.37Å; M361-L1006 HydrophobicContact CE-CD1 3.95Å; M361-L1006 HydrophobicContact CE-CD2 3.84Å; M361-L1006 HydrophobicContact SD-CD1 4.24Å; L1002-L1006 WeakPolarHBondContact O-CG 3.5Å; L1002-L1006 PolarHBondContact O-N 3.06Å; L1003-L1006 PolarHBondContact O-N 2.75Å; N1004-L1006 VanDerWaalsContact C-N 3.3Å; N1004-L1006 PolarHBondContact O-N 2.78Å
1007	C	33.9	Very low	36.1	Very low	88 Å²	88	118.6 Å²	118.6	60%	0.595	65%	0.652	S	S	*	*			trans	-137.3	74.6	-176.7	-79.6	0	0	0	0	112.4	L1003 N1004 T1005 R1009	L1003-C1007 PolarHBondContact O-N 3.13Å; N1004-C1007 CarbonylContact O-C 3.52Å; N1004-C1007 PolarHBondContact O-N 3.23Å; T1005-C1007 VanDerWaalsContact C-N 3.33Å; C1007-R1009 PolarHBondContact O-N 2.89Å
1008	P	38.6	Very low	35.8	Very low	97 Å²	97	119.8 Å²	119.8	63%	0.63	66%	0.659	S	S	*	*			trans	-63.7	102.2	170.5	27.3	-34.1	0	0	0	110.2	Y1010	P1008-Y1010 PolarHBondContact O-N 3.47Å; P1008-Y1010 VanDerWaalsContact O-N 3.13Å
1009	R	33.5	Very low	35.1	Very low	240 Å²	240	124.8 Å²	124.8	91%	0.906	68%	0.678	S	S	*	*			trans	-68.5	106	172.4	-74.8	-174.5	174.2	-170.7	-1.3	109.7	C1007	C1007-R1009 PolarHBondContact O-N 2.89Å
1010	Y	29.9	Very low	34.7	Very low	198 Å²	198	127.9 Å²	127.9	78%	0.776	70%	0.695	S	S	*	*			trans	-64.1	134.6	164.9	-77.4	-89.9	0	0	0	110.1	P1008	P1008-Y1010 PolarHBondContact O-N 3.47Å; P1008-Y1010 VanDerWaalsContact O-N 3.13Å
1011	P	33.8	Very low	34.2	Very low	113 Å²	113	133.6 Å²	133.6	73%	0.734	72%	0.718	S	S	*	*			trans	-71.8	131.5	174	29.4	-33.1	0	0	0	110.1	S1013	P1011-S1013 PolarHBondContact O-N 3.39Å
1012	L	28.5	Very low	33.6	Very low	173 Å²	173	137.4 Å²	137.4	91%	0.906	73%	0.732	S	S	*	*			trans	-71.9	109.2	167.3	-81.2	77.7	0	0	0	108.8
1013	S	29.4	Very low	33.2	Very low	117 Å²	117	138.3 Å²	138.3	82%	0.818	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-79.8	116.6	161.2	40.5	0	0	0	0	109.2	P1011 T1015	P1011-S1013 PolarHBondContact O-N 3.39Å; S1013-T1015 PolarHBondContact O-N 2.97Å
1014	S	27.6	Very low	32.8	Very low	105 Å²	105	142.2 Å²	142.2	73%	0.734	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-70.4	118.9	-179.7	51.7	0	0	0	0	111.6	H1016	S1014-H1016 PolarHBondContact O-N 3.43Å
1015	T	31.8	Very low	32.3	Very low	142 Å²	142	142 Å²	142	87%	0.871	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-68.6	117.3	162	47.7	0	0	0	0	109	S1013	S1013-T1015 PolarHBondContact O-N 2.97Å
1016	H	32	Very low	31.6	Very low	175 Å²	175	141 Å²	141	81%	0.81	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-63.7	140.5	-176.2	-124.2	-85.4	0	0	0	112.4	S1014	S1014-H1016 PolarHBondContact O-N 3.43Å
1017	D	30	Very low	31.5	Very low	158 Å²	158	143.5 Å²	143.5	85%	0.845	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-59.9	142.1	166.3	-79.6	-57.1	0	0	0	111.1
1018	N	32.9	Very low	31.4	Very low	136 Å²	136	149.4 Å²	149.4	73%	0.727	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-99.2	139	-179	-114	-56.2	0	0	0	111.3
1019	Q	31.6	Very low	31.2	Very low	164 Å²	164	150.9 Å²	150.9	77%	0.766	79%	0.793	S	S	*	*			trans	65.3	99.1	156.3	-59.1	170.2	22.4	0	0	117.7
1020	N	29.8	Very low	31.2	Very low	168 Å²	168	144.8 Å²	144.8	90%	0.898	78%	0.782	S	S	*	*			trans	-147.5	99.8	136.4	-105.7	-49.9	0	0	0	109.4
1021	I	30.4	Very low	31.3	Very low	165 Å²	165	142 Å²	142	85%	0.846	78%	0.781	S	S	*	*			trans	-121.9	112.9	169	-68	179.7	0	0	0	106.7
1022	L	29	Very low	31.4	Very low	152 Å²	152	141.7 Å²	141.7	80%	0.796	78%	0.781	S	S	*	*			trans	-66.8	135.1	156.5	-67.1	109.6	0	0	0	106.7
1023	T	29.9	Very low	31.5	Very low	118 Å²	118	139.2 Å²	139.2	72%	0.724	77%	0.774	S	S	*	*				-170.7	164.9	72.9	38.1	0	0	0	0	112.5
1024	E	32	Very low	31.8	Very low	175 Å²	175	139 Å²	139	82%	0.818	77%	0.77	S	S	*	*			trans	72.4	119.6	156.3	-75.9	179.1	-169.4	0	0	121
1025	S	32.8	Very low	31.9	Very low	112 Å²	112	139.7 Å²	139.7	78%	0.783	77%	0.774	S	S	*	*				59.5	132.6	123.7	-55.2	0	0	0	0	121
1026	S	31.2	Very low	32.1	Very low	95 Å²	95	138.5 Å²	138.5	66%	0.664	77%	0.769	S	S	*	*			cis	-170.9	156.5	-6.6	-166.8	0	0	0	0	110.4
1027	T	33.4	Very low	32	Very low	123 Å²	123	138 Å²	138	76%	0.755	77%	0.771	S	S	*	*			trans	63.3	148.1	168.4	61.9	0	0	0	0	118
1028	R	31.6	Very low	32	Very low	212 Å²	212	137.5 Å²	137.5	80%	0.8	77%	0.767	S	S	*	*			cis	-156.8	135.6	-3	-123.3	177.4	175.4	-159.4	-0.4	111.4
1029	L	33.4	Very low	31.9	Very low	127 Å²	127	134.4 Å²	134.4	67%	0.665	77%	0.767	S	S	*	*			trans	58.2	121.4	141.8	-65.8	165.6	0	0	0	122.3
1030	T	34	Very low	31.8	Very low	112 Å²	112	134 Å²	134	69%	0.687	77%	0.769	S	S	*	*			trans	57.9	136	130.2	64.8	0	0	0	0	119.9
1031	D	33	Very low	31.9	Very low	141 Å²	141	131.4 Å²	131.4	75%	0.754	77%	0.765	S	S	*	*			cis	-162.2	-178.3	4.7	-128.4	54.1	0	0	0	109
1032	S	34.6	Very low	31.8	Very low	105 Å²	105	130 Å²	130	73%	0.734	76%	0.764	S	S	*	*			cis	-145.3	-171.5	12.2	73.6	0	0	0	0	114.2
1033	T	30.7	Very low	32.1	Very low	122 Å²	122	127.8 Å²	127.8	75%	0.748	76%	0.759	S	S	*	*			trans	-94.9	171.8	-175.8	34.6	0	0	0	0	115.6
1034	P	36	Very low	32	Very low	113 Å²	113	128.8 Å²	128.8	73%	0.734	76%	0.76	S	S	*	*			trans	-112.3	176.8	-167.4	42.7	-35.3	0	0	0	114.8
1035	S	29.7	Very low	31.9	Very low	118 Å²	118	126.9 Å²	126.9	83%	0.825	75%	0.754	S	S	*	*			trans	-179.9	154.4	136.3	-82.3	0	0	0	0	113.6
1036	P	35.7	Very low	31.9	Very low	117 Å²	117	128.6 Å²	128.6	76%	0.76	75%	0.749	S	S	*	*			trans	-103.3	154.2	172.8	38.3	-32	0	0	0	113.2
1037	L	29.9	Very low	31.7	Very low	166 Å²	166	133.5 Å²	133.5	87%	0.869	76%	0.759	S	S	*	*			trans	-167.6	155.7	152.2	-109.9	155.2	0	0	0	115.1
1038	I	29.7	Very low	31.5	Very low	147 Å²	147	134.1 Å²	134.1	75%	0.754	76%	0.763	S	S	*	*			trans	-55.2	145.9	-172.8	-64.7	158.7	0	0	0	116.3	L1040	I1038-L1040 HydrophobicContact CG2-CD1 3.91Å
1039	G	32.3	Very low	31.2	Very low	71 Å²	71	130.1 Å²	130.1	73%	0.732	76%	0.762	S	S	*	*			trans	179.4	90.3	159.9	0	0	0	0	0	111.3
1040	L	29.5	Very low	31	Very low	154 Å²	154	133.4 Å²	133.4	81%	0.806	77%	0.771	S	S	*	*				64.9	145	86.6	-106.3	79.9	0	0	0	116.8	I1038	I1038-L1040 HydrophobicContact CG2-CD1 3.91Å
1041	S	31.1	Very low	30.7	Very low	115 Å²	115	132.4 Å²	132.4	80%	0.804	77%	0.769	S	S	*	*			trans	82.1	104.9	165.4	-45.4	0	0	0	0	119
1042	T	28.1	Very low	30.3	Very low	134 Å²	134	130.6 Å²	130.6	82%	0.822	76%	0.763	S	S	*	*			trans	-70.1	-178.9	149.4	50.5	0	0	0	0	110.5
1043	P	36.1	Very low	30.2	Very low	107 Å²	107	132 Å²	132	70%	0.695	77%	0.77	S	S	*	*			cis	-137.8	177.4	5.7	43	-24.8	0	0	0	117.6
1044	D	28.2	Very low	29.9	Very low	139 Å²	139	131.2 Å²	131.2	74%	0.743	77%	0.765	S	S	*	*			trans	75.8	139.8	137.7	-93.5	-40.7	0	0	0	126.5
1045	L	28.4	Very low	29.8	Very low	134 Å²	134	132.3 Å²	132.3	70%	0.702	77%	0.765	S	S	*	*			trans	80.7	148	141.4	-77.7	167.7	0	0	0	124.2
1046	H	32.6	Very low	29.6	Very low	148 Å²	148	132.9 Å²	132.9	69%	0.685	76%	0.759	S	S	*	*			trans	70.4	74.2	162.3	-62.5	-56.5	0	0	0	122
1047	K	27.4	Very low	29.3	Very low	198 Å²	198	134.3 Å²	134.3	86%	0.861	76%	0.76	S	S	*	*				39.9	99.6	105.5	-174.7	-159.4	177.5	-175.5	0	118
1048	T	29.7	Very low	29.5	Very low	137 Å²	137	132.1 Å²	132.1	84%	0.84	75%	0.753	S	S	*	*			trans	-148.3	146.7	145.6	-4.8	0	0	0	0	113.8
1049	T	25.4	Very low	29.4	Very low	128 Å²	128	133.2 Å²	133.2	79%	0.785	76%	0.755	S	S	*	*			trans	-78.8	126.3	-176.3	-54.4	0	0	0	0	113.3
1050	F	29	Very low	29.3	Very low	196 Å²	196	135.7 Å²	135.7	86%	0.86	76%	0.755	S	S	*	*			trans	-157.4	145.7	151.5	-80.4	-75.8	0	0	0	106.7
1051	S	28.3	Very low	29.1	Very low	91 Å²	91	133.5 Å²	133.5	64%	0.636	75%	0.752	S	S	*	*			cis	170.8	152.1	-21.7	46.4	0	0	0	0	104.1
1052	T	24.2	Very low	28.8	Very low	103 Å²	103	135.9 Å²	135.9	63%	0.632	76%	0.755	S	S	*	*			trans	-46.1	143	175.1	44	0	0	0	0	115.4	T1054	T1052-T1054 VanDerWaalsContact C-N 3.34Å; T1052-T1054 PolarHBondContact O-N 2.97Å
1053	P	31.3	Very low	28.7	Very low	135 Å²	135	136.6 Å²	136.6	88%	0.877	75%	0.747	S	S	*	*			trans	-74.8	91.1	143.8	32.1	-28.9	0	0	0	108.5
1054	T	26.1	Very low	28.3	Very low	104 Å²	104	139.5 Å²	139.5	64%	0.638	76%	0.755	S	S	*	*			trans	-86.3	111	162.1	42.7	0	0	0	0	109.1	T1052	T1052-T1054 VanDerWaalsContact C-N 3.34Å; T1052-T1054 PolarHBondContact O-N 2.97Å
1055	N	32.4	Very low	28.2	Very low	137 Å²	137	139 Å²	139	73%	0.733	75%	0.748	S	S	*	*			trans	-160.8	130.5	145.1	-90.5	-22.5	0	0	0	105.7
1056	N	27.1	Very low	28.1	Very low	130 Å²	130	140.6 Å²	140.6	70%	0.695	75%	0.752	S	S	*	*				67.8	143.9	53	-64.9	-10.6	0	0	0	113
1057	D	29.1	Very low	27.8	Very low	147 Å²	147	140.8 Å²	140.8	79%	0.786	76%	0.758	S	S	*	*			trans	70.3	128.3	169	-51.7	-37.3	0	0	0	116
1058	V	32.8	Very low	27.9	Very low	119 Å²	119	135.5 Å²	135.5	72%	0.721	75%	0.752	S	S	*	*			cis	-154.5	158.5	0.6	86.7	0	0	0	0	111.7
1059	H	28.5	Very low	27.7	Very low	171 Å²	171	138.8 Å²	138.8	79%	0.792	75%	0.754	S	S	*	*			trans	20.1	136.1	155.6	-86.5	-126.4	0	0	0	119.7
1060	V	30.1	Very low	27.9	Very low	122 Å²	122	142.2 Å²	142.2	74%	0.739	76%	0.758	S	S	*	*			cis	-150	140.8	46.6	170.3	0	0	0	0	111.4
1061	S	24.9	Very low	27.7	Very low	108 Å²	108	137.3 Å²	137.3	76%	0.755	75%	0.748	S	S	*	*			trans	-94.3	138.4	164.7	-59	0	0	0	0	111.7
1062	L	25.4	Very low	27.7	Very low	165 Å²	165	142.5 Å²	142.5	86%	0.864	76%	0.759	S	S	*	*			trans	-129.5	94.3	149.3	-82.9	-178.4	0	0	0	109.7
1063	K	26.1	Very low	27.8	Very low	150 Å²	150	143.3 Å²	143.3	65%	0.652	76%	0.76	S	S	*	*			trans	-84.4	104.4	167.4	-173.2	-167.4	-173.6	-158.7	0	107.2	E1065	K1063-E1065 VanDerWaalsContact CE-CD 3.41Å; K1063-E1065 WeakPolarHBondContact CE-OE1 3.47Å; K1063-E1065 VanDerWaalsContact CE-OE2 3.31Å; K1063-E1065 WeakPolarHBondContact CE-OE2 3.3Å; K1063-E1065 IonicContact NZ-OE1 2.67Å; K1063-E1065 PolarHBondContact NZ-OE1 2.82Å; K1063-E1065 IonicContact NZ-OE2 2.64Å; K1063-E1065 PolarHBondContact NZ-OE2 3.23Å
1064	I	28	Very low	27.6	Very low	168 Å²	168	147.2 Å²	147.2	86%	0.862	76%	0.763	S	S	*	*			trans	-87.4	110.9	162.8	-63.1	-179.5	0	0	0	106.5
1065	E	25.7	Very low	27.5	Very low	127 Å²	127	151.8 Å²	151.8	59%	0.593	77%	0.769	S	S	*	*			trans	-106.1	143.2	178.2	-171.3	153.9	-125.3	0	0	108.9	K1063	K1063-E1065 VanDerWaalsContact CE-CD 3.41Å; K1063-E1065 WeakPolarHBondContact CE-OE1 3.47Å; K1063-E1065 VanDerWaalsContact CE-OE2 3.31Å; K1063-E1065 WeakPolarHBondContact CE-OE2 3.3Å; K1063-E1065 IonicContact NZ-OE1 2.67Å; K1063-E1065 PolarHBondContact NZ-OE1 2.82Å; K1063-E1065 IonicContact NZ-OE2 2.64Å; K1063-E1065 PolarHBondContact NZ-OE2 3.23Å
1066	E	26.7	Very low	27.4	Very low	169 Å²	169	151.9 Å²	151.9	79%	0.79	78%	0.775	S	S	*	*			trans	48.3	101.6	161.4	-170.1	165.8	-138.1	0	0	118.5
1067	N	26.3	Very low	27.4	Very low	152 Å²	152	151.8 Å²	151.8	81%	0.813	77%	0.773	S	S	*	*				-168.3	162.3	116.8	-113.1	-74.4	0	0	0	115.8
1068	A	29.3	Very low	27.4	Very low	87 Å²	87	152.1 Å²	152.1	72%	0.719	78%	0.775	S	S	*	*			trans	55.7	111.2	157.1	0	0	0	0	0	121	K1070	A1068-K1070 PolarHBondContact O-N 3Å
1069	K	26.1	Very low	27.2	Very low	205 Å²	205	151.8 Å²	151.8	89%	0.891	78%	0.778	S	S	*	*			trans	-22.4	122.6	154.3	-58.5	165.7	179.5	172.9	0	115.8
1070	K	29	Very low	27.1	Very low	201 Å²	201	149.4 Å²	149.4	87%	0.874	78%	0.775	S	S	*	*			trans	-164.9	151	142.8	-109.8	155.6	-172.2	176.1	0	112.6	A1068	A1068-K1070 PolarHBondContact O-N 3Å
1071	S	24.9	Very low	27.1	Very low	92 Å²	92	149.1 Å²	149.1	64%	0.643	78%	0.777	S	S	*	*			trans	-72.6	148.9	167.2	-179.7	0	0	0	0	110.3
1072	F	28.1	Very low	27.2	Very low	200 Å²	200	148.4 Å²	148.4	88%	0.877	77%	0.772	S	S	*	*			trans	-147.5	113.9	158.1	-110.8	-79	0	0	0	111.1
1073	D	26.4	Very low	27.4	Very low	121 Å²	121	150.9 Å²	150.9	65%	0.647	77%	0.771	S	S	*	*			trans	-76.1	150	170.6	-60	-68.4	0	0	0	111.2	R1075	D1073-R1075 VanDerWaalsContact C-N 3.25Å; D1073-R1075 PolarHBondContact O-N 2.98Å
1074	F	26.3	Very low	27.7	Very low	216 Å²	216	149 Å²	149	95%	0.947	77%	0.774	S	S	*	*			trans	-73.7	82	160.6	-103.4	-84.2	0	0	0	110	T1076	F1074-T1076 PolarHBondContact O-N 3.4Å
1075	R	25.4	Very low	27.9	Very low	201 Å²	201	147.4 Å²	147.4	76%	0.758	78%	0.775	S	S	*	*			trans	-78.2	107.8	161	-75.7	-169.5	177.4	-153.5	-0.4	109.7	D1073	D1073-R1075 VanDerWaalsContact C-N 3.25Å; D1073-R1075 PolarHBondContact O-N 2.98Å
1076	T	30.5	Very low	28	Very low	138 Å²	138	144.9 Å²	144.9	85%	0.847	78%	0.783	S	S	*	*			trans	-68.5	143.2	142.6	-51.7	0	0	0	0	107.5	F1074	F1074-T1076 PolarHBondContact O-N 3.4Å
1077	I	26.3	Very low	28.2	Very low	129 Å²	129	142.7 Å²	142.7	66%	0.662	79%	0.786	S	S	*	*			trans	-101.6	162.4	-164.5	-64.9	172.3	0	0	0	110.1
1078	D	28.2	Very low	28.3	Very low	153 Å²	153	141.6 Å²	141.6	82%	0.818	79%	0.787	S	S	*	*			trans	71.7	130.1	178.1	-58.5	-42.9	0	0	0	117.3
1079	S	29.9	Very low	28.4	Very low	113 Å²	113	143 Å²	143	79%	0.79	79%	0.792	S	S	*	*			cis	-143.8	155.7	-9	63.8	0	0	0	0	111.6
1080	V	26.5	Very low	28.6	Very low	121 Å²	121	141.7 Å²	141.7	73%	0.733	79%	0.793	S	S	*	*			trans	-103.2	135.5	-171.4	174.8	0	0	0	0	111	S1082	V1080-S1082 WeakPolarHBondContact CG1-OG 3.45Å
1081	C	29.6	Very low	28.7	Very low	116 Å²	116	135 Å²	135	78%	0.784	78%	0.781	S	S	*	*			trans	-138.9	121.3	148.5	-158.4	0	0	0	0	109.8
1082	S	26.9	Very low	28.8	Very low	92 Å²	92	136.9 Å²	136.9	64%	0.643	78%	0.784	S	S	*	*			trans	-101.1	138.5	-169	-55.9	0	0	0	0	111.9	V1080	V1080-S1082 WeakPolarHBondContact CG1-OG 3.45Å
1083	Y	30.2	Very low	29	Very low	217 Å²	217	134.7 Å²	134.7	85%	0.851	78%	0.78	S	S	*	*			trans	-131.2	149.6	161.3	-83.7	-80.2	0	0	0	111.4
1084	P	31.7	Very low	29	Very low	111 Å²	111	133 Å²	133	72%	0.721	78%	0.778	S	S	*	*			trans	-88.3	163.7	-157.6	35.1	-37.3	0	0	0	114.4
1085	P	31	Very low	29.5	Very low	134 Å²	134	132.6 Å²	132.6	87%	0.87	78%	0.776	S	S	*	*			trans	-80.7	144.7	176.6	33.2	-35	0	0	0	112.9
1086	G	28.7	Very low	29.7	Very low	74 Å²	74	128.6 Å²	128.6	76%	0.763	77%	0.774	S	S	*	*			trans	117	99.5	158.6	0	0	0	0	0	116.5
1087	S	30	Very low	29.7	Very low	123 Å²	123	129.6 Å²	129.6	86%	0.86	77%	0.774	S	S	*	*			trans	-160.5	148.3	151.1	-81.7	0	0	0	0	109.6
1088	P	29.2	Very low	29.8	Very low	129 Å²	129	128.8 Å²	128.8	84%	0.838	78%	0.779	S	S	*	*			trans	-87.1	177.5	-165.7	35.2	-37.4	0	0	0	114.8
1089	S	31.3	Very low	29.9	Very low	117 Å²	117	130.6 Å²	130.6	82%	0.818	79%	0.786	S	S	*	*			trans	-69.7	127.9	-173.5	54.1	0	0	0	0	115.8
1090	I	30.2	Very low	29.7	Very low	177 Å²	177	130 Å²	130	91%	0.908	79%	0.787	S	S	*	*			trans	-139.1	136.6	152.2	-78.3	172.1	0	0	0	105.6
1091	G	31.2	Very low	29.8	Very low	60 Å²	60	129.3 Å²	129.3	62%	0.619	79%	0.794	S	S	*	*			cis	-171.6	159.7	-7	0	0	0	0	0	109.5
1092	D	27.6	Very low	30	Very low	132 Å²	132	128.8 Å²	128.8	71%	0.706	80%	0.798	S	S	*	*			trans	-64.2	135.2	-175.4	-57.9	-95.9	0	0	0	113.2	N155	N155-D1092 PolarHBondContact ND2-OD1 3.22Å; N155-D1092 PolarHBondContact ND2-OD2 3.24Å
1093	I	32	Very low	30.2	Very low	155 Å²	155	130.5 Å²	130.5	80%	0.795	80%	0.804	S	S	*	*			trans	-123	90.8	156.8	-54.5	-179.4	0	0	0	107.9	F1095	I1093-F1095 HydrophobicContact CG2-CD2 4.41Å
1094	S	27.1	Very low	30.4	Very low	86 Å²	86	128.8 Å²	128.8	60%	0.601	81%	0.807	S	S	*	*			trans	-78.1	131.6	171.7	56.6	0	0	0	0	111.1
1095	F	35.1	Very low	30.3	Very low	207 Å²	207	130.4 Å²	130.4	91%	0.908	81%	0.809	S	S	*	*			trans	-116.8	97.9	154.2	-96.8	-82.8	0	0	0	109	I1093	I1093-F1095 HydrophobicContact CG2-CD2 4.41Å
1096	T	31.5	Very low	30.7	Very low	116 Å²	116	130.2 Å²	130.2	71%	0.712	81%	0.805	S	S	*	*			trans	-96.7	178.1	174.3	48	0	0	0	0	111.2
1097	D	29.4	Very low	30.9	Very low	160 Å²	160	134 Å²	134	86%	0.856	80%	0.802	S	S	*	*			trans	-43.1	139.8	-172	-65.3	-75.1	0	0	0	116.7
1098	S	28.5	Very low	31	Very low	111 Å²	111	135.4 Å²	135.4	78%	0.776	80%	0.795	S	S	*	*			trans	-154.8	148.9	152.8	-81.6	0	0	0	0	110.5
1099	M	29.6	Very low	31.1	Very low	192 Å²	192	136.3 Å²	136.3	95%	0.946	79%	0.79	S	S	*	*			trans	69.2	69.3	179.8	-57.9	-174.2	-70.4	0	0	116.7
1100	A	26.4	Very low	30.9	Very low	99 Å²	99	138.4 Å²	138.4	82%	0.818	79%	0.787	S	S	*	*			trans	-111.4	151.7	141.6	0	0	0	0	0	109.4
1101	A	28.3	Very low	31	Very low	108 Å²	108	137.2 Å²	137.2	89%	0.893	78%	0.782	S	S	*	*			trans	73.9	108.9	175.5	0	0	0	0	0	118.9
1102	A	34.9	Very low	30.8	Very low	104 Å²	104	140.4 Å²	140.4	86%	0.86	79%	0.785	S	S	*	*			trans	-149.4	156.4	143.7	0	0	0	0	0	108
1103	V	30.2	Very low	31.1	Very low	128 Å²	128	142 Å²	142	78%	0.776	79%	0.787	S	S	*	*			trans	-142.6	140.8	-170.8	171.2	0	0	0	0	109.8
1104	M	34.7	Very low	31	Very low	182 Å²	182	138.7 Å²	138.7	90%	0.897	78%	0.778	S	S	*	*			trans	-176.2	170.1	142.3	-100.5	161.8	-156.5	0	0	112.1
1105	D	29.5	Very low	31.1	Very low	144 Å²	144	142.6 Å²	142.6	77%	0.77	79%	0.792	S	S	*	*			trans	-99.3	-176.8	-156.3	-58.7	-84.6	0	0	0	116.9
1106	V	39.9	Very low	31	Very low	130 Å²	130	136.1 Å²	136.1	79%	0.788	78%	0.784	S	S	*	*			trans	127.6	91.4	142.2	-175.3	0	0	0	0	116.9
1107	H	31.6	Very low	31	Very low	153 Å²	153	137.8 Å²	137.8	71%	0.708	78%	0.784	S	S	*	*			trans	39.1	137.2	130.5	-80.6	-94.4	0	0	0	126
1108	H	33.5	Very low	31	Very low	154 Å²	154	138 Å²	138	71%	0.713	78%	0.779	S	S	*	*			trans	63.4	152.6	149.8	-67.6	-57.1	0	0	0	119.2
1109	M	30.5	Very low	31.1	Very low	148 Å²	148	136.9 Å²	136.9	73%	0.729	77%	0.772	S	S	*	*			cis	-144.3	136.9	-6.9	-106.9	147.1	62.9	0	0	105.7
1110	E	27.2	Very low	31.2	Very low	160 Å²	160	133.9 Å²	133.9	75%	0.748	76%	0.764	S	S	*	*				63.7	107.8	73.2	-169.1	170.4	-138	0	0	115
1111	L	32.3	Very low	31.3	Very low	153 Å²	153	135.7 Å²	135.7	80%	0.801	76%	0.76	S	S	*	*			trans	-176.5	152.6	136.8	-100.7	166.4	0	0	0	111.4
1112	D	27.2	Very low	31.6	Very low	127 Å²	127	137.6 Å²	137.6	68%	0.679	76%	0.761	S	S	*	*			trans	-92.9	-178.8	-164.6	-46.6	-91.4	0	0	0	115.2
1113	H	34.8	Very low	31.3	Very low	164 Å²	164	141.1 Å²	141.1	76%	0.759	76%	0.759	S	S	*	*				177	107	110.4	-92.7	75.8	0	0	0	114.4
1114	S	29.9	Very low	31.4	Very low	87 Å²	87	141 Å²	141	61%	0.608	76%	0.764	S	S	*	*			trans	36	111.3	138.8	61.4	0	0	0	0	123.5
1115	D	28.7	Very low	31.2	Very low	167 Å²	167	141 Å²	141	89%	0.893	76%	0.762	S	S	*	*				51.8	144.1	108.3	-47.7	-34.9	0	0	0	124.1
1116	G	32.1	Very low	31.2	Very low	71 Å²	71	139.1 Å²	139.1	73%	0.732	76%	0.76	S	S	*	*			trans	147.9	61.1	169.6	0	0	0	0	0	114.8
1117	E	30.9	Very low	30.8	Very low	151 Å²	151	140.5 Å²	140.5	71%	0.706	76%	0.762	S	S	*	*				77.2	130.4	85	-86.5	-107.6	114.9	0	0	117.4
1118	Q	31.1	Very low	31	Very low	164 Å²	164	139.6 Å²	139.6	77%	0.766	76%	0.762	S	S	*	*			trans	69.3	150.3	154.4	-66.5	-176.4	45.8	0	0	120.7
1119	S	30.5	Very low	31	Very low	89 Å²	89	140.1 Å²	140.1	62%	0.622	77%	0.77	S	S	*	*			cis	-170.1	-177.7	-24.9	-163.8	0	0	0	0	110.3
1120	T	31.9	Very low	31.3	Very low	128 Å²	128	138 Å²	138	79%	0.785	76%	0.76	S	S	*	*			trans	70.4	155.2	166.3	72.3	0	0	0	0	119.3
1121	D	28.1	Very low	31.8	Very low	137 Å²	137	133.5 Å²	133.5	73%	0.733	75%	0.747	S	S	*	*			cis	175.3	119.9	-45.6	-111.4	-45.1	0	0	0	108.1
1122	V	33.5	Very low	31.9	Very low	149 Å²	149	130.9 Å²	130.9	90%	0.903	74%	0.741	S	S	*	*			trans	-152.8	139.9	154.5	-176.7	0	0	0	0	109.4
1123	Q	28.4	Very low	32.6	Very low	178 Å²	178	130.1 Å²	130.1	83%	0.832	74%	0.737	S	S	*	*			trans	-90.5	159.8	-174.7	-60.8	170.4	-36.5	0	0	114.5
1124	S	32	Very low	32.7	Very low	125 Å²	125	123.9 Å²	123.9	87%	0.874	71%	0.709	S	S	*	*			trans	-159	155.1	154.3	-79.2	0	0	0	0	110.5
1125	E	31.7	Very low	33.2	Very low	182 Å²	182	124.9 Å²	124.9	85%	0.85	71%	0.706	S	S	*	*			trans	-106.5	152.2	-149.8	-67.6	-173.8	97.6	0	0	118.5
1126	S	29.4	Very low	33.8	Very low	105 Å²	105	120.5 Å²	120.5	73%	0.734	68%	0.682	S	S	*	*			trans	60.2	76.7	136.8	-64.3	0	0	0	0	122.3
1127	L	32.2	Very low	34.1	Very low	159 Å²	159	122.4 Å²	122.4	83%	0.832	67%	0.672	S	S	*	*			trans	-142.7	-6	154.4	-89.8	-173.8	0	0	0	117.9
1128	N	34.9	Very low	34.3	Very low	133 Å²	133	120.5 Å²	120.5	71%	0.711	67%	0.673	S	S	*	*	G	3₁₀ helix	trans	-92.7	-2.5	-157.3	-77	-29.6	0	0	0	119.1	I1130	N1128-I1130 VanDerWaalsContact C-N 3.31Å; N1128-I1130 PolarHBondContact O-N 2.93Å
1129	L	32.9	Very low	34.5	Very low	166 Å²	166	115.6 Å²	115.6	87%	0.869	65%	0.652	S	S	*	*	G	3₁₀ helix	trans	-71.5	-13.1	-172.2	-104.2	80	0	0	0	116.3	S1132	L1129-S1132 PolarHBondContact O-OG 3.04Å
1130	I	37.1	Very low	34.6	Very low	103 Å²	103	118.9 Å²	118.9	53%	0.528	66%	0.661	S	S	.	*	G	3₁₀ helix	trans	-89.3	-24.9	-177.5	-62.6	177.8	0	0	0	112.2	F348 N1128	F348-I1130 HydrophobicContact CE1-CD1 4.45Å; N1128-I1130 VanDerWaalsContact C-N 3.31Å; N1128-I1130 PolarHBondContact O-N 2.93Å
1131	S	37.2	Very low	34.7	Very low	66 Å²	66	118.6 Å²	118.6	46%	0.462	65%	0.646	S	S	.	*	S	Bend	trans	-84.6	-13.2	-170.4	-54	0	0	0	0	114.8	N1133 L1134	S1131-N1133 PolarHBondContact O-N 3.48Å; S1131-L1134 PolarHBondContact O-N 2.81Å; S1131-L1134 VanDerWaalsContact O-N 3.07Å
1132	S	36.2	Very low	34.9	Very low	97 Å²	97	117.7 Å²	117.7	68%	0.678	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.3	-13.4	-164.5	44.7	0	0	0	0	116.7	L1129	L1129-S1132 PolarHBondContact O-OG 3.04Å
1133	N	40.3	Very low	34.8	Very low	112 Å²	112	117.9 Å²	117.9	60%	0.599	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112	8.4	176.9	-73.7	5.8	0	0	0	114.2	S1131	S1131-N1133 PolarHBondContact O-N 3.48Å
1134	L	38.5	Very low	34.9	Very low	32 Å²	32	120.2 Å²	120.2	17%	0.168	64%	0.643	C	S	.	*			trans	-106.9	96.9	-176.6	-77.7	122.5	0	0	0	112.4	L335 V337 L349 S1131 I1136	L335-L1134 HydrophobicContact CD2-CD2 4.21Å; V337-L1134 HydrophobicContact CG2-CD2 4.14Å; L349-L1134 HydrophobicContact CD1-CD1 3.48Å; L349-L1134 VanDerWaalsContact CD1-CD1 3.48Å; L349-L1134 HydrophobicContact CD1-CD2 3.66Å; L349-L1134 HydrophobicContact CD1-CG 4.05Å; S1131-L1134 PolarHBondContact O-N 2.81Å; S1131-L1134 VanDerWaalsContact O-N 3.07Å; L1134-I1136 PolarHBondContact O-N 2.76Å
1135	I	40.3	Very low	35	Very low	108 Å²	108	119.6 Å²	119.6	55%	0.554	64%	0.636	S	S	*	*	P	Polyproline II helix	trans	-79.4	117.4	169.7	-58	175.8	0	0	0	108.7
1136	I	41	Very low	35.2	Very low	76 Å²	76	116.7 Å²	116.7	39%	0.39	64%	0.636	S	S	.	*	B	Isolated β-bridge	trans	-103.4	123	175.1	-58.5	170.9	0	0	0	107.9	L333 L335 L1134	L333-I1136 HydrophobicContact CD1-CG2 3.83Å; L335-I1136 HydrophobicContact CD2-CG1 4.01Å; L1134-I1136 PolarHBondContact O-N 2.76Å
1137	Q	37.9	Very low	35.2	Very low	111 Å²	111	122.2 Å²	122.2	52%	0.519	64%	0.642	S	S	.	*	P	Polyproline II helix	trans	-100.4	127.1	171.2	-74.2	-167.7	-57.5	0	0	110.9	D1139	Q1137-D1139 PolarHBondContact O-N 2.75Å
1138	P	35.4	Very low	35.3	Very low	111 Å²	111	123.6 Å²	123.6	72%	0.721	64%	0.644	S	S	*	*			trans	-84.2	85.9	174.8	33.3	-33	0	0	0	111	I1140	P1138-I1140 PolarHBondContact O-N 3.04Å
1139	D	36.1	Very low	35.1	Very low	60 Å²	60	122.2 Å²	122.2	32%	0.321	65%	0.645	S	S	.	*			trans	-74.7	115.7	169.3	-75.3	-42.5	0	0	0	110.8	N330 R334 Q1137 Y1141	N330-D1139 PolarHBondContact ND2-O 3.27Å; R334-D1139 WeakPolarHBondContact CD-OD2 3.23Å; R334-D1139 IonicContact CZ-OD2 3.58Å; R334-D1139 IonicContact NE-OD2 3.04Å; R334-D1139 IonicContact NH1-OD2 2.63Å; R334-D1139 PolarHBondContact NH1-OD2 3.2Å; Q1137-D1139 PolarHBondContact O-N 2.75Å; D1139-Y1141 HydrophobicContact CB-CD2 4.01Å; D1139-Y1141 HydrophobicContact CB-CE2 3.68Å; D1139-Y1141 PolarHBondContact O-N 2.88Å
1140	I	31.8	Very low	34.8	Very low	158 Å²	158	121.1 Å²	121.1	81%	0.81	64%	0.64	S	S	*	*			trans	-80.3	110.7	172.7	-56.9	176	0	0	0	108.9	P1138	P1138-I1140 PolarHBondContact O-N 3.04Å
1141	Y	33.6	Very low	34.6	Very low	123 Å²	123	122.9 Å²	122.9	48%	0.482	66%	0.655	S	S	.	*			trans	-112.8	124	169.9	-75.9	-77.2	0	0	0	110.3	R334 D1139 I1143	R334-Y1141 PolarHBondContact NH1-OH 3.21Å; R334-Y1141 PolarHBondContact NH2-OH 2.67Å; D1139-Y1141 HydrophobicContact CB-CD2 4.01Å; D1139-Y1141 HydrophobicContact CB-CE2 3.68Å; D1139-Y1141 PolarHBondContact O-N 2.88Å; Y1141-I1143 PolarHBondContact O-N 3.38Å
1142	P	32.9	Very low	34.2	Very low	118 Å²	118	126.1 Å²	126.1	77%	0.766	66%	0.663	S	S	*	*			trans	-66.9	131.8	172.6	27.8	-33.2	0	0	0	110.3	R1144	P1142-R1144 PolarHBondContact O-N 3.45Å
1143	I	31.9	Very low	34.2	Very low	153 Å²	153	130.4 Å²	130.4	79%	0.785	67%	0.672	S	S	*	*			trans	-70	116.2	173.8	-58.7	174.1	0	0	0	107.7	Y1141	Y1141-I1143 PolarHBondContact O-N 3.38Å
1144	R	30.8	Very low	33.9	Very low	227 Å²	227	131.6 Å²	131.6	86%	0.857	67%	0.674	S	S	*	*			trans	-104.6	117.1	177.9	-157.8	179	-162.5	-177.8	4.9	108.8	P1142	P1142-R1144 PolarHBondContact O-N 3.45Å
1145	P	34.1	Very low	33.4	Very low	111 Å²	111	135.1 Å²	135.1	72%	0.721	69%	0.693	S	S	*	*	P	Polyproline II helix	trans	-65.3	152.3	176	27.5	-33.7	0	0	0	110.8
1146	S	34.9	Very low	33.1	Very low	121 Å²	121	138 Å²	138	85%	0.846	71%	0.707	S	S	*	*	P	Polyproline II helix	trans	-67.9	141.9	174.2	41.9	0	0	0	0	111.4
1147	Y	29	Very low	32.4	Very low	222 Å²	222	141.6 Å²	141.6	87%	0.871	72%	0.72	S	S	*	*	P	Polyproline II helix	trans	-76.6	141.7	-178.6	-126.2	-97.1	0	0	0	111.5
1148	E	33.8	Very low	32.3	Very low	187 Å²	187	143.2 Å²	143.2	87%	0.874	74%	0.738	S	S	*	*			trans	-132.7	170.2	159.6	-157.5	157.7	-133.4	0	0	109.2
1149	S	31.1	Very low	32	Very low	105 Å²	105	147.7 Å²	147.7	73%	0.734	75%	0.746	S	S	*	*			trans	-85.1	164.9	-148.7	-159	0	0	0	0	117.2
1150	L	28	Very low	31.7	Very low	143 Å²	143	148.3 Å²	148.3	75%	0.749	77%	0.766	S	S	*	*			trans	-58.2	145.6	-175.6	-61.4	73.6	0	0	0	114.7
1151	V	32.1	Very low	31.7	Very low	140 Å²	140	149.4 Å²	149.4	85%	0.848	77%	0.772	S	S	*	*				-136.7	142.9	118.1	-179.8	0	0	0	0	108.2
1152	E	28.3	Very low	31.3	Very low	134 Å²	134	148.4 Å²	148.4	63%	0.626	78%	0.783	S	S	*	*			trans	-108.7	130.7	-178.2	-179.7	-177.7	-176.7	0	0	111.2
1153	H	37.3	Very low	31.3	Very low	187 Å²	187	149 Å²	149	87%	0.866	79%	0.785	S	S	*	*			trans	-145.4	153.3	159.9	-92.2	-61	0	0	0	110.6
1154	Q	32.2	Very low	31.2	Very low	137 Å²	137	146.1 Å²	146.1	64%	0.64	78%	0.778	S	S	*	*			trans	-107.2	153.5	-153.4	-67.4	174.6	-21.9	0	0	115.2
1155	D	29.1	Very low	31	Very low	106 Å²	106	144 Å²	144	57%	0.567	78%	0.777	S	S	*	*			trans	27.9	129.5	146.7	-61.5	15.1	0	0	0	120.7	R1185	D1155-R1185 IonicContact OD1-NH1 3.59Å; D1155-R1185 PolarHBondContact OD1-NH1 3.39Å; D1155-R1185 IonicContact OD2-CZ 2.7Å; D1155-R1185 IonicContact OD2-NH1 2.66Å; D1155-R1185 PolarHBondContact OD2-NH1 3.36Å
1156	I	33.1	Very low	30.8	Very low	167 Å²	167	150.1 Å²	150.1	86%	0.856	79%	0.788	S	S	*	*				-149.4	140.4	119.5	-99.6	146.8	0	0	0	108.9
1157	K	27.7	Very low	30.4	Very low	153 Å²	153	152 Å²	152	67%	0.665	79%	0.789	S	S	*	*			trans	-111	142	175	-76.1	-176.8	175.9	-178	0	110.7
1158	T	34.5	Very low	30.2	Very low	144 Å²	144	147 Å²	147	88%	0.883	78%	0.784	S	S	*	*			trans	-147.5	166.3	151.7	-0.4	0	0	0	0	111.9
1159	K	30	Very low	29.8	Very low	206 Å²	206	145 Å²	145	90%	0.896	78%	0.778	S	S	*	*			trans	-100.7	146.4	-162.9	-63.2	174.4	178.7	175.5	0	113.4
1160	G	28.7	Very low	29.7	Very low	73 Å²	73	145.1 Å²	145.1	75%	0.753	78%	0.775	S	S	*	*			trans	-72.4	-155.5	179.4	0	0	0	0	0	117.4
1161	I	31.6	Very low	29.8	Very low	181 Å²	181	145.4 Å²	145.4	93%	0.928	78%	0.777	S	S	*	*			trans	-160	157.4	165.1	-101	151	0	0	0	107.6
1162	S	25.4	Very low	29.6	Very low	102 Å²	102	145.9 Å²	145.9	71%	0.713	78%	0.78	S	S	*	*			trans	-119.3	145.9	-175	55.4	0	0	0	0	112.5
1163	T	33.9	Very low	29.7	Very low	131 Å²	131	147.7 Å²	147.7	80%	0.804	79%	0.789	S	S	*	*			trans	-173.5	138	134.9	24.6	0	0	0	0	114.4
1164	S	29	Very low	29.4	Very low	91 Å²	91	145.2 Å²	145.2	64%	0.636	79%	0.786	S	S	*	*			trans	20.7	114	144.6	61.5	0	0	0	0	119.9
1165	E	27.2	Very low	29.2	Very low	182 Å²	182	147.8 Å²	147.8	85%	0.85	80%	0.796	S	S	*	*				97.8	122.2	78.7	-85.6	-178.1	163.9	0	0	113.2
1166	Y	30.4	Very low	29.3	Very low	241 Å²	241	150 Å²	150	95%	0.945	81%	0.807	S	S	*	*			trans	-163.4	141	138.9	-113	-74.4	0	0	0	109.9
1167	N	26.5	Very low	29.1	Very low	160 Å²	160	152 Å²	152	86%	0.856	80%	0.804	S	S	*	*			trans	-88.8	136.1	-170.4	-75.3	-56.7	0	0	0	114.2
1168	C	24.1	Very low	29.1	Very low	116 Å²	116	153 Å²	153	78%	0.784	81%	0.813	S	S	*	*			trans	-177.4	173.9	133.9	50.5	0	0	0	0	112.3
1169	I	26	Very low	28.9	Very low	145 Å²	145	152.4 Å²	152.4	74%	0.744	80%	0.804	S	S	*	*			trans	88.9	93.2	163.8	-57.1	170.4	0	0	0	118.1
1170	T	27.5	Very low	28.9	Very low	109 Å²	109	148.3 Å²	148.3	67%	0.669	80%	0.796	S	S	*	*			trans	49.2	147.5	134.6	70	0	0	0	0	124.5
1171	N	31	Very low	29.2	Very low	149 Å²	149	151 Å²	151	80%	0.797	80%	0.8	S	S	*	*			trans	85.8	143.4	156	-57.7	-25.7	0	0	0	117.8
1172	V	28.1	Very low	29.2	Very low	149 Å²	149	151.3 Å²	151.3	90%	0.903	80%	0.798	S	S	*	*			trans	-94.1	102.8	-174.4	178.9	0	0	0	0	109.4
1173	E	30.9	Very low	29.5	Very low	173 Å²	173	151.4 Å²	151.4	81%	0.808	80%	0.799	S	S	*	*			trans	-79.8	144.5	172.4	-68.5	-166.8	124.5	0	0	112.5
1174	V	30.3	Very low	29.4	Very low	135 Å²	135	150.3 Å²	150.3	82%	0.818	80%	0.797	S	S	*	*			trans	-83.8	113.4	169.8	176.2	0	0	0	0	109	L1176	V1174-L1176 PolarHBondContact O-N 3.12Å; V1174-L1176 VanDerWaalsContact O-N 3.1Å
1175	F	28.3	Very low	29.5	Very low	191 Å²	191	153.1 Å²	153.1	84%	0.838	79%	0.793	S	S	*	*			trans	-59.8	109.2	-178	-86.8	-100.2	0	0	0	113.6
1176	L	30.3	Very low	29.7	Very low	153 Å²	153	151.5 Å²	151.5	80%	0.801	79%	0.791	S	S	*	*			trans	-106.6	86.6	161.2	-83	173.7	0	0	0	110.6	V1174 M1178	V1174-L1176 PolarHBondContact O-N 3.12Å; V1174-L1176 VanDerWaalsContact O-N 3.1Å; L1176-M1178 PolarHBondContact O-N 3.41Å
1177	R	29	Very low	29.7	Very low	209 Å²	209	144.7 Å²	144.7	79%	0.789	78%	0.778	S	S	*	*			trans	-78.6	86.2	-177.5	-167.8	179.1	-167.7	154.4	7.6	112.3	N1179	R1177-N1179 PolarHBondContact O-N 2.75Å
1178	M	28	Very low	30.1	Very low	173 Å²	173	142.8 Å²	142.8	85%	0.852	77%	0.772	S	S	*	*			trans	-73.6	106.3	164.8	-69.9	-163.6	-173.7	0	0	110.6	L1176	L1176-M1178 PolarHBondContact O-N 3.41Å
1179	N	30.7	Very low	30.5	Very low	132 Å²	132	144 Å²	144	71%	0.706	77%	0.771	S	S	*	*			trans	-89.3	108	165.1	-79.2	1	0	0	0	109.3	R1177	R1177-N1179 PolarHBondContact O-N 2.75Å
1180	T	29.5	Very low	30.7	Very low	119 Å²	119	144.4 Å²	144.4	73%	0.73	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-90.4	128.5	173.7	41.8	0	0	0	0	111.4	Q1182	T1180-Q1182 PolarHBondContact O-N 2.75Å
1181	P	34.7	Very low	31	Very low	129 Å²	129	146.7 Å²	146.7	84%	0.838	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-76.2	119.1	167.4	-10.8	27.3	0	0	0	109.9
1182	Q	33.2	Very low	31	Very low	188 Å²	188	144.1 Å²	144.1	88%	0.879	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-75.6	142.7	167.5	-68.6	-166.2	9	0	0	110.7	T1180	T1180-Q1182 PolarHBondContact O-N 2.75Å
1183	S	29.9	Very low	31.2	Very low	105 Å²	105	142.9 Å²	142.9	73%	0.734	77%	0.768	S	S	*	*			trans	-106.9	148.6	168	69.7	0	0	0	0	111.9
1184	S	33.1	Very low	31.2	Very low	108 Å²	108	141.7 Å²	141.7	76%	0.755	77%	0.767	S	S	*	*			trans	-125.5	105.8	175.6	53.9	0	0	0	0	110.3
1185	R	30.1	Very low	31.3	Very low	149 Å²	149	144.9 Å²	144.9	56%	0.562	77%	0.77	S	S	*	*			trans	-58.4	148.8	167.7	-81.8	-178.5	165	148.4	-0.8	112	D1155	D1155-R1185 IonicContact OD1-NH1 3.59Å; D1155-R1185 PolarHBondContact OD1-NH1 3.39Å; D1155-R1185 IonicContact OD2-CZ 2.7Å; D1155-R1185 IonicContact OD2-NH1 2.66Å; D1155-R1185 PolarHBondContact OD2-NH1 3.36Å
1186	N	32.4	Very low	31.5	Very low	149 Å²	149	141.8 Å²	141.8	80%	0.797	77%	0.766	S	S	*	*			trans	-163.8	112.4	130.1	-83.8	-17.9	0	0	0	104.5
1187	S	31.1	Very low	31.7	Very low	98 Å²	98	139.2 Å²	139.2	69%	0.685	76%	0.761	S	S	*	*				55.7	134.1	91.2	63.1	0	0	0	0	113.2
1188	V	33.5	Very low	31.9	Very low	120 Å²	120	135 Å²	135	73%	0.727	76%	0.759	S	S	*	*				-157	141.2	53.2	159.3	0	0	0	0	113.6
1189	D	33.5	Very low	32.2	Very low	141 Å²	141	132.2 Å²	132.2	75%	0.754	75%	0.752	S	S	*	*			trans	43	115.3	148	-51.3	-11.1	0	0	0	127
1190	L	29.7	Very low	32.3	Very low	154 Å²	154	133.5 Å²	133.5	81%	0.806	76%	0.758	S	S	*	*				8.1	141.7	126.3	-62.1	166	0	0	0	122.3
1191	N	32.8	Very low	32.6	Very low	156 Å²	156	133.2 Å²	133.2	83%	0.834	76%	0.761	S	S	*	*				-166.4	158.8	113.8	-107.5	-54.6	0	0	0	116.3
1192	S	31.3	Very low	32.5	Very low	96 Å²	96	138.7 Å²	138.7	67%	0.671	78%	0.783	S	S	*	*			trans	-19.4	164.1	171.7	63.8	0	0	0	0	121.5
1193	T	32.8	Very low	32.5	Very low	122 Å²	122	136.2 Å²	136.2	75%	0.748	78%	0.778	S	S	*	*			cis	-159.9	171	32.5	-41.9	0	0	0	0	113.8
1194	L	30.2	Very low	32.6	Very low	149 Å²	149	137.8 Å²	137.8	78%	0.78	78%	0.781	S	S	*	*			trans	-43.8	158.1	172.6	-69.4	76.6	0	0	0	115.9
1195	K	33.1	Very low	32.6	Very low	202 Å²	202	139.5 Å²	139.5	88%	0.878	78%	0.782	S	S	*	*				-159.8	170.2	63.9	-82.8	-177.7	179.3	177.6	0	116.2
1196	T	32.2	Very low	32.8	Very low	125 Å²	125	138.9 Å²	138.9	77%	0.767	80%	0.795	S	S	*	*			trans	-89.5	163.3	-172.7	55.6	0	0	0	0	115
1197	S	34.4	Very low	32.8	Very low	99 Å²	99	138.3 Å²	138.3	69%	0.692	80%	0.795	S	S	*	*				153.7	133.3	114.3	-75.7	0	0	0	0	115.2
1198	T	33	Very low	32.9	Very low	122 Å²	122	141 Å²	141	75%	0.748	80%	0.802	S	S	*	*			trans	11	152.2	143.3	43.5	0	0	0	0	121.7
1199	T	34.7	Very low	32.8	Very low	114 Å²	114	142.5 Å²	142.5	70%	0.699	81%	0.807	S	S	*	*			cis	-165.8	153.1	29.4	-11.5	0	0	0	0	114
1200	L	32.3	Very low	32.8	Very low	158 Å²	158	142.6 Å²	142.6	83%	0.827	81%	0.812	S	S	*	*			trans	30	124.4	144.8	-71.5	164.3	0	0	0	122.4
1201	S	37.2	Very low	33.1	Very low	114 Å²	114	141.7 Å²	141.7	80%	0.797	81%	0.812	S	S	*	*				-176.5	150.5	105.4	38.5	0	0	0	0	112.6
1202	N	32.8	Very low	33.1	Very low	243 Å²	243	140.4 Å²	140.4	100%	1.299	81%	0.81	S	S	*	*			trans	61.9	0	-170.3	-71.5	-6.4	0	0	0	115.9

Retrieved 1,202 of 1,202 residues in 998 ms (Link to these results)

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