A0A087XMX1_POEFO Loading...

Phosphodiesterase

AlphaFold DB , UniProt , Accession A0A087XMX1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,096 aa.

						>A0A087XMX1_POEFO|A0A087XMX1
MAAREEGEVLHGKLRHHDGTGSVNSSEGFRNGYVKSCVTPLKQDHQRGFLFSVCRFCNEDVLNSKLLKVSALYVGAFVVFAVSFLISRSLQSDSVWDLRTFLLGFSQSISPLFSIGCAFFFLTFYLRRKKKQSSRSWLLSLPASCYLGDFLVLRFLQWGEDQHQMQMVGRLLFVLGCVGLLTLIPTLKLKHSVLVLVFASVVWLLSLTSLSGLPALLRPLLACFAGVSGSLLGICFDRYYQTREAPCGISSAEEKVPVIKPRRRSSCVSLGETSTSYYGSCKMPRRPSLPCISREQMILWDWDLKHWYKPQYQGAVSGNGVDLSVINEARNLVSELLMDSSLSPNTTATLRSISSLMGTFSGSCRPRVNPFTPFPGFYSVEAEDSAERSDRKGMKGLSSRNSLPTPQPRRSSTSSTSSALPPLDSSSSRWERNNGKRPHCDLSLTSSSLTNGPNANLLTIPKQRSSSVTLTYHTVPRRTGTSPSLSPVTSPSHSPPTLNTGSSSSLTPRLPVEFPDTADFLTKPSVNLNLHKPLVSSTDFQQAFRSSTFSLCTSCGRQMLKGISSSESGDSHQLFNSEAQRRRSAVEGLEYAGGDFIREEPDVTGDGKPDAEGDLGVVEEEKEKSPITELQTQKAEGEKEFRLDSMLEDHEGLMEKMDTWNFQIFELVDTTGGKTGRILSYVTYTLFQDMCLFEIFKIPVKEFMSYFCALESGYRDIPYHNRVHATDVLHAVWYLTTRPIPGFQQIHSEHVTGSDTDSDSGISPGRISYATSKSSSISDDSYGCLAWNIPALELMALYVAAAMHDYDHPGRTNAFLIATNAPQAVLYNDRSVLENHHAASAWSLYLSQPEYNFLANLDHVEFKRFRFLVIEAILATDLKKHFDFLAEFNAKVNDVNSPGIDWTNENDRLLVCQVCIKLADINGPAKVRDLHLKWTEGIVNEFYEQGDEEAKLGLPISPFMDRSAPQLAKLQESFITHIVGPLCNSYDAAGLLPGHWVNESESDEEDDEAQEDTDEEDDEEDELEVDLATGRTKGRRRLFSCIMQHLTENHKVWKKIIEEEDKNKELGKQQQPDSLPTSPSDDIQVIQEEEEGEERQ
					

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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	29.2	Very low	29.6	Very low	249 Å²	249	140.3 Å²	140.3	100%	1.227	76%	0.764	S	S	*	*				0	137.1	0	-59.2	168.8	177.9	0	0	106.6
2	A	29	Very low	29.3	Very low	101 Å²	101	134 Å²	134	84%	0.835	76%	0.757	S	S	*	*			cis	177.2	152.6	-21.1	0	0	0	0	0	106.5
3	A	30.5	Very low	29.1	Very low	92 Å²	92	138.1 Å²	138.1	76%	0.76	76%	0.761	S	S	*	*			cis	-162.1	176	-18.8	0	0	0	0	0	105.5
4	R	27.9	Very low	29	Very low	154 Å²	154	138.1 Å²	138.1	58%	0.581	76%	0.758	S	S	*	*			cis	-135.1	160.3	15	-83.7	-158.9	82.9	-137.5	-1.7	108.5	E6	R4-E6 IonicContact CZ-OE1 3.78Å; R4-E6 VanDerWaalsContact NH1-CD 3.3Å; R4-E6 IonicContact NH1-OE1 3.94Å; R4-E6 PolarHBondContact NH1-OE1 3.18Å; R4-E6 IonicContact NH1-OE2 3.41Å; R4-E6 IonicContact NH2-OE1 3.92Å; R4-E6 PolarHBondContact NH2-OE1 3.41Å
5	E	36.3	Very low	28.9	Very low	151 Å²	151	140.5 Å²	140.5	71%	0.706	75%	0.752	S	S	*	*				76.4	147.5	54.2	-57.6	-169	119.4	0	0	117.1
6	E	29.5	Very low	29	Very low	159 Å²	159	140.8 Å²	140.8	74%	0.743	75%	0.747	S	S	*	*			trans	75.9	131.7	175.3	-65.1	173	-154.7	0	0	118	R4	R4-E6 IonicContact CZ-OE1 3.78Å; R4-E6 VanDerWaalsContact NH1-CD 3.3Å; R4-E6 IonicContact NH1-OE1 3.94Å; R4-E6 PolarHBondContact NH1-OE1 3.18Å; R4-E6 IonicContact NH1-OE2 3.41Å; R4-E6 IonicContact NH2-OE1 3.92Å; R4-E6 PolarHBondContact NH2-OE1 3.41Å
7	G	29.8	Very low	28.9	Very low	67 Å²	67	140.6 Å²	140.6	69%	0.691	74%	0.74	S	S	*	*			cis	170.3	140.3	-11.4	0	0	0	0	0	116.5
8	E	28.6	Very low	28.9	Very low	186 Å²	186	140.4 Å²	140.4	87%	0.869	74%	0.74	S	S	*	*			trans	70	156	143	-65.2	-145.6	135.8	0	0	123.3
9	V	28.1	Very low	28.9	Very low	101 Å²	101	135.9 Å²	135.9	61%	0.612	73%	0.731	S	S	*	*			cis	-169.8	163.8	-33.7	73.4	0	0	0	0	113.4
10	L	28.4	Very low	28.8	Very low	125 Å²	125	136.3 Å²	136.3	65%	0.654	74%	0.738	S	S	*	*			trans	89.1	138.3	145.9	-76.7	-177.1	0	0	0	125.3
11	H	27.9	Very low	28.8	Very low	158 Å²	158	133.9 Å²	133.9	73%	0.731	75%	0.745	S	S	*	*			trans	74.2	131	148.3	-70.2	-24.4	0	0	0	121.4
12	G	26.6	Very low	28.7	Very low	65 Å²	65	127.4 Å²	127.4	67%	0.67	72%	0.724	S	S	*	*			cis	143.2	169.9	-16.9	0	0	0	0	0	116.2
13	K	27	Very low	28.7	Very low	187 Å²	187	128.3 Å²	128.3	81%	0.813	72%	0.719	S	S	*	*			trans	73.3	153.9	174.2	-57.2	-177.3	171.4	171.4	0	114.8
14	L	26.7	Very low	28.5	Very low	138 Å²	138	131.1 Å²	131.1	72%	0.723	72%	0.722	S	S	*	*			cis	-163.4	162.3	-11.6	-129.1	77.2	0	0	0	105.5
15	R	27.7	Very low	28.6	Very low	175 Å²	175	130 Å²	130	66%	0.66	74%	0.737	S	S	*	*			cis	-170.5	151.6	-11	-146	-174.4	173.5	176.2	-2.8	109.7
16	H	29.9	Very low	28.2	Very low	145 Å²	145	128.3 Å²	128.3	67%	0.671	74%	0.742	S	S	*	*			trans	60.6	163	148.5	-74.6	-8.2	0	0	0	118.5
17	H	28.8	Very low	28.2	Very low	138 Å²	138	129.9 Å²	129.9	64%	0.639	75%	0.749	S	S	*	*			cis	-159.1	156.9	-4.7	-106.6	-36.6	0	0	0	105.3
18	D	28	Very low	28	Very low	136 Å²	136	130.1 Å²	130.1	73%	0.727	75%	0.752	S	S	*	*			cis	-170.3	-164.7	-18.5	-146	99.3	0	0	0	108.2
19	G	28.7	Very low	27.9	Very low	55 Å²	55	131.3 Å²	131.3	57%	0.567	75%	0.754	S	S	*	*			trans	116.5	54.3	145.1	0	0	0	0	0	120.8
20	T	27	Very low	27.9	Very low	144 Å²	144	137.4 Å²	137.4	88%	0.883	77%	0.766	S	S	*	*			trans	42.3	117.8	141.9	58.3	0	0	0	0	121.6
21	G	29.7	Very low	27.8	Very low	86 Å²	86	138.5 Å²	138.5	89%	0.887	77%	0.773	S	S	*	*			trans	-166.3	109.8	157	0	0	0	0	0	111.1
22	S	26.6	Very low	27.7	Very low	112 Å²	112	134.2 Å²	134.2	78%	0.783	77%	0.771	S	S	*	*			trans	-114.7	142.4	-172.4	-176.8	0	0	0	0	112.3
23	V	28.6	Very low	27.7	Very low	121 Å²	121	141.7 Å²	141.7	73%	0.733	78%	0.781	S	S	*	*				160.4	117.6	127.7	160.2	0	0	0	0	111
24	N	26.8	Very low	27.8	Very low	151 Å²	151	139 Å²	139	81%	0.807	78%	0.78	S	S	*	*			trans	38.4	109.8	150.7	-53.3	0	0	0	0	121.4
25	S	29.8	Very low	27.8	Very low	129 Å²	129	141.7 Å²	141.7	90%	0.902	79%	0.786	S	S	*	*				-156.5	169.6	102.8	58	0	0	0	0	110.5
26	S	28.9	Very low	27.7	Very low	116 Å²	116	138.2 Å²	138.2	81%	0.811	79%	0.789	S	S	*	*			trans	-96.7	170.4	-156.8	54.2	0	0	0	0	116.6
27	E	27.9	Very low	27.6	Very low	193 Å²	193	136.8 Å²	136.8	90%	0.902	79%	0.793	S	S	*	*			trans	-56.2	165.8	178.9	-67.3	161.4	121.5	0	0	115.1
28	G	26.5	Very low	27.6	Very low	72 Å²	72	135.7 Å²	135.7	74%	0.742	80%	0.796	S	S	*	*			cis	-171.6	-167.3	13.2	0	0	0	0	0	118.3
29	F	27	Very low	27.4	Very low	210 Å²	210	134.7 Å²	134.7	92%	0.921	80%	0.795	S	S	*	*			trans	-83	145.4	-176.9	-88.6	-112.3	0	0	0	113.7
30	R	26.4	Very low	27.3	Very low	229 Å²	229	137.7 Å²	137.7	86%	0.864	80%	0.804	S	S	*	*			trans	150.5	145.5	148.1	-87.4	167.7	171.7	-151.9	-2.7	107.7
31	N	26.5	Very low	27.3	Very low	148 Å²	148	138.6 Å²	138.6	79%	0.791	80%	0.803	S	S	*	*			cis	-145.7	158.5	-22	-92.6	-18.7	0	0	0	104.1
32	G	26.5	Very low	27.1	Very low	68 Å²	68	143.3 Å²	143.3	70%	0.701	80%	0.799	S	S	*	*			cis	121.1	39.4	27	0	0	0	0	0	111.6
33	Y	27.6	Very low	27.1	Very low	222 Å²	222	145.9 Å²	145.9	87%	0.871	80%	0.799	S	S	*	*			trans	-128.7	137	172.9	-88.9	-74.7	0	0	0	112.7
34	V	27.8	Very low	27	Very low	131 Å²	131	145.4 Å²	145.4	79%	0.794	79%	0.792	S	S	*	*			trans	29.3	93.8	169.6	-164.9	0	0	0	0	117.4	S36	V34-S36 PolarHBondContact O-N 3.14Å
35	K	26.2	Very low	27.2	Very low	195 Å²	195	144.1 Å²	144.1	85%	0.848	78%	0.781	S	S	*	*			trans	-67.9	124.5	152.7	-84.5	-179.1	174.9	174.3	0	109.2	C37	K35-C37 PolarHBondContact O-N 2.86Å
36	S	27.4	Very low	27.3	Very low	102 Å²	102	146.2 Å²	146.2	71%	0.713	78%	0.777	S	S	*	*			trans	-63.1	107.1	171.3	-176.2	0	0	0	0	110.8	V34 V38	V34-S36 PolarHBondContact O-N 3.14Å; S36-V38 VanDerWaalsContact C-N 3.31Å; S36-V38 PolarHBondContact O-N 2.91Å; S36-V38 VanDerWaalsContact O-N 3.16Å; S36-V38 WeakPolarHBondContact OG-CG2 3.39Å
37	C	27.6	Very low	27.5	Very low	114 Å²	114	151 Å²	151	77%	0.77	78%	0.777	S	S	*	*			trans	-86.6	70.6	175	-73.2	0	0	0	0	110.2	K35 T39	K35-C37 PolarHBondContact O-N 2.86Å; C37-T39 PolarHBondContact O-N 3.01Å
38	V	27.2	Very low	28	Very low	115 Å²	115	144.1 Å²	144.1	70%	0.697	76%	0.758	S	S	*	*			trans	-62.6	96.6	175.6	-176.8	0	0	0	0	110	S36	S36-V38 VanDerWaalsContact C-N 3.31Å; S36-V38 PolarHBondContact O-N 2.91Å; S36-V38 VanDerWaalsContact O-N 3.16Å; S36-V38 WeakPolarHBondContact OG-CG2 3.39Å
39	T	25.6	Very low	28.7	Very low	115 Å²	115	144.9 Å²	144.9	71%	0.706	74%	0.741	S	S	*	*			trans	-73.3	124.1	157.5	48.6	0	0	0	0	107.6	C37 L41	C37-T39 PolarHBondContact O-N 3.01Å; T39-L41 PolarHBondContact O-N 3.46Å
40	P	25	Very low	29.4	Very low	118 Å²	118	141.3 Å²	141.3	77%	0.766	73%	0.731	S	S	*	*			trans	-73.7	92.4	-178.7	28.2	-33.7	0	0	0	109.9	K42	P40-K42 PolarHBondContact O-N 3.42Å; P40-K42 VanDerWaalsContact O-N 3.14Å
41	L	27.5	Very low	30.1	Very low	163 Å²	163	138.3 Å²	138.3	85%	0.853	72%	0.724	S	S	*	*			trans	-53.8	117.3	170.2	-88.6	167.2	0	0	0	109.5	T39 Q43	T39-L41 PolarHBondContact O-N 3.46Å; L41-Q43 PolarHBondContact O-N 3.2Å
42	K	25.2	Very low	30.9	Very low	186 Å²	186	133 Å²	133	81%	0.809	70%	0.698	S	S	*	*			trans	-68.1	117.7	173.4	-72.3	173.2	-179	163.5	0	108.6	P40 D44	P40-K42 PolarHBondContact O-N 3.42Å; P40-K42 VanDerWaalsContact O-N 3.14Å; K42-D44 VanDerWaalsContact C-N 3.29Å; K42-D44 PolarHBondContact O-N 2.85Å
43	Q	27.5	Very low	31.7	Very low	165 Å²	165	133 Å²	133	77%	0.771	69%	0.685	S	S	*	*			trans	-65.3	88.4	164.3	-71.6	-175.6	-26.8	0	0	110	L41 H45	L41-Q43 PolarHBondContact O-N 3.2Å; Q43-H45 PolarHBondContact O-N 3.13Å; Q43-H45 PolarHBondContact O-ND1 3.04Å
44	D	25.9	Very low	32.3	Very low	112 Å²	112	127.2 Å²	127.2	60%	0.599	68%	0.676	S	S	*	*			trans	-74.9	89.5	-179.2	-137.3	-26.8	0	0	0	110.5	K42 Q46 R128	K42-D44 VanDerWaalsContact C-N 3.29Å; K42-D44 PolarHBondContact O-N 2.85Å; D44-Q46 VanDerWaalsContact C-N 3.31Å; D44-Q46 PolarHBondContact O-N 3.44Å; D44-R128 IonicContact OD1-NH2 3.7Å; D44-R128 PolarHBondContact OD1-NH2 2.77Å
45	H	30.3	Very low	32.8	Very low	124 Å²	124	129.4 Å²	129.4	57%	0.574	67%	0.67	S	S	*	*			trans	-68	83	-179.3	-82.2	65	0	0	0	111.4	Q43 R47	Q43-H45 PolarHBondContact O-N 3.13Å; Q43-H45 PolarHBondContact O-ND1 3.04Å; H45-R47 VanDerWaalsContact C-N 3.33Å; H45-R47 PolarHBondContact O-N 3.46Å
46	Q	32.1	Very low	33.4	Very low	172 Å²	172	125.3 Å²	125.3	80%	0.804	65%	0.652	S	S	*	*			trans	-92.9	53.9	165.3	-66.3	-147.5	36.3	0	0	112.3	D44	D44-Q46 VanDerWaalsContact C-N 3.31Å; D44-Q46 PolarHBondContact O-N 3.44Å
47	R	33.6	Very low	34.1	Very low	216 Å²	216	126 Å²	126	82%	0.815	66%	0.656	S	S	*	*			trans	-78.2	122.2	156.3	-77.3	-172.3	173	178	-1.4	108.2	H45 F49	H45-R47 VanDerWaalsContact C-N 3.33Å; H45-R47 PolarHBondContact O-N 3.46Å; R47-F49 PolarHBondContact O-N 3.23Å
48	G	38.1	Very low	34.7	Very low	49 Å²	49	124.9 Å²	124.9	51%	0.505	64%	0.642	S	S	.	*			trans	-55.8	134.9	-167	0	0	0	0	0	114	L50 F51	G48-L50 PolarHBondContact O-N 3.4Å; G48-L50 VanDerWaalsContact O-N 3.08Å; G48-F51 WeakPolarHBondContact O-CB 3.43Å; G48-F51 PolarHBondContact O-N 2.9Å
49	F	41.7	Very low	35.3	Very low	88 Å²	88	128 Å²	128	39%	0.386	65%	0.649	S	S	.	*	H	α-helix	trans	-46.6	-42.7	-175.6	170.1	-98.4	0	0	0	113.8	R47 F51 S52 V53 F120 F121	R47-F49 PolarHBondContact O-N 3.23Å; F49-F51 VanDerWaalsContact C-N 3.3Å; F49-F51 PolarHBondContact O-N 3.08Å; F49-S52 PolarHBondContact O-N 2.71Å; F49-V53 HydrophobicContact CD1-CG2 4.37Å; F49-V53 HydrophobicContact CE1-CG2 3.84Å; F49-V53 HydrophobicContact CE2-CG2 4.26Å; F49-V53 HydrophobicContact CZ-CG2 3.77Å; F49-V53 PolarHBondContact O-N 3.41Å; F49-F120 HydrophobicContact CE2-CE1 4.34Å; F49-F120 HydrophobicContact CZ-CE1 4.29Å; F49-F121 HydrophobicContact CD1-CE1 4.37Å; F49-F121 HydrophobicContact CD1-CZ 4.47Å; F49-F121 HydrophobicContact CD2-CE1 4.34Å; F49-F121 AromaticContact CE1-CE1 3.75Å; F49-F121 HydrophobicContact CE1-CE1 3.75Å; F49-F121 AromaticContact CE1-CZ 3.6Å; F49-F121 HydrophobicContact CE1-CZ 3.6Å; F49-F121 AromaticContact CE2-CE1 3.71Å; F49-F121 HydrophobicContact CE2-CE1 3.71Å; F49-F121 HydrophobicContact CE2-CZ 4.3Å; F49-F121 AromaticContact CZ-CE1 3.38Å; F49-F121 HydrophobicContact CZ-CE1 3.38Å; F49-F121 AromaticContact CZ-CZ 3.5Å; F49-F121 HydrophobicContact CZ-CZ 3.5Å; F49-F121 VanDerWaalsContact CZ-CZ 3.5Å
50	L	41.1	Very low	36.1	Very low	135 Å²	135	129.1 Å²	129.1	71%	0.707	65%	0.651	S	S	*	*	H	α-helix	trans	-60.6	-34.6	-179.3	-65.5	170.4	0	0	0	113.2	G48 S52 V53 C54	G48-L50 PolarHBondContact O-N 3.4Å; G48-L50 VanDerWaalsContact O-N 3.08Å; L50-S52 VanDerWaalsContact C-N 3.34Å; L50-S52 PolarHBondContact O-N 3.07Å; L50-V53 PolarHBondContact O-N 3.06Å; L50-C54 PolarHBondContact O-N 3.19Å
51	F	40.7	Very low	37.2	Very low	166 Å²	166	126.2 Å²	126.2	73%	0.728	63%	0.631	S	S	*	*	H	α-helix	trans	-68.6	-33.5	-177.6	-162.7	-94.2	0	0	0	112.3	G48 F49	G48-F51 WeakPolarHBondContact O-CB 3.43Å; G48-F51 PolarHBondContact O-N 2.9Å; F49-F51 VanDerWaalsContact C-N 3.3Å; F49-F51 PolarHBondContact O-N 3.08Å
52	S	44.5	Very low	38.1	Very low	36 Å²	36	124.3 Å²	124.3	25%	0.252	62%	0.621	S	S	.	*	H	α-helix	trans	-73.2	-29.8	173.6	-71	0	0	0	0	113	F49 L50 R55	F49-S52 PolarHBondContact O-N 2.71Å; L50-S52 VanDerWaalsContact C-N 3.34Å; L50-S52 PolarHBondContact O-N 3.07Å; S52-R55 PolarHBondContact O-N 3.15Å
53	V	43.1	Very low	39.1	Very low	68 Å²	68	121.3 Å²	121.3	41%	0.412	61%	0.614	S	S	.	*	H	α-helix	trans	-67.9	-39.2	177.8	176.1	0	0	0	0	111.1	F49 L50 R55 F56	F49-V53 HydrophobicContact CD1-CG2 4.37Å; F49-V53 HydrophobicContact CE1-CG2 3.84Å; F49-V53 HydrophobicContact CE2-CG2 4.26Å; F49-V53 HydrophobicContact CZ-CG2 3.77Å; F49-V53 PolarHBondContact O-N 3.41Å; L50-V53 PolarHBondContact O-N 3.06Å; V53-R55 PolarHBondContact O-N 3.2Å; V53-R55 VanDerWaalsContact O-N 3.17Å; V53-F56 WeakPolarHBondContact O-CB 3.44Å; V53-F56 PolarHBondContact O-N 3.19Å; V53-F56 VanDerWaalsContact O-N 3.16Å
54	C	41.2	Very low	40.5	Very low	102 Å²	102	114.5 Å²	114.5	69%	0.689	59%	0.585	S	S	*	*	G	3₁₀ helix	trans	-63.7	-19.7	177.6	-64.5	0	0	0	0	114.1	L50 F56	L50-C54 PolarHBondContact O-N 3.19Å; C54-F56 VanDerWaalsContact C-N 3.27Å; C54-F56 PolarHBondContact O-N 3.14Å
55	R	38.2	Very low	41.8	Very low	176 Å²	176	118 Å²	118	66%	0.664	59%	0.594	S	S	*	*	G	3₁₀ helix	trans	-80.4	-3.4	177.8	-154.9	172.8	-175.2	170.7	2.6	113.7	S52 V53 C57	S52-R55 PolarHBondContact O-N 3.15Å; V53-R55 PolarHBondContact O-N 3.2Å; V53-R55 VanDerWaalsContact O-N 3.17Å; R55-C57 PolarHBondContact O-N 3.43Å
56	F	37.3	Very low	42.7	Very low	109 Å²	109	115.8 Å²	115.8	48%	0.478	59%	0.586	S	S	.	*	G	3₁₀ helix	trans	-73.2	-5.9	-179.4	-138	-89.3	0	0	0	114.1	V53 C54 F236	V53-F56 WeakPolarHBondContact O-CB 3.44Å; V53-F56 PolarHBondContact O-N 3.19Å; V53-F56 VanDerWaalsContact O-N 3.16Å; C54-F56 VanDerWaalsContact C-N 3.27Å; C54-F56 PolarHBondContact O-N 3.14Å; F56-F236 HydrophobicContact CE2-CD2 4.42Å
57	C	43.8	Very low	43.8	Very low	117 Å²	117	109.9 Å²	109.9	79%	0.791	56%	0.56	S	S	*	*	G	3₁₀ helix	trans	-90.4	7.4	-179.9	-63	0	0	0	0	114.8	R55	R55-C57 PolarHBondContact O-N 3.43Å
58	N	39.4	Very low	44.7	Very low	91 Å²	91	103.9 Å²	103.9	49%	0.487	54%	0.54	S	S	.	.			trans	-78.9	137.5	176	-103.5	47	0	0	0	112.5	D60 V61	N58-D60 PolarHBondContact O-N 2.99Å; N58-V61 PolarHBondContact O-N 3.27Å
59	E	38.7	Very low	45.6	Very low	180 Å²	180	105 Å²	105	84%	0.841	54%	0.537	S	S	*	.	G	3₁₀ helix	trans	-58.8	-37.7	-170.1	-119.8	173.9	141.4	0	0	114.6	V61 L62	E59-V61 PolarHBondContact O-N 3.14Å; E59-V61 VanDerWaalsContact O-N 3.1Å; E59-L62 PolarHBondContact O-N 3.45Å
60	D	44	Very low	46.3	Very low	139 Å²	139	101.5 Å²	101.5	74%	0.743	52%	0.523	S	S	*	.	G	3₁₀ helix	trans	-59.5	-27.2	-174.4	-59.1	-63.3	0	0	0	114.2	N58 L62	N58-D60 PolarHBondContact O-N 2.99Å; D60-L62 PolarHBondContact O-N 3.34Å
61	V	46.4	Very low	47	Very low	56 Å²	56	98 Å²	98	34%	0.339	51%	0.514	S	S	.	.	G	3₁₀ helix	trans	-73	-27.7	-172.8	-176.7	0	0	0	0	112.1	N58 E59 N63 L67	N58-V61 PolarHBondContact O-N 3.27Å; E59-V61 PolarHBondContact O-N 3.14Å; E59-V61 VanDerWaalsContact O-N 3.1Å; V61-N63 PolarHBondContact O-N 2.92Å; V61-N63 VanDerWaalsContact O-N 3.14Å; V61-L67 HydrophobicContact CG1-CD1 3.78Å
62	L	47.4	Very low	47.9	Very low	124 Å²	124	96.1 Å²	96.1	65%	0.649	51%	0.511	S	S	*	.	G	3₁₀ helix	trans	-65.8	-18.4	-174.6	-94.7	82.6	0	0	0	114.2	E59 D60 S64 K68	E59-L62 PolarHBondContact O-N 3.45Å; D60-L62 PolarHBondContact O-N 3.34Å; L62-S64 VanDerWaalsContact C-N 3.33Å; L62-S64 PolarHBondContact O-N 2.92Å; L62-K68 WeakPolarHBondContact O-CE 3.29Å
63	N	47.1	Very low	48.5	Very low	122 Å²	122	102.5 Å²	102.5	65%	0.652	53%	0.53	S	S	*	.	G	3₁₀ helix	trans	-79.9	-10.1	-169.5	-106.6	-41.8	0	0	0	115.5	V61 K65 K68	V61-N63 PolarHBondContact O-N 2.92Å; V61-N63 VanDerWaalsContact O-N 3.14Å; N63-K65 PolarHBondContact O-N 3.36Å; N63-K68 PolarHBondContact O-NZ 3.24Å; N63-K68 PolarHBondContact OD1-NZ 3.26Å
64	S	56.1	Low	49.5	Very low	23 Å²	23	102.5 Å²	102.5	16%	0.161	53%	0.53	C	S	.	.			trans	-58.8	130.9	-179.7	166	0	0	0	0	114.1	L62 L66 L67 K68 Y239	L62-S64 VanDerWaalsContact C-N 3.33Å; L62-S64 PolarHBondContact O-N 2.92Å; S64-L66 PolarHBondContact O-N 3.44Å; S64-L66 PolarHBondContact OG-N 2.91Å; S64-L66 VanDerWaalsContact OG-N 3.11Å; S64-L67 PolarHBondContact O-N 3.11Å; S64-L67 PolarHBondContact OG-N 3.39Å; S64-K68 WeakPolarHBondContact O-CG 3.41Å; S64-K68 PolarHBondContact O-N 3.47Å; S64-Y239 WeakPolarHBondContact CB-OH 3.39Å; S64-Y239 PolarHBondContact OG-OH 2.87Å
65	K	52.9	Low	50.4	Low	185 Å²	185	99.1 Å²	99.1	80%	0.804	51%	0.513	S	S	*	.	H	α-helix	trans	-59.4	-31	171.9	-69.1	-175.4	178.8	179.7	0	112.7	N63 V69	N63-K65 PolarHBondContact O-N 3.36Å; K65-V69 WeakPolarHBondContact O-CG2 3.27Å; K65-V69 PolarHBondContact O-N 2.88Å
66	L	49.4	Very low	51.6	Low	78 Å²	78	93.6 Å²	93.6	41%	0.408	51%	0.505	S	S	.	.	H	α-helix	trans	-77.8	-40.1	-178.7	-158	75.6	0	0	0	111.5	S64 K68 V69 S70	S64-L66 PolarHBondContact O-N 3.44Å; S64-L66 PolarHBondContact OG-N 2.91Å; S64-L66 VanDerWaalsContact OG-N 3.11Å; L66-K68 VanDerWaalsContact C-N 3.35Å; L66-V69 PolarHBondContact O-N 2.96Å; L66-S70 PolarHBondContact O-N 2.91Å
67	L	54.8	Low	52.7	Low	47 Å²	47	91.1 Å²	91.1	25%	0.246	49%	0.494	C	S	.	.	H	α-helix	trans	-64.9	-38.5	171.7	-93.7	163.5	0	0	0	111.6	V61 S64 V69 S70 A71	V61-L67 HydrophobicContact CG1-CD1 3.78Å; S64-L67 PolarHBondContact O-N 3.11Å; S64-L67 PolarHBondContact OG-N 3.39Å; L67-V69 VanDerWaalsContact C-N 3.3Å; L67-V69 PolarHBondContact O-N 3.49Å; L67-S70 PolarHBondContact O-N 2.95Å; L67-S70 VanDerWaalsContact O-N 3.15Å; L67-A71 VanDerWaalsContact O-CB 3.28Å; L67-A71 WeakPolarHBondContact O-CB 3.47Å; L67-A71 PolarHBondContact O-N 3.11Å
68	K	52.8	Low	53.6	Low	90 Å²	90	89.3 Å²	89.3	39%	0.391	48%	0.479	S	S	.	.	H	α-helix	trans	-60.2	-37.8	174.2	-73.6	165.6	-179.4	167	0	112.2	L62 N63 S64 L66 L72	L62-K68 WeakPolarHBondContact O-CE 3.29Å; N63-K68 PolarHBondContact O-NZ 3.24Å; N63-K68 PolarHBondContact OD1-NZ 3.26Å; S64-K68 WeakPolarHBondContact O-CG 3.41Å; S64-K68 PolarHBondContact O-N 3.47Å; L66-K68 VanDerWaalsContact C-N 3.35Å; K68-L72 WeakPolarHBondContact O-CB 3.34Å; K68-L72 VanDerWaalsContact O-CG 3.29Å; K68-L72 WeakPolarHBondContact O-CG 3.25Å; K68-L72 PolarHBondContact O-N 3.31Å
69	V	56.5	Low	54.9	Low	73 Å²	73	89.3 Å²	89.3	44%	0.442	48%	0.483	S	S	.	.	H	α-helix	trans	-68.9	-43.5	171.5	172.7	0	0	0	0	111.9	K65 L66 L67 A71 L72 Y73	K65-V69 WeakPolarHBondContact O-CG2 3.27Å; K65-V69 PolarHBondContact O-N 2.88Å; L66-V69 PolarHBondContact O-N 2.96Å; L67-V69 VanDerWaalsContact C-N 3.3Å; L67-V69 PolarHBondContact O-N 3.49Å; V69-A71 VanDerWaalsContact C-N 3.34Å; V69-A71 PolarHBondContact O-N 3.35Å; V69-L72 WeakPolarHBondContact O-CB 3.45Å; V69-L72 PolarHBondContact O-N 3Å; V69-Y73 HydrophobicContact CG1-CD2 3.86Å; V69-Y73 HydrophobicContact CG1-CE2 3.74Å; V69-Y73 WeakPolarHBondContact O-CD2 3.43Å; V69-Y73 PolarHBondContact O-N 3.3Å
70	S	56.3	Low	56	Low	15 Å²	15	86 Å²	86	11%	0.105	47%	0.466	C	S	.	.	H	α-helix	trans	-62.3	-40.9	176.7	-167.2	0	0	0	0	112.3	L66 L67 Y73 V74	L66-S70 PolarHBondContact O-N 2.91Å; L67-S70 PolarHBondContact O-N 2.95Å; L67-S70 VanDerWaalsContact O-N 3.15Å; S70-Y73 PolarHBondContact O-N 2.88Å; S70-V74 WeakPolarHBondContact O-CG2 3.4Å; S70-V74 PolarHBondContact O-N 3.43Å
71	A	57	Low	56.6	Low	62 Å²	62	80.4 Å²	80.4	51%	0.512	44%	0.439	S	S	.	.	H	α-helix	trans	-68.3	-32.5	176.1	0	0	0	0	0	112.1	L67 V69 G75	L67-A71 VanDerWaalsContact O-CB 3.28Å; L67-A71 WeakPolarHBondContact O-CB 3.47Å; L67-A71 PolarHBondContact O-N 3.11Å; V69-A71 VanDerWaalsContact C-N 3.34Å; V69-A71 PolarHBondContact O-N 3.35Å; A71-G75 WeakPolarHBondContact O-CA 3.24Å; A71-G75 PolarHBondContact O-N 3.36Å
72	L	59.4	Low	57.3	Low	126 Å²	126	80 Å²	80	66%	0.66	44%	0.436	S	S	*	.	H	α-helix	trans	-66.1	-41.4	170.1	-79.5	165.9	0	0	0	112.1	K68 V69 A76	K68-L72 WeakPolarHBondContact O-CB 3.34Å; K68-L72 VanDerWaalsContact O-CG 3.29Å; K68-L72 WeakPolarHBondContact O-CG 3.25Å; K68-L72 PolarHBondContact O-N 3.31Å; V69-L72 WeakPolarHBondContact O-CB 3.45Å; V69-L72 PolarHBondContact O-N 3Å; L72-A76 WeakPolarHBondContact O-CB 3.31Å; L72-A76 PolarHBondContact O-N 2.87Å
73	Y	57.8	Low	58.1	Low	169 Å²	169	77.3 Å²	77.3	66%	0.663	43%	0.427	S	S	*	.	H	α-helix	trans	-68	-42.7	175	-82.5	-70.9	0	0	0	112.8	V69 S70 A76 F77	V69-Y73 HydrophobicContact CG1-CD2 3.86Å; V69-Y73 HydrophobicContact CG1-CE2 3.74Å; V69-Y73 WeakPolarHBondContact O-CD2 3.43Å; V69-Y73 PolarHBondContact O-N 3.3Å; S70-Y73 PolarHBondContact O-N 2.88Å; Y73-A76 PolarHBondContact O-N 2.86Å; Y73-F77 WeakPolarHBondContact O-CB 3.42Å; Y73-F77 PolarHBondContact O-N 3.24Å
74	V	62.2	Low	58.7	Low	68 Å²	68	74.2 Å²	74.2	41%	0.412	41%	0.408	S	S	.	.	H	α-helix	trans	-66.6	-41.8	175.6	171.5	0	0	0	0	110.9	S70 F77 V78	S70-V74 WeakPolarHBondContact O-CG2 3.4Å; S70-V74 PolarHBondContact O-N 3.43Å; V74-F77 PolarHBondContact O-N 3.05Å; V74-V78 HydrophobicContact CG1-CG2 4.47Å; V74-V78 WeakPolarHBondContact O-CG2 3.38Å; V74-V78 PolarHBondContact O-N 2.81Å
75	G	61.7	Low	58.8	Low	32 Å²	32	74.3 Å²	74.3	33%	0.33	41%	0.407	S	S	.	.	H	α-helix	trans	-61.8	-45.4	174.3	0	0	0	0	0	112.4	A71 F77 V78 V79	A71-G75 WeakPolarHBondContact O-CA 3.24Å; A71-G75 PolarHBondContact O-N 3.36Å; G75-F77 VanDerWaalsContact C-N 3.34Å; G75-F77 PolarHBondContact O-N 2.73Å; G75-V78 PolarHBondContact O-N 3.42Å; G75-V79 WeakPolarHBondContact O-CB 3.37Å; G75-V79 VanDerWaalsContact O-CG2 3.29Å; G75-V79 WeakPolarHBondContact O-CG2 3.24Å; G75-V79 PolarHBondContact O-N 3.04Å
76	A	63.4	Low	59	Low	59 Å²	59	68.9 Å²	68.9	49%	0.488	39%	0.386	S	S	.	.	H	α-helix	trans	-63.6	-37.3	174.8	0	0	0	0	0	112.4	L72 Y73 F80	L72-A76 WeakPolarHBondContact O-CB 3.31Å; L72-A76 PolarHBondContact O-N 2.87Å; Y73-A76 PolarHBondContact O-N 2.86Å; A76-F80 VanDerWaalsContact O-CB 3.23Å; A76-F80 WeakPolarHBondContact O-CB 3.44Å; A76-F80 PolarHBondContact O-N 3.03Å
77	F	59.3	Low	59.4	Low	58 Å²	58	68.3 Å²	68.3	25%	0.254	39%	0.388	S	S	.	.	H	α-helix	trans	-67	-43.7	174.6	-177.2	-93.6	0	0	0	112.2	Y73 V74 G75 F80 A81 L112 L221 F224	Y73-F77 WeakPolarHBondContact O-CB 3.42Å; Y73-F77 PolarHBondContact O-N 3.24Å; V74-F77 PolarHBondContact O-N 3.05Å; G75-F77 VanDerWaalsContact C-N 3.34Å; G75-F77 PolarHBondContact O-N 2.73Å; F77-F80 PolarHBondContact O-N 3.02Å; F77-A81 VanDerWaalsContact O-CB 3.31Å; F77-A81 WeakPolarHBondContact O-CB 3.5Å; F77-A81 PolarHBondContact O-N 3.4Å; F77-L112 HydrophobicContact CZ-CD1 4.26Å; F77-L221 HydrophobicContact CE2-CD2 3.66Å; F77-L221 HydrophobicContact CZ-CD2 4.03Å; F77-F224 HydrophobicContact CD2-CB 4.25Å; F77-F224 HydrophobicContact CE2-CB 3.89Å
78	V	63.6	Low	59.5	Low	78 Å²	78	71.8 Å²	71.8	47%	0.473	40%	0.398	S	S	.	.	H	α-helix	trans	-63.6	-45.4	174.9	169.8	0	0	0	0	110.7	V74 G75 A81 V82	V74-V78 HydrophobicContact CG1-CG2 4.47Å; V74-V78 WeakPolarHBondContact O-CG2 3.38Å; V74-V78 PolarHBondContact O-N 2.81Å; G75-V78 PolarHBondContact O-N 3.42Å; V78-A81 PolarHBondContact O-N 3.46Å; V78-V82 HydrophobicContact CG1-CG2 4.3Å; V78-V82 VanDerWaalsContact O-CB 3.29Å; V78-V82 WeakPolarHBondContact O-CB 3.34Å; V78-V82 VanDerWaalsContact O-CG2 3.24Å; V78-V82 WeakPolarHBondContact O-CG2 3.32Å; V78-V82 PolarHBondContact O-N 3.29Å
79	V	66.6	Low	59.5	Low	92 Å²	92	69.5 Å²	69.5	56%	0.558	39%	0.393	S	S	*	.	H	α-helix	trans	-60.9	-45.4	174.8	169.2	0	0	0	0	110.8	G75 V82 S83	G75-V79 WeakPolarHBondContact O-CB 3.37Å; G75-V79 VanDerWaalsContact O-CG2 3.29Å; G75-V79 WeakPolarHBondContact O-CG2 3.24Å; G75-V79 PolarHBondContact O-N 3.04Å; V79-V82 PolarHBondContact O-N 3.34Å; V79-S83 VanDerWaalsContact O-CB 3.29Å; V79-S83 WeakPolarHBondContact O-CB 3.45Å; V79-S83 PolarHBondContact O-N 3.04Å; V79-S83 PolarHBondContact O-OG 3.35Å; V79-S83 VanDerWaalsContact O-OG 3.07Å
80	F	62.1	Low	59.2	Low	111 Å²	111	72.3 Å²	72.3	49%	0.487	41%	0.405	S	S	.	.	H	α-helix	trans	-62.7	-44.8	177.5	-177.5	-99.3	0	0	0	112.3	A76 F77 S83 F84	A76-F80 VanDerWaalsContact O-CB 3.23Å; A76-F80 WeakPolarHBondContact O-CB 3.44Å; A76-F80 PolarHBondContact O-N 3.03Å; F77-F80 PolarHBondContact O-N 3.02Å; F80-S83 PolarHBondContact O-N 3.45Å; F80-F84 VanDerWaalsContact O-CB 3.24Å; F80-F84 WeakPolarHBondContact O-CB 3.38Å; F80-F84 PolarHBondContact O-N 3.19Å
81	A	56.9	Low	59.1	Low	21 Å²	21	79.4 Å²	79.4	17%	0.174	44%	0.437	C	S	.	.	H	α-helix	trans	-64.2	-42.7	176.8	0	0	0	0	0	112.1	F77 V78 F84 L85	F77-A81 VanDerWaalsContact O-CB 3.31Å; F77-A81 WeakPolarHBondContact O-CB 3.5Å; F77-A81 PolarHBondContact O-N 3.4Å; V78-A81 PolarHBondContact O-N 3.46Å; A81-F84 PolarHBondContact O-N 3.46Å; A81-L85 WeakPolarHBondContact O-CB 3.46Å; A81-L85 VanDerWaalsContact O-CG 3.28Å; A81-L85 WeakPolarHBondContact O-CG 3.39Å; A81-L85 PolarHBondContact O-N 3.05Å
82	V	60.3	Low	58.7	Low	47 Å²	47	79.1 Å²	79.1	29%	0.285	43%	0.431	S	S	.	.	H	α-helix	trans	-66.1	-46.5	176	168.3	0	0	0	0	111	V78 V79 F84 L85 I86 F105	V78-V82 HydrophobicContact CG1-CG2 4.3Å; V78-V82 VanDerWaalsContact O-CB 3.29Å; V78-V82 WeakPolarHBondContact O-CB 3.34Å; V78-V82 VanDerWaalsContact O-CG2 3.24Å; V78-V82 WeakPolarHBondContact O-CG2 3.32Å; V78-V82 PolarHBondContact O-N 3.29Å; V79-V82 PolarHBondContact O-N 3.34Å; V82-F84 VanDerWaalsContact C-N 3.31Å; V82-F84 PolarHBondContact O-N 2.92Å; V82-L85 PolarHBondContact O-N 2.9Å; V82-I86 HydrophobicContact CG1-CD1 3.61Å; V82-I86 HydrophobicContact CG1-CG1 4.33Å; V82-I86 WeakPolarHBondContact O-CB 3.29Å; V82-I86 VanDerWaalsContact O-CG1 3.24Å; V82-I86 WeakPolarHBondContact O-CG1 3.42Å; V82-I86 PolarHBondContact O-N 3.47Å; V82-F105 HydrophobicContact CG2-CE2 4.26Å
83	S	64.3	Low	58.2	Low	67 Å²	67	81.5 Å²	81.5	47%	0.469	44%	0.444	S	S	.	.	H	α-helix	trans	-61.4	-37.1	174.9	-67.3	0	0	0	0	112.6	V79 F80 S87	V79-S83 VanDerWaalsContact O-CB 3.29Å; V79-S83 WeakPolarHBondContact O-CB 3.45Å; V79-S83 PolarHBondContact O-N 3.04Å; V79-S83 PolarHBondContact O-OG 3.35Å; V79-S83 VanDerWaalsContact O-OG 3.07Å; F80-S83 PolarHBondContact O-N 3.45Å; S83-S87 VanDerWaalsContact O-CB 3.24Å; S83-S87 WeakPolarHBondContact O-CB 3.3Å; S83-S87 PolarHBondContact O-N 3.32Å
84	F	59.8	Low	57.9	Low	58 Å²	58	77.8 Å²	77.8	25%	0.254	44%	0.443	S	S	.	.	H	α-helix	trans	-68.5	-42	175.6	-176	-101.5	0	0	0	112.2	F80 A81 V82 S87 R88 L213 P214 L217	F80-F84 VanDerWaalsContact O-CB 3.24Å; F80-F84 WeakPolarHBondContact O-CB 3.38Å; F80-F84 PolarHBondContact O-N 3.19Å; A81-F84 PolarHBondContact O-N 3.46Å; V82-F84 VanDerWaalsContact C-N 3.31Å; V82-F84 PolarHBondContact O-N 2.92Å; F84-S87 PolarHBondContact O-N 3.49Å; F84-R88 PolarHBondContact O-N 2.93Å; F84-L213 HydrophobicContact CE1-CD2 4.15Å; F84-P214 HydrophobicContact CZ-CG 4.05Å; F84-L217 HydrophobicContact CE2-CD1 4.34Å; F84-L217 HydrophobicContact CE2-CD2 4.23Å; F84-L217 HydrophobicContact CZ-CD1 4.07Å; F84-L217 HydrophobicContact CZ-CD2 4.26Å
85	L	56.8	Low	57.3	Low	24 Å²	24	80.9 Å²	80.9	13%	0.126	46%	0.462	C	S	.	.	H	α-helix	trans	-68.4	-37.5	175.4	-70.2	170.9	0	0	0	112.2	A81 V82 R88 S89 F101 F105	A81-L85 WeakPolarHBondContact O-CB 3.46Å; A81-L85 VanDerWaalsContact O-CG 3.28Å; A81-L85 WeakPolarHBondContact O-CG 3.39Å; A81-L85 PolarHBondContact O-N 3.05Å; V82-L85 PolarHBondContact O-N 2.9Å; L85-R88 PolarHBondContact O-N 3.38Å; L85-S89 PolarHBondContact O-N 2.98Å; L85-S89 PolarHBondContact O-OG 2.95Å; L85-F101 HydrophobicContact CB-CE2 3.94Å; L85-F101 HydrophobicContact CB-CZ 4.38Å; L85-F105 HydrophobicContact CD1-CB 4.5Å; L85-F105 HydrophobicContact CD1-CD2 3.73Å
86	I	58.4	Low	57	Low	72 Å²	72	90 Å²	90	37%	0.369	49%	0.487	S	S	.	.	H	α-helix	trans	-63.4	-46.7	172.2	-71.7	168.4	0	0	0	110.6	V82 R88 S89 L90	V82-I86 HydrophobicContact CG1-CD1 3.61Å; V82-I86 HydrophobicContact CG1-CG1 4.33Å; V82-I86 WeakPolarHBondContact O-CB 3.29Å; V82-I86 VanDerWaalsContact O-CG1 3.24Å; V82-I86 WeakPolarHBondContact O-CG1 3.42Å; V82-I86 PolarHBondContact O-N 3.47Å; I86-R88 PolarHBondContact O-N 3.05Å; I86-S89 WeakPolarHBondContact CA-OG 3.39Å; I86-S89 PolarHBondContact O-N 3.44Å; I86-S89 VanDerWaalsContact O-N 3.11Å; I86-S89 PolarHBondContact O-OG 2.94Å; I86-L90 HydrophobicContact CG2-CD1 3.89Å; I86-L90 HydrophobicContact CG2-CG 4.5Å; I86-L90 WeakPolarHBondContact O-CG 3.43Å; I86-L90 PolarHBondContact O-N 3.19Å
87	S	58.5	Low	56.8	Low	65 Å²	65	91.2 Å²	91.2	46%	0.455	49%	0.485	S	S	.	.	H	α-helix	trans	-57.1	-38	175.3	-172.5	0	0	0	0	111.9	S83 F84 L90 Q91	S83-S87 VanDerWaalsContact O-CB 3.24Å; S83-S87 WeakPolarHBondContact O-CB 3.3Å; S83-S87 PolarHBondContact O-N 3.32Å; F84-S87 PolarHBondContact O-N 3.49Å; S87-L90 PolarHBondContact O-N 3.33Å; S87-Q91 PolarHBondContact O-N 3.36Å
88	R	56	Low	56.9	Low	120 Å²	120	93.8 Å²	93.8	45%	0.453	50%	0.501	S	S	.	.	H	α-helix	trans	-72.1	-36.2	175.3	-166.3	173.7	-179.7	-177.1	-1	113.4	F84 L85 I86 L90 Q91 G212	F84-R88 PolarHBondContact O-N 2.93Å; L85-R88 PolarHBondContact O-N 3.38Å; I86-R88 PolarHBondContact O-N 3.05Å; R88-L90 VanDerWaalsContact C-N 3.27Å; R88-L90 PolarHBondContact O-N 2.94Å; R88-Q91 PolarHBondContact O-N 3.04Å; R88-G212 PolarHBondContact NH1-O 3.44Å; R88-G212 PolarHBondContact NH2-O 3.29Å
89	S	51.9	Low	56.5	Low	42 Å²	42	99.7 Å²	99.7	29%	0.294	52%	0.515	S	S	.	.	H	α-helix	trans	-69.4	-24.7	171.3	58.1	0	0	0	0	113.4	L85 I86 Q91 S92	L85-S89 PolarHBondContact O-N 2.98Å; L85-S89 PolarHBondContact O-OG 2.95Å; I86-S89 WeakPolarHBondContact CA-OG 3.39Å; I86-S89 PolarHBondContact O-N 3.44Å; I86-S89 VanDerWaalsContact O-N 3.11Å; I86-S89 PolarHBondContact O-OG 2.94Å; S89-Q91 PolarHBondContact O-N 3.22Å; S89-S92 PolarHBondContact O-N 2.86Å; S89-S92 PolarHBondContact O-OG 2.94Å
90	L	51	Low	56.4	Low	133 Å²	133	99.7 Å²	99.7	70%	0.696	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.1	-6.9	172.5	-74	165.1	0	0	0	113.4	I86 S87 R88	I86-L90 HydrophobicContact CG2-CD1 3.89Å; I86-L90 HydrophobicContact CG2-CG 4.5Å; I86-L90 WeakPolarHBondContact O-CG 3.43Å; I86-L90 PolarHBondContact O-N 3.19Å; S87-L90 PolarHBondContact O-N 3.33Å; R88-L90 VanDerWaalsContact C-N 3.27Å; R88-L90 PolarHBondContact O-N 2.94Å
91	Q	53.9	Low	56.5	Low	163 Å²	163	97.4 Å²	97.4	76%	0.762	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.9	5.2	172.2	-73	-170.2	-44.4	0	0	113.5	S87 R88 S89	S87-Q91 PolarHBondContact O-N 3.36Å; R88-Q91 PolarHBondContact O-N 3.04Å; S89-Q91 PolarHBondContact O-N 3.22Å
92	S	49.2	Very low	56.8	Low	56 Å²	56	100.8 Å²	100.8	39%	0.392	52%	0.52	S	S	.	.			trans	-113	112.5	172.3	51.9	0	0	0	0	110.2	S89 S94	S89-S92 PolarHBondContact O-N 2.86Å; S89-S92 PolarHBondContact O-OG 2.94Å; S92-S94 PolarHBondContact O-N 3.48Å
93	D	48.4	Very low	57	Low	176 Å²	176	103.6 Å²	103.6	94%	0.941	53%	0.533	S	S	*	.			trans	-67	10	-178.2	-65.2	-50.7	0	0	0	114.9
94	S	51.3	Low	57.1	Low	91 Å²	91	101.5 Å²	101.5	64%	0.636	52%	0.522	S	S	*	.	S	Bend	trans	-102.1	123	-179.8	59.1	0	0	0	0	112	S92 W96	S92-S94 PolarHBondContact O-N 3.48Å; S94-W96 PolarHBondContact O-N 3.31Å
95	V	49.5	Very low	57.4	Low	134 Å²	134	102 Å²	102	81%	0.812	52%	0.524	S	S	*	.			trans	-58.5	116.7	-175.2	178.9	0	0	0	0	113.2	D97	V95-D97 PolarHBondContact O-N 2.9Å
96	W	55.4	Low	58	Low	222 Å²	222	104.1 Å²	104.1	84%	0.841	54%	0.541	S	S	*	.			trans	22.7	78.1	152.2	-61.3	89.7	0	0	0	118.6	S94	S94-W96 PolarHBondContact O-N 3.31Å
97	D	60.4	Low	58.6	Low	86 Å²	86	106.4 Å²	106.4	46%	0.46	55%	0.55	S	S	.	*			trans	-95.1	100.9	151	-176.1	4.5	0	0	0	110.3	V95 R99 T100 F101	V95-D97 PolarHBondContact O-N 2.9Å; D97-R99 PolarHBondContact O-N 3.32Å; D97-R99 VanDerWaalsContact O-N 3.09Å; D97-R99 WeakPolarHBondContact OD1-CB 3.36Å; D97-R99 PolarHBondContact OD1-N 3.26Å; D97-T100 HydrophobicContact CB-CG2 4.05Å; D97-T100 PolarHBondContact O-N 3.28Å; D97-T100 PolarHBondContact O-OG1 2.75Å; D97-F101 PolarHBondContact O-N 2.82Å
98	L	59.8	Low	59.2	Low	112 Å²	112	103.9 Å²	103.9	59%	0.586	53%	0.532	S	S	*	.	H	α-helix	trans	-51.6	-30.3	175.1	179.1	62.7	0	0	0	112.7	F101 L102	L98-F101 PolarHBondContact O-N 3.39Å; L98-L102 HydrophobicContact CD1-CD1 4.14Å; L98-L102 HydrophobicContact CD1-CG 4.07Å; L98-L102 HydrophobicContact CD2-CD1 4.42Å; L98-L102 HydrophobicContact CG-CD1 3.86Å; L98-L102 HydrophobicContact CG-CG 4.24Å; L98-L102 WeakPolarHBondContact O-CB 3.34Å; L98-L102 VanDerWaalsContact O-CG 3.29Å; L98-L102 WeakPolarHBondContact O-CG 3.48Å; L98-L102 PolarHBondContact O-N 3.07Å
99	R	56.7	Low	60.3	Low	201 Å²	201	101.1 Å²	101.1	76%	0.758	53%	0.526	S	S	*	.	H	α-helix	trans	-65.9	-39.9	178.4	-166.6	179.4	-175.5	172.5	1.1	111.8	D97 L103	D97-R99 PolarHBondContact O-N 3.32Å; D97-R99 VanDerWaalsContact O-N 3.09Å; D97-R99 WeakPolarHBondContact OD1-CB 3.36Å; D97-R99 PolarHBondContact OD1-N 3.26Å; R99-L103 WeakPolarHBondContact O-CB 3.38Å; R99-L103 PolarHBondContact O-N 3.28Å
100	T	63.7	Low	61.5	Low	93 Å²	93	102.9 Å²	102.9	57%	0.571	54%	0.538	S	S	*	.	H	α-helix	trans	-68	-41.7	176.7	66.3	0	0	0	0	111.6	D97 L103 G104	D97-T100 HydrophobicContact CB-CG2 4.05Å; D97-T100 PolarHBondContact O-N 3.28Å; D97-T100 PolarHBondContact O-OG1 2.75Å; T100-L103 PolarHBondContact O-N 3.4Å; T100-G104 PolarHBondContact O-N 3.26Å
101	F	64.1	Low	62.9	Low	62 Å²	62	97.4 Å²	97.4	27%	0.272	51%	0.511	S	S	.	.	H	α-helix	trans	-60.9	-50.2	175.2	178.8	-91.4	0	0	0	111.4	L85 D97 L98 L103 G104 F105	L85-F101 HydrophobicContact CB-CE2 3.94Å; L85-F101 HydrophobicContact CB-CZ 4.38Å; D97-F101 PolarHBondContact O-N 2.82Å; L98-F101 PolarHBondContact O-N 3.39Å; F101-L103 VanDerWaalsContact C-N 3.31Å; F101-L103 PolarHBondContact O-N 3.07Å; F101-G104 PolarHBondContact O-N 3.43Å; F101-F105 HydrophobicContact CE1-CD2 4.38Å; F101-F105 WeakPolarHBondContact O-CB 3.37Å; F101-F105 PolarHBondContact O-N 2.77Å
102	L	63.2	Low	64.1	Low	92 Å²	92	90.4 Å²	90.4	48%	0.482	48%	0.478	S	S	.	.	H	α-helix	trans	-63.2	-35.1	178.4	-71.8	174	0	0	0	112.6	L98 S106	L98-L102 HydrophobicContact CD1-CD1 4.14Å; L98-L102 HydrophobicContact CD1-CG 4.07Å; L98-L102 HydrophobicContact CD2-CD1 4.42Å; L98-L102 HydrophobicContact CG-CD1 3.86Å; L98-L102 HydrophobicContact CG-CG 4.24Å; L98-L102 WeakPolarHBondContact O-CB 3.34Å; L98-L102 VanDerWaalsContact O-CG 3.29Å; L98-L102 WeakPolarHBondContact O-CG 3.48Å; L98-L102 PolarHBondContact O-N 3.07Å; L102-S106 VanDerWaalsContact O-CB 3.24Å; L102-S106 WeakPolarHBondContact O-CB 3.24Å; L102-S106 PolarHBondContact O-N 2.82Å
103	L	65.8	Low	65.7	Low	106 Å²	106	94.8 Å²	94.8	56%	0.555	49%	0.491	S	S	*	.	H	α-helix	trans	-67	-47.9	176.2	-163	74.9	0	0	0	111.4	R99 T100 F101 S106 Q107	R99-L103 WeakPolarHBondContact O-CB 3.38Å; R99-L103 PolarHBondContact O-N 3.28Å; T100-L103 PolarHBondContact O-N 3.4Å; F101-L103 VanDerWaalsContact C-N 3.31Å; F101-L103 PolarHBondContact O-N 3.07Å; L103-S106 PolarHBondContact O-N 3.39Å; L103-Q107 WeakPolarHBondContact O-CB 3.28Å; L103-Q107 VanDerWaalsContact O-CG 3.28Å; L103-Q107 WeakPolarHBondContact O-CG 3.19Å; L103-Q107 PolarHBondContact O-N 3.37Å
104	G	65.5	Low	67.3	Low	24 Å²	24	90 Å²	90	25%	0.247	47%	0.471	C	S	.	.	H	α-helix	trans	-66.8	-35.5	177.3	0	0	0	0	0	113.5	T100 F101 S108	T100-G104 PolarHBondContact O-N 3.26Å; F101-G104 PolarHBondContact O-N 3.43Å; G104-S108 WeakPolarHBondContact O-CB 3.44Å; G104-S108 PolarHBondContact O-N 2.94Å; G104-S108 VanDerWaalsContact O-N 3.09Å; G104-S108 PolarHBondContact O-OG 3.48Å
105	F	65.9	Low	68.8	Low	68 Å²	68	86 Å²	86	30%	0.298	44%	0.443	S	S	.	.	H	α-helix	trans	-61.1	-50.7	171.5	-178.8	-89.2	0	0	0	110.8	V82 L85 F101 S108 I109	V82-F105 HydrophobicContact CG2-CE2 4.26Å; L85-F105 HydrophobicContact CD1-CB 4.5Å; L85-F105 HydrophobicContact CD1-CD2 3.73Å; F101-F105 HydrophobicContact CE1-CD2 4.38Å; F101-F105 WeakPolarHBondContact O-CB 3.37Å; F101-F105 PolarHBondContact O-N 2.77Å; F105-S108 PolarHBondContact O-N 2.78Å; F105-I109 HydrophobicContact CD1-CD1 3.84Å; F105-I109 HydrophobicContact CD2-CD1 3.63Å; F105-I109 HydrophobicContact CE1-CD1 3.59Å; F105-I109 HydrophobicContact CE2-CD1 3.36Å; F105-I109 HydrophobicContact CG-CD1 3.86Å; F105-I109 HydrophobicContact CZ-CD1 3.34Å; F105-I109 WeakPolarHBondContact O-CB 3.29Å; F105-I109 PolarHBondContact O-N 2.85Å
106	S	69.6	Low	70.5	Confident	69 Å²	69	80.3 Å²	80.3	48%	0.483	41%	0.41	S	S	.	.	H	α-helix	trans	-59.7	-49.1	177.2	-178.1	0	0	0	0	112.5	L102 L103 S108 I109 S110	L102-S106 VanDerWaalsContact O-CB 3.24Å; L102-S106 WeakPolarHBondContact O-CB 3.24Å; L102-S106 PolarHBondContact O-N 2.82Å; L103-S106 PolarHBondContact O-N 3.39Å; S106-S108 PolarHBondContact O-N 2.84Å; S106-I109 PolarHBondContact O-N 3.39Å; S106-S110 WeakPolarHBondContact O-CB 3.4Å; S106-S110 PolarHBondContact O-N 2.86Å
107	Q	71.8	Confident	71.9	Confident	120 Å²	120	71.7 Å²	71.7	56%	0.561	38%	0.383	S	S	*	.	H	α-helix	trans	-60	-30.4	177.5	-74.6	173.7	-6.4	0	0	113.2	L103 P111	L103-Q107 WeakPolarHBondContact O-CB 3.28Å; L103-Q107 VanDerWaalsContact O-CG 3.28Å; L103-Q107 WeakPolarHBondContact O-CG 3.19Å; L103-Q107 PolarHBondContact O-N 3.37Å; Q107-P111 WeakPolarHBondContact O-CD 3.23Å; Q107-P111 VanDerWaalsContact O-CG 3.3Å; Q107-P111 WeakPolarHBondContact O-CG 3.31Å
108	S	70.9	Confident	73	Confident	11 Å²	11	68.4 Å²	68.4	8%	0.077	37%	0.369	C	S	.	.	H	α-helix	trans	-87.4	-34.4	179.9	-55.2	0	0	0	0	113.2	G104 F105 S106 L112	G104-S108 WeakPolarHBondContact O-CB 3.44Å; G104-S108 PolarHBondContact O-N 2.94Å; G104-S108 VanDerWaalsContact O-N 3.09Å; G104-S108 PolarHBondContact O-OG 3.48Å; F105-S108 PolarHBondContact O-N 2.78Å; S106-S108 PolarHBondContact O-N 2.84Å; S108-L112 WeakPolarHBondContact O-CD1 3.5Å; S108-L112 WeakPolarHBondContact O-CG 3.16Å
109	I	77.4	Confident	74.2	Confident	62 Å²	62	63.2 Å²	63.2	32%	0.318	34%	0.341	S	S	.	.	H	α-helix	trans	-90.7	-33.5	-171.7	-72.9	168.9	0	0	0	112.7	F105 S106 L112 F113	F105-I109 HydrophobicContact CD1-CD1 3.84Å; F105-I109 HydrophobicContact CD2-CD1 3.63Å; F105-I109 HydrophobicContact CE1-CD1 3.59Å; F105-I109 HydrophobicContact CE2-CD1 3.36Å; F105-I109 HydrophobicContact CG-CD1 3.86Å; F105-I109 HydrophobicContact CZ-CD1 3.34Å; F105-I109 WeakPolarHBondContact O-CB 3.29Å; F105-I109 PolarHBondContact O-N 2.85Å; S106-I109 PolarHBondContact O-N 3.39Å; I109-L112 PolarHBondContact O-N 3.15Å; I109-F113 WeakPolarHBondContact O-CB 3.24Å; I109-F113 PolarHBondContact O-N 3.08Å
110	S	78	Confident	75.6	Confident	79 Å²	79	55.4 Å²	55.4	55%	0.552	31%	0.313	S	S	*	.	H	α-helix	trans	-53	-51	174	-179.3	0	0	0	0	113.2	S106 F113 S114	S106-S110 WeakPolarHBondContact O-CB 3.4Å; S106-S110 PolarHBondContact O-N 2.86Å; S110-F113 PolarHBondContact O-N 3.04Å; S110-S114 PolarHBondContact O-N 3.01Å
111	P	80.6	Confident	76.6	Confident	18 Å²	18	55.5 Å²	55.5	12%	0.117	31%	0.306	C	S	.	.	H	α-helix	trans	-66.3	-39	175.1	24.2	-33.6	0	0	0	113.7	Q107 F113 S114 I115 S209 L210	Q107-P111 WeakPolarHBondContact O-CD 3.23Å; Q107-P111 VanDerWaalsContact O-CG 3.3Å; Q107-P111 WeakPolarHBondContact O-CG 3.31Å; P111-F113 VanDerWaalsContact C-N 3.32Å; P111-F113 PolarHBondContact O-N 2.96Å; P111-S114 WeakPolarHBondContact O-CB 3.45Å; P111-S114 PolarHBondContact O-N 3.38Å; P111-I115 VanDerWaalsContact O-CD1 3.29Å; P111-I115 WeakPolarHBondContact O-CD1 3.24Å; P111-I115 WeakPolarHBondContact O-CG1 3.45Å; P111-I115 PolarHBondContact O-N 3.48Å; P111-S209 WeakPolarHBondContact CB-OG 3.28Å; P111-L210 HydrophobicContact CB-CD2 4.05Å; P111-L210 HydrophobicContact CG-CD2 3.68Å
112	L	79.8	Confident	77.4	Confident	16 Å²	16	53.3 Å²	53.3	8%	0.084	30%	0.296	C	S	.	.	H	α-helix	trans	-60.8	-41.1	176.3	-70.7	173.2	0	0	0	112.1	F77 S108 I109 I115 G116 L210 L221 A225	F77-L112 HydrophobicContact CZ-CD1 4.26Å; S108-L112 WeakPolarHBondContact O-CD1 3.5Å; S108-L112 WeakPolarHBondContact O-CG 3.16Å; I109-L112 PolarHBondContact O-N 3.15Å; L112-I115 PolarHBondContact O-N 3.17Å; L112-G116 PolarHBondContact O-N 3.39Å; L112-G116 VanDerWaalsContact O-N 3.09Å; L112-L210 HydrophobicContact CD2-CD1 3.97Å; L112-L210 HydrophobicContact CD2-CD2 3.79Å; L112-L210 HydrophobicContact CG-CD2 3.72Å; L112-L221 HydrophobicContact CD2-CB 3.98Å; L112-A225 HydrophobicContact CD2-CB 4.23Å; L112-A225 WeakPolarHBondContact O-CB 3.36Å
113	F	81.1	Confident	78.3	Confident	149 Å²	149	49 Å²	49	65%	0.654	27%	0.274	S	S	*	.	H	α-helix	trans	-64.3	-45.7	174.3	-177.7	-103.3	0	0	0	111.5	I109 S110 P111 I115 G116 C117	I109-F113 WeakPolarHBondContact O-CB 3.24Å; I109-F113 PolarHBondContact O-N 3.08Å; S110-F113 PolarHBondContact O-N 3.04Å; P111-F113 VanDerWaalsContact C-N 3.32Å; P111-F113 PolarHBondContact O-N 2.96Å; F113-I115 VanDerWaalsContact C-N 3.34Å; F113-I115 PolarHBondContact O-N 3.47Å; F113-G116 PolarHBondContact O-N 3.25Å; F113-G116 VanDerWaalsContact O-N 3.14Å; F113-C117 PolarHBondContact O-N 3.43Å; F113-C117 PolarHBondContact O-SG 3.3Å
114	S	83.1	Confident	78.7	Confident	75 Å²	75	47 Å²	47	52%	0.524	26%	0.261	S	S	.	.	H	α-helix	trans	-57.4	-43.4	176.4	-172.4	0	0	0	0	112.7	S110 P111 C117 A118	S110-S114 PolarHBondContact O-N 3.01Å; P111-S114 WeakPolarHBondContact O-CB 3.45Å; P111-S114 PolarHBondContact O-N 3.38Å; S114-C117 PolarHBondContact O-N 3.08Å; S114-A118 WeakPolarHBondContact O-CB 3.35Å; S114-A118 PolarHBondContact O-N 3.47Å
115	I	83.4	Confident	79.2	Confident	8 Å²	8	50.7 Å²	50.7	4%	0.041	27%	0.268	C	S	.	.	H	α-helix	trans	-61.5	-45.7	174.8	-65.5	155.5	0	0	0	110.9	P111 L112 F113 C117 A118 F119 L210 A222 A225	P111-I115 VanDerWaalsContact O-CD1 3.29Å; P111-I115 WeakPolarHBondContact O-CD1 3.24Å; P111-I115 WeakPolarHBondContact O-CG1 3.45Å; P111-I115 PolarHBondContact O-N 3.48Å; L112-I115 PolarHBondContact O-N 3.17Å; F113-I115 VanDerWaalsContact C-N 3.34Å; F113-I115 PolarHBondContact O-N 3.47Å; I115-C117 PolarHBondContact O-N 3.06Å; I115-A118 PolarHBondContact O-N 3.25Å; I115-F119 HydrophobicContact CG2-CD2 3.86Å; I115-F119 HydrophobicContact CG2-CE2 3.92Å; I115-F119 WeakPolarHBondContact O-CD2 3.38Å; I115-F119 PolarHBondContact O-N 2.62Å; I115-F119 VanDerWaalsContact O-N 3.07Å; I115-L210 HydrophobicContact CD1-CD1 4.22Å; I115-A222 HydrophobicContact CD1-CB 4.31Å; I115-A225 HydrophobicContact CB-CB 4.29Å; I115-A225 HydrophobicContact CG2-CB 4.04Å
116	G	85.1	Confident	79.5	Confident	13 Å²	13	49.1 Å²	49.1	13%	0.134	26%	0.263	C	S	.	.	H	α-helix	trans	-58.7	-44.7	175.7	0	0	0	0	0	112.7	L112 F113 F120 A225 G229	L112-G116 PolarHBondContact O-N 3.39Å; L112-G116 VanDerWaalsContact O-N 3.09Å; F113-G116 PolarHBondContact O-N 3.25Å; F113-G116 VanDerWaalsContact O-N 3.14Å; G116-F120 WeakPolarHBondContact O-CB 3.38Å; G116-F120 PolarHBondContact O-N 3.06Å; G116-A225 WeakPolarHBondContact CA-O 3.26Å; G116-G229 WeakPolarHBondContact O-CA 3.35Å
117	C	83.4	Confident	79.4	Confident	41 Å²	41	47.4 Å²	47.4	28%	0.277	25%	0.246	S	C	.	.	H	α-helix	trans	-62.4	-44.3	174.1	-69.1	0	0	0	0	112.4	F113 S114 I115 F119 F120 F121	F113-C117 PolarHBondContact O-N 3.43Å; F113-C117 PolarHBondContact O-SG 3.3Å; S114-C117 PolarHBondContact O-N 3.08Å; I115-C117 PolarHBondContact O-N 3.06Å; C117-F119 PolarHBondContact O-N 3.49Å; C117-F120 WeakPolarHBondContact O-CB 3.31Å; C117-F120 PolarHBondContact O-N 2.86Å; C117-F121 HydrophobicContact CB-CE2 4.49Å; C117-F121 WeakPolarHBondContact O-CD2 3.49Å; C117-F121 PolarHBondContact O-N 3.25Å
118	A	84.8	Confident	79.1	Confident	18 Å²	18	49.7 Å²	49.7	15%	0.149	25%	0.249	C	C	.	.	H	α-helix	trans	-59.9	-44.9	179.6	0	0	0	0	0	112.2	S114 I115 L122 F198 V202	S114-A118 WeakPolarHBondContact O-CB 3.35Å; S114-A118 PolarHBondContact O-N 3.47Å; I115-A118 PolarHBondContact O-N 3.25Å; A118-L122 VanDerWaalsContact O-CB 3.3Å; A118-L122 WeakPolarHBondContact O-CB 3.27Å; A118-L122 PolarHBondContact O-N 2.92Å; A118-F198 HydrophobicContact CB-CZ 4.48Å; A118-V202 HydrophobicContact CB-CG1 3.9Å; A118-V202 HydrophobicContact CB-CG2 4.12Å
119	F	85.3	Confident	78.4	Confident	3 Å²	3	55.1 Å²	55.1	1%	0.013	27%	0.271	C	S	.	.	H	α-helix	trans	-72.5	-30.2	176.4	-77.8	-72.5	0	0	0	113.5	I115 C117 L122 T123 L141 P142 V202 G226	I115-F119 HydrophobicContact CG2-CD2 3.86Å; I115-F119 HydrophobicContact CG2-CE2 3.92Å; I115-F119 WeakPolarHBondContact O-CD2 3.38Å; I115-F119 PolarHBondContact O-N 2.62Å; I115-F119 VanDerWaalsContact O-N 3.07Å; C117-F119 PolarHBondContact O-N 3.49Å; F119-L122 HydrophobicContact CD1-CD2 4.17Å; F119-L122 HydrophobicContact CE1-CD2 4.33Å; F119-T123 VanDerWaalsContact O-CB 3.24Å; F119-T123 WeakPolarHBondContact O-CB 3.27Å; F119-T123 PolarHBondContact O-N 2.94Å; F119-T123 PolarHBondContact O-OG1 3.43Å; F119-L141 HydrophobicContact CE1-CD2 3.8Å; F119-P142 HydrophobicContact CD1-CG 3.87Å; F119-P142 HydrophobicContact CE1-CB 4.42Å; F119-P142 HydrophobicContact CE1-CG 3.98Å; F119-P142 HydrophobicContact CG-CG 4.26Å; F119-P142 HydrophobicContact CZ-CB 4.44Å; F119-P142 HydrophobicContact CZ-CG 4.44Å; F119-V202 HydrophobicContact CE2-CG1 4Å; F119-G226 WeakPolarHBondContact CB-O 3.44Å
120	F	86.3	Confident	77.3	Confident	36 Å²	36	56.6 Å²	56.6	16%	0.158	28%	0.276	C	S	.	.	H	α-helix	trans	-60	-54	169.6	171.3	-91.1	0	0	0	111.5	F49 G116 C117 L122 T123 F124 G229 L232 F236	F49-F120 HydrophobicContact CE2-CE1 4.34Å; F49-F120 HydrophobicContact CZ-CE1 4.29Å; G116-F120 WeakPolarHBondContact O-CB 3.38Å; G116-F120 PolarHBondContact O-N 3.06Å; C117-F120 WeakPolarHBondContact O-CB 3.31Å; C117-F120 PolarHBondContact O-N 2.86Å; F120-L122 PolarHBondContact O-N 2.9Å; F120-T123 PolarHBondContact O-N 3.26Å; F120-F124 PolarHBondContact O-N 3.44Å; F120-G229 WeakPolarHBondContact CA-O 3.31Å; F120-L232 HydrophobicContact CD2-CB 3.99Å; F120-L232 HydrophobicContact CE2-CB 4.42Å; F120-F236 HydrophobicContact CE2-CB 4.22Å; F120-F236 HydrophobicContact CZ-CG 4.39Å
121	F	83	Confident	76.1	Confident	96 Å²	96	61 Å²	61	42%	0.421	29%	0.285	S	S	.	.	H	α-helix	trans	-64.5	-41.1	179.7	-75.9	-66.4	0	0	0	112.5	F49 C117 T123 F124 Y125	F49-F121 HydrophobicContact CD1-CE1 4.37Å; F49-F121 HydrophobicContact CD1-CZ 4.47Å; F49-F121 HydrophobicContact CD2-CE1 4.34Å; F49-F121 AromaticContact CE1-CE1 3.75Å; F49-F121 HydrophobicContact CE1-CE1 3.75Å; F49-F121 AromaticContact CE1-CZ 3.6Å; F49-F121 HydrophobicContact CE1-CZ 3.6Å; F49-F121 AromaticContact CE2-CE1 3.71Å; F49-F121 HydrophobicContact CE2-CE1 3.71Å; F49-F121 HydrophobicContact CE2-CZ 4.3Å; F49-F121 AromaticContact CZ-CE1 3.38Å; F49-F121 HydrophobicContact CZ-CE1 3.38Å; F49-F121 AromaticContact CZ-CZ 3.5Å; F49-F121 HydrophobicContact CZ-CZ 3.5Å; F49-F121 VanDerWaalsContact CZ-CZ 3.5Å; C117-F121 HydrophobicContact CB-CE2 4.49Å; C117-F121 WeakPolarHBondContact O-CD2 3.49Å; C117-F121 PolarHBondContact O-N 3.25Å; F121-T123 VanDerWaalsContact C-N 3.33Å; F121-T123 PolarHBondContact O-N 3.36Å; F121-F124 PolarHBondContact O-N 3.29Å; F121-Y125 WeakPolarHBondContact O-CB 3.41Å; F121-Y125 PolarHBondContact O-N 3.27Å
122	L	82.1	Confident	74.6	Confident	15 Å²	15	69.4 Å²	69.4	8%	0.079	32%	0.322	C	S	.	.	H	α-helix	trans	-59.6	-43.5	175.1	-177.5	64.4	0	0	0	111.5	A118 F119 F120 Y125 L126 L141 V195 F198	A118-L122 VanDerWaalsContact O-CB 3.3Å; A118-L122 WeakPolarHBondContact O-CB 3.27Å; A118-L122 PolarHBondContact O-N 2.92Å; F119-L122 HydrophobicContact CD1-CD2 4.17Å; F119-L122 HydrophobicContact CE1-CD2 4.33Å; F120-L122 PolarHBondContact O-N 2.9Å; L122-Y125 PolarHBondContact O-N 3.35Å; L122-L126 HydrophobicContact CD1-CD1 4.18Å; L122-L126 HydrophobicContact CD1-CG 4.48Å; L122-L126 HydrophobicContact CG-CD1 4.03Å; L122-L126 WeakPolarHBondContact O-CB 3.33Å; L122-L126 VanDerWaalsContact O-CG 3.26Å; L122-L126 WeakPolarHBondContact O-CG 3.12Å; L122-L126 PolarHBondContact O-N 2.97Å; L122-L141 HydrophobicContact CD2-CD2 4.46Å; L122-V195 HydrophobicContact CD1-CG1 4.49Å; L122-F198 HydrophobicContact CB-CE1 4.19Å; L122-F198 HydrophobicContact CD1-CD1 3.93Å; L122-F198 HydrophobicContact CD1-CE1 4.31Å; L122-F198 HydrophobicContact CD2-CD1 4.04Å; L122-F198 HydrophobicContact CD2-CE1 4.32Å; L122-F198 HydrophobicContact CG-CD1 4.41Å
123	T	80.6	Confident	73.4	Confident	3 Å²	3	70.8 Å²	70.8	2%	0.018	33%	0.333	C	S	.	.	H	α-helix	trans	-65.2	-40	178.4	-62.9	0	0	0	0	112	F119 F120 F121 R127 L138 S230 I234	F119-T123 VanDerWaalsContact O-CB 3.24Å; F119-T123 WeakPolarHBondContact O-CB 3.27Å; F119-T123 PolarHBondContact O-N 2.94Å; F119-T123 PolarHBondContact O-OG1 3.43Å; F120-T123 PolarHBondContact O-N 3.26Å; F121-T123 VanDerWaalsContact C-N 3.33Å; F121-T123 PolarHBondContact O-N 3.36Å; T123-R127 PolarHBondContact O-N 3.27Å; T123-R127 VanDerWaalsContact O-N 3.11Å; T123-L138 HydrophobicContact CG2-CB 4.49Å; T123-L138 HydrophobicContact CG2-CD1 4.3Å; T123-S230 WeakPolarHBondContact OG1-CA 3.35Å; T123-S230 WeakPolarHBondContact OG1-CB 3.37Å; T123-S230 PolarHBondContact OG1-OG 3.37Å; T123-S230 VanDerWaalsContact OG1-OG 3.12Å; T123-I234 HydrophobicContact CG2-CD1 4.47Å; T123-I234 HydrophobicContact CG2-CG1 3.9Å
124	F	75.9	Confident	72.3	Confident	63 Å²	63	67.1 Å²	67.1	28%	0.276	33%	0.326	S	S	.	.	H	α-helix	trans	-66.4	-45.8	175.3	-174.6	-105.9	0	0	0	112.2	F120 F121 L126 R127 R128 F236	F120-F124 PolarHBondContact O-N 3.44Å; F121-F124 PolarHBondContact O-N 3.29Å; F124-L126 VanDerWaalsContact C-N 3.33Å; F124-L126 PolarHBondContact O-N 3.46Å; F124-R127 PolarHBondContact O-N 2.68Å; F124-R128 PolarHBondContact O-N 3.4Å; F124-F236 HydrophobicContact CD2-CD1 4.49Å; F124-F236 HydrophobicContact CE2-CD1 4.31Å; F124-F236 HydrophobicContact CE2-CE1 4.35Å
125	Y	75.2	Confident	71.3	Confident	101 Å²	101	70.5 Å²	70.5	40%	0.396	33%	0.328	S	S	.	.	H	α-helix	trans	-57.8	-43.8	176	177.4	-100.4	0	0	0	112.2	F121 L122 K129	F121-Y125 WeakPolarHBondContact O-CB 3.41Å; F121-Y125 PolarHBondContact O-N 3.27Å; L122-Y125 PolarHBondContact O-N 3.35Å; Y125-K129 PolarHBondContact OH-NZ 2.74Å
126	L	71.4	Confident	70.3	Confident	35 Å²	35	74.3 Å²	74.3	18%	0.183	36%	0.355	C	S	.	.	H	α-helix	trans	-68.5	-32	178.4	-70.5	170.3	0	0	0	113.1	L122 F124 L138 V195	L122-L126 HydrophobicContact CD1-CD1 4.18Å; L122-L126 HydrophobicContact CD1-CG 4.48Å; L122-L126 HydrophobicContact CG-CD1 4.03Å; L122-L126 WeakPolarHBondContact O-CB 3.33Å; L122-L126 VanDerWaalsContact O-CG 3.26Å; L122-L126 WeakPolarHBondContact O-CG 3.12Å; L122-L126 PolarHBondContact O-N 2.97Å; F124-L126 VanDerWaalsContact C-N 3.33Å; F124-L126 PolarHBondContact O-N 3.46Å; L126-L138 HydrophobicContact CB-CD2 3.96Å; L126-L138 HydrophobicContact CD1-CD2 3.7Å; L126-L138 HydrophobicContact CG-CD2 4.48Å; L126-V195 HydrophobicContact CD1-CG1 4.33Å; L126-V195 HydrophobicContact CD2-CG2 3.76Å
127	R	68.7	Low	69.6	Low	34 Å²	34	74.5 Å²	74.5	13%	0.128	35%	0.351	C	S	.	.	H	α-helix	trans	-73.1	-46.2	174.3	-83.7	-155.9	167	172.9	6.5	113.5	T123 F124 K129 K130 L138 I234 D237	T123-R127 PolarHBondContact O-N 3.27Å; T123-R127 VanDerWaalsContact O-N 3.11Å; F124-R127 PolarHBondContact O-N 2.68Å; R127-K129 PolarHBondContact O-N 3.37Å; R127-K130 PolarHBondContact O-N 3.27Å; R127-L138 HydrophobicContact CG-CD1 4.14Å; R127-I234 PolarHBondContact NH1-O 2.82Å; R127-D237 WeakPolarHBondContact CD-OD2 3.48Å; R127-D237 IonicContact CZ-OD2 3.46Å; R127-D237 IonicContact NE-OD2 3.99Å; R127-D237 IonicContact NH1-OD2 3.6Å; R127-D237 PolarHBondContact NH1-OD2 3.09Å
128	R	64.3	Low	69	Low	167 Å²	167	73.4 Å²	73.4	63%	0.63	34%	0.343	S	S	*	.	H	α-helix	trans	-56.5	-21.5	-176.2	-168.3	173.1	177.4	-176.2	-2.1	113.3	D44 F124	D44-R128 IonicContact OD1-NH2 3.7Å; D44-R128 PolarHBondContact OD1-NH2 2.77Å; F124-R128 PolarHBondContact O-N 3.4Å
129	K	57	Low	68.5	Low	125 Å²	125	75.3 Å²	75.3	54%	0.543	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.5	-5.5	176.8	-73.4	-177.1	169.7	-179.5	0	116.2	Y125 R127 H191	Y125-K129 PolarHBondContact OH-NZ 2.74Å; R127-K129 PolarHBondContact O-N 3.37Å; K129-H191 PolarHBondContact NZ-NE2 2.89Å
130	K	53.9	Low	68	Low	94 Å²	94	77.1 Å²	77.1	41%	0.409	36%	0.363	S	S	.	.			trans	-146.7	105.3	-178.5	-87.1	-171	171.6	176.3	0	114.5	R127 Q132 T186	R127-K130 PolarHBondContact O-N 3.27Å; K130-Q132 VanDerWaalsContact C-N 3.26Å; K130-Q132 PolarHBondContact O-N 3.19Å; K130-T186 PolarHBondContact NZ-O 3.38Å
131	K	53.1	Low	67.6	Low	172 Å²	172	75.6 Å²	75.6	75%	0.748	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.9	-3.1	177.6	-120.9	175.1	-171.9	173.3	0	115.9	E244	K131-E244 IonicContact NZ-OE1 2.66Å; K131-E244 PolarHBondContact NZ-OE1 3.11Å; K131-E244 IonicContact NZ-OE2 3.51Å; K131-E244 PolarHBondContact NZ-OE2 3.19Å
132	Q	48.9	Very low	67.5	Low	194 Å²	194	71 Å²	71	91%	0.907	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-145.5	35.6	-160.9	-145.3	175.5	23.8	0	0	115.6	K130	K130-Q132 VanDerWaalsContact C-N 3.26Å; K130-Q132 PolarHBondContact O-N 3.19Å
133	S	53.8	Low	67.4	Low	45 Å²	45	72.3 Å²	72.3	32%	0.315	35%	0.349	S	S	.	.	S	Bend	trans	-109.5	149.4	172.4	-169.7	0	0	0	0	112.2
134	S	58.5	Low	67.3	Low	72 Å²	72	72.5 Å²	72.5	50%	0.503	35%	0.351	S	S	.	.			trans	-65.4	134.2	179.8	58.5	0	0	0	0	111.7	S136	S134-S136 PolarHBondContact O-N 2.72Å
135	R	62.6	Low	67.5	Low	146 Å²	146	69.5 Å²	69.5	55%	0.551	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-24.7	-169.8	-62.5	-176.3	171.4	150.5	-0.6	113.7	W137	R135-W137 PolarHBondContact O-N 2.81Å
136	S	62.3	Low	67.8	Low	88 Å²	88	68 Å²	68	62%	0.615	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	-32.2	-174.8	-42.9	0	0	0	0	113.6	S134 L138 L139 S140	S134-S136 PolarHBondContact O-N 2.72Å; S136-L138 VanDerWaalsContact C-N 3.34Å; S136-L138 PolarHBondContact O-N 3.33Å; S136-L139 PolarHBondContact O-N 2.89Å; S136-L139 VanDerWaalsContact O-N 3.12Å; S136-S140 PolarHBondContact O-N 2.73Å; S136-S140 VanDerWaalsContact O-N 3.11Å; S136-S140 PolarHBondContact O-OG 2.85Å
137	W	70	Confident	68.2	Low	16 Å²	16	70.6 Å²	70.6	6%	0.061	35%	0.346	C	S	.	.	H	α-helix	trans	-62.9	-39.5	-173.5	-173.4	78.9	0	0	0	113.2	R135 L139 S140 L141 L181 T182 L187	R135-W137 PolarHBondContact O-N 2.81Å; W137-L139 PolarHBondContact O-N 3.4Å; W137-S140 VanDerWaalsContact CA-OG 3.31Å; W137-S140 WeakPolarHBondContact CA-OG 3.43Å; W137-S140 PolarHBondContact O-N 3.02Å; W137-S140 PolarHBondContact O-OG 3.09Å; W137-L141 HydrophobicContact CH2-CD1 3.72Å; W137-L141 HydrophobicContact CZ2-CD1 4.29Å; W137-L141 HydrophobicContact CZ3-CD1 4Å; W137-L141 PolarHBondContact O-N 2.93Å; W137-L181 HydrophobicContact CZ2-CD2 4.29Å; W137-L181 PolarHBondContact NE1-O 3.34Å; W137-T182 HydrophobicContact CH2-CG2 4.5Å; W137-T182 HydrophobicContact CZ2-CG2 4.01Å; W137-L187 HydrophobicContact CD2-CD1 4.32Å; W137-L187 HydrophobicContact CH2-CD1 3.64Å; W137-L187 HydrophobicContact CH2-CD2 4.19Å; W137-L187 HydrophobicContact CZ2-CD1 3.35Å; W137-L187 HydrophobicContact CZ3-CD1 4.22Å; W137-L187 HydrophobicContact CZ3-CD2 4.24Å
138	L	70.8	Confident	68.6	Low	19 Å²	19	69 Å²	69	10%	0.099	34%	0.34	C	S	.	.	H	α-helix	trans	-67.1	-25.1	178.5	-64	167.6	0	0	0	112.8	T123 L126 R127 S136 S230 I234	T123-L138 HydrophobicContact CG2-CB 4.49Å; T123-L138 HydrophobicContact CG2-CD1 4.3Å; L126-L138 HydrophobicContact CB-CD2 3.96Å; L126-L138 HydrophobicContact CD1-CD2 3.7Å; L126-L138 HydrophobicContact CG-CD2 4.48Å; R127-L138 HydrophobicContact CG-CD1 4.14Å; S136-L138 VanDerWaalsContact C-N 3.34Å; S136-L138 PolarHBondContact O-N 3.33Å; L138-S230 PolarHBondContact O-OG 3.42Å; L138-I234 HydrophobicContact CB-CD1 4.33Å
139	L	74.8	Confident	69.1	Low	57 Å²	57	61.1 Å²	61.1	30%	0.298	31%	0.31	S	S	.	.	H	α-helix	trans	-84.5	-28.7	174.7	-70	163.8	0	0	0	112.1	S136 W137 L141 V227 L231 I234	S136-L139 PolarHBondContact O-N 2.89Å; S136-L139 VanDerWaalsContact O-N 3.12Å; W137-L139 PolarHBondContact O-N 3.4Å; L139-L141 VanDerWaalsContact C-N 3.31Å; L139-V227 HydrophobicContact CD2-CG1 4.37Å; L139-L231 HydrophobicContact CD2-CB 4.22Å; L139-L231 HydrophobicContact CD2-CD1 4.46Å; L139-I234 HydrophobicContact CD1-CD1 4.06Å; L139-I234 HydrophobicContact CD2-CD1 4.03Å; L139-I234 HydrophobicContact CG-CD1 3.73Å
140	S	74.6	Confident	69.9	Low	41 Å²	41	59.2 Å²	59.2	29%	0.287	30%	0.302	S	S	.	.	H	α-helix	trans	-76	-13.7	173.8	48	0	0	0	0	114.3	S136 W137 A143 S144	S136-S140 PolarHBondContact O-N 2.73Å; S136-S140 VanDerWaalsContact O-N 3.11Å; S136-S140 PolarHBondContact O-OG 2.85Å; W137-S140 VanDerWaalsContact CA-OG 3.31Å; W137-S140 WeakPolarHBondContact CA-OG 3.43Å; W137-S140 PolarHBondContact O-N 3.02Å; W137-S140 PolarHBondContact O-OG 3.09Å; S140-A143 CarbonylContact O-C 3.58Å; S140-A143 PolarHBondContact O-N 3.39Å; S140-S144 PolarHBondContact O-N 2.99Å
141	L	78	Confident	70.9	Confident	4 Å²	4	57 Å²	57	2%	0.021	29%	0.294	C	S	.	.	H	α-helix	trans	-65.6	-49.9	-175.1	-163.5	156.2	0	0	0	112.9	F119 L122 W137 L139 A143 S144 C145 V178 L181 V195 A199	F119-L141 HydrophobicContact CE1-CD2 3.8Å; L122-L141 HydrophobicContact CD2-CD2 4.46Å; W137-L141 HydrophobicContact CH2-CD1 3.72Å; W137-L141 HydrophobicContact CZ2-CD1 4.29Å; W137-L141 HydrophobicContact CZ3-CD1 4Å; W137-L141 PolarHBondContact O-N 2.93Å; L139-L141 VanDerWaalsContact C-N 3.31Å; L141-A143 VanDerWaalsContact C-N 3.28Å; L141-A143 PolarHBondContact O-N 3.36Å; L141-S144 PolarHBondContact O-N 2.93Å; L141-S144 PolarHBondContact O-OG 2.87Å; L141-C145 PolarHBondContact O-N 3.35Å; L141-C145 PolarHBondContact O-SG 3.35Å; L141-C145 VanDerWaalsContact O-SG 3.4Å; L141-V178 HydrophobicContact CG-CG1 4.31Å; L141-L181 HydrophobicContact CB-CD2 4.32Å; L141-V195 HydrophobicContact CD1-CG1 3.99Å; L141-A199 HydrophobicContact CD2-CB 3.81Å
142	P	80.1	Confident	71.9	Confident	0 Å²	0	49 Å²	49	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-61.9	-34.9	171.8	-19.8	31.8	0	0	0	113	F119 S144 C145 Y146 V227	F119-P142 HydrophobicContact CD1-CG 3.87Å; F119-P142 HydrophobicContact CE1-CB 4.42Å; F119-P142 HydrophobicContact CE1-CG 3.98Å; F119-P142 HydrophobicContact CG-CG 4.26Å; F119-P142 HydrophobicContact CZ-CB 4.44Å; F119-P142 HydrophobicContact CZ-CG 4.44Å; P142-S144 VanDerWaalsContact C-N 3.33Å; P142-S144 PolarHBondContact O-N 3.44Å; P142-C145 WeakPolarHBondContact O-CB 3.25Å; P142-C145 PolarHBondContact O-N 3.38Å; P142-Y146 PolarHBondContact O-N 3.09Å; P142-V227 HydrophobicContact CB-CG2 3.99Å; P142-V227 HydrophobicContact CG-CG2 4.21Å
143	A	80.9	Confident	72.8	Confident	42 Å²	42	43.6 Å²	43.6	35%	0.347	24%	0.237	S	C	.	.	H	α-helix	trans	-67.5	-31.4	177.8	0	0	0	0	0	112.8	S140 L141 Y146 L147	S140-A143 CarbonylContact O-C 3.58Å; S140-A143 PolarHBondContact O-N 3.39Å; L141-A143 VanDerWaalsContact C-N 3.28Å; L141-A143 PolarHBondContact O-N 3.36Å; A143-Y146 PolarHBondContact O-N 2.78Å; A143-L147 WeakPolarHBondContact O-CB 3.21Å; A143-L147 PolarHBondContact O-N 3.24Å
144	S	78.9	Confident	73.6	Confident	8 Å²	8	50 Å²	50	6%	0.056	25%	0.254	C	S	.	.	H	α-helix	trans	-73	-32.5	173.8	69.9	0	0	0	0	112.8	S140 L141 P142 L147 G148 C177	S140-S144 PolarHBondContact O-N 2.99Å; L141-S144 PolarHBondContact O-N 2.93Å; L141-S144 PolarHBondContact O-OG 2.87Å; P142-S144 VanDerWaalsContact C-N 3.33Å; P142-S144 PolarHBondContact O-N 3.44Å; S144-L147 PolarHBondContact O-N 2.83Å; S144-G148 PolarHBondContact O-N 3.34Å; S144-C177 WeakPolarHBondContact O-CB 3.35Å
145	C	79	Confident	73.9	Confident	0 Å²	0	54 Å²	54	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-64.6	-44.2	169.7	-56	0	0	0	0	111.2	L141 P142 L147 G148 D149 V174 V178 W203	L141-C145 PolarHBondContact O-N 3.35Å; L141-C145 PolarHBondContact O-SG 3.35Å; L141-C145 VanDerWaalsContact O-SG 3.4Å; P142-C145 WeakPolarHBondContact O-CB 3.25Å; P142-C145 PolarHBondContact O-N 3.38Å; C145-L147 PolarHBondContact O-N 3.01Å; C145-G148 PolarHBondContact O-N 2.92Å; C145-D149 PolarHBondContact O-N 3.46Å; C145-V174 HydrophobicContact CB-CG1 4.27Å; C145-V178 VanDerWaalsContact SG-CG2 3.55Å; C145-W203 HydrophobicContact CB-CB 4.39Å; C145-W203 HydrophobicContact CB-CD2 3.48Å; C145-W203 VanDerWaalsContact CB-CD2 3.48Å; C145-W203 HydrophobicContact CB-CE3 3.65Å; C145-W203 HydrophobicContact CB-CG 3.81Å; C145-W203 HydrophobicContact CB-CH2 4.47Å; C145-W203 HydrophobicContact CB-CZ2 4.35Å; C145-W203 HydrophobicContact CB-CZ3 4.15Å
146	Y	82.1	Confident	73.9	Confident	70 Å²	70	49.7 Å²	49.7	28%	0.275	25%	0.25	S	C	.	.	H	α-helix	trans	-59.5	-43.4	172.9	176.3	-94	0	0	0	112.5	P142 A143 G148 D149 F150 P219 L220 C223	P142-Y146 PolarHBondContact O-N 3.09Å; A143-Y146 PolarHBondContact O-N 2.78Å; Y146-G148 VanDerWaalsContact C-N 3.34Å; Y146-G148 PolarHBondContact O-N 2.94Å; Y146-D149 PolarHBondContact O-N 3.25Å; Y146-F150 HydrophobicContact CE1-CB 4.43Å; Y146-F150 WeakPolarHBondContact O-CB 3.13Å; Y146-F150 PolarHBondContact O-N 3.05Å; Y146-P219 HydrophobicContact CD2-CB 3.91Å; Y146-P219 WeakPolarHBondContact CD2-O 3.16Å; Y146-P219 HydrophobicContact CE2-CB 4.09Å; Y146-P219 HydrophobicContact CE2-CG 4.26Å; Y146-L220 HydrophobicContact CE2-CB 4.1Å; Y146-C223 HydrophobicContact CD2-CB 4.11Å; Y146-C223 HydrophobicContact CG-CB 4.24Å
147	L	80.2	Confident	73.7	Confident	89 Å²	89	54.6 Å²	54.6	47%	0.466	26%	0.263	S	S	.	.	H	α-helix	trans	-62.2	-40.2	177.8	-176.9	60.6	0	0	0	112	A143 S144 C145 F150 L151	A143-L147 WeakPolarHBondContact O-CB 3.21Å; A143-L147 PolarHBondContact O-N 3.24Å; S144-L147 PolarHBondContact O-N 2.83Å; C145-L147 PolarHBondContact O-N 3.01Å; L147-F150 PolarHBondContact O-N 3.36Å; L147-L151 HydrophobicContact CD1-CD1 4.37Å; L147-L151 HydrophobicContact CD1-CG 4.34Å; L147-L151 HydrophobicContact CG-CD1 4.11Å; L147-L151 WeakPolarHBondContact O-CB 3.41Å; L147-L151 VanDerWaalsContact O-CG 3.25Å; L147-L151 WeakPolarHBondContact O-CG 3.24Å; L147-L151 PolarHBondContact O-N 2.88Å
148	G	76.6	Confident	73.2	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-60.4	-46.8	175	0	0	0	0	0	113.1	S144 C145 Y146 L151 V152 C177	S144-G148 PolarHBondContact O-N 3.34Å; C145-G148 PolarHBondContact O-N 2.92Å; Y146-G148 VanDerWaalsContact C-N 3.34Å; Y146-G148 PolarHBondContact O-N 2.94Å; G148-L151 PolarHBondContact O-N 3.23Å; G148-V152 PolarHBondContact O-N 3.29Å; G148-V152 VanDerWaalsContact O-N 3.14Å; G148-C177 VanDerWaalsContact CA-SG 3.53Å
149	D	74.2	Confident	72.5	Confident	1 Å²	1	60 Å²	60	1%	0.005	30%	0.298	C	S	.	.	H	α-helix	trans	-67.6	-39.4	178	-161.8	64.3	0	0	0	112.2	C145 Y146 L151 V152 L153 R170 L207	C145-D149 PolarHBondContact O-N 3.46Å; Y146-D149 PolarHBondContact O-N 3.25Å; D149-L151 VanDerWaalsContact C-N 3.33Å; D149-L151 PolarHBondContact O-N 2.86Å; D149-V152 PolarHBondContact O-N 2.91Å; D149-L153 WeakPolarHBondContact O-CG 3.18Å; D149-L153 PolarHBondContact O-N 2.78Å; D149-R170 WeakPolarHBondContact OD1-CD 3.29Å; D149-R170 WeakPolarHBondContact OD1-CG 3.24Å; D149-R170 IonicContact OD1-CZ 3.69Å; D149-R170 IonicContact OD1-NE 3.92Å; D149-R170 IonicContact OD1-NH1 2.71Å; D149-R170 PolarHBondContact OD1-NH1 3.4Å; D149-R170 IonicContact OD2-NH1 3.07Å; D149-R170 PolarHBondContact OD2-NH1 3.27Å; D149-L207 WeakPolarHBondContact OD1-CD1 3.49Å
150	F	75.5	Confident	71.5	Confident	86 Å²	86	65.9 Å²	65.9	38%	0.377	32%	0.324	S	S	.	.	H	α-helix	trans	-62	-38.3	174.1	179.7	-96.2	0	0	0	112.6	Y146 L147 L153 R154	Y146-F150 HydrophobicContact CE1-CB 4.43Å; Y146-F150 WeakPolarHBondContact O-CB 3.13Å; Y146-F150 PolarHBondContact O-N 3.05Å; L147-F150 PolarHBondContact O-N 3.36Å; F150-L153 PolarHBondContact O-N 3.44Å; F150-R154 HydrophobicContact CD1-CG 4.4Å; F150-R154 HydrophobicContact CE1-CG 3.93Å; F150-R154 HydrophobicContact CZ-CG 4.03Å; F150-R154 WeakPolarHBondContact O-CB 3.28Å; F150-R154 PolarHBondContact O-N 2.66Å
151	L	74.8	Confident	70.5	Confident	48 Å²	48	71.8 Å²	71.8	25%	0.251	35%	0.352	S	S	.	.	H	α-helix	trans	-66.3	-40.7	175.3	-74.8	168.3	0	0	0	111.6	L147 G148 D149 R154 F155 F173	L147-L151 HydrophobicContact CD1-CD1 4.37Å; L147-L151 HydrophobicContact CD1-CG 4.34Å; L147-L151 HydrophobicContact CG-CD1 4.11Å; L147-L151 WeakPolarHBondContact O-CB 3.41Å; L147-L151 VanDerWaalsContact O-CG 3.25Å; L147-L151 WeakPolarHBondContact O-CG 3.24Å; L147-L151 PolarHBondContact O-N 2.88Å; G148-L151 PolarHBondContact O-N 3.23Å; D149-L151 VanDerWaalsContact C-N 3.33Å; D149-L151 PolarHBondContact O-N 2.86Å; L151-R154 PolarHBondContact O-N 3.09Å; L151-R154 VanDerWaalsContact O-N 3.13Å; L151-F155 HydrophobicContact CD2-CD2 3.98Å; L151-F155 HydrophobicContact CD2-CE2 3.68Å; L151-F155 WeakPolarHBondContact O-CB 3.29Å; L151-F155 WeakPolarHBondContact O-CD2 3.33Å; L151-F155 PolarHBondContact O-N 3.5Å; L151-F173 HydrophobicContact CB-CD1 4.38Å
152	V	72.6	Confident	69.6	Low	4 Å²	4	76.4 Å²	76.4	2%	0.024	37%	0.374	C	S	.	.	H	α-helix	trans	-62.8	-45.1	174.4	175.5	0	0	0	0	111.4	G148 D149 R154 F155 L156 R170 F173	G148-V152 PolarHBondContact O-N 3.29Å; G148-V152 VanDerWaalsContact O-N 3.14Å; D149-V152 PolarHBondContact O-N 2.91Å; V152-R154 PolarHBondContact O-N 3.47Å; V152-F155 PolarHBondContact O-N 2.84Å; V152-L156 HydrophobicContact CG1-CB 4.34Å; V152-L156 HydrophobicContact CG1-CD1 4.44Å; V152-L156 PolarHBondContact O-N 3.22Å; V152-R170 HydrophobicContact CB-CG 4.39Å; V152-R170 HydrophobicContact CG1-CG 3.95Å; V152-F173 HydrophobicContact CG2-CB 3.36Å; V152-F173 HydrophobicContact CG2-CD1 4.14Å; V152-F173 HydrophobicContact CG2-CD2 3.67Å; V152-F173 HydrophobicContact CG2-CE2 4.49Å; V152-F173 HydrophobicContact CG2-CG 3.46Å; V152-F173 VanDerWaalsContact CG2-CG 3.46Å
153	L	69	Low	68.7	Low	80 Å²	80	82.6 Å²	82.6	42%	0.419	40%	0.402	S	S	.	.	H	α-helix	trans	-62.6	-21.9	175.1	-68.6	170.8	0	0	0	113.6	D149 F150	D149-L153 WeakPolarHBondContact O-CG 3.18Å; D149-L153 PolarHBondContact O-N 2.78Å; F150-L153 PolarHBondContact O-N 3.44Å
154	R	69.4	Low	67.7	Low	178 Å²	178	88.8 Å²	88.8	67%	0.672	42%	0.424	S	S	*	.	H	α-helix	trans	-91.7	-36.3	177.8	-91.6	-74.4	-172.4	150.9	-0.5	114.4	F150 L151 V152	F150-R154 HydrophobicContact CD1-CG 4.4Å; F150-R154 HydrophobicContact CE1-CG 3.93Å; F150-R154 HydrophobicContact CZ-CG 4.03Å; F150-R154 WeakPolarHBondContact O-CB 3.28Å; F150-R154 PolarHBondContact O-N 2.66Å; L151-R154 PolarHBondContact O-N 3.09Å; L151-R154 VanDerWaalsContact O-N 3.13Å; V152-R154 PolarHBondContact O-N 3.47Å
155	F	65.2	Low	66.9	Low	158 Å²	158	93.4 Å²	93.4	69%	0.693	45%	0.446	S	S	*	.	H	α-helix	trans	-106.4	-22.9	-171	-77.8	-84.6	0	0	0	114.3	L151 V152	L151-F155 HydrophobicContact CD2-CD2 3.98Å; L151-F155 HydrophobicContact CD2-CE2 3.68Å; L151-F155 WeakPolarHBondContact O-CB 3.29Å; L151-F155 WeakPolarHBondContact O-CD2 3.33Å; L151-F155 PolarHBondContact O-N 3.5Å; V152-F155 PolarHBondContact O-N 2.84Å
156	L	62.7	Low	66.3	Low	54 Å²	54	95.6 Å²	95.6	28%	0.283	46%	0.456	S	S	.	.			trans	-118.1	86.8	177.9	-67.7	96.1	0	0	0	110.6	V152 W158 F173	V152-L156 HydrophobicContact CG1-CB 4.34Å; V152-L156 HydrophobicContact CG1-CD1 4.44Å; V152-L156 PolarHBondContact O-N 3.22Å; L156-W158 HydrophobicContact CB-CE3 4.33Å; L156-W158 HydrophobicContact CD2-CE3 3.68Å; L156-W158 HydrophobicContact CD2-CZ3 3.49Å; L156-W158 VanDerWaalsContact CD2-CZ3 3.49Å; L156-W158 PolarHBondContact O-N 3.42Å; L156-F173 HydrophobicContact CD1-CD2 4.46Å; L156-F173 HydrophobicContact CD1-CE2 3.74Å; L156-F173 HydrophobicContact CD1-CZ 3.87Å
157	Q	58.3	Low	65.7	Low	192 Å²	192	95 Å²	95	90%	0.897	46%	0.456	S	S	*	.			trans	-72.1	70.2	166.6	-68.8	-175	-15.5	0	0	110.3
158	W	60.2	Low	65.2	Low	98 Å²	98	94.6 Å²	94.6	37%	0.371	46%	0.458	S	S	.	.			trans	-78.4	130.5	175.9	-132.3	-56	0	0	0	110.2	L156 M165	L156-W158 HydrophobicContact CB-CE3 4.33Å; L156-W158 HydrophobicContact CD2-CE3 3.68Å; L156-W158 HydrophobicContact CD2-CZ3 3.49Å; L156-W158 VanDerWaalsContact CD2-CZ3 3.49Å; L156-W158 PolarHBondContact O-N 3.42Å; W158-M165 HydrophobicContact CD2-CB 4.48Å; W158-M165 HydrophobicContact CH2-CB 3.84Å; W158-M165 HydrophobicContact CH2-CG 4.46Å; W158-M165 HydrophobicContact CZ2-CB 3.54Å; W158-M165 HydrophobicContact CZ2-CG 4.01Å; W158-M165 HydrophobicContact CZ3-CB 4.4Å
159	G	55.5	Low	65	Low	49 Å²	49	95.2 Å²	95.2	51%	0.505	46%	0.464	S	S	.	.			trans	-62.7	155.7	173.7	0	0	0	0	0	112.8	D161 Q162	G159-D161 PolarHBondContact O-N 2.92Å; G159-D161 VanDerWaalsContact O-N 3.14Å; G159-Q162 PolarHBondContact O-N 2.91Å
160	E	54.6	Low	64.9	Low	181 Å²	181	96.6 Å²	96.6	85%	0.846	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-26.3	-167.9	-62.2	-175.8	115.7	0	0	113.7	Q162	E160-Q162 VanDerWaalsContact C-N 3.27Å; E160-Q162 PolarHBondContact O-N 3.3Å
161	D	52.4	Low	64.9	Low	165 Å²	165	95.2 Å²	95.2	88%	0.882	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-9.2	-176.2	-58.7	-57.5	0	0	0	115.6	G159	G159-D161 PolarHBondContact O-N 2.92Å; G159-D161 VanDerWaalsContact O-N 3.14Å
162	Q	59.1	Low	65	Low	102 Å²	102	98.2 Å²	98.2	48%	0.477	48%	0.481	S	S	.	.			trans	-115.6	50	-173.7	-65.3	-159.6	-4.1	0	0	114.8	G159 E160 Q164 M165 Q166	G159-Q162 PolarHBondContact O-N 2.91Å; E160-Q162 VanDerWaalsContact C-N 3.27Å; E160-Q162 PolarHBondContact O-N 3.3Å; Q162-Q164 VanDerWaalsContact C-N 3.31Å; Q162-Q164 PolarHBondContact O-N 3.45Å; Q162-M165 HydrophobicContact CB-CB 4.34Å; Q162-M165 PolarHBondContact O-N 2.82Å; Q162-Q166 PolarHBondContact O-N 2.96Å
163	H	60.8	Low	65.1	Low	130 Å²	130	102 Å²	102	60%	0.602	50%	0.497	S	S	*	.	H	α-helix	trans	-49.2	-40.6	178.2	-99.7	-67	0	0	0	115.5	M167	H163-M167 WeakPolarHBondContact O-CG 3.37Å; H163-M167 PolarHBondContact O-N 3.02Å; H163-M167 VanDerWaalsContact O-N 3.14Å
164	Q	60.4	Low	65.6	Low	171 Å²	171	98.3 Å²	98.3	80%	0.799	48%	0.478	S	S	*	.	H	α-helix	trans	-66.7	-46.7	178.8	-86.5	-172.9	-34.9	0	0	112.7	Q162 Q166 M167 V168	Q162-Q164 VanDerWaalsContact C-N 3.31Å; Q162-Q164 PolarHBondContact O-N 3.45Å; Q164-Q166 VanDerWaalsContact C-N 3.28Å; Q164-Q166 PolarHBondContact O-N 3.32Å; Q164-M167 PolarHBondContact O-N 3Å; Q164-V168 PolarHBondContact O-N 2.93Å; Q164-V168 VanDerWaalsContact O-N 3.15Å
165	M	62.2	Low	66	Low	106 Å²	106	92.5 Å²	92.5	52%	0.522	46%	0.46	S	S	.	.	H	α-helix	trans	-62.2	-39	177.3	-72.7	-68.2	156.8	0	0	111.3	W158 Q162 M167 V168 G169	W158-M165 HydrophobicContact CD2-CB 4.48Å; W158-M165 HydrophobicContact CH2-CB 3.84Å; W158-M165 HydrophobicContact CH2-CG 4.46Å; W158-M165 HydrophobicContact CZ2-CB 3.54Å; W158-M165 HydrophobicContact CZ2-CG 4.01Å; W158-M165 HydrophobicContact CZ3-CB 4.4Å; Q162-M165 HydrophobicContact CB-CB 4.34Å; Q162-M165 PolarHBondContact O-N 2.82Å; M165-M167 VanDerWaalsContact C-N 3.35Å; M165-M167 PolarHBondContact O-N 3.47Å; M165-V168 PolarHBondContact O-N 2.97Å; M165-G169 PolarHBondContact O-N 3.49Å
166	Q	66.8	Low	66.7	Low	45 Å²	45	86.7 Å²	86.7	21%	0.21	45%	0.445	C	S	.	.	H	α-helix	trans	-61.6	-40.2	176.1	-157.7	-166.1	73.7	0	0	112.3	Q162 Q164 R170	Q162-Q166 PolarHBondContact O-N 2.96Å; Q164-Q166 VanDerWaalsContact C-N 3.28Å; Q164-Q166 PolarHBondContact O-N 3.32Å; Q166-R170 VanDerWaalsContact O-CG 3.27Å; Q166-R170 WeakPolarHBondContact O-CG 3.42Å; Q166-R170 PolarHBondContact O-N 3.12Å
167	M	68.6	Low	67.4	Low	57 Å²	57	84.9 Å²	84.9	28%	0.281	44%	0.436	S	S	.	.	H	α-helix	trans	-66.5	-42.9	177.1	-71.5	-63.3	-165.8	0	0	112.7	H163 Q164 M165 R170 L171 L204 T208	H163-M167 WeakPolarHBondContact O-CG 3.37Å; H163-M167 PolarHBondContact O-N 3.02Å; H163-M167 VanDerWaalsContact O-N 3.14Å; Q164-M167 PolarHBondContact O-N 3Å; M165-M167 VanDerWaalsContact C-N 3.35Å; M165-M167 PolarHBondContact O-N 3.47Å; M167-R170 PolarHBondContact O-N 2.95Å; M167-L171 PolarHBondContact O-N 2.86Å; M167-L204 HydrophobicContact SD-CD1 3.73Å; M167-T208 HydrophobicContact CE-CG2 3.65Å
168	V	71.1	Confident	68.3	Low	82 Å²	82	75.8 Å²	75.8	50%	0.497	39%	0.394	S	S	.	.	H	α-helix	trans	-65.6	-42.6	177	177.4	0	0	0	0	110.8	Q164 M165 L171 L172	Q164-V168 PolarHBondContact O-N 2.93Å; Q164-V168 VanDerWaalsContact O-N 3.15Å; M165-V168 PolarHBondContact O-N 2.97Å; V168-L171 PolarHBondContact O-N 3.1Å; V168-L172 HydrophobicContact CG1-CD1 4.05Å; V168-L172 HydrophobicContact CG1-CG 4.5Å; V168-L172 WeakPolarHBondContact O-CG 3.4Å; V168-L172 PolarHBondContact O-N 2.94Å
169	G	71.6	Confident	68.9	Low	12 Å²	12	71.9 Å²	71.9	12%	0.124	39%	0.385	C	S	.	.	H	α-helix	trans	-59.3	-46.7	174.8	0	0	0	0	0	113	M165 L171 L172 F173	M165-G169 PolarHBondContact O-N 3.49Å; G169-L171 PolarHBondContact O-N 3.43Å; G169-L172 PolarHBondContact O-N 3.35Å; G169-F173 WeakPolarHBondContact O-CD2 3.3Å; G169-F173 PolarHBondContact O-N 2.91Å; G169-F173 VanDerWaalsContact O-N 3.11Å
170	R	73.1	Confident	69.8	Low	31 Å²	31	75.1 Å²	75.1	12%	0.117	39%	0.39	C	S	.	.	H	α-helix	trans	-57	-47.6	173.8	-72.7	174.9	-166.9	-97.7	5.4	111.9	D149 V152 Q166 M167 L172 F173 V174	D149-R170 WeakPolarHBondContact OD1-CD 3.29Å; D149-R170 WeakPolarHBondContact OD1-CG 3.24Å; D149-R170 IonicContact OD1-CZ 3.69Å; D149-R170 IonicContact OD1-NE 3.92Å; D149-R170 IonicContact OD1-NH1 2.71Å; D149-R170 PolarHBondContact OD1-NH1 3.4Å; D149-R170 IonicContact OD2-NH1 3.07Å; D149-R170 PolarHBondContact OD2-NH1 3.27Å; V152-R170 HydrophobicContact CB-CG 4.39Å; V152-R170 HydrophobicContact CG1-CG 3.95Å; Q166-R170 VanDerWaalsContact O-CG 3.27Å; Q166-R170 WeakPolarHBondContact O-CG 3.42Å; Q166-R170 PolarHBondContact O-N 3.12Å; M167-R170 PolarHBondContact O-N 2.95Å; R170-L172 PolarHBondContact O-N 3Å; R170-F173 PolarHBondContact O-N 3.34Å; R170-V174 WeakPolarHBondContact O-CB 3.33Å; R170-V174 VanDerWaalsContact O-CG2 3.29Å; R170-V174 WeakPolarHBondContact O-CG2 3.42Å; R170-V174 PolarHBondContact O-N 3.2Å
171	L	75.3	Confident	70.5	Confident	57 Å²	57	68 Å²	68	30%	0.298	36%	0.357	S	S	.	.	H	α-helix	trans	-59.5	-45.7	-179.9	-178.9	59.9	0	0	0	112.1	M167 V168 G169 L175	M167-L171 PolarHBondContact O-N 2.86Å; V168-L171 PolarHBondContact O-N 3.1Å; G169-L171 PolarHBondContact O-N 3.43Å; L171-L175 HydrophobicContact CD1-CD1 4.11Å; L171-L175 HydrophobicContact CD1-CG 4.39Å; L171-L175 HydrophobicContact CG-CD1 4.02Å; L171-L175 WeakPolarHBondContact O-CB 3.29Å; L171-L175 VanDerWaalsContact O-CG 3.3Å; L171-L175 WeakPolarHBondContact O-CG 3.17Å; L171-L175 PolarHBondContact O-N 3.47Å
172	L	76.3	Confident	71.1	Confident	111 Å²	111	61.4 Å²	61.4	58%	0.581	32%	0.323	S	S	*	.	H	α-helix	trans	-66.1	-42.3	-179.5	-68.7	171.8	0	0	0	112.9	V168 G169 R170 L175 G176	V168-L172 HydrophobicContact CG1-CD1 4.05Å; V168-L172 HydrophobicContact CG1-CG 4.5Å; V168-L172 WeakPolarHBondContact O-CG 3.4Å; V168-L172 PolarHBondContact O-N 2.94Å; G169-L172 PolarHBondContact O-N 3.35Å; R170-L172 PolarHBondContact O-N 3Å; L172-L175 PolarHBondContact O-N 3.41Å; L172-G176 PolarHBondContact O-N 3.14Å
173	F	75.4	Confident	71.4	Confident	82 Å²	82	63.2 Å²	63.2	36%	0.36	34%	0.335	S	S	.	.	H	α-helix	trans	-70.8	-35.9	177.6	-89.6	-98.8	0	0	0	113.1	L151 V152 L156 G169 R170 G176 C177	L151-F173 HydrophobicContact CB-CD1 4.38Å; V152-F173 HydrophobicContact CG2-CB 3.36Å; V152-F173 HydrophobicContact CG2-CD1 4.14Å; V152-F173 HydrophobicContact CG2-CD2 3.67Å; V152-F173 HydrophobicContact CG2-CE2 4.49Å; V152-F173 HydrophobicContact CG2-CG 3.46Å; V152-F173 VanDerWaalsContact CG2-CG 3.46Å; L156-F173 HydrophobicContact CD1-CD2 4.46Å; L156-F173 HydrophobicContact CD1-CE2 3.74Å; L156-F173 HydrophobicContact CD1-CZ 3.87Å; G169-F173 WeakPolarHBondContact O-CD2 3.3Å; G169-F173 PolarHBondContact O-N 2.91Å; G169-F173 VanDerWaalsContact O-N 3.11Å; R170-F173 PolarHBondContact O-N 3.34Å; F173-G176 PolarHBondContact O-N 3.12Å; F173-C177 PolarHBondContact O-N 3.36Å; F173-C177 PolarHBondContact O-SG 2.66Å
174	V	78.6	Confident	71.5	Confident	4 Å²	4	60.6 Å²	60.6	2%	0.024	33%	0.325	C	S	.	.	H	α-helix	trans	-64.1	-47.4	172.4	169.1	0	0	0	0	110.3	C145 R170 G176 C177 V178	C145-V174 HydrophobicContact CB-CG1 4.27Å; R170-V174 WeakPolarHBondContact O-CB 3.33Å; R170-V174 VanDerWaalsContact O-CG2 3.29Å; R170-V174 WeakPolarHBondContact O-CG2 3.42Å; R170-V174 PolarHBondContact O-N 3.2Å; V174-G176 VanDerWaalsContact C-N 3.28Å; V174-G176 PolarHBondContact O-N 3.49Å; V174-C177 PolarHBondContact O-N 2.92Å; V174-V178 HydrophobicContact CG1-CG2 4.29Å; V174-V178 WeakPolarHBondContact O-CG2 3.44Å; V174-V178 PolarHBondContact O-N 3.29Å
175	L	78.9	Confident	71.2	Confident	55 Å²	55	58.8 Å²	58.8	29%	0.288	33%	0.328	S	S	.	.	H	α-helix	trans	-57.1	-40.4	173.8	-77.2	166.1	0	0	0	112.1	L171 L172 G179 L196 S200	L171-L175 HydrophobicContact CD1-CD1 4.11Å; L171-L175 HydrophobicContact CD1-CG 4.39Å; L171-L175 HydrophobicContact CG-CD1 4.02Å; L171-L175 WeakPolarHBondContact O-CB 3.29Å; L171-L175 VanDerWaalsContact O-CG 3.3Å; L171-L175 WeakPolarHBondContact O-CG 3.17Å; L171-L175 PolarHBondContact O-N 3.47Å; L172-L175 PolarHBondContact O-N 3.41Å; L175-G179 WeakPolarHBondContact O-CA 3.35Å; L175-G179 PolarHBondContact O-N 2.92Å; L175-L196 HydrophobicContact CD2-CB 4.22Å; L175-S200 VanDerWaalsContact CD2-OG 3.27Å; L175-S200 WeakPolarHBondContact CD2-OG 3.35Å
176	G	78.6	Confident	70.8	Confident	37 Å²	37	56.3 Å²	56.3	38%	0.381	32%	0.319	S	S	.	.	H	α-helix	trans	-63.6	-45.6	174.6	0	0	0	0	0	113.5	L172 F173 V174 G179 L180	L172-G176 PolarHBondContact O-N 3.14Å; F173-G176 PolarHBondContact O-N 3.12Å; V174-G176 VanDerWaalsContact C-N 3.28Å; V174-G176 PolarHBondContact O-N 3.49Å; G176-G179 PolarHBondContact O-N 3.35Å; G176-L180 WeakPolarHBondContact O-CG 3.35Å; G176-L180 PolarHBondContact O-N 2.86Å
177	C	78.1	Confident	70.2	Confident	15 Å²	15	56.3 Å²	56.3	10%	0.101	32%	0.32	C	S	.	.	H	α-helix	trans	-70.9	-39.5	-178.2	-67.5	0	0	0	0	113.1	S144 G148 F173 V174 G179 L181	S144-C177 WeakPolarHBondContact O-CB 3.35Å; G148-C177 VanDerWaalsContact CA-SG 3.53Å; F173-C177 PolarHBondContact O-N 3.36Å; F173-C177 PolarHBondContact O-SG 2.66Å; V174-C177 PolarHBondContact O-N 2.92Å; C177-G179 VanDerWaalsContact C-N 3.34Å; C177-L181 PolarHBondContact O-N 3.46Å
178	V	76.6	Confident	69.6	Low	1 Å²	1	62.2 Å²	62.2	1%	0.006	34%	0.344	C	S	.	.	H	α-helix	trans	-71.5	-34.7	171.9	-170.1	0	0	0	0	109.8	L141 C145 V174 L181 T182 L196	L141-V178 HydrophobicContact CG-CG1 4.31Å; C145-V178 VanDerWaalsContact SG-CG2 3.55Å; V174-V178 HydrophobicContact CG1-CG2 4.29Å; V174-V178 WeakPolarHBondContact O-CG2 3.44Å; V174-V178 PolarHBondContact O-N 3.29Å; V178-L181 WeakPolarHBondContact O-CA 3.46Å; V178-L181 WeakPolarHBondContact O-CB 3.5Å; V178-L181 PolarHBondContact O-N 2.92Å; V178-L181 VanDerWaalsContact O-N 3.07Å; V178-T182 WeakPolarHBondContact O-CG2 3.43Å; V178-T182 PolarHBondContact O-N 3.5Å; V178-L196 VanDerWaalsContact C-CD2 3.48Å; V178-L196 HydrophobicContact CB-CD2 3.65Å; V178-L196 HydrophobicContact CG1-CD2 3.54Å
179	G	72.9	Confident	68.8	Low	17 Å²	17	65.5 Å²	65.5	18%	0.175	36%	0.358	C	S	.	.	H	α-helix	trans	-60	-46.4	175.6	0	0	0	0	0	113.1	L175 G176 C177 L181 T182 L183	L175-G179 WeakPolarHBondContact O-CA 3.35Å; L175-G179 PolarHBondContact O-N 2.92Å; G176-G179 PolarHBondContact O-N 3.35Å; C177-G179 VanDerWaalsContact C-N 3.34Å; G179-L181 PolarHBondContact O-N 3.14Å; G179-T182 WeakPolarHBondContact O-CA 3.29Å; G179-T182 PolarHBondContact O-N 3.01Å; G179-T182 PolarHBondContact O-OG1 2.77Å; G179-L183 PolarHBondContact O-N 3.23Å
180	L	75.3	Confident	68.1	Low	117 Å²	117	74.9 Å²	74.9	61%	0.613	40%	0.395	S	S	*	.	H	α-helix	trans	-54.5	-39.9	170.3	-81.4	159.5	0	0	0	112	G176 T182 L183	G176-L180 WeakPolarHBondContact O-CG 3.35Å; G176-L180 PolarHBondContact O-N 2.86Å; L180-T182 PolarHBondContact O-N 3.02Å; L180-L183 HydrophobicContact CD2-CD1 4.28Å; L180-L183 PolarHBondContact O-N 3.43Å
181	L	69.5	Low	67.5	Low	32 Å²	32	78.2 Å²	78.2	17%	0.168	41%	0.412	C	S	.	.	H	α-helix	trans	-62.3	-27.5	174.5	-136.2	77.8	0	0	0	112.6	W137 L141 C177 V178 G179	W137-L181 HydrophobicContact CZ2-CD2 4.29Å; W137-L181 PolarHBondContact NE1-O 3.34Å; L141-L181 HydrophobicContact CB-CD2 4.32Å; C177-L181 PolarHBondContact O-N 3.46Å; V178-L181 WeakPolarHBondContact O-CA 3.46Å; V178-L181 WeakPolarHBondContact O-CB 3.5Å; V178-L181 PolarHBondContact O-N 2.92Å; V178-L181 VanDerWaalsContact O-N 3.07Å; G179-L181 PolarHBondContact O-N 3.14Å
182	T	65	Low	67.1	Low	26 Å²	26	76 Å²	76	16%	0.16	40%	0.402	C	S	.	.	H	α-helix	trans	-86.9	-9.6	179.6	70.3	0	0	0	0	114.7	W137 V178 G179 L180 I184 L187 S192 L196	W137-T182 HydrophobicContact CH2-CG2 4.5Å; W137-T182 HydrophobicContact CZ2-CG2 4.01Å; V178-T182 WeakPolarHBondContact O-CG2 3.43Å; V178-T182 PolarHBondContact O-N 3.5Å; G179-T182 WeakPolarHBondContact O-CA 3.29Å; G179-T182 PolarHBondContact O-N 3.01Å; G179-T182 PolarHBondContact O-OG1 2.77Å; L180-T182 PolarHBondContact O-N 3.02Å; T182-I184 PolarHBondContact O-N 3.39Å; T182-L187 HydrophobicContact CG2-CD1 4.2Å; T182-S192 VanDerWaalsContact CB-OG 3.25Å; T182-S192 WeakPolarHBondContact CB-OG 3.29Å; T182-S192 WeakPolarHBondContact CG2-OG 3.34Å; T182-S192 PolarHBondContact OG1-OG 3.15Å; T182-L196 HydrophobicContact CG2-CD1 4.43Å; T182-L196 HydrophobicContact CG2-CD2 4.14Å; T182-L196 HydrophobicContact CG2-CG 4.3Å
183	L	63.9	Low	66.8	Low	139 Å²	139	75.4 Å²	75.4	73%	0.728	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.1	-9	171	-67.1	174.3	0	0	0	113	G179 L180	G179-L183 PolarHBondContact O-N 3.23Å; L180-L183 HydrophobicContact CD2-CD1 4.28Å; L180-L183 PolarHBondContact O-N 3.43Å
184	I	63.6	Low	66.6	Low	75 Å²	75	77 Å²	77	39%	0.385	41%	0.414	S	S	.	.	S	Bend	trans	-63.4	127.2	170	-63.1	173	0	0	0	108	T182 T186	T182-I184 PolarHBondContact O-N 3.39Å; I184-T186 HydrophobicContact CG2-CG2 4.42Å; I184-T186 PolarHBondContact O-N 2.98Å
185	P	54	Low	66.4	Low	133 Å²	133	77.1 Å²	77.1	86%	0.864	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	2.7	-165.2	-28.4	35.6	0	0	0	118.4	L187	P185-L187 VanDerWaalsContact C-N 3.34Å; P185-L187 PolarHBondContact O-N 3.31Å
186	T	54.2	Low	66.1	Low	54 Å²	54	75.7 Å²	75.7	33%	0.331	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.6	-1.4	-175	59.2	0	0	0	0	114	K130 I184	K130-T186 PolarHBondContact NZ-O 3.38Å; I184-T186 HydrophobicContact CG2-CG2 4.42Å; I184-T186 PolarHBondContact O-N 2.98Å
187	L	53.6	Low	66	Low	45 Å²	45	77.6 Å²	77.6	24%	0.236	41%	0.411	C	S	.	.			trans	-119.5	128.5	-172.3	-69.1	156.1	0	0	0	112	W137 T182 P185	W137-L187 HydrophobicContact CD2-CD1 4.32Å; W137-L187 HydrophobicContact CH2-CD1 3.64Å; W137-L187 HydrophobicContact CH2-CD2 4.19Å; W137-L187 HydrophobicContact CZ2-CD1 3.35Å; W137-L187 HydrophobicContact CZ3-CD1 4.22Å; W137-L187 HydrophobicContact CZ3-CD2 4.24Å; T182-L187 HydrophobicContact CG2-CD1 4.2Å; P185-L187 VanDerWaalsContact C-N 3.34Å; P185-L187 PolarHBondContact O-N 3.31Å
188	K	56.5	Low	66.1	Low	181 Å²	181	81.1 Å²	81.1	79%	0.787	43%	0.425	S	S	*	.			trans	-91.1	130	173.6	-73.1	-167.7	174	-171.5	0	108.9	K190 H191	K188-K190 VanDerWaalsContact C-N 3.3Å; K188-K190 PolarHBondContact O-N 3.23Å; K188-K190 VanDerWaalsContact O-N 3.08Å; K188-H191 PolarHBondContact O-N 3Å
189	L	53	Low	66.2	Low	152 Å²	152	81.1 Å²	81.1	80%	0.796	43%	0.425	S	S	*	.	G	3₁₀ helix	trans	-48.8	-41.1	-167.5	-83.8	108.1	0	0	0	115.4	H191 S192	L189-H191 PolarHBondContact O-N 3.25Å; L189-S192 WeakPolarHBondContact O-CB 3.48Å; L189-S192 PolarHBondContact O-N 3.47Å
190	K	57.6	Low	66.4	Low	208 Å²	208	80.4 Å²	80.4	90%	0.904	42%	0.418	S	S	*	.	G	3₁₀ helix	trans	-54.8	-18.6	-174.5	-71.7	-161.7	175.5	-168.7	0	115.6	K188	K188-K190 VanDerWaalsContact C-N 3.3Å; K188-K190 PolarHBondContact O-N 3.23Å; K188-K190 VanDerWaalsContact O-N 3.08Å
191	H	59.9	Low	66.5	Low	101 Å²	101	78.2 Å²	78.2	47%	0.468	41%	0.409	S	S	.	.	G	3₁₀ helix	trans	-109.9	-8.2	174.6	-73.1	66.1	0	0	0	113.8	K129 K188 L189 V195	K129-H191 PolarHBondContact NZ-NE2 2.89Å; K188-H191 PolarHBondContact O-N 3Å; L189-H191 PolarHBondContact O-N 3.25Å; H191-V195 WeakPolarHBondContact O-CG2 3.29Å
192	S	66.8	Low	66.9	Low	12 Å²	12	77.7 Å²	77.7	8%	0.084	41%	0.407	C	S	.	.	H	α-helix	trans	-67.8	-47.4	-175.9	-162.9	0	0	0	0	112	T182 L189 L194 V195 L196	T182-S192 VanDerWaalsContact CB-OG 3.25Å; T182-S192 WeakPolarHBondContact CB-OG 3.29Å; T182-S192 WeakPolarHBondContact CG2-OG 3.34Å; T182-S192 PolarHBondContact OG1-OG 3.15Å; L189-S192 WeakPolarHBondContact O-CB 3.48Å; L189-S192 PolarHBondContact O-N 3.47Å; S192-L194 PolarHBondContact O-N 2.97Å; S192-V195 PolarHBondContact O-N 2.89Å; S192-V195 VanDerWaalsContact O-N 3.14Å; S192-L196 WeakPolarHBondContact O-CG 3.48Å; S192-L196 PolarHBondContact O-N 3.35Å
193	V	70.8	Confident	67.5	Low	97 Å²	97	76.6 Å²	76.6	59%	0.588	40%	0.4	S	S	*	.	H	α-helix	trans	-58.4	-44.9	-175.1	-175.7	0	0	0	0	112.4	V195 L196 V197	V193-V195 VanDerWaalsContact C-N 3.32Å; V193-V195 PolarHBondContact O-N 3.32Å; V193-L196 WeakPolarHBondContact O-CB 3.21Å; V193-L196 PolarHBondContact O-N 3.07Å; V193-V197 HydrophobicContact CG1-CG2 4.42Å; V193-V197 WeakPolarHBondContact O-CG2 3.33Å; V193-V197 PolarHBondContact O-N 3.31Å
194	L	72	Confident	68	Low	116 Å²	116	72.2 Å²	72.2	61%	0.607	38%	0.377	S	S	*	.	H	α-helix	trans	-66.8	-33.7	-179.5	-173.1	139	0	0	0	112.4	S192 F198	S192-L194 PolarHBondContact O-N 2.97Å; L194-F198 VanDerWaalsContact O-CB 3.22Å; L194-F198 WeakPolarHBondContact O-CB 3.48Å; L194-F198 PolarHBondContact O-N 3.29Å
195	V	73.9	Confident	68.4	Low	7 Å²	7	73.7 Å²	73.7	4%	0.042	39%	0.385	C	S	.	.	H	α-helix	trans	-71.3	-42.3	174.8	177.3	0	0	0	0	110.9	L122 L126 L141 H191 S192 V193 A199	L122-V195 HydrophobicContact CD1-CG1 4.49Å; L126-V195 HydrophobicContact CD1-CG1 4.33Å; L126-V195 HydrophobicContact CD2-CG2 3.76Å; L141-V195 HydrophobicContact CD1-CG1 3.99Å; H191-V195 WeakPolarHBondContact O-CG2 3.29Å; S192-V195 PolarHBondContact O-N 2.89Å; S192-V195 VanDerWaalsContact O-N 3.14Å; V193-V195 VanDerWaalsContact C-N 3.32Å; V193-V195 PolarHBondContact O-N 3.32Å; V195-A199 VanDerWaalsContact O-CB 3.25Å; V195-A199 WeakPolarHBondContact O-CB 3.45Å; V195-A199 PolarHBondContact O-N 3.14Å
196	L	72.5	Confident	69.4	Low	24 Å²	24	67.4 Å²	67.4	13%	0.126	34%	0.344	C	S	.	.	H	α-helix	trans	-59.2	-49.6	175.9	-73.8	163.5	0	0	0	111.4	L175 V178 T182 S192 V193 S200	L175-L196 HydrophobicContact CD2-CB 4.22Å; V178-L196 VanDerWaalsContact C-CD2 3.48Å; V178-L196 HydrophobicContact CB-CD2 3.65Å; V178-L196 HydrophobicContact CG1-CD2 3.54Å; T182-L196 HydrophobicContact CG2-CD1 4.43Å; T182-L196 HydrophobicContact CG2-CD2 4.14Å; T182-L196 HydrophobicContact CG2-CG 4.3Å; S192-L196 WeakPolarHBondContact O-CG 3.48Å; S192-L196 PolarHBondContact O-N 3.35Å; V193-L196 WeakPolarHBondContact O-CB 3.21Å; V193-L196 PolarHBondContact O-N 3.07Å; L196-S200 VanDerWaalsContact O-CB 3.27Å; L196-S200 WeakPolarHBondContact O-CB 3.46Å; L196-S200 PolarHBondContact O-N 3.44Å; L196-S200 VanDerWaalsContact O-N 3.1Å; L196-S200 PolarHBondContact O-OG 3.23Å
197	V	76.6	Confident	70	Confident	78 Å²	78	65.6 Å²	65.6	47%	0.473	33%	0.332	S	S	.	.	H	α-helix	trans	-63.6	-50.9	177.9	172.5	0	0	0	0	110.8	V193 A199 S200 V201	V193-V197 HydrophobicContact CG1-CG2 4.42Å; V193-V197 WeakPolarHBondContact O-CG2 3.33Å; V193-V197 PolarHBondContact O-N 3.31Å; V197-A199 PolarHBondContact O-N 3.11Å; V197-S200 PolarHBondContact O-N 2.99Å; V197-V201 HydrophobicContact CG1-CG2 4.32Å; V197-V201 WeakPolarHBondContact O-CB 3.29Å; V197-V201 WeakPolarHBondContact O-CG2 3.36Å; V197-V201 PolarHBondContact O-N 2.75Å
198	F	80.8	Confident	70.7	Confident	89 Å²	89	66.9 Å²	66.9	39%	0.39	34%	0.342	S	S	.	.	H	α-helix	trans	-60.6	-48.1	-178.1	-178.4	-93.3	0	0	0	112.5	A118 L122 L194 S200 V201 V202	A118-F198 HydrophobicContact CB-CZ 4.48Å; L122-F198 HydrophobicContact CB-CE1 4.19Å; L122-F198 HydrophobicContact CD1-CD1 3.93Å; L122-F198 HydrophobicContact CD1-CE1 4.31Å; L122-F198 HydrophobicContact CD2-CD1 4.04Å; L122-F198 HydrophobicContact CD2-CE1 4.32Å; L122-F198 HydrophobicContact CG-CD1 4.41Å; L194-F198 VanDerWaalsContact O-CB 3.22Å; L194-F198 WeakPolarHBondContact O-CB 3.48Å; L194-F198 PolarHBondContact O-N 3.29Å; F198-S200 VanDerWaalsContact C-N 3.31Å; F198-S200 PolarHBondContact O-N 2.95Å; F198-V201 PolarHBondContact O-N 2.99Å; F198-V202 HydrophobicContact CD1-CG2 4.18Å; F198-V202 HydrophobicContact CE1-CG2 3.79Å; F198-V202 HydrophobicContact CE2-CG2 4.25Å; F198-V202 HydrophobicContact CZ-CG2 3.83Å; F198-V202 WeakPolarHBondContact O-CG2 3.44Å; F198-V202 PolarHBondContact O-N 2.96Å
199	A	77.8	Confident	71.4	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-62.4	-39.3	178.8	0	0	0	0	0	112.1	L141 V195 V197 W203	L141-A199 HydrophobicContact CD2-CB 3.81Å; V195-A199 VanDerWaalsContact O-CB 3.25Å; V195-A199 WeakPolarHBondContact O-CB 3.45Å; V195-A199 PolarHBondContact O-N 3.14Å; V197-A199 PolarHBondContact O-N 3.11Å; A199-W203 VanDerWaalsContact O-CB 3.31Å; A199-W203 WeakPolarHBondContact O-CB 3.47Å; A199-W203 PolarHBondContact O-N 3.46Å
200	S	76.1	Confident	72.2	Confident	3 Å²	3	53.5 Å²	53.5	2%	0.021	28%	0.284	C	S	.	.	H	α-helix	trans	-70.5	-37.1	179.1	-55	0	0	0	0	112.5	L175 L196 V197 F198 W203 L204	L175-S200 VanDerWaalsContact CD2-OG 3.27Å; L175-S200 WeakPolarHBondContact CD2-OG 3.35Å; L196-S200 VanDerWaalsContact O-CB 3.27Å; L196-S200 WeakPolarHBondContact O-CB 3.46Å; L196-S200 PolarHBondContact O-N 3.44Å; L196-S200 VanDerWaalsContact O-N 3.1Å; L196-S200 PolarHBondContact O-OG 3.23Å; V197-S200 PolarHBondContact O-N 2.99Å; F198-S200 VanDerWaalsContact C-N 3.31Å; F198-S200 PolarHBondContact O-N 2.95Å; S200-W203 PolarHBondContact O-N 3.31Å; S200-L204 WeakPolarHBondContact O-CB 3.33Å; S200-L204 PolarHBondContact O-N 3.37Å
201	V	78.1	Confident	72.6	Confident	71 Å²	71	47.3 Å²	47.3	43%	0.43	27%	0.267	S	S	.	.	H	α-helix	trans	-67.5	-46.8	174.6	169.6	0	0	0	0	111.2	V197 F198 W203 L204 L205	V197-V201 HydrophobicContact CG1-CG2 4.32Å; V197-V201 WeakPolarHBondContact O-CB 3.29Å; V197-V201 WeakPolarHBondContact O-CG2 3.36Å; V197-V201 PolarHBondContact O-N 2.75Å; F198-V201 PolarHBondContact O-N 2.99Å; V201-W203 VanDerWaalsContact C-N 3.26Å; V201-W203 PolarHBondContact O-N 3.46Å; V201-L204 PolarHBondContact O-N 2.99Å; V201-L205 HydrophobicContact CG1-CD1 3.9Å; V201-L205 HydrophobicContact CG1-CG 4.45Å; V201-L205 WeakPolarHBondContact O-CB 3.5Å; V201-L205 VanDerWaalsContact O-CG 3.29Å; V201-L205 WeakPolarHBondContact O-CG 3.25Å; V201-L205 PolarHBondContact O-N 3.44Å
202	V	78.8	Confident	72.8	Confident	20 Å²	20	44 Å²	44	12%	0.121	26%	0.261	C	S	.	.	H	α-helix	trans	-59.3	-39.2	174.8	170.9	0	0	0	0	111	A118 F119 F198 S206	A118-V202 HydrophobicContact CB-CG1 3.9Å; A118-V202 HydrophobicContact CB-CG2 4.12Å; F119-V202 HydrophobicContact CE2-CG1 4Å; F198-V202 HydrophobicContact CD1-CG2 4.18Å; F198-V202 HydrophobicContact CE1-CG2 3.79Å; F198-V202 HydrophobicContact CE2-CG2 4.25Å; F198-V202 HydrophobicContact CZ-CG2 3.83Å; F198-V202 WeakPolarHBondContact O-CG2 3.44Å; F198-V202 PolarHBondContact O-N 2.96Å; V202-S206 PolarHBondContact O-N 3.32Å
203	W	76.8	Confident	72.8	Confident	3 Å²	3	43.9 Å²	43.9	1%	0.011	26%	0.259	C	S	.	.	H	α-helix	trans	-67.8	-44.3	176.5	-162.9	-102.2	0	0	0	112.7	C145 A199 S200 V201 L205 S206 L207 P219 A222 C223	C145-W203 HydrophobicContact CB-CB 4.39Å; C145-W203 HydrophobicContact CB-CD2 3.48Å; C145-W203 VanDerWaalsContact CB-CD2 3.48Å; C145-W203 HydrophobicContact CB-CE3 3.65Å; C145-W203 HydrophobicContact CB-CG 3.81Å; C145-W203 HydrophobicContact CB-CH2 4.47Å; C145-W203 HydrophobicContact CB-CZ2 4.35Å; C145-W203 HydrophobicContact CB-CZ3 4.15Å; A199-W203 VanDerWaalsContact O-CB 3.31Å; A199-W203 WeakPolarHBondContact O-CB 3.47Å; A199-W203 PolarHBondContact O-N 3.46Å; S200-W203 PolarHBondContact O-N 3.31Å; V201-W203 VanDerWaalsContact C-N 3.26Å; V201-W203 PolarHBondContact O-N 3.46Å; W203-L205 VanDerWaalsContact C-N 3.33Å; W203-L205 PolarHBondContact O-N 3Å; W203-S206 WeakPolarHBondContact O-CB 3.35Å; W203-S206 PolarHBondContact O-N 2.91Å; W203-S206 VanDerWaalsContact O-N 3.08Å; W203-S206 PolarHBondContact O-OG 3.08Å; W203-L207 PolarHBondContact O-N 3.36Å; W203-P219 WeakPolarHBondContact CH2-O 3.42Å; W203-P219 HydrophobicContact CZ2-CB 3.99Å; W203-A222 HydrophobicContact CE3-CB 4.49Å; W203-A222 HydrophobicContact CH2-CB 3.87Å; W203-A222 HydrophobicContact CZ3-CB 3.86Å; W203-C223 HydrophobicContact CH2-CB 3.98Å
204	L	74.3	Confident	72.7	Confident	48 Å²	48	41.8 Å²	41.8	25%	0.251	25%	0.247	S	C	.	.	H	α-helix	trans	-61.8	-40.9	176.7	-173.2	64.4	0	0	0	111.8	M167 S200 V201 S206 L207 T208	M167-L204 HydrophobicContact SD-CD1 3.73Å; S200-L204 WeakPolarHBondContact O-CB 3.33Å; S200-L204 PolarHBondContact O-N 3.37Å; V201-L204 PolarHBondContact O-N 2.99Å; L204-S206 VanDerWaalsContact C-N 3.29Å; L204-S206 PolarHBondContact O-N 2.94Å; L204-L207 PolarHBondContact O-N 3.44Å; L204-T208 PolarHBondContact O-N 2.78Å
205	L	73.4	Confident	72.4	Confident	105 Å²	105	39.5 Å²	39.5	55%	0.55	25%	0.245	S	C	.	.	H	α-helix	trans	-65.7	-28.4	173.9	-69.3	170.9	0	0	0	112.9	V201 W203 T208 S209	V201-L205 HydrophobicContact CG1-CD1 3.9Å; V201-L205 HydrophobicContact CG1-CG 4.45Å; V201-L205 WeakPolarHBondContact O-CB 3.5Å; V201-L205 VanDerWaalsContact O-CG 3.29Å; V201-L205 WeakPolarHBondContact O-CG 3.25Å; V201-L205 PolarHBondContact O-N 3.44Å; W203-L205 VanDerWaalsContact C-N 3.33Å; W203-L205 PolarHBondContact O-N 3Å; L205-T208 PolarHBondContact O-OG1 3.37Å; L205-S209 VanDerWaalsContact O-CB 3.29Å; L205-S209 WeakPolarHBondContact O-CB 3.43Å; L205-S209 PolarHBondContact O-N 3.31Å; L205-S209 VanDerWaalsContact O-N 3.08Å; L205-S209 PolarHBondContact O-OG 3.29Å
206	S	73	Confident	72	Confident	1 Å²	1	46.1 Å²	46.1	1%	0.007	28%	0.279	C	S	.	.	H	α-helix	trans	-65.7	-40.2	172.6	80.7	0	0	0	0	112.3	V202 W203 L204 T208 S209 L210	V202-S206 PolarHBondContact O-N 3.32Å; W203-S206 WeakPolarHBondContact O-CB 3.35Å; W203-S206 PolarHBondContact O-N 2.91Å; W203-S206 VanDerWaalsContact O-N 3.08Å; W203-S206 PolarHBondContact O-OG 3.08Å; L204-S206 VanDerWaalsContact C-N 3.29Å; L204-S206 PolarHBondContact O-N 2.94Å; S206-T208 PolarHBondContact O-N 2.95Å; S206-S209 PolarHBondContact O-OG 3.49Å; S206-L210 VanDerWaalsContact O-CB 3.24Å; S206-L210 WeakPolarHBondContact O-CB 3.4Å; S206-L210 WeakPolarHBondContact O-CD1 3.47Å; S206-L210 WeakPolarHBondContact O-CG 3.37Å; S206-L210 PolarHBondContact O-N 2.73Å
207	L	67.8	Low	71.8	Confident	16 Å²	16	46.9 Å²	46.9	8%	0.084	28%	0.283	C	S	.	.	H	α-helix	trans	-72	-30.3	-175.8	-65.6	175.3	0	0	0	112.9	D149 W203 L204 R218 P219	D149-L207 WeakPolarHBondContact OD1-CD1 3.49Å; W203-L207 PolarHBondContact O-N 3.36Å; L204-L207 PolarHBondContact O-N 3.44Å; L207-R218 HydrophobicContact CD2-CB 4.47Å; L207-P219 HydrophobicContact CD2-CB 4.35Å
208	T	68.3	Low	71.8	Confident	72 Å²	72	46.3 Å²	46.3	44%	0.442	27%	0.273	S	S	.	.	H	α-helix	trans	-81.1	-41.5	174.8	53.7	0	0	0	0	112.6	M167 L204 L205 S206	M167-T208 HydrophobicContact CE-CG2 3.65Å; L204-T208 PolarHBondContact O-N 2.78Å; L205-T208 PolarHBondContact O-OG1 3.37Å; S206-T208 PolarHBondContact O-N 2.95Å
209	S	70.6	Confident	71.4	Confident	51 Å²	51	42.4 Å²	42.4	36%	0.357	26%	0.256	S	S	.	.	H	α-helix	trans	-75.3	-30.7	-178.1	59.4	0	0	0	0	114.1	P111 L205 S206 S211	P111-S209 WeakPolarHBondContact CB-OG 3.28Å; L205-S209 VanDerWaalsContact O-CB 3.29Å; L205-S209 WeakPolarHBondContact O-CB 3.43Å; L205-S209 PolarHBondContact O-N 3.31Å; L205-S209 VanDerWaalsContact O-N 3.08Å; L205-S209 PolarHBondContact O-OG 3.29Å; S206-S209 PolarHBondContact O-OG 3.49Å; S209-S211 PolarHBondContact O-N 3.01Å
210	L	70.7	Confident	71.4	Confident	1 Å²	1	45.2 Å²	45.2	1%	0.005	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-79.9	26.4	177.4	-61.5	171.5	0	0	0	113.4	P111 L112 I115 S206 G212 L213 R218 A222	P111-L210 HydrophobicContact CB-CD2 4.05Å; P111-L210 HydrophobicContact CG-CD2 3.68Å; L112-L210 HydrophobicContact CD2-CD1 3.97Å; L112-L210 HydrophobicContact CD2-CD2 3.79Å; L112-L210 HydrophobicContact CG-CD2 3.72Å; I115-L210 HydrophobicContact CD1-CD1 4.22Å; S206-L210 VanDerWaalsContact O-CB 3.24Å; S206-L210 WeakPolarHBondContact O-CB 3.4Å; S206-L210 WeakPolarHBondContact O-CD1 3.47Å; S206-L210 WeakPolarHBondContact O-CG 3.37Å; S206-L210 PolarHBondContact O-N 2.73Å; L210-G212 PolarHBondContact O-N 3.25Å; L210-G212 VanDerWaalsContact O-N 3.15Å; L210-L213 HydrophobicContact CB-CD1 4.32Å; L210-L213 HydrophobicContact CD2-CD1 4Å; L210-L213 PolarHBondContact O-N 3.47Å; L210-R218 HydrophobicContact CB-CB 4.27Å; L210-R218 HydrophobicContact CB-CG 3.96Å; L210-R218 VanDerWaalsContact O-CD 3.31Å; L210-R218 WeakPolarHBondContact O-CD 3.3Å; L210-R218 WeakPolarHBondContact O-CG 3.32Å; L210-R218 PolarHBondContact O-NE 3.19Å; L210-A222 HydrophobicContact CD1-CB 4.04Å
211	S	66.4	Low	71.4	Confident	79 Å²	79	45.7 Å²	45.7	55%	0.552	27%	0.273	S	S	*	.	G	3₁₀ helix	trans	-54.5	-33.3	-177.5	60.2	0	0	0	0	113.6	S209 L213 R218	S209-S211 PolarHBondContact O-N 3.01Å; S211-L213 PolarHBondContact O-N 3.28Å; S211-R218 PolarHBondContact O-NH2 3.5Å
212	G	64.4	Low	71.6	Confident	32 Å²	32	42.3 Å²	42.3	33%	0.33	25%	0.252	S	S	.	.	G	3₁₀ helix	trans	-64.1	-19.6	177.3	0	0	0	0	0	115.3	R88 L210	R88-G212 PolarHBondContact NH1-O 3.44Å; R88-G212 PolarHBondContact NH2-O 3.29Å; L210-G212 PolarHBondContact O-N 3.25Å; L210-G212 VanDerWaalsContact O-N 3.15Å
213	L	66.2	Low	71.8	Confident	9 Å²	9	42.2 Å²	42.2	5%	0.047	25%	0.253	C	S	.	.	S	Bend	trans	-95	154.3	-179.1	-71.4	159.2	0	0	0	112.1	F84 L210 S211 R218 L221	F84-L213 HydrophobicContact CE1-CD2 4.15Å; L210-L213 HydrophobicContact CB-CD1 4.32Å; L210-L213 HydrophobicContact CD2-CD1 4Å; L210-L213 PolarHBondContact O-N 3.47Å; S211-L213 PolarHBondContact O-N 3.28Å; L213-R218 HydrophobicContact CB-CG 4.02Å; L213-R218 PolarHBondContact O-NE 2.83Å; L213-R218 PolarHBondContact O-NH2 3.19Å; L213-L221 HydrophobicContact CD1-CD1 3.8Å; L213-L221 HydrophobicContact CD2-CD1 4.06Å
214	P	68.9	Low	72.1	Confident	53 Å²	53	47.8 Å²	47.8	34%	0.344	28%	0.277	S	S	.	.			trans	-62.1	142.6	174.2	-21.6	33.9	0	0	0	111.9	F84 L216 L217 R218	F84-P214 HydrophobicContact CZ-CG 4.05Å; P214-L216 PolarHBondContact O-N 3.01Å; P214-L216 VanDerWaalsContact O-N 3.08Å; P214-L217 HydrophobicContact CB-CD1 4.03Å; P214-L217 HydrophobicContact CG-CD1 4.1Å; P214-L217 PolarHBondContact O-N 3.16Å; P214-R218 PolarHBondContact O-N 3.26Å
215	A	65.3	Low	72.6	Confident	68 Å²	68	45.8 Å²	45.8	56%	0.562	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.2	-36.9	-170.4	0	0	0	0	0	114.3	P219	A215-P219 VanDerWaalsContact O-CD 3.29Å; A215-P219 WeakPolarHBondContact O-CD 3.32Å
216	L	64.9	Low	73.2	Confident	146 Å²	146	40.8 Å²	40.8	76%	0.764	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.9	-27.8	178.1	-67.6	169.4	0	0	0	114	P214	P214-L216 PolarHBondContact O-N 3.01Å; P214-L216 VanDerWaalsContact O-N 3.08Å
217	L	69.3	Low	73.8	Confident	39 Å²	39	42.9 Å²	42.9	20%	0.204	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89	-22.7	-179.9	-76.9	108.1	0	0	0	113.3	F84 P214 L220 L221	F84-L217 HydrophobicContact CE2-CD1 4.34Å; F84-L217 HydrophobicContact CE2-CD2 4.23Å; F84-L217 HydrophobicContact CZ-CD1 4.07Å; F84-L217 HydrophobicContact CZ-CD2 4.26Å; P214-L217 HydrophobicContact CB-CD1 4.03Å; P214-L217 HydrophobicContact CG-CD1 4.1Å; P214-L217 PolarHBondContact O-N 3.16Å; L217-L220 PolarHBondContact O-N 3.48Å; L217-L221 HydrophobicContact CB-CD1 4.11Å; L217-L221 HydrophobicContact CD2-CD1 4.43Å; L217-L221 WeakPolarHBondContact O-CB 3.35Å; L217-L221 WeakPolarHBondContact O-CG 3.33Å; L217-L221 PolarHBondContact O-N 3.17Å
218	R	75.3	Confident	74.5	Confident	67 Å²	67	44.3 Å²	44.3	25%	0.253	27%	0.265	S	S	.	.	H	α-helix	trans	-52.8	-58.6	-179.7	-64.4	-179.9	-166	166.4	5.2	113.3	L207 L210 S211 L213 P214 L220 L221 A222	L207-R218 HydrophobicContact CD2-CB 4.47Å; L210-R218 HydrophobicContact CB-CB 4.27Å; L210-R218 HydrophobicContact CB-CG 3.96Å; L210-R218 VanDerWaalsContact O-CD 3.31Å; L210-R218 WeakPolarHBondContact O-CD 3.3Å; L210-R218 WeakPolarHBondContact O-CG 3.32Å; L210-R218 PolarHBondContact O-NE 3.19Å; S211-R218 PolarHBondContact O-NH2 3.5Å; L213-R218 HydrophobicContact CB-CG 4.02Å; L213-R218 PolarHBondContact O-NE 2.83Å; L213-R218 PolarHBondContact O-NH2 3.19Å; P214-R218 PolarHBondContact O-N 3.26Å; R218-L220 VanDerWaalsContact C-N 3.31Å; R218-L220 PolarHBondContact O-N 2.89Å; R218-L221 PolarHBondContact O-N 3.4Å; R218-A222 WeakPolarHBondContact O-CB 3.46Å; R218-A222 PolarHBondContact O-N 2.99Å
219	P	74.1	Confident	75.4	Confident	6 Å²	6	41 Å²	41	4%	0.039	25%	0.245	C	C	.	.	H	α-helix	trans	-68.5	-31.3	-177.4	28.9	-36.1	0	0	0	112	Y146 W203 L207 A215 C223	Y146-P219 HydrophobicContact CD2-CB 3.91Å; Y146-P219 WeakPolarHBondContact CD2-O 3.16Å; Y146-P219 HydrophobicContact CE2-CB 4.09Å; Y146-P219 HydrophobicContact CE2-CG 4.26Å; W203-P219 WeakPolarHBondContact CH2-O 3.42Å; W203-P219 HydrophobicContact CZ2-CB 3.99Å; L207-P219 HydrophobicContact CD2-CB 4.35Å; A215-P219 VanDerWaalsContact O-CD 3.29Å; A215-P219 WeakPolarHBondContact O-CD 3.32Å; P219-C223 WeakPolarHBondContact O-CB 3.41Å; P219-C223 PolarHBondContact O-N 3.3Å
220	L	76.9	Confident	76.1	Confident	60 Å²	60	38.6 Å²	38.6	31%	0.314	23%	0.229	S	C	.	.	H	α-helix	trans	-67	-46.6	178.3	179.2	143.4	0	0	0	111.5	Y146 L217 R218 C223 F224	Y146-L220 HydrophobicContact CE2-CB 4.1Å; L217-L220 PolarHBondContact O-N 3.48Å; R218-L220 VanDerWaalsContact C-N 3.31Å; R218-L220 PolarHBondContact O-N 2.89Å; L220-C223 WeakPolarHBondContact O-CB 3.3Å; L220-C223 PolarHBondContact O-N 3.39Å; L220-F224 HydrophobicContact CD2-CD2 3.86Å; L220-F224 HydrophobicContact CD2-CE2 3.78Å; L220-F224 HydrophobicContact CG-CD2 4.18Å; L220-F224 HydrophobicContact CG-CE2 3.96Å; L220-F224 VanDerWaalsContact O-CD2 3.24Å; L220-F224 WeakPolarHBondContact O-CD2 3.22Å; L220-F224 PolarHBondContact O-N 2.85Å
221	L	77.1	Confident	76.7	Confident	12 Å²	12	41.6 Å²	41.6	6%	0.063	24%	0.244	C	C	.	.	H	α-helix	trans	-69.5	-36.9	177.6	-67.4	169.7	0	0	0	111.8	F77 L112 L213 L217 R218 C223 F224 A225	F77-L221 HydrophobicContact CE2-CD2 3.66Å; F77-L221 HydrophobicContact CZ-CD2 4.03Å; L112-L221 HydrophobicContact CD2-CB 3.98Å; L213-L221 HydrophobicContact CD1-CD1 3.8Å; L213-L221 HydrophobicContact CD2-CD1 4.06Å; L217-L221 HydrophobicContact CB-CD1 4.11Å; L217-L221 HydrophobicContact CD2-CD1 4.43Å; L217-L221 WeakPolarHBondContact O-CB 3.35Å; L217-L221 WeakPolarHBondContact O-CG 3.33Å; L217-L221 PolarHBondContact O-N 3.17Å; R218-L221 PolarHBondContact O-N 3.4Å; L221-C223 VanDerWaalsContact C-N 3.32Å; L221-C223 PolarHBondContact O-N 3.11Å; L221-F224 PolarHBondContact O-N 2.66Å; L221-A225 WeakPolarHBondContact O-CB 3.24Å; L221-A225 PolarHBondContact O-N 2.96Å
222	A	81.6	Confident	77.4	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-61.8	-37.7	170.6	0	0	0	0	0	112.4	I115 W203 L210 R218 A225 G226	I115-A222 HydrophobicContact CD1-CB 4.31Å; W203-A222 HydrophobicContact CE3-CB 4.49Å; W203-A222 HydrophobicContact CH2-CB 3.87Å; W203-A222 HydrophobicContact CZ3-CB 3.86Å; L210-A222 HydrophobicContact CD1-CB 4.04Å; R218-A222 WeakPolarHBondContact O-CB 3.46Å; R218-A222 PolarHBondContact O-N 2.99Å; A222-A225 PolarHBondContact O-N 2.94Å; A222-G226 PolarHBondContact O-N 2.95Å
223	C	83.8	Confident	78.2	Confident	19 Å²	19	39.8 Å²	39.8	13%	0.128	22%	0.221	C	C	.	.	H	α-helix	trans	-63.8	-48.1	175	-168.6	0	0	0	0	111.5	Y146 W203 P219 L220 L221 A225 G226 V227	Y146-C223 HydrophobicContact CD2-CB 4.11Å; Y146-C223 HydrophobicContact CG-CB 4.24Å; W203-C223 HydrophobicContact CH2-CB 3.98Å; P219-C223 WeakPolarHBondContact O-CB 3.41Å; P219-C223 PolarHBondContact O-N 3.3Å; L220-C223 WeakPolarHBondContact O-CB 3.3Å; L220-C223 PolarHBondContact O-N 3.39Å; L221-C223 VanDerWaalsContact C-N 3.32Å; L221-C223 PolarHBondContact O-N 3.11Å; C223-A225 PolarHBondContact O-N 3.22Å; C223-G226 PolarHBondContact O-N 3.14Å; C223-V227 WeakPolarHBondContact O-CB 3.46Å; C223-V227 WeakPolarHBondContact O-CG2 3.45Å; C223-V227 PolarHBondContact O-N 3.46Å
224	F	82.1	Confident	78.8	Confident	120 Å²	120	40.2 Å²	40.2	53%	0.526	22%	0.223	S	C	.	.	H	α-helix	trans	-62.3	-41	176.6	-80.3	-68.6	0	0	0	112.7	F77 L220 L221 S228	F77-F224 HydrophobicContact CD2-CB 4.25Å; F77-F224 HydrophobicContact CE2-CB 3.89Å; L220-F224 HydrophobicContact CD2-CD2 3.86Å; L220-F224 HydrophobicContact CD2-CE2 3.78Å; L220-F224 HydrophobicContact CG-CD2 4.18Å; L220-F224 HydrophobicContact CG-CE2 3.96Å; L220-F224 VanDerWaalsContact O-CD2 3.24Å; L220-F224 WeakPolarHBondContact O-CD2 3.22Å; L220-F224 PolarHBondContact O-N 2.85Å; L221-F224 PolarHBondContact O-N 2.66Å; F224-S228 WeakPolarHBondContact O-CB 3.48Å; F224-S228 PolarHBondContact O-N 3.06Å; F224-S228 PolarHBondContact O-OG 3.22Å
225	A	84.4	Confident	79.1	Confident	6 Å²	6	38.9 Å²	38.9	5%	0.05	21%	0.214	C	C	.	.	H	α-helix	trans	-59.3	-48	172.3	0	0	0	0	0	112.1	L112 I115 G116 L221 A222 C223 S228 G229	L112-A225 HydrophobicContact CD2-CB 4.23Å; L112-A225 WeakPolarHBondContact O-CB 3.36Å; I115-A225 HydrophobicContact CB-CB 4.29Å; I115-A225 HydrophobicContact CG2-CB 4.04Å; G116-A225 WeakPolarHBondContact CA-O 3.26Å; L221-A225 WeakPolarHBondContact O-CB 3.24Å; L221-A225 PolarHBondContact O-N 2.96Å; A222-A225 PolarHBondContact O-N 2.94Å; C223-A225 PolarHBondContact O-N 3.22Å; A225-S228 PolarHBondContact O-OG 3.13Å; A225-G229 PolarHBondContact O-N 2.63Å
226	G	86.5	Confident	79.7	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-63.9	-46	177.9	0	0	0	0	0	113.7	F119 A222 C223 S228 G229 S230	F119-G226 WeakPolarHBondContact CB-O 3.44Å; A222-G226 PolarHBondContact O-N 2.95Å; C223-G226 PolarHBondContact O-N 3.14Å; G226-S228 PolarHBondContact O-N 3.3Å; G226-G229 PolarHBondContact O-N 3.42Å; G226-S230 PolarHBondContact O-N 2.7Å; G226-S230 PolarHBondContact O-OG 3.27Å
227	V	85	Confident	79.9	Confident	45 Å²	45	33 Å²	33	27%	0.273	17%	0.173	S	C	.	.	H	α-helix	trans	-63.9	-41.1	178.8	172.4	0	0	0	0	111.4	L139 P142 C223 S230 L231	L139-V227 HydrophobicContact CD2-CG1 4.37Å; P142-V227 HydrophobicContact CB-CG2 3.99Å; P142-V227 HydrophobicContact CG-CG2 4.21Å; C223-V227 WeakPolarHBondContact O-CB 3.46Å; C223-V227 WeakPolarHBondContact O-CG2 3.45Å; C223-V227 PolarHBondContact O-N 3.46Å; V227-S230 PolarHBondContact O-N 3.1Å; V227-L231 VanDerWaalsContact O-CB 3.32Å; V227-L231 WeakPolarHBondContact O-CB 3.48Å; V227-L231 PolarHBondContact O-N 3.33Å
228	S	83.4	Confident	79.7	Confident	46 Å²	46	38 Å²	38	32%	0.322	19%	0.189	S	C	.	.	H	α-helix	trans	-66.2	-39.6	175.9	57.2	0	0	0	0	112.3	F224 A225 G226 L231 L232	F224-S228 WeakPolarHBondContact O-CB 3.48Å; F224-S228 PolarHBondContact O-N 3.06Å; F224-S228 PolarHBondContact O-OG 3.22Å; A225-S228 PolarHBondContact O-OG 3.13Å; G226-S228 PolarHBondContact O-N 3.3Å; S228-L231 PolarHBondContact O-N 3.24Å; S228-L232 WeakPolarHBondContact O-CB 3.41Å; S228-L232 WeakPolarHBondContact O-CG 3.21Å; S228-L232 PolarHBondContact O-N 3.42Å
229	G	86.5	Confident	78.8	Confident	2 Å²	2	41.2 Å²	41.2	2%	0.021	20%	0.202	C	C	.	.	H	α-helix	trans	-57.8	-49.9	170.9	0	0	0	0	0	113	G116 F120 A225 G226 L231 L232 G233	G116-G229 WeakPolarHBondContact O-CA 3.35Å; F120-G229 WeakPolarHBondContact CA-O 3.31Å; A225-G229 PolarHBondContact O-N 2.63Å; G226-G229 PolarHBondContact O-N 3.42Å; G229-L231 PolarHBondContact O-N 3.08Å; G229-L232 PolarHBondContact O-N 3.44Å; G229-G233 PolarHBondContact O-N 3.16Å
230	S	85	Confident	78	Confident	1 Å²	1	46.4 Å²	46.4	1%	0.007	22%	0.222	C	C	.	.	H	α-helix	trans	-61.7	-39.7	174.8	-64.2	0	0	0	0	112.7	T123 L138 G226 V227 G233 I234	T123-S230 WeakPolarHBondContact OG1-CA 3.35Å; T123-S230 WeakPolarHBondContact OG1-CB 3.37Å; T123-S230 PolarHBondContact OG1-OG 3.37Å; T123-S230 VanDerWaalsContact OG1-OG 3.12Å; L138-S230 PolarHBondContact O-OG 3.42Å; G226-S230 PolarHBondContact O-N 2.7Å; G226-S230 PolarHBondContact O-OG 3.27Å; V227-S230 PolarHBondContact O-N 3.1Å; S230-G233 PolarHBondContact O-N 3.17Å; S230-I234 WeakPolarHBondContact O-CB 3.38Å; S230-I234 VanDerWaalsContact O-CG1 3.3Å; S230-I234 WeakPolarHBondContact O-CG1 3.4Å; S230-I234 PolarHBondContact O-N 3.5Å
231	L	82.8	Confident	76.4	Confident	63 Å²	63	51.2 Å²	51.2	33%	0.33	24%	0.243	S	C	.	.	H	α-helix	trans	-65.4	-42.3	177.5	-175.8	64.7	0	0	0	111.7	L139 V227 S228 G229 I234 C235	L139-L231 HydrophobicContact CD2-CB 4.22Å; L139-L231 HydrophobicContact CD2-CD1 4.46Å; V227-L231 VanDerWaalsContact O-CB 3.32Å; V227-L231 WeakPolarHBondContact O-CB 3.48Å; V227-L231 PolarHBondContact O-N 3.33Å; S228-L231 PolarHBondContact O-N 3.24Å; G229-L231 PolarHBondContact O-N 3.08Å; L231-I234 PolarHBondContact O-N 3.23Å; L231-C235 WeakPolarHBondContact O-CB 3.36Å; L231-C235 PolarHBondContact O-N 3.21Å; L231-C235 PolarHBondContact O-SG 3.35Å
232	L	81.8	Confident	74.5	Confident	72 Å²	72	56.2 Å²	56.2	38%	0.377	27%	0.274	S	S	.	.	H	α-helix	trans	-62.1	-42.8	174.2	-74.3	168.5	0	0	0	111.3	F120 S228 G229 I234 C235 F236	F120-L232 HydrophobicContact CD2-CB 3.99Å; F120-L232 HydrophobicContact CE2-CB 4.42Å; S228-L232 WeakPolarHBondContact O-CB 3.41Å; S228-L232 WeakPolarHBondContact O-CG 3.21Å; S228-L232 PolarHBondContact O-N 3.42Å; G229-L232 PolarHBondContact O-N 3.44Å; L232-I234 PolarHBondContact O-N 3.47Å; L232-C235 PolarHBondContact O-N 3.32Å; L232-F236 WeakPolarHBondContact O-CB 3.41Å; L232-F236 PolarHBondContact O-N 3.33Å
233	G	81.7	Confident	72.1	Confident	1 Å²	1	67.3 Å²	67.3	1%	0.01	32%	0.316	C	S	.	.	H	α-helix	trans	-61.9	-40.8	175	0	0	0	0	0	112.8	G229 S230 C235 D237	G229-G233 PolarHBondContact O-N 3.16Å; S230-G233 PolarHBondContact O-N 3.17Å; G233-C235 VanDerWaalsContact C-N 3.32Å; G233-C235 PolarHBondContact O-N 2.95Å; G233-D237 PolarHBondContact O-N 3.43Å
234	I	78.9	Confident	69.6	Low	19 Å²	19	72.8 Å²	72.8	10%	0.097	34%	0.339	C	S	.	.	H	α-helix	trans	-66.2	-32.5	175.1	-74.3	167.1	0	0	0	112.5	T123 R127 L138 L139 S230 L231 L232	T123-I234 HydrophobicContact CG2-CD1 4.47Å; T123-I234 HydrophobicContact CG2-CG1 3.9Å; R127-I234 PolarHBondContact NH1-O 2.82Å; L138-I234 HydrophobicContact CB-CD1 4.33Å; L139-I234 HydrophobicContact CD1-CD1 4.06Å; L139-I234 HydrophobicContact CD2-CD1 4.03Å; L139-I234 HydrophobicContact CG-CD1 3.73Å; S230-I234 WeakPolarHBondContact O-CB 3.38Å; S230-I234 VanDerWaalsContact O-CG1 3.3Å; S230-I234 WeakPolarHBondContact O-CG1 3.4Å; S230-I234 PolarHBondContact O-N 3.5Å; L231-I234 PolarHBondContact O-N 3.23Å; L232-I234 PolarHBondContact O-N 3.47Å
235	C	74.6	Confident	67	Low	24 Å²	24	71.1 Å²	71.1	16%	0.162	35%	0.348	C	S	.	.	H	α-helix	trans	-77.7	-42.5	176.6	-67.5	0	0	0	0	112	L231 L232 G233 D237 R238 Y239	L231-C235 WeakPolarHBondContact O-CB 3.36Å; L231-C235 PolarHBondContact O-N 3.21Å; L231-C235 PolarHBondContact O-SG 3.35Å; L232-C235 PolarHBondContact O-N 3.32Å; G233-C235 VanDerWaalsContact C-N 3.32Å; G233-C235 PolarHBondContact O-N 2.95Å; C235-D237 PolarHBondContact O-N 2.64Å; C235-R238 WeakPolarHBondContact O-CA 3.22Å; C235-R238 WeakPolarHBondContact O-CB 3.37Å; C235-R238 PolarHBondContact O-N 3.48Å; C235-Y239 WeakPolarHBondContact O-CD2 3.27Å; C235-Y239 PolarHBondContact O-N 3.21Å; C235-Y239 VanDerWaalsContact O-N 3.17Å
236	F	77.3	Confident	64.4	Low	36 Å²	36	76.8 Å²	76.8	16%	0.158	38%	0.384	C	S	.	.	H	α-helix	trans	-56.5	-51.8	178.3	-173.7	-93	0	0	0	111.2	F56 F120 F124 L232 R238 Y239 Y240	F56-F236 HydrophobicContact CE2-CD2 4.42Å; F120-F236 HydrophobicContact CE2-CB 4.22Å; F120-F236 HydrophobicContact CZ-CG 4.39Å; F124-F236 HydrophobicContact CD2-CD1 4.49Å; F124-F236 HydrophobicContact CE2-CD1 4.31Å; F124-F236 HydrophobicContact CE2-CE1 4.35Å; L232-F236 WeakPolarHBondContact O-CB 3.41Å; L232-F236 PolarHBondContact O-N 3.33Å; F236-R238 PolarHBondContact O-N 3.44Å; F236-R238 VanDerWaalsContact O-N 3.16Å; F236-Y239 PolarHBondContact O-N 2.82Å; F236-Y240 HydrophobicContact CE1-CD2 4.35Å; F236-Y240 HydrophobicContact CE1-CG 4.46Å; F236-Y240 HydrophobicContact CE2-CD2 4.12Å; F236-Y240 HydrophobicContact CE2-CE2 4.42Å; F236-Y240 AromaticContact CZ-CD2 3.93Å; F236-Y240 HydrophobicContact CZ-CD2 3.93Å; F236-Y240 HydrophobicContact CZ-CE2 4.31Å; F236-Y240 HydrophobicContact CZ-CG 4.4Å; F236-Y240 PolarHBondContact O-N 3.05Å
237	D	70.3	Confident	61.7	Low	55 Å²	55	83.6 Å²	83.6	29%	0.294	43%	0.43	S	S	.	.	H	α-helix	trans	-60.6	-21.4	175	177.6	91.8	0	0	0	113.9	R127 G233 C235	R127-D237 WeakPolarHBondContact CD-OD2 3.48Å; R127-D237 IonicContact CZ-OD2 3.46Å; R127-D237 IonicContact NE-OD2 3.99Å; R127-D237 IonicContact NH1-OD2 3.6Å; R127-D237 PolarHBondContact NH1-OD2 3.09Å; G233-D237 PolarHBondContact O-N 3.43Å; C235-D237 PolarHBondContact O-N 2.64Å
238	R	64.8	Low	59	Low	143 Å²	143	84.5 Å²	84.5	54%	0.54	45%	0.448	S	S	.	.	H	α-helix	trans	-84.3	-23.6	176	-163.5	178.1	-170.9	171.9	2.5	113.4	C235 F236	C235-R238 WeakPolarHBondContact O-CA 3.22Å; C235-R238 WeakPolarHBondContact O-CB 3.37Å; C235-R238 PolarHBondContact O-N 3.48Å; F236-R238 PolarHBondContact O-N 3.44Å; F236-R238 VanDerWaalsContact O-N 3.16Å
239	Y	57.3	Low	56.5	Low	135 Å²	135	90.7 Å²	90.7	53%	0.529	48%	0.476	S	S	.	.	H	α-helix	trans	-94.4	-37	175	-80.9	-76	0	0	0	112	S64 C235 F236 Q241	S64-Y239 WeakPolarHBondContact CB-OH 3.39Å; S64-Y239 PolarHBondContact OG-OH 2.87Å; C235-Y239 WeakPolarHBondContact O-CD2 3.27Å; C235-Y239 PolarHBondContact O-N 3.21Å; C235-Y239 VanDerWaalsContact O-N 3.17Å; F236-Y239 PolarHBondContact O-N 2.82Å; Y239-Q241 VanDerWaalsContact C-N 3.25Å; Y239-Q241 PolarHBondContact O-N 2.9Å
240	Y	55.8	Low	53.7	Low	115 Å²	115	96 Å²	96	45%	0.451	51%	0.513	S	S	.	.			trans	-88	51.2	171.7	-98.4	-86.4	0	0	0	111.9	F236 T242	F236-Y240 HydrophobicContact CE1-CD2 4.35Å; F236-Y240 HydrophobicContact CE1-CG 4.46Å; F236-Y240 HydrophobicContact CE2-CD2 4.12Å; F236-Y240 HydrophobicContact CE2-CE2 4.42Å; F236-Y240 AromaticContact CZ-CD2 3.93Å; F236-Y240 HydrophobicContact CZ-CD2 3.93Å; F236-Y240 HydrophobicContact CZ-CE2 4.31Å; F236-Y240 HydrophobicContact CZ-CG 4.4Å; F236-Y240 PolarHBondContact O-N 3.05Å; Y240-T242 PolarHBondContact O-N 3.28Å; Y240-T242 VanDerWaalsContact O-N 3.13Å
241	Q	42.9	Very low	51.2	Low	162 Å²	162	101.6 Å²	101.6	76%	0.757	55%	0.552	S	S	*	*			trans	-69	108.6	162.2	-74.3	-159.9	-81.8	0	0	108.8	Y239 R243	Y239-Q241 VanDerWaalsContact C-N 3.25Å; Y239-Q241 PolarHBondContact O-N 2.9Å; Q241-R243 PolarHBondContact O-N 3.14Å
242	T	38.2	Very low	48.5	Very low	116 Å²	116	103.3 Å²	103.3	71%	0.712	58%	0.575	S	S	*	*			trans	-52.9	124.3	162.1	-44.6	0	0	0	0	108.1	Y240 E244	Y240-T242 PolarHBondContact O-N 3.28Å; Y240-T242 VanDerWaalsContact O-N 3.13Å; T242-E244 PolarHBondContact O-N 3.24Å
243	R	31.8	Very low	46.5	Very low	234 Å²	234	107.7 Å²	107.7	88%	0.883	59%	0.594	S	S	*	*			trans	-76.4	70.2	-176.3	-169.5	-177.1	177.7	-177.5	-1.7	110.9	Q241 A245	Q241-R243 PolarHBondContact O-N 3.14Å; R243-A245 PolarHBondContact O-N 3.08Å
244	E	30.9	Very low	43.8	Very low	133 Å²	133	116 Å²	116	62%	0.621	63%	0.632	S	S	*	*	P	Polyproline II helix	trans	-55.7	122.2	154.2	-71.3	175.2	-170.4	0	0	107.5	K131 T242	K131-E244 IonicContact NZ-OE1 2.66Å; K131-E244 PolarHBondContact NZ-OE1 3.11Å; K131-E244 IonicContact NZ-OE2 3.51Å; K131-E244 PolarHBondContact NZ-OE2 3.19Å; T242-E244 PolarHBondContact O-N 3.24Å
245	A	26.7	Very low	41.6	Very low	86 Å²	86	123.9 Å²	123.9	71%	0.711	67%	0.666	S	S	*	*	P	Polyproline II helix	trans	-69.5	129.2	-179.2	0	0	0	0	0	110.2	R243 C247	R243-A245 PolarHBondContact O-N 3.08Å; A245-C247 PolarHBondContact O-N 3.46Å
246	P	30.2	Very low	39.3	Very low	124 Å²	124	128.1 Å²	128.1	81%	0.805	69%	0.691	S	S	*	*	P	Polyproline II helix	trans	-67.2	116.4	170.3	-16.3	30.5	0	0	0	109.5	G248	P246-G248 PolarHBondContact O-N 3.12Å
247	C	29.6	Very low	37	Very low	143 Å²	143	131.5 Å²	131.5	97%	0.966	72%	0.716	S	S	*	*			trans	-74.3	113.9	164.8	-171.6	0	0	0	0	108.1	A245	A245-C247 PolarHBondContact O-N 3.46Å
248	G	29	Very low	34.9	Very low	64 Å²	64	135 Å²	135	66%	0.66	74%	0.74	S	S	*	*			trans	-170.7	120.1	-176.8	0	0	0	0	0	111.5	P246	P246-G248 PolarHBondContact O-N 3.12Å
249	I	31.6	Very low	33.1	Very low	176 Å²	176	135.3 Å²	135.3	90%	0.903	75%	0.75	S	S	*	*			trans	-74.5	131.7	-179.7	-62	162.6	0	0	0	109.6
250	S	27	Very low	31.9	Very low	115 Å²	115	137.6 Å²	137.6	80%	0.804	76%	0.763	S	S	*	*			trans	-146.5	109.5	160.2	62.8	0	0	0	0	110.8
251	S	32.1	Very low	30.8	Very low	118 Å²	118	138.2 Å²	138.2	83%	0.825	78%	0.781	S	S	*	*			trans	-80.7	120.1	174.4	52.7	0	0	0	0	111.4
252	A	27.1	Very low	30	Very low	99 Å²	99	142.2 Å²	142.2	82%	0.818	79%	0.789	S	S	*	*			trans	-156.4	128.7	160	0	0	0	0	0	109.5
253	E	37.9	Very low	29.6	Very low	163 Å²	163	148.2 Å²	148.2	76%	0.762	80%	0.799	S	S	*	*			trans	-72.8	135.6	161.8	-73.4	-179.2	85.1	0	0	109.2	K255	E253-K255 IonicContact OE1-NZ 3.47Å; E253-K255 PolarHBondContact OE1-NZ 2.87Å
254	E	25.6	Very low	29.4	Very low	176 Å²	176	149 Å²	149	82%	0.822	80%	0.802	S	S	*	*			trans	-139.5	105.3	160.3	-155.5	172.8	-158.3	0	0	111	V256	E254-V256 HydrophobicContact CG-CG2 3.95Å; E254-V256 PolarHBondContact O-N 2.88Å
255	K	32.1	Very low	29.5	Very low	184 Å²	184	148.1 Å²	148.1	80%	0.8	81%	0.81	S	S	*	*			trans	-83.9	107.4	177.1	-73	167.2	179	142.6	0	109.3	E253	E253-K255 IonicContact OE1-NZ 3.47Å; E253-K255 PolarHBondContact OE1-NZ 2.87Å
256	V	26.6	Very low	29.6	Very low	114 Å²	114	149.9 Å²	149.9	69%	0.691	82%	0.818	S	S	*	*			trans	-120	137.2	179.1	-174.7	0	0	0	0	109.2	E254	E254-V256 HydrophobicContact CG-CG2 3.95Å; E254-V256 PolarHBondContact O-N 2.88Å
257	P	30.1	Very low	29.6	Very low	106 Å²	106	149.2 Å²	149.2	69%	0.688	82%	0.815	S	S	*	*			trans	-94.9	160.3	-142.7	35.2	-37.9	0	0	0	117	I259	P257-I259 PolarHBondContact O-N 3.16Å
258	V	26.4	Very low	29.4	Very low	129 Å²	129	149.3 Å²	149.3	78%	0.782	81%	0.811	S	S	*	*			trans	-63.4	121.6	173.1	177	0	0	0	0	111.5	K260	V258-K260 HydrophobicContact CG1-CG 4.18Å
259	I	27	Very low	29.5	Very low	150 Å²	150	151 Å²	151	77%	0.769	81%	0.813	S	S	*	*			trans	-111.4	112.8	169.5	-60.1	177.8	0	0	0	108.8	P257 P261	P257-I259 PolarHBondContact O-N 3.16Å; I259-P261 WeakPolarHBondContact O-CD 3.44Å
260	K	31.6	Very low	29.3	Very low	183 Å²	183	150.5 Å²	150.5	80%	0.796	81%	0.811	S	S	*	*			trans	-96.4	115.3	174	-75.9	-179.1	176.5	176	0	111.2	V258	V258-K260 HydrophobicContact CG1-CG 4.18Å
261	P	31.7	Very low	29.4	Very low	128 Å²	128	147.8 Å²	147.8	83%	0.831	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-69.2	129.2	163.4	-18.1	33	0	0	0	110.7	I259	I259-P261 WeakPolarHBondContact O-CD 3.44Å
262	R	26.4	Very low	29.3	Very low	245 Å²	245	150.3 Å²	150.3	93%	0.925	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-92.8	127.6	-174.7	-174.2	176.4	-175.9	163.7	1.2	110.6
263	R	31.1	Very low	29.4	Very low	242 Å²	242	151.5 Å²	151.5	91%	0.913	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-57.2	141.2	171.4	-80	-172.4	173.2	-158.2	-1.3	111.2
264	R	27.8	Very low	29.1	Very low	250 Å²	250	148.6 Å²	148.6	94%	0.943	80%	0.795	S	S	*	*			trans	-130.7	131.9	144	-92.2	-166.5	170.4	-149.1	-2.3	109.3
265	S	32.9	Very low	29.2	Very low	115 Å²	115	145.7 Å²	145.7	80%	0.804	79%	0.789	S	S	*	*			trans	-102.8	157	166.8	45.5	0	0	0	0	109.7
266	S	27.5	Very low	28.9	Very low	124 Å²	124	141.5 Å²	141.5	87%	0.867	78%	0.783	S	S	*	*			trans	-147	97.7	161.1	54.6	0	0	0	0	108.6
267	C	31.2	Very low	28.9	Very low	109 Å²	109	146.1 Å²	146.1	74%	0.736	79%	0.789	S	S	*	*			trans	-88.1	154.5	163.1	48	0	0	0	0	109.4
268	V	25.5	Very low	28.7	Very low	146 Å²	146	151.4 Å²	151.4	89%	0.885	80%	0.797	S	S	*	*			trans	-135.6	130	160.4	176.8	0	0	0	0	106.8
269	S	29.6	Very low	28.5	Very low	100 Å²	100	148.6 Å²	148.6	70%	0.699	79%	0.794	S	S	*	*			trans	-108.7	168	178.8	-51.8	0	0	0	0	110.5
270	L	29	Very low	28.5	Very low	164 Å²	164	147.1 Å²	147.1	86%	0.859	80%	0.797	S	S	*	*			trans	170.2	138.5	143.4	-94.6	156.9	0	0	0	108.3
271	G	27.4	Very low	28.3	Very low	58 Å²	58	144.4 Å²	144.4	60%	0.598	80%	0.8	S	S	*	*			cis	-147.5	155.6	-10.7	0	0	0	0	0	108.5
272	E	30.6	Very low	28	Very low	171 Å²	171	147.5 Å²	147.5	80%	0.799	80%	0.8	S	S	*	*				64.4	138.6	71.2	-64.5	-168.8	136.4	0	0	113.3
273	T	30.4	Very low	28.1	Very low	125 Å²	125	144.1 Å²	144.1	77%	0.767	80%	0.797	S	S	*	*			cis	-155.2	167.4	-5	11.4	0	0	0	0	107.2
274	S	30.9	Very low	28	Very low	102 Å²	102	138.9 Å²	138.9	71%	0.713	79%	0.794	S	S	*	*			cis	-155.1	-171.9	2	44.2	0	0	0	0	106.8
275	T	27.1	Very low	28	Very low	115 Å²	115	137.5 Å²	137.5	71%	0.706	79%	0.789	S	S	*	*			cis	-145.1	149.7	16.8	52.1	0	0	0	0	112.7
276	S	26	Very low	28.1	Very low	96 Å²	96	139 Å²	139	67%	0.671	78%	0.777	S	S	*	*			trans	25.8	135.8	145.1	69.5	0	0	0	0	121.7
277	Y	26	Very low	28.1	Very low	211 Å²	211	138.2 Å²	138.2	83%	0.827	77%	0.769	S	S	*	*			cis	-131.4	176.8	25.7	-109.4	-93.9	0	0	0	113.9
278	Y	25.5	Very low	27.9	Very low	216 Å²	216	137 Å²	137	85%	0.847	76%	0.762	S	S	*	*			trans	-41.6	146.2	175.2	-75.8	-119.2	0	0	0	113.7
279	G	24.2	Very low	28.1	Very low	70 Å²	70	133.7 Å²	133.7	72%	0.722	74%	0.739	S	S	*	*			cis	108	102.1	13.8	0	0	0	0	0	110.6
280	S	25.5	Very low	28.3	Very low	119 Å²	119	134 Å²	134	83%	0.832	74%	0.739	S	S	*	*				-164.4	138.8	86.9	-174.6	0	0	0	0	112.8
281	C	27.4	Very low	28.5	Very low	127 Å²	127	130.6 Å²	130.6	86%	0.858	73%	0.727	S	S	*	*			trans	-87.3	140.1	175.9	-65.5	0	0	0	0	112
282	K	25.4	Very low	29	Very low	192 Å²	192	132.2 Å²	132.2	84%	0.835	72%	0.722	S	S	*	*			trans	-119.4	127.2	159.1	-73.4	176.9	-178.5	168.7	0	108.7
283	M	29.4	Very low	29.1	Very low	174 Å²	174	126 Å²	126	86%	0.857	70%	0.697	S	S	*	*	P	Polyproline II helix	trans	-59.2	139.1	167	-93.8	148	56.8	0	0	109.7	R285	M283-R285 PolarHBondContact O-N 2.73Å
284	P	28	Very low	29.3	Very low	132 Å²	132	129.2 Å²	129.2	86%	0.857	70%	0.695	S	S	*	*	P	Polyproline II helix	trans	-62.9	127.1	176.3	26.4	-33.4	0	0	0	109.7
285	R	28.5	Very low	29.4	Very low	222 Å²	222	130.9 Å²	130.9	84%	0.838	69%	0.692	S	S	*	*	P	Polyproline II helix	trans	-86	151.5	169.1	-72.2	-174.2	169.5	111.6	-5.8	109.3	M283 P287	M283-R285 PolarHBondContact O-N 2.73Å; R285-P287 WeakPolarHBondContact O-CD 3.41Å
286	R	34.3	Very low	29.9	Very low	146 Å²	146	130.4 Å²	130.4	55%	0.551	68%	0.681	S	S	*	*	P	Polyproline II helix	trans	-55.7	130.1	175.3	-70.7	-179.6	167.9	-164.2	-7.7	110.8	I817 N820	R286-I817 PolarHBondContact NH1-O 2.83Å; R286-N820 PolarHBondContact NH1-OD1 3.4Å; R286-N820 PolarHBondContact NH2-OD1 3.09Å
287	P	28.6	Very low	30.5	Very low	107 Å²	107	131.1 Å²	131.1	70%	0.695	68%	0.676	S	S	*	*			trans	-90.7	110.8	159.1	32.6	-26.6	0	0	0	109.9	R285	R285-P287 WeakPolarHBondContact O-CD 3.41Å
288	S	26.1	Very low	30.9	Very low	85 Å²	85	126 Å²	126	59%	0.594	66%	0.661	S	S	*	*			trans	-69	-179.6	148.9	45.4	0	0	0	0	109.9
289	L	30.2	Very low	31.1	Very low	75 Å²	75	121 Å²	121	39%	0.393	65%	0.649	S	S	.	*	S	Bend	trans	-50.4	148.1	178.4	-75.1	162.2	0	0	0	112.7	C291 T812 A814	L289-C291 PolarHBondContact O-N 2.71Å; L289-C291 VanDerWaalsContact O-N 3.08Å; L289-T812 HydrophobicContact CD1-CG2 4.48Å; L289-A814 HydrophobicContact CB-CB 4.46Å; L289-A814 HydrophobicContact CD1-CB 3.99Å; L289-A814 HydrophobicContact CG-CB 4.07Å
290	P	34.1	Very low	31.8	Very low	108 Å²	108	125.8 Å²	125.8	70%	0.701	65%	0.645	S	S	*	*			trans	-71.4	104.7	-168.2	28.4	-35.3	0	0	0	112.4	I292	P290-I292 PolarHBondContact O-N 3.02Å
291	C	33.5	Very low	32.1	Very low	91 Å²	91	123.7 Å²	123.7	62%	0.615	63%	0.625	S	S	*	*			trans	-80.9	108.2	157.9	49.9	0	0	0	0	109.1	L289 S293 P958	L289-C291 PolarHBondContact O-N 2.71Å; L289-C291 VanDerWaalsContact O-N 3.08Å; C291-S293 PolarHBondContact O-N 3.36Å; C291-P958 HydrophobicContact CB-CG 4.41Å
292	I	36.7	Very low	32.3	Very low	93 Å²	93	126.5 Å²	126.5	48%	0.477	62%	0.617	S	S	.	*			trans	-59.5	119	171.4	-61.3	172.7	0	0	0	107.8	P290 M297	P290-I292 PolarHBondContact O-N 3.02Å; I292-M297 HydrophobicContact CG2-CB 4.16Å
293	S	32.5	Very low	32.7	Very low	41 Å²	41	121.2 Å²	121.2	29%	0.287	60%	0.598	S	S	.	*			trans	-77.8	153.3	176.1	100.3	0	0	0	0	110.5	C291 E295 Q296 M297	C291-S293 PolarHBondContact O-N 3.36Å; S293-E295 WeakPolarHBondContact CB-OE2 3.48Å; S293-E295 PolarHBondContact O-N 2.71Å; S293-E295 PolarHBondContact OG-N 2.8Å; S293-E295 PolarHBondContact OG-OE2 2.86Å; S293-Q296 PolarHBondContact O-N 3.24Å; S293-Q296 VanDerWaalsContact O-N 3.15Å; S293-Q296 PolarHBondContact OG-N 2.66Å; S293-M297 PolarHBondContact O-N 3.02Å
294	R	35.5	Very low	32.9	Very low	191 Å²	191	118 Å²	118	72%	0.721	58%	0.584	S	S	*	*	H	α-helix	trans	-62.3	-32.3	-179.8	-174.2	179	177.2	-168.7	-1.6	111.7	M297 I298	R294-M297 WeakPolarHBondContact O-CB 3.41Å; R294-M297 PolarHBondContact O-N 3.1Å; R294-I298 HydrophobicContact CG-CD1 4.3Å; R294-I298 WeakPolarHBondContact O-CD1 3.14Å; R294-I298 VanDerWaalsContact O-CG1 3.3Å; R294-I298 WeakPolarHBondContact O-CG1 3.11Å; R294-I298 PolarHBondContact O-N 2.75Å
295	E	33.4	Very low	33.2	Very low	137 Å²	137	118 Å²	118	64%	0.64	57%	0.571	S	S	*	*	H	α-helix	trans	-71.1	-38.6	176.9	-49.6	75.4	-164.4	0	0	111.4	S293 I298 L299	S293-E295 WeakPolarHBondContact CB-OE2 3.48Å; S293-E295 PolarHBondContact O-N 2.71Å; S293-E295 PolarHBondContact OG-N 2.8Å; S293-E295 PolarHBondContact OG-OE2 2.86Å; E295-I298 PolarHBondContact O-N 2.78Å; E295-L299 PolarHBondContact O-N 3.14Å; E295-L299 VanDerWaalsContact O-N 3.1Å
296	Q	37.2	Very low	33.4	Very low	105 Å²	105	114.4 Å²	114.4	49%	0.491	56%	0.563	S	S	.	*	H	α-helix	trans	-67	-40.7	171	-69.9	-178.1	-47.4	0	0	111.3	S293 I298 L299 W300	S293-Q296 PolarHBondContact O-N 3.24Å; S293-Q296 VanDerWaalsContact O-N 3.15Å; S293-Q296 PolarHBondContact OG-N 2.66Å; Q296-I298 VanDerWaalsContact C-N 3.29Å; Q296-I298 PolarHBondContact O-N 3.01Å; Q296-L299 PolarHBondContact O-N 3.18Å; Q296-W300 VanDerWaalsContact O-CD1 3.25Å; Q296-W300 PolarHBondContact O-N 3.48Å
297	M	37.5	Very low	33.3	Very low	112 Å²	112	117.8 Å²	117.8	55%	0.552	58%	0.576	S	S	*	*	H	α-helix	trans	-59.1	-39.3	176	-162.5	-177.4	82.2	0	0	111.9	I292 S293 R294 D301	I292-M297 HydrophobicContact CG2-CB 4.16Å; S293-M297 PolarHBondContact O-N 3.02Å; R294-M297 WeakPolarHBondContact O-CB 3.41Å; R294-M297 PolarHBondContact O-N 3.1Å; M297-D301 VanDerWaalsContact O-CB 3.24Å; M297-D301 WeakPolarHBondContact O-CB 2.94Å; M297-D301 PolarHBondContact O-N 3.4Å
298	I	35.5	Very low	33.2	Very low	103 Å²	103	122.1 Å²	122.1	53%	0.528	58%	0.58	S	S	.	*	H	α-helix	trans	-69.1	-42.3	175.8	-69.4	162.1	0	0	0	111.6	R294 E295 Q296 W300 D301 W302	R294-I298 HydrophobicContact CG-CD1 4.3Å; R294-I298 WeakPolarHBondContact O-CD1 3.14Å; R294-I298 VanDerWaalsContact O-CG1 3.3Å; R294-I298 WeakPolarHBondContact O-CG1 3.11Å; R294-I298 PolarHBondContact O-N 2.75Å; E295-I298 PolarHBondContact O-N 2.78Å; Q296-I298 VanDerWaalsContact C-N 3.29Å; Q296-I298 PolarHBondContact O-N 3.01Å; I298-W300 VanDerWaalsContact C-N 3.33Å; I298-W300 PolarHBondContact O-N 2.62Å; I298-D301 PolarHBondContact O-N 3.37Å; I298-W302 PolarHBondContact O-N 3.32Å; I298-W302 VanDerWaalsContact O-N 3.15Å
299	L	30.2	Very low	33.2	Very low	110 Å²	110	126.6 Å²	126.6	58%	0.576	59%	0.588	S	S	*	*	H	α-helix	trans	-64.1	-39.3	177.9	-165.5	70.9	0	0	0	111.8	E295 Q296 W302 D303	E295-L299 PolarHBondContact O-N 3.14Å; E295-L299 VanDerWaalsContact O-N 3.1Å; Q296-L299 PolarHBondContact O-N 3.18Å; L299-W302 WeakPolarHBondContact O-CB 3.14Å; L299-W302 PolarHBondContact O-N 2.91Å; L299-D303 PolarHBondContact O-N 2.8Å
300	W	37.5	Very low	33.3	Very low	171 Å²	171	128.9 Å²	128.9	65%	0.648	61%	0.608	S	S	*	*	H	α-helix	trans	-78.8	-27.9	177.4	-78.7	76	0	0	0	113.7	Q296 I298 W302 D303 L304	Q296-W300 VanDerWaalsContact O-CD1 3.25Å; Q296-W300 PolarHBondContact O-N 3.48Å; I298-W300 VanDerWaalsContact C-N 3.33Å; I298-W300 PolarHBondContact O-N 2.62Å; W300-W302 PolarHBondContact O-N 2.6Å; W300-D303 PolarHBondContact O-N 3.45Å; W300-L304 VanDerWaalsContact O-CB 3.26Å; W300-L304 WeakPolarHBondContact O-CB 3.26Å; W300-L304 PolarHBondContact O-N 3.22Å
301	D	32.7	Very low	33.1	Very low	76 Å²	76	131.8 Å²	131.8	41%	0.406	61%	0.612	S	S	.	*	H	α-helix	trans	-67.2	-28	170.2	-178.8	59.9	0	0	0	111.6	M297 I298 K305	M297-D301 VanDerWaalsContact O-CB 3.24Å; M297-D301 WeakPolarHBondContact O-CB 2.94Å; M297-D301 PolarHBondContact O-N 3.4Å; I298-D301 PolarHBondContact O-N 3.37Å; D301-K305 WeakPolarHBondContact O-CB 3.28Å; D301-K305 WeakPolarHBondContact O-CD 3.37Å; D301-K305 VanDerWaalsContact O-CG 3.3Å; D301-K305 WeakPolarHBondContact O-CG 3.27Å; D301-K305 PolarHBondContact O-N 2.94Å; D301-K305 WeakPolarHBondContact OD1-CE 3.19Å; D301-K305 IonicContact OD1-NZ 3.16Å; D301-K305 PolarHBondContact OD1-NZ 2.79Å; D301-K305 WeakPolarHBondContact OD2-CE 3.22Å; D301-K305 IonicContact OD2-NZ 2.65Å; D301-K305 PolarHBondContact OD2-NZ 3.05Å
302	W	30.5	Very low	33	Very low	185 Å²	185	138.1 Å²	138.1	70%	0.701	62%	0.624	S	S	*	*	H	α-helix	trans	-66.7	-52.2	170.2	-149	53.4	0	0	0	111.3	I298 L299 W300 H306	I298-W302 PolarHBondContact O-N 3.32Å; I298-W302 VanDerWaalsContact O-N 3.15Å; L299-W302 WeakPolarHBondContact O-CB 3.14Å; L299-W302 PolarHBondContact O-N 2.91Å; W300-W302 PolarHBondContact O-N 2.6Å; W302-H306 PolarHBondContact O-CD2 3.45Å; W302-H306 VanDerWaalsContact O-CD2 3.26Å
303	D	33.8	Very low	32.5	Very low	81 Å²	81	143.6 Å²	143.6	43%	0.433	65%	0.648	S	S	.	*	H	α-helix	trans	-60.5	-46.3	174.9	-83.1	-34	0	0	0	112.1	L299 W300 K305 H306 W307	L299-D303 PolarHBondContact O-N 2.8Å; W300-D303 PolarHBondContact O-N 3.45Å; D303-K305 VanDerWaalsContact C-N 3.29Å; D303-K305 PolarHBondContact O-N 2.75Å; D303-H306 WeakPolarHBondContact O-CB 3.45Å; D303-H306 PolarHBondContact O-N 2.93Å; D303-W307 PolarHBondContact O-N 3.3Å
304	L	35.2	Very low	32.3	Very low	108 Å²	108	145 Å²	145	57%	0.565	67%	0.668	S	S	*	*	H	α-helix	trans	-65.7	-30.9	-174.1	-152.2	75.9	0	0	0	112.6	W300 H306 W307 Y308	W300-L304 VanDerWaalsContact O-CB 3.26Å; W300-L304 WeakPolarHBondContact O-CB 3.26Å; W300-L304 PolarHBondContact O-N 3.22Å; L304-H306 PolarHBondContact O-N 2.64Å; L304-W307 PolarHBondContact O-N 3.41Å; L304-W307 VanDerWaalsContact O-N 3.1Å; L304-Y308 PolarHBondContact O-N 2.82Å
305	K	33.8	Very low	32.5	Very low	132 Å²	132	140.4 Å²	140.4	57%	0.574	67%	0.672	S	S	*	*	H	α-helix	trans	-65.6	-23.6	172.1	-80.5	168.4	179.9	158.1	0	113.5	D301 D303	D301-K305 WeakPolarHBondContact O-CB 3.28Å; D301-K305 WeakPolarHBondContact O-CD 3.37Å; D301-K305 VanDerWaalsContact O-CG 3.3Å; D301-K305 WeakPolarHBondContact O-CG 3.27Å; D301-K305 PolarHBondContact O-N 2.94Å; D301-K305 WeakPolarHBondContact OD1-CE 3.19Å; D301-K305 IonicContact OD1-NZ 3.16Å; D301-K305 PolarHBondContact OD1-NZ 2.79Å; D301-K305 WeakPolarHBondContact OD2-CE 3.22Å; D301-K305 IonicContact OD2-NZ 2.65Å; D301-K305 PolarHBondContact OD2-NZ 3.05Å; D303-K305 VanDerWaalsContact C-N 3.29Å; D303-K305 PolarHBondContact O-N 2.75Å
306	H	31.8	Very low	32.3	Very low	145 Å²	145	141 Å²	141	67%	0.671	68%	0.684	S	S	*	*	H	α-helix	trans	-78.9	-23	170.9	-72.3	-69.9	0	0	0	113.4	W302 D303 L304	W302-H306 PolarHBondContact O-CD2 3.45Å; W302-H306 VanDerWaalsContact O-CD2 3.26Å; D303-H306 WeakPolarHBondContact O-CB 3.45Å; D303-H306 PolarHBondContact O-N 2.93Å; L304-H306 PolarHBondContact O-N 2.64Å
307	W	32.8	Very low	32.2	Very low	218 Å²	218	141.6 Å²	141.6	83%	0.826	70%	0.7	S	S	*	*	H	α-helix	trans	-85.4	-17.5	179.3	-77.7	88	0	0	0	114.8	D303 L304 K309	D303-W307 PolarHBondContact O-N 3.3Å; L304-W307 PolarHBondContact O-N 3.41Å; L304-W307 VanDerWaalsContact O-N 3.1Å; W307-K309 PolarHBondContact O-N 2.75Å
308	Y	27.1	Very low	31.8	Very low	198 Å²	198	139.4 Å²	139.4	78%	0.776	71%	0.706	S	S	*	*			trans	-93.4	19.6	-168.7	-135.2	-89.3	0	0	0	116	L304 P310	L304-Y308 PolarHBondContact O-N 2.82Å; Y308-P310 WeakPolarHBondContact O-CD 3.34Å
309	K	25.9	Very low	31.8	Very low	178 Å²	178	142.9 Å²	142.9	77%	0.774	73%	0.726	S	S	*	*			trans	-109	103.7	175.9	-78.2	-169	174.1	-175.2	0	112.1	W307 Q311	W307-K309 PolarHBondContact O-N 2.75Å; K309-Q311 VanDerWaalsContact C-N 3.29Å; K309-Q311 PolarHBondContact O-N 3.36Å
310	P	31.3	Very low	32.3	Very low	123 Å²	123	141 Å²	141	80%	0.799	73%	0.733	S	S	*	*			trans	-84.5	58.4	-174.5	35.5	-37.4	0	0	0	113.5	Y308	Y308-P310 WeakPolarHBondContact O-CD 3.34Å
311	Q	29.9	Very low	33	Very low	169 Å²	169	138.6 Å²	138.6	79%	0.79	74%	0.737	S	S	*	*	S	Bend	trans	-166.5	138.5	163.4	-108.3	150.4	57.5	0	0	112.1	K309	K309-Q311 VanDerWaalsContact C-N 3.29Å; K309-Q311 PolarHBondContact O-N 3.36Å
312	Y	32.3	Very low	34	Very low	224 Å²	224	139.4 Å²	139.4	88%	0.878	74%	0.741	S	S	*	*			trans	47.7	85.2	169.7	-81.5	-86.2	0	0	0	118.4
313	Q	27	Very low	35.5	Very low	209 Å²	209	136.1 Å²	136.1	98%	0.977	74%	0.737	S	S	*	*				-162.6	162.9	124.4	-109.6	159.8	4.5	0	0	111.4
314	G	27.8	Very low	37.2	Very low	69 Å²	69	135.6 Å²	135.6	71%	0.711	74%	0.739	S	S	*	*			trans	-144.3	153.1	-177.5	0	0	0	0	0	113.2
315	A	38.5	Very low	39	Very low	96 Å²	96	134.2 Å²	134.2	79%	0.793	74%	0.735	S	S	*	*			trans	71.6	151.8	-179.8	0	0	0	0	0	117.1
316	V	30.7	Very low	41	Very low	149 Å²	149	129.9 Å²	129.9	90%	0.903	72%	0.718	S	S	*	*			trans	70.9	126.4	177.6	-170.4	0	0	0	0	113
317	S	33.8	Very low	43	Very low	118 Å²	118	127.2 Å²	127.2	83%	0.825	71%	0.709	S	S	*	*			cis	-153.9	157.7	-3.3	-166.1	0	0	0	0	108.3
318	G	29.5	Very low	45.4	Very low	65 Å²	65	122.6 Å²	122.6	67%	0.67	70%	0.696	S	S	*	*			cis	156.4	141.1	-9.2	0	0	0	0	0	112.6
319	N	36.3	Very low	47.9	Very low	177 Å²	177	115 Å²	115	95%	0.947	67%	0.674	S	S	*	*	S	Bend	trans	-147.5	24	159	-143.8	2.3	0	0	0	111.9
320	G	39.7	Very low	50.5	Low	70 Å²	70	110.4 Å²	110.4	72%	0.722	65%	0.652	S	S	*	*	S	Bend	trans	-99.7	139.9	170.3	0	0	0	0	0	109.9	D322	G320-D322 PolarHBondContact O-N 2.91Å
321	V	52.8	Low	52.8	Low	121 Å²	121	109.1 Å²	109.1	73%	0.733	64%	0.638	S	S	*	*	P	Polyproline II helix	trans	-69.2	122.7	173.3	-173.4	0	0	0	0	108.4	L323 I326	V321-L323 PolarHBondContact O-N 3.16Å; V321-I326 HydrophobicContact CB-CD1 4.13Å; V321-I326 HydrophobicContact CG1-CD1 3.74Å; V321-I326 HydrophobicContact CG1-CG1 3.92Å
322	D	54.1	Low	55.5	Low	92 Å²	92	105.5 Å²	105.5	49%	0.492	62%	0.624	S	S	.	*	P	Polyproline II helix	trans	-58.5	120.4	-175.1	-171.7	-17.5	0	0	0	111.3	G320 S324 V325 I326	G320-D322 PolarHBondContact O-N 2.91Å; D322-S324 PolarHBondContact O-N 3.47Å; D322-S324 VanDerWaalsContact OD1-CB 3.3Å; D322-S324 WeakPolarHBondContact OD1-CB 3.32Å; D322-S324 PolarHBondContact OD1-N 3.08Å; D322-S324 PolarHBondContact OD1-OG 3.01Å; D322-S324 PolarHBondContact OD2-OG 2.88Å; D322-V325 HydrophobicContact CB-CB 4.32Å; D322-V325 HydrophobicContact CB-CG2 3.97Å; D322-V325 PolarHBondContact O-N 3.39Å; D322-I326 PolarHBondContact O-N 2.95Å; D322-I326 VanDerWaalsContact O-N 3.1Å
323	L	62.2	Low	58.1	Low	117 Å²	117	95.8 Å²	95.8	61%	0.613	59%	0.588	S	S	*	*	H	α-helix	trans	-67.6	-23.9	-177.5	-159	70.1	0	0	0	111.8	V321 I326 N327	V321-L323 PolarHBondContact O-N 3.16Å; L323-I326 HydrophobicContact CD1-CD1 4.49Å; L323-N327 VanDerWaalsContact O-CB 3.31Å; L323-N327 WeakPolarHBondContact O-CB 3.4Å; L323-N327 PolarHBondContact O-N 3.25Å; L323-N327 VanDerWaalsContact O-N 3.09Å
324	S	69.1	Low	60.8	Low	70 Å²	70	88.1 Å²	88.1	49%	0.49	56%	0.557	S	S	.	*	H	α-helix	trans	-66.2	-49.2	172.8	73.9	0	0	0	0	111	D322 I326 N327 E328	D322-S324 PolarHBondContact O-N 3.47Å; D322-S324 VanDerWaalsContact OD1-CB 3.3Å; D322-S324 WeakPolarHBondContact OD1-CB 3.32Å; D322-S324 PolarHBondContact OD1-N 3.08Å; D322-S324 PolarHBondContact OD1-OG 3.01Å; D322-S324 PolarHBondContact OD2-OG 2.88Å; S324-I326 PolarHBondContact O-N 3.39Å; S324-N327 CarbonylContact O-C 3.57Å; S324-N327 WeakPolarHBondContact O-CA 3.26Å; S324-N327 WeakPolarHBondContact O-CB 3.4Å; S324-N327 PolarHBondContact O-N 3.33Å; S324-E328 PolarHBondContact O-N 3.3Å
325	V	73.3	Confident	63.6	Low	78 Å²	78	91.4 Å²	91.4	47%	0.473	55%	0.554	S	S	.	*	H	α-helix	trans	-63.4	-39.8	178	179.8	0	0	0	0	111.5	D322 N327 E328 A329	D322-V325 HydrophobicContact CB-CB 4.32Å; D322-V325 HydrophobicContact CB-CG2 3.97Å; D322-V325 PolarHBondContact O-N 3.39Å; V325-N327 VanDerWaalsContact C-N 3.29Å; V325-N327 PolarHBondContact O-N 3.31Å; V325-E328 PolarHBondContact O-N 3.42Å; V325-A329 VanDerWaalsContact O-CB 3.3Å; V325-A329 WeakPolarHBondContact O-CB 3.4Å; V325-A329 PolarHBondContact O-N 3.1Å
326	I	75.6	Confident	65.8	Low	42 Å²	42	91.3 Å²	91.3	22%	0.215	54%	0.54	C	S	.	.	H	α-helix	trans	-60.7	-40.5	172.3	-66.1	173.2	0	0	0	110.8	V321 D322 L323 S324 R330 M357	V321-I326 HydrophobicContact CB-CD1 4.13Å; V321-I326 HydrophobicContact CG1-CD1 3.74Å; V321-I326 HydrophobicContact CG1-CG1 3.92Å; D322-I326 PolarHBondContact O-N 2.95Å; D322-I326 VanDerWaalsContact O-N 3.1Å; L323-I326 HydrophobicContact CD1-CD1 4.49Å; S324-I326 PolarHBondContact O-N 3.39Å; I326-R330 VanDerWaalsContact O-CB 3.28Å; I326-R330 WeakPolarHBondContact O-CB 3.48Å; I326-R330 PolarHBondContact O-N 3.19Å; I326-M357 HydrophobicContact CG2-CE 4.26Å; I326-M357 WeakPolarHBondContact O-CE 3.34Å
327	N	73.6	Confident	68.3	Low	89 Å²	89	85.8 Å²	85.8	48%	0.476	51%	0.505	S	S	.	.	H	α-helix	trans	-75.4	-36.1	-178	-162.4	59.7	0	0	0	112.6	L323 S324 V325 R330 N331	L323-N327 VanDerWaalsContact O-CB 3.31Å; L323-N327 WeakPolarHBondContact O-CB 3.4Å; L323-N327 PolarHBondContact O-N 3.25Å; L323-N327 VanDerWaalsContact O-N 3.09Å; S324-N327 CarbonylContact O-C 3.57Å; S324-N327 WeakPolarHBondContact O-CA 3.26Å; S324-N327 WeakPolarHBondContact O-CB 3.4Å; S324-N327 PolarHBondContact O-N 3.33Å; V325-N327 VanDerWaalsContact C-N 3.29Å; V325-N327 PolarHBondContact O-N 3.31Å; N327-R330 WeakPolarHBondContact O-CB 3.32Å; N327-R330 PolarHBondContact O-N 3.28Å; N327-N331 PolarHBondContact O-N 3.46Å; N327-N331 PolarHBondContact O-ND2 3.17Å
328	E	83.3	Confident	70.4	Confident	121 Å²	121	87.5 Å²	87.5	57%	0.565	50%	0.502	S	S	*	.	H	α-helix	trans	-64.1	-50.8	172.1	-176.7	177.3	-162.4	0	0	111.3	S324 V325 R330 N331 L332	S324-E328 PolarHBondContact O-N 3.3Å; V325-E328 PolarHBondContact O-N 3.42Å; E328-R330 PolarHBondContact O-N 2.9Å; E328-N331 WeakPolarHBondContact O-CA 3.3Å; E328-N331 WeakPolarHBondContact O-CB 3.46Å; E328-N331 PolarHBondContact O-N 2.81Å; E328-L332 HydrophobicContact CG-CD1 4.43Å; E328-L332 PolarHBondContact O-N 3.32Å
329	A	79.9	Confident	73	Confident	37 Å²	37	88 Å²	88	31%	0.306	49%	0.489	S	S	.	.	H	α-helix	trans	-58.5	-32.6	174.4	0	0	0	0	0	112	V325 V333 M357	V325-A329 VanDerWaalsContact O-CB 3.3Å; V325-A329 WeakPolarHBondContact O-CB 3.4Å; V325-A329 PolarHBondContact O-N 3.1Å; A329-V333 WeakPolarHBondContact O-CB 3.46Å; A329-V333 VanDerWaalsContact O-CG2 3.3Å; A329-V333 WeakPolarHBondContact O-CG2 3.24Å; A329-V333 PolarHBondContact O-N 3.42Å; A329-M357 HydrophobicContact CB-CE 3.7Å
330	R	78.8	Confident	74.4	Confident	82 Å²	82	85.6 Å²	85.6	31%	0.309	49%	0.486	S	S	.	.	H	α-helix	trans	-70.3	-35.6	174.8	-169.3	175.9	-168.3	160.5	5.1	112.6	I326 N327 E328 S334 M357	I326-R330 VanDerWaalsContact O-CB 3.28Å; I326-R330 WeakPolarHBondContact O-CB 3.48Å; I326-R330 PolarHBondContact O-N 3.19Å; N327-R330 WeakPolarHBondContact O-CB 3.32Å; N327-R330 PolarHBondContact O-N 3.28Å; E328-R330 PolarHBondContact O-N 2.9Å; R330-S334 WeakPolarHBondContact O-CB 3.24Å; R330-S334 PolarHBondContact O-N 3.03Å; R330-S334 PolarHBondContact O-OG 2.83Å; R330-M357 HydrophobicContact CB-CE 4.02Å
331	N	81.1	Confident	76.2	Confident	96 Å²	96	86.8 Å²	86.8	51%	0.513	48%	0.483	S	S	.	.	H	α-helix	trans	-66.1	-48.3	172.5	-69.7	-23.5	0	0	0	110.6	N327 E328 V333 S334 E335	N327-N331 PolarHBondContact O-N 3.46Å; N327-N331 PolarHBondContact O-ND2 3.17Å; E328-N331 WeakPolarHBondContact O-CA 3.3Å; E328-N331 WeakPolarHBondContact O-CB 3.46Å; E328-N331 PolarHBondContact O-N 2.81Å; N331-V333 PolarHBondContact O-N 3.39Å; N331-S334 CarbonylContact O-C 3.55Å; N331-S334 WeakPolarHBondContact O-CA 3.49Å; N331-S334 WeakPolarHBondContact O-CB 3.25Å; N331-S334 PolarHBondContact O-N 3.44Å; N331-E335 PolarHBondContact O-N 3.37Å
332	L	86.1	Confident	77.7	Confident	94 Å²	94	83.4 Å²	83.4	49%	0.492	46%	0.461	S	S	.	.	H	α-helix	trans	-58.9	-44.5	177.1	-67.7	170.5	0	0	0	112.6	E328 S334 E335 L336	E328-L332 HydrophobicContact CG-CD1 4.43Å; E328-L332 PolarHBondContact O-N 3.32Å; L332-S334 VanDerWaalsContact C-N 3.28Å; L332-S334 PolarHBondContact O-N 2.76Å; L332-E335 PolarHBondContact O-N 2.88Å; L332-L336 WeakPolarHBondContact O-CB 3.48Å; L332-L336 WeakPolarHBondContact O-CG 3.38Å; L332-L336 PolarHBondContact O-N 3.04Å
333	V	86.4	Confident	79.2	Confident	19 Å²	19	81.8 Å²	81.8	12%	0.115	46%	0.457	C	S	.	.	H	α-helix	trans	-64.8	-32.7	174.1	170	0	0	0	0	111.7	A329 N331 L337 L350	A329-V333 WeakPolarHBondContact O-CB 3.46Å; A329-V333 VanDerWaalsContact O-CG2 3.3Å; A329-V333 WeakPolarHBondContact O-CG2 3.24Å; A329-V333 PolarHBondContact O-N 3.42Å; N331-V333 PolarHBondContact O-N 3.39Å; V333-L337 HydrophobicContact CG1-CD1 4.12Å; V333-L337 WeakPolarHBondContact O-CB 3.35Å; V333-L337 WeakPolarHBondContact O-CD1 3.31Å; V333-L337 WeakPolarHBondContact O-CG 3.34Å; V333-L337 PolarHBondContact O-N 3.42Å; V333-L337 VanDerWaalsContact O-N 3.11Å; V333-L350 HydrophobicContact CG1-CD2 4.4Å
334	S	84.1	Confident	79.8	Confident	48 Å²	48	81.1 Å²	81.1	34%	0.336	46%	0.459	S	S	.	.	H	α-helix	trans	-73.4	-38.1	176.9	-58.2	0	0	0	0	112.4	R330 N331 L332 L337 M338	R330-S334 WeakPolarHBondContact O-CB 3.24Å; R330-S334 PolarHBondContact O-N 3.03Å; R330-S334 PolarHBondContact O-OG 2.83Å; N331-S334 CarbonylContact O-C 3.55Å; N331-S334 WeakPolarHBondContact O-CA 3.49Å; N331-S334 WeakPolarHBondContact O-CB 3.25Å; N331-S334 PolarHBondContact O-N 3.44Å; L332-S334 VanDerWaalsContact C-N 3.28Å; L332-S334 PolarHBondContact O-N 2.76Å; S334-L337 PolarHBondContact O-N 3.08Å; S334-M338 WeakPolarHBondContact O-CG 3.42Å; S334-M338 PolarHBondContact O-N 2.95Å
335	E	86.5	Confident	80.3	Confident	139 Å²	139	83.9 Å²	83.9	65%	0.65	47%	0.469	S	S	*	.	H	α-helix	trans	-66.8	-46.4	175.8	-174.5	168.8	-155	0	0	111.4	N331 L332 L337 M338	N331-E335 PolarHBondContact O-N 3.37Å; L332-E335 PolarHBondContact O-N 2.88Å; E335-L337 PolarHBondContact O-N 3.39Å; E335-M338 WeakPolarHBondContact O-CB 3.39Å; E335-M338 PolarHBondContact O-N 3.39Å
336	L	85	Confident	80.7	Confident	93 Å²	93	82.9 Å²	82.9	49%	0.487	46%	0.463	S	S	.	.	H	α-helix	trans	-58	-35.3	170.8	-71.3	169.9	0	0	0	112.1	L332 M338 D339 L342 L350	L332-L336 WeakPolarHBondContact O-CB 3.48Å; L332-L336 WeakPolarHBondContact O-CG 3.38Å; L332-L336 PolarHBondContact O-N 3.04Å; L336-M338 PolarHBondContact O-N 2.85Å; L336-D339 PolarHBondContact O-N 3.1Å; L336-L342 WeakPolarHBondContact O-CD1 3.4Å; L336-L350 HydrophobicContact CB-CD1 4.25Å
337	L	82.6	Confident	81	Confident	33 Å²	33	82 Å²	82	17%	0.173	46%	0.459	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-10.4	175.3	-78.2	172.4	0	0	0	114.5	V333 S334 E335 T347 L350 R351	V333-L337 HydrophobicContact CG1-CD1 4.12Å; V333-L337 WeakPolarHBondContact O-CB 3.35Å; V333-L337 WeakPolarHBondContact O-CD1 3.31Å; V333-L337 WeakPolarHBondContact O-CG 3.34Å; V333-L337 PolarHBondContact O-N 3.42Å; V333-L337 VanDerWaalsContact O-N 3.11Å; S334-L337 PolarHBondContact O-N 3.08Å; E335-L337 PolarHBondContact O-N 3.39Å; L337-T347 HydrophobicContact CD2-CG2 3.55Å; L337-L350 HydrophobicContact CD1-CB 4.32Å; L337-L350 HydrophobicContact CD2-CB 3.61Å; L337-L350 HydrophobicContact CD2-CD1 4.43Å; L337-L350 HydrophobicContact CG-CB 3.92Å; L337-R351 HydrophobicContact CD1-CG 3.91Å; L337-R351 HydrophobicContact CD2-CG 3.79Å
338	M	78.9	Confident	81.4	Confident	155 Å²	155	79.9 Å²	79.9	76%	0.764	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86	-13.6	169.7	-62.5	-62.9	95.3	0	0	112.9	S334 E335 L336 S340	S334-M338 WeakPolarHBondContact O-CG 3.42Å; S334-M338 PolarHBondContact O-N 2.95Å; E335-M338 WeakPolarHBondContact O-CB 3.39Å; E335-M338 PolarHBondContact O-N 3.39Å; L336-M338 PolarHBondContact O-N 2.85Å; M338-S340 PolarHBondContact O-N 3.39Å
339	D	82.8	Confident	81.5	Confident	75 Å²	75	77.9 Å²	77.9	40%	0.401	45%	0.451	S	S	.	.			trans	-72.8	110	175.3	-173.8	-5.8	0	0	0	111.2	L336 S341 L342	L336-D339 PolarHBondContact O-N 3.1Å; D339-S341 PolarHBondContact O-N 3.25Å; D339-S341 VanDerWaalsContact OD1-CB 3.26Å; D339-S341 WeakPolarHBondContact OD1-CB 3.45Å; D339-S341 PolarHBondContact OD1-N 3.22Å; D339-S341 PolarHBondContact OD1-OG 3.49Å; D339-S341 PolarHBondContact OD2-OG 2.63Å; D339-L342 HydrophobicContact CB-CD1 4.48Å; D339-L342 HydrophobicContact CB-CG 4.21Å
340	S	66.1	Low	81.8	Confident	127 Å²	127	77.3 Å²	77.3	89%	0.888	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.8	-5.3	179.3	59.2	0	0	0	0	114.8	M338	M338-S340 PolarHBondContact O-N 3.39Å
341	S	78.8	Confident	82	Confident	94 Å²	94	80.1 Å²	80.1	66%	0.657	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	-12.3	178	76.6	0	0	0	0	114.5	D339	D339-S341 PolarHBondContact O-N 3.25Å; D339-S341 VanDerWaalsContact OD1-CB 3.26Å; D339-S341 WeakPolarHBondContact OD1-CB 3.45Å; D339-S341 PolarHBondContact OD1-N 3.22Å; D339-S341 PolarHBondContact OD1-OG 3.49Å; D339-S341 PolarHBondContact OD2-OG 2.63Å
342	L	84.5	Confident	81.9	Confident	51 Å²	51	79.4 Å²	79.4	27%	0.267	46%	0.455	S	S	.	.	S	Bend	trans	-69.1	146.1	-174.3	-66.9	-176.2	0	0	0	114.1	L336 D339 L350	L336-L342 WeakPolarHBondContact O-CD1 3.4Å; D339-L342 HydrophobicContact CB-CD1 4.48Å; D339-L342 HydrophobicContact CB-CG 4.21Å; L342-L350 HydrophobicContact CD1-CD1 3.83Å
343	S	84.6	Confident	81.7	Confident	57 Å²	57	78.8 Å²	78.8	40%	0.399	45%	0.452	S	S	.	.			trans	-66.5	145.7	177.4	97.2	0	0	0	0	111.8	N345 T346 T347	S343-N345 PolarHBondContact O-N 2.92Å; S343-N345 VanDerWaalsContact O-N 3.09Å; S343-T346 WeakPolarHBondContact O-CA 3.47Å; S343-T346 WeakPolarHBondContact O-CB 3.14Å; S343-T346 PolarHBondContact O-N 3.27Å; S343-T346 PolarHBondContact OG-N 2.88Å; S343-T346 PolarHBondContact OG-OG1 2.9Å; S343-T347 PolarHBondContact O-N 2.89Å; S343-T347 PolarHBondContact O-OG1 3.42Å
344	P	75.2	Confident	81.4	Confident	103 Å²	103	79 Å²	79	67%	0.669	45%	0.454	S	S	*	.	H	α-helix	trans	-55.9	-33.3	-176.4	-27.8	35.1	0	0	0	114.5	A348	P344-A348 WeakPolarHBondContact O-CB 3.34Å; P344-A348 PolarHBondContact O-N 2.83Å
345	N	79.2	Confident	81.1	Confident	129 Å²	129	80.8 Å²	80.8	69%	0.69	47%	0.466	S	S	*	.	H	α-helix	trans	-70.8	-40.6	176.7	-69.2	-8.6	0	0	0	111.3	S343 A348 T349	S343-N345 PolarHBondContact O-N 2.92Å; S343-N345 VanDerWaalsContact O-N 3.09Å; N345-A348 PolarHBondContact O-N 3.38Å; N345-T349 PolarHBondContact O-N 3.05Å; N345-T349 PolarHBondContact O-OG1 2.99Å
346	T	82.4	Confident	80.5	Confident	57 Å²	57	79.5 Å²	79.5	35%	0.35	46%	0.463	S	S	.	.	H	α-helix	trans	-64.5	-43.2	175.3	-40.5	0	0	0	0	111.2	S343 A348 T349 L350	S343-T346 WeakPolarHBondContact O-CA 3.47Å; S343-T346 WeakPolarHBondContact O-CB 3.14Å; S343-T346 PolarHBondContact O-N 3.27Å; S343-T346 PolarHBondContact OG-N 2.88Å; S343-T346 PolarHBondContact OG-OG1 2.9Å; T346-A348 VanDerWaalsContact C-N 3.27Å; T346-A348 PolarHBondContact O-N 3.13Å; T346-T349 PolarHBondContact O-N 2.83Å; T346-T349 PolarHBondContact O-OG1 3.41Å; T346-L350 HydrophobicContact CG2-CD1 4.22Å; T346-L350 WeakPolarHBondContact O-CB 3.12Å; T346-L350 WeakPolarHBondContact O-CG 3.38Å; T346-L350 PolarHBondContact O-N 3.04Å
347	T	81.6	Confident	79.8	Confident	23 Å²	23	76.7 Å²	76.7	14%	0.141	45%	0.448	C	S	.	.	H	α-helix	trans	-66.5	-30.9	176	-24.3	0	0	0	0	111.8	L337 S343 R351	L337-T347 HydrophobicContact CD2-CG2 3.55Å; S343-T347 PolarHBondContact O-N 2.89Å; S343-T347 PolarHBondContact O-OG1 3.42Å; T347-R351 VanDerWaalsContact CG2-NH2 3.29Å; T347-R351 WeakPolarHBondContact O-CB 3.37Å; T347-R351 WeakPolarHBondContact O-CG 3.36Å; T347-R351 PolarHBondContact O-N 3.03Å; T347-R351 VanDerWaalsContact O-N 3.1Å
348	A	82.5	Confident	78.8	Confident	45 Å²	45	76.3 Å²	76.3	37%	0.372	45%	0.452	S	S	.	.	H	α-helix	trans	-71.2	-43.8	175.3	0	0	0	0	0	112.5	P344 N345 T346 R351 S352	P344-A348 WeakPolarHBondContact O-CB 3.34Å; P344-A348 PolarHBondContact O-N 2.83Å; N345-A348 PolarHBondContact O-N 3.38Å; T346-A348 VanDerWaalsContact C-N 3.27Å; T346-A348 PolarHBondContact O-N 3.13Å; A348-R351 PolarHBondContact O-N 3.03Å; A348-S352 PolarHBondContact O-N 3.23Å
349	T	85.3	Confident	77.8	Confident	79 Å²	79	73.3 Å²	73.3	49%	0.485	44%	0.443	S	S	.	.	H	α-helix	trans	-66.7	-43.3	176.2	51.7	0	0	0	0	111.8	N345 T346 R351 S352 I353	N345-T349 PolarHBondContact O-N 3.05Å; N345-T349 PolarHBondContact O-OG1 2.99Å; T346-T349 PolarHBondContact O-N 2.83Å; T346-T349 PolarHBondContact O-OG1 3.41Å; T349-R351 PolarHBondContact O-N 2.87Å; T349-S352 WeakPolarHBondContact O-CB 3.41Å; T349-S352 PolarHBondContact O-N 3.17Å; T349-S352 VanDerWaalsContact O-N 3.09Å; T349-I353 WeakPolarHBondContact O-CG1 3.43Å; T349-I353 PolarHBondContact O-N 3.21Å
350	L	86.5	Confident	76.4	Confident	24 Å²	24	77 Å²	77	13%	0.126	46%	0.456	C	S	.	.	H	α-helix	trans	-61.3	-40.4	175.3	-72.9	170.6	0	0	0	112.6	V333 L336 L337 L342 T346 S352 I353 S354	V333-L350 HydrophobicContact CG1-CD2 4.4Å; L336-L350 HydrophobicContact CB-CD1 4.25Å; L337-L350 HydrophobicContact CD1-CB 4.32Å; L337-L350 HydrophobicContact CD2-CB 3.61Å; L337-L350 HydrophobicContact CD2-CD1 4.43Å; L337-L350 HydrophobicContact CG-CB 3.92Å; L342-L350 HydrophobicContact CD1-CD1 3.83Å; T346-L350 HydrophobicContact CG2-CD1 4.22Å; T346-L350 WeakPolarHBondContact O-CB 3.12Å; T346-L350 WeakPolarHBondContact O-CG 3.38Å; T346-L350 PolarHBondContact O-N 3.04Å; L350-S352 VanDerWaalsContact C-N 3.34Å; L350-S352 PolarHBondContact O-N 2.79Å; L350-I353 PolarHBondContact O-N 3.02Å; L350-S354 WeakPolarHBondContact O-CB 3.31Å; L350-S354 PolarHBondContact O-N 3.34Å
351	R	81.3	Confident	75.8	Confident	141 Å²	141	74.3 Å²	74.3	53%	0.532	44%	0.437	S	S	.	.	H	α-helix	trans	-64.3	-36.4	172	-79.3	-173.1	-114.7	105	-3.7	112.7	L337 T347 A348 T349 S355	L337-R351 HydrophobicContact CD1-CG 3.91Å; L337-R351 HydrophobicContact CD2-CG 3.79Å; T347-R351 VanDerWaalsContact CG2-NH2 3.29Å; T347-R351 WeakPolarHBondContact O-CB 3.37Å; T347-R351 WeakPolarHBondContact O-CG 3.36Å; T347-R351 PolarHBondContact O-N 3.03Å; T347-R351 VanDerWaalsContact O-N 3.1Å; A348-R351 PolarHBondContact O-N 3.03Å; T349-R351 PolarHBondContact O-N 2.87Å; R351-S355 WeakPolarHBondContact O-CB 3.3Å; R351-S355 PolarHBondContact O-N 2.63Å
352	S	80.6	Confident	74.1	Confident	82 Å²	82	72.8 Å²	72.8	57%	0.573	44%	0.436	S	S	*	.	H	α-helix	trans	-65.6	-44.2	175.3	-164.4	0	0	0	0	111.8	A348 T349 L350 S355 L356	A348-S352 PolarHBondContact O-N 3.23Å; T349-S352 WeakPolarHBondContact O-CB 3.41Å; T349-S352 PolarHBondContact O-N 3.17Å; T349-S352 VanDerWaalsContact O-N 3.09Å; L350-S352 VanDerWaalsContact C-N 3.34Å; L350-S352 PolarHBondContact O-N 2.79Å; S352-S355 WeakPolarHBondContact O-CB 3.35Å; S352-S355 PolarHBondContact O-N 3.18Å; S352-L356 PolarHBondContact O-N 3.11Å
353	I	80.4	Confident	72	Confident	81 Å²	81	75.4 Å²	75.4	42%	0.415	46%	0.459	S	S	.	.	H	α-helix	trans	-61	-48.6	175.1	-67.6	162.8	0	0	0	110.6	T349 L350 S355 L356 M357	T349-I353 WeakPolarHBondContact O-CG1 3.43Å; T349-I353 PolarHBondContact O-N 3.21Å; L350-I353 PolarHBondContact O-N 3.02Å; I353-S355 VanDerWaalsContact C-N 3.28Å; I353-S355 PolarHBondContact O-N 2.7Å; I353-L356 WeakPolarHBondContact O-CB 3.34Å; I353-L356 PolarHBondContact O-N 3.38Å; I353-M357 HydrophobicContact CG2-CG 4.48Å; I353-M357 HydrophobicContact CG2-SD 4.01Å; I353-M357 WeakPolarHBondContact O-CG 3.48Å; I353-M357 PolarHBondContact O-N 3.5Å
354	S	81.3	Confident	69.9	Low	24 Å²	24	78.3 Å²	78.3	17%	0.168	48%	0.478	C	S	.	.	H	α-helix	trans	-57.8	-39.3	175.8	-171.8	0	0	0	0	112.5	L350 G358	L350-S354 WeakPolarHBondContact O-CB 3.31Å; L350-S354 PolarHBondContact O-N 3.34Å; S354-G358 PolarHBondContact O-N 3.26Å; S354-G358 VanDerWaalsContact O-N 3.12Å
355	S	77.6	Confident	67.9	Low	84 Å²	84	84.2 Å²	84.2	59%	0.587	49%	0.486	S	S	*	.	H	α-helix	trans	-67.5	-37	174.3	-169.1	0	0	0	0	113	R351 S352 I353 G358	R351-S355 WeakPolarHBondContact O-CB 3.3Å; R351-S355 PolarHBondContact O-N 2.63Å; S352-S355 WeakPolarHBondContact O-CB 3.35Å; S352-S355 PolarHBondContact O-N 3.18Å; I353-S355 VanDerWaalsContact C-N 3.28Å; I353-S355 PolarHBondContact O-N 2.7Å; S355-G358 PolarHBondContact O-N 2.86Å
356	L	73.9	Confident	65.5	Low	112 Å²	112	84 Å²	84	59%	0.586	49%	0.492	S	S	*	.	H	α-helix	trans	-69	-45.5	178.2	-163.6	79.5	0	0	0	111.2	S352 I353 G358 T359 F360	S352-L356 PolarHBondContact O-N 3.11Å; I353-L356 WeakPolarHBondContact O-CB 3.34Å; I353-L356 PolarHBondContact O-N 3.38Å; L356-G358 PolarHBondContact O-N 3.31Å; L356-T359 PolarHBondContact O-N 3.48Å; L356-T359 PolarHBondContact O-OG1 2.82Å; L356-F360 HydrophobicContact CG-CE2 4.39Å; L356-F360 WeakPolarHBondContact O-CD2 3.5Å
357	M	69.2	Low	62.9	Low	34 Å²	34	92.1 Å²	92.1	17%	0.167	52%	0.516	C	S	.	.	H	α-helix	trans	-59	-32.4	173.1	-64.9	173.3	74.8	0	0	111.7	I326 A329 R330 I353 T359	I326-M357 HydrophobicContact CG2-CE 4.26Å; I326-M357 WeakPolarHBondContact O-CE 3.34Å; A329-M357 HydrophobicContact CB-CE 3.7Å; R330-M357 HydrophobicContact CB-CE 4.02Å; I353-M357 HydrophobicContact CG2-CG 4.48Å; I353-M357 HydrophobicContact CG2-SD 4.01Å; I353-M357 WeakPolarHBondContact O-CG 3.48Å; I353-M357 PolarHBondContact O-N 3.5Å; M357-T359 VanDerWaalsContact C-N 3.29Å; M357-T359 PolarHBondContact O-N 2.96Å
358	G	61.4	Low	60.8	Low	25 Å²	25	97.3 Å²	97.3	26%	0.258	55%	0.548	S	S	.	.	H	α-helix	trans	-60.8	-29.3	173.3	0	0	0	0	0	115	S354 S355 L356	S354-G358 PolarHBondContact O-N 3.26Å; S354-G358 VanDerWaalsContact O-N 3.12Å; S355-G358 PolarHBondContact O-N 2.86Å; L356-G358 PolarHBondContact O-N 3.31Å
359	T	58.8	Low	58.1	Low	93 Å²	93	101.2 Å²	101.2	57%	0.571	56%	0.562	S	S	*	*	H	α-helix	trans	-77.3	-31.7	-176.4	58.7	0	0	0	0	113.5	L356 M357 G362	L356-T359 PolarHBondContact O-N 3.48Å; L356-T359 PolarHBondContact O-OG1 2.82Å; M357-T359 VanDerWaalsContact C-N 3.29Å; M357-T359 PolarHBondContact O-N 2.96Å; T359-G362 PolarHBondContact O-N 3.46Å
360	F	53.2	Low	55.8	Low	152 Å²	152	102.1 Å²	102.1	67%	0.667	57%	0.57	S	S	*	*	H	α-helix	trans	-70.1	-32.2	179.7	-68.3	-82	0	0	0	112.8	L356 G362	L356-F360 HydrophobicContact CG-CE2 4.39Å; L356-F360 WeakPolarHBondContact O-CD2 3.5Å; F360-G362 PolarHBondContact O-N 2.81Å
361	S	53.3	Low	52.9	Low	71 Å²	71	110.5 Å²	110.5	50%	0.497	61%	0.605	S	S	.	*	T	Hydrogen-bonded Turn	trans	-71.5	-12.1	178.5	-179.3	0	0	0	0	114
362	G	43.9	Very low	50.6	Low	61 Å²	61	109.1 Å²	109.1	63%	0.629	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.9	-10.2	-173.6	0	0	0	0	0	116.4	T359 F360	T359-G362 PolarHBondContact O-N 3.46Å; F360-G362 PolarHBondContact O-N 2.81Å
363	S	40.2	Very low	48.2	Very low	107 Å²	107	110.9 Å²	110.9	75%	0.748	62%	0.622	S	S	*	*	S	Bend	trans	-82.2	-17.7	-169.7	-158.5	0	0	0	0	114.8
364	C	40.3	Very low	45.9	Very low	118 Å²	118	115.7 Å²	115.7	80%	0.797	64%	0.641	S	S	*	*			trans	-109.9	83.2	-173.3	-58.8	0	0	0	0	111.4
365	R	33.5	Very low	43.7	Very low	227 Å²	227	120 Å²	120	86%	0.857	67%	0.668	S	S	*	*			trans	-139.3	126	161	-75	-167.1	174.4	-154	-3	109.8	R367	R365-R367 PolarHBondContact O-N 3.27Å
366	P	28.1	Very low	41.3	Very low	124 Å²	124	118.8 Å²	118.8	81%	0.805	67%	0.669	S	S	*	*			trans	-65.7	124.2	178.2	26.7	-33.6	0	0	0	110.1	V368	P366-V368 PolarHBondContact O-N 3.15Å
367	R	27.5	Very low	38.9	Very low	227 Å²	227	123.9 Å²	123.9	86%	0.857	69%	0.687	S	S	*	*			trans	-90.5	79	-180	-171.2	-178.6	178.2	171.9	-1.7	110.4	R365 N369	R365-R367 PolarHBondContact O-N 3.27Å; R367-N369 PolarHBondContact O-N 2.91Å
368	V	37.4	Very low	36.8	Very low	133 Å²	133	132.1 Å²	132.1	81%	0.806	72%	0.717	S	S	*	*			trans	-57.8	126.6	169.1	-176.2	0	0	0	0	109.2	P366	P366-V368 PolarHBondContact O-N 3.15Å
369	N	26.9	Very low	35	Very low	126 Å²	126	136.1 Å²	136.1	67%	0.674	74%	0.741	S	S	*	*			trans	-145.9	141.3	169.8	-154.5	70.2	0	0	0	109.1	R367 F371	R367-N369 PolarHBondContact O-N 2.91Å; N369-F371 PolarHBondContact O-N 3.49Å
370	P	36.5	Very low	33.4	Very low	99 Å²	99	138.1 Å²	138.1	64%	0.643	75%	0.753	S	S	*	*			trans	-102.5	97.3	-152.1	36.1	-32.4	0	0	0	114.1
371	F	25.7	Very low	32	Very low	199 Å²	199	140.3 Å²	140.3	87%	0.873	77%	0.765	S	S	*	*			trans	-149.2	82.5	159.2	-86.9	-66.3	0	0	0	111.8	N369	N369-F371 PolarHBondContact O-N 3.49Å
372	T	32.2	Very low	30.8	Very low	112 Å²	112	141 Å²	141	69%	0.687	78%	0.775	S	S	*	*			trans	-122.4	101.6	160.5	37.4	0	0	0	0	109.1	F374	T372-F374 PolarHBondContact O-N 2.98Å
373	P	31	Very low	29.9	Very low	119 Å²	119	147.3 Å²	147.3	77%	0.773	79%	0.788	S	S	*	*			trans	-76.7	105.6	163.6	30.7	-28.7	0	0	0	108.2	P375	P373-P375 WeakPolarHBondContact O-CD 3.47Å
374	F	32.9	Very low	29.2	Very low	183 Å²	183	149.2 Å²	149.2	80%	0.803	79%	0.79	S	S	*	*			trans	-83.7	128.2	165.2	-77.7	-85.2	0	0	0	109.9	T372	T372-F374 PolarHBondContact O-N 2.98Å
375	P	33.3	Very low	28.4	Very low	114 Å²	114	148.1 Å²	148.1	74%	0.74	78%	0.784	S	S	*	*			trans	-127.5	120.4	150.8	34.6	-22.3	0	0	0	111.3	P373	P373-P375 WeakPolarHBondContact O-CD 3.47Å
376	G	27.1	Very low	28.1	Very low	59 Å²	59	142 Å²	142	61%	0.608	78%	0.781	S	S	*	*			cis	172.3	161.6	-11.3	0	0	0	0	0	113.9
377	F	25.4	Very low	28.1	Very low	219 Å²	219	142.8 Å²	142.8	96%	0.961	78%	0.775	S	S	*	*			trans	-84.7	107.3	143.9	-79.3	-91.5	0	0	0	107.1
378	Y	24.5	Very low	28.2	Very low	207 Å²	207	142.2 Å²	142.2	81%	0.812	77%	0.772	S	S	*	*			trans	-106.4	97.6	162.1	-91.9	-77.7	0	0	0	108.5
379	S	22.5	Very low	27.7	Very low	109 Å²	109	140 Å²	140	76%	0.762	76%	0.763	S	S	*	*			trans	-65.9	131.7	156.7	-69.6	0	0	0	0	108.1	E381	S379-E381 PolarHBondContact O-N 3.16Å
380	V	26	Very low	27.8	Very low	135 Å²	135	139.2 Å²	139.2	82%	0.818	76%	0.759	S	S	*	*			trans	-74.5	108.7	169	176.6	0	0	0	0	107.7	A382	V380-A382 PolarHBondContact O-N 2.9Å
381	E	23	Very low	27.6	Very low	197 Å²	197	143.4 Å²	143.4	92%	0.921	76%	0.762	S	S	*	*			trans	-74.5	105.5	160.2	-73.6	-168.8	150	0	0	108.3	S379	S379-E381 PolarHBondContact O-N 3.16Å
382	A	28.6	Very low	27.8	Very low	85 Å²	85	143 Å²	143	70%	0.702	76%	0.76	S	S	*	*			trans	-98.8	142.2	160.6	0	0	0	0	0	108.7	V380	V380-A382 PolarHBondContact O-N 2.9Å
383	E	25.4	Very low	27.5	Very low	194 Å²	194	140.7 Å²	140.7	91%	0.907	76%	0.757	S	S	*	*			trans	-59.8	144.5	165.1	-56.9	178.8	122.8	0	0	108.4
384	D	25.7	Very low	27.4	Very low	147 Å²	147	142.4 Å²	142.4	79%	0.786	76%	0.757	S	S	*	*				-175.2	160.9	62.2	-172.4	13.6	0	0	0	112.4
385	S	24.2	Very low	27.2	Very low	96 Å²	96	143.8 Å²	143.8	67%	0.671	76%	0.763	S	S	*	*			trans	68.7	128.7	150.9	74.8	0	0	0	0	123.4
386	A	27.2	Very low	26.9	Very low	97 Å²	97	141.7 Å²	141.7	80%	0.802	76%	0.762	S	S	*	*			trans	63.5	149.7	149.3	0	0	0	0	0	120.2
387	E	27.3	Very low	27	Very low	142 Å²	142	147.4 Å²	147.4	66%	0.664	78%	0.777	S	S	*	*			cis	-151.9	160	-9.9	-131.3	-162.2	131.4	0	0	112
388	R	29	Very low	27	Very low	214 Å²	214	141.7 Å²	141.7	81%	0.808	77%	0.765	S	S	*	*			trans	20.3	146.7	146.7	-78.6	-170.7	178	120	-5.8	122.3
389	S	27.6	Very low	27.2	Very low	86 Å²	86	136.4 Å²	136.4	60%	0.601	76%	0.758	S	S	*	*			cis	-172.4	163.5	-0.7	-171.4	0	0	0	0	112.8
390	D	29.8	Very low	27.5	Very low	111 Å²	111	141.2 Å²	141.2	59%	0.594	76%	0.76	S	S	*	*			trans	74.9	143.3	154.2	-74.3	-58.5	0	0	0	119.5
391	R	31.9	Very low	27.6	Very low	187 Å²	187	141.1 Å²	141.1	71%	0.706	75%	0.754	S	S	*	*			cis	-162.8	131.5	6	-139.1	156.4	-122.7	176	14.6	114.2
392	K	29.7	Very low	27.9	Very low	191 Å²	191	136.2 Å²	136.2	83%	0.83	74%	0.742	S	S	*	*			trans	54.6	145.3	154.8	-60.7	167.9	-176	178.7	0	119
393	G	25.3	Very low	27.9	Very low	62 Å²	62	139.9 Å²	139.9	64%	0.639	75%	0.749	S	S	*	*			cis	111.2	141.2	3.2	0	0	0	0	0	113.6
394	M	28.6	Very low	28.9	Very low	155 Å²	155	135.3 Å²	135.3	76%	0.764	74%	0.736	S	S	*	*			cis	-160.7	157.6	2.2	-53.6	77.1	46.9	0	0	112.2
395	K	28.3	Very low	29.4	Very low	212 Å²	212	134.6 Å²	134.6	92%	0.922	74%	0.737	S	S	*	*			trans	74.9	152.2	167.1	-53	168.1	-179.7	176.9	0	117.6
396	G	27.1	Very low	29.8	Very low	70 Å²	70	135.8 Å²	135.8	72%	0.722	74%	0.742	S	S	*	*			cis	158.4	143.3	-13.4	0	0	0	0	0	116.2
397	L	29.1	Very low	30.4	Very low	179 Å²	179	139.6 Å²	139.6	94%	0.937	74%	0.744	S	S	*	*			trans	67.6	122.7	157.5	-68.1	172.5	0	0	0	123.5
398	S	26.3	Very low	31.3	Very low	99 Å²	99	137.8 Å²	137.8	69%	0.692	74%	0.744	S	S	*	*				85.7	98.8	126.4	-155.3	0	0	0	0	124
399	S	28	Very low	31.4	Very low	97 Å²	97	137.8 Å²	137.8	68%	0.678	74%	0.744	S	S	*	*				82.7	154.2	118.4	78.2	0	0	0	0	124.3
400	R	29.2	Very low	31.8	Very low	210 Å²	210	144.1 Å²	144.1	79%	0.792	76%	0.755	S	S	*	*			trans	89	109.3	155.2	-61.9	-179.6	83.2	133.9	1.7	121.2
401	N	28.3	Very low	31.6	Very low	132 Å²	132	144.1 Å²	144.1	71%	0.706	76%	0.764	S	S	*	*				61.7	114.1	122.9	-62.8	25.7	0	0	0	122.7
402	S	28.7	Very low	31.6	Very low	94 Å²	94	139.6 Å²	139.6	66%	0.657	76%	0.761	S	S	*	*				75.3	119	120.2	72.2	0	0	0	0	123.1
403	L	29.7	Very low	31.6	Very low	163 Å²	163	136.4 Å²	136.4	85%	0.853	76%	0.757	S	S	*	*			trans	72.7	175.4	139.1	-56.9	171.5	0	0	0	115.4
404	P	46.2	Very low	32	Very low	98 Å²	98	138.5 Å²	138.5	64%	0.636	76%	0.762	S	S	*	*				-135.8	-170	-103.6	32.7	-7.7	0	0	0	115.2
405	T	35.7	Very low	32.1	Very low	132 Å²	132	136.4 Å²	136.4	81%	0.81	76%	0.763	S	S	*	*			trans	72.9	161.1	171.4	77.3	0	0	0	0	114.9
406	P	32.2	Very low	32	Very low	120 Å²	120	133.1 Å²	133.1	78%	0.779	76%	0.761	S	S	*	*			cis	-134.7	175.2	11.9	43.1	-25.6	0	0	0	118.2
407	Q	40.3	Very low	32.3	Very low	178 Å²	178	135.4 Å²	135.4	83%	0.832	77%	0.766	S	S	*	*			trans	-62.4	178.7	156.6	-70.5	-171.7	-13	0	0	111.3
408	P	45.8	Very low	32.4	Very low	104 Å²	104	132.8 Å²	132.8	68%	0.675	76%	0.762	S	S	*	*			cis	-156.1	-167.2	28.6	38.1	-11.6	0	0	0	119.7
409	R	32.8	Very low	32.5	Very low	214 Å²	214	132.1 Å²	132.1	81%	0.808	76%	0.763	S	S	*	*			trans	96.1	146.8	160.6	-56.9	178.7	-177.7	171.6	2.5	116.5
410	R	33.9	Very low	32.5	Very low	219 Å²	219	135.6 Å²	135.6	83%	0.826	77%	0.773	S	S	*	*			cis	-163.6	139.8	-19.1	-112.8	179.3	178	-178.4	-2.6	106.3
411	S	26.5	Very low	33.9	Very low	110 Å²	110	130.9 Å²	130.9	77%	0.769	77%	0.77	S	S	*	*				173	165.5	95.7	49.8	0	0	0	0	108.3
412	S	31.9	Very low	34.9	Very low	92 Å²	92	129.7 Å²	129.7	64%	0.643	77%	0.769	S	S	*	*			cis	-163.9	115.2	-21.6	-91.5	0	0	0	0	106.7
413	T	30.6	Very low	34.9	Very low	124 Å²	124	132.2 Å²	132.2	76%	0.761	77%	0.774	S	S	*	*				54.8	143	103.5	63.5	0	0	0	0	118
414	S	33	Very low	34.7	Very low	107 Å²	107	131.2 Å²	131.2	75%	0.748	77%	0.77	S	S	*	*			cis	177.3	150.1	-12.1	-89.3	0	0	0	0	110.1
415	S	31	Very low	33.9	Very low	111 Å²	111	131.6 Å²	131.6	78%	0.776	78%	0.775	S	S	*	*			trans	154.7	153	148.3	49.2	0	0	0	0	111.5
416	T	25.2	Very low	33.5	Very low	143 Å²	143	130.9 Å²	130.9	88%	0.877	78%	0.776	S	S	*	*			cis	-158.8	168.1	-24.4	20.9	0	0	0	0	108.4
417	S	34.5	Very low	33.4	Very low	117 Å²	117	129.9 Å²	129.9	82%	0.818	77%	0.771	S	S	*	*			trans	-139.8	138.2	-171.2	51.9	0	0	0	0	116.4
418	S	31	Very low	32.9	Very low	124 Å²	124	126.6 Å²	126.6	87%	0.867	77%	0.768	S	S	*	*			trans	-176.2	170.8	170.5	55.2	0	0	0	0	112.1
419	A	27.5	Very low	32	Very low	85 Å²	85	132.9 Å²	132.9	70%	0.702	78%	0.778	S	S	*	*			cis	-168.6	129	-44.5	0	0	0	0	0	113.1
420	L	28.3	Very low	31.7	Very low	170 Å²	170	132.6 Å²	132.6	89%	0.89	78%	0.777	S	S	*	*			trans	66.4	-163.7	157.1	-55.4	172.4	0	0	0	117.4
421	P	59.3	Low	31.3	Very low	112 Å²	112	129.8 Å²	129.8	73%	0.727	77%	0.774	S	S	*	*				-127.8	-152.3	-100.8	45.6	-27.3	0	0	0	112.2
422	P	49.6	Very low	31.6	Very low	107 Å²	107	133.7 Å²	133.7	70%	0.695	77%	0.771	S	S	*	*			cis	-137.9	-163.7	-10	39.7	-18.3	0	0	0	115.1
423	L	28.1	Very low	31.6	Very low	146 Å²	146	135.2 Å²	135.2	76%	0.764	77%	0.772	S	S	*	*				130.9	129.3	126.8	-142.9	83.9	0	0	0	120
424	D	26.1	Very low	31.6	Very low	142 Å²	142	136.3 Å²	136.3	76%	0.759	77%	0.774	S	S	*	*			trans	75.2	164	144.3	-84.5	4.5	0	0	0	126.5
425	S	29	Very low	31.5	Very low	106 Å²	106	134.3 Å²	134.3	74%	0.741	77%	0.77	S	S	*	*			trans	-163.5	160.2	-147.9	65.2	0	0	0	0	114.3
426	S	26.1	Very low	31.3	Very low	118 Å²	118	138.7 Å²	138.7	83%	0.825	78%	0.775	S	S	*	*			trans	165.9	174	154.7	47.3	0	0	0	0	111.9
427	S	30	Very low	31.7	Very low	99 Å²	99	143 Å²	143	69%	0.692	78%	0.775	S	S	*	*				-169.2	158	-52.7	69.6	0	0	0	0	111.6
428	S	30.9	Very low	32.4	Very low	109 Å²	109	141.7 Å²	141.7	76%	0.762	76%	0.764	S	S	*	*			trans	69.6	166.7	166.7	83.5	0	0	0	0	117.5
429	R	27.6	Very low	32.3	Very low	236 Å²	236	143.9 Å²	143.9	89%	0.891	76%	0.76	S	S	*	*			cis	-152.1	178.5	8.7	-148.1	167.1	-176.6	177.5	0.9	112.9
430	W	26	Very low	32.4	Very low	208 Å²	208	144 Å²	144	79%	0.788	76%	0.755	S	S	*	*			trans	-75	159.5	-176.5	-63.4	-1	0	0	0	115.2
431	E	24.5	Very low	32.3	Very low	160 Å²	160	142.4 Å²	142.4	75%	0.748	75%	0.747	S	S	*	*				-166.9	143.5	69.4	-84.6	-158.9	110.6	0	0	111.5
432	R	33.8	Very low	30.8	Very low	192 Å²	192	144.2 Å²	144.2	73%	0.725	75%	0.75	S	S	*	*				62.7	140.8	84.2	-81.2	-177.9	177.1	-179.3	0.1	115.7
433	N	32.7	Very low	29.6	Very low	124 Å²	124	144 Å²	144	66%	0.663	75%	0.751	S	S	*	*			cis	-160.3	168	15.4	-154.6	7	0	0	0	115.8
434	N	29.6	Very low	29.5	Very low	147 Å²	147	144.4 Å²	144.4	79%	0.786	75%	0.753	S	S	*	*			trans	64.7	142.8	161	-64.1	-33.1	0	0	0	121.3
435	G	30.1	Very low	29.4	Very low	65 Å²	65	143.4 Å²	143.4	67%	0.67	75%	0.752	S	S	*	*			cis	150.6	126.5	-21.1	0	0	0	0	0	118.3
436	K	27.2	Very low	29.1	Very low	203 Å²	203	143.3 Å²	143.3	88%	0.883	75%	0.752	S	S	*	*			trans	164.6	124.3	142.4	-90.4	161.9	-175.4	179.7	0	109
437	R	34.1	Very low	29	Very low	233 Å²	233	143.4 Å²	143.4	88%	0.879	75%	0.752	S	S	*	*			cis	93	151.1	46.4	-84.9	-163	-174.8	-175.4	3.4	113
438	P	50	Low	28.7	Very low	89 Å²	89	143.3 Å²	143.3	58%	0.578	75%	0.752	S	S	*	*			cis	-150.3	-176	-34	42.4	-24.4	0	0	0	116.4
439	H	28.9	Very low	28.5	Very low	170 Å²	170	145.8 Å²	145.8	79%	0.787	76%	0.755	S	S	*	*			trans	75.4	149.9	150.7	-65.8	-42.2	0	0	0	121.8
440	C	29.1	Very low	28.3	Very low	88 Å²	88	139.6 Å²	139.6	60%	0.595	74%	0.744	S	S	*	*			cis	-171.1	147.6	-33.9	-113.9	0	0	0	0	113.7
441	D	25.1	Very low	28.3	Very low	137 Å²	137	137.1 Å²	137.1	73%	0.733	75%	0.746	S	S	*	*			trans	72.3	144.8	133.6	-61.5	-18.8	0	0	0	127.7
442	L	29.2	Very low	28.3	Very low	149 Å²	149	133 Å²	133	78%	0.78	75%	0.746	S	S	*	*			trans	88.9	89.3	143	-105	86	0	0	0	123.8
443	S	24.2	Very low	28.6	Very low	102 Å²	102	129.3 Å²	129.3	71%	0.713	75%	0.747	S	S	*	*				73.6	153.9	111.5	-60.3	0	0	0	0	125.8
444	L	25.7	Very low	28.2	Very low	155 Å²	155	131 Å²	131	81%	0.812	76%	0.756	S	S	*	*			trans	95.9	120.1	156.6	-65	169.6	0	0	0	121.2
445	T	23.1	Very low	28.1	Very low	122 Å²	122	128.4 Å²	128.4	75%	0.748	76%	0.755	S	S	*	*			trans	49.3	151.5	138.4	56.8	0	0	0	0	122.8
446	S	23	Very low	28.1	Very low	104 Å²	104	133 Å²	133	73%	0.727	77%	0.765	S	S	*	*			cis	164.1	116.1	-36.5	50.3	0	0	0	0	110
447	S	25.1	Very low	28.1	Very low	120 Å²	120	131.7 Å²	131.7	84%	0.839	77%	0.766	S	S	*	*			trans	-179.6	164	162.2	53	0	0	0	0	112.7
448	S	23.8	Very low	28	Very low	97 Å²	97	127.8 Å²	127.8	68%	0.678	76%	0.762	S	S	*	*				-176.6	131.5	-71.5	49.1	0	0	0	0	112.1
449	L	25.2	Very low	26.9	Very low	161 Å²	161	130.4 Å²	130.4	84%	0.843	78%	0.776	S	S	*	*			trans	68.5	157.7	159.1	-56.4	162.2	0	0	0	115.6
450	T	23.9	Very low	27.1	Very low	106 Å²	106	129.7 Å²	129.7	65%	0.65	78%	0.777	S	S	*	*			cis	-155.4	162.9	5.7	-13.1	0	0	0	0	112.5
451	N	25.2	Very low	27.2	Very low	156 Å²	156	131.3 Å²	131.3	83%	0.834	79%	0.786	S	S	*	*			trans	73.2	132.3	156.3	-59.7	-18.6	0	0	0	121.3
452	G	25.3	Very low	27.2	Very low	72 Å²	72	134.7 Å²	134.7	74%	0.742	79%	0.794	S	S	*	*			trans	-114	-141.7	158.6	0	0	0	0	0	110.2
453	P	40.1	Very low	27.1	Very low	115 Å²	115	135.7 Å²	135.7	75%	0.747	80%	0.795	S	S	*	*			cis	-133.8	-177.2	-3.5	42.4	-26	0	0	0	115.4
454	N	25	Very low	27.3	Very low	161 Å²	161	141.2 Å²	141.2	86%	0.861	80%	0.8	S	S	*	*			trans	75.1	160.2	165	-69.2	-18.7	0	0	0	120.4
455	A	26.6	Very low	27.4	Very low	92 Å²	92	139.3 Å²	139.3	76%	0.76	80%	0.8	S	S	*	*			trans	84.2	96.6	167	0	0	0	0	0	120
456	N	29.3	Very low	27.6	Very low	162 Å²	162	138.6 Å²	138.6	87%	0.866	80%	0.8	S	S	*	*			trans	23	129.7	135.8	-55.2	-12.6	0	0	0	121
457	L	27.8	Very low	27.7	Very low	174 Å²	174	139.2 Å²	139.2	91%	0.911	80%	0.804	S	S	*	*			trans	-151.4	142.3	130.7	-117.5	170.3	0	0	0	112.1
458	L	31.5	Very low	27.7	Very low	152 Å²	152	139.4 Å²	139.4	80%	0.796	80%	0.8	S	S	*	*			trans	-98	142.9	175.6	-69.2	157.4	0	0	0	109.8
459	T	28.7	Very low	27.7	Very low	143 Å²	143	140.9 Å²	140.9	88%	0.877	81%	0.805	S	S	*	*			trans	-165.1	123.2	134.7	11	0	0	0	0	111.2
460	I	31.6	Very low	27.8	Very low	155 Å²	155	139.8 Å²	139.8	80%	0.795	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-100.1	129.3	166.1	-64.1	171.3	0	0	0	106.9
461	P	31.1	Very low	27.9	Very low	122 Å²	122	140.3 Å²	140.3	79%	0.792	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-67.9	143.6	178.2	27.6	-33.6	0	0	0	111.5
462	K	26.6	Very low	27.9	Very low	208 Å²	208	141.8 Å²	141.8	90%	0.904	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-69.9	143.4	-169.5	-65.5	179.5	178.5	179.5	0	113.2
463	Q	26.5	Very low	28	Very low	171 Å²	171	147.1 Å²	147.1	80%	0.799	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-93.1	166.3	157.2	-107.2	-158.4	10.8	0	0	111.6
464	R	29	Very low	27.3	Very low	218 Å²	218	147.1 Å²	147.1	82%	0.823	80%	0.801	S	S	*	*			trans	72.9	126.9	161	-76.7	-173.7	178	-147.1	-2.9	120
465	S	26.6	Very low	27.4	Very low	115 Å²	115	145.6 Å²	145.6	80%	0.804	80%	0.797	S	S	*	*				59	121.1	129.1	-50.8	0	0	0	0	120.8
466	S	27.1	Very low	28.1	Very low	107 Å²	107	146 Å²	146	75%	0.748	79%	0.792	S	S	*	*			trans	-138.8	99.5	152.2	60.3	0	0	0	0	109.8
467	S	25.1	Very low	28	Very low	116 Å²	116	149.4 Å²	149.4	81%	0.811	79%	0.793	S	S	*	*			trans	-61.6	153.7	144.4	40.7	0	0	0	0	108.6
468	V	25.6	Very low	27.9	Very low	124 Å²	124	152.1 Å²	152.1	75%	0.752	79%	0.791	S	S	*	*			trans	-123	106.1	178	178.8	0	0	0	0	108.8
469	T	24.5	Very low	27.6	Very low	129 Å²	129	151.6 Å²	151.6	79%	0.791	79%	0.794	S	S	*	*			trans	-101.4	132.1	161.7	-48.8	0	0	0	0	107
470	L	25.8	Very low	27.5	Very low	137 Å²	137	148.8 Å²	148.8	72%	0.717	79%	0.794	S	S	*	*			trans	-105.3	121.8	-178.6	-163.4	86.2	0	0	0	109.8	Y472	L470-Y472 HydrophobicContact CD2-CD2 4.37Å; L470-Y472 HydrophobicContact CD2-CE2 3.92Å
471	T	26.1	Very low	27.4	Very low	118 Å²	118	148.3 Å²	148.3	72%	0.724	80%	0.798	S	S	*	*			trans	-115.7	127.1	175.5	-46.7	0	0	0	0	109.6
472	Y	25.6	Very low	27.2	Very low	187 Å²	187	147.5 Å²	147.5	73%	0.733	80%	0.796	S	S	*	*			trans	-88.1	126	175.9	-91.2	-94	0	0	0	111.1	L470	L470-Y472 HydrophobicContact CD2-CD2 4.37Å; L470-Y472 HydrophobicContact CD2-CE2 3.92Å
473	H	27.2	Very low	27.9	Very low	184 Å²	184	142.7 Å²	142.7	85%	0.852	79%	0.786	S	S	*	*			trans	-143.2	140.9	150.2	-86.2	-72.6	0	0	0	109.5
474	T	26.6	Very low	28	Very low	115 Å²	115	139.3 Å²	139.3	71%	0.706	78%	0.78	S	S	*	*			trans	-115.8	179.8	-169.3	43.8	0	0	0	0	112.4
475	V	26.6	Very low	27.9	Very low	128 Å²	128	137.1 Å²	137.1	78%	0.776	78%	0.784	S	S	*	*			trans	86.5	130.7	162.4	-172.4	0	0	0	0	115.7
476	P	41.1	Very low	28	Very low	101 Å²	101	136.4 Å²	136.4	66%	0.656	78%	0.779	S	S	*	*			cis	-142.9	162.3	-33.5	37.7	-19.3	0	0	0	115.7
477	R	26.8	Very low	29.1	Very low	234 Å²	234	136.5 Å²	136.5	88%	0.883	78%	0.777	S	S	*	*				158.9	108.6	126.9	-87.4	169.9	179	-169.4	0.8	116.3
478	R	26.8	Very low	29.3	Very low	231 Å²	231	137.2 Å²	137.2	87%	0.872	78%	0.776	S	S	*	*			trans	46.1	130.6	135.7	-70	-171.4	176.8	-179.9	-0.2	123.8
479	T	25.7	Very low	29.3	Very low	141 Å²	141	137.6 Å²	137.6	87%	0.865	78%	0.779	S	S	*	*			trans	72	118.4	138.8	52	0	0	0	0	121.7
480	G	26.3	Very low	29.4	Very low	84 Å²	84	136.6 Å²	136.6	87%	0.866	78%	0.778	S	S	*	*			trans	176.3	117.7	164.5	0	0	0	0	0	113.5
481	T	27.8	Very low	30.1	Very low	144 Å²	144	136.4 Å²	136.4	88%	0.883	78%	0.784	S	S	*	*			trans	-72.1	162.3	-170.5	43.3	0	0	0	0	117.7
482	S	27.4	Very low	30.1	Very low	106 Å²	106	135.7 Å²	135.7	74%	0.741	79%	0.785	S	S	*	*			trans	-67.1	179.5	165.3	57.3	0	0	0	0	113
483	P	41.6	Very low	30.2	Very low	107 Å²	107	136.1 Å²	136.1	70%	0.695	79%	0.793	S	S	*	*			cis	-152.2	176.2	25.5	46	-24.3	0	0	0	121.3
484	S	28.6	Very low	30.3	Very low	99 Å²	99	132.6 Å²	132.6	69%	0.692	79%	0.789	S	S	*	*			trans	29.6	142.5	144.9	66	0	0	0	0	124.7
485	L	27.8	Very low	30.8	Very low	173 Å²	173	133.1 Å²	133.1	91%	0.906	79%	0.794	S	S	*	*				-177.9	165.1	121.2	-100.1	167.5	0	0	0	115.6
486	S	27.3	Very low	31.5	Very low	100 Å²	100	131.7 Å²	131.7	70%	0.699	79%	0.788	S	S	*	*			trans	-162.6	-169.8	172.4	66.1	0	0	0	0	108.4
487	P	51.2	Low	31	Very low	108 Å²	108	133 Å²	133	70%	0.701	79%	0.794	S	S	*	*			cis	-139.2	-147.8	-4.3	37.3	-12.2	0	0	0	114.9
488	V	28.1	Very low	31	Very low	131 Å²	131	128.5 Å²	128.5	79%	0.794	79%	0.786	S	S	*	*			trans	66.7	164.2	172	-91.1	0	0	0	0	118.5
489	T	25.7	Very low	31.1	Very low	132 Å²	132	123.9 Å²	123.9	81%	0.81	78%	0.779	S	S	*	*			cis	-148.6	-171.9	23.7	-31.5	0	0	0	0	113.5
490	S	27.6	Very low	31.2	Very low	109 Å²	109	123.5 Å²	123.5	76%	0.762	78%	0.777	S	S	*	*			trans	-114	-164	179.1	-35.7	0	0	0	0	112.4
491	P	39.6	Very low	31.3	Very low	132 Å²	132	122.8 Å²	122.8	86%	0.857	77%	0.77	S	S	*	*			cis	-142.8	-153	33	43.6	-20	0	0	0	116.8
492	S	26.9	Very low	31.3	Very low	104 Å²	104	121.6 Å²	121.6	73%	0.727	77%	0.767	S	S	*	*			trans	-144	165.1	-160.5	56.3	0	0	0	0	115.7
493	H	28.7	Very low	31.3	Very low	196 Å²	196	121.9 Å²	121.9	91%	0.907	77%	0.769	S	S	*	*			trans	-155.5	165.9	166.7	-89.4	-65.7	0	0	0	115.4
494	S	27.7	Very low	30.7	Very low	109 Å²	109	122.8 Å²	122.8	76%	0.762	78%	0.778	S	S	*	*			trans	-156.1	160.7	174.9	-46.2	0	0	0	0	109.2
495	P	38.6	Very low	30.6	Very low	127 Å²	127	123.2 Å²	123.2	83%	0.825	78%	0.781	S	S	*	*				-153.8	-136.2	90.1	36.6	-9.2	0	0	0	116
496	P	40.6	Very low	30.6	Very low	98 Å²	98	123.2 Å²	123.2	64%	0.636	78%	0.781	S	S	*	*				-140	168.4	-104.1	45.5	-26.5	0	0	0	121
497	T	29.5	Very low	30.6	Very low	128 Å²	128	124.4 Å²	124.4	79%	0.785	79%	0.785	S	S	*	*			trans	61.7	152.8	150.2	50.1	0	0	0	0	120.8
498	L	28.6	Very low	29.6	Very low	139 Å²	139	125.1 Å²	125.1	73%	0.728	79%	0.789	S	S	*	*			cis	-169.3	149.4	44.8	-166.9	77.7	0	0	0	113.4
499	N	27.1	Very low	29.5	Very low	134 Å²	134	129.7 Å²	129.7	72%	0.717	79%	0.792	S	S	*	*			trans	62.8	172.1	161.7	-74.8	-1.1	0	0	0	118.9
500	T	29.5	Very low	29.5	Very low	133 Å²	133	130.7 Å²	130.7	82%	0.816	79%	0.791	S	S	*	*			cis	-167.5	166.4	-29.9	34.1	0	0	0	0	107.8
501	G	27.1	Very low	29.8	Very low	70 Å²	70	130.9 Å²	130.9	72%	0.722	79%	0.79	S	S	*	*			cis	164.4	168.4	-3.2	0	0	0	0	0	113.7
502	S	28.8	Very low	29.3	Very low	119 Å²	119	130.3 Å²	130.3	83%	0.832	78%	0.784	S	S	*	*			trans	67.1	102.8	161.6	-60.7	0	0	0	0	124.8
503	S	27.7	Very low	29.2	Very low	112 Å²	112	134.5 Å²	134.5	78%	0.783	79%	0.792	S	S	*	*				77.8	146.1	123.2	73.4	0	0	0	0	125.7
504	S	28.2	Very low	29.2	Very low	125 Å²	125	133.3 Å²	133.3	87%	0.874	79%	0.785	S	S	*	*			trans	94.4	161.9	153.6	80.8	0	0	0	0	119.7
505	S	26.6	Very low	29.3	Very low	109 Å²	109	133.9 Å²	133.9	76%	0.762	79%	0.786	S	S	*	*			trans	-138.9	148.9	-158.3	54.8	0	0	0	0	113.3
506	L	27.5	Very low	28.8	Very low	172 Å²	172	134.7 Å²	134.7	90%	0.901	78%	0.783	S	S	*	*			trans	176.4	154.6	139.4	-97.7	158.9	0	0	0	111
507	T	26.6	Very low	28.2	Very low	126 Å²	126	137 Å²	137	77%	0.773	80%	0.795	S	S	*	*			trans	-102.2	153.2	172.8	50.6	0	0	0	0	110.8
508	P	30.2	Very low	28.1	Very low	123 Å²	123	135.4 Å²	135.4	80%	0.799	80%	0.795	S	S	*	*				-146	160.6	103.5	37.2	-21.9	0	0	0	116.8
509	R	26.4	Very low	28	Very low	227 Å²	227	135.5 Å²	135.5	86%	0.857	80%	0.797	S	S	*	*			trans	-18.4	146.6	148.3	-84.9	175.9	-178.8	163.9	-0.2	115.5
510	L	26	Very low	27.9	Very low	152 Å²	152	138 Å²	138	80%	0.796	80%	0.802	S	S	*	*			cis	-170.4	-172.9	34	-103.2	145.2	0	0	0	107.6
511	P	34.1	Very low	27.9	Very low	113 Å²	113	139.5 Å²	139.5	73%	0.734	80%	0.804	S	S	*	*			cis	-121.5	-161.6	-24.8	39.5	-22.6	0	0	0	112.3
512	V	29.7	Very low	27.8	Very low	121 Å²	121	142.1 Å²	142.1	73%	0.733	81%	0.806	S	S	*	*			trans	-94	141.6	174.5	173	0	0	0	0	111.1	F514	V512-F514 HydrophobicContact CG1-CD2 4Å; V512-F514 HydrophobicContact CG1-CE2 4.12Å
513	E	23.9	Very low	27.7	Very low	192 Å²	192	145.8 Å²	145.8	90%	0.897	81%	0.807	S	S	*	*			trans	-144.9	137.3	161.8	-162.8	159.5	-126.6	0	0	109.3
514	F	28.7	Very low	28	Very low	170 Å²	170	145.7 Å²	145.7	75%	0.746	80%	0.803	S	S	*	*			trans	-110.7	152.8	173.2	-85.8	-93.8	0	0	0	108.4	V512	V512-F514 HydrophobicContact CG1-CD2 4Å; V512-F514 HydrophobicContact CG1-CE2 4.12Å
515	P	30.2	Very low	27.9	Very low	121 Å²	121	144.8 Å²	144.8	79%	0.786	80%	0.797	S	S	*	*				-139.2	161	107.2	38.4	-28.7	0	0	0	114.3
516	D	27.6	Very low	27.8	Very low	145 Å²	145	146.7 Å²	146.7	78%	0.775	80%	0.804	S	S	*	*			trans	-66.1	151.2	165	-65.6	-70.3	0	0	0	112.1
517	T	28.1	Very low	27.7	Very low	145 Å²	145	145.4 Å²	145.4	89%	0.89	80%	0.798	S	S	*	*				-159.6	139.8	122	3.9	0	0	0	0	109.7
518	A	28.3	Very low	27.6	Very low	95 Å²	95	147.2 Å²	147.2	79%	0.785	80%	0.802	S	S	*	*			trans	-87.9	145.9	173.2	0	0	0	0	0	110.2
519	D	25.7	Very low	27.4	Very low	142 Å²	142	147.8 Å²	147.8	76%	0.759	80%	0.799	S	S	*	*			trans	-162.5	173.1	146.4	-130.6	-32.1	0	0	0	113.1
520	F	24.1	Very low	27.4	Very low	186 Å²	186	144.6 Å²	144.6	82%	0.816	80%	0.798	S	S	*	*			trans	74.9	90.6	171.1	-56.8	-69.4	0	0	0	119.7
521	L	29.3	Very low	27.5	Very low	165 Å²	165	145.7 Å²	145.7	86%	0.864	80%	0.798	S	S	*	*			trans	-83.7	133	138.4	-68.2	169.9	0	0	0	109.5
522	T	26.6	Very low	27.4	Very low	124 Å²	124	149.3 Å²	149.3	76%	0.761	80%	0.802	S	S	*	*				168	119.8	127.4	33.6	0	0	0	0	115.6
523	K	25.6	Very low	27.4	Very low	196 Å²	196	149.8 Å²	149.8	85%	0.852	81%	0.808	S	S	*	*			trans	65.5	173.1	152.8	-54.9	179.7	177.4	175.9	0	116.4
524	P	34.8	Very low	27.4	Very low	110 Å²	110	148.1 Å²	148.1	71%	0.714	80%	0.804	S	S	*	*				-132.6	153.4	-72.1	39.6	-24.8	0	0	0	115.5
525	S	25.8	Very low	27.3	Very low	107 Å²	107	146 Å²	146	75%	0.748	81%	0.806	S	S	*	*			trans	34.9	113.3	150	62.9	0	0	0	0	121.4
526	V	25	Very low	27.1	Very low	149 Å²	149	145.8 Å²	145.8	90%	0.903	81%	0.806	S	S	*	*			trans	-151.9	144.6	142.3	146.4	0	0	0	0	109.5
527	N	24.9	Very low	27	Very low	145 Å²	145	143.3 Å²	143.3	78%	0.775	80%	0.801	S	S	*	*			trans	-78.2	152	171.1	-90.7	-70.4	0	0	0	112
528	L	25.4	Very low	26.9	Very low	164 Å²	164	142.3 Å²	142.3	86%	0.859	79%	0.794	S	S	*	*			trans	-156.4	155.3	141.2	-114.9	171.1	0	0	0	113.3
529	N	25.7	Very low	26.8	Very low	135 Å²	135	144 Å²	144	72%	0.722	79%	0.79	S	S	*	*			trans	-90.7	151.4	-163.3	-66.4	-70.3	0	0	0	114.2
530	L	26.6	Very low	26.8	Very low	160 Å²	160	145 Å²	145	84%	0.838	79%	0.788	S	S	*	*			trans	-86.5	129.5	165.9	-176.6	74.3	0	0	0	110.4
531	H	27.6	Very low	27.1	Very low	174 Å²	174	143.9 Å²	143.9	81%	0.806	79%	0.786	S	S	*	*			trans	-134.2	141.8	166.9	-96.1	-97.8	0	0	0	112
532	K	31.2	Very low	27	Very low	189 Å²	189	144.3 Å²	144.3	82%	0.822	78%	0.783	S	S	*	*			trans	-85.7	169.2	176.3	-60.7	175.8	179.2	176.8	0	110.9
533	P	29.5	Very low	27	Very low	131 Å²	131	142.4 Å²	142.4	85%	0.851	78%	0.78	S	S	*	*				-139.9	131.2	115.9	35.4	-22.7	0	0	0	117.2
534	L	25.2	Very low	27	Very low	157 Å²	157	141.8 Å²	141.8	82%	0.822	78%	0.777	S	S	*	*			trans	8	110.1	139.8	-159.4	68.9	0	0	0	122.7
535	V	26.9	Very low	26.6	Very low	127 Å²	127	147.1 Å²	147.1	77%	0.77	78%	0.784	S	S	*	*				31.9	128.1	118.7	-175.9	0	0	0	0	122
536	S	25	Very low	26.7	Very low	115 Å²	115	148.1 Å²	148.1	80%	0.804	79%	0.79	S	S	*	*			trans	-166.3	171	134.2	60	0	0	0	0	110.3
537	S	25.2	Very low	26.8	Very low	94 Å²	94	145.7 Å²	145.7	66%	0.657	78%	0.78	S	S	*	*				-151.2	175.2	-77.5	51.2	0	0	0	0	110.9
538	T	26	Very low	27.1	Very low	123 Å²	123	145.9 Å²	145.9	76%	0.755	79%	0.786	S	S	*	*			trans	72.5	140.3	177.3	68.5	0	0	0	0	115.9
539	D	26.3	Very low	27.6	Very low	130 Å²	130	145.2 Å²	145.2	70%	0.695	78%	0.777	S	S	*	*			cis	-157.2	169.5	-3.1	-130.6	-32.8	0	0	0	116
540	F	26.2	Very low	28	Very low	164 Å²	164	144.1 Å²	144.1	72%	0.719	78%	0.78	S	S	*	*			trans	60.4	100.9	164.4	-85.3	-90.4	0	0	0	123
541	Q	29.6	Very low	28.8	Very low	163 Å²	163	142.3 Å²	142.3	76%	0.762	77%	0.771	S	S	*	*				35.2	141.7	121.3	-69.4	-179.4	-4.8	0	0	121.7
542	Q	27.7	Very low	29.4	Very low	174 Å²	174	136.7 Å²	136.7	81%	0.813	75%	0.75	S	S	*	*			cis	-159	156.4	9	-152.6	179	0.7	0	0	113.9
543	A	26.8	Very low	30	Very low	84 Å²	84	135 Å²	135	69%	0.694	76%	0.756	S	S	*	*			trans	92.3	143	149.9	0	0	0	0	0	122.4
544	F	26	Very low	30.6	Very low	182 Å²	182	134 Å²	134	80%	0.798	75%	0.752	S	S	*	*			trans	73.9	108.8	169.8	-83.1	-92.6	0	0	0	122.4
545	R	26.8	Very low	32	Very low	223 Å²	223	130.7 Å²	130.7	84%	0.842	74%	0.741	S	S	*	*			trans	57.5	106	147.3	-68	177.1	178.9	-175.6	-0.6	120.2
546	S	26.6	Very low	32.9	Very low	127 Å²	127	127 Å²	127	89%	0.888	73%	0.728	S	S	*	*				178.5	155.6	101.6	47.7	0	0	0	0	111.8
547	S	27.9	Very low	34.1	Very low	99 Å²	99	131.4 Å²	131.4	69%	0.692	73%	0.727	S	S	*	*			trans	-148.9	107	170.5	59.5	0	0	0	0	110.2
548	T	30.6	Very low	34.7	Very low	148 Å²	148	132.7 Å²	132.7	91%	0.908	72%	0.723	S	S	*	*	P	Polyproline II helix	trans	-76.8	140	175.2	28.2	0	0	0	0	111.2
549	F	36.5	Very low	35.1	Very low	150 Å²	150	135.6 Å²	135.6	66%	0.658	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-103.1	142.2	169.3	-69.9	-83.7	0	0	0	110.2
550	S	33.8	Very low	35.5	Very low	112 Å²	112	137.7 Å²	137.7	78%	0.783	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-77.7	124.3	178.4	51.4	0	0	0	0	111.7
551	L	42.7	Very low	35.7	Very low	123 Å²	123	138.9 Å²	138.9	64%	0.644	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-89.9	150.5	176.3	-69.6	158.2	0	0	0	111.4	G556	L551-G556 WeakPolarHBondContact CD2-O 3.46Å
552	C	40.9	Very low	35.6	Very low	55 Å²	55	134.7 Å²	134.7	37%	0.372	75%	0.746	S	S	.	*	P	Polyproline II helix	trans	-74.4	125.2	166	-177.2	0	0	0	0	110.6	S554 C555 G556	C552-S554 VanDerWaalsContact C-N 3.28Å; C552-S554 PolarHBondContact O-N 3.08Å; C552-C555 PolarHBondContact O-N 3.29Å; C552-G556 WeakPolarHBondContact O-CA 3.5Å; C552-G556 PolarHBondContact O-N 3.15Å
553	T	43.1	Very low	35.6	Very low	155 Å²	155	134 Å²	134	95%	0.951	75%	0.746	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.7	-4.5	-174.7	37.9	0	0	0	0	115.7
554	S	43.7	Very low	35.7	Very low	110 Å²	110	134.9 Å²	134.9	77%	0.769	75%	0.748	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.8	-16.2	173.3	62.1	0	0	0	0	115	C552	C552-S554 VanDerWaalsContact C-N 3.28Å; C552-S554 PolarHBondContact O-N 3.08Å
555	C	53.5	Low	35.8	Very low	87 Å²	87	131.9 Å²	131.9	59%	0.588	75%	0.749	S	S	*	*	T	Hydrogen-bonded Turn	trans	-144.4	2.3	-175.2	69.9	0	0	0	0	116.1	C552 R557	C552-C555 PolarHBondContact O-N 3.29Å; C555-R557 PolarHBondContact O-N 3.21Å
556	G	46.7	Very low	35.8	Very low	48 Å²	48	126.5 Å²	126.5	50%	0.495	75%	0.745	S	S	.	*			trans	66.6	-0.2	166.8	0	0	0	0	0	117.6	L551 C552	L551-G556 WeakPolarHBondContact CD2-O 3.46Å; C552-G556 WeakPolarHBondContact O-CA 3.5Å; C552-G556 PolarHBondContact O-N 3.15Å
557	R	49.8	Very low	35.7	Very low	209 Å²	209	129.9 Å²	129.9	79%	0.789	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-87	157.5	178.5	-67	-167.5	180	-148.5	1.2	112.8	C555	C555-R557 PolarHBondContact O-N 3.21Å
558	Q	38.3	Very low	35.7	Very low	121 Å²	121	130.6 Å²	130.6	57%	0.565	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-103.1	130	-175.5	-170.5	179.4	11.9	0	0	109.6
559	M	34	Very low	35.4	Very low	184 Å²	184	127.2 Å²	127.2	91%	0.906	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-87.8	125.7	178.7	-70.2	-158.3	78.5	0	0	112.1
560	L	34.1	Very low	34.9	Very low	174 Å²	174	127 Å²	127	91%	0.911	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-93.7	136.9	165.3	-154.1	77.1	0	0	0	109.3
561	K	30.6	Very low	34.4	Very low	188 Å²	188	127.3 Å²	127.3	82%	0.817	76%	0.755	S	S	*	*			trans	-110.2	107	-176.5	-171.7	176.1	-176.5	178.6	0	110.7
562	G	28.1	Very low	33.7	Very low	76 Å²	76	129.5 Å²	129.5	78%	0.784	76%	0.761	S	S	*	*			trans	-65.5	141.3	168.9	0	0	0	0	0	111.4
563	I	27.5	Very low	32.9	Very low	158 Å²	158	135.4 Å²	135.4	81%	0.81	78%	0.784	S	S	*	*			trans	-119.5	144.7	168.5	-68.2	178.4	0	0	0	107.2
564	S	28	Very low	31.9	Very low	104 Å²	104	134.1 Å²	134.1	73%	0.727	77%	0.77	S	S	*	*			trans	-97.4	-173.9	-169.1	54.8	0	0	0	0	113
565	S	28	Very low	30.9	Very low	119 Å²	119	138.9 Å²	138.9	83%	0.832	78%	0.777	S	S	*	*			trans	77.4	149	179.9	77.8	0	0	0	0	116
566	S	27.5	Very low	29.6	Very low	109 Å²	109	141.6 Å²	141.6	76%	0.762	79%	0.786	S	S	*	*			cis	168.5	116.8	-33.3	160.4	0	0	0	0	106.1
567	E	24.7	Very low	28.7	Very low	199 Å²	199	144.6 Å²	144.6	93%	0.93	80%	0.799	S	S	*	*			trans	-153.2	148.9	152.8	-128.2	162.2	-148.5	0	0	111.9
568	S	27.5	Very low	27.5	Very low	114 Å²	114	144 Å²	144	80%	0.797	81%	0.806	S	S	*	*			trans	-98.4	138.8	-169.8	51.3	0	0	0	0	111.8
569	G	24.8	Very low	27	Very low	77 Å²	77	142.4 Å²	142.4	79%	0.794	81%	0.813	S	S	*	*			trans	-93.6	132.4	163.3	0	0	0	0	0	111
570	D	26.5	Very low	26.6	Very low	145 Å²	145	142.5 Å²	142.5	78%	0.775	81%	0.811	S	S	*	*			trans	-160.4	130.5	154.7	-141	-15.7	0	0	0	111.5
571	S	23.5	Very low	26.3	Very low	119 Å²	119	144.4 Å²	144.4	83%	0.832	81%	0.806	S	S	*	*			trans	179.7	119.1	160.9	-85.2	0	0	0	0	111.4
572	H	26.8	Very low	26	Very low	168 Å²	168	146.6 Å²	146.6	78%	0.778	81%	0.81	S	S	*	*			trans	-66.5	155.9	-176.6	-53.6	-93.3	0	0	0	115.3
573	Q	24.4	Very low	25.9	Very low	180 Å²	180	154 Å²	154	84%	0.841	81%	0.814	S	S	*	*				151.3	161.8	113	-80.1	-160.6	4.5	0	0	112.4
574	L	22.6	Very low	25.9	Very low	128 Å²	128	151.9 Å²	151.9	67%	0.67	81%	0.813	S	S	*	*			cis	-176.6	119.8	-34.7	-176.9	154.2	0	0	0	106.7
575	F	23.1	Very low	25.8	Very low	209 Å²	209	151 Å²	151	92%	0.917	81%	0.813	S	S	*	*			trans	-154.1	153.4	155.4	-111.4	-74.4	0	0	0	110.4
576	N	26.2	Very low	25.8	Very low	144 Å²	144	151.8 Å²	151.8	77%	0.77	81%	0.812	S	S	*	*			trans	-152.2	173.3	-164.2	-158.9	0.2	0	0	0	111
577	S	27.2	Very low	25.8	Very low	111 Å²	111	155 Å²	155	78%	0.776	82%	0.815	S	S	*	*			trans	75.3	146.1	-168.4	-54.9	0	0	0	0	113.6
578	E	25	Very low	25.9	Very low	197 Å²	197	149.4 Å²	149.4	92%	0.921	81%	0.81	S	S	*	*			cis	-129.4	170.8	13.1	-159.2	157.2	-145.5	0	0	112.4
579	A	27.3	Very low	25.8	Very low	87 Å²	87	152.2 Å²	152.2	72%	0.719	82%	0.815	S	S	*	*			trans	-128.9	150.8	-161.1	0	0	0	0	0	115
580	Q	26	Very low	25.9	Very low	187 Å²	187	156 Å²	156	87%	0.874	81%	0.812	S	S	*	*			trans	-149.4	153.1	149.2	-154.9	62.5	-77.1	0	0	111.9
581	R	26.4	Very low	26.1	Very low	213 Å²	213	159.3 Å²	159.3	80%	0.804	82%	0.815	S	S	*	*			trans	-82.6	169.3	-179.9	-57.1	169.4	-178.8	161.6	0	110.1
582	R	25.3	Very low	26.3	Very low	235 Å²	235	158 Å²	158	89%	0.887	81%	0.812	S	S	*	*			cis	-158.3	-172.8	21.4	-146.1	168.4	-164.7	-172.1	3.3	111.1
583	R	26.4	Very low	26.3	Very low	230 Å²	230	154.2 Å²	154.2	87%	0.868	82%	0.818	S	S	*	*			trans	-79.8	159.8	-173	-60.8	174.3	172.6	165.6	-5.8	115.4
584	S	27.1	Very low	26.5	Very low	114 Å²	114	149.2 Å²	149.2	80%	0.797	82%	0.815	S	S	*	*			trans	64.4	159	138.5	55.5	0	0	0	0	121
585	A	26.5	Very low	26.7	Very low	87 Å²	87	149.8 Å²	149.8	72%	0.719	82%	0.819	S	S	*	*			cis	180	163.1	-28.2	0	0	0	0	0	109.4
586	V	27.5	Very low	26.9	Very low	134 Å²	134	148.1 Å²	148.1	81%	0.812	81%	0.811	S	S	*	*			trans	71.1	162.2	165.2	178.3	0	0	0	0	116.2
587	E	27.4	Very low	27	Very low	178 Å²	178	148.6 Å²	148.6	83%	0.832	81%	0.812	S	S	*	*			trans	-68.6	173.5	-172.3	-62.7	126	122.4	0	0	115.6
588	G	26.7	Very low	27	Very low	80 Å²	80	152.8 Å²	152.8	83%	0.825	81%	0.811	S	S	*	*			trans	-95.8	178	-175.7	0	0	0	0	0	115.8
589	L	25.1	Very low	27.1	Very low	173 Å²	173	150.1 Å²	150.1	91%	0.906	80%	0.798	S	S	*	*			trans	-142	162.7	175.2	-170.1	62.5	0	0	0	109.6
590	E	28.1	Very low	26.9	Very low	157 Å²	157	153.8 Å²	153.8	73%	0.734	80%	0.801	S	S	*	*			trans	-88.9	174.1	-166.7	-51.6	179.5	110.6	0	0	116.7
591	Y	28.9	Very low	28.1	Very low	214 Å²	214	149.9 Å²	149.9	84%	0.839	79%	0.791	S	S	*	*			trans	94.2	140.2	142.1	-101.6	-77.9	0	0	0	123.8
592	A	28.5	Very low	28.1	Very low	93 Å²	93	146.6 Å²	146.6	77%	0.769	79%	0.79	S	S	*	*			trans	89.2	90.7	148.1	0	0	0	0	0	122.9
593	G	27.2	Very low	28.3	Very low	87 Å²	87	141.7 Å²	141.7	90%	0.897	79%	0.786	S	S	*	*				104.9	129.9	105.7	0	0	0	0	0	121.3
594	G	27.6	Very low	28.4	Very low	75 Å²	75	137.2 Å²	137.2	77%	0.773	78%	0.784	S	S	*	*			trans	154.6	78	159.8	0	0	0	0	0	120.3
595	D	28.4	Very low	28.4	Very low	141 Å²	141	135.6 Å²	135.6	75%	0.754	79%	0.785	S	S	*	*			trans	66.7	107.3	141.6	-73.6	20.6	0	0	0	126.7
596	F	25.4	Very low	28.4	Very low	174 Å²	174	139.8 Å²	139.8	76%	0.763	80%	0.796	S	S	*	*				94.8	127.1	122.9	-80.3	-55	0	0	0	126.9
597	I	29.1	Very low	28.3	Very low	153 Å²	153	136.2 Å²	136.2	79%	0.785	79%	0.786	S	S	*	*			trans	78.8	134.5	145.9	-69.1	166.6	0	0	0	119.1
598	R	28.3	Very low	28.5	Very low	200 Å²	200	135.5 Å²	135.5	76%	0.755	78%	0.78	S	S	*	*			cis	-170.4	159.2	-19.6	-162.3	176.9	88	179	4.3	110.7
599	E	25.3	Very low	29.1	Very low	140 Å²	140	137.4 Å²	137.4	65%	0.654	78%	0.778	S	S	*	*			trans	79.5	121.9	166	-48.4	-166.3	165.9	0	0	117.4
600	E	23.7	Very low	29.4	Very low	165 Å²	165	135 Å²	135	77%	0.771	77%	0.766	S	S	*	*			cis	71.2	153.1	20.2	-57.5	-62.6	162.3	0	0	116.8
601	P	50.9	Low	29.6	Very low	104 Å²	104	131.8 Å²	131.8	68%	0.675	77%	0.767	S	S	*	*			cis	-137.4	170.9	1.7	38.2	-18.6	0	0	0	118.5
602	D	26.8	Very low	29.6	Very low	144 Å²	144	131.2 Å²	131.2	77%	0.77	77%	0.772	S	S	*	*			trans	39.1	147.5	140.8	-75.5	-45.6	0	0	0	125.6
603	V	29	Very low	29.5	Very low	132 Å²	132	130.4 Å²	130.4	80%	0.8	77%	0.773	S	S	*	*				-177.6	143.4	104	151.2	0	0	0	0	113.8
604	T	29.4	Very low	29.6	Very low	136 Å²	136	133.4 Å²	133.4	83%	0.834	77%	0.768	S	S	*	*			trans	-53.4	163.5	-178.8	54.8	0	0	0	0	119
605	G	26.6	Very low	29.6	Very low	80 Å²	80	137 Å²	137	83%	0.825	77%	0.769	S	S	*	*			trans	-166.3	89.9	161.6	0	0	0	0	0	115.7
606	D	26.1	Very low	29.5	Very low	175 Å²	175	133.4 Å²	133.4	94%	0.936	77%	0.765	S	S	*	*			trans	-73.6	168.7	171.3	177	37.5	0	0	0	112.9
607	G	25	Very low	29.5	Very low	60 Å²	60	131.7 Å²	131.7	62%	0.619	77%	0.768	S	S	*	*			trans	122.5	111.7	154.5	0	0	0	0	0	117.9
608	K	32.7	Very low	29.4	Very low	162 Å²	162	130 Å²	130	70%	0.704	76%	0.764	S	S	*	*			trans	-67.5	158.8	156.7	-136.3	-171.4	-172	-159.4	0	110	D610	K608-D610 VanDerWaalsContact CE-OD1 3.27Å; K608-D610 WeakPolarHBondContact CE-OD1 3.34Å; K608-D610 WeakPolarHBondContact CE-OD2 3.49Å; K608-D610 VanDerWaalsContact NZ-CG 3.26Å; K608-D610 IonicContact NZ-OD1 2.67Å; K608-D610 PolarHBondContact NZ-OD1 2.99Å; K608-D610 VanDerWaalsContact NZ-OD1 3.09Å; K608-D610 IonicContact NZ-OD2 3.59Å; K608-D610 PolarHBondContact NZ-OD2 3.06Å
609	P	38.8	Very low	29.3	Very low	120 Å²	120	128.7 Å²	128.7	78%	0.779	77%	0.767	S	S	*	*				-149.2	164.5	88.7	38.6	-21.9	0	0	0	115.9
610	D	32.7	Very low	29.3	Very low	123 Å²	123	129.6 Å²	129.6	66%	0.658	77%	0.771	S	S	*	*			trans	-94	149.4	166.3	-33.4	-89.6	0	0	0	110.7	K608	K608-D610 VanDerWaalsContact CE-OD1 3.27Å; K608-D610 WeakPolarHBondContact CE-OD1 3.34Å; K608-D610 WeakPolarHBondContact CE-OD2 3.49Å; K608-D610 VanDerWaalsContact NZ-CG 3.26Å; K608-D610 IonicContact NZ-OD1 2.67Å; K608-D610 PolarHBondContact NZ-OD1 2.99Å; K608-D610 VanDerWaalsContact NZ-OD1 3.09Å; K608-D610 IonicContact NZ-OD2 3.59Å; K608-D610 PolarHBondContact NZ-OD2 3.06Å
611	A	31.2	Very low	29.6	Very low	90 Å²	90	129.3 Å²	129.3	74%	0.744	77%	0.77	S	S	*	*			trans	-155.2	120	163.3	0	0	0	0	0	111.6
612	E	29.4	Very low	28.4	Very low	202 Å²	202	134 Å²	134	94%	0.944	78%	0.78	S	S	*	*			trans	31.6	151.4	142	-54.1	179.8	128.2	0	0	122.1
613	G	27	Very low	28.5	Very low	76 Å²	76	135.5 Å²	135.5	78%	0.784	78%	0.782	S	S	*	*			trans	-170.5	-51.5	170.2	0	0	0	0	0	118.4
614	D	28.6	Very low	28.3	Very low	149 Å²	149	139.1 Å²	139.1	80%	0.797	79%	0.787	S	S	*	*			trans	72.8	152	170.6	-156.1	23.6	0	0	0	120.8
615	L	27.6	Very low	28.1	Very low	152 Å²	152	137.8 Å²	137.8	80%	0.796	78%	0.784	S	S	*	*			trans	40.6	100.5	158.5	-90.4	166.3	0	0	0	123.4
616	G	26.1	Very low	28.7	Very low	65 Å²	65	139.7 Å²	139.7	67%	0.67	78%	0.781	S	S	*	*				125.1	145.1	98.7	0	0	0	0	0	121.8
617	V	25.9	Very low	28.8	Very low	138 Å²	138	139 Å²	139	84%	0.836	78%	0.776	S	S	*	*			trans	87.9	89.8	150.1	-168.5	0	0	0	0	120.9
618	V	26.5	Very low	28.9	Very low	116 Å²	116	142 Å²	142	70%	0.703	78%	0.782	S	S	*	*				67.5	124.4	121.2	177.6	0	0	0	0	123
619	E	27.2	Very low	28.7	Very low	174 Å²	174	143.9 Å²	143.9	81%	0.813	79%	0.794	S	S	*	*			trans	90.6	136.4	146.3	-84.8	161.6	-161.6	0	0	126.7
620	E	24.9	Very low	28.5	Very low	158 Å²	158	145.5 Å²	145.5	74%	0.738	80%	0.795	S	S	*	*			trans	63.9	110.8	149.7	-66.2	-167	164	0	0	125.9
621	E	29.8	Very low	28.2	Very low	159 Å²	159	148.6 Å²	148.6	74%	0.743	81%	0.806	S	S	*	*				50.1	129.3	126.8	-58.5	-163.5	160.8	0	0	123.3
622	K	25	Very low	27.9	Very low	202 Å²	202	150.1 Å²	150.1	88%	0.878	81%	0.806	S	S	*	*				-159.6	149.9	119.4	-113.7	163.9	-154.6	75.1	0	117.2
623	E	28.6	Very low	28.1	Very low	176 Å²	176	150 Å²	150	82%	0.822	81%	0.805	S	S	*	*			trans	-76.1	167.6	173.5	-46.1	164.1	102.4	0	0	113.4
624	K	25.2	Very low	28.2	Very low	208 Å²	208	156 Å²	156	90%	0.904	81%	0.81	S	S	*	*				-159	167.9	122.3	-112.9	166.6	-172.8	177.5	0	114.3
625	S	26.3	Very low	28.2	Very low	109 Å²	109	153.4 Å²	153.4	76%	0.762	81%	0.809	S	S	*	*			trans	-126.7	168.1	-155.1	50	0	0	0	0	114.5
626	P	39	Very low	28.6	Very low	119 Å²	119	156.3 Å²	156.3	77%	0.773	82%	0.818	S	S	*	*			trans	-104.8	166.6	-167.9	40	-35.7	0	0	0	115.9
627	I	28.1	Very low	29	Very low	160 Å²	160	156.1 Å²	156.1	82%	0.821	82%	0.816	S	S	*	*			trans	-145.1	111.7	169	-56.2	180	0	0	0	105.3
628	T	27.1	Very low	29.3	Very low	124 Å²	124	158.8 Å²	158.8	76%	0.761	82%	0.82	S	S	*	*				74.1	109.6	69.5	-51.9	0	0	0	0	115.2
629	E	28.2	Very low	29.8	Very low	202 Å²	202	163.4 Å²	163.4	94%	0.944	83%	0.83	S	S	*	*			trans	-157.9	171.9	136.1	-125.7	174.3	-153.1	0	0	112.5
630	L	34.1	Very low	30.4	Very low	153 Å²	153	163.2 Å²	163.2	80%	0.801	83%	0.83	S	S	*	*			trans	-145.2	113	-154.7	-179.5	104.8	0	0	0	114.8
631	Q	26.4	Very low	31.5	Very low	189 Å²	189	160.2 Å²	160.2	88%	0.883	81%	0.814	S	S	*	*			trans	-177.1	142.6	158.8	-103.9	146.6	91.4	0	0	107.1
632	T	24.9	Very low	32.5	Very low	122 Å²	122	163.2 Å²	163.2	75%	0.748	82%	0.819	S	S	*	*			cis	-150.6	141.8	31	-61.3	0	0	0	0	111.4	K634	T632-K634 PolarHBondContact O-N 3.23Å
633	Q	32.8	Very low	34.2	Very low	198 Å²	198	156.2 Å²	156.2	93%	0.925	79%	0.791	S	S	*	*			trans	-85.3	97.9	168.8	-73.8	-178.1	-49.4	0	0	111.7
634	K	29.9	Very low	35.8	Very low	203 Å²	203	150.9 Å²	150.9	88%	0.883	77%	0.768	S	S	*	*			trans	-162.4	54.9	160.1	-135.4	178.3	-175.7	-176.1	0	116.6	T632	T632-K634 PolarHBondContact O-N 3.23Å
635	A	28.4	Very low	37.3	Very low	95 Å²	95	144.8 Å²	144.8	79%	0.785	75%	0.752	S	S	*	*			trans	-153.4	61.9	170.9	0	0	0	0	0	112.3	G637	A635-G637 PolarHBondContact O-N 3.4Å
636	E	36.2	Very low	38.7	Very low	212 Å²	212	143.3 Å²	143.3	99%	0.991	73%	0.733	S	S	*	*			trans	-94.3	84.7	164	-74.2	-166	144.4	0	0	109.5
637	G	33.9	Very low	39.9	Very low	61 Å²	61	138.3 Å²	138.3	63%	0.629	70%	0.7	S	S	*	*	S	Bend	trans	-167.7	132.3	173.3	0	0	0	0	0	106.6	A635	A635-G637 PolarHBondContact O-N 3.4Å
638	E	33.8	Very low	41.4	Very low	195 Å²	195	137.6 Å²	137.6	91%	0.911	69%	0.693	S	S	*	*			trans	54.4	69.3	178.3	-69.5	159.3	-147	0	0	114.6	E640	E638-E640 VanDerWaalsContact C-N 3.29Å; E638-E640 PolarHBondContact O-N 3.09Å; E638-E640 VanDerWaalsContact O-N 3.08Å
639	K	36.9	Very low	43.5	Very low	212 Å²	212	135.8 Å²	135.8	92%	0.922	68%	0.679	S	S	*	*			trans	-64.8	101.5	141.4	-86.3	-172.1	176.6	179.8	0	107.1	F641	K639-F641 PolarHBondContact O-N 2.97Å
640	E	39.5	Very low	45.9	Very low	171 Å²	171	127.5 Å²	127.5	80%	0.799	64%	0.64	S	S	*	*			trans	-47.4	128.6	170.7	-172.7	171.9	-147.8	0	0	110	E638 R642	E638-E640 VanDerWaalsContact C-N 3.29Å; E638-E640 PolarHBondContact O-N 3.09Å; E638-E640 VanDerWaalsContact O-N 3.08Å; E640-R642 PolarHBondContact O-N 3.5Å
641	F	46.7	Very low	48.1	Very low	95 Å²	95	128.1 Å²	128.1	42%	0.417	64%	0.639	S	S	.	*			trans	-74.6	83	176.2	176	-100.1	0	0	0	108.3	K639 L643 V700 K701 M704	K639-F641 PolarHBondContact O-N 2.97Å; F641-L643 HydrophobicContact CE1-CD1 3.8Å; F641-L643 HydrophobicContact CZ-CD1 4.32Å; F641-L643 PolarHBondContact O-N 2.85Å; F641-V700 HydrophobicContact CE1-CG1 4.19Å; F641-K701 HydrophobicContact CB-CD 4.22Å; F641-K701 HydrophobicContact CD1-CB 4.09Å; F641-K701 HydrophobicContact CD2-CB 4.27Å; F641-K701 HydrophobicContact CD2-CD 4.4Å; F641-K701 HydrophobicContact CD2-CG 3.93Å; F641-K701 HydrophobicContact CE1-CB 4.34Å; F641-K701 HydrophobicContact CE2-CB 4.49Å; F641-K701 HydrophobicContact CE2-CG 4.31Å; F641-K701 HydrophobicContact CG-CB 4.06Å; F641-K701 HydrophobicContact CG-CD 4.34Å; F641-K701 HydrophobicContact CG-CG 4.09Å; F641-M704 HydrophobicContact CZ-CB 3.96Å; F641-M704 HydrophobicContact CZ-CG 4.18Å
642	R	51.5	Low	50.9	Low	221 Å²	221	119.8 Å²	119.8	83%	0.834	60%	0.604	S	S	*	*			trans	-72.2	112.9	174.7	-156.9	172.5	-170.4	178.8	2.5	108.4	E640	E640-R642 PolarHBondContact O-N 3.5Å
643	L	59.9	Low	53.8	Low	55 Å²	55	114.2 Å²	114.2	29%	0.288	57%	0.569	S	S	.	*			trans	-55.3	144.1	169.7	-154	70	0	0	0	108.5	F641 L647 V700	F641-L643 HydrophobicContact CE1-CD1 3.8Å; F641-L643 HydrophobicContact CZ-CD1 4.32Å; F641-L643 PolarHBondContact O-N 2.85Å; L643-L647 HydrophobicContact CD1-CD1 3.85Å; L643-L647 HydrophobicContact CD2-CB 3.75Å; L643-L647 HydrophobicContact CD2-CD1 4.49Å; L643-L647 HydrophobicContact CG-CB 3.81Å; L643-L647 HydrophobicContact CG-CD1 3.71Å; L643-L647 HydrophobicContact CG-CG 4.32Å; L643-V700 HydrophobicContact CD1-CG1 3.99Å
644	D	62.3	Low	56.5	Low	65 Å²	65	105.3 Å²	105.3	35%	0.348	53%	0.528	S	S	.	.			trans	-66.2	143.6	178.3	-160.1	-14.3	0	0	0	109.6	M646 L647 R677	D644-M646 PolarHBondContact O-N 3.3Å; D644-L647 HydrophobicContact CB-CD1 3.84Å; D644-L647 WeakPolarHBondContact O-CB 3.48Å; D644-L647 PolarHBondContact O-N 2.89Å; D644-R677 IonicContact OD2-CZ 2.63Å; D644-R677 IonicContact OD2-NH2 2.7Å; D644-R677 PolarHBondContact OD2-NH2 2.67Å
645	S	57.1	Low	59.3	Low	80 Å²	80	102.9 Å²	102.9	56%	0.559	52%	0.52	S	S	*	.	G	3₁₀ helix	trans	-65.5	-22.1	-178.3	-174.1	0	0	0	0	111.8	L647 E648	S645-L647 PolarHBondContact O-N 2.86Å; S645-E648 VanDerWaalsContact CA-OE2 3.27Å; S645-E648 WeakPolarHBondContact CA-OE2 3.48Å; S645-E648 VanDerWaalsContact CB-OE2 3.28Å; S645-E648 WeakPolarHBondContact CB-OE2 3.35Å; S645-E648 WeakPolarHBondContact O-CB 3.19Å; S645-E648 PolarHBondContact O-N 3.29Å; S645-E648 VanDerWaalsContact O-N 3.11Å; S645-E648 PolarHBondContact OG-OE2 3.47Å
646	M	55.8	Low	62.2	Low	77 Å²	77	103.8 Å²	103.8	38%	0.379	51%	0.506	S	S	.	.	G	3₁₀ helix	trans	-61.5	-20.2	168.3	-67.3	-155.8	74.5	0	0	114.6	D644 E648 T670 T671 Y681	D644-M646 PolarHBondContact O-N 3.3Å; M646-E648 VanDerWaalsContact C-N 3.3Å; M646-T670 HydrophobicContact CE-CG2 4.23Å; M646-T670 WeakPolarHBondContact CE-O 3.34Å; M646-T671 HydrophobicContact CE-CG2 4.29Å; M646-Y681 WeakPolarHBondContact O-CE2 3.41Å; M646-Y681 PolarHBondContact O-OH 3.36Å
647	L	63.3	Low	64.9	Low	15 Å²	15	93.7 Å²	93.7	8%	0.079	46%	0.459	C	S	.	.	G	3₁₀ helix	trans	-87.1	1.7	177	-69.8	143.7	0	0	0	112.7	L643 D644 S645 Y681 Y684 M704	L643-L647 HydrophobicContact CD1-CD1 3.85Å; L643-L647 HydrophobicContact CD2-CB 3.75Å; L643-L647 HydrophobicContact CD2-CD1 4.49Å; L643-L647 HydrophobicContact CG-CB 3.81Å; L643-L647 HydrophobicContact CG-CD1 3.71Å; L643-L647 HydrophobicContact CG-CG 4.32Å; D644-L647 HydrophobicContact CB-CD1 3.84Å; D644-L647 WeakPolarHBondContact O-CB 3.48Å; D644-L647 PolarHBondContact O-N 2.89Å; S645-L647 PolarHBondContact O-N 2.86Å; L647-Y681 HydrophobicContact CD2-CD2 3.51Å; L647-Y681 HydrophobicContact CD2-CE2 3.96Å; L647-Y681 HydrophobicContact CG-CD2 4.09Å; L647-Y681 HydrophobicContact CG-CE2 4.32Å; L647-Y684 HydrophobicContact CD2-CD1 3.31Å; L647-Y684 HydrophobicContact CD2-CD2 4.38Å; L647-Y684 HydrophobicContact CD2-CE1 3.92Å; L647-Y684 HydrophobicContact CD2-CG 3.6Å; L647-M704 HydrophobicContact CD1-CE 4.1Å; L647-M704 HydrophobicContact CD2-CE 4.4Å
648	E	59.7	Low	67.6	Low	144 Å²	144	94 Å²	94	67%	0.673	45%	0.446	S	S	*	.	S	Bend	trans	-86.1	-27.9	178	-59.6	174.7	133	0	0	111.9	S645 M646 H650	S645-E648 VanDerWaalsContact CA-OE2 3.27Å; S645-E648 WeakPolarHBondContact CA-OE2 3.48Å; S645-E648 VanDerWaalsContact CB-OE2 3.28Å; S645-E648 WeakPolarHBondContact CB-OE2 3.35Å; S645-E648 WeakPolarHBondContact O-CB 3.19Å; S645-E648 PolarHBondContact O-N 3.29Å; S645-E648 VanDerWaalsContact O-N 3.11Å; S645-E648 PolarHBondContact OG-OE2 3.47Å; M646-E648 VanDerWaalsContact C-N 3.3Å; E648-H650 VanDerWaalsContact C-N 3.26Å; E648-H650 PolarHBondContact O-N 2.76Å
649	D	72.7	Confident	70.5	Confident	86 Å²	86	87.9 Å²	87.9	46%	0.46	42%	0.422	S	S	.	.			trans	-83.5	59	174.9	-175	26.4	0	0	0	112.5	G652 L653 Y681	D649-G652 VanDerWaalsContact OD1-CA 3.24Å; D649-G652 WeakPolarHBondContact OD1-CA 3.48Å; D649-G652 PolarHBondContact OD1-N 3.27Å; D649-L653 PolarHBondContact O-N 3.23Å; D649-Y681 PolarHBondContact O-OH 3.12Å
650	H	77.5	Confident	73.3	Confident	29 Å²	29	78 Å²	78	13%	0.134	38%	0.379	C	S	.	.	H	α-helix	trans	-66.3	-44.4	177.5	177.6	64.3	0	0	0	112	E648 L653 M654 T685 Q688	E648-H650 VanDerWaalsContact C-N 3.26Å; E648-H650 PolarHBondContact O-N 2.76Å; H650-L653 PolarHBondContact O-N 3.33Å; H650-M654 WeakPolarHBondContact O-CG 3.43Å; H650-M654 PolarHBondContact O-N 3.34Å; H650-T685 PolarHBondContact CE1-O 2.86Å; H650-T685 WeakPolarHBondContact ND1-CG2 3.48Å; H650-Q688 PolarHBondContact CD2-NE2 2.97Å; H650-Q688 PolarHBondContact NE2-NE2 3.15Å
651	E	81.4	Confident	76	Confident	166 Å²	166	71.5 Å²	71.5	78%	0.776	35%	0.35	S	S	*	.	H	α-helix	trans	-67.8	-47.8	-175.3	-64	-179.5	172.3	0	0	111.6	L653 M654 E655	E651-L653 PolarHBondContact O-N 3.28Å; E651-M654 PolarHBondContact O-N 2.88Å; E651-M654 VanDerWaalsContact O-N 3.14Å; E651-E655 PolarHBondContact O-N 3.02Å
652	G	83.9	Confident	78.3	Confident	14 Å²	14	67.1 Å²	67.1	14%	0.144	33%	0.331	C	S	.	.	H	α-helix	trans	-69.6	-15.4	178.8	0	0	0	0	0	114.2	D649 K656	D649-G652 VanDerWaalsContact OD1-CA 3.24Å; D649-G652 WeakPolarHBondContact OD1-CA 3.48Å; D649-G652 PolarHBondContact OD1-N 3.27Å; G652-K656 WeakPolarHBondContact O-CD 3.44Å; G652-K656 WeakPolarHBondContact O-CE 3.44Å; G652-K656 WeakPolarHBondContact O-CG 3.08Å; G652-K656 PolarHBondContact O-NZ 2.95Å
653	L	85.7	Confident	80.3	Confident	4 Å²	4	59.5 Å²	59.5	2%	0.021	31%	0.305	C	S	.	.	H	α-helix	trans	-83.2	-45.1	165.4	175.1	58.7	0	0	0	111.7	D649 H650 E651 E655 K656 M657 L667 Y681 T685	D649-L653 PolarHBondContact O-N 3.23Å; H650-L653 PolarHBondContact O-N 3.33Å; E651-L653 PolarHBondContact O-N 3.28Å; L653-E655 VanDerWaalsContact C-N 3.32Å; L653-E655 PolarHBondContact O-N 2.75Å; L653-K656 PolarHBondContact O-N 2.91Å; L653-K656 VanDerWaalsContact O-N 3.11Å; L653-M657 HydrophobicContact CD1-CG 3.86Å; L653-M657 HydrophobicContact CD1-SD 3.79Å; L653-M657 HydrophobicContact CD2-SD 4.14Å; L653-M657 HydrophobicContact CG-CG 4.24Å; L653-M657 HydrophobicContact CG-SD 3.76Å; L653-M657 WeakPolarHBondContact O-CG 3.47Å; L653-M657 PolarHBondContact O-N 2.98Å; L653-L667 HydrophobicContact CD1-CD1 4.08Å; L653-L667 HydrophobicContact CD1-CD2 3.78Å; L653-Y681 HydrophobicContact CD2-CD1 4.15Å; L653-Y681 HydrophobicContact CD2-CD2 4.35Å; L653-Y681 HydrophobicContact CD2-CE1 3.63Å; L653-Y681 HydrophobicContact CD2-CE2 3.84Å; L653-Y681 HydrophobicContact CD2-CG 4.5Å; L653-Y681 VanDerWaalsContact CD2-CZ 3.44Å; L653-T685 HydrophobicContact CB-CG2 4.46Å; L653-T685 HydrophobicContact CD2-CG2 3.62Å; L653-T685 WeakPolarHBondContact CD2-OG1 3.46Å; L653-T685 HydrophobicContact CG-CG2 4.04Å
654	M	91.1	Very high	81.9	Confident	12 Å²	12	56.9 Å²	56.9	6%	0.059	29%	0.291	C	S	.	.	H	α-helix	trans	-61.5	-38.2	-178.4	-74.1	-57.6	-58.7	0	0	112.6	H650 E651 K656 M657 D658 T685 L686 D689 W733	H650-M654 WeakPolarHBondContact O-CG 3.43Å; H650-M654 PolarHBondContact O-N 3.34Å; E651-M654 PolarHBondContact O-N 2.88Å; E651-M654 VanDerWaalsContact O-N 3.14Å; M654-K656 VanDerWaalsContact C-N 3.29Å; M654-K656 PolarHBondContact O-N 2.84Å; M654-M657 PolarHBondContact O-N 2.91Å; M654-D658 PolarHBondContact O-N 3.39Å; M654-T685 HydrophobicContact CG-CG2 3.89Å; M654-T685 HydrophobicContact SD-CG2 3.53Å; M654-T685 VanDerWaalsContact SD-CG2 3.53Å; M654-L686 HydrophobicContact SD-CD2 4.41Å; M654-D689 HydrophobicContact CE-CB 3.66Å; M654-D689 VanDerWaalsContact CE-CG 3.41Å; M654-D689 HydrophobicContact SD-CB 4.02Å; M654-W733 HydrophobicContact CE-CH2 4.06Å; M654-W733 HydrophobicContact CE-CZ2 3.52Å
655	E	88.5	Confident	83.4	Confident	151 Å²	151	56.2 Å²	56.2	71%	0.706	29%	0.285	S	S	*	.	H	α-helix	trans	-54.9	-43.1	173	-176.5	-176.3	-155.7	0	0	112.2	E651 L653	E651-E655 PolarHBondContact O-N 3.02Å; L653-E655 VanDerWaalsContact C-N 3.32Å; L653-E655 PolarHBondContact O-N 2.75Å
656	K	89.3	Confident	85	Confident	115 Å²	115	58.3 Å²	58.3	50%	0.5	29%	0.286	S	S	.	.	H	α-helix	trans	-71.8	-36.8	179.1	-61.2	173.2	-175.7	110.5	0	111.7	G652 L653 M654 T659 F662	G652-K656 WeakPolarHBondContact O-CD 3.44Å; G652-K656 WeakPolarHBondContact O-CE 3.44Å; G652-K656 WeakPolarHBondContact O-CG 3.08Å; G652-K656 PolarHBondContact O-NZ 2.95Å; L653-K656 PolarHBondContact O-N 2.91Å; L653-K656 VanDerWaalsContact O-N 3.11Å; M654-K656 VanDerWaalsContact C-N 3.29Å; M654-K656 PolarHBondContact O-N 2.84Å; K656-T659 PolarHBondContact O-OG1 3.17Å; K656-T659 VanDerWaalsContact O-OG1 3.13Å; K656-F662 HydrophobicContact CB-CD2 4.37Å; K656-F662 HydrophobicContact CB-CE2 4.39Å; K656-F662 WeakPolarHBondContact O-CD2 3.4Å
657	M	93.1	Very high	86.6	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-76.1	-22.2	-178.7	-72.6	-174.2	66.1	0	0	113.7	L653 M654 T659 F662 V682 L686 H730 W733	L653-M657 HydrophobicContact CD1-CG 3.86Å; L653-M657 HydrophobicContact CD1-SD 3.79Å; L653-M657 HydrophobicContact CD2-SD 4.14Å; L653-M657 HydrophobicContact CG-CG 4.24Å; L653-M657 HydrophobicContact CG-SD 3.76Å; L653-M657 WeakPolarHBondContact O-CG 3.47Å; L653-M657 PolarHBondContact O-N 2.98Å; M654-M657 PolarHBondContact O-N 2.91Å; M657-T659 PolarHBondContact O-N 2.74Å; M657-F662 HydrophobicContact CG-CD2 4.03Å; M657-F662 HydrophobicContact CG-CE1 4.38Å; M657-F662 HydrophobicContact CG-CE2 3.85Å; M657-F662 HydrophobicContact CG-CG 4.39Å; M657-F662 HydrophobicContact CG-CZ 4.05Å; M657-V682 HydrophobicContact CE-CG1 3.62Å; M657-V682 HydrophobicContact SD-CG1 4.2Å; M657-V682 HydrophobicContact SD-CG2 4.41Å; M657-L686 HydrophobicContact CE-CD1 3.94Å; M657-L686 HydrophobicContact CE-CD2 3.51Å; M657-L686 HydrophobicContact CE-CG 3.8Å; M657-H730 HydrophobicContact CE-CB 4.37Å; M657-H730 PolarHBondContact O-NE2 3.29Å; M657-W733 HydrophobicContact CB-CZ3 4.4Å; M657-W733 VanDerWaalsContact O-CZ3 3.3Å; M657-W733 WeakPolarHBondContact O-CZ3 3.45Å
658	D	90.6	Very high	87.7	Confident	66 Å²	66	55.8 Å²	55.8	35%	0.353	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-0.5	178.7	-163.7	33.7	0	0	0	114.5	M654 Y734 R738	M654-D658 PolarHBondContact O-N 3.39Å; D658-Y734 WeakPolarHBondContact O-CE2 3.4Å; D658-R738 VanDerWaalsContact OD1-CD 3.28Å; D658-R738 WeakPolarHBondContact OD1-CD 3.49Å; D658-R738 IonicContact OD1-CZ 2.82Å; D658-R738 IonicContact OD1-NE 3.98Å; D658-R738 IonicContact OD1-NH1 3.92Å; D658-R738 PolarHBondContact OD1-NH1 3.14Å
659	T	93.5	Very high	88.8	Confident	68 Å²	68	55.1 Å²	55.1	42%	0.417	28%	0.276	S	S	.	.	S	Bend	trans	-102.5	140.6	173.5	66.7	0	0	0	0	111.6	K656 M657 N661 F662 H730 Y734	K656-T659 PolarHBondContact O-OG1 3.17Å; K656-T659 VanDerWaalsContact O-OG1 3.13Å; M657-T659 PolarHBondContact O-N 2.74Å; T659-N661 PolarHBondContact O-N 3.19Å; T659-F662 WeakPolarHBondContact O-CB 3.24Å; T659-F662 PolarHBondContact O-N 2.91Å; T659-F662 PolarHBondContact OG1-N 3.22Å; T659-H730 PolarHBondContact O-CE1 3.07Å; T659-H730 PolarHBondContact O-NE2 3Å; T659-Y734 VanDerWaalsContact C-CE2 3.5Å
660	W	96.5	Very high	89.1	Confident	3 Å²	3	55.6 Å²	55.6	1%	0.011	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-38.3	171.5	174.6	-114.4	0	0	0	111	F662 A731 Y734 L735 L918 N922 A925 K926 I1042	W660-F662 PolarHBondContact O-N 3.1Å; W660-F662 VanDerWaalsContact O-N 3.16Å; W660-A731 HydrophobicContact CH2-CB 4.04Å; W660-A731 HydrophobicContact CZ3-CB 3.8Å; W660-Y734 HydrophobicContact CB-CD1 4.42Å; W660-Y734 HydrophobicContact CB-CE1 3.81Å; W660-Y734 HydrophobicContact CB-CE2 4.08Å; W660-Y734 HydrophobicContact CD2-CD1 4.41Å; W660-Y734 HydrophobicContact CD2-CE1 4.43Å; W660-Y734 AromaticContact CE3-CD1 3.51Å; W660-Y734 HydrophobicContact CE3-CD1 3.51Å; W660-Y734 AromaticContact CE3-CE1 3.96Å; W660-Y734 HydrophobicContact CE3-CE1 3.96Å; W660-Y734 AromaticContact CE3-CG 3.97Å; W660-Y734 HydrophobicContact CE3-CG 3.97Å; W660-Y734 HydrophobicContact CG-CE1 4.43Å; W660-Y734 HydrophobicContact CZ3-CD1 4.19Å; W660-L735 HydrophobicContact CZ3-CD1 4.47Å; W660-L735 HydrophobicContact CZ3-CD2 4.32Å; W660-L735 HydrophobicContact CZ3-CG 4.12Å; W660-L918 HydrophobicContact CH2-CD2 4.44Å; W660-N922 HydrophobicContact CH2-CB 4Å; W660-N922 HydrophobicContact CZ2-CB 4.07Å; W660-A925 PolarHBondContact NE1-O 2.69Å; W660-K926 HydrophobicContact CD2-CD 4.29Å; W660-K926 HydrophobicContact CG-CD 4.46Å; W660-K926 HydrophobicContact CZ2-CD 4.33Å; W660-K926 WeakPolarHBondContact O-CD 3.35Å; W660-K926 WeakPolarHBondContact O-CE 3.28Å; W660-I1042 HydrophobicContact CD2-CD1 3.93Å; W660-I1042 HydrophobicContact CD2-CG1 3.92Å; W660-I1042 HydrophobicContact CE3-CD1 4.03Å; W660-I1042 HydrophobicContact CG-CG1 4.12Å; W660-I1042 HydrophobicContact CH2-CD1 4.14Å; W660-I1042 HydrophobicContact CZ2-CD1 4.06Å; W660-I1042 HydrophobicContact CZ2-CG1 4.15Å; W660-I1042 HydrophobicContact CZ2-CG2 4.13Å; W660-I1042 HydrophobicContact CZ3-CD1 4.12Å
661	N	96.8	Very high	89.2	Confident	36 Å²	36	54.8 Å²	54.8	19%	0.193	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.8	40	177.1	-63.6	-46.2	0	0	0	112.6	T659 Q663 V927 L930	T659-N661 PolarHBondContact O-N 3.19Å; N661-Q663 PolarHBondContact O-N 3.33Å; N661-Q663 PolarHBondContact O-NE2 3.34Å; N661-V927 HydrophobicContact CB-CB 4.32Å; N661-V927 HydrophobicContact CB-CG1 3.83Å; N661-V927 WeakPolarHBondContact OD1-CB 3.22Å; N661-V927 PolarHBondContact OD1-N 2.84Å; N661-L930 HydrophobicContact CB-CD1 4.43Å
662	F	94.2	Very high	88.8	Confident	3 Å²	3	48.8 Å²	48.8	1%	0.013	26%	0.262	C	S	.	.			trans	-50.9	123.6	173.9	165	-126.9	0	0	0	110.6	K656 M657 T659 W660 I664 L667 H730 L930	K656-F662 HydrophobicContact CB-CD2 4.37Å; K656-F662 HydrophobicContact CB-CE2 4.39Å; K656-F662 WeakPolarHBondContact O-CD2 3.4Å; M657-F662 HydrophobicContact CG-CD2 4.03Å; M657-F662 HydrophobicContact CG-CE1 4.38Å; M657-F662 HydrophobicContact CG-CE2 3.85Å; M657-F662 HydrophobicContact CG-CG 4.39Å; M657-F662 HydrophobicContact CG-CZ 4.05Å; T659-F662 WeakPolarHBondContact O-CB 3.24Å; T659-F662 PolarHBondContact O-N 2.91Å; T659-F662 PolarHBondContact OG1-N 3.22Å; W660-F662 PolarHBondContact O-N 3.1Å; W660-F662 VanDerWaalsContact O-N 3.16Å; F662-I664 HydrophobicContact CD1-CB 3.88Å; F662-I664 HydrophobicContact CD1-CG1 4.45Å; F662-I664 HydrophobicContact CE1-CB 3.61Å; F662-I664 HydrophobicContact CE1-CD1 4.28Å; F662-I664 HydrophobicContact CE1-CG1 3.77Å; F662-I664 HydrophobicContact CZ-CB 4.22Å; F662-I664 HydrophobicContact CZ-CG1 4.36Å; F662-I664 PolarHBondContact O-N 2.9Å; F662-L667 HydrophobicContact CZ-CB 4.11Å; F662-L667 HydrophobicContact CZ-CD2 3.75Å; F662-H730 VanDerWaalsContact CB-CE1 3.44Å; F662-H730 WeakPolarHBondContact CB-CE1 3.18Å; F662-H730 HydrophobicContact CD1-CB 4.35Å; F662-H730 AromaticContact CD1-CG 3.85Å; F662-L930 WeakPolarHBondContact O-CD1 3.26Å
663	Q	93.1	Very high	88.7	Confident	61 Å²	61	48.7 Å²	48.7	29%	0.285	26%	0.261	S	S	.	.			trans	-78.8	62.8	-177	-63.9	-55.1	-51.1	0	0	111.8	N661 F665 E666 L667	N661-Q663 PolarHBondContact O-N 3.33Å; N661-Q663 PolarHBondContact O-NE2 3.34Å; Q663-F665 PolarHBondContact O-N 2.92Å; Q663-E666 HydrophobicContact CB-CB 4.39Å; Q663-E666 HydrophobicContact CB-CG 4.02Å; Q663-E666 WeakPolarHBondContact O-CB 3.3Å; Q663-E666 PolarHBondContact O-N 3.17Å; Q663-L667 PolarHBondContact O-N 3.04Å
664	I	94.8	Very high	87.8	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-51	-35.9	-175.2	-171.1	171.6	0	0	0	113.8	F662 E666 L667 V668 I678 V723 T726 D727 W934	F662-I664 HydrophobicContact CD1-CB 3.88Å; F662-I664 HydrophobicContact CD1-CG1 4.45Å; F662-I664 HydrophobicContact CE1-CB 3.61Å; F662-I664 HydrophobicContact CE1-CD1 4.28Å; F662-I664 HydrophobicContact CE1-CG1 3.77Å; F662-I664 HydrophobicContact CZ-CB 4.22Å; F662-I664 HydrophobicContact CZ-CG1 4.36Å; F662-I664 PolarHBondContact O-N 2.9Å; I664-E666 VanDerWaalsContact C-N 3.28Å; I664-E666 PolarHBondContact O-N 3.47Å; I664-L667 WeakPolarHBondContact O-CB 3.42Å; I664-L667 PolarHBondContact O-N 2.9Å; I664-L667 VanDerWaalsContact O-N 3.13Å; I664-V668 WeakPolarHBondContact O-CG2 3.45Å; I664-V668 PolarHBondContact O-N 3.22Å; I664-I678 HydrophobicContact CG1-CD1 3.92Å; I664-V723 HydrophobicContact CD1-CG1 3.79Å; I664-V723 WeakPolarHBondContact CD1-O 3.29Å; I664-V723 HydrophobicContact CG1-CG1 3.95Å; I664-T726 HydrophobicContact CD1-CG2 3.84Å; I664-D727 HydrophobicContact CD1-CB 3.74Å; I664-W934 HydrophobicContact CG2-CZ2 4.16Å
665	F	93.6	Very high	86.6	Confident	51 Å²	51	61.7 Å²	61.7	22%	0.224	33%	0.329	C	S	.	.	H	α-helix	trans	-66.2	-26.1	178.7	-63.2	-78.4	0	0	0	113.6	Q663 V668 L930 K933 W934	Q663-F665 PolarHBondContact O-N 2.92Å; F665-V668 WeakPolarHBondContact O-CB 3.43Å; F665-V668 PolarHBondContact O-N 3.46Å; F665-L930 HydrophobicContact CD2-CD2 3.77Å; F665-L930 HydrophobicContact CE2-CD2 4.01Å; F665-K933 HydrophobicContact CD2-CB 4.38Å; F665-K933 HydrophobicContact CD2-CD 3.49Å; F665-K933 VanDerWaalsContact CD2-CD 3.49Å; F665-K933 HydrophobicContact CE2-CB 3.75Å; F665-K933 HydrophobicContact CE2-CD 3.74Å; F665-K933 HydrophobicContact CE2-CG 4.4Å; F665-K933 HydrophobicContact CG-CD 3.93Å; F665-K933 HydrophobicContact CZ-CB 3.83Å; F665-K933 HydrophobicContact CZ-CD 4.37Å; F665-W934 HydrophobicContact CE1-CH2 4.3Å; F665-W934 HydrophobicContact CE1-CZ3 4.45Å; F665-W934 HydrophobicContact CE2-CD2 4.44Å; F665-W934 HydrophobicContact CE2-CZ2 4.15Å; F665-W934 AromaticContact CZ-CD2 3.89Å; F665-W934 HydrophobicContact CZ-CD2 3.89Å; F665-W934 AromaticContact CZ-CE2 3.74Å; F665-W934 HydrophobicContact CZ-CE3 4.02Å; F665-W934 AromaticContact CZ-CH2 3.87Å; F665-W934 HydrophobicContact CZ-CH2 3.87Å; F665-W934 AromaticContact CZ-CZ2 3.72Å; F665-W934 HydrophobicContact CZ-CZ2 3.72Å; F665-W934 HydrophobicContact CZ-CZ3 4.03Å
666	E	90.4	Very high	85.9	Confident	124 Å²	124	54.9 Å²	54.9	58%	0.579	30%	0.299	S	S	*	.	H	α-helix	trans	-76.3	-33.7	173.1	-59.7	178.1	-179.5	0	0	111.1	Q663 I664 V668 T670	Q663-E666 HydrophobicContact CB-CB 4.39Å; Q663-E666 HydrophobicContact CB-CG 4.02Å; Q663-E666 WeakPolarHBondContact O-CB 3.3Å; Q663-E666 PolarHBondContact O-N 3.17Å; I664-E666 VanDerWaalsContact C-N 3.28Å; I664-E666 PolarHBondContact O-N 3.47Å; E666-V668 VanDerWaalsContact C-N 3.33Å; E666-T670 PolarHBondContact O-N 3.41Å; E666-T670 VanDerWaalsContact O-N 3.15Å; E666-T670 PolarHBondContact O-OG1 3.31Å
667	L	88.4	Confident	85.8	Confident	16 Å²	16	54.7 Å²	54.7	8%	0.084	30%	0.295	C	S	.	.	H	α-helix	trans	-67.5	-33.2	170.1	-171.5	66.7	0	0	0	111.7	L653 F662 Q663 I664 D669 T670 T671 I678 Y681 V682	L653-L667 HydrophobicContact CD1-CD1 4.08Å; L653-L667 HydrophobicContact CD1-CD2 3.78Å; F662-L667 HydrophobicContact CZ-CB 4.11Å; F662-L667 HydrophobicContact CZ-CD2 3.75Å; Q663-L667 PolarHBondContact O-N 3.04Å; I664-L667 WeakPolarHBondContact O-CB 3.42Å; I664-L667 PolarHBondContact O-N 2.9Å; I664-L667 VanDerWaalsContact O-N 3.13Å; L667-D669 PolarHBondContact O-N 3.19Å; L667-T670 PolarHBondContact O-N 3.46Å; L667-T671 HydrophobicContact CD1-CG2 3.67Å; L667-T671 HydrophobicContact CG-CG2 3.76Å; L667-T671 WeakPolarHBondContact O-CB 3.34Å; L667-T671 VanDerWaalsContact O-CG2 3.3Å; L667-T671 WeakPolarHBondContact O-CG2 3.44Å; L667-T671 PolarHBondContact O-N 2.79Å; L667-T671 PolarHBondContact O-OG1 2.68Å; L667-I678 HydrophobicContact CB-CD1 4.13Å; L667-I678 HydrophobicContact CD2-CD1 4.07Å; L667-I678 HydrophobicContact CD2-CG1 3.83Å; L667-I678 HydrophobicContact CG-CD1 4.07Å; L667-I678 HydrophobicContact CG-CG1 4.06Å; L667-Y681 HydrophobicContact CD1-CE1 4.35Å; L667-V682 HydrophobicContact CD2-CG2 3.63Å
668	V	87.4	Confident	85.8	Confident	22 Å²	22	54.7 Å²	54.7	13%	0.133	30%	0.295	C	S	.	.	H	α-helix	trans	-56.2	-51.2	174.3	171.1	0	0	0	0	110.7	I664 F665 E666 T670 T671 G673 I678 V723	I664-V668 WeakPolarHBondContact O-CG2 3.45Å; I664-V668 PolarHBondContact O-N 3.22Å; F665-V668 WeakPolarHBondContact O-CB 3.43Å; F665-V668 PolarHBondContact O-N 3.46Å; E666-V668 VanDerWaalsContact C-N 3.33Å; V668-T670 PolarHBondContact O-N 3.44Å; V668-T671 PolarHBondContact O-N 3.4Å; V668-T671 PolarHBondContact O-OG1 3.45Å; V668-G673 WeakPolarHBondContact O-CA 3.29Å; V668-G673 PolarHBondContact O-N 2.91Å; V668-I678 HydrophobicContact CB-CD1 4.42Å; V668-I678 HydrophobicContact CG2-CD1 3.56Å; V668-V723 HydrophobicContact CG2-CB 4.31Å; V668-V723 HydrophobicContact CG2-CG1 3.54Å; V668-V723 HydrophobicContact CG2-CG2 3.7Å
669	D	82.3	Confident	86.1	Confident	131 Å²	131	51.5 Å²	51.5	70%	0.701	28%	0.278	S	S	*	.	H	α-helix	trans	-64.2	-42.6	179	-74.9	-26	0	0	0	111.6	L667 T671 G672	L667-D669 PolarHBondContact O-N 3.19Å; D669-T671 VanDerWaalsContact C-N 3.32Å; D669-T671 PolarHBondContact O-N 3.16Å; D669-G672 PolarHBondContact O-N 3.22Å
670	T	79.4	Confident	86.2	Confident	95 Å²	95	48.3 Å²	48.3	58%	0.583	26%	0.258	S	S	*	.	H	α-helix	trans	-61.9	-36.7	178.6	-53.1	0	0	0	0	112.6	M646 E666 L667 V668 G672	M646-T670 HydrophobicContact CE-CG2 4.23Å; M646-T670 WeakPolarHBondContact CE-O 3.34Å; E666-T670 PolarHBondContact O-N 3.41Å; E666-T670 VanDerWaalsContact O-N 3.15Å; E666-T670 PolarHBondContact O-OG1 3.31Å; L667-T670 PolarHBondContact O-N 3.46Å; V668-T670 PolarHBondContact O-N 3.44Å; T670-G672 PolarHBondContact O-N 2.64Å
671	T	79.8	Confident	85.9	Confident	12 Å²	12	49 Å²	49	7%	0.074	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.8	9.3	-175.5	54.9	0	0	0	0	114.9	M646 L667 V668 D669 G676 R677 Y681	M646-T671 HydrophobicContact CE-CG2 4.29Å; L667-T671 HydrophobicContact CD1-CG2 3.67Å; L667-T671 HydrophobicContact CG-CG2 3.76Å; L667-T671 WeakPolarHBondContact O-CB 3.34Å; L667-T671 VanDerWaalsContact O-CG2 3.3Å; L667-T671 WeakPolarHBondContact O-CG2 3.44Å; L667-T671 PolarHBondContact O-N 2.79Å; L667-T671 PolarHBondContact O-OG1 2.68Å; V668-T671 PolarHBondContact O-N 3.4Å; V668-T671 PolarHBondContact O-OG1 3.45Å; D669-T671 VanDerWaalsContact C-N 3.32Å; D669-T671 PolarHBondContact O-N 3.16Å; T671-G676 WeakPolarHBondContact O-CA 3.46Å; T671-R677 PolarHBondContact O-N 2.76Å; T671-Y681 HydrophobicContact CG2-CD1 3.74Å; T671-Y681 HydrophobicContact CG2-CE1 4.31Å
672	G	72.8	Confident	85.9	Confident	41 Å²	41	47.2 Å²	47.2	42%	0.423	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	100.4	15.3	178.2	0	0	0	0	0	115.3	D669 T670 T675 G676	D669-G672 PolarHBondContact O-N 3.22Å; T670-G672 PolarHBondContact O-N 2.64Å; G672-T675 CarbonylContact O-C 3.57Å; G672-T675 PolarHBondContact O-N 2.68Å; G672-T675 PolarHBondContact O-OG1 3.07Å; G672-T675 VanDerWaalsContact O-OG1 3.12Å; G672-G676 PolarHBondContact O-N 3.08Å; G672-G676 VanDerWaalsContact O-N 3.1Å
673	G	80.6	Confident	86	Confident	12 Å²	12	47.1 Å²	47.1	12%	0.124	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	62.2	-131	167.7	0	0	0	0	0	114.1	V668 T675 G676 R722	V668-G673 WeakPolarHBondContact O-CA 3.29Å; V668-G673 PolarHBondContact O-N 2.91Å; G673-T675 PolarHBondContact O-N 3.04Å; G673-T675 VanDerWaalsContact O-N 3.14Å; G673-G676 PolarHBondContact O-N 2.74Å; G673-R722 PolarHBondContact O-NH1 3.48Å; G673-R722 PolarHBondContact O-NH2 3.48Å
674	K	66.8	Low	86.2	Confident	154 Å²	154	45.2 Å²	45.2	67%	0.67	24%	0.242	S	C	*	.	G	3₁₀ helix	trans	-63.1	-14.7	177.6	-87.8	-178	174.1	-80.2	0	114.6	D716 R722	K674-D716 IonicContact NZ-OD1 3.62Å; K674-D716 PolarHBondContact NZ-OD1 3.41Å; K674-D716 IonicContact NZ-OD2 3.55Å; K674-D716 PolarHBondContact NZ-OD2 3.48Å; K674-R722 VanDerWaalsContact CA-NH2 3.32Å; K674-R722 PolarHBondContact O-NH2 3.14Å
675	T	65.9	Low	86.2	Confident	135 Å²	135	45.3 Å²	45.3	83%	0.828	24%	0.242	S	C	*	.	G	3₁₀ helix	trans	-113.7	11.3	173.3	46.1	0	0	0	0	113.3	G672 G673	G672-T675 CarbonylContact O-C 3.57Å; G672-T675 PolarHBondContact O-N 2.68Å; G672-T675 PolarHBondContact O-OG1 3.07Å; G672-T675 VanDerWaalsContact O-OG1 3.12Å; G673-T675 PolarHBondContact O-N 3.04Å; G673-T675 VanDerWaalsContact O-N 3.14Å
676	G	75.6	Confident	86.3	Confident	8 Å²	8	42.9 Å²	42.9	8%	0.082	23%	0.231	C	C	.	.			trans	-78.5	173.3	-174.8	0	0	0	0	0	115.3	T671 G672 G673 R722	T671-G676 WeakPolarHBondContact O-CA 3.46Å; G672-G676 PolarHBondContact O-N 3.08Å; G672-G676 VanDerWaalsContact O-N 3.1Å; G673-G676 PolarHBondContact O-N 2.74Å; G676-R722 PolarHBondContact O-NH1 3.25Å
677	R	86.6	Confident	86.6	Confident	110 Å²	110	37 Å²	37	42%	0.415	20%	0.204	S	C	.	.			trans	-117.1	45.7	-177.9	-67.1	-162.6	-69.5	171.6	-5.2	112.8	D644 T671 S680 Y681 E711	D644-R677 IonicContact OD2-CZ 2.63Å; D644-R677 IonicContact OD2-NH2 2.7Å; D644-R677 PolarHBondContact OD2-NH2 2.67Å; T671-R677 PolarHBondContact O-N 2.76Å; R677-S680 PolarHBondContact O-OG 2.85Å; R677-Y681 WeakPolarHBondContact O-CB 3.31Å; R677-Y681 PolarHBondContact O-N 2.92Å; R677-E711 VanDerWaalsContact C-OE2 3.26Å; R677-E711 WeakPolarHBondContact CA-OE1 3.3Å; R677-E711 VanDerWaalsContact CA-OE2 3.31Å; R677-E711 WeakPolarHBondContact CA-OE2 3.34Å
678	I	93.5	Very high	86.9	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-65.1	-43.7	-173	-164.1	178.5	0	0	0	112.5	I664 L667 V668 Y681 V682 E711 V723 T726	I664-I678 HydrophobicContact CG1-CD1 3.92Å; L667-I678 HydrophobicContact CB-CD1 4.13Å; L667-I678 HydrophobicContact CD2-CD1 4.07Å; L667-I678 HydrophobicContact CD2-CG1 3.83Å; L667-I678 HydrophobicContact CG-CD1 4.07Å; L667-I678 HydrophobicContact CG-CG1 4.06Å; V668-I678 HydrophobicContact CB-CD1 4.42Å; V668-I678 HydrophobicContact CG2-CD1 3.56Å; I678-Y681 PolarHBondContact O-N 3.5Å; I678-V682 HydrophobicContact CG1-CG2 4.37Å; I678-V682 WeakPolarHBondContact O-CB 3.24Å; I678-V682 WeakPolarHBondContact O-CG2 3.45Å; I678-V682 PolarHBondContact O-N 2.89Å; I678-E711 PolarHBondContact N-OE1 2.93Å; I678-V723 HydrophobicContact CG2-CG2 4.48Å; I678-T726 HydrophobicContact CD1-CG2 4.41Å; I678-T726 HydrophobicContact CG1-CG2 4.21Å
679	L	96.2	Very high	87.2	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-70	-47.2	-176.1	177.4	63.6	0	0	0	110.7	Y681 V682 T683 E711 Y714 R722 A725 T726 L729 A802	L679-Y681 VanDerWaalsContact C-N 3.33Å; L679-Y681 PolarHBondContact O-N 2.95Å; L679-V682 PolarHBondContact O-N 3.4Å; L679-T683 WeakPolarHBondContact O-CB 3.43Å; L679-T683 PolarHBondContact O-N 3.41Å; L679-T683 PolarHBondContact O-OG1 3.45Å; L679-E711 HydrophobicContact CB-CB 4.25Å; L679-E711 HydrophobicContact CB-CG 3.99Å; L679-E711 HydrophobicContact CD2-CB 4.27Å; L679-E711 PolarHBondContact N-OE1 2.81Å; L679-E711 PolarHBondContact N-OE2 2.95Å; L679-Y714 HydrophobicContact CD2-CD2 4.14Å; L679-Y714 HydrophobicContact CD2-CE2 3.87Å; L679-R722 HydrophobicContact CB-CB 4.33Å; L679-R722 HydrophobicContact CD2-CB 4.42Å; L679-A725 HydrophobicContact CD1-CB 4.22Å; L679-A725 HydrophobicContact CD2-CB 4.23Å; L679-T726 VanDerWaalsContact CA-OG1 3.26Å; L679-T726 WeakPolarHBondContact CA-OG1 3.41Å; L679-T726 WeakPolarHBondContact CB-OG1 3.21Å; L679-T726 WeakPolarHBondContact CD1-OG1 3.48Å; L679-L729 HydrophobicContact CD1-CD2 4.07Å; L679-A802 HydrophobicContact CD1-CB 4.14Å
680	S	94.7	Very high	87.8	Confident	1 Å²	1	31.5 Å²	31.5	1%	0.007	17%	0.172	C	C	.	.	H	α-helix	trans	-67.6	-32.5	177.9	52.9	0	0	0	0	112.7	R677 Y684 E711	R677-S680 PolarHBondContact O-OG 2.85Å; S680-Y684 WeakPolarHBondContact O-CB 3.49Å; S680-Y684 PolarHBondContact O-N 2.89Å; S680-E711 WeakPolarHBondContact CB-OE2 3.43Å; S680-E711 PolarHBondContact N-OE2 3.48Å; S680-E711 PolarHBondContact OG-OE2 3.45Å
681	Y	92.1	Very high	88.6	Confident	16 Å²	16	28.4 Å²	28.4	6%	0.063	15%	0.154	C	C	.	.	H	α-helix	trans	-67.2	-53.1	171.7	-178.9	-153.1	0	0	0	112	M646 L647 D649 L653 L667 T671 R677 I678 L679 T683 Y684 T685	M646-Y681 WeakPolarHBondContact O-CE2 3.41Å; M646-Y681 PolarHBondContact O-OH 3.36Å; L647-Y681 HydrophobicContact CD2-CD2 3.51Å; L647-Y681 HydrophobicContact CD2-CE2 3.96Å; L647-Y681 HydrophobicContact CG-CD2 4.09Å; L647-Y681 HydrophobicContact CG-CE2 4.32Å; D649-Y681 PolarHBondContact O-OH 3.12Å; L653-Y681 HydrophobicContact CD2-CD1 4.15Å; L653-Y681 HydrophobicContact CD2-CD2 4.35Å; L653-Y681 HydrophobicContact CD2-CE1 3.63Å; L653-Y681 HydrophobicContact CD2-CE2 3.84Å; L653-Y681 HydrophobicContact CD2-CG 4.5Å; L653-Y681 VanDerWaalsContact CD2-CZ 3.44Å; L667-Y681 HydrophobicContact CD1-CE1 4.35Å; T671-Y681 HydrophobicContact CG2-CD1 3.74Å; T671-Y681 HydrophobicContact CG2-CE1 4.31Å; R677-Y681 WeakPolarHBondContact O-CB 3.31Å; R677-Y681 PolarHBondContact O-N 2.92Å; I678-Y681 PolarHBondContact O-N 3.5Å; L679-Y681 VanDerWaalsContact C-N 3.33Å; L679-Y681 PolarHBondContact O-N 2.95Å; Y681-T683 VanDerWaalsContact C-N 3.34Å; Y681-T683 PolarHBondContact O-N 2.82Å; Y681-Y684 WeakPolarHBondContact O-CB 3.42Å; Y681-Y684 PolarHBondContact O-N 3.39Å; Y681-T685 WeakPolarHBondContact CE2-OG1 3.37Å; Y681-T685 PolarHBondContact O-N 3.06Å; Y681-T685 PolarHBondContact O-OG1 3.28Å; Y681-T685 VanDerWaalsContact O-OG1 3.06Å
682	V	95.4	Very high	89.4	Confident	0 Å²	0	27.8 Å²	27.8	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-63	-39.8	-179	169.3	0	0	0	0	111.8	M657 L667 I678 L679 Y684 T685 L686 T726 L729	M657-V682 HydrophobicContact CE-CG1 3.62Å; M657-V682 HydrophobicContact SD-CG1 4.2Å; M657-V682 HydrophobicContact SD-CG2 4.41Å; L667-V682 HydrophobicContact CD2-CG2 3.63Å; I678-V682 HydrophobicContact CG1-CG2 4.37Å; I678-V682 WeakPolarHBondContact O-CB 3.24Å; I678-V682 WeakPolarHBondContact O-CG2 3.45Å; I678-V682 PolarHBondContact O-N 2.89Å; L679-V682 PolarHBondContact O-N 3.4Å; V682-Y684 VanDerWaalsContact C-N 3.33Å; V682-Y684 PolarHBondContact O-N 3.01Å; V682-T685 PolarHBondContact O-N 3.13Å; V682-L686 HydrophobicContact CG1-CD1 4.03Å; V682-L686 HydrophobicContact CG1-CG 4.31Å; V682-L686 WeakPolarHBondContact O-CG 3.41Å; V682-L686 PolarHBondContact O-N 3.11Å; V682-T726 HydrophobicContact CB-CG2 3.76Å; V682-T726 HydrophobicContact CG1-CG2 3.84Å; V682-T726 HydrophobicContact CG2-CG2 3.7Å; V682-L729 HydrophobicContact CG1-CD2 4.06Å
683	T	97.3	Very high	90.5	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-63.3	-39.6	176.5	-43.3	0	0	0	0	111.4	L679 Y681 F687 F703 F707 L729	L679-T683 WeakPolarHBondContact O-CB 3.43Å; L679-T683 PolarHBondContact O-N 3.41Å; L679-T683 PolarHBondContact O-OG1 3.45Å; Y681-T683 VanDerWaalsContact C-N 3.34Å; Y681-T683 PolarHBondContact O-N 2.82Å; T683-F687 HydrophobicContact CG2-CD2 4.02Å; T683-F687 HydrophobicContact CG2-CE2 3.88Å; T683-F687 WeakPolarHBondContact O-CB 3.26Å; T683-F687 WeakPolarHBondContact O-CD2 3.44Å; T683-F687 PolarHBondContact O-N 3.45Å; T683-F687 VanDerWaalsContact O-N 3.11Å; T683-F703 HydrophobicContact CG2-CE2 4.5Å; T683-F703 HydrophobicContact CG2-CZ 3.87Å; T683-F707 HydrophobicContact CG2-CD1 4.07Å; T683-F707 HydrophobicContact CG2-CD2 4.46Å; T683-F707 HydrophobicContact CG2-CE1 3.88Å; T683-F707 HydrophobicContact CG2-CE2 4.28Å; T683-F707 HydrophobicContact CG2-CG 4.39Å; T683-F707 HydrophobicContact CG2-CZ 4Å; T683-L729 HydrophobicContact CG2-CD2 4.23Å; T683-L729 VanDerWaalsContact OG1-CD2 3.24Å; T683-L729 WeakPolarHBondContact OG1-CD2 3.33Å
684	Y	95.7	Very high	91.2	Very high	22 Å²	22	31.7 Å²	31.7	9%	0.086	15%	0.154	C	C	.	.	H	α-helix	trans	-60.7	-51.2	173.4	175.9	-87.4	0	0	0	111.5	L647 S680 Y681 V682 L686 F687 Q688 F693 V700 F703 M704	L647-Y684 HydrophobicContact CD2-CD1 3.31Å; L647-Y684 HydrophobicContact CD2-CD2 4.38Å; L647-Y684 HydrophobicContact CD2-CE1 3.92Å; L647-Y684 HydrophobicContact CD2-CG 3.6Å; S680-Y684 WeakPolarHBondContact O-CB 3.49Å; S680-Y684 PolarHBondContact O-N 2.89Å; Y681-Y684 WeakPolarHBondContact O-CB 3.42Å; Y681-Y684 PolarHBondContact O-N 3.39Å; V682-Y684 VanDerWaalsContact C-N 3.33Å; V682-Y684 PolarHBondContact O-N 3.01Å; Y684-L686 VanDerWaalsContact C-N 3.34Å; Y684-L686 PolarHBondContact O-N 3.48Å; Y684-F687 PolarHBondContact O-N 3.48Å; Y684-F687 VanDerWaalsContact O-N 3.12Å; Y684-Q688 VanDerWaalsContact CZ-OE1 3.32Å; Y684-Q688 PolarHBondContact O-N 3.41Å; Y684-Q688 PolarHBondContact OH-OE1 2.96Å; Y684-F693 AromaticContact CD2-CE2 3.85Å; Y684-F693 HydrophobicContact CD2-CE2 3.85Å; Y684-F693 AromaticContact CD2-CZ 3.51Å; Y684-F693 HydrophobicContact CD2-CZ 3.51Å; Y684-F693 AromaticContact CE2-CE2 3.8Å; Y684-F693 HydrophobicContact CE2-CE2 3.8Å; Y684-F693 AromaticContact CE2-CZ 3.73Å; Y684-F693 HydrophobicContact CE2-CZ 3.73Å; Y684-F693 HydrophobicContact CG-CE2 4.43Å; Y684-F693 HydrophobicContact CG-CZ 4.34Å; Y684-V700 HydrophobicContact CD2-CG1 4.21Å; Y684-V700 HydrophobicContact CE2-CG1 3.64Å; Y684-V700 HydrophobicContact CE2-CG2 4.28Å; Y684-F703 HydrophobicContact CD2-CD1 4.47Å; Y684-F703 HydrophobicContact CD2-CE1 4.29Å; Y684-M704 HydrophobicContact CD2-CG 4.46Å; Y684-M704 HydrophobicContact CD2-SD 3.86Å; Y684-M704 HydrophobicContact CG-SD 4.13Å
685	T	94.8	Very high	92.6	Very high	1 Å²	1	26.2 Å²	26.2	1%	0.006	13%	0.131	C	C	.	.	H	α-helix	trans	-58.6	-44.9	-177.1	-56.7	0	0	0	0	111.4	H650 L653 M654 Y681 V682 F687 Q688 D689	H650-T685 PolarHBondContact CE1-O 2.86Å; H650-T685 WeakPolarHBondContact ND1-CG2 3.48Å; L653-T685 HydrophobicContact CB-CG2 4.46Å; L653-T685 HydrophobicContact CD2-CG2 3.62Å; L653-T685 WeakPolarHBondContact CD2-OG1 3.46Å; L653-T685 HydrophobicContact CG-CG2 4.04Å; M654-T685 HydrophobicContact CG-CG2 3.89Å; M654-T685 HydrophobicContact SD-CG2 3.53Å; M654-T685 VanDerWaalsContact SD-CG2 3.53Å; Y681-T685 WeakPolarHBondContact CE2-OG1 3.37Å; Y681-T685 PolarHBondContact O-N 3.06Å; Y681-T685 PolarHBondContact O-OG1 3.28Å; Y681-T685 VanDerWaalsContact O-OG1 3.06Å; V682-T685 PolarHBondContact O-N 3.13Å; T685-F687 PolarHBondContact O-N 3.33Å; T685-Q688 PolarHBondContact O-N 3.07Å; T685-D689 PolarHBondContact O-N 3.22Å
686	L	96.6	Very high	94	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-67.8	-33.3	177.2	-67.2	-177.7	0	0	0	113.5	M654 M657 V682 Y684 Q688 M690 L729 W733	M654-L686 HydrophobicContact SD-CD2 4.41Å; M657-L686 HydrophobicContact CE-CD1 3.94Å; M657-L686 HydrophobicContact CE-CD2 3.51Å; M657-L686 HydrophobicContact CE-CG 3.8Å; V682-L686 HydrophobicContact CG1-CD1 4.03Å; V682-L686 HydrophobicContact CG1-CG 4.31Å; V682-L686 WeakPolarHBondContact O-CG 3.41Å; V682-L686 PolarHBondContact O-N 3.11Å; Y684-L686 VanDerWaalsContact C-N 3.34Å; Y684-L686 PolarHBondContact O-N 3.48Å; L686-Q688 VanDerWaalsContact C-N 3.3Å; L686-Q688 PolarHBondContact O-N 3.39Å; L686-M690 WeakPolarHBondContact O-CB 3.46Å; L686-M690 WeakPolarHBondContact O-CG 3.34Å; L686-M690 PolarHBondContact O-N 3.16Å; L686-L729 HydrophobicContact CD1-CD1 4.02Å; L686-L729 HydrophobicContact CD1-CD2 4.37Å; L686-L729 HydrophobicContact CD1-CG 3.82Å; L686-W733 HydrophobicContact CD1-CB 3.89Å; L686-W733 HydrophobicContact CD1-CG 4.07Å; L686-W733 HydrophobicContact CD2-CB 4.33Å; L686-W733 HydrophobicContact CD2-CD2 3.49Å; L686-W733 VanDerWaalsContact CD2-CD2 3.49Å; L686-W733 HydrophobicContact CD2-CE3 4.08Å; L686-W733 HydrophobicContact CD2-CG 3.59Å; L686-W733 HydrophobicContact CD2-CZ2 4.21Å; L686-W733 HydrophobicContact CG-CG 4.35Å
687	F	97	Very high	95	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-70.2	-26.7	173.9	-89.6	-120.6	0	0	0	112.8	T683 Y684 T685 C691 L692 F693 I698 F703 M795 V799	T683-F687 HydrophobicContact CG2-CD2 4.02Å; T683-F687 HydrophobicContact CG2-CE2 3.88Å; T683-F687 WeakPolarHBondContact O-CB 3.26Å; T683-F687 WeakPolarHBondContact O-CD2 3.44Å; T683-F687 PolarHBondContact O-N 3.45Å; T683-F687 VanDerWaalsContact O-N 3.11Å; Y684-F687 PolarHBondContact O-N 3.48Å; Y684-F687 VanDerWaalsContact O-N 3.12Å; T685-F687 PolarHBondContact O-N 3.33Å; F687-C691 PolarHBondContact O-N 3.12Å; F687-L692 HydrophobicContact CB-CB 4.33Å; F687-L692 HydrophobicContact CD1-CB 3.57Å; F687-L692 HydrophobicContact CD1-CD1 3.95Å; F687-L692 HydrophobicContact CD1-CG 4.42Å; F687-L692 HydrophobicContact CD2-CD1 4.01Å; F687-L692 HydrophobicContact CE1-CB 4.05Å; F687-L692 HydrophobicContact CE1-CD1 3.95Å; F687-L692 HydrophobicContact CE2-CD1 4.04Å; F687-L692 HydrophobicContact CG-CB 4.05Å; F687-L692 HydrophobicContact CG-CD1 3.98Å; F687-L692 HydrophobicContact CZ-CD1 4Å; F687-L692 PolarHBondContact O-N 2.93Å; F687-F693 HydrophobicContact CB-CD2 3.83Å; F687-F693 HydrophobicContact CB-CE1 4.46Å; F687-F693 HydrophobicContact CB-CE2 3.36Å; F687-F693 HydrophobicContact CB-CZ 3.69Å; F687-I698 HydrophobicContact CD1-CD1 3.92Å; F687-I698 HydrophobicContact CE1-CD1 3.76Å; F687-F703 HydrophobicContact CB-CE2 4.41Å; F687-F703 HydrophobicContact CB-CZ 4.19Å; F687-F703 HydrophobicContact CD1-CD2 4.35Å; F687-F703 AromaticContact CD1-CE2 3.51Å; F687-F703 HydrophobicContact CD1-CE2 3.51Å; F687-F703 HydrophobicContact CD1-CZ 4.1Å; F687-F703 HydrophobicContact CD2-CE2 4.14Å; F687-F703 HydrophobicContact CD2-CZ 4.09Å; F687-F703 HydrophobicContact CE1-CD2 4.48Å; F687-F703 AromaticContact CE1-CE2 3.69Å; F687-F703 HydrophobicContact CE1-CE2 3.69Å; F687-F703 HydrophobicContact CE2-CE2 4.28Å; F687-F703 AromaticContact CG-CE2 3.76Å; F687-F703 HydrophobicContact CG-CE2 3.76Å; F687-F703 AromaticContact CG-CZ 3.86Å; F687-F703 HydrophobicContact CG-CZ 3.86Å; F687-F703 HydrophobicContact CZ-CE2 4.07Å; F687-M795 HydrophobicContact CE1-CG 3.75Å; F687-M795 HydrophobicContact CE1-SD 3.82Å; F687-M795 HydrophobicContact CZ-CG 3.65Å; F687-M795 HydrophobicContact CZ-SD 4.33Å; F687-V799 HydrophobicContact CE2-CG2 4.33Å; F687-V799 HydrophobicContact CZ-CG2 3.67Å
688	Q	94.3	Very high	95.5	Very high	53 Å²	53	20.9 Å²	20.9	25%	0.248	10%	0.098	C	C	.	.	H	α-helix	trans	-77.9	-40.8	173.7	-176.9	171	-50.5	0	0	112.1	H650 Y684 T685 L686 C691 F693 K773	H650-Q688 PolarHBondContact CD2-NE2 2.97Å; H650-Q688 PolarHBondContact NE2-NE2 3.15Å; Y684-Q688 VanDerWaalsContact CZ-OE1 3.32Å; Y684-Q688 PolarHBondContact O-N 3.41Å; Y684-Q688 PolarHBondContact OH-OE1 2.96Å; T685-Q688 PolarHBondContact O-N 3.07Å; L686-Q688 VanDerWaalsContact C-N 3.3Å; L686-Q688 PolarHBondContact O-N 3.39Å; Q688-C691 PolarHBondContact O-N 3.39Å; Q688-F693 HydrophobicContact CB-CD2 4.36Å; Q688-F693 HydrophobicContact CB-CE2 4.32Å; Q688-K773 PolarHBondContact O-NZ 3.05Å
689	D	94.8	Very high	95.7	Very high	2 Å²	2	22.9 Å²	22.9	1%	0.011	11%	0.111	C	C	.	.	H	α-helix	trans	-59.8	-48.1	172.7	172.1	61.6	0	0	0	111.9	M654 T685 C691 W733 S772 K773 S774	M654-D689 HydrophobicContact CE-CB 3.66Å; M654-D689 VanDerWaalsContact CE-CG 3.41Å; M654-D689 HydrophobicContact SD-CB 4.02Å; T685-D689 PolarHBondContact O-N 3.22Å; D689-C691 VanDerWaalsContact C-N 3.26Å; D689-C691 PolarHBondContact O-N 3.16Å; D689-W733 PolarHBondContact OD2-NE1 3.35Å; D689-S772 PolarHBondContact OD1-OG 3.41Å; D689-S772 VanDerWaalsContact OD2-CB 3.23Å; D689-S772 WeakPolarHBondContact OD2-CB 3.38Å; D689-S772 PolarHBondContact OD2-OG 3.13Å; D689-K773 WeakPolarHBondContact O-CG 3.47Å; D689-K773 PolarHBondContact O-N 3.04Å; D689-K773 VanDerWaalsContact O-N 3.11Å; D689-K773 WeakPolarHBondContact OD1-CA 3.42Å; D689-K773 PolarHBondContact OD1-N 3.19Å; D689-S774 PolarHBondContact OD1-N 3.06Å
690	M	95.2	Very high	95.6	Very high	0 Å²	0	25 Å²	25	0%	0	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.4	11.5	-176.8	-65.8	-66	-59.2	0	0	114.3	L686 L692 T737 A770 A786 L794 Y798	L686-M690 WeakPolarHBondContact O-CB 3.46Å; L686-M690 WeakPolarHBondContact O-CG 3.34Å; L686-M690 PolarHBondContact O-N 3.16Å; M690-L692 HydrophobicContact CB-CD1 4.08Å; M690-L692 HydrophobicContact CB-CG 3.83Å; M690-L692 PolarHBondContact O-N 3.42Å; M690-T737 HydrophobicContact CE-CG2 3.87Å; M690-T737 HydrophobicContact SD-CG2 3.37Å; M690-T737 WeakPolarHBondContact SD-CG2 3.41Å; M690-A770 HydrophobicContact CE-CB 3.72Å; M690-A786 HydrophobicContact CE-CB 4.22Å; M690-L794 HydrophobicContact CE-CD1 4.14Å; M690-Y798 HydrophobicContact CE-CE2 4.36Å; M690-Y798 HydrophobicContact CG-CE2 3.98Å
691	C	95.3	Very high	95.6	Very high	29 Å²	29	29.5 Å²	29.5	20%	0.196	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.5	17	-177.1	-58.6	0	0	0	0	115.6	F687 Q688 D689 F693 E694 I695 K773	F687-C691 PolarHBondContact O-N 3.12Å; Q688-C691 PolarHBondContact O-N 3.39Å; D689-C691 VanDerWaalsContact C-N 3.26Å; D689-C691 PolarHBondContact O-N 3.16Å; C691-F693 VanDerWaalsContact C-N 3.29Å; C691-F693 PolarHBondContact O-N 2.72Å; C691-E694 WeakPolarHBondContact O-CA 3.35Å; C691-E694 WeakPolarHBondContact O-CB 3.38Å; C691-E694 PolarHBondContact O-N 3.27Å; C691-I695 HydrophobicContact CB-CD1 4.15Å; C691-I695 HydrophobicContact CB-CG1 4.39Å; C691-I695 WeakPolarHBondContact O-CG1 3.4Å; C691-I695 PolarHBondContact O-N 3.5Å; C691-K773 WeakPolarHBondContact SG-CE 3.4Å; C691-K773 PolarHBondContact SG-NZ 3.09Å
692	L	96.8	Very high	95.9	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-65.6	-32.1	-170.7	-65.7	176	0	0	0	112.5	F687 M690 E694 I695 F696 A770 A791 M795 Y798	F687-L692 HydrophobicContact CB-CB 4.33Å; F687-L692 HydrophobicContact CD1-CB 3.57Å; F687-L692 HydrophobicContact CD1-CD1 3.95Å; F687-L692 HydrophobicContact CD1-CG 4.42Å; F687-L692 HydrophobicContact CD2-CD1 4.01Å; F687-L692 HydrophobicContact CE1-CB 4.05Å; F687-L692 HydrophobicContact CE1-CD1 3.95Å; F687-L692 HydrophobicContact CE2-CD1 4.04Å; F687-L692 HydrophobicContact CG-CB 4.05Å; F687-L692 HydrophobicContact CG-CD1 3.98Å; F687-L692 HydrophobicContact CZ-CD1 4Å; F687-L692 PolarHBondContact O-N 2.93Å; M690-L692 HydrophobicContact CB-CD1 4.08Å; M690-L692 HydrophobicContact CB-CG 3.83Å; M690-L692 PolarHBondContact O-N 3.42Å; L692-E694 VanDerWaalsContact C-N 3.3Å; L692-E694 PolarHBondContact O-N 3.03Å; L692-I695 HydrophobicContact CD2-CD1 4.47Å; L692-F696 HydrophobicContact CD2-CD2 4.27Å; L692-F696 HydrophobicContact CD2-CE2 4Å; L692-F696 PolarHBondContact O-N 2.9Å; L692-F696 VanDerWaalsContact O-N 3.1Å; L692-A770 HydrophobicContact CD2-CB 4.18Å; L692-A791 HydrophobicContact CD2-CB 4.39Å; L692-M795 HydrophobicContact CD1-CB 4.14Å; L692-M795 HydrophobicContact CD1-CG 4.14Å; L692-M795 HydrophobicContact CD2-CB 4.21Å; L692-Y798 HydrophobicContact CD1-CD2 3.89Å; L692-Y798 HydrophobicContact CD1-CE2 4.17Å
693	F	96.3	Very high	96	Very high	26 Å²	26	30.6 Å²	30.6	11%	0.114	15%	0.149	C	C	.	.	H	α-helix	trans	-58.6	-40.8	169.5	-67.9	-67.5	0	0	0	112.6	Y684 F687 Q688 C691 K697 I698 V700 F703	Y684-F693 AromaticContact CD2-CE2 3.85Å; Y684-F693 HydrophobicContact CD2-CE2 3.85Å; Y684-F693 AromaticContact CD2-CZ 3.51Å; Y684-F693 HydrophobicContact CD2-CZ 3.51Å; Y684-F693 AromaticContact CE2-CE2 3.8Å; Y684-F693 HydrophobicContact CE2-CE2 3.8Å; Y684-F693 AromaticContact CE2-CZ 3.73Å; Y684-F693 HydrophobicContact CE2-CZ 3.73Å; Y684-F693 HydrophobicContact CG-CE2 4.43Å; Y684-F693 HydrophobicContact CG-CZ 4.34Å; F687-F693 HydrophobicContact CB-CD2 3.83Å; F687-F693 HydrophobicContact CB-CE1 4.46Å; F687-F693 HydrophobicContact CB-CE2 3.36Å; F687-F693 HydrophobicContact CB-CZ 3.69Å; Q688-F693 HydrophobicContact CB-CD2 4.36Å; Q688-F693 HydrophobicContact CB-CE2 4.32Å; C691-F693 VanDerWaalsContact C-N 3.29Å; C691-F693 PolarHBondContact O-N 2.72Å; F693-K697 CarbonylContact O-C 3.54Å; F693-K697 WeakPolarHBondContact O-CA 3.39Å; F693-K697 PolarHBondContact O-N 3.22Å; F693-K697 VanDerWaalsContact O-N 3.08Å; F693-I698 HydrophobicContact CD1-CB 3.81Å; F693-I698 HydrophobicContact CD1-CG2 3.77Å; F693-I698 HydrophobicContact CE1-CB 4.42Å; F693-I698 HydrophobicContact CE1-CG2 3.88Å; F693-I698 PolarHBondContact O-N 2.9Å; F693-I698 VanDerWaalsContact O-N 3.17Å; F693-V700 HydrophobicContact CD1-CG2 3.92Å; F693-V700 HydrophobicContact CE1-CG2 3.93Å; F693-V700 HydrophobicContact CZ-CG2 4.49Å; F693-F703 HydrophobicContact CE1-CB 4.25Å; F693-F703 AromaticContact CE1-CD1 3.97Å; F693-F703 HydrophobicContact CE1-CD1 3.97Å; F693-F703 AromaticContact CE1-CD2 3.96Å; F693-F703 HydrophobicContact CE1-CD2 3.96Å; F693-F703 HydrophobicContact CE1-CE1 4.29Å; F693-F703 HydrophobicContact CE1-CE2 4.24Å; F693-F703 AromaticContact CE1-CG 3.81Å; F693-F703 HydrophobicContact CE1-CG 3.81Å; F693-F703 HydrophobicContact CE1-CZ 4.39Å; F693-F703 AromaticContact CZ-CD1 3.89Å; F693-F703 HydrophobicContact CZ-CD1 3.89Å; F693-F703 HydrophobicContact CZ-CD2 4.34Å; F693-F703 AromaticContact CZ-CE1 3.8Å; F693-F703 HydrophobicContact CZ-CE1 3.8Å; F693-F703 HydrophobicContact CZ-CE2 4.23Å; F693-F703 HydrophobicContact CZ-CG 4.17Å; F693-F703 AromaticContact CZ-CZ 3.95Å; F693-F703 HydrophobicContact CZ-CZ 3.95Å
694	E	95.1	Very high	95.9	Very high	109 Å²	109	31 Å²	31	51%	0.509	15%	0.151	S	C	.	.	H	α-helix	trans	-78.9	-37.6	-176.4	-58.1	172.1	-128.6	0	0	111.7	C691 L692 K697 K773	C691-E694 WeakPolarHBondContact O-CA 3.35Å; C691-E694 WeakPolarHBondContact O-CB 3.38Å; C691-E694 PolarHBondContact O-N 3.27Å; L692-E694 VanDerWaalsContact C-N 3.3Å; L692-E694 PolarHBondContact O-N 3.03Å; E694-K697 WeakPolarHBondContact O-CD 3.42Å; E694-K697 VanDerWaalsContact O-CE 3.22Å; E694-K697 WeakPolarHBondContact O-CE 3.35Å; E694-K697 PolarHBondContact O-NZ 3.48Å; E694-K773 IonicContact OE1-NZ 2.78Å; E694-K773 PolarHBondContact OE1-NZ 3.2Å
695	I	94.8	Very high	96	Very high	38 Å²	38	31.6 Å²	31.6	20%	0.195	16%	0.158	C	C	.	.	H	α-helix	trans	-68.5	-54.5	179.7	-66	165.1	0	0	0	110.5	C691 L692 A770 A791	C691-I695 HydrophobicContact CB-CD1 4.15Å; C691-I695 HydrophobicContact CB-CG1 4.39Å; C691-I695 WeakPolarHBondContact O-CG1 3.4Å; C691-I695 PolarHBondContact O-N 3.5Å; L692-I695 HydrophobicContact CD2-CD1 4.47Å; I695-A770 HydrophobicContact CD1-CB 3.91Å; I695-A791 HydrophobicContact CD1-CB 4.23Å; I695-A791 HydrophobicContact CG2-CB 4.37Å
696	F	96.3	Very high	96.1	Very high	15 Å²	15	31.7 Å²	31.7	7%	0.066	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.3	7.4	-173.7	-62.1	-64.9	0	0	0	114.1	L692 I698 A791 L792 M795 L857	L692-F696 HydrophobicContact CD2-CD2 4.27Å; L692-F696 HydrophobicContact CD2-CE2 4Å; L692-F696 PolarHBondContact O-N 2.9Å; L692-F696 VanDerWaalsContact O-N 3.1Å; F696-I698 HydrophobicContact CB-CD1 4.16Å; F696-I698 HydrophobicContact CB-CG1 3.96Å; F696-I698 PolarHBondContact O-N 2.92Å; F696-A791 HydrophobicContact CE2-CB 3.89Å; F696-A791 HydrophobicContact CZ-CB 3.88Å; F696-L792 HydrophobicContact CE1-CB 4.36Å; F696-L792 HydrophobicContact CE1-CD1 4.01Å; F696-L792 HydrophobicContact CZ-CB 3.9Å; F696-L792 HydrophobicContact CZ-CD1 4.08Å; F696-M795 HydrophobicContact CD2-CE 3.64Å; F696-M795 HydrophobicContact CD2-SD 3.51Å; F696-M795 VanDerWaalsContact CD2-SD 3.51Å; F696-M795 HydrophobicContact CE2-CB 4.38Å; F696-M795 HydrophobicContact CE2-CE 3.89Å; F696-M795 HydrophobicContact CE2-SD 3.98Å; F696-M795 HydrophobicContact CG-CE 3.99Å; F696-M795 HydrophobicContact CG-SD 4.25Å; F696-M795 HydrophobicContact CZ-CE 4.45Å; F696-L857 HydrophobicContact CB-CD2 4.13Å; F696-L857 HydrophobicContact CD1-CD2 3.44Å; F696-L857 VanDerWaalsContact CD1-CD2 3.44Å; F696-L857 HydrophobicContact CE1-CD2 4.16Å; F696-L857 HydrophobicContact CG-CD2 4.04Å
697	K	96.6	Very high	96.2	Very high	116 Å²	116	31.7 Å²	31.7	50%	0.504	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.2	44.2	-178.6	-53.3	-55.8	178.3	-160.3	0	112.4	F693 E694 P699 I762 N856	F693-K697 CarbonylContact O-C 3.54Å; F693-K697 WeakPolarHBondContact O-CA 3.39Å; F693-K697 PolarHBondContact O-N 3.22Å; F693-K697 VanDerWaalsContact O-N 3.08Å; E694-K697 WeakPolarHBondContact O-CD 3.42Å; E694-K697 VanDerWaalsContact O-CE 3.22Å; E694-K697 WeakPolarHBondContact O-CE 3.35Å; E694-K697 PolarHBondContact O-NZ 3.48Å; K697-P699 WeakPolarHBondContact O-CD 3.27Å; K697-I762 HydrophobicContact CG-CD1 4.08Å; K697-I762 HydrophobicContact CG-CG1 4.42Å; K697-N856 HydrophobicContact CB-CB 4.28Å; K697-N856 PolarHBondContact O-ND2 2.88Å
698	I	97.5	Very high	96.2	Very high	10 Å²	10	33 Å²	33	5%	0.051	17%	0.168	C	C	.	.			trans	-70.5	123.6	-176.1	-67	167.5	0	0	0	109.6	F687 F693 F696 V700 F703 M795 F853	F687-I698 HydrophobicContact CD1-CD1 3.92Å; F687-I698 HydrophobicContact CE1-CD1 3.76Å; F693-I698 HydrophobicContact CD1-CB 3.81Å; F693-I698 HydrophobicContact CD1-CG2 3.77Å; F693-I698 HydrophobicContact CE1-CB 4.42Å; F693-I698 HydrophobicContact CE1-CG2 3.88Å; F693-I698 PolarHBondContact O-N 2.9Å; F693-I698 VanDerWaalsContact O-N 3.17Å; F696-I698 HydrophobicContact CB-CD1 4.16Å; F696-I698 HydrophobicContact CB-CG1 3.96Å; F696-I698 PolarHBondContact O-N 2.92Å; I698-V700 PolarHBondContact O-N 2.79Å; I698-F703 HydrophobicContact CG2-CB 3.91Å; I698-F703 HydrophobicContact CG2-CD2 3.91Å; I698-F703 HydrophobicContact CG2-CG 4.27Å; I698-M795 HydrophobicContact CD1-SD 3.72Å; I698-F853 HydrophobicContact CD1-CD2 4.31Å; I698-F853 HydrophobicContact CD1-CE2 4.48Å; I698-F853 HydrophobicContact CG1-CD2 4.37Å; I698-F853 HydrophobicContact CG2-CB 4.04Å; I698-F853 HydrophobicContact CG2-CD2 3.76Å; I698-F853 HydrophobicContact CG2-CG 4.35Å
699	P	96.4	Very high	96.3	Very high	43 Å²	43	31.3 Å²	31.3	28%	0.279	16%	0.163	S	C	.	.			trans	-75.2	117.6	175.1	30.5	-32.1	0	0	0	110.4	K697 K701 E702 F703 F853	K697-P699 WeakPolarHBondContact O-CD 3.27Å; P699-K701 VanDerWaalsContact C-N 3.26Å; P699-K701 PolarHBondContact O-N 3.01Å; P699-E702 WeakPolarHBondContact CB-OE2 3.03Å; P699-E702 HydrophobicContact CG-CB 4.24Å; P699-E702 PolarHBondContact O-N 3.05Å; P699-F703 PolarHBondContact O-N 3.5Å; P699-F703 VanDerWaalsContact O-N 3.1Å; P699-F853 WeakPolarHBondContact CD-O 3.48Å
700	V	95.3	Very high	96.5	Very high	44 Å²	44	31.2 Å²	31.2	27%	0.267	16%	0.162	S	C	.	.	H	α-helix	trans	-57.6	-35.1	-173.2	174.1	0	0	0	0	113.1	F641 L643 Y684 F693 I698 F703 M704	F641-V700 HydrophobicContact CE1-CG1 4.19Å; L643-V700 HydrophobicContact CD1-CG1 3.99Å; Y684-V700 HydrophobicContact CD2-CG1 4.21Å; Y684-V700 HydrophobicContact CE2-CG1 3.64Å; Y684-V700 HydrophobicContact CE2-CG2 4.28Å; F693-V700 HydrophobicContact CD1-CG2 3.92Å; F693-V700 HydrophobicContact CE1-CG2 3.93Å; F693-V700 HydrophobicContact CZ-CG2 4.49Å; I698-V700 PolarHBondContact O-N 2.79Å; V700-F703 PolarHBondContact O-N 3.12Å; V700-M704 HydrophobicContact CG1-CG 4.17Å; V700-M704 WeakPolarHBondContact O-CB 3.47Å; V700-M704 WeakPolarHBondContact O-CG 3.29Å; V700-M704 PolarHBondContact O-N 3.06Å
701	K	95.1	Very high	96.5	Very high	95 Å²	95	31.6 Å²	31.6	41%	0.413	16%	0.164	S	C	.	.	H	α-helix	trans	-62	-55.3	-179.9	171.9	177.1	160.9	-97.1	0	111.2	F641 P699 F703 M704 S705	F641-K701 HydrophobicContact CB-CD 4.22Å; F641-K701 HydrophobicContact CD1-CB 4.09Å; F641-K701 HydrophobicContact CD2-CB 4.27Å; F641-K701 HydrophobicContact CD2-CD 4.4Å; F641-K701 HydrophobicContact CD2-CG 3.93Å; F641-K701 HydrophobicContact CE1-CB 4.34Å; F641-K701 HydrophobicContact CE2-CB 4.49Å; F641-K701 HydrophobicContact CE2-CG 4.31Å; F641-K701 HydrophobicContact CG-CB 4.06Å; F641-K701 HydrophobicContact CG-CD 4.34Å; F641-K701 HydrophobicContact CG-CG 4.09Å; P699-K701 VanDerWaalsContact C-N 3.26Å; P699-K701 PolarHBondContact O-N 3.01Å; K701-F703 VanDerWaalsContact C-N 3.29Å; K701-F703 PolarHBondContact O-N 3.15Å; K701-M704 PolarHBondContact O-N 3.04Å; K701-S705 WeakPolarHBondContact O-CB 3.4Å; K701-S705 PolarHBondContact O-N 2.9Å; K701-S705 PolarHBondContact O-OG 2.88Å
702	E	97.3	Very high	96.5	Very high	39 Å²	39	35.1 Å²	35.1	18%	0.182	19%	0.189	C	C	.	.	H	α-helix	trans	-65.7	-33.9	179.9	-71.2	59.7	-143.1	0	0	111.7	P699 Y706 E850 F853	P699-E702 WeakPolarHBondContact CB-OE2 3.03Å; P699-E702 HydrophobicContact CG-CB 4.24Å; P699-E702 PolarHBondContact O-N 3.05Å; E702-Y706 PolarHBondContact O-N 2.7Å; E702-E850 VanDerWaalsContact CA-O 3.26Å; E702-E850 WeakPolarHBondContact CA-O 3.22Å; E702-E850 WeakPolarHBondContact CB-O 3.32Å; E702-F853 HydrophobicContact CB-CB 4.26Å
703	F	98	Very high	96.5	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-59.5	-55.5	171.5	176.6	-85.1	0	0	0	111.2	T683 Y684 F687 F693 I698 P699 V700 K701 S705 Y706 F707 F853	T683-F703 HydrophobicContact CG2-CE2 4.5Å; T683-F703 HydrophobicContact CG2-CZ 3.87Å; Y684-F703 HydrophobicContact CD2-CD1 4.47Å; Y684-F703 HydrophobicContact CD2-CE1 4.29Å; F687-F703 HydrophobicContact CB-CE2 4.41Å; F687-F703 HydrophobicContact CB-CZ 4.19Å; F687-F703 HydrophobicContact CD1-CD2 4.35Å; F687-F703 AromaticContact CD1-CE2 3.51Å; F687-F703 HydrophobicContact CD1-CE2 3.51Å; F687-F703 HydrophobicContact CD1-CZ 4.1Å; F687-F703 HydrophobicContact CD2-CE2 4.14Å; F687-F703 HydrophobicContact CD2-CZ 4.09Å; F687-F703 HydrophobicContact CE1-CD2 4.48Å; F687-F703 AromaticContact CE1-CE2 3.69Å; F687-F703 HydrophobicContact CE1-CE2 3.69Å; F687-F703 HydrophobicContact CE2-CE2 4.28Å; F687-F703 AromaticContact CG-CE2 3.76Å; F687-F703 HydrophobicContact CG-CE2 3.76Å; F687-F703 AromaticContact CG-CZ 3.86Å; F687-F703 HydrophobicContact CG-CZ 3.86Å; F687-F703 HydrophobicContact CZ-CE2 4.07Å; F693-F703 HydrophobicContact CE1-CB 4.25Å; F693-F703 AromaticContact CE1-CD1 3.97Å; F693-F703 HydrophobicContact CE1-CD1 3.97Å; F693-F703 AromaticContact CE1-CD2 3.96Å; F693-F703 HydrophobicContact CE1-CD2 3.96Å; F693-F703 HydrophobicContact CE1-CE1 4.29Å; F693-F703 HydrophobicContact CE1-CE2 4.24Å; F693-F703 AromaticContact CE1-CG 3.81Å; F693-F703 HydrophobicContact CE1-CG 3.81Å; F693-F703 HydrophobicContact CE1-CZ 4.39Å; F693-F703 AromaticContact CZ-CD1 3.89Å; F693-F703 HydrophobicContact CZ-CD1 3.89Å; F693-F703 HydrophobicContact CZ-CD2 4.34Å; F693-F703 AromaticContact CZ-CE1 3.8Å; F693-F703 HydrophobicContact CZ-CE1 3.8Å; F693-F703 HydrophobicContact CZ-CE2 4.23Å; F693-F703 HydrophobicContact CZ-CG 4.17Å; F693-F703 AromaticContact CZ-CZ 3.95Å; F693-F703 HydrophobicContact CZ-CZ 3.95Å; I698-F703 HydrophobicContact CG2-CB 3.91Å; I698-F703 HydrophobicContact CG2-CD2 3.91Å; I698-F703 HydrophobicContact CG2-CG 4.27Å; P699-F703 PolarHBondContact O-N 3.5Å; P699-F703 VanDerWaalsContact O-N 3.1Å; V700-F703 PolarHBondContact O-N 3.12Å; K701-F703 VanDerWaalsContact C-N 3.29Å; K701-F703 PolarHBondContact O-N 3.15Å; F703-S705 VanDerWaalsContact C-N 3.31Å; F703-S705 PolarHBondContact O-N 2.85Å; F703-Y706 PolarHBondContact O-N 3.3Å; F703-F707 HydrophobicContact CD1-CD2 4.01Å; F703-F707 AromaticContact CD2-CD2 3.79Å; F703-F707 HydrophobicContact CD2-CD2 3.79Å; F703-F707 AromaticContact CD2-CE2 3.62Å; F703-F707 HydrophobicContact CD2-CE2 3.62Å; F703-F707 AromaticContact CE1-CD2 3.85Å; F703-F707 HydrophobicContact CE1-CD2 3.85Å; F703-F707 HydrophobicContact CE1-CE2 4.41Å; F703-F707 AromaticContact CE2-CD2 3.66Å; F703-F707 HydrophobicContact CE2-CD2 3.66Å; F703-F707 AromaticContact CE2-CE2 3.37Å; F703-F707 HydrophobicContact CE2-CE2 3.37Å; F703-F707 HydrophobicContact CE2-CZ 4.37Å; F703-F707 AromaticContact CG-CD2 3.97Å; F703-F707 HydrophobicContact CG-CD2 3.97Å; F703-F707 HydrophobicContact CG-CE2 4.28Å; F703-F707 AromaticContact CZ-CD2 3.7Å; F703-F707 HydrophobicContact CZ-CD2 3.7Å; F703-F707 AromaticContact CZ-CE2 3.81Å; F703-F707 HydrophobicContact CZ-CE2 3.81Å; F703-F707 WeakPolarHBondContact O-CD2 3.39Å; F703-F707 PolarHBondContact O-N 2.8Å; F703-F853 HydrophobicContact CB-CB 3.88Å; F703-F853 HydrophobicContact CB-CG 4.27Å; F703-F853 AromaticContact CD2-CD2 3.85Å; F703-F853 HydrophobicContact CD2-CD2 3.85Å; F703-F853 HydrophobicContact CD2-CE2 4.11Å; F703-F853 HydrophobicContact CD2-CG 4.17Å
704	M	95.8	Very high	96.6	Very high	10 Å²	10	35.3 Å²	35.3	5%	0.049	19%	0.194	C	C	.	.	H	α-helix	trans	-64.5	-36.3	179.5	-69.6	-55.1	-66.4	0	0	112	F641 L647 Y684 V700 K701 C708	F641-M704 HydrophobicContact CZ-CB 3.96Å; F641-M704 HydrophobicContact CZ-CG 4.18Å; L647-M704 HydrophobicContact CD1-CE 4.1Å; L647-M704 HydrophobicContact CD2-CE 4.4Å; Y684-M704 HydrophobicContact CD2-CG 4.46Å; Y684-M704 HydrophobicContact CD2-SD 3.86Å; Y684-M704 HydrophobicContact CG-SD 4.13Å; V700-M704 HydrophobicContact CG1-CG 4.17Å; V700-M704 WeakPolarHBondContact O-CB 3.47Å; V700-M704 WeakPolarHBondContact O-CG 3.29Å; V700-M704 PolarHBondContact O-N 3.06Å; K701-M704 PolarHBondContact O-N 3.04Å; M704-C708 VanDerWaalsContact O-CB 3.24Å; M704-C708 WeakPolarHBondContact O-CB 3.45Å; M704-C708 PolarHBondContact O-N 3.46Å; M704-C708 PolarHBondContact O-SG 3.45Å
705	S	96.4	Very high	96.7	Very high	34 Å²	34	34.5 Å²	34.5	24%	0.238	19%	0.186	C	C	.	.	H	α-helix	trans	-60.6	-43.7	173.6	-66.4	0	0	0	0	112	K701 F703 A709 E850 Y851	K701-S705 WeakPolarHBondContact O-CB 3.4Å; K701-S705 PolarHBondContact O-N 2.9Å; K701-S705 PolarHBondContact O-OG 2.88Å; F703-S705 VanDerWaalsContact C-N 3.31Å; F703-S705 PolarHBondContact O-N 2.85Å; S705-A709 WeakPolarHBondContact O-CB 3.47Å; S705-A709 PolarHBondContact O-N 3.26Å; S705-E850 WeakPolarHBondContact CB-O 3.46Å; S705-Y851 VanDerWaalsContact O-CE1 3.3Å; S705-Y851 WeakPolarHBondContact O-CE1 3.47Å
706	Y	98.5	Very high	96.7	Very high	2 Å²	2	38 Å²	38	1%	0.008	21%	0.205	C	C	.	.	H	α-helix	trans	-67.6	-52.7	175.2	179	-113.2	0	0	0	112.1	E702 F703 C708 A709 L710 M803 A841 L844 Y845 Y851 F853	E702-Y706 PolarHBondContact O-N 2.7Å; F703-Y706 PolarHBondContact O-N 3.3Å; Y706-C708 PolarHBondContact O-N 3.43Å; Y706-A709 CarbonylContact O-C 3.49Å; Y706-A709 WeakPolarHBondContact O-CA 3.41Å; Y706-A709 WeakPolarHBondContact O-CB 3.3Å; Y706-A709 PolarHBondContact O-N 3.1Å; Y706-L710 HydrophobicContact CE1-CD2 4.22Å; Y706-L710 WeakPolarHBondContact O-CB 3.46Å; Y706-L710 PolarHBondContact O-N 3.16Å; Y706-M803 HydrophobicContact CE1-CE 4.19Å; Y706-M803 VanDerWaalsContact OH-CE 3.24Å; Y706-M803 WeakPolarHBondContact OH-CE 3.24Å; Y706-A841 PolarHBondContact OH-O 2.87Å; Y706-L844 HydrophobicContact CD2-CD2 4.39Å; Y706-L844 HydrophobicContact CD2-CG 4.36Å; Y706-L844 HydrophobicContact CE2-CB 4.39Å; Y706-L844 HydrophobicContact CE2-CD2 3.96Å; Y706-L844 HydrophobicContact CE2-CG 3.98Å; Y706-Y845 HydrophobicContact CD1-CD2 4.42Å; Y706-Y845 HydrophobicContact CD2-CD2 4.12Å; Y706-Y845 HydrophobicContact CE1-CD2 4.29Å; Y706-Y845 HydrophobicContact CE2-CD2 4Å; Y706-Y845 HydrophobicContact CE2-CG 4.32Å; Y706-Y845 HydrophobicContact CG-CD2 4.31Å; Y706-Y851 HydrophobicContact CD2-CG 4.15Å; Y706-F853 AromaticContact CD1-CD1 3.95Å; Y706-F853 HydrophobicContact CD1-CD1 3.95Å; Y706-F853 AromaticContact CD1-CE1 3.48Å; Y706-F853 HydrophobicContact CD1-CE1 3.48Å; Y706-F853 VanDerWaalsContact CD1-CE1 3.48Å; Y706-F853 AromaticContact CE1-CE1 3.95Å; Y706-F853 HydrophobicContact CE1-CE1 3.95Å; Y706-F853 HydrophobicContact CG-CD1 4.24Å; Y706-F853 HydrophobicContact CG-CE1 4.19Å
707	F	98.1	Very high	96.8	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-68.2	-32.1	-174.1	-78.6	-74	0	0	0	113.3	T683 F703 A709 L710 E711 V799 A802 F853	T683-F707 HydrophobicContact CG2-CD1 4.07Å; T683-F707 HydrophobicContact CG2-CD2 4.46Å; T683-F707 HydrophobicContact CG2-CE1 3.88Å; T683-F707 HydrophobicContact CG2-CE2 4.28Å; T683-F707 HydrophobicContact CG2-CG 4.39Å; T683-F707 HydrophobicContact CG2-CZ 4Å; F703-F707 HydrophobicContact CD1-CD2 4.01Å; F703-F707 AromaticContact CD2-CD2 3.79Å; F703-F707 HydrophobicContact CD2-CD2 3.79Å; F703-F707 AromaticContact CD2-CE2 3.62Å; F703-F707 HydrophobicContact CD2-CE2 3.62Å; F703-F707 AromaticContact CE1-CD2 3.85Å; F703-F707 HydrophobicContact CE1-CD2 3.85Å; F703-F707 HydrophobicContact CE1-CE2 4.41Å; F703-F707 AromaticContact CE2-CD2 3.66Å; F703-F707 HydrophobicContact CE2-CD2 3.66Å; F703-F707 AromaticContact CE2-CE2 3.37Å; F703-F707 HydrophobicContact CE2-CE2 3.37Å; F703-F707 HydrophobicContact CE2-CZ 4.37Å; F703-F707 AromaticContact CG-CD2 3.97Å; F703-F707 HydrophobicContact CG-CD2 3.97Å; F703-F707 HydrophobicContact CG-CE2 4.28Å; F703-F707 AromaticContact CZ-CD2 3.7Å; F703-F707 HydrophobicContact CZ-CD2 3.7Å; F703-F707 AromaticContact CZ-CE2 3.81Å; F703-F707 HydrophobicContact CZ-CE2 3.81Å; F703-F707 WeakPolarHBondContact O-CD2 3.39Å; F703-F707 PolarHBondContact O-N 2.8Å; F707-A709 VanDerWaalsContact C-N 3.34Å; F707-L710 HydrophobicContact CD1-CD2 3.65Å; F707-L710 HydrophobicContact CE1-CD2 3.7Å; F707-L710 PolarHBondContact O-N 3.27Å; F707-E711 VanDerWaalsContact O-CB 3.24Å; F707-E711 WeakPolarHBondContact O-CB 3.39Å; F707-E711 PolarHBondContact O-N 2.99Å; F707-V799 HydrophobicContact CZ-CG1 4.4Å; F707-V799 HydrophobicContact CZ-CG2 4.15Å; F707-A802 HydrophobicContact CD1-CB 4.48Å; F707-A802 HydrophobicContact CE1-CB 3.9Å; F707-F853 HydrophobicContact CE2-CD1 4.38Å; F707-F853 AromaticContact CE2-CE1 3.78Å; F707-F853 HydrophobicContact CE2-CE1 3.78Å; F707-F853 HydrophobicContact CE2-CE2 4.36Å; F707-F853 AromaticContact CE2-CZ 3.77Å; F707-F853 HydrophobicContact CE2-CZ 3.77Å; F707-F853 HydrophobicContact CZ-CE1 4.22Å; F707-F853 HydrophobicContact CZ-CZ 4.05Å
708	C	95.8	Very high	96.8	Very high	28 Å²	28	35 Å²	35	19%	0.189	20%	0.197	C	C	.	.	H	α-helix	trans	-66.4	-35.1	170.1	-68.1	0	0	0	0	112.2	M704 Y706 S712	M704-C708 VanDerWaalsContact O-CB 3.24Å; M704-C708 WeakPolarHBondContact O-CB 3.45Å; M704-C708 PolarHBondContact O-N 3.46Å; M704-C708 PolarHBondContact O-SG 3.45Å; Y706-C708 PolarHBondContact O-N 3.43Å; C708-S712 WeakPolarHBondContact O-CB 3.29Å; C708-S712 PolarHBondContact O-N 3Å; C708-S712 VanDerWaalsContact O-N 3.1Å; C708-S712 PolarHBondContact O-OG 3.17Å
709	A	97.1	Very high	96.9	Very high	18 Å²	18	35.4 Å²	35.4	15%	0.149	20%	0.198	C	C	.	.	H	α-helix	trans	-73.3	-37.4	176.4	0	0	0	0	0	112	S705 Y706 F707 S712 G713 L844 Y851	S705-A709 WeakPolarHBondContact O-CB 3.47Å; S705-A709 PolarHBondContact O-N 3.26Å; Y706-A709 CarbonylContact O-C 3.49Å; Y706-A709 WeakPolarHBondContact O-CA 3.41Å; Y706-A709 WeakPolarHBondContact O-CB 3.3Å; Y706-A709 PolarHBondContact O-N 3.1Å; F707-A709 VanDerWaalsContact C-N 3.34Å; A709-S712 WeakPolarHBondContact O-CB 3.37Å; A709-S712 PolarHBondContact O-N 3.14Å; A709-G713 PolarHBondContact O-N 2.79Å; A709-L844 HydrophobicContact CB-CD1 4.26Å; A709-L844 HydrophobicContact CB-CD2 4.16Å; A709-Y851 HydrophobicContact CB-CE1 3.9Å
710	L	98.3	Very high	97	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-62.6	-49.4	173.5	-172.6	76.3	0	0	0	110.7	Y706 F707 S712 G713 A802 M803 Y806 A841 L844	Y706-L710 HydrophobicContact CE1-CD2 4.22Å; Y706-L710 WeakPolarHBondContact O-CB 3.46Å; Y706-L710 PolarHBondContact O-N 3.16Å; F707-L710 HydrophobicContact CD1-CD2 3.65Å; F707-L710 HydrophobicContact CE1-CD2 3.7Å; F707-L710 PolarHBondContact O-N 3.27Å; L710-S712 PolarHBondContact O-N 3.39Å; L710-G713 PolarHBondContact O-N 3.49Å; L710-A802 HydrophobicContact CD2-CB 4.46Å; L710-A802 VanDerWaalsContact CD2-O 3.29Å; L710-A802 WeakPolarHBondContact CD2-O 3.3Å; L710-M803 HydrophobicContact CD1-CB 3.9Å; L710-M803 HydrophobicContact CD2-CB 4.06Å; L710-M803 HydrophobicContact CG-CB 4.48Å; L710-Y806 HydrophobicContact CD1-CD2 3.43Å; L710-Y806 VanDerWaalsContact CD1-CD2 3.43Å; L710-Y806 HydrophobicContact CD1-CE2 3.86Å; L710-Y806 HydrophobicContact CD1-CG 4Å; L710-Y806 HydrophobicContact CG-CD2 4.04Å; L710-Y806 HydrophobicContact CG-CE2 4.45Å; L710-Y806 WeakPolarHBondContact O-CD2 3.34Å; L710-Y806 VanDerWaalsContact O-CE2 3.26Å; L710-Y806 WeakPolarHBondContact O-CE2 3.37Å; L710-A841 HydrophobicContact CD1-CB 3.91Å; L710-L844 HydrophobicContact CB-CD2 4.26Å; L710-L844 HydrophobicContact CD1-CD2 4.3Å
711	E	96.7	Very high	97.1	Very high	8 Å²	8	34.1 Å²	34.1	4%	0.037	19%	0.186	C	C	.	.	H	α-helix	trans	-58.9	-34.2	175	-177.2	164.2	-159.7	0	0	112.4	R677 I678 L679 S680 F707 G713 Y714 R722	R677-E711 VanDerWaalsContact C-OE2 3.26Å; R677-E711 WeakPolarHBondContact CA-OE1 3.3Å; R677-E711 VanDerWaalsContact CA-OE2 3.31Å; R677-E711 WeakPolarHBondContact CA-OE2 3.34Å; I678-E711 PolarHBondContact N-OE1 2.93Å; L679-E711 HydrophobicContact CB-CB 4.25Å; L679-E711 HydrophobicContact CB-CG 3.99Å; L679-E711 HydrophobicContact CD2-CB 4.27Å; L679-E711 PolarHBondContact N-OE1 2.81Å; L679-E711 PolarHBondContact N-OE2 2.95Å; S680-E711 WeakPolarHBondContact CB-OE2 3.43Å; S680-E711 PolarHBondContact N-OE2 3.48Å; S680-E711 PolarHBondContact OG-OE2 3.45Å; F707-E711 VanDerWaalsContact O-CB 3.24Å; F707-E711 WeakPolarHBondContact O-CB 3.39Å; F707-E711 PolarHBondContact O-N 2.99Å; E711-G713 VanDerWaalsContact C-N 3.27Å; E711-G713 PolarHBondContact O-N 3.43Å; E711-Y714 PolarHBondContact O-N 3.06Å; E711-R722 HydrophobicContact CG-CB 4Å; E711-R722 VanDerWaalsContact CG-CD 3.42Å; E711-R722 HydrophobicContact CG-CG 4.3Å; E711-R722 WeakPolarHBondContact OE1-CD 3.44Å; E711-R722 IonicContact OE1-NH1 2.63Å
712	S	95.5	Very high	97.2	Very high	103 Å²	103	31 Å²	31	72%	0.72	17%	0.172	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.3	-14	176.2	-60	0	0	0	0	114.6	C708 A709 L710	C708-S712 WeakPolarHBondContact O-CB 3.29Å; C708-S712 PolarHBondContact O-N 3Å; C708-S712 VanDerWaalsContact O-N 3.1Å; C708-S712 PolarHBondContact O-OG 3.17Å; A709-S712 WeakPolarHBondContact O-CB 3.37Å; A709-S712 PolarHBondContact O-N 3.14Å; L710-S712 PolarHBondContact O-N 3.39Å
713	G	96.6	Very high	97.2	Very high	15 Å²	15	29.9 Å²	29.9	16%	0.155	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.3	-10.3	175.6	0	0	0	0	0	114.3	A709 L710 E711 D807	A709-G713 PolarHBondContact O-N 2.79Å; L710-G713 PolarHBondContact O-N 3.49Å; E711-G713 VanDerWaalsContact C-N 3.27Å; E711-G713 PolarHBondContact O-N 3.43Å; G713-D807 WeakPolarHBondContact O-CA 3.33Å; G713-D807 PolarHBondContact O-N 2.87Å
714	Y	97.9	Very high	97.2	Very high	15 Å²	15	29.9 Å²	29.9	6%	0.059	17%	0.168	C	C	.	.	S	Bend	trans	-71.1	132.4	167.9	-83.1	-88.6	0	0	0	110.4	L679 E711 N721 R722 A725 A802 M803 D805 Y806	L679-Y714 HydrophobicContact CD2-CD2 4.14Å; L679-Y714 HydrophobicContact CD2-CE2 3.87Å; E711-Y714 PolarHBondContact O-N 3.06Å; Y714-N721 VanDerWaalsContact CD1-C 3.44Å; Y714-R722 HydrophobicContact CD2-CB 4.29Å; Y714-R722 HydrophobicContact CG-CB 4.04Å; Y714-A725 HydrophobicContact CE1-CB 3.74Å; Y714-A725 HydrophobicContact CE2-CB 4.1Å; Y714-A725 VanDerWaalsContact CZ-CB 3.47Å; Y714-A725 WeakPolarHBondContact OH-CB 3.05Å; Y714-A802 PolarHBondContact OH-O 3.47Å; Y714-M803 WeakPolarHBondContact OH-CA 3.47Å; Y714-D805 HydrophobicContact CE1-CB 3.62Å; Y714-D805 WeakPolarHBondContact CE1-O 3.48Å; Y714-D805 PolarHBondContact OH-N 2.98Å; Y714-Y806 HydrophobicContact CD2-CD2 4.39Å; Y714-Y806 HydrophobicContact CE2-CD2 4.33Å
715	R	96.6	Very high	97.3	Very high	92 Å²	92	29.4 Å²	29.4	35%	0.347	17%	0.165	S	C	.	.			trans	-81.4	152.6	-176.1	-54.6	-167.1	-173.4	167.9	8.1	110.9	I717 N721 D807 H808	R715-I717 HydrophobicContact CB-CG1 4.29Å; R715-I717 HydrophobicContact CB-CG2 4.12Å; R715-I717 PolarHBondContact O-N 3.19Å; R715-N721 WeakPolarHBondContact O-CB 3.48Å; R715-D807 IonicContact CZ-OD1 2.99Å; R715-D807 IonicContact CZ-OD2 2.81Å; R715-D807 IonicContact NE-OD1 2.94Å; R715-D807 PolarHBondContact NE-OD1 3.33Å; R715-D807 PolarHBondContact NH2-O 3.38Å; R715-D807 IonicContact NH2-OD1 2.67Å; R715-D807 PolarHBondContact NH2-OD1 2.87Å; R715-D807 IonicContact NH2-OD2 2.82Å; R715-D807 PolarHBondContact NH2-OD2 2.76Å; R715-H808 VanDerWaalsContact CD-O 3.25Å; R715-H808 WeakPolarHBondContact CD-O 3.25Å
716	D	95.9	Very high	97.4	Very high	112 Å²	112	27.8 Å²	27.8	60%	0.599	15%	0.154	S	C	*	.	S	Bend	trans	-79.1	68.5	172.9	-166.1	44.2	0	0	0	110.3	K674	K674-D716 IonicContact NZ-OD1 3.62Å; K674-D716 PolarHBondContact NZ-OD1 3.41Å; K674-D716 IonicContact NZ-OD2 3.55Å; K674-D716 PolarHBondContact NZ-OD2 3.48Å
717	I	96.9	Very high	97.4	Very high	24 Å²	24	27.8 Å²	27.8	12%	0.123	15%	0.154	C	C	.	.			trans	-114	157.8	178.3	56	174	0	0	0	111.1	R715 Y719 H720 N721 H808	R715-I717 HydrophobicContact CB-CG1 4.29Å; R715-I717 HydrophobicContact CB-CG2 4.12Å; R715-I717 PolarHBondContact O-N 3.19Å; I717-Y719 PolarHBondContact O-N 3.12Å; I717-H720 HydrophobicContact CD1-CB 4.07Å; I717-H720 WeakPolarHBondContact CD1-O 3.46Å; I717-N721 PolarHBondContact O-ND2 3.11Å; I717-H808 HydrophobicContact CD1-CB 4.3Å; I717-H808 WeakPolarHBondContact CD1-O 3.23Å
718	P	97.6	Very high	97.5	Very high	42 Å²	42	27.8 Å²	27.8	27%	0.273	15%	0.154	S	C	.	.	S	Bend	trans	-62.4	-32	-166	-25.4	35.4	0	0	0	116.2	G937 N940 E941	P718-G937 WeakPolarHBondContact CB-O 3.32Å; P718-N940 HydrophobicContact CB-CB 3.94Å; P718-N940 HydrophobicContact CG-CB 4.16Å; P718-E941 HydrophobicContact CB-CB 4.14Å; P718-E941 HydrophobicContact CG-CB 4.18Å
719	Y	98.4	Very high	97.6	Very high	20 Å²	20	26.4 Å²	26.4	8%	0.078	15%	0.145	C	C	.	.	S	Bend	trans	-120.7	-65.5	-178.5	-176.7	-117.3	0	0	0	114	I717 N721 H724 W934 I938 E941	I717-Y719 PolarHBondContact O-N 3.12Å; Y719-N721 PolarHBondContact O-N 3.17Å; Y719-N721 PolarHBondContact O-ND2 3.17Å; Y719-H724 AromaticContact CE2-ND1 3.8Å; Y719-H724 AromaticContact CZ-CE1 3.61Å; Y719-H724 AromaticContact CZ-ND1 3.48Å; Y719-H724 VanDerWaalsContact O-CB 3.29Å; Y719-H724 WeakPolarHBondContact O-CB 3.3Å; Y719-H724 PolarHBondContact OH-CE1 3.02Å; Y719-H724 PolarHBondContact OH-ND1 3.11Å; Y719-W934 AromaticContact CD2-CE3 3.69Å; Y719-W934 HydrophobicContact CD2-CE3 3.69Å; Y719-W934 HydrophobicContact CD2-CZ3 4.18Å; Y719-W934 HydrophobicContact CE2-CB 4.38Å; Y719-W934 HydrophobicContact CE2-CD2 4.16Å; Y719-W934 AromaticContact CE2-CE3 3.57Å; Y719-W934 HydrophobicContact CE2-CE3 3.57Å; Y719-W934 HydrophobicContact CE2-CZ3 4.21Å; Y719-I938 HydrophobicContact CD1-CG1 3.73Å; Y719-I938 HydrophobicContact CD2-CD1 4.33Å; Y719-I938 HydrophobicContact CD2-CG1 3.55Å; Y719-I938 HydrophobicContact CE1-CD1 4.29Å; Y719-I938 HydrophobicContact CE1-CG1 3.85Å; Y719-I938 HydrophobicContact CE2-CD1 3.99Å; Y719-I938 HydrophobicContact CE2-CG1 3.71Å; Y719-I938 HydrophobicContact CG-CG1 3.57Å; Y719-E941 PolarHBondContact N-OE2 3.47Å
720	H	98.6	Very high	97.7	Very high	37 Å²	37	25.6 Å²	25.6	17%	0.171	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.9	65.7	-169.6	-54.2	93	0	0	0	111.8	I717 D805 H808 E941	I717-H720 HydrophobicContact CD1-CB 4.07Å; I717-H720 WeakPolarHBondContact CD1-O 3.46Å; H720-D805 WeakPolarHBondContact CB-OD2 3.38Å; H720-D805 IonicContact CD2-OD1 3.68Å; H720-D805 IonicContact CD2-OD2 3.82Å; H720-D805 PolarHBondContact CD2-OD2 2.84Å; H720-D805 IonicContact CG-OD2 2.82Å; H720-H808 HydrophobicContact CB-CB 3.78Å; H720-H808 VanDerWaalsContact CB-CG 3.5Å; H720-H808 WeakPolarHBondContact CB-ND1 3.41Å; H720-H808 AromaticContact CE1-CE1 3.6Å; H720-H808 AromaticContact CG-CE1 3.52Å; H720-H808 AromaticContact CG-CG 3.87Å; H720-H808 AromaticContact CG-ND1 3.42Å; H720-H808 AromaticContact ND1-CE1 3.22Å; H720-H808 PolarHBondContact ND1-CE1 3.1Å; H720-H808 AromaticContact ND1-ND1 3.44Å; H720-H808 PolarHBondContact ND1-ND1 3.2Å; H720-E941 IonicContact CE1-OE1 3.05Å; H720-E941 PolarHBondContact CE1-OE1 2.92Å; H720-E941 IonicContact CG-OE1 2.69Å; H720-E941 PolarHBondContact N-OE2 3.22Å; H720-E941 IonicContact ND1-OE1 2.71Å; H720-E941 PolarHBondContact ND1-OE1 3.43Å; H720-E941 IonicContact ND1-OE2 3.89Å
721	N	97.4	Very high	97.7	Very high	22 Å²	22	25.6 Å²	25.6	12%	0.118	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	-124.6	178.5	-175.1	67.4	56.9	0	0	0	110.8	Y714 R715 I717 Y719 V723 H724 A725	Y714-N721 VanDerWaalsContact CD1-C 3.44Å; R715-N721 WeakPolarHBondContact O-CB 3.48Å; I717-N721 PolarHBondContact O-ND2 3.11Å; Y719-N721 PolarHBondContact O-N 3.17Å; Y719-N721 PolarHBondContact O-ND2 3.17Å; N721-V723 PolarHBondContact O-N 3.05Å; N721-V723 VanDerWaalsContact O-N 3.08Å; N721-V723 WeakPolarHBondContact OD1-CA 3.48Å; N721-V723 VanDerWaalsContact OD1-CB 3.27Å; N721-V723 WeakPolarHBondContact OD1-CB 3.38Å; N721-V723 WeakPolarHBondContact OD1-CG2 3.36Å; N721-V723 PolarHBondContact OD1-N 3.34Å; N721-H724 WeakPolarHBondContact O-CB 3.29Å; N721-H724 PolarHBondContact O-N 2.79Å; N721-A725 PolarHBondContact O-N 3.15Å
722	R	97	Very high	97.8	Very high	30 Å²	30	25.2 Å²	25.2	11%	0.113	14%	0.136	C	C	.	.	H	α-helix	trans	-58	-22.2	-178.4	57.1	-172.7	172.5	75.3	7.3	115	G673 K674 G676 L679 E711 Y714 T726	G673-R722 PolarHBondContact O-NH1 3.48Å; G673-R722 PolarHBondContact O-NH2 3.48Å; K674-R722 VanDerWaalsContact CA-NH2 3.32Å; K674-R722 PolarHBondContact O-NH2 3.14Å; G676-R722 PolarHBondContact O-NH1 3.25Å; L679-R722 HydrophobicContact CB-CB 4.33Å; L679-R722 HydrophobicContact CD2-CB 4.42Å; E711-R722 HydrophobicContact CG-CB 4Å; E711-R722 VanDerWaalsContact CG-CD 3.42Å; E711-R722 HydrophobicContact CG-CG 4.3Å; E711-R722 WeakPolarHBondContact OE1-CD 3.44Å; E711-R722 IonicContact OE1-NH1 2.63Å; Y714-R722 HydrophobicContact CD2-CB 4.29Å; Y714-R722 HydrophobicContact CG-CB 4.04Å; R722-T726 WeakPolarHBondContact O-CB 3.24Å; R722-T726 PolarHBondContact O-N 3.19Å; R722-T726 VanDerWaalsContact O-N 3.14Å; R722-T726 PolarHBondContact O-OG1 3.19Å
723	V	97.6	Very high	98	Very high	15 Å²	15	20.3 Å²	20.3	9%	0.091	10%	0.102	C	C	.	.	H	α-helix	trans	-75.4	-42.9	174.8	-166.8	0	0	0	0	110.3	I664 V668 I678 N721 T726 D727 W934	I664-V723 HydrophobicContact CD1-CG1 3.79Å; I664-V723 WeakPolarHBondContact CD1-O 3.29Å; I664-V723 HydrophobicContact CG1-CG1 3.95Å; V668-V723 HydrophobicContact CG2-CB 4.31Å; V668-V723 HydrophobicContact CG2-CG1 3.54Å; V668-V723 HydrophobicContact CG2-CG2 3.7Å; I678-V723 HydrophobicContact CG2-CG2 4.48Å; N721-V723 PolarHBondContact O-N 3.05Å; N721-V723 VanDerWaalsContact O-N 3.08Å; N721-V723 WeakPolarHBondContact OD1-CA 3.48Å; N721-V723 VanDerWaalsContact OD1-CB 3.27Å; N721-V723 WeakPolarHBondContact OD1-CB 3.38Å; N721-V723 WeakPolarHBondContact OD1-CG2 3.36Å; N721-V723 PolarHBondContact OD1-N 3.34Å; V723-T726 WeakPolarHBondContact O-CB 3.1Å; V723-T726 PolarHBondContact O-N 3.42Å; V723-T726 VanDerWaalsContact O-N 3.13Å; V723-D727 PolarHBondContact O-N 3.13Å; V723-W934 HydrophobicContact CB-CH2 4.17Å; V723-W934 HydrophobicContact CG1-CH2 3.87Å; V723-W934 HydrophobicContact CG1-CZ2 4.47Å
724	H	98.6	Very high	98	Very high	1 Å²	1	21 Å²	21	1%	0.005	10%	0.1	C	C	.	.	H	α-helix	trans	-59.3	-49.9	171.9	172.5	63.3	0	0	0	110.9	Y719 N721 T726 D727 V728 H804 D805 D920 W934	Y719-H724 AromaticContact CE2-ND1 3.8Å; Y719-H724 AromaticContact CZ-CE1 3.61Å; Y719-H724 AromaticContact CZ-ND1 3.48Å; Y719-H724 VanDerWaalsContact O-CB 3.29Å; Y719-H724 WeakPolarHBondContact O-CB 3.3Å; Y719-H724 PolarHBondContact OH-CE1 3.02Å; Y719-H724 PolarHBondContact OH-ND1 3.11Å; N721-H724 WeakPolarHBondContact O-CB 3.29Å; N721-H724 PolarHBondContact O-N 2.79Å; H724-T726 PolarHBondContact O-N 3.21Å; H724-D727 PolarHBondContact O-N 2.96Å; H724-V728 WeakPolarHBondContact CE1-CG2 3.44Å; H724-V728 WeakPolarHBondContact O-CG2 3.27Å; H724-V728 PolarHBondContact O-N 2.98Å; H724-H804 AromaticContact CD2-CE1 3.88Å; H724-H804 AromaticContact CD2-NE2 3.61Å; H724-H804 AromaticContact NE2-CE1 3.72Å; H724-H804 AromaticContact NE2-NE2 3.19Å; H724-H804 PolarHBondContact NE2-NE2 3.11Å; H724-H804 VanDerWaalsContact NE2-NE2 3.19Å; H724-D805 IonicContact CD2-OD2 2.71Å; H724-D805 PolarHBondContact CD2-OD2 3.28Å; H724-D805 IonicContact NE2-OD2 3.67Å; H724-D920 PolarHBondContact CE1-O 3.43Å; H724-D920 IonicContact CE1-OD1 3.41Å; H724-D920 IonicContact NE2-OD1 2.75Å; H724-D920 PolarHBondContact NE2-OD1 3.18Å; H724-W934 HydrophobicContact CB-CH2 4.2Å; H724-W934 HydrophobicContact CB-CZ3 4.13Å
725	A	98.7	Very high	98.1	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-55.8	-29.8	174.8	0	0	0	0	0	113.8	L679 Y714 N721 L729	L679-A725 HydrophobicContact CD1-CB 4.22Å; L679-A725 HydrophobicContact CD2-CB 4.23Å; Y714-A725 HydrophobicContact CE1-CB 3.74Å; Y714-A725 HydrophobicContact CE2-CB 4.1Å; Y714-A725 VanDerWaalsContact CZ-CB 3.47Å; Y714-A725 WeakPolarHBondContact OH-CB 3.05Å; N721-A725 PolarHBondContact O-N 3.15Å; A725-L729 WeakPolarHBondContact O-CB 3.41Å; A725-L729 PolarHBondContact O-N 3.46Å; A725-L729 VanDerWaalsContact O-N 3.15Å
726	T	98.6	Very high	98.1	Very high	0 Å²	0	15.9 Å²	15.9	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-76.9	-37.3	174.8	-58.1	0	0	0	0	112.4	I664 I678 L679 V682 R722 V723 H724 L729 H730	I664-T726 HydrophobicContact CD1-CG2 3.84Å; I678-T726 HydrophobicContact CD1-CG2 4.41Å; I678-T726 HydrophobicContact CG1-CG2 4.21Å; L679-T726 VanDerWaalsContact CA-OG1 3.26Å; L679-T726 WeakPolarHBondContact CA-OG1 3.41Å; L679-T726 WeakPolarHBondContact CB-OG1 3.21Å; L679-T726 WeakPolarHBondContact CD1-OG1 3.48Å; V682-T726 HydrophobicContact CB-CG2 3.76Å; V682-T726 HydrophobicContact CG1-CG2 3.84Å; V682-T726 HydrophobicContact CG2-CG2 3.7Å; R722-T726 WeakPolarHBondContact O-CB 3.24Å; R722-T726 PolarHBondContact O-N 3.19Å; R722-T726 VanDerWaalsContact O-N 3.14Å; R722-T726 PolarHBondContact O-OG1 3.19Å; V723-T726 WeakPolarHBondContact O-CB 3.1Å; V723-T726 PolarHBondContact O-N 3.42Å; V723-T726 VanDerWaalsContact O-N 3.13Å; H724-T726 PolarHBondContact O-N 3.21Å; T726-L729 PolarHBondContact O-N 3.02Å; T726-H730 WeakPolarHBondContact O-CB 3.37Å; T726-H730 PolarHBondContact O-N 3.5Å
727	D	98.8	Very high	98.1	Very high	1 Å²	1	10.6 Å²	10.6	1%	0.005	5%	0.053	C	C	.	.	H	α-helix	trans	-69.5	-39.5	176.7	-163.9	65.2	0	0	0	111.7	I664 V723 H724 H730 A731 N922 K926 W934	I664-D727 HydrophobicContact CD1-CB 3.74Å; V723-D727 PolarHBondContact O-N 3.13Å; H724-D727 PolarHBondContact O-N 2.96Å; D727-H730 PolarHBondContact O-N 2.94Å; D727-A731 VanDerWaalsContact O-CB 3.28Å; D727-A731 WeakPolarHBondContact O-CB 3.24Å; D727-A731 PolarHBondContact O-N 3.42Å; D727-N922 PolarHBondContact OD2-ND2 2.8Å; D727-N922 PolarHBondContact OD2-OD1 3.28Å; D727-K926 IonicContact OD1-NZ 3.74Å; D727-K926 PolarHBondContact OD1-NZ 3.41Å; D727-K926 IonicContact OD2-NZ 3.77Å; D727-K926 PolarHBondContact OD2-NZ 3.37Å; D727-W934 HydrophobicContact CB-CH2 4.43Å; D727-W934 HydrophobicContact CB-CZ2 3.66Å; D727-W934 PolarHBondContact OD2-NE1 3.24Å
728	V	98.9	Very high	98	Very high	0 Å²	0	9.9 Å²	9.9	0%	0	5%	0.048	C	C	.	.	H	α-helix	trans	-64.6	-42.4	172.3	-177.8	0	0	0	0	110.9	H724 A731 V732 A801 I916 A919	H724-V728 WeakPolarHBondContact CE1-CG2 3.44Å; H724-V728 WeakPolarHBondContact O-CG2 3.27Å; H724-V728 PolarHBondContact O-N 2.98Å; V728-A731 PolarHBondContact O-N 2.81Å; V728-V732 WeakPolarHBondContact O-CG2 3.37Å; V728-V732 PolarHBondContact O-N 3.34Å; V728-A801 HydrophobicContact CG1-CB 4.04Å; V728-I916 HydrophobicContact CG1-CG1 4.24Å; V728-A919 HydrophobicContact CG1-CB 3.97Å
729	L	98.9	Very high	97.8	Very high	0 Å²	0	9.9 Å²	9.9	0%	0	5%	0.048	C	C	.	.	H	α-helix	trans	-61.1	-46.3	174.7	169.3	63.4	0	0	0	112.3	L679 V682 T683 L686 A725 T726 V732 W733 A801 A802	L679-L729 HydrophobicContact CD1-CD2 4.07Å; V682-L729 HydrophobicContact CG1-CD2 4.06Å; T683-L729 HydrophobicContact CG2-CD2 4.23Å; T683-L729 VanDerWaalsContact OG1-CD2 3.24Å; T683-L729 WeakPolarHBondContact OG1-CD2 3.33Å; L686-L729 HydrophobicContact CD1-CD1 4.02Å; L686-L729 HydrophobicContact CD1-CD2 4.37Å; L686-L729 HydrophobicContact CD1-CG 3.82Å; A725-L729 WeakPolarHBondContact O-CB 3.41Å; A725-L729 PolarHBondContact O-N 3.46Å; A725-L729 VanDerWaalsContact O-N 3.15Å; T726-L729 PolarHBondContact O-N 3.02Å; L729-V732 VanDerWaalsContact O-CG2 3.29Å; L729-V732 WeakPolarHBondContact O-CG2 3.47Å; L729-W733 PolarHBondContact O-N 2.93Å; L729-A801 HydrophobicContact CB-CB 4.23Å; L729-A802 HydrophobicContact CD2-CB 4.42Å
730	H	98.6	Very high	97.6	Very high	0 Å²	0	9 Å²	9	0%	0	5%	0.045	C	C	.	.	H	α-helix	trans	-60	-46.7	173.4	166.7	-102.2	0	0	0	111.1	M657 T659 F662 T726 D727 W733 Y734	M657-H730 HydrophobicContact CE-CB 4.37Å; M657-H730 PolarHBondContact O-NE2 3.29Å; T659-H730 PolarHBondContact O-CE1 3.07Å; T659-H730 PolarHBondContact O-NE2 3Å; F662-H730 VanDerWaalsContact CB-CE1 3.44Å; F662-H730 WeakPolarHBondContact CB-CE1 3.18Å; F662-H730 HydrophobicContact CD1-CB 4.35Å; F662-H730 AromaticContact CD1-CG 3.85Å; T726-H730 WeakPolarHBondContact O-CB 3.37Å; T726-H730 PolarHBondContact O-N 3.5Å; D727-H730 PolarHBondContact O-N 2.94Å; H730-W733 AromaticContact CD2-CE3 3.92Å; H730-W733 AromaticContact CD2-CZ3 3.91Å; H730-W733 AromaticContact NE2-CZ3 3.98Å; H730-W733 PolarHBondContact O-N 3.43Å; H730-Y734 WeakPolarHBondContact O-CB 3.46Å; H730-Y734 PolarHBondContact O-N 2.89Å
731	A	98.8	Very high	97.3	Very high	0 Å²	0	7.8 Å²	7.8	0%	0	4%	0.04	C	C	.	.	H	α-helix	trans	-63.6	-43.2	-178.8	0	0	0	0	0	112.9	W660 D727 V728 W733 Y734 L735 A919	W660-A731 HydrophobicContact CH2-CB 4.04Å; W660-A731 HydrophobicContact CZ3-CB 3.8Å; D727-A731 VanDerWaalsContact O-CB 3.28Å; D727-A731 WeakPolarHBondContact O-CB 3.24Å; D727-A731 PolarHBondContact O-N 3.42Å; V728-A731 PolarHBondContact O-N 2.81Å; A731-W733 PolarHBondContact O-N 3.15Å; A731-Y734 PolarHBondContact O-N 3.44Å; A731-L735 VanDerWaalsContact O-CB 3.32Å; A731-L735 WeakPolarHBondContact O-CB 3.44Å; A731-L735 WeakPolarHBondContact O-CD1 3.38Å; A731-L735 WeakPolarHBondContact O-CG 3.36Å; A731-L735 PolarHBondContact O-N 3Å; A731-A919 HydrophobicContact CB-CB 3.63Å
732	V	98.8	Very high	96.8	Very high	0 Å²	0	8.9 Å²	8.9	0%	0	6%	0.057	C	C	.	.	H	α-helix	trans	-65.6	-35.8	175.8	-65.5	0	0	0	0	112.7	V728 L729 T736 L797 Y798 A801 I916 A919	V728-V732 WeakPolarHBondContact O-CG2 3.37Å; V728-V732 PolarHBondContact O-N 3.34Å; L729-V732 VanDerWaalsContact O-CG2 3.29Å; L729-V732 WeakPolarHBondContact O-CG2 3.47Å; V732-T736 WeakPolarHBondContact O-CB 3.21Å; V732-T736 WeakPolarHBondContact O-CG2 3.33Å; V732-T736 PolarHBondContact O-N 2.79Å; V732-T736 PolarHBondContact O-OG1 3.33Å; V732-L797 HydrophobicContact CB-CD2 4.22Å; V732-L797 HydrophobicContact CB-CG 4.1Å; V732-L797 HydrophobicContact CG1-CD1 4.18Å; V732-L797 HydrophobicContact CG1-CG 4.27Å; V732-L797 HydrophobicContact CG2-CG 4.4Å; V732-Y798 HydrophobicContact CG2-CD1 3.77Å; V732-Y798 HydrophobicContact CG2-CE1 4.34Å; V732-A801 HydrophobicContact CG1-CB 4.46Å; V732-A801 HydrophobicContact CG2-CB 3.72Å; V732-I916 HydrophobicContact CG1-CB 4.12Å; V732-I916 HydrophobicContact CG1-CG1 4.27Å; V732-A919 HydrophobicContact CB-CB 4.45Å; V732-A919 HydrophobicContact CG1-CB 3.41Å; V732-A919 VanDerWaalsContact CG1-CB 3.41Å
733	W	98.6	Very high	96.5	Very high	0 Å²	0	8.4 Å²	8.4	0%	0	6%	0.056	C	C	.	.	H	α-helix	trans	-67.1	-44.9	173.3	163.1	88.4	0	0	0	111.1	M654 M657 L686 D689 L729 H730 A731 T736 T737 Y798	M654-W733 HydrophobicContact CE-CH2 4.06Å; M654-W733 HydrophobicContact CE-CZ2 3.52Å; M657-W733 HydrophobicContact CB-CZ3 4.4Å; M657-W733 VanDerWaalsContact O-CZ3 3.3Å; M657-W733 WeakPolarHBondContact O-CZ3 3.45Å; L686-W733 HydrophobicContact CD1-CB 3.89Å; L686-W733 HydrophobicContact CD1-CG 4.07Å; L686-W733 HydrophobicContact CD2-CB 4.33Å; L686-W733 HydrophobicContact CD2-CD2 3.49Å; L686-W733 VanDerWaalsContact CD2-CD2 3.49Å; L686-W733 HydrophobicContact CD2-CE3 4.08Å; L686-W733 HydrophobicContact CD2-CG 3.59Å; L686-W733 HydrophobicContact CD2-CZ2 4.21Å; L686-W733 HydrophobicContact CG-CG 4.35Å; D689-W733 PolarHBondContact OD2-NE1 3.35Å; L729-W733 PolarHBondContact O-N 2.93Å; H730-W733 AromaticContact CD2-CE3 3.92Å; H730-W733 AromaticContact CD2-CZ3 3.91Å; H730-W733 AromaticContact NE2-CZ3 3.98Å; H730-W733 PolarHBondContact O-N 3.43Å; A731-W733 PolarHBondContact O-N 3.15Å; W733-T736 PolarHBondContact O-N 2.96Å; W733-T736 PolarHBondContact O-OG1 3.44Å; W733-T737 HydrophobicContact CG-CG2 4.39Å; W733-T737 VanDerWaalsContact O-CB 3.31Å; W733-T737 WeakPolarHBondContact O-CB 3.48Å; W733-T737 VanDerWaalsContact O-CG2 3.24Å; W733-T737 WeakPolarHBondContact O-CG2 3.27Å; W733-T737 PolarHBondContact O-N 2.82Å; W733-T737 PolarHBondContact O-OG1 2.84Å; W733-Y798 HydrophobicContact CB-CE1 4.18Å
734	Y	98.1	Very high	95.7	Very high	29 Å²	29	15.3 Å²	15.3	11%	0.114	9%	0.087	C	C	.	.	H	α-helix	trans	-60.7	-51	179.4	-172.6	-83.9	0	0	0	111.1	D658 T659 W660 H730 A731 T736 T737 R738 P993	D658-Y734 WeakPolarHBondContact O-CE2 3.4Å; T659-Y734 VanDerWaalsContact C-CE2 3.5Å; W660-Y734 HydrophobicContact CB-CD1 4.42Å; W660-Y734 HydrophobicContact CB-CE1 3.81Å; W660-Y734 HydrophobicContact CB-CE2 4.08Å; W660-Y734 HydrophobicContact CD2-CD1 4.41Å; W660-Y734 HydrophobicContact CD2-CE1 4.43Å; W660-Y734 AromaticContact CE3-CD1 3.51Å; W660-Y734 HydrophobicContact CE3-CD1 3.51Å; W660-Y734 AromaticContact CE3-CE1 3.96Å; W660-Y734 HydrophobicContact CE3-CE1 3.96Å; W660-Y734 AromaticContact CE3-CG 3.97Å; W660-Y734 HydrophobicContact CE3-CG 3.97Å; W660-Y734 HydrophobicContact CG-CE1 4.43Å; W660-Y734 HydrophobicContact CZ3-CD1 4.19Å; H730-Y734 WeakPolarHBondContact O-CB 3.46Å; H730-Y734 PolarHBondContact O-N 2.89Å; A731-Y734 PolarHBondContact O-N 3.44Å; Y734-T736 PolarHBondContact O-N 3.18Å; Y734-T737 PolarHBondContact O-N 2.96Å; Y734-R738 HydrophobicContact CD1-CB 4.45Å; Y734-R738 HydrophobicContact CD1-CG 3.89Å; Y734-R738 HydrophobicContact CD2-CG 3.51Å; Y734-R738 HydrophobicContact CE1-CB 4.25Å; Y734-R738 HydrophobicContact CE1-CG 3.8Å; Y734-R738 HydrophobicContact CE2-CG 3.4Å; Y734-R738 HydrophobicContact CG-CG 3.75Å; Y734-R738 WeakPolarHBondContact O-CB 3.49Å; Y734-R738 WeakPolarHBondContact O-CG 3.49Å; Y734-R738 PolarHBondContact O-N 3.39Å; Y734-P993 HydrophobicContact CD1-CG 4.41Å; Y734-P993 HydrophobicContact CE1-CB 4.2Å; Y734-P993 HydrophobicContact CE1-CG 4.33Å
735	L	98.3	Very high	94.7	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-61.7	-27.1	179.5	-69.6	166.4	0	0	0	113.6	W660 A731 L785 L918 A919 Y986 L992 I1042	W660-L735 HydrophobicContact CZ3-CD1 4.47Å; W660-L735 HydrophobicContact CZ3-CD2 4.32Å; W660-L735 HydrophobicContact CZ3-CG 4.12Å; A731-L735 VanDerWaalsContact O-CB 3.32Å; A731-L735 WeakPolarHBondContact O-CB 3.44Å; A731-L735 WeakPolarHBondContact O-CD1 3.38Å; A731-L735 WeakPolarHBondContact O-CG 3.36Å; A731-L735 PolarHBondContact O-N 3Å; L735-L785 WeakPolarHBondContact O-CD1 3.33Å; L735-L918 HydrophobicContact CD1-CD2 3.88Å; L735-L918 HydrophobicContact CD2-CD2 4.32Å; L735-A919 HydrophobicContact CD1-CB 4.33Å; L735-Y986 HydrophobicContact CD2-CE1 4.43Å; L735-L992 HydrophobicContact CD2-CD2 4.28Å; L735-I1042 HydrophobicContact CD2-CD1 3.8Å
736	T	97.6	Very high	93.7	Very high	1 Å²	1	23.8 Å²	23.8	1%	0.006	13%	0.129	C	C	.	.	H	α-helix	trans	-93.9	-18.8	179.5	50.7	0	0	0	0	114.3	V732 W733 Y734 L785 A786 L794 L797 Y798	V732-T736 WeakPolarHBondContact O-CB 3.21Å; V732-T736 WeakPolarHBondContact O-CG2 3.33Å; V732-T736 PolarHBondContact O-N 2.79Å; V732-T736 PolarHBondContact O-OG1 3.33Å; W733-T736 PolarHBondContact O-N 2.96Å; W733-T736 PolarHBondContact O-OG1 3.44Å; Y734-T736 PolarHBondContact O-N 3.18Å; T736-L785 HydrophobicContact CG2-CB 4.26Å; T736-L785 HydrophobicContact CG2-CD1 4.06Å; T736-L785 PolarHBondContact O-N 3.35Å; T736-A786 WeakPolarHBondContact O-CB 3.29Å; T736-A786 PolarHBondContact O-N 3.08Å; T736-L794 HydrophobicContact CG2-CD2 3.98Å; T736-L797 HydrophobicContact CG2-CD2 3.91Å; T736-Y798 PolarHBondContact OG1-OH 2.92Å
737	T	96	Very high	91.6	Very high	1 Å²	1	30.1 Å²	30.1	1%	0.006	16%	0.158	C	C	.	.	H	α-helix	trans	-115.6	-26.6	-170.4	62.4	0	0	0	0	115.6	M690 W733 Y734 S775	M690-T737 HydrophobicContact CE-CG2 3.87Å; M690-T737 HydrophobicContact SD-CG2 3.37Å; M690-T737 WeakPolarHBondContact SD-CG2 3.41Å; W733-T737 HydrophobicContact CG-CG2 4.39Å; W733-T737 VanDerWaalsContact O-CB 3.31Å; W733-T737 WeakPolarHBondContact O-CB 3.48Å; W733-T737 VanDerWaalsContact O-CG2 3.24Å; W733-T737 WeakPolarHBondContact O-CG2 3.27Å; W733-T737 PolarHBondContact O-N 2.82Å; W733-T737 PolarHBondContact O-OG1 2.84Å; Y734-T737 PolarHBondContact O-N 2.96Å; T737-S775 PolarHBondContact O-OG 3.21Å
738	R	94.8	Very high	89.2	Confident	8 Å²	8	32.1 Å²	32.1	3%	0.03	17%	0.172	C	C	.	.	S	Bend	trans	-75	161.8	-179.3	-67.2	-42.4	90	-175.3	4.6	112.3	D658 Y734 I740 S772 S774 C784 P993	D658-R738 VanDerWaalsContact OD1-CD 3.28Å; D658-R738 WeakPolarHBondContact OD1-CD 3.49Å; D658-R738 IonicContact OD1-CZ 2.82Å; D658-R738 IonicContact OD1-NE 3.98Å; D658-R738 IonicContact OD1-NH1 3.92Å; D658-R738 PolarHBondContact OD1-NH1 3.14Å; Y734-R738 HydrophobicContact CD1-CB 4.45Å; Y734-R738 HydrophobicContact CD1-CG 3.89Å; Y734-R738 HydrophobicContact CD2-CG 3.51Å; Y734-R738 HydrophobicContact CE1-CB 4.25Å; Y734-R738 HydrophobicContact CE1-CG 3.8Å; Y734-R738 HydrophobicContact CE2-CG 3.4Å; Y734-R738 HydrophobicContact CG-CG 3.75Å; Y734-R738 WeakPolarHBondContact O-CB 3.49Å; Y734-R738 WeakPolarHBondContact O-CG 3.49Å; Y734-R738 PolarHBondContact O-N 3.39Å; R738-I740 PolarHBondContact O-N 3Å; R738-S772 PolarHBondContact NH2-OG 3.46Å; R738-S774 PolarHBondContact NH1-O 3.03Å; R738-S774 PolarHBondContact NH1-OG 2.84Å; R738-S774 PolarHBondContact NH2-OG 2.85Å; R738-C784 WeakPolarHBondContact O-CB 3.27Å; R738-P993 HydrophobicContact CB-CB 3.85Å; R738-P993 HydrophobicContact CB-CG 4.07Å
739	P	93.6	Very high	86.5	Confident	42 Å²	42	38.6 Å²	38.6	27%	0.273	20%	0.202	S	C	.	.			trans	-65.5	130.9	-178.1	-18.2	31.2	0	0	0	112.8	I777 Y782 P993 G994	P739-I777 HydrophobicContact CB-CD1 4.26Å; P739-I777 HydrophobicContact CB-CG1 4.2Å; P739-I777 HydrophobicContact CG-CD1 4.4Å; P739-I777 HydrophobicContact CG-CG1 3.98Å; P739-Y782 HydrophobicContact CB-CD1 3.59Å; P739-Y782 HydrophobicContact CB-CE1 4.23Å; P739-Y782 HydrophobicContact CB-CG 4.24Å; P739-P993 VanDerWaalsContact O-CA 3.25Å; P739-P993 WeakPolarHBondContact O-CA 3.42Å; P739-G994 PolarHBondContact O-N 2.73Å; P739-G994 VanDerWaalsContact O-N 3.1Å
740	I	93.9	Very high	83.7	Confident	1 Å²	1	48 Å²	48	1%	0.005	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	116.3	176.6	-57.3	174	0	0	0	107.2	R738 G742 F743 Y782 G783 L785 G990 L991 P993	R738-I740 PolarHBondContact O-N 3Å; I740-G742 PolarHBondContact O-N 3.18Å; I740-F743 HydrophobicContact CB-CB 3.74Å; I740-F743 HydrophobicContact CB-CG 4.26Å; I740-F743 HydrophobicContact CG2-CB 3.69Å; I740-F743 HydrophobicContact CG2-CD2 4.23Å; I740-F743 HydrophobicContact CG2-CG 4.21Å; I740-F743 WeakPolarHBondContact O-CB 3.5Å; I740-F743 PolarHBondContact O-N 3.11Å; I740-Y782 WeakPolarHBondContact O-CA 3.5Å; I740-G783 WeakPolarHBondContact CB-O 3.42Å; I740-G783 PolarHBondContact N-O 3.12Å; I740-G783 PolarHBondContact O-N 3.44Å; I740-G783 VanDerWaalsContact O-N 3.08Å; I740-L785 HydrophobicContact CD1-CD2 3.54Å; I740-L785 HydrophobicContact CD1-CG 3.69Å; I740-G990 WeakPolarHBondContact CG2-O 3.32Å; I740-L991 WeakPolarHBondContact CD1-O 3.4Å; I740-P993 HydrophobicContact CG1-CG 4.27Å
741	P	91.6	Very high	81.2	Confident	12 Å²	12	50.8 Å²	50.8	8%	0.078	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	131.2	-175.6	-21.2	32.7	0	0	0	112.5	F743 Y782 G994 W996 L1038	P741-F743 PolarHBondContact O-N 3.38Å; P741-Y782 HydrophobicContact CB-CD1 4.29Å; P741-Y782 HydrophobicContact CB-CE1 4.1Å; P741-Y782 HydrophobicContact CG-CD1 4.14Å; P741-Y782 HydrophobicContact CG-CE1 3.76Å; P741-G994 VanDerWaalsContact CG-C 3.43Å; P741-G994 WeakPolarHBondContact CG-O 3.41Å; P741-W996 HydrophobicContact CB-CD2 3.96Å; P741-W996 VanDerWaalsContact CB-CE2 3.48Å; P741-W996 HydrophobicContact CB-CE3 4.43Å; P741-W996 HydrophobicContact CB-CG 4.48Å; P741-W996 HydrophobicContact CB-CH2 4.07Å; P741-W996 HydrophobicContact CB-CZ2 3.56Å; P741-W996 HydrophobicContact CB-CZ3 4.48Å; P741-L1038 HydrophobicContact CB-CD1 3.57Å; P741-L1038 HydrophobicContact CG-CD1 3.54Å
742	G	87.7	Confident	78.4	Confident	46 Å²	46	54.4 Å²	54.4	47%	0.474	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.5	0.1	180	0	0	0	0	0	115.6	I740 S781	I740-G742 PolarHBondContact O-N 3.18Å; G742-S781 PolarHBondContact N-O 3.36Å
743	F	89.9	Confident	75.3	Confident	20 Å²	20	57.1 Å²	57.1	9%	0.088	31%	0.313	C	S	.	.	P	Polyproline II helix	trans	-74.7	124.2	-179.8	-169	-93.3	0	0	0	111.6	I740 P741 Y782 G783 C784 L785 N788 W902 L991	I740-F743 HydrophobicContact CB-CB 3.74Å; I740-F743 HydrophobicContact CB-CG 4.26Å; I740-F743 HydrophobicContact CG2-CB 3.69Å; I740-F743 HydrophobicContact CG2-CD2 4.23Å; I740-F743 HydrophobicContact CG2-CG 4.21Å; I740-F743 WeakPolarHBondContact O-CB 3.5Å; I740-F743 PolarHBondContact O-N 3.11Å; P741-F743 PolarHBondContact O-N 3.38Å; F743-Y782 CarbonylContact O-C 3.48Å; F743-G783 WeakPolarHBondContact O-CA 3.31Å; F743-G783 PolarHBondContact O-N 3.26Å; F743-C784 VanDerWaalsContact CE1-O 3.28Å; F743-C784 WeakPolarHBondContact CE1-O 3.46Å; F743-L785 HydrophobicContact CD2-CD2 4.41Å; F743-L785 HydrophobicContact CE1-CD2 4.27Å; F743-L785 HydrophobicContact CE2-CD2 3.65Å; F743-L785 HydrophobicContact CZ-CD2 3.56Å; F743-N788 HydrophobicContact CE1-CB 4.39Å; F743-N788 WeakPolarHBondContact CE1-ND2 3.41Å; F743-N788 HydrophobicContact CZ-CB 4.37Å; F743-N788 VanDerWaalsContact CZ-ND2 3.33Å; F743-N788 WeakPolarHBondContact CZ-ND2 3.4Å; F743-W902 HydrophobicContact CE2-CH2 4.09Å; F743-W902 AromaticContact CE2-CZ2 3.6Å; F743-W902 HydrophobicContact CE2-CZ2 3.6Å; F743-W902 AromaticContact CZ-CH2 3.91Å; F743-W902 HydrophobicContact CZ-CH2 3.91Å; F743-W902 AromaticContact CZ-CZ2 3.65Å; F743-W902 HydrophobicContact CZ-CZ2 3.65Å; F743-L991 HydrophobicContact CD2-CD2 4.18Å; F743-L991 HydrophobicContact CE2-CD2 3.63Å
744	Q	81.7	Confident	72.2	Confident	160 Å²	160	61.4 Å²	61.4	75%	0.748	34%	0.343	S	S	*	.	P	Polyproline II helix	trans	-98.1	135.1	-174.1	-65.1	-174.8	-11.3	0	0	112.7	I746 N788	Q744-I746 PolarHBondContact O-N 3.13Å; Q744-N788 PolarHBondContact O-ND2 2.83Å
745	Q	77.7	Confident	69.7	Low	88 Å²	88	67.6 Å²	67.6	41%	0.411	38%	0.378	S	S	.	.	P	Polyproline II helix	trans	-74.5	117.6	167.6	-176.7	170.2	34.6	0	0	110.8	H747 W787	Q745-H747 PolarHBondContact O-N 3.26Å; Q745-H747 PolarHBondContact O-ND1 2.83Å; Q745-H747 VanDerWaalsContact O-ND1 3.09Å; Q745-W787 HydrophobicContact CB-CB 4.4Å; Q745-W787 HydrophobicContact CB-CE3 3.88Å; Q745-W787 HydrophobicContact CG-CB 3.99Å; Q745-W787 HydrophobicContact CG-CE3 4.47Å
746	I	77.7	Confident	66.9	Low	90 Å²	90	73 Å²	73	46%	0.462	41%	0.411	S	S	.	.			trans	-79	109.4	174.6	-66	176	0	0	0	108.3	Q744 S748 N788 W902	Q744-I746 PolarHBondContact O-N 3.13Å; I746-S748 PolarHBondContact O-N 2.88Å; I746-S748 VanDerWaalsContact O-N 3.07Å; I746-N788 PolarHBondContact N-OD1 2.83Å; I746-W902 HydrophobicContact CD1-CB 4.05Å; I746-W902 VanDerWaalsContact CD1-CD1 3.48Å; I746-W902 HydrophobicContact CD1-CG 4.04Å
747	H	54.1	Low	64.4	Low	133 Å²	133	81 Å²	81	62%	0.616	45%	0.454	S	S	*	.			trans	-61.8	108.3	-171.5	-78.4	36.9	0	0	0	112.5	Q745 E749	Q745-H747 PolarHBondContact O-N 3.26Å; Q745-H747 PolarHBondContact O-ND1 2.83Å; Q745-H747 VanDerWaalsContact O-ND1 3.09Å; H747-E749 HydrophobicContact CB-CG 4.26Å; H747-E749 PolarHBondContact O-N 3.21Å; H747-E749 VanDerWaalsContact O-N 3.12Å
748	S	48.8	Very low	61.6	Low	43 Å²	43	85.6 Å²	85.6	30%	0.301	49%	0.486	S	S	.	.			trans	-81.9	26.7	178.8	-154.8	0	0	0	0	113.4	I746 H750 V751	I746-S748 PolarHBondContact O-N 2.88Å; I746-S748 VanDerWaalsContact O-N 3.07Å; S748-H750 PolarHBondContact O-N 2.88Å; S748-V751 PolarHBondContact O-N 3.37Å
749	E	40.9	Very low	59.2	Low	136 Å²	136	93.7 Å²	93.7	64%	0.636	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-19.4	-170.4	-70	-171.1	134.2	0	0	114.4	H747 V751 T752	H747-E749 HydrophobicContact CB-CG 4.26Å; H747-E749 PolarHBondContact O-N 3.21Å; H747-E749 VanDerWaalsContact O-N 3.12Å; E749-V751 PolarHBondContact O-N 3.35Å; E749-T752 WeakPolarHBondContact CA-OG1 3.26Å
750	H	41.4	Very low	56.8	Low	199 Å²	199	96.4 Å²	96.4	92%	0.921	55%	0.55	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.7	0.2	172.7	-72.2	-24.9	0	0	0	114.5	S748	S748-H750 PolarHBondContact O-N 2.88Å
751	V	45.1	Very low	54.4	Low	58 Å²	58	99.8 Å²	99.8	35%	0.352	59%	0.585	S	S	.	*	T	Hydrogen-bonded Turn	trans	-112.3	-20.6	173.2	-173.1	0	0	0	0	112.1	S748 E749 G753 R766	S748-V751 PolarHBondContact O-N 3.37Å; E749-V751 PolarHBondContact O-N 3.35Å; V751-G753 PolarHBondContact O-N 3.04Å; V751-R766 HydrophobicContact CG1-CG 4.23Å
752	T	40.9	Very low	52.2	Low	75 Å²	75	103.3 Å²	103.3	46%	0.46	60%	0.602	S	S	.	*			trans	-98.3	37	-176.2	49.2	0	0	0	0	114.3	E749 S754	E749-T752 WeakPolarHBondContact CA-OG1 3.26Å; T752-S754 PolarHBondContact O-N 3.49Å
753	G	32.3	Very low	50	Low	57 Å²	57	105.2 Å²	105.2	59%	0.588	61%	0.609	S	S	*	*			trans	-64.9	129.3	176.7	0	0	0	0	0	114	V751 R766	V751-G753 PolarHBondContact O-N 3.04Å; G753-R766 PolarHBondContact O-NH2 2.75Å; G753-R766 VanDerWaalsContact O-NH2 3.1Å
754	S	33.8	Very low	47.8	Very low	91 Å²	91	109.6 Å²	109.6	64%	0.636	64%	0.639	S	S	*	*			trans	60.7	126.5	170.7	-151.2	0	0	0	0	118.3	T752	T752-S754 PolarHBondContact O-N 3.49Å
755	D	46.5	Very low	46.4	Very low	158 Å²	158	105.4 Å²	105.4	85%	0.845	64%	0.639	S	S	*	*			trans	-75.4	127.3	150.8	-54.3	-63.2	0	0	0	109.3
756	T	39.8	Very low	45.9	Very low	114 Å²	114	106.8 Å²	106.8	70%	0.699	64%	0.64	S	S	*	*			trans	-153.8	135.1	154.7	48.9	0	0	0	0	108.3	S758	T756-S758 PolarHBondContact O-N 2.95Å
757	D	43.9	Very low	46.2	Very low	168 Å²	168	106.6 Å²	106.6	90%	0.898	64%	0.639	S	S	*	*			trans	-55.1	126.3	-173.1	-52.4	-71.5	0	0	0	113.3
758	S	36.6	Very low	47.8	Very low	98 Å²	98	102.9 Å²	102.9	69%	0.685	63%	0.628	S	S	*	*			trans	-158.8	83.4	169.5	-77.2	0	0	0	0	109.7	T756 S760	T756-S758 PolarHBondContact O-N 2.95Å; S758-S760 PolarHBondContact O-N 3.05Å
759	D	44.4	Very low	49.8	Very low	179 Å²	179	104.5 Å²	104.5	96%	0.957	63%	0.628	S	S	*	*			trans	-73.1	47	178.3	-167.5	23.2	0	0	0	112.2
760	S	43.6	Very low	52.1	Low	98 Å²	98	98.1 Å²	98.1	69%	0.685	60%	0.599	S	S	*	*	S	Bend	trans	-157.4	91.3	-169.4	65.8	0	0	0	0	113.9	S758	S758-S760 PolarHBondContact O-N 3.05Å
761	G	43.8	Very low	54.3	Low	72 Å²	72	92.1 Å²	92.1	74%	0.742	58%	0.576	S	S	*	*			trans	95.5	143.9	156.2	0	0	0	0	0	116.8	S763	G761-S763 PolarHBondContact O-N 3.38Å
762	I	46	Very low	56.5	Low	86 Å²	86	89.7 Å²	89.7	44%	0.441	56%	0.562	S	S	.	*			trans	-58.1	120.3	170	-59.8	163.7	0	0	0	107.8	K697 P764	K697-I762 HydrophobicContact CG-CD1 4.08Å; K697-I762 HydrophobicContact CG-CG1 4.42Å; I762-P764 WeakPolarHBondContact O-CD 3.43Å
763	S	40.5	Very low	58.7	Low	87 Å²	87	91.6 Å²	91.6	61%	0.608	56%	0.564	S	S	*	*			trans	-94.7	106.4	176.9	29.9	0	0	0	0	109.3	G761 G765	G761-S763 PolarHBondContact O-N 3.38Å; S763-G765 PolarHBondContact O-N 3.36Å
764	P	43.4	Very low	61.1	Low	111 Å²	111	90.6 Å²	90.6	72%	0.721	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	95.5	-175.2	27.7	-34.7	0	0	0	110.2	I762	I762-P764 WeakPolarHBondContact O-CD 3.43Å
765	G	53	Low	63.3	Low	73 Å²	73	87.3 Å²	87.3	75%	0.753	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	160.8	-22.7	-177.3	0	0	0	0	0	116.4	S763	S763-G765 PolarHBondContact O-N 3.36Å
766	R	67.7	Low	64.6	Low	117 Å²	117	85.1 Å²	85.1	44%	0.442	52%	0.522	S	S	.	.	S	Bend	trans	-93	124.6	171.5	-173	179	-86.4	-164.5	4.1	109.4	V751 G753 S768	V751-R766 HydrophobicContact CG1-CG 4.23Å; G753-R766 PolarHBondContact O-NH2 2.75Å; G753-R766 VanDerWaalsContact O-NH2 3.1Å; R766-S768 PolarHBondContact O-N 3.34Å
767	I	82.6	Confident	66.3	Low	86 Å²	86	81.4 Å²	81.4	44%	0.441	50%	0.498	S	S	.	.	P	Polyproline II helix	trans	-73.7	118.2	174.8	-60	176.7	0	0	0	108.5	Y769 P790	I767-Y769 HydrophobicContact CB-CE2 4.3Å; I767-Y769 HydrophobicContact CG2-CD2 4.29Å; I767-Y769 HydrophobicContact CG2-CE2 3.7Å; I767-P790 HydrophobicContact CG2-CB 3.79Å; I767-P790 HydrophobicContact CG2-CG 3.87Å
768	S	88.8	Confident	67.3	Low	55 Å²	55	79.2 Å²	79.2	39%	0.385	50%	0.495	S	S	.	.	P	Polyproline II helix	trans	-81.1	136.8	172	-60.6	0	0	0	0	111.2	R766 A791	R766-S768 PolarHBondContact O-N 3.34Å; S768-A791 WeakPolarHBondContact O-CB 3.43Å; S768-A791 PolarHBondContact O-N 2.92Å
769	Y	91.2	Very high	69.3	Low	76 Å²	76	78.1 Å²	78.1	30%	0.298	48%	0.482	S	S	.	.			trans	-109.3	155.5	165.4	-68.6	-98	0	0	0	108.5	I767 W787 I789 P790	I767-Y769 HydrophobicContact CB-CE2 4.3Å; I767-Y769 HydrophobicContact CG2-CD2 4.29Å; I767-Y769 HydrophobicContact CG2-CE2 3.7Å; Y769-W787 WeakPolarHBondContact CD1-O 3.03Å; Y769-I789 WeakPolarHBondContact CD1-O 3.39Å; Y769-P790 HydrophobicContact CE1-CG 4.23Å
770	A	88.9	Confident	71.1	Confident	2 Å²	2	77.9 Å²	77.9	2%	0.017	48%	0.48	C	S	.	.			trans	-118	145.8	-179.1	0	0	0	0	0	109.5	M690 L692 I695 A786 A791 L794	M690-A770 HydrophobicContact CE-CB 3.72Å; L692-A770 HydrophobicContact CD2-CB 4.18Å; I695-A770 HydrophobicContact CD1-CB 3.91Å; A770-A786 WeakPolarHBondContact O-CB 3.37Å; A770-A791 HydrophobicContact CB-CB 3.82Å; A770-L794 HydrophobicContact CB-CD1 4.28Å
771	T	87.5	Confident	73.1	Confident	73 Å²	73	74.5 Å²	74.5	45%	0.448	46%	0.457	S	S	.	.			trans	-131.6	136.8	179.4	-52.9	0	0	0	0	107.9
772	S	90.4	Very high	75.3	Confident	8 Å²	8	73.1 Å²	73.1	6%	0.056	43%	0.429	C	S	.	.			trans	-70.4	132.2	175.3	172.9	0	0	0	0	110.3	D689 R738 S774 S775	D689-S772 PolarHBondContact OD1-OG 3.41Å; D689-S772 VanDerWaalsContact OD2-CB 3.23Å; D689-S772 WeakPolarHBondContact OD2-CB 3.38Å; D689-S772 PolarHBondContact OD2-OG 3.13Å; R738-S772 PolarHBondContact NH2-OG 3.46Å; S772-S774 VanDerWaalsContact C-N 3.26Å; S772-S774 PolarHBondContact O-N 3.34Å; S772-S774 PolarHBondContact OG-N 3.18Å; S772-S774 PolarHBondContact OG-OG 3.35Å; S772-S775 PolarHBondContact O-N 2.93Å
773	K	88.4	Confident	77.5	Confident	115 Å²	115	69 Å²	69	50%	0.5	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-29.1	171.8	-74.5	163.8	178.6	153.3	0	111.7	Q688 D689 C691 E694	Q688-K773 PolarHBondContact O-NZ 3.05Å; D689-K773 WeakPolarHBondContact O-CG 3.47Å; D689-K773 PolarHBondContact O-N 3.04Å; D689-K773 VanDerWaalsContact O-N 3.11Å; D689-K773 WeakPolarHBondContact OD1-CA 3.42Å; D689-K773 PolarHBondContact OD1-N 3.19Å; C691-K773 WeakPolarHBondContact SG-CE 3.4Å; C691-K773 PolarHBondContact SG-NZ 3.09Å; E694-K773 IonicContact OE1-NZ 2.78Å; E694-K773 PolarHBondContact OE1-NZ 3.2Å
774	S	83.3	Confident	80.1	Confident	35 Å²	35	65.1 Å²	65.1	25%	0.245	38%	0.381	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.4	-5.2	176.6	78.7	0	0	0	0	115.2	D689 R738 S772	D689-S774 PolarHBondContact OD1-N 3.06Å; R738-S774 PolarHBondContact NH1-O 3.03Å; R738-S774 PolarHBondContact NH1-OG 2.84Å; R738-S774 PolarHBondContact NH2-OG 2.85Å; S772-S774 VanDerWaalsContact C-N 3.26Å; S772-S774 PolarHBondContact O-N 3.34Å; S772-S774 PolarHBondContact OG-N 3.18Å; S772-S774 PolarHBondContact OG-OG 3.35Å
775	S	79.9	Confident	82.5	Confident	22 Å²	22	59.8 Å²	59.8	15%	0.154	35%	0.346	C	S	.	.			trans	-106.3	102.7	-177.9	-159	0	0	0	0	112.7	T737 S772	T737-S775 PolarHBondContact O-OG 3.21Å; S772-S775 PolarHBondContact O-N 2.93Å
776	S	72.6	Confident	84.5	Confident	112 Å²	112	56.4 Å²	56.4	78%	0.783	31%	0.311	S	S	*	.			trans	-97.3	86.3	175.2	61.9	0	0	0	0	111.9	S778	S776-S778 PolarHBondContact O-N 3.34Å
777	I	76.5	Confident	85.6	Confident	37 Å²	37	53.3 Å²	53.3	19%	0.19	30%	0.299	C	S	.	.			trans	-83.1	112.2	169.1	-59.1	176.2	0	0	0	108.5	P739 C784 W787	P739-I777 HydrophobicContact CB-CD1 4.26Å; P739-I777 HydrophobicContact CB-CG1 4.2Å; P739-I777 HydrophobicContact CG-CD1 4.4Å; P739-I777 HydrophobicContact CG-CG1 3.98Å; I777-C784 HydrophobicContact CD1-CB 4.02Å; I777-W787 HydrophobicContact CB-CH2 3.77Å; I777-W787 HydrophobicContact CB-CZ2 4.01Å; I777-W787 HydrophobicContact CD1-CH2 3.89Å; I777-W787 HydrophobicContact CD1-CZ2 3.96Å; I777-W787 HydrophobicContact CD1-CZ3 4.41Å; I777-W787 HydrophobicContact CG1-CH2 4.4Å; I777-W787 HydrophobicContact CG1-CZ2 4.45Å; I777-W787 HydrophobicContact CG2-CH2 3.68Å; I777-W787 HydrophobicContact CG2-CZ2 4.43Å; I777-W787 HydrophobicContact CG2-CZ3 4.43Å
778	S	65.1	Low	86.1	Confident	121 Å²	121	49.5 Å²	49.5	85%	0.846	28%	0.28	S	S	*	.			trans	-120	7	-177	68.8	0	0	0	0	114.4	S776	S776-S778 PolarHBondContact O-N 3.34Å
779	D	78.3	Confident	86.5	Confident	76 Å²	76	46.9 Å²	46.9	41%	0.406	26%	0.262	S	S	.	.	S	Bend	trans	-125.4	125.7	179.7	170.9	19.8	0	0	0	109	S781 Y782	D779-S781 PolarHBondContact O-N 2.92Å; D779-S781 PolarHBondContact OD1-N 3.33Å; D779-S781 WeakPolarHBondContact OD2-CB 3.16Å; D779-S781 PolarHBondContact OD2-OG 2.98Å; D779-Y782 HydrophobicContact CB-CD2 4.15Å; D779-Y782 PolarHBondContact O-N 2.81Å; D779-Y782 VanDerWaalsContact O-N 3.13Å; D779-Y782 WeakPolarHBondContact OD2-CE2 3.33Å
780	D	80.8	Confident	86.7	Confident	174 Å²	174	43.7 Å²	43.7	93%	0.93	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-12.1	177.4	-60.1	-29.8	0	0	0	113.1	Y782	D780-Y782 PolarHBondContact O-N 3.11Å
781	S	86	Confident	87.1	Confident	26 Å²	26	43.6 Å²	43.6	18%	0.182	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79	6.5	174.3	95.4	0	0	0	0	115.2	G742 D779 W996	G742-S781 PolarHBondContact N-O 3.36Å; D779-S781 PolarHBondContact O-N 2.92Å; D779-S781 PolarHBondContact OD1-N 3.33Å; D779-S781 WeakPolarHBondContact OD2-CB 3.16Å; D779-S781 PolarHBondContact OD2-OG 2.98Å; S781-W996 PolarHBondContact O-NE1 3.37Å; S781-W996 PolarHBondContact OG-NE1 2.58Å
782	Y	91.1	Very high	87.6	Confident	44 Å²	44	41.3 Å²	41.3	17%	0.173	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	160.1	179.1	-67.3	-99.6	0	0	0	113	P739 I740 P741 F743 D779 D780 H995 W996	P739-Y782 HydrophobicContact CB-CD1 3.59Å; P739-Y782 HydrophobicContact CB-CE1 4.23Å; P739-Y782 HydrophobicContact CB-CG 4.24Å; I740-Y782 WeakPolarHBondContact O-CA 3.5Å; P741-Y782 HydrophobicContact CB-CD1 4.29Å; P741-Y782 HydrophobicContact CB-CE1 4.1Å; P741-Y782 HydrophobicContact CG-CD1 4.14Å; P741-Y782 HydrophobicContact CG-CE1 3.76Å; F743-Y782 CarbonylContact O-C 3.48Å; D779-Y782 HydrophobicContact CB-CD2 4.15Å; D779-Y782 PolarHBondContact O-N 2.81Å; D779-Y782 VanDerWaalsContact O-N 3.13Å; D779-Y782 WeakPolarHBondContact OD2-CE2 3.33Å; D780-Y782 PolarHBondContact O-N 3.11Å; Y782-H995 HydrophobicContact CE1-CB 4.47Å; Y782-H995 WeakPolarHBondContact OH-CA 3.33Å; Y782-W996 AromaticContact CE2-CD1 3.82Å; Y782-W996 AromaticContact CZ-CD1 3.75Å; Y782-W996 PolarHBondContact OH-N 2.89Å
783	G	91.9	Very high	88	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.6	-170.9	164.5	0	0	0	0	0	112.4	I740 F743 W787	I740-G783 WeakPolarHBondContact CB-O 3.42Å; I740-G783 PolarHBondContact N-O 3.12Å; I740-G783 PolarHBondContact O-N 3.44Å; I740-G783 VanDerWaalsContact O-N 3.08Å; F743-G783 WeakPolarHBondContact O-CA 3.31Å; F743-G783 PolarHBondContact O-N 3.26Å; G783-W787 VanDerWaalsContact CA-CZ3 3.4Å
784	C	93.8	Very high	88.4	Confident	4 Å²	4	36 Å²	36	3%	0.027	21%	0.21	C	C	.	.			trans	-144.4	159.5	174.2	68.6	0	0	0	0	112.5	R738 F743 I777 A786 W787	R738-C784 WeakPolarHBondContact O-CB 3.27Å; F743-C784 VanDerWaalsContact CE1-O 3.28Å; F743-C784 WeakPolarHBondContact CE1-O 3.46Å; I777-C784 HydrophobicContact CD1-CB 4.02Å; C784-A786 PolarHBondContact O-N 2.98Å; C784-W787 WeakPolarHBondContact O-CB 3.4Å; C784-W787 PolarHBondContact O-N 2.86Å
785	L	94.9	Very high	89.2	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	20%	0.199	C	C	.	.	G	3₁₀ helix	trans	-62.2	-31.9	-176.2	-50.3	-175.6	0	0	0	112.4	L735 T736 I740 F743 W787 N788 I789 W902 V911 Y986 L991	L735-L785 WeakPolarHBondContact O-CD1 3.33Å; T736-L785 HydrophobicContact CG2-CB 4.26Å; T736-L785 HydrophobicContact CG2-CD1 4.06Å; T736-L785 PolarHBondContact O-N 3.35Å; I740-L785 HydrophobicContact CD1-CD2 3.54Å; I740-L785 HydrophobicContact CD1-CG 3.69Å; F743-L785 HydrophobicContact CD2-CD2 4.41Å; F743-L785 HydrophobicContact CE1-CD2 4.27Å; F743-L785 HydrophobicContact CE2-CD2 3.65Å; F743-L785 HydrophobicContact CZ-CD2 3.56Å; L785-W787 PolarHBondContact O-N 3.42Å; L785-W787 VanDerWaalsContact O-N 3.11Å; L785-N788 PolarHBondContact O-N 2.89Å; L785-I789 HydrophobicContact CB-CD1 3.93Å; L785-I789 WeakPolarHBondContact O-CG1 3.23Å; L785-I789 PolarHBondContact O-N 3.07Å; L785-W902 HydrophobicContact CD2-CH2 3.95Å; L785-V911 HydrophobicContact CD1-CG1 4.4Å; L785-Y986 VanDerWaalsContact CD1-OH 3.32Å; L785-Y986 WeakPolarHBondContact CD1-OH 3.32Å; L785-L991 HydrophobicContact CD2-CB 4.47Å; L785-L991 HydrophobicContact CD2-CD2 3.88Å
786	A	94.2	Very high	90.1	Very high	1 Å²	1	33.3 Å²	33.3	1%	0.008	19%	0.192	C	C	.	.	G	3₁₀ helix	trans	-60.9	-20.6	-179.7	0	0	0	0	0	114	M690 T736 A770 C784 L794	M690-A786 HydrophobicContact CE-CB 4.22Å; T736-A786 WeakPolarHBondContact O-CB 3.29Å; T736-A786 PolarHBondContact O-N 3.08Å; A770-A786 WeakPolarHBondContact O-CB 3.37Å; C784-A786 PolarHBondContact O-N 2.98Å; A786-L794 HydrophobicContact CB-CD1 3.72Å
787	W	91.6	Very high	91.3	Very high	53 Å²	53	28.1 Å²	28.1	20%	0.201	16%	0.155	C	C	.	.	G	3₁₀ helix	trans	-78.4	-23.7	173.4	-65.9	-11.2	0	0	0	114.2	Q745 Y769 I777 G783 C784 L785	Q745-W787 HydrophobicContact CB-CB 4.4Å; Q745-W787 HydrophobicContact CB-CE3 3.88Å; Q745-W787 HydrophobicContact CG-CB 3.99Å; Q745-W787 HydrophobicContact CG-CE3 4.47Å; Y769-W787 WeakPolarHBondContact CD1-O 3.03Å; I777-W787 HydrophobicContact CB-CH2 3.77Å; I777-W787 HydrophobicContact CB-CZ2 4.01Å; I777-W787 HydrophobicContact CD1-CH2 3.89Å; I777-W787 HydrophobicContact CD1-CZ2 3.96Å; I777-W787 HydrophobicContact CD1-CZ3 4.41Å; I777-W787 HydrophobicContact CG1-CH2 4.4Å; I777-W787 HydrophobicContact CG1-CZ2 4.45Å; I777-W787 HydrophobicContact CG2-CH2 3.68Å; I777-W787 HydrophobicContact CG2-CZ2 4.43Å; I777-W787 HydrophobicContact CG2-CZ3 4.43Å; G783-W787 VanDerWaalsContact CA-CZ3 3.4Å; C784-W787 WeakPolarHBondContact O-CB 3.4Å; C784-W787 PolarHBondContact O-N 2.86Å; L785-W787 PolarHBondContact O-N 3.42Å; L785-W787 VanDerWaalsContact O-N 3.11Å
788	N	93.5	Very high	92.4	Very high	5 Å²	5	26.4 Å²	26.4	3%	0.027	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.3	-13.6	-178.9	-71.5	-15.5	0	0	0	113	F743 Q744 I746 L785 W902 R908	F743-N788 HydrophobicContact CE1-CB 4.39Å; F743-N788 WeakPolarHBondContact CE1-ND2 3.41Å; F743-N788 HydrophobicContact CZ-CB 4.37Å; F743-N788 VanDerWaalsContact CZ-ND2 3.33Å; F743-N788 WeakPolarHBondContact CZ-ND2 3.4Å; Q744-N788 PolarHBondContact O-ND2 2.83Å; I746-N788 PolarHBondContact N-OD1 2.83Å; L785-N788 PolarHBondContact O-N 2.89Å; N788-W902 HydrophobicContact CB-CB 4.26Å; N788-W902 HydrophobicContact CB-CD2 3.76Å; N788-W902 HydrophobicContact CB-CE3 3.63Å; N788-W902 HydrophobicContact CB-CG 4.02Å; N788-W902 HydrophobicContact CB-CZ3 4.34Å; N788-R908 WeakPolarHBondContact O-CD 3.41Å
789	I	95.9	Very high	94	Very high	1 Å²	1	20.7 Å²	20.7	1%	0.005	11%	0.106	C	C	.	.	S	Bend	trans	-106.7	123.3	175.9	-56.5	175.3	0	0	0	110.1	Y769 L785 E793 L794 W902 V911	Y769-I789 WeakPolarHBondContact CD1-O 3.39Å; L785-I789 HydrophobicContact CB-CD1 3.93Å; L785-I789 WeakPolarHBondContact O-CG1 3.23Å; L785-I789 PolarHBondContact O-N 3.07Å; I789-E793 HydrophobicContact CG2-CB 3.64Å; I789-L794 HydrophobicContact CB-CD2 3.93Å; I789-L794 HydrophobicContact CB-CG 4.18Å; I789-L794 HydrophobicContact CD1-CD2 4.38Å; I789-L794 HydrophobicContact CG2-CD2 3.83Å; I789-L794 HydrophobicContact CG2-CG 3.9Å; I789-W902 HydrophobicContact CD1-CZ3 4.15Å; I789-W902 HydrophobicContact CG1-CE3 4.21Å; I789-W902 HydrophobicContact CG1-CZ3 3.86Å; I789-V911 HydrophobicContact CD1-CG1 4.22Å
790	P	96.2	Very high	95	Very high	8 Å²	8	17 Å²	17	5%	0.052	9%	0.087	C	C	.	.			trans	-55.5	149	177.2	-28.4	35.8	0	0	0	114.6	I767 Y769 L792 E793 L794	I767-P790 HydrophobicContact CG2-CB 3.79Å; I767-P790 HydrophobicContact CG2-CG 3.87Å; Y769-P790 HydrophobicContact CE1-CG 4.23Å; P790-L792 PolarHBondContact O-N 3.08Å; P790-L792 VanDerWaalsContact O-N 3.1Å; P790-E793 WeakPolarHBondContact CD-OE2 3.22Å; P790-E793 WeakPolarHBondContact O-CA 3.36Å; P790-E793 WeakPolarHBondContact O-CB 3.05Å; P790-E793 PolarHBondContact O-N 3.1Å; P790-L794 PolarHBondContact O-N 3.49Å
791	A	96.9	Very high	95.9	Very high	0 Å²	0	8.8 Å²	8.8	0%	0	4%	0.042	C	C	.	.	H	α-helix	trans	-56.7	-31.3	-178.9	0	0	0	0	0	113.6	L692 I695 F696 S768 A770 E793 M795	L692-A791 HydrophobicContact CD2-CB 4.39Å; I695-A791 HydrophobicContact CD1-CB 4.23Å; I695-A791 HydrophobicContact CG2-CB 4.37Å; F696-A791 HydrophobicContact CE2-CB 3.89Å; F696-A791 HydrophobicContact CZ-CB 3.88Å; S768-A791 WeakPolarHBondContact O-CB 3.43Å; S768-A791 PolarHBondContact O-N 2.92Å; A770-A791 HydrophobicContact CB-CB 3.82Å; A791-E793 VanDerWaalsContact C-N 3.34Å; A791-M795 WeakPolarHBondContact O-CB 3.39Å; A791-M795 PolarHBondContact O-N 2.74Å
792	L	97.7	Very high	96.5	Very high	26 Å²	26	7.5 Å²	7.5	14%	0.136	3%	0.034	C	C	.	.	H	α-helix	trans	-70.4	-31.6	177.5	-171.5	67.8	0	0	0	112	F696 P790 M795 A796 L857 E861 R864 F865	F696-L792 HydrophobicContact CE1-CB 4.36Å; F696-L792 HydrophobicContact CE1-CD1 4.01Å; F696-L792 HydrophobicContact CZ-CB 3.9Å; F696-L792 HydrophobicContact CZ-CD1 4.08Å; P790-L792 PolarHBondContact O-N 3.08Å; P790-L792 VanDerWaalsContact O-N 3.1Å; L792-M795 HydrophobicContact CD1-CE 3.95Å; L792-A796 WeakPolarHBondContact O-CB 3.2Å; L792-A796 PolarHBondContact O-N 2.96Å; L792-A796 VanDerWaalsContact O-N 3.11Å; L792-L857 HydrophobicContact CD1-CD1 4.15Å; L792-L857 HydrophobicContact CD1-CD2 4.42Å; L792-E861 HydrophobicContact CD2-CB 4.33Å; L792-R864 HydrophobicContact CD2-CB 4.49Å; L792-R864 HydrophobicContact CD2-CG 4.15Å; L792-F865 HydrophobicContact CD1-CB 4.13Å; L792-F865 HydrophobicContact CD1-CD2 4.13Å
793	E	98.5	Very high	96.8	Very high	11 Å²	11	5.5 Å²	5.5	5%	0.051	3%	0.026	C	C	.	.	H	α-helix	trans	-80.1	-41.4	178.6	-70.7	173	-166.9	0	0	110.7	I789 P790 A791 A796 L797 R864 L868 R908	I789-E793 HydrophobicContact CG2-CB 3.64Å; P790-E793 WeakPolarHBondContact CD-OE2 3.22Å; P790-E793 WeakPolarHBondContact O-CA 3.36Å; P790-E793 WeakPolarHBondContact O-CB 3.05Å; P790-E793 PolarHBondContact O-N 3.1Å; A791-E793 VanDerWaalsContact C-N 3.34Å; E793-A796 PolarHBondContact O-N 3.36Å; E793-L797 PolarHBondContact O-N 2.93Å; E793-R864 IonicContact OE1-CZ 2.76Å; E793-R864 IonicContact OE1-NE 3.74Å; E793-R864 IonicContact OE1-NH2 2.83Å; E793-R864 PolarHBondContact OE1-NH2 3.18Å; E793-L868 HydrophobicContact CB-CD1 4.42Å; E793-L868 HydrophobicContact CG-CD1 3.64Å; E793-L868 HydrophobicContact CG-CD2 4.08Å; E793-R908 IonicContact OE1-CZ 2.84Å; E793-R908 IonicContact OE1-NE 3.62Å; E793-R908 IonicContact OE1-NH2 2.73Å; E793-R908 PolarHBondContact OE1-NH2 3.45Å; E793-R908 IonicContact OE2-CZ 3.59Å; E793-R908 IonicContact OE2-NE 3.73Å; E793-R908 PolarHBondContact OE2-NE 2.97Å; E793-R908 IonicContact OE2-NH2 2.83Å; E793-R908 PolarHBondContact OE2-NH2 2.56Å
794	L	98.4	Very high	97.2	Very high	0 Å²	0	5.5 Å²	5.5	0%	0	3%	0.026	C	C	.	.	H	α-helix	trans	-61.1	-46.4	169.6	-62.8	172.1	0	0	0	112.1	M690 T736 A770 A786 I789 P790 A796 L797 Y798	M690-L794 HydrophobicContact CE-CD1 4.14Å; T736-L794 HydrophobicContact CG2-CD2 3.98Å; A770-L794 HydrophobicContact CB-CD1 4.28Å; A786-L794 HydrophobicContact CB-CD1 3.72Å; I789-L794 HydrophobicContact CB-CD2 3.93Å; I789-L794 HydrophobicContact CB-CG 4.18Å; I789-L794 HydrophobicContact CD1-CD2 4.38Å; I789-L794 HydrophobicContact CG2-CD2 3.83Å; I789-L794 HydrophobicContact CG2-CG 3.9Å; P790-L794 PolarHBondContact O-N 3.49Å; L794-A796 VanDerWaalsContact C-N 3.28Å; L794-A796 PolarHBondContact O-N 3.3Å; L794-L797 WeakPolarHBondContact O-CB 3.34Å; L794-L797 PolarHBondContact O-N 3.41Å; L794-L797 VanDerWaalsContact O-N 3.14Å; L794-Y798 HydrophobicContact CB-CE2 4.21Å; L794-Y798 WeakPolarHBondContact O-CD1 3.16Å; L794-Y798 WeakPolarHBondContact O-CD2 3.24Å; L794-Y798 PolarHBondContact O-N 3.08Å
795	M	98.7	Very high	97.4	Very high	0 Å²	0	5.9 Å²	5.9	0%	0	3%	0.028	C	C	.	.	H	α-helix	trans	-61.2	-38.8	176.8	-172	175.8	65.3	0	0	111.3	F687 L692 F696 I698 A791 L792 Y798 V799 L854 L857 F865	F687-M795 HydrophobicContact CE1-CG 3.75Å; F687-M795 HydrophobicContact CE1-SD 3.82Å; F687-M795 HydrophobicContact CZ-CG 3.65Å; F687-M795 HydrophobicContact CZ-SD 4.33Å; L692-M795 HydrophobicContact CD1-CB 4.14Å; L692-M795 HydrophobicContact CD1-CG 4.14Å; L692-M795 HydrophobicContact CD2-CB 4.21Å; F696-M795 HydrophobicContact CD2-CE 3.64Å; F696-M795 HydrophobicContact CD2-SD 3.51Å; F696-M795 VanDerWaalsContact CD2-SD 3.51Å; F696-M795 HydrophobicContact CE2-CB 4.38Å; F696-M795 HydrophobicContact CE2-CE 3.89Å; F696-M795 HydrophobicContact CE2-SD 3.98Å; F696-M795 HydrophobicContact CG-CE 3.99Å; F696-M795 HydrophobicContact CG-SD 4.25Å; F696-M795 HydrophobicContact CZ-CE 4.45Å; I698-M795 HydrophobicContact CD1-SD 3.72Å; A791-M795 WeakPolarHBondContact O-CB 3.39Å; A791-M795 PolarHBondContact O-N 2.74Å; L792-M795 HydrophobicContact CD1-CE 3.95Å; M795-Y798 PolarHBondContact O-N 2.87Å; M795-V799 HydrophobicContact CG-CG2 4.38Å; M795-V799 WeakPolarHBondContact O-CB 3.19Å; M795-V799 VanDerWaalsContact O-CG2 3.24Å; M795-V799 WeakPolarHBondContact O-CG2 3.43Å; M795-V799 PolarHBondContact O-N 2.93Å; M795-L854 HydrophobicContact CE-CD2 3.94Å; M795-L854 HydrophobicContact SD-CD2 4.47Å; M795-L857 HydrophobicContact CE-CD1 4.37Å; M795-F865 HydrophobicContact CB-CE2 4.32Å; M795-F865 HydrophobicContact CE-CD2 3.79Å; M795-F865 HydrophobicContact CE-CE2 3.7Å; M795-F865 HydrophobicContact CG-CE2 3.94Å
796	A	98.9	Very high	97.6	Very high	1 Å²	1	7.3 Å²	7.3	1%	0.008	3%	0.033	C	C	.	.	H	α-helix	trans	-65.6	-39.1	175	0	0	0	0	0	112.3	L792 E793 L794 A800 F865 L868 V869	L792-A796 WeakPolarHBondContact O-CB 3.2Å; L792-A796 PolarHBondContact O-N 2.96Å; L792-A796 VanDerWaalsContact O-N 3.11Å; E793-A796 PolarHBondContact O-N 3.36Å; L794-A796 VanDerWaalsContact C-N 3.28Å; L794-A796 PolarHBondContact O-N 3.3Å; A796-A800 WeakPolarHBondContact O-CB 3.45Å; A796-A800 PolarHBondContact O-N 2.99Å; A796-F865 HydrophobicContact CB-CD2 3.83Å; A796-F865 HydrophobicContact CB-CE2 3.91Å; A796-L868 HydrophobicContact CB-CB 3.43Å; A796-L868 VanDerWaalsContact CB-CB 3.43Å; A796-L868 HydrophobicContact CB-CD1 4.07Å; A796-L868 HydrophobicContact CB-CG 4.37Å; A796-V869 HydrophobicContact CB-CG2 3.94Å
797	L	98.9	Very high	97.8	Very high	3 Å²	3	9.2 Å²	9.2	2%	0.016	4%	0.043	C	C	.	.	H	α-helix	trans	-62.5	-45.9	174.9	-179.7	62.3	0	0	0	112.1	V732 T736 E793 L794 A800 A801 C912 I916	V732-L797 HydrophobicContact CB-CD2 4.22Å; V732-L797 HydrophobicContact CB-CG 4.1Å; V732-L797 HydrophobicContact CG1-CD1 4.18Å; V732-L797 HydrophobicContact CG1-CG 4.27Å; V732-L797 HydrophobicContact CG2-CG 4.4Å; T736-L797 HydrophobicContact CG2-CD2 3.91Å; E793-L797 PolarHBondContact O-N 2.93Å; L794-L797 WeakPolarHBondContact O-CB 3.34Å; L794-L797 PolarHBondContact O-N 3.41Å; L794-L797 VanDerWaalsContact O-N 3.14Å; L797-A800 PolarHBondContact O-N 3.48Å; L797-A801 PolarHBondContact O-N 3.37Å; L797-C912 HydrophobicContact CD1-CB 4.3Å; L797-C912 WeakPolarHBondContact CD1-O 3.48Å; L797-C912 HydrophobicContact CD2-CB 4.48Å; L797-I916 HydrophobicContact CD1-CB 3.79Å; L797-I916 HydrophobicContact CD1-CG2 4.37Å
798	Y	98.9	Very high	98.1	Very high	0 Å²	0	7 Å²	7	0%	0	4%	0.035	C	C	.	.	H	α-helix	trans	-67.3	-42.3	178.9	-55.3	-20.4	0	0	0	111.8	M690 L692 V732 W733 T736 L794 M795 A800 A801 A802	M690-Y798 HydrophobicContact CE-CE2 4.36Å; M690-Y798 HydrophobicContact CG-CE2 3.98Å; L692-Y798 HydrophobicContact CD1-CD2 3.89Å; L692-Y798 HydrophobicContact CD1-CE2 4.17Å; V732-Y798 HydrophobicContact CG2-CD1 3.77Å; V732-Y798 HydrophobicContact CG2-CE1 4.34Å; W733-Y798 HydrophobicContact CB-CE1 4.18Å; T736-Y798 PolarHBondContact OG1-OH 2.92Å; L794-Y798 HydrophobicContact CB-CE2 4.21Å; L794-Y798 WeakPolarHBondContact O-CD1 3.16Å; L794-Y798 WeakPolarHBondContact O-CD2 3.24Å; L794-Y798 PolarHBondContact O-N 3.08Å; M795-Y798 PolarHBondContact O-N 2.87Å; Y798-A800 VanDerWaalsContact C-N 3.34Å; Y798-A801 PolarHBondContact O-N 2.99Å; Y798-A802 PolarHBondContact O-N 2.88Å
799	V	98.9	Very high	98.3	Very high	1 Å²	1	7.9 Å²	7.9	1%	0.006	4%	0.041	C	C	.	.	H	α-helix	trans	-68.3	-34.7	176.8	174.7	0	0	0	0	111.6	F687 F707 M795 A802 M803 F853 F865 V869	F687-V799 HydrophobicContact CE2-CG2 4.33Å; F687-V799 HydrophobicContact CZ-CG2 3.67Å; F707-V799 HydrophobicContact CZ-CG1 4.4Å; F707-V799 HydrophobicContact CZ-CG2 4.15Å; M795-V799 HydrophobicContact CG-CG2 4.38Å; M795-V799 WeakPolarHBondContact O-CB 3.19Å; M795-V799 VanDerWaalsContact O-CG2 3.24Å; M795-V799 WeakPolarHBondContact O-CG2 3.43Å; M795-V799 PolarHBondContact O-N 2.93Å; V799-A802 PolarHBondContact O-N 3.27Å; V799-M803 HydrophobicContact CG1-CE 3.44Å; V799-M803 VanDerWaalsContact CG1-CE 3.44Å; V799-M803 WeakPolarHBondContact O-CG 3.39Å; V799-M803 PolarHBondContact O-N 2.94Å; V799-F853 HydrophobicContact CG2-CZ 4.36Å; V799-F865 HydrophobicContact CB-CE2 4.49Å; V799-F865 HydrophobicContact CB-CZ 3.85Å; V799-F865 HydrophobicContact CG1-CE1 4.46Å; V799-F865 HydrophobicContact CG1-CZ 3.89Å; V799-F865 HydrophobicContact CG2-CE2 4.43Å; V799-F865 HydrophobicContact CG2-CZ 3.93Å; V799-V869 HydrophobicContact CB-CG2 4.45Å; V799-V869 HydrophobicContact CG1-CG2 4.36Å
800	A	98.9	Very high	98.4	Very high	0 Å²	0	8 Å²	8	0%	0	4%	0.043	C	C	.	.	H	α-helix	trans	-62.2	-50.1	171.1	0	0	0	0	0	111.7	A796 L797 Y798 A802 M803 H804 V869 A872 I873 I916	A796-A800 WeakPolarHBondContact O-CB 3.45Å; A796-A800 PolarHBondContact O-N 2.99Å; L797-A800 PolarHBondContact O-N 3.48Å; Y798-A800 VanDerWaalsContact C-N 3.34Å; A800-A802 VanDerWaalsContact C-N 3.27Å; A800-A802 PolarHBondContact O-N 2.81Å; A800-M803 CarbonylContact O-C 3.55Å; A800-M803 PolarHBondContact O-N 3.47Å; A800-H804 WeakPolarHBondContact O-CB 3.29Å; A800-H804 PolarHBondContact O-N 2.67Å; A800-V869 HydrophobicContact CB-CG1 4.33Å; A800-A872 HydrophobicContact CB-CB 3.58Å; A800-I873 HydrophobicContact CB-CG1 3.97Å; A800-I916 HydrophobicContact CB-CD1 4.17Å
801	A	98.9	Very high	98.6	Very high	0 Å²	0	9.1 Å²	9.1	0%	0	5%	0.046	C	C	.	.	H	α-helix	trans	-56	-41.5	177.3	0	0	0	0	0	112.2	V728 L729 V732 L797 Y798 M803 H804 I916	V728-A801 HydrophobicContact CG1-CB 4.04Å; L729-A801 HydrophobicContact CB-CB 4.23Å; V732-A801 HydrophobicContact CG1-CB 4.46Å; V732-A801 HydrophobicContact CG2-CB 3.72Å; L797-A801 PolarHBondContact O-N 3.37Å; Y798-A801 PolarHBondContact O-N 2.99Å; A801-M803 PolarHBondContact O-N 3.3Å; A801-H804 PolarHBondContact O-ND1 2.83Å; A801-I916 HydrophobicContact CB-CD1 4.25Å
802	A	98.9	Very high	98.6	Very high	0 Å²	0	10.4 Å²	10.4	0%	0	5%	0.054	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-10.7	176.9	0	0	0	0	0	115.2	L679 F707 L710 Y714 L729 Y798 V799 A800	L679-A802 HydrophobicContact CD1-CB 4.14Å; F707-A802 HydrophobicContact CD1-CB 4.48Å; F707-A802 HydrophobicContact CE1-CB 3.9Å; L710-A802 HydrophobicContact CD2-CB 4.46Å; L710-A802 VanDerWaalsContact CD2-O 3.29Å; L710-A802 WeakPolarHBondContact CD2-O 3.3Å; Y714-A802 PolarHBondContact OH-O 3.47Å; L729-A802 HydrophobicContact CD2-CB 4.42Å; Y798-A802 PolarHBondContact O-N 2.88Å; V799-A802 PolarHBondContact O-N 3.27Å; A800-A802 VanDerWaalsContact C-N 3.27Å; A800-A802 PolarHBondContact O-N 2.81Å
803	M	98.6	Very high	98.7	Very high	2 Å²	2	10 Å²	10	1%	0.01	5%	0.051	C	C	.	.	T	Hydrogen-bonded Turn	trans	-131.8	1.1	-178.3	75.5	179.5	52.2	0	0	115.9	Y706 L710 Y714 V799 A800 A801 D805 Y806 A841 V869 I873	Y706-M803 HydrophobicContact CE1-CE 4.19Å; Y706-M803 VanDerWaalsContact OH-CE 3.24Å; Y706-M803 WeakPolarHBondContact OH-CE 3.24Å; L710-M803 HydrophobicContact CD1-CB 3.9Å; L710-M803 HydrophobicContact CD2-CB 4.06Å; L710-M803 HydrophobicContact CG-CB 4.48Å; Y714-M803 WeakPolarHBondContact OH-CA 3.47Å; V799-M803 HydrophobicContact CG1-CE 3.44Å; V799-M803 VanDerWaalsContact CG1-CE 3.44Å; V799-M803 WeakPolarHBondContact O-CG 3.39Å; V799-M803 PolarHBondContact O-N 2.94Å; A800-M803 CarbonylContact O-C 3.55Å; A800-M803 PolarHBondContact O-N 3.47Å; A801-M803 PolarHBondContact O-N 3.3Å; M803-D805 PolarHBondContact O-N 3Å; M803-Y806 VanDerWaalsContact O-CB 3.3Å; M803-Y806 WeakPolarHBondContact O-CB 3.41Å; M803-Y806 PolarHBondContact O-N 3.45Å; M803-A841 HydrophobicContact CB-CB 3.83Å; M803-A841 HydrophobicContact CE-CB 4.14Å; M803-A841 HydrophobicContact CG-CB 4.06Å; M803-A841 HydrophobicContact SD-CB 3.53Å; M803-A841 VanDerWaalsContact SD-CB 3.53Å; M803-V869 HydrophobicContact SD-CG1 3.69Å; M803-I873 HydrophobicContact CG-CD1 3.54Å; M803-I873 HydrophobicContact CG-CG1 4.43Å; M803-I873 HydrophobicContact SD-CD1 3.81Å
804	H	98.9	Very high	98.6	Very high	0 Å²	0	10 Å²	10	0%	0	5%	0.054	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-24.9	-168.3	73.5	-82.1	0	0	0	114.4	H724 A800 A801 H837 I873 T876 D920	H724-H804 AromaticContact CD2-CE1 3.88Å; H724-H804 AromaticContact CD2-NE2 3.61Å; H724-H804 AromaticContact NE2-CE1 3.72Å; H724-H804 AromaticContact NE2-NE2 3.19Å; H724-H804 PolarHBondContact NE2-NE2 3.11Å; H724-H804 VanDerWaalsContact NE2-NE2 3.19Å; A800-H804 WeakPolarHBondContact O-CB 3.29Å; A800-H804 PolarHBondContact O-N 2.67Å; A801-H804 PolarHBondContact O-ND1 2.83Å; H804-H837 WeakPolarHBondContact O-CB 3.46Å; H804-H837 PolarHBondContact O-CD2 3.35Å; H804-I873 HydrophobicContact CB-CG1 4.29Å; H804-I873 HydrophobicContact CB-CG2 4.41Å; H804-T876 HydrophobicContact CB-CG2 4.32Å; H804-D920 IonicContact NE2-OD1 2.66Å
805	D	98.8	Very high	98.6	Very high	12 Å²	12	10.6 Å²	10.6	6%	0.064	6%	0.057	C	C	.	.	T	Hydrogen-bonded Turn	trans	-115.5	15.9	-179.1	-98.4	-10.2	0	0	0	113.2	Y714 H720 H724 M803 D807 H808 H837	Y714-D805 HydrophobicContact CE1-CB 3.62Å; Y714-D805 WeakPolarHBondContact CE1-O 3.48Å; Y714-D805 PolarHBondContact OH-N 2.98Å; H720-D805 WeakPolarHBondContact CB-OD2 3.38Å; H720-D805 IonicContact CD2-OD1 3.68Å; H720-D805 IonicContact CD2-OD2 3.82Å; H720-D805 PolarHBondContact CD2-OD2 2.84Å; H720-D805 IonicContact CG-OD2 2.82Å; H724-D805 IonicContact CD2-OD2 2.71Å; H724-D805 PolarHBondContact CD2-OD2 3.28Å; H724-D805 IonicContact NE2-OD2 3.67Å; M803-D805 PolarHBondContact O-N 3Å; D805-D807 PolarHBondContact O-N 2.94Å; D805-H808 HydrophobicContact CB-CB 4.39Å; D805-H808 VanDerWaalsContact O-CB 3.31Å; D805-H808 WeakPolarHBondContact O-CB 3.22Å; D805-H808 PolarHBondContact O-N 3.32Å; D805-H808 IonicContact OD1-CD2 2.73Å; D805-H837 IonicContact OD1-NE2 3.81Å
806	Y	98.8	Very high	98.6	Very high	30 Å²	30	11 Å²	11	12%	0.118	6%	0.059	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.8	122.8	-173.1	175.1	-93.2	0	0	0	112.4	L710 Y714 M803 H837 A841 L844	L710-Y806 HydrophobicContact CD1-CD2 3.43Å; L710-Y806 VanDerWaalsContact CD1-CD2 3.43Å; L710-Y806 HydrophobicContact CD1-CE2 3.86Å; L710-Y806 HydrophobicContact CD1-CG 4Å; L710-Y806 HydrophobicContact CG-CD2 4.04Å; L710-Y806 HydrophobicContact CG-CE2 4.45Å; L710-Y806 WeakPolarHBondContact O-CD2 3.34Å; L710-Y806 VanDerWaalsContact O-CE2 3.26Å; L710-Y806 WeakPolarHBondContact O-CE2 3.37Å; Y714-Y806 HydrophobicContact CD2-CD2 4.39Å; Y714-Y806 HydrophobicContact CE2-CD2 4.33Å; M803-Y806 VanDerWaalsContact O-CB 3.3Å; M803-Y806 WeakPolarHBondContact O-CB 3.41Å; M803-Y806 PolarHBondContact O-N 3.45Å; Y806-H837 PolarHBondContact O-ND1 3.21Å; Y806-A841 HydrophobicContact CD1-CB 4.19Å; Y806-A841 HydrophobicContact CG-CB 4.2Å; Y806-L844 HydrophobicContact CE2-CD2 4.11Å
807	D	98.5	Very high	98.6	Very high	40 Å²	40	12.1 Å²	12.1	21%	0.214	6%	0.064	C	C	.	.	T	Hydrogen-bonded Turn	trans	65.3	29.3	-172.6	-169.6	50.9	0	0	0	115.2	G713 R715 D805 H836	G713-D807 WeakPolarHBondContact O-CA 3.33Å; G713-D807 PolarHBondContact O-N 2.87Å; R715-D807 IonicContact CZ-OD1 2.99Å; R715-D807 IonicContact CZ-OD2 2.81Å; R715-D807 IonicContact NE-OD1 2.94Å; R715-D807 PolarHBondContact NE-OD1 3.33Å; R715-D807 PolarHBondContact NH2-O 3.38Å; R715-D807 IonicContact NH2-OD1 2.67Å; R715-D807 PolarHBondContact NH2-OD1 2.87Å; R715-D807 IonicContact NH2-OD2 2.82Å; R715-D807 PolarHBondContact NH2-OD2 2.76Å; D805-D807 PolarHBondContact O-N 2.94Å; D807-H836 IonicContact OD2-CD2 3.61Å; D807-H836 IonicContact OD2-CE1 3.09Å; D807-H836 IonicContact OD2-NE2 3.34Å; D807-H836 PolarHBondContact OD2-NE2 2.76Å
808	H	98.7	Very high	98.5	Very high	6 Å²	6	14.3 Å²	14.3	3%	0.028	8%	0.083	C	C	.	.			trans	-54.3	131.5	175	-169.8	-95.3	0	0	0	112.9	R715 I717 H720 D805 G810 H837 E941	R715-H808 VanDerWaalsContact CD-O 3.25Å; R715-H808 WeakPolarHBondContact CD-O 3.25Å; I717-H808 HydrophobicContact CD1-CB 4.3Å; I717-H808 WeakPolarHBondContact CD1-O 3.23Å; H720-H808 HydrophobicContact CB-CB 3.78Å; H720-H808 VanDerWaalsContact CB-CG 3.5Å; H720-H808 WeakPolarHBondContact CB-ND1 3.41Å; H720-H808 AromaticContact CE1-CE1 3.6Å; H720-H808 AromaticContact CG-CE1 3.52Å; H720-H808 AromaticContact CG-CG 3.87Å; H720-H808 AromaticContact CG-ND1 3.42Å; H720-H808 AromaticContact ND1-CE1 3.22Å; H720-H808 PolarHBondContact ND1-CE1 3.1Å; H720-H808 AromaticContact ND1-ND1 3.44Å; H720-H808 PolarHBondContact ND1-ND1 3.2Å; D805-H808 HydrophobicContact CB-CB 4.39Å; D805-H808 VanDerWaalsContact O-CB 3.31Å; D805-H808 WeakPolarHBondContact O-CB 3.22Å; D805-H808 PolarHBondContact O-N 3.32Å; D805-H808 IonicContact OD1-CD2 2.73Å; H808-G810 PolarHBondContact ND1-N 3.19Å; H808-G810 VanDerWaalsContact ND1-N 3.19Å; H808-G810 PolarHBondContact O-N 3.16Å; H808-H837 AromaticContact CD2-CE1 3.94Å; H808-H837 AromaticContact CD2-NE2 3.69Å; H808-E941 IonicContact CE1-OE1 3.78Å; H808-E941 PolarHBondContact CE1-OE1 2.99Å; H808-E941 IonicContact ND1-OE1 3.15Å
809	P	98.3	Very high	98.5	Very high	25 Å²	25	16.6 Å²	16.6	16%	0.162	10%	0.097	C	C	.	.			trans	-86.8	-1	-169.5	35	-37.2	0	0	0	115.2	R811 L833	P809-R811 HydrophobicContact CG-CB 4.28Å; P809-L833 HydrophobicContact CG-CD2 3.64Å
810	G	98.1	Very high	98.4	Very high	3 Å²	3	20.6 Å²	20.6	3%	0.031	12%	0.118	C	C	.	.	S	Bend	trans	82.7	16.5	-172.8	0	0	0	0	0	113.8	H808 E941	H808-G810 PolarHBondContact ND1-N 3.19Å; H808-G810 VanDerWaalsContact ND1-N 3.19Å; H808-G810 PolarHBondContact O-N 3.16Å; G810-E941 WeakPolarHBondContact CA-OE1 3.4Å
811	R	98.4	Very high	98.4	Very high	32 Å²	32	21.4 Å²	21.4	12%	0.121	12%	0.124	C	C	.	.	S	Bend	trans	-147	135.4	-166.5	-59	-66.4	176.6	-99	0.3	110.8	P809 F815 E944 E948	P809-R811 HydrophobicContact CG-CB 4.28Å; R811-F815 HydrophobicContact CB-CB 4.44Å; R811-F815 HydrophobicContact CB-CD1 3.69Å; R811-F815 HydrophobicContact CB-CE1 4.26Å; R811-F815 HydrophobicContact CB-CG 4.26Å; R811-F815 HydrophobicContact CG-CD1 3.87Å; R811-F815 HydrophobicContact CG-CE1 3.92Å; R811-E944 PolarHBondContact NH2-O 2.96Å; R811-E944 VanDerWaalsContact NH2-O 3.1Å; R811-E948 IonicContact CZ-OE2 2.64Å; R811-E948 VanDerWaalsContact CZ-OE2 3.24Å; R811-E948 IonicContact NE-OE2 3.34Å; R811-E948 PolarHBondContact NE-OE2 2.93Å; R811-E948 IonicContact NH2-OE2 3.89Å; R811-E948 PolarHBondContact NH2-OE2 3.02Å
812	T	98.6	Very high	98.4	Very high	26 Å²	26	26.7 Å²	26.7	16%	0.16	16%	0.159	C	C	.	.			trans	-68.2	156.9	-177.3	61.5	0	0	0	0	114	L289 A814 F815 L816 Q945 M960	L289-T812 HydrophobicContact CD1-CG2 4.48Å; T812-A814 PolarHBondContact O-N 2.97Å; T812-A814 VanDerWaalsContact O-N 3.14Å; T812-F815 WeakPolarHBondContact O-CB 3.39Å; T812-F815 PolarHBondContact O-N 2.84Å; T812-F815 PolarHBondContact OG1-N 2.82Å; T812-L816 PolarHBondContact O-N 3.27Å; T812-Q945 PolarHBondContact OG1-NE2 3.5Å; T812-Q945 PolarHBondContact OG1-OE1 3.08Å; T812-M960 HydrophobicContact CG2-CE 4.08Å
813	N	98.4	Very high	98.3	Very high	17 Å²	17	28.6 Å²	28.6	9%	0.091	17%	0.168	C	C	.	.	H	α-helix	trans	-46	-42.3	168.6	-90	-32.9	0	0	0	112.4	F815 L816 I817 V832 L833 E834	N813-F815 PolarHBondContact O-N 2.89Å; N813-L816 PolarHBondContact O-N 3.2Å; N813-I817 WeakPolarHBondContact O-CD1 3.38Å; N813-I817 VanDerWaalsContact O-CG1 3.24Å; N813-I817 WeakPolarHBondContact O-CG1 3.4Å; N813-I817 PolarHBondContact O-N 2.96Å; N813-I817 VanDerWaalsContact O-N 3.1Å; N813-V832 WeakPolarHBondContact OD1-CA 3.29Å; N813-V832 VanDerWaalsContact OD1-CB 3.29Å; N813-V832 WeakPolarHBondContact OD1-CB 3.34Å; N813-V832 PolarHBondContact OD1-N 2.91Å; N813-L833 HydrophobicContact CB-CD1 4.39Å; N813-L833 WeakPolarHBondContact OD1-CG 3.4Å; N813-L833 PolarHBondContact OD1-N 3.38Å; N813-E834 VanDerWaalsContact ND2-CD 3.26Å; N813-E834 PolarHBondContact ND2-OE1 3.04Å; N813-E834 PolarHBondContact ND2-OE2 3.33Å
814	A	97.9	Very high	98.3	Very high	13 Å²	13	28.5 Å²	28.5	11%	0.107	17%	0.167	C	C	.	.	H	α-helix	trans	-62.9	-40.6	179.1	0	0	0	0	0	113.1	L289 T812 I817 A818	L289-A814 HydrophobicContact CB-CB 4.46Å; L289-A814 HydrophobicContact CD1-CB 3.99Å; L289-A814 HydrophobicContact CG-CB 4.07Å; T812-A814 PolarHBondContact O-N 2.97Å; T812-A814 VanDerWaalsContact O-N 3.14Å; A814-I817 PolarHBondContact O-N 2.77Å; A814-A818 VanDerWaalsContact O-CB 3.27Å; A814-A818 WeakPolarHBondContact O-CB 3.28Å; A814-A818 PolarHBondContact O-N 3.45Å
815	F	98.5	Very high	98.2	Very high	12 Å²	12	33 Å²	33	5%	0.053	20%	0.195	C	C	.	.	H	α-helix	trans	-65.5	-43.4	176.8	177.7	-90.7	0	0	0	111.9	R811 T812 N813 I817 A818 T819 Q945 E948 E949 L952	R811-F815 HydrophobicContact CB-CB 4.44Å; R811-F815 HydrophobicContact CB-CD1 3.69Å; R811-F815 HydrophobicContact CB-CE1 4.26Å; R811-F815 HydrophobicContact CB-CG 4.26Å; R811-F815 HydrophobicContact CG-CD1 3.87Å; R811-F815 HydrophobicContact CG-CE1 3.92Å; T812-F815 WeakPolarHBondContact O-CB 3.39Å; T812-F815 PolarHBondContact O-N 2.84Å; T812-F815 PolarHBondContact OG1-N 2.82Å; N813-F815 PolarHBondContact O-N 2.89Å; F815-I817 VanDerWaalsContact C-N 3.32Å; F815-I817 PolarHBondContact O-N 3.28Å; F815-A818 PolarHBondContact O-N 3.15Å; F815-T819 HydrophobicContact CD1-CG2 4.28Å; F815-T819 HydrophobicContact CD2-CG2 4.34Å; F815-T819 HydrophobicContact CE1-CG2 3.92Å; F815-T819 HydrophobicContact CE2-CG2 3.99Å; F815-T819 HydrophobicContact CG-CG2 4.48Å; F815-T819 HydrophobicContact CZ-CG2 3.77Å; F815-T819 WeakPolarHBondContact O-CB 3.23Å; F815-T819 WeakPolarHBondContact O-CG2 3.44Å; F815-T819 PolarHBondContact O-N 3.05Å; F815-T819 PolarHBondContact O-OG1 3.3Å; F815-Q945 HydrophobicContact CB-CG 4.38Å; F815-Q945 HydrophobicContact CD2-CG 3.73Å; F815-Q945 HydrophobicContact CE2-CG 4.26Å; F815-Q945 HydrophobicContact CG-CG 4.15Å; F815-E948 HydrophobicContact CE2-CG 4.42Å; F815-E948 HydrophobicContact CZ-CB 4.42Å; F815-E948 HydrophobicContact CZ-CG 3.95Å; F815-E949 HydrophobicContact CD2-CG 3.68Å; F815-E949 HydrophobicContact CE2-CG 3.7Å; F815-L952 HydrophobicContact CE2-CD1 4.22Å; F815-L952 HydrophobicContact CZ-CD1 4.01Å
816	L	98.5	Very high	98.2	Very high	8 Å²	8	37.8 Å²	37.8	4%	0.042	22%	0.22	C	C	.	.	H	α-helix	trans	-61.6	-40.8	177.5	-61	-179.3	0	0	0	111.6	T812 N813 T819 N820 A821 A824 V832 L833	T812-L816 PolarHBondContact O-N 3.27Å; N813-L816 PolarHBondContact O-N 3.2Å; L816-T819 PolarHBondContact O-OG1 3.37Å; L816-N820 WeakPolarHBondContact O-CA 3.48Å; L816-N820 PolarHBondContact O-N 3.07Å; L816-A821 HydrophobicContact CB-CB 4.1Å; L816-A821 HydrophobicContact CD2-CB 3.76Å; L816-A821 PolarHBondContact O-N 2.95Å; L816-A824 HydrophobicContact CB-CB 4.13Å; L816-A824 WeakPolarHBondContact O-CB 3.45Å; L816-V832 HydrophobicContact CB-CG1 4.5Å; L816-V832 HydrophobicContact CD1-CG1 3.89Å; L816-L833 HydrophobicContact CD1-CD2 3.7Å; L816-L833 HydrophobicContact CD1-CG 3.99Å
817	I	98.4	Very high	98.2	Very high	25 Å²	25	38.7 Å²	38.7	13%	0.128	22%	0.223	C	C	.	.	H	α-helix	trans	-69.7	-42.4	176.2	-64.6	164.9	0	0	0	111.2	R286 N813 A814 F815 N820 A824 D829 V832	R286-I817 PolarHBondContact NH1-O 2.83Å; N813-I817 WeakPolarHBondContact O-CD1 3.38Å; N813-I817 VanDerWaalsContact O-CG1 3.24Å; N813-I817 WeakPolarHBondContact O-CG1 3.4Å; N813-I817 PolarHBondContact O-N 2.96Å; N813-I817 VanDerWaalsContact O-N 3.1Å; A814-I817 PolarHBondContact O-N 2.77Å; F815-I817 VanDerWaalsContact C-N 3.32Å; F815-I817 PolarHBondContact O-N 3.28Å; I817-N820 PolarHBondContact O-N 3.23Å; I817-A824 HydrophobicContact CG1-CB 4.16Å; I817-D829 HydrophobicContact CD1-CB 3.95Å; I817-D829 HydrophobicContact CG1-CB 3.94Å; I817-D829 HydrophobicContact CG2-CB 4.25Å; I817-V832 HydrophobicContact CG1-CG2 4.37Å
818	A	97.6	Very high	98.2	Very high	49 Å²	49	42.5 Å²	42.5	41%	0.405	24%	0.244	S	C	.	.	H	α-helix	trans	-63.3	-44.8	178.9	0	0	0	0	0	112.4	A814 F815 N820	A814-A818 VanDerWaalsContact O-CB 3.27Å; A814-A818 WeakPolarHBondContact O-CB 3.28Å; A814-A818 PolarHBondContact O-N 3.45Å; F815-A818 PolarHBondContact O-N 3.15Å; A818-N820 VanDerWaalsContact C-N 3.3Å; A818-N820 PolarHBondContact O-ND2 2.9Å
819	T	97.8	Very high	98.2	Very high	47 Å²	47	45 Å²	45	29%	0.288	26%	0.257	S	S	.	.	H	α-helix	trans	-75.9	-15.8	176.6	55.8	0	0	0	0	113.5	F815 L816 A821 L952 L954	F815-T819 HydrophobicContact CD1-CG2 4.28Å; F815-T819 HydrophobicContact CD2-CG2 4.34Å; F815-T819 HydrophobicContact CE1-CG2 3.92Å; F815-T819 HydrophobicContact CE2-CG2 3.99Å; F815-T819 HydrophobicContact CG-CG2 4.48Å; F815-T819 HydrophobicContact CZ-CG2 3.77Å; F815-T819 WeakPolarHBondContact O-CB 3.23Å; F815-T819 WeakPolarHBondContact O-CG2 3.44Å; F815-T819 PolarHBondContact O-N 3.05Å; F815-T819 PolarHBondContact O-OG1 3.3Å; L816-T819 PolarHBondContact O-OG1 3.37Å; T819-A821 VanDerWaalsContact C-N 3.34Å; T819-L952 HydrophobicContact CG2-CD1 3.88Å; T819-L954 HydrophobicContact CG2-CD1 4.09Å
820	N	97.8	Very high	98.2	Very high	86 Å²	86	52.6 Å²	52.6	46%	0.46	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.8	43.8	-171	-39.2	-92.1	0	0	0	111.3	R286 L816 I817 A818	R286-N820 PolarHBondContact NH1-OD1 3.4Å; R286-N820 PolarHBondContact NH2-OD1 3.09Å; L816-N820 WeakPolarHBondContact O-CA 3.48Å; L816-N820 PolarHBondContact O-N 3.07Å; I817-N820 PolarHBondContact O-N 3.23Å; A818-N820 VanDerWaalsContact C-N 3.3Å; A818-N820 PolarHBondContact O-ND2 2.9Å
821	A	97.9	Very high	98.1	Very high	16 Å²	16	53.4 Å²	53.4	13%	0.132	29%	0.288	C	S	.	.			trans	-57.5	150	178.2	0	0	0	0	0	111.4	L816 T819 Q823 A824 V825	L816-A821 HydrophobicContact CB-CB 4.1Å; L816-A821 HydrophobicContact CD2-CB 3.76Å; L816-A821 PolarHBondContact O-N 2.95Å; T819-A821 VanDerWaalsContact C-N 3.34Å; A821-Q823 PolarHBondContact O-N 3.32Å; A821-Q823 VanDerWaalsContact O-N 3.08Å; A821-A824 WeakPolarHBondContact O-CB 3.3Å; A821-A824 PolarHBondContact O-N 3.24Å; A821-V825 PolarHBondContact O-N 3.36Å; A821-V825 VanDerWaalsContact O-N 3.16Å
822	P	98.4	Very high	98.2	Very high	112 Å²	112	51.9 Å²	51.9	73%	0.727	28%	0.282	S	S	*	.	H	α-helix	trans	-55.2	-32.7	-176.2	-28.3	35.9	0	0	0	114.7	L826	P822-L826 WeakPolarHBondContact O-CB 3.18Å; P822-L826 PolarHBondContact O-N 3.16Å
823	Q	97.1	Very high	98.2	Very high	39 Å²	39	51.1 Å²	51.1	18%	0.182	28%	0.277	C	S	.	.	H	α-helix	trans	-65.9	-42.2	174.2	-70.1	161.6	-66.5	0	0	112.1	A821 V825 L826 Y827 V832 H836	A821-Q823 PolarHBondContact O-N 3.32Å; A821-Q823 VanDerWaalsContact O-N 3.08Å; Q823-V825 VanDerWaalsContact C-N 3.35Å; Q823-V825 PolarHBondContact O-N 2.94Å; Q823-L826 WeakPolarHBondContact O-CB 3.2Å; Q823-L826 PolarHBondContact O-N 2.82Å; Q823-Y827 VanDerWaalsContact O-CD2 3.3Å; Q823-Y827 WeakPolarHBondContact O-CD2 3.44Å; Q823-Y827 PolarHBondContact O-N 3.03Å; Q823-V832 VanDerWaalsContact C-CG1 3.42Å; Q823-V832 HydrophobicContact CB-CG1 3.81Å; Q823-H836 PolarHBondContact NE2-CD2 2.92Å; Q823-H836 VanDerWaalsContact NE2-CD2 3.34Å; Q823-H836 PolarHBondContact NE2-CE1 3.38Å; Q823-H836 PolarHBondContact NE2-ND1 2.99Å; Q823-H836 VanDerWaalsContact NE2-ND1 3.12Å; Q823-H836 PolarHBondContact NE2-NE2 3.12Å
824	A	98.3	Very high	98.2	Very high	0 Å²	0	51 Å²	51	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-65.8	-38.8	178.5	0	0	0	0	0	111.9	L816 I817 A821 N828 D829 V832	L816-A824 HydrophobicContact CB-CB 4.13Å; L816-A824 WeakPolarHBondContact O-CB 3.45Å; I817-A824 HydrophobicContact CG1-CB 4.16Å; A821-A824 WeakPolarHBondContact O-CB 3.3Å; A821-A824 PolarHBondContact O-N 3.24Å; A824-N828 WeakPolarHBondContact O-CA 3.14Å; A824-N828 PolarHBondContact O-N 3.26Å; A824-D829 PolarHBondContact O-N 2.81Å; A824-V832 VanDerWaalsContact CA-CG1 3.5Å; A824-V832 HydrophobicContact CB-CG1 4.1Å; A824-V832 HydrophobicContact CB-CG2 4.17Å
825	V	98.3	Very high	98.2	Very high	95 Å²	95	52.8 Å²	52.8	58%	0.576	28%	0.283	S	S	*	.	H	α-helix	trans	-65.3	-40.6	173	-177.7	0	0	0	0	111.4	A821 Q823	A821-V825 PolarHBondContact O-N 3.36Å; A821-V825 VanDerWaalsContact O-N 3.16Å; Q823-V825 VanDerWaalsContact C-N 3.35Å; Q823-V825 PolarHBondContact O-N 2.94Å
826	L	98.4	Very high	98.3	Very high	112 Å²	112	53.2 Å²	53.2	59%	0.586	29%	0.286	S	S	*	.	H	α-helix	trans	-64.5	-44.8	177.5	179.4	63.1	0	0	0	112.4	P822 Q823 N828	P822-L826 WeakPolarHBondContact O-CB 3.18Å; P822-L826 PolarHBondContact O-N 3.16Å; Q823-L826 WeakPolarHBondContact O-CB 3.2Å; Q823-L826 PolarHBondContact O-N 2.82Å; L826-N828 PolarHBondContact O-ND2 3.19Å; L826-N828 VanDerWaalsContact O-ND2 3.09Å
827	Y	98.5	Very high	98.3	Very high	49 Å²	49	52.9 Å²	52.9	19%	0.192	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.1	10.9	-178.2	-60.6	-62.1	0	0	0	114	Q823 D829 R830 V832 N835 H836 A839	Q823-Y827 VanDerWaalsContact O-CD2 3.3Å; Q823-Y827 WeakPolarHBondContact O-CD2 3.44Å; Q823-Y827 PolarHBondContact O-N 3.03Å; Y827-D829 PolarHBondContact O-N 3.27Å; Y827-R830 PolarHBondContact O-N 3.01Å; Y827-V832 HydrophobicContact CD2-CG1 4.27Å; Y827-V832 WeakPolarHBondContact CD2-O 3.49Å; Y827-N835 HydrophobicContact CD1-CB 3.54Å; Y827-N835 HydrophobicContact CD2-CB 4.19Å; Y827-N835 HydrophobicContact CE1-CB 3.72Å; Y827-N835 HydrophobicContact CE2-CB 4.34Å; Y827-N835 HydrophobicContact CG-CB 3.8Å; Y827-H836 HydrophobicContact CE2-CB 3.83Å; Y827-A839 WeakPolarHBondContact OH-CB 3.45Å
828	N	98.3	Very high	98.3	Very high	121 Å²	121	52 Å²	52	65%	0.647	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.9	45.4	171.6	-59.3	-101	0	0	0	113.5	A824 L826 R830	A824-N828 WeakPolarHBondContact O-CA 3.14Å; A824-N828 PolarHBondContact O-N 3.26Å; L826-N828 PolarHBondContact O-ND2 3.19Å; L826-N828 VanDerWaalsContact O-ND2 3.09Å; N828-R830 PolarHBondContact O-N 3.16Å
829	D	98.1	Very high	98.3	Very high	59 Å²	59	51.7 Å²	51.7	32%	0.316	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.1	21.2	-179.6	-57.7	-20	0	0	0	115.5	I817 A824 Y827	I817-D829 HydrophobicContact CD1-CB 3.95Å; I817-D829 HydrophobicContact CG1-CB 3.94Å; I817-D829 HydrophobicContact CG2-CB 4.25Å; A824-D829 PolarHBondContact O-N 2.81Å; Y827-D829 PolarHBondContact O-N 3.27Å
830	R	97.9	Very high	98.4	Very high	184 Å²	184	50.8 Å²	50.8	69%	0.694	27%	0.273	S	S	*	.	S	Bend	trans	-115.6	117.9	178.9	-64	173.9	-172.3	-155.4	-0.8	110.9	Y827 N828 V832 N835	Y827-R830 PolarHBondContact O-N 3.01Å; N828-R830 PolarHBondContact O-N 3.16Å; R830-V832 PolarHBondContact O-N 3.31Å; R830-V832 VanDerWaalsContact O-N 3.11Å; R830-N835 PolarHBondContact O-ND2 3.38Å
831	S	97.9	Very high	98.4	Very high	20 Å²	20	46.7 Å²	46.7	14%	0.14	25%	0.251	C	S	.	.	S	Bend	trans	38.6	56.8	173.5	-44.1	0	0	0	0	111.5	E834 N835 D877	S831-E834 WeakPolarHBondContact CA-OE2 3.03Å; S831-E834 WeakPolarHBondContact CB-OE2 3.46Å; S831-E834 PolarHBondContact O-N 2.67Å; S831-N835 VanDerWaalsContact O-CB 3.32Å; S831-N835 WeakPolarHBondContact O-CB 3.4Å; S831-N835 PolarHBondContact O-N 2.94Å; S831-N835 PolarHBondContact O-ND2 3.38Å; S831-D877 VanDerWaalsContact CB-OD2 3.29Å; S831-D877 WeakPolarHBondContact CB-OD2 3.39Å; S831-D877 PolarHBondContact OG-OD2 2.94Å
832	V	98.8	Very high	98.5	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-69.4	-39.7	-159.6	172.4	0	0	0	0	110.8	N813 L816 I817 Q823 A824 Y827 R830 E834 H836	N813-V832 WeakPolarHBondContact OD1-CA 3.29Å; N813-V832 VanDerWaalsContact OD1-CB 3.29Å; N813-V832 WeakPolarHBondContact OD1-CB 3.34Å; N813-V832 PolarHBondContact OD1-N 2.91Å; L816-V832 HydrophobicContact CB-CG1 4.5Å; L816-V832 HydrophobicContact CD1-CG1 3.89Å; I817-V832 HydrophobicContact CG1-CG2 4.37Å; Q823-V832 VanDerWaalsContact C-CG1 3.42Å; Q823-V832 HydrophobicContact CB-CG1 3.81Å; A824-V832 VanDerWaalsContact CA-CG1 3.5Å; A824-V832 HydrophobicContact CB-CG1 4.1Å; A824-V832 HydrophobicContact CB-CG2 4.17Å; Y827-V832 HydrophobicContact CD2-CG1 4.27Å; Y827-V832 WeakPolarHBondContact CD2-O 3.49Å; R830-V832 PolarHBondContact O-N 3.31Å; R830-V832 VanDerWaalsContact O-N 3.11Å; V832-E834 PolarHBondContact N-OE2 3.46Å; V832-H836 WeakPolarHBondContact O-CB 3.31Å; V832-H836 PolarHBondContact O-N 2.93Å
833	L	98.8	Very high	98.5	Very high	9 Å²	9	44.6 Å²	44.6	5%	0.047	24%	0.238	C	C	.	.	H	α-helix	trans	-68.4	-53.2	174.4	-73	171.5	0	0	0	110.6	P809 N813 L816 N835 H836 H837	P809-L833 HydrophobicContact CG-CD2 3.64Å; N813-L833 HydrophobicContact CB-CD1 4.39Å; N813-L833 WeakPolarHBondContact OD1-CG 3.4Å; N813-L833 PolarHBondContact OD1-N 3.38Å; L816-L833 HydrophobicContact CD1-CD2 3.7Å; L816-L833 HydrophobicContact CD1-CG 3.99Å; L833-N835 VanDerWaalsContact C-N 3.35Å; L833-N835 PolarHBondContact O-N 2.84Å; L833-H836 CarbonylContact O-C 3.58Å; L833-H836 VanDerWaalsContact O-CA 3.3Å; L833-H836 WeakPolarHBondContact O-CA 3.44Å; L833-H836 VanDerWaalsContact O-CB 3.25Å; L833-H836 WeakPolarHBondContact O-CB 3.31Å; L833-H836 PolarHBondContact O-N 3.42Å; L833-H837 WeakPolarHBondContact CB-NE2 3.49Å; L833-H837 PolarHBondContact O-CD2 2.99Å; L833-H837 PolarHBondContact O-N 3.06Å; L833-H837 PolarHBondContact O-NE2 3.03Å
834	E	98.8	Very high	98.5	Very high	16 Å²	16	44 Å²	44	8%	0.075	24%	0.236	C	C	.	.	H	α-helix	trans	-65.1	-38.3	-172.6	-54.1	80.9	179.3	0	0	111.5	N813 S831 V832 A838 I873 L874 D877	N813-E834 VanDerWaalsContact ND2-CD 3.26Å; N813-E834 PolarHBondContact ND2-OE1 3.04Å; N813-E834 PolarHBondContact ND2-OE2 3.33Å; S831-E834 WeakPolarHBondContact CA-OE2 3.03Å; S831-E834 WeakPolarHBondContact CB-OE2 3.46Å; S831-E834 PolarHBondContact O-N 2.67Å; V832-E834 PolarHBondContact N-OE2 3.46Å; E834-A838 WeakPolarHBondContact O-CB 3.26Å; E834-A838 PolarHBondContact O-N 3.32Å; E834-A838 VanDerWaalsContact O-N 3.16Å; E834-I873 HydrophobicContact CB-CG2 4.5Å; E834-L874 HydrophobicContact CB-CD2 3.94Å; E834-D877 HydrophobicContact CG-CB 3.9Å; E834-D877 WeakPolarHBondContact OE1-CA 3.47Å; E834-D877 WeakPolarHBondContact OE1-CB 3.39Å
835	N	98.8	Very high	98.6	Very high	49 Å²	49	44.3 Å²	44.3	26%	0.262	24%	0.237	S	C	.	.	H	α-helix	trans	-65	-39.7	168.3	-81.5	-84.7	0	0	0	112.1	Y827 R830 S831 L833 A839 L874	Y827-N835 HydrophobicContact CD1-CB 3.54Å; Y827-N835 HydrophobicContact CD2-CB 4.19Å; Y827-N835 HydrophobicContact CE1-CB 3.72Å; Y827-N835 HydrophobicContact CE2-CB 4.34Å; Y827-N835 HydrophobicContact CG-CB 3.8Å; R830-N835 PolarHBondContact O-ND2 3.38Å; S831-N835 VanDerWaalsContact O-CB 3.32Å; S831-N835 WeakPolarHBondContact O-CB 3.4Å; S831-N835 PolarHBondContact O-N 2.94Å; S831-N835 PolarHBondContact O-ND2 3.38Å; L833-N835 VanDerWaalsContact C-N 3.35Å; L833-N835 PolarHBondContact O-N 2.84Å; N835-A839 WeakPolarHBondContact O-CB 3.34Å; N835-A839 PolarHBondContact O-N 3Å; N835-L874 HydrophobicContact CB-CD2 4.5Å
836	H	98.8	Very high	98.5	Very high	22 Å²	22	44.7 Å²	44.7	10%	0.102	24%	0.235	C	C	.	.	H	α-helix	trans	-65	-43.2	177.6	179.8	80.9	0	0	0	112.2	D807 Q823 Y827 V832 L833 S840	D807-H836 IonicContact OD2-CD2 3.61Å; D807-H836 IonicContact OD2-CE1 3.09Å; D807-H836 IonicContact OD2-NE2 3.34Å; D807-H836 PolarHBondContact OD2-NE2 2.76Å; Q823-H836 PolarHBondContact NE2-CD2 2.92Å; Q823-H836 VanDerWaalsContact NE2-CD2 3.34Å; Q823-H836 PolarHBondContact NE2-CE1 3.38Å; Q823-H836 PolarHBondContact NE2-ND1 2.99Å; Q823-H836 VanDerWaalsContact NE2-ND1 3.12Å; Q823-H836 PolarHBondContact NE2-NE2 3.12Å; Y827-H836 HydrophobicContact CE2-CB 3.83Å; V832-H836 WeakPolarHBondContact O-CB 3.31Å; V832-H836 PolarHBondContact O-N 2.93Å; L833-H836 CarbonylContact O-C 3.58Å; L833-H836 VanDerWaalsContact O-CA 3.3Å; L833-H836 WeakPolarHBondContact O-CA 3.44Å; L833-H836 VanDerWaalsContact O-CB 3.25Å; L833-H836 WeakPolarHBondContact O-CB 3.31Å; L833-H836 PolarHBondContact O-N 3.42Å; H836-S840 PolarHBondContact CE1-OG 3.31Å; H836-S840 VanDerWaalsContact CE1-OG 3.29Å; H836-S840 WeakPolarHBondContact O-CB 3.47Å; H836-S840 PolarHBondContact O-N 3.18Å; H836-S840 PolarHBondContact O-OG 3.29Å
837	H	98.8	Very high	98.5	Very high	1 Å²	1	42.7 Å²	42.7	1%	0.005	23%	0.23	C	C	.	.	H	α-helix	trans	-61.8	-56	178.7	-55.9	-35.1	0	0	0	110.4	H804 D805 Y806 H808 L833 A839 S840 A841 I873	H804-H837 WeakPolarHBondContact O-CB 3.46Å; H804-H837 PolarHBondContact O-CD2 3.35Å; D805-H837 IonicContact OD1-NE2 3.81Å; Y806-H837 PolarHBondContact O-ND1 3.21Å; H808-H837 AromaticContact CD2-CE1 3.94Å; H808-H837 AromaticContact CD2-NE2 3.69Å; L833-H837 WeakPolarHBondContact CB-NE2 3.49Å; L833-H837 PolarHBondContact O-CD2 2.99Å; L833-H837 PolarHBondContact O-N 3.06Å; L833-H837 PolarHBondContact O-NE2 3.03Å; H837-A839 PolarHBondContact O-N 3.07Å; H837-S840 PolarHBondContact O-N 2.7Å; H837-A841 VanDerWaalsContact O-CB 3.29Å; H837-A841 WeakPolarHBondContact O-CB 3.39Å; H837-A841 PolarHBondContact O-N 2.85Å; H837-I873 HydrophobicContact CB-CG2 4.39Å
838	A	98.8	Very high	98.5	Very high	5 Å²	5	44.2 Å²	44.2	4%	0.041	24%	0.239	C	C	.	.	H	α-helix	trans	-59.2	-48.2	177.4	0	0	0	0	0	112.3	E834 S840 W842 I873	E834-A838 WeakPolarHBondContact O-CB 3.26Å; E834-A838 PolarHBondContact O-N 3.32Å; E834-A838 VanDerWaalsContact O-N 3.16Å; A838-S840 PolarHBondContact O-N 3.32Å; A838-W842 WeakPolarHBondContact O-CB 3.32Å; A838-W842 PolarHBondContact O-N 3.26Å; A838-I873 HydrophobicContact CB-CB 4.3Å; A838-I873 HydrophobicContact CB-CD1 3.84Å; A838-I873 HydrophobicContact CB-CG2 4.07Å
839	A	98.8	Very high	98.4	Very high	43 Å²	43	43.8 Å²	43.8	36%	0.355	24%	0.243	S	C	.	.	H	α-helix	trans	-65.5	-38.8	-178.8	0	0	0	0	0	112.5	Y827 N835 H837 S843	Y827-A839 WeakPolarHBondContact OH-CB 3.45Å; N835-A839 WeakPolarHBondContact O-CB 3.34Å; N835-A839 PolarHBondContact O-N 3Å; H837-A839 PolarHBondContact O-N 3.07Å; A839-S843 WeakPolarHBondContact O-CB 3.14Å; A839-S843 PolarHBondContact O-N 2.79Å
840	S	98.7	Very high	98.3	Very high	28 Å²	28	45.3 Å²	45.3	20%	0.196	25%	0.249	C	C	.	.	H	α-helix	trans	-76.8	-37.8	-177.8	-57.8	0	0	0	0	112.2	H836 H837 A838 S843 L844	H836-S840 PolarHBondContact CE1-OG 3.31Å; H836-S840 VanDerWaalsContact CE1-OG 3.29Å; H836-S840 WeakPolarHBondContact O-CB 3.47Å; H836-S840 PolarHBondContact O-N 3.18Å; H836-S840 PolarHBondContact O-OG 3.29Å; H837-S840 PolarHBondContact O-N 2.7Å; A838-S840 PolarHBondContact O-N 3.32Å; S840-S843 WeakPolarHBondContact O-CB 3.28Å; S840-S843 PolarHBondContact O-N 2.93Å; S840-L844 WeakPolarHBondContact O-CB 3.31Å; S840-L844 PolarHBondContact O-N 3.26Å
841	A	98.7	Very high	98.3	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-67.4	-38.4	174	0	0	0	0	0	112.4	Y706 L710 M803 Y806 H837 L844 Y845	Y706-A841 PolarHBondContact OH-O 2.87Å; L710-A841 HydrophobicContact CD1-CB 3.91Å; M803-A841 HydrophobicContact CB-CB 3.83Å; M803-A841 HydrophobicContact CE-CB 4.14Å; M803-A841 HydrophobicContact CG-CB 4.06Å; M803-A841 HydrophobicContact SD-CB 3.53Å; M803-A841 VanDerWaalsContact SD-CB 3.53Å; Y806-A841 HydrophobicContact CD1-CB 4.19Å; Y806-A841 HydrophobicContact CG-CB 4.2Å; H837-A841 VanDerWaalsContact O-CB 3.29Å; H837-A841 WeakPolarHBondContact O-CB 3.39Å; H837-A841 PolarHBondContact O-N 2.85Å; A841-L844 PolarHBondContact O-N 3.16Å; A841-Y845 PolarHBondContact O-N 3.05Å
842	W	98.8	Very high	98.3	Very high	5 Å²	5	39.9 Å²	39.9	2%	0.019	23%	0.23	C	C	.	.	H	α-helix	trans	-70.8	-32.5	171.2	-82.8	108.2	0	0	0	113	A838 Y845 L846 F862 F865 R866 V869	A838-W842 WeakPolarHBondContact O-CB 3.32Å; A838-W842 PolarHBondContact O-N 3.26Å; W842-Y845 HydrophobicContact CE3-CD1 4.04Å; W842-Y845 HydrophobicContact CE3-CG 4.21Å; W842-Y845 AromaticContact CZ3-CD1 3.77Å; W842-Y845 HydrophobicContact CZ3-CD1 3.77Å; W842-Y845 HydrophobicContact CZ3-CE1 4.16Å; W842-Y845 HydrophobicContact CZ3-CG 4.07Å; W842-L846 WeakPolarHBondContact O-CB 3.46Å; W842-L846 VanDerWaalsContact O-CG 3.3Å; W842-L846 WeakPolarHBondContact O-CG 2.83Å; W842-L846 PolarHBondContact O-N 3.38Å; W842-L846 VanDerWaalsContact O-N 3.09Å; W842-F862 HydrophobicContact CH2-CE2 4.17Å; W842-F862 HydrophobicContact CH2-CZ 4.29Å; W842-F862 AromaticContact CZ3-CE2 3.87Å; W842-F862 HydrophobicContact CZ3-CE2 3.87Å; W842-F862 AromaticContact CZ3-CZ 3.71Å; W842-F862 HydrophobicContact CZ3-CZ 3.71Å; W842-F865 AromaticContact CH2-CD1 3.89Å; W842-F865 HydrophobicContact CH2-CD1 3.89Å; W842-F865 AromaticContact CH2-CE1 3.78Å; W842-F865 HydrophobicContact CH2-CE1 3.78Å; W842-F865 HydrophobicContact CZ2-CD1 4.14Å; W842-F865 AromaticContact CZ2-CE1 3.94Å; W842-F865 HydrophobicContact CZ2-CE1 3.94Å; W842-R866 HydrophobicContact CD2-CG 4.06Å; W842-R866 HydrophobicContact CE3-CG 4.43Å; W842-R866 HydrophobicContact CH2-CB 3.86Å; W842-R866 HydrophobicContact CH2-CG 4.11Å; W842-R866 HydrophobicContact CZ2-CB 3.71Å; W842-R866 HydrophobicContact CZ2-CG 3.72Å; W842-R866 HydrophobicContact CZ3-CB 4.49Å; W842-R866 HydrophobicContact CZ3-CG 4.45Å; W842-V869 HydrophobicContact CZ2-CB 4.16Å; W842-V869 HydrophobicContact CZ2-CG1 4.2Å; W842-V869 HydrophobicContact CZ2-CG2 4.3Å
843	S	98.6	Very high	98.3	Very high	80 Å²	80	40 Å²	40	56%	0.559	23%	0.23	S	C	*	.	H	α-helix	trans	-65.7	-43.7	172.4	-172.5	0	0	0	0	111.2	A839 S840 L846 S847	A839-S843 WeakPolarHBondContact O-CB 3.14Å; A839-S843 PolarHBondContact O-N 2.79Å; S840-S843 WeakPolarHBondContact O-CB 3.28Å; S840-S843 PolarHBondContact O-N 2.93Å; S843-L846 PolarHBondContact O-N 2.92Å; S843-S847 WeakPolarHBondContact O-CB 3.25Å; S843-S847 PolarHBondContact O-N 3.35Å
844	L	98.6	Very high	98.3	Very high	26 Å²	26	39.8 Å²	39.8	14%	0.136	23%	0.229	C	C	.	.	H	α-helix	trans	-57.5	-53	171.8	176.6	66	0	0	0	110.6	Y706 A709 L710 Y806 S840 A841 L846 S847 Y851	Y706-L844 HydrophobicContact CD2-CD2 4.39Å; Y706-L844 HydrophobicContact CD2-CG 4.36Å; Y706-L844 HydrophobicContact CE2-CB 4.39Å; Y706-L844 HydrophobicContact CE2-CD2 3.96Å; Y706-L844 HydrophobicContact CE2-CG 3.98Å; A709-L844 HydrophobicContact CB-CD1 4.26Å; A709-L844 HydrophobicContact CB-CD2 4.16Å; L710-L844 HydrophobicContact CB-CD2 4.26Å; L710-L844 HydrophobicContact CD1-CD2 4.3Å; Y806-L844 HydrophobicContact CE2-CD2 4.11Å; S840-L844 WeakPolarHBondContact O-CB 3.31Å; S840-L844 PolarHBondContact O-N 3.26Å; A841-L844 PolarHBondContact O-N 3.16Å; L844-L846 VanDerWaalsContact C-N 3.26Å; L844-L846 PolarHBondContact O-N 3.11Å; L844-S847 WeakPolarHBondContact O-CB 3.27Å; L844-S847 PolarHBondContact O-N 2.82Å; L844-S847 PolarHBondContact O-OG 3.25Å; L844-Y851 HydrophobicContact CD1-CD2 4.39Å; L844-Y851 HydrophobicContact CD1-CE2 3.76Å; L844-Y851 HydrophobicContact CG-CE2 4.4Å; L844-Y851 VanDerWaalsContact O-CD2 3.26Å; L844-Y851 WeakPolarHBondContact O-CD2 3.28Å
845	Y	98.7	Very high	98.1	Very high	6 Å²	6	41.8 Å²	41.8	2%	0.024	25%	0.249	C	C	.	.	H	α-helix	trans	-53.3	-43.3	-179.8	-178.1	-86.6	0	0	0	112.5	Y706 A841 W842 S847 Y851 N852 F853 L854 F862	Y706-Y845 HydrophobicContact CD1-CD2 4.42Å; Y706-Y845 HydrophobicContact CD2-CD2 4.12Å; Y706-Y845 HydrophobicContact CE1-CD2 4.29Å; Y706-Y845 HydrophobicContact CE2-CD2 4Å; Y706-Y845 HydrophobicContact CE2-CG 4.32Å; Y706-Y845 HydrophobicContact CG-CD2 4.31Å; A841-Y845 PolarHBondContact O-N 3.05Å; W842-Y845 HydrophobicContact CE3-CD1 4.04Å; W842-Y845 HydrophobicContact CE3-CG 4.21Å; W842-Y845 AromaticContact CZ3-CD1 3.77Å; W842-Y845 HydrophobicContact CZ3-CD1 3.77Å; W842-Y845 HydrophobicContact CZ3-CE1 4.16Å; W842-Y845 HydrophobicContact CZ3-CG 4.07Å; Y845-S847 VanDerWaalsContact C-N 3.34Å; Y845-Y851 VanDerWaalsContact CE2-O 3.22Å; Y845-Y851 WeakPolarHBondContact CE2-O 3.45Å; Y845-N852 WeakPolarHBondContact OH-CA 3.47Å; Y845-N852 PolarHBondContact OH-OD1 3.27Å; Y845-F853 HydrophobicContact CD2-CD1 4.28Å; Y845-F853 HydrophobicContact CD2-CE1 4.04Å; Y845-F853 AromaticContact CE2-CD1 3.63Å; Y845-F853 HydrophobicContact CE2-CD1 3.63Å; Y845-F853 AromaticContact CE2-CE1 3.63Å; Y845-F853 HydrophobicContact CE2-CE1 3.63Å; Y845-F853 HydrophobicContact CE2-CG 4.49Å; Y845-L854 HydrophobicContact CE2-CD1 4.34Å; Y845-L854 HydrophobicContact CE2-CG 4.42Å; Y845-L854 VanDerWaalsContact OH-CB 3.29Å; Y845-L854 WeakPolarHBondContact OH-CB 3.38Å; Y845-L854 PolarHBondContact OH-N 3.28Å; Y845-L854 VanDerWaalsContact OH-N 3.12Å; Y845-F862 AromaticContact CE1-CE2 3.84Å; Y845-F862 HydrophobicContact CE1-CE2 3.84Å; Y845-F862 HydrophobicContact CE1-CZ 4.12Å
846	L	98	Very high	98	Very high	104 Å²	104	43.5 Å²	43.5	55%	0.545	26%	0.258	S	S	.	.	H	α-helix	trans	-83.5	-5.2	-178.6	-64.2	172.1	0	0	0	114	W842 S843 L844	W842-L846 WeakPolarHBondContact O-CB 3.46Å; W842-L846 VanDerWaalsContact O-CG 3.3Å; W842-L846 WeakPolarHBondContact O-CG 2.83Å; W842-L846 PolarHBondContact O-N 3.38Å; W842-L846 VanDerWaalsContact O-N 3.09Å; S843-L846 PolarHBondContact O-N 2.92Å; L844-L846 VanDerWaalsContact C-N 3.26Å; L844-L846 PolarHBondContact O-N 3.11Å
847	S	98.1	Very high	97.9	Very high	69 Å²	69	43.4 Å²	43.4	48%	0.483	26%	0.258	S	S	.	.	H	α-helix	trans	-74.9	-31	-173.4	69.2	0	0	0	0	114.1	S843 L844 Y845	S843-S847 WeakPolarHBondContact O-CB 3.25Å; S843-S847 PolarHBondContact O-N 3.35Å; L844-S847 WeakPolarHBondContact O-CB 3.27Å; L844-S847 PolarHBondContact O-N 2.82Å; L844-S847 PolarHBondContact O-OG 3.25Å; Y845-S847 VanDerWaalsContact C-N 3.34Å
848	Q	97	Very high	97.6	Very high	81 Å²	81	46.6 Å²	46.6	38%	0.379	28%	0.275	S	S	.	.			trans	-141.4	142.8	-176.5	-54.7	-167.2	69.4	0	0	111	E850 Y851	Q848-E850 HydrophobicContact CB-CG 3.97Å; Q848-E850 PolarHBondContact O-N 3.2Å; Q848-Y851 HydrophobicContact CB-CD2 3.82Å; Q848-Y851 HydrophobicContact CB-CE2 3.86Å; Q848-Y851 HydrophobicContact CB-CG 4.44Å; Q848-Y851 HydrophobicContact CG-CD2 4.3Å; Q848-Y851 HydrophobicContact CG-CE2 3.87Å; Q848-Y851 PolarHBondContact NE2-OH 2.96Å; Q848-Y851 PolarHBondContact O-N 2.94Å
849	P	96.3	Very high	97.4	Very high	113 Å²	113	53.8 Å²	53.8	73%	0.734	31%	0.307	S	S	*	.	G	3₁₀ helix	trans	-67.2	-24.9	-178.7	29	-35.6	0	0	0	112.9	Y851 N852	P849-Y851 PolarHBondContact O-N 3.37Å; P849-N852 WeakPolarHBondContact O-CB 3.25Å; P849-N852 PolarHBondContact O-N 3.44Å; P849-N852 VanDerWaalsContact O-N 3.15Å
850	E	96.7	Very high	97.3	Very high	91 Å²	91	56.7 Å²	56.7	43%	0.425	32%	0.321	S	S	.	.	G	3₁₀ helix	trans	-71.7	-0.1	176.4	63.6	-163.9	-114.1	0	0	114.4	E702 S705 Q848	E702-E850 VanDerWaalsContact CA-O 3.26Å; E702-E850 WeakPolarHBondContact CA-O 3.22Å; E702-E850 WeakPolarHBondContact CB-O 3.32Å; S705-E850 WeakPolarHBondContact CB-O 3.46Å; Q848-E850 HydrophobicContact CB-CG 3.97Å; Q848-E850 PolarHBondContact O-N 3.2Å
851	Y	98.2	Very high	97.2	Very high	26 Å²	26	57.7 Å²	57.7	10%	0.102	32%	0.322	C	S	.	.	G	3₁₀ helix	trans	-102.6	-3.3	170.3	-58.5	-31.7	0	0	0	113.2	S705 Y706 A709 L844 Y845 Q848 P849 F853	S705-Y851 VanDerWaalsContact O-CE1 3.3Å; S705-Y851 WeakPolarHBondContact O-CE1 3.47Å; Y706-Y851 HydrophobicContact CD2-CG 4.15Å; A709-Y851 HydrophobicContact CB-CE1 3.9Å; L844-Y851 HydrophobicContact CD1-CD2 4.39Å; L844-Y851 HydrophobicContact CD1-CE2 3.76Å; L844-Y851 HydrophobicContact CG-CE2 4.4Å; L844-Y851 VanDerWaalsContact O-CD2 3.26Å; L844-Y851 WeakPolarHBondContact O-CD2 3.28Å; Y845-Y851 VanDerWaalsContact CE2-O 3.22Å; Y845-Y851 WeakPolarHBondContact CE2-O 3.45Å; Q848-Y851 HydrophobicContact CB-CD2 3.82Å; Q848-Y851 HydrophobicContact CB-CE2 3.86Å; Q848-Y851 HydrophobicContact CB-CG 4.44Å; Q848-Y851 HydrophobicContact CG-CD2 4.3Å; Q848-Y851 HydrophobicContact CG-CE2 3.87Å; Q848-Y851 PolarHBondContact NE2-OH 2.96Å; Q848-Y851 PolarHBondContact O-N 2.94Å; P849-Y851 PolarHBondContact O-N 3.37Å; Y851-F853 PolarHBondContact O-N 3.24Å
852	N	97.9	Very high	97.1	Very high	63 Å²	63	59.9 Å²	59.9	34%	0.337	33%	0.332	S	S	.	.			trans	-79.8	61.2	-172	-170.6	34.7	0	0	0	112.8	Y845 P849 L854 A855	Y845-N852 WeakPolarHBondContact OH-CA 3.47Å; Y845-N852 PolarHBondContact OH-OD1 3.27Å; P849-N852 WeakPolarHBondContact O-CB 3.25Å; P849-N852 PolarHBondContact O-N 3.44Å; P849-N852 VanDerWaalsContact O-N 3.15Å; N852-L854 PolarHBondContact O-N 2.85Å; N852-L854 VanDerWaalsContact O-N 3.17Å; N852-A855 WeakPolarHBondContact ND2-CB 3.48Å; N852-A855 WeakPolarHBondContact O-CB 3.47Å; N852-A855 PolarHBondContact O-N 2.99Å; N852-A855 VanDerWaalsContact O-N 3.15Å
853	F	98.4	Very high	97.1	Very high	2 Å²	2	66.6 Å²	66.6	1%	0.009	36%	0.361	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-10.1	-179	78.4	-96.3	0	0	0	113.9	I698 P699 E702 F703 Y706 F707 V799 Y845 Y851	I698-F853 HydrophobicContact CD1-CD2 4.31Å; I698-F853 HydrophobicContact CD1-CE2 4.48Å; I698-F853 HydrophobicContact CG1-CD2 4.37Å; I698-F853 HydrophobicContact CG2-CB 4.04Å; I698-F853 HydrophobicContact CG2-CD2 3.76Å; I698-F853 HydrophobicContact CG2-CG 4.35Å; P699-F853 WeakPolarHBondContact CD-O 3.48Å; E702-F853 HydrophobicContact CB-CB 4.26Å; F703-F853 HydrophobicContact CB-CB 3.88Å; F703-F853 HydrophobicContact CB-CG 4.27Å; F703-F853 AromaticContact CD2-CD2 3.85Å; F703-F853 HydrophobicContact CD2-CD2 3.85Å; F703-F853 HydrophobicContact CD2-CE2 4.11Å; F703-F853 HydrophobicContact CD2-CG 4.17Å; Y706-F853 AromaticContact CD1-CD1 3.95Å; Y706-F853 HydrophobicContact CD1-CD1 3.95Å; Y706-F853 AromaticContact CD1-CE1 3.48Å; Y706-F853 HydrophobicContact CD1-CE1 3.48Å; Y706-F853 VanDerWaalsContact CD1-CE1 3.48Å; Y706-F853 AromaticContact CE1-CE1 3.95Å; Y706-F853 HydrophobicContact CE1-CE1 3.95Å; Y706-F853 HydrophobicContact CG-CD1 4.24Å; Y706-F853 HydrophobicContact CG-CE1 4.19Å; F707-F853 HydrophobicContact CE2-CD1 4.38Å; F707-F853 AromaticContact CE2-CE1 3.78Å; F707-F853 HydrophobicContact CE2-CE1 3.78Å; F707-F853 HydrophobicContact CE2-CE2 4.36Å; F707-F853 AromaticContact CE2-CZ 3.77Å; F707-F853 HydrophobicContact CE2-CZ 3.77Å; F707-F853 HydrophobicContact CZ-CE1 4.22Å; F707-F853 HydrophobicContact CZ-CZ 4.05Å; V799-F853 HydrophobicContact CG2-CZ 4.36Å; Y845-F853 HydrophobicContact CD2-CD1 4.28Å; Y845-F853 HydrophobicContact CD2-CE1 4.04Å; Y845-F853 AromaticContact CE2-CD1 3.63Å; Y845-F853 HydrophobicContact CE2-CD1 3.63Å; Y845-F853 AromaticContact CE2-CE1 3.63Å; Y845-F853 HydrophobicContact CE2-CE1 3.63Å; Y845-F853 HydrophobicContact CE2-CG 4.49Å; Y851-F853 PolarHBondContact O-N 3.24Å
854	L	97.9	Very high	97.1	Very high	6 Å²	6	65 Å²	65	3%	0.031	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.4	19.2	173.9	-53.3	170.9	0	0	0	112.9	M795 Y845 N852 N856 L857 F862 F865	M795-L854 HydrophobicContact CE-CD2 3.94Å; M795-L854 HydrophobicContact SD-CD2 4.47Å; Y845-L854 HydrophobicContact CE2-CD1 4.34Å; Y845-L854 HydrophobicContact CE2-CG 4.42Å; Y845-L854 VanDerWaalsContact OH-CB 3.29Å; Y845-L854 WeakPolarHBondContact OH-CB 3.38Å; Y845-L854 PolarHBondContact OH-N 3.28Å; Y845-L854 VanDerWaalsContact OH-N 3.12Å; N852-L854 PolarHBondContact O-N 2.85Å; N852-L854 VanDerWaalsContact O-N 3.17Å; L854-N856 PolarHBondContact O-N 3.1Å; L854-L857 HydrophobicContact CB-CD1 4.06Å; L854-L857 HydrophobicContact CB-CG 4.17Å; L854-L857 HydrophobicContact CD1-CD1 4.4Å; L854-L857 HydrophobicContact CD2-CD1 3.98Å; L854-L857 HydrophobicContact CD2-CG 4.37Å; L854-L857 HydrophobicContact CG-CD1 4.38Å; L854-L857 PolarHBondContact O-N 3.3Å; L854-F862 HydrophobicContact CB-CD2 4.14Å; L854-F862 HydrophobicContact CB-CE2 4.46Å; L854-F862 HydrophobicContact CD1-CD2 4.08Å; L854-F862 HydrophobicContact CD1-CE2 4.1Å; L854-F865 HydrophobicContact CD1-CD1 3.57Å; L854-F865 HydrophobicContact CD1-CE1 3.34Å; L854-F865 HydrophobicContact CD1-CG 4.39Å; L854-F865 HydrophobicContact CD1-CZ 3.98Å
855	A	96.3	Very high	97.1	Very high	58 Å²	58	63.8 Å²	63.8	48%	0.479	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-19.5	-178.2	0	0	0	0	0	115.2	N852	N852-A855 WeakPolarHBondContact ND2-CB 3.48Å; N852-A855 WeakPolarHBondContact O-CB 3.47Å; N852-A855 PolarHBondContact O-N 2.99Å; N852-A855 VanDerWaalsContact O-N 3.15Å
856	N	96.4	Very high	97.1	Very high	84 Å²	84	68 Å²	68	45%	0.449	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.3	-1.7	-179.3	-67.5	-36.9	0	0	0	114.1	K697 L854	K697-N856 HydrophobicContact CB-CB 4.28Å; K697-N856 PolarHBondContact O-ND2 2.88Å; L854-N856 PolarHBondContact O-N 3.1Å
857	L	95.6	Very high	97.1	Very high	20 Å²	20	67.3 Å²	67.3	11%	0.105	35%	0.345	C	S	.	.	S	Bend	trans	-74.4	146.3	165.8	-66.5	-169.2	0	0	0	110.3	F696 L792 M795 L854 E861 F862 F865	F696-L857 HydrophobicContact CB-CD2 4.13Å; F696-L857 HydrophobicContact CD1-CD2 3.44Å; F696-L857 VanDerWaalsContact CD1-CD2 3.44Å; F696-L857 HydrophobicContact CE1-CD2 4.16Å; F696-L857 HydrophobicContact CG-CD2 4.04Å; L792-L857 HydrophobicContact CD1-CD1 4.15Å; L792-L857 HydrophobicContact CD1-CD2 4.42Å; M795-L857 HydrophobicContact CE-CD1 4.37Å; L854-L857 HydrophobicContact CB-CD1 4.06Å; L854-L857 HydrophobicContact CB-CG 4.17Å; L854-L857 HydrophobicContact CD1-CD1 4.4Å; L854-L857 HydrophobicContact CD2-CD1 3.98Å; L854-L857 HydrophobicContact CD2-CG 4.37Å; L854-L857 HydrophobicContact CG-CD1 4.38Å; L854-L857 PolarHBondContact O-N 3.3Å; L857-E861 HydrophobicContact CB-CB 4.09Å; L857-E861 HydrophobicContact CD1-CB 4.41Å; L857-E861 HydrophobicContact CD2-CB 4.36Å; L857-F862 HydrophobicContact CB-CB 4.31Å; L857-F865 HydrophobicContact CD1-CB 4.39Å
858	D	93.9	Very high	97.2	Very high	68 Å²	68	64.3 Å²	64.3	36%	0.364	32%	0.324	S	S	.	.			trans	-72.6	167.6	169	99.3	8.8	0	0	0	112.1	V860 E861 F862	D858-V860 VanDerWaalsContact C-N 3.27Å; D858-V860 PolarHBondContact O-N 3.05Å; D858-V860 VanDerWaalsContact OD1-CA 3.27Å; D858-V860 WeakPolarHBondContact OD1-CA 3.49Å; D858-V860 VanDerWaalsContact OD1-CB 3.25Å; D858-V860 WeakPolarHBondContact OD1-CB 3.37Å; D858-V860 PolarHBondContact OD1-N 2.96Å; D858-E861 PolarHBondContact N-OE2 3.36Å; D858-E861 PolarHBondContact O-N 3.31Å; D858-E861 PolarHBondContact OD1-N 2.98Å; D858-F862 WeakPolarHBondContact O-CB 3.34Å; D858-F862 PolarHBondContact O-N 3.11Å
859	H	94.7	Very high	97.2	Very high	157 Å²	157	60.5 Å²	60.5	73%	0.727	31%	0.306	S	S	*	.	H	α-helix	trans	-67.2	-25	-176.5	-179	-74.7	0	0	0	113.5	K863	H859-K863 VanDerWaalsContact O-CB 3.22Å; H859-K863 WeakPolarHBondContact O-CB 3.4Å; H859-K863 PolarHBondContact O-N 3.14Å
860	V	96.1	Very high	97.4	Very high	104 Å²	104	57.3 Å²	57.3	63%	0.63	28%	0.282	S	S	*	.	H	α-helix	trans	-76.6	-47.6	174.4	-173.3	0	0	0	0	109.6	D858 K863 R864	D858-V860 VanDerWaalsContact C-N 3.27Å; D858-V860 PolarHBondContact O-N 3.05Å; D858-V860 VanDerWaalsContact OD1-CA 3.27Å; D858-V860 WeakPolarHBondContact OD1-CA 3.49Å; D858-V860 VanDerWaalsContact OD1-CB 3.25Å; D858-V860 WeakPolarHBondContact OD1-CB 3.37Å; D858-V860 PolarHBondContact OD1-N 2.96Å; V860-K863 PolarHBondContact O-N 2.91Å; V860-R864 WeakPolarHBondContact O-CB 3.44Å; V860-R864 PolarHBondContact O-N 3.43Å
861	E	95.9	Very high	97.5	Very high	48 Å²	48	55.8 Å²	55.8	22%	0.224	28%	0.275	C	S	.	.	H	α-helix	trans	-58.2	-52.5	175.5	-67	179.6	128.7	0	0	111.4	L792 L857 D858 K863 R864 F865	L792-E861 HydrophobicContact CD2-CB 4.33Å; L857-E861 HydrophobicContact CB-CB 4.09Å; L857-E861 HydrophobicContact CD1-CB 4.41Å; L857-E861 HydrophobicContact CD2-CB 4.36Å; D858-E861 PolarHBondContact N-OE2 3.36Å; D858-E861 PolarHBondContact O-N 3.31Å; D858-E861 PolarHBondContact OD1-N 2.98Å; E861-K863 VanDerWaalsContact C-N 3.26Å; E861-K863 PolarHBondContact O-N 2.7Å; E861-R864 PolarHBondContact O-N 2.97Å; E861-R864 VanDerWaalsContact O-N 3.16Å; E861-F865 VanDerWaalsContact O-CB 3.25Å; E861-F865 WeakPolarHBondContact O-CB 3.37Å; E861-F865 PolarHBondContact O-N 3.49Å
862	F	98	Very high	97.5	Very high	46 Å²	46	54.7 Å²	54.7	20%	0.202	27%	0.271	C	S	.	.	H	α-helix	trans	-58.9	-37.3	177.5	178.5	-97.1	0	0	0	112.2	W842 Y845 L854 L857 D858 R866	W842-F862 HydrophobicContact CH2-CE2 4.17Å; W842-F862 HydrophobicContact CH2-CZ 4.29Å; W842-F862 AromaticContact CZ3-CE2 3.87Å; W842-F862 HydrophobicContact CZ3-CE2 3.87Å; W842-F862 AromaticContact CZ3-CZ 3.71Å; W842-F862 HydrophobicContact CZ3-CZ 3.71Å; Y845-F862 AromaticContact CE1-CE2 3.84Å; Y845-F862 HydrophobicContact CE1-CE2 3.84Å; Y845-F862 HydrophobicContact CE1-CZ 4.12Å; L854-F862 HydrophobicContact CB-CD2 4.14Å; L854-F862 HydrophobicContact CB-CE2 4.46Å; L854-F862 HydrophobicContact CD1-CD2 4.08Å; L854-F862 HydrophobicContact CD1-CE2 4.1Å; L857-F862 HydrophobicContact CB-CB 4.31Å; D858-F862 WeakPolarHBondContact O-CB 3.34Å; D858-F862 PolarHBondContact O-N 3.11Å; F862-R866 VanDerWaalsContact O-CB 3.31Å; F862-R866 WeakPolarHBondContact O-CB 3.46Å; F862-R866 PolarHBondContact O-N 3Å
863	K	97.9	Very high	97.5	Very high	146 Å²	146	51.7 Å²	51.7	64%	0.635	26%	0.255	S	S	*	.	H	α-helix	trans	-70.4	-41.7	176.5	-174	-173.9	174.7	-165.8	0	112.1	H859 V860 E861 F867	H859-K863 VanDerWaalsContact O-CB 3.22Å; H859-K863 WeakPolarHBondContact O-CB 3.4Å; H859-K863 PolarHBondContact O-N 3.14Å; V860-K863 PolarHBondContact O-N 2.91Å; E861-K863 VanDerWaalsContact C-N 3.26Å; E861-K863 PolarHBondContact O-N 2.7Å; K863-F867 WeakPolarHBondContact O-CB 3.43Å; K863-F867 PolarHBondContact O-N 2.85Å
864	R	97.9	Very high	97.6	Very high	47 Å²	47	53.2 Å²	53.2	18%	0.177	26%	0.263	C	S	.	.	H	α-helix	trans	-64.3	-47.2	175.4	172.4	59.8	175.5	163.9	2.7	110.5	L792 E793 V860 E861 F867 L868 E905	L792-R864 HydrophobicContact CD2-CB 4.49Å; L792-R864 HydrophobicContact CD2-CG 4.15Å; E793-R864 IonicContact OE1-CZ 2.76Å; E793-R864 IonicContact OE1-NE 3.74Å; E793-R864 IonicContact OE1-NH2 2.83Å; E793-R864 PolarHBondContact OE1-NH2 3.18Å; V860-R864 WeakPolarHBondContact O-CB 3.44Å; V860-R864 PolarHBondContact O-N 3.43Å; E861-R864 PolarHBondContact O-N 2.97Å; E861-R864 VanDerWaalsContact O-N 3.16Å; R864-F867 WeakPolarHBondContact O-CB 3.4Å; R864-F867 PolarHBondContact O-N 3.15Å; R864-L868 HydrophobicContact CG-CD1 3.88Å; R864-L868 WeakPolarHBondContact O-CD1 3.31Å; R864-L868 VanDerWaalsContact O-CG 3.28Å; R864-L868 WeakPolarHBondContact O-CG 3.49Å; R864-L868 PolarHBondContact O-N 3.12Å; R864-E905 IonicContact CZ-OE2 3.49Å; R864-E905 IonicContact NH1-OE2 3.24Å; R864-E905 IonicContact NH2-OE2 2.69Å
865	F	98.7	Very high	97.6	Very high	1 Å²	1	53 Å²	53	0%	0.004	26%	0.262	C	S	.	.	H	α-helix	trans	-55.3	-51.4	173.8	177.4	-92	0	0	0	112	L792 M795 A796 V799 W842 L854 L857 E861 F867 L868 V869	L792-F865 HydrophobicContact CD1-CB 4.13Å; L792-F865 HydrophobicContact CD1-CD2 4.13Å; M795-F865 HydrophobicContact CB-CE2 4.32Å; M795-F865 HydrophobicContact CE-CD2 3.79Å; M795-F865 HydrophobicContact CE-CE2 3.7Å; M795-F865 HydrophobicContact CG-CE2 3.94Å; A796-F865 HydrophobicContact CB-CD2 3.83Å; A796-F865 HydrophobicContact CB-CE2 3.91Å; V799-F865 HydrophobicContact CB-CE2 4.49Å; V799-F865 HydrophobicContact CB-CZ 3.85Å; V799-F865 HydrophobicContact CG1-CE1 4.46Å; V799-F865 HydrophobicContact CG1-CZ 3.89Å; V799-F865 HydrophobicContact CG2-CE2 4.43Å; V799-F865 HydrophobicContact CG2-CZ 3.93Å; W842-F865 AromaticContact CH2-CD1 3.89Å; W842-F865 HydrophobicContact CH2-CD1 3.89Å; W842-F865 AromaticContact CH2-CE1 3.78Å; W842-F865 HydrophobicContact CH2-CE1 3.78Å; W842-F865 HydrophobicContact CZ2-CD1 4.14Å; W842-F865 AromaticContact CZ2-CE1 3.94Å; W842-F865 HydrophobicContact CZ2-CE1 3.94Å; L854-F865 HydrophobicContact CD1-CD1 3.57Å; L854-F865 HydrophobicContact CD1-CE1 3.34Å; L854-F865 HydrophobicContact CD1-CG 4.39Å; L854-F865 HydrophobicContact CD1-CZ 3.98Å; L857-F865 HydrophobicContact CD1-CB 4.39Å; E861-F865 VanDerWaalsContact O-CB 3.25Å; E861-F865 WeakPolarHBondContact O-CB 3.37Å; E861-F865 PolarHBondContact O-N 3.49Å; F865-F867 VanDerWaalsContact C-N 3.31Å; F865-F867 PolarHBondContact O-N 3.23Å; F865-L868 WeakPolarHBondContact O-CB 3.35Å; F865-L868 PolarHBondContact O-N 3.48Å; F865-V869 HydrophobicContact CD1-CG2 4.19Å; F865-V869 HydrophobicContact CE1-CG2 3.7Å; F865-V869 HydrophobicContact CE2-CG2 4.18Å; F865-V869 HydrophobicContact CZ-CG2 3.71Å; F865-V869 WeakPolarHBondContact O-CG2 3.41Å; F865-V869 PolarHBondContact O-N 3.5Å
866	R	98.8	Very high	97.7	Very high	93 Å²	93	50.6 Å²	50.6	35%	0.351	24%	0.241	S	C	.	.	H	α-helix	trans	-61.6	-37.7	178.5	176.2	165.4	179.9	-174.4	0.8	113	W842 F862 I870	W842-R866 HydrophobicContact CD2-CG 4.06Å; W842-R866 HydrophobicContact CE3-CG 4.43Å; W842-R866 HydrophobicContact CH2-CB 3.86Å; W842-R866 HydrophobicContact CH2-CG 4.11Å; W842-R866 HydrophobicContact CZ2-CB 3.71Å; W842-R866 HydrophobicContact CZ2-CG 3.72Å; W842-R866 HydrophobicContact CZ3-CB 4.49Å; W842-R866 HydrophobicContact CZ3-CG 4.45Å; F862-R866 VanDerWaalsContact O-CB 3.31Å; F862-R866 WeakPolarHBondContact O-CB 3.46Å; F862-R866 PolarHBondContact O-N 3Å; R866-I870 HydrophobicContact CG-CD1 3.91Å; R866-I870 WeakPolarHBondContact O-CD1 3.39Å; R866-I870 VanDerWaalsContact O-CG1 3.27Å; R866-I870 WeakPolarHBondContact O-CG1 3.4Å; R866-I870 PolarHBondContact O-N 2.95Å
867	F	98.8	Very high	97.8	Very high	90 Å²	90	46.8 Å²	46.8	40%	0.395	22%	0.221	S	C	.	.	H	α-helix	trans	-62.4	-51.1	173.2	167.1	-101.1	0	0	0	111.2	K863 R864 F865 V869 I870 E871 L909	K863-F867 WeakPolarHBondContact O-CB 3.43Å; K863-F867 PolarHBondContact O-N 2.85Å; R864-F867 WeakPolarHBondContact O-CB 3.4Å; R864-F867 PolarHBondContact O-N 3.15Å; F865-F867 VanDerWaalsContact C-N 3.31Å; F865-F867 PolarHBondContact O-N 3.23Å; F867-V869 PolarHBondContact O-N 3.43Å; F867-I870 PolarHBondContact O-N 3.43Å; F867-I870 VanDerWaalsContact O-N 3.11Å; F867-E871 HydrophobicContact CD1-CG 4.46Å; F867-E871 HydrophobicContact CD2-CG 3.93Å; F867-E871 HydrophobicContact CE1-CG 4.05Å; F867-E871 HydrophobicContact CE2-CG 3.46Å; F867-E871 VanDerWaalsContact CE2-CG 3.46Å; F867-E871 HydrophobicContact CG-CG 4.42Å; F867-E871 HydrophobicContact CZ-CG 3.54Å; F867-E871 WeakPolarHBondContact O-CG 3.14Å; F867-E871 PolarHBondContact O-N 2.97Å; F867-L909 HydrophobicContact CE1-CD2 4.1Å; F867-L909 HydrophobicContact CZ-CD2 4.26Å
868	L	98.8	Very high	97.8	Very high	7 Å²	7	49.2 Å²	49.2	4%	0.037	23%	0.234	C	C	.	.	H	α-helix	trans	-56.3	-45.8	178.6	-72	160.4	0	0	0	112.8	E793 A796 R864 F865 I870 E871 A872 L909	E793-L868 HydrophobicContact CB-CD1 4.42Å; E793-L868 HydrophobicContact CG-CD1 3.64Å; E793-L868 HydrophobicContact CG-CD2 4.08Å; A796-L868 HydrophobicContact CB-CB 3.43Å; A796-L868 VanDerWaalsContact CB-CB 3.43Å; A796-L868 HydrophobicContact CB-CD1 4.07Å; A796-L868 HydrophobicContact CB-CG 4.37Å; R864-L868 HydrophobicContact CG-CD1 3.88Å; R864-L868 WeakPolarHBondContact O-CD1 3.31Å; R864-L868 VanDerWaalsContact O-CG 3.28Å; R864-L868 WeakPolarHBondContact O-CG 3.49Å; R864-L868 PolarHBondContact O-N 3.12Å; F865-L868 WeakPolarHBondContact O-CB 3.35Å; F865-L868 PolarHBondContact O-N 3.48Å; L868-I870 VanDerWaalsContact C-N 3.32Å; L868-I870 PolarHBondContact O-N 3.18Å; L868-E871 PolarHBondContact O-N 3.35Å; L868-A872 WeakPolarHBondContact O-CB 3.26Å; L868-A872 PolarHBondContact O-N 3.33Å; L868-L909 HydrophobicContact CD2-CD1 4.11Å
869	V	98.9	Very high	97.8	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-59.4	-43.2	176.6	170.9	0	0	0	0	111.2	A796 V799 A800 M803 W842 F865 F867 I873	A796-V869 HydrophobicContact CB-CG2 3.94Å; V799-V869 HydrophobicContact CB-CG2 4.45Å; V799-V869 HydrophobicContact CG1-CG2 4.36Å; A800-V869 HydrophobicContact CB-CG1 4.33Å; M803-V869 HydrophobicContact SD-CG1 3.69Å; W842-V869 HydrophobicContact CZ2-CB 4.16Å; W842-V869 HydrophobicContact CZ2-CG1 4.2Å; W842-V869 HydrophobicContact CZ2-CG2 4.3Å; F865-V869 HydrophobicContact CD1-CG2 4.19Å; F865-V869 HydrophobicContact CE1-CG2 3.7Å; F865-V869 HydrophobicContact CE2-CG2 4.18Å; F865-V869 HydrophobicContact CZ-CG2 3.71Å; F865-V869 WeakPolarHBondContact O-CG2 3.41Å; F865-V869 PolarHBondContact O-N 3.5Å; F867-V869 PolarHBondContact O-N 3.43Å; V869-I873 HydrophobicContact CG1-CD1 3.75Å; V869-I873 WeakPolarHBondContact O-CD1 3.4Å; V869-I873 VanDerWaalsContact O-CG1 3.23Å; V869-I873 WeakPolarHBondContact O-CG1 3.41Å; V869-I873 PolarHBondContact O-N 3.25Å; V869-I873 VanDerWaalsContact O-N 3.12Å
870	I	98.9	Very high	97.7	Very high	46 Å²	46	47.7 Å²	47.7	24%	0.236	22%	0.222	C	C	.	.	H	α-helix	trans	-67.7	-44.7	179.5	-69.7	167.2	0	0	0	111.2	R866 F867 L868 A872 I873 L874	R866-I870 HydrophobicContact CG-CD1 3.91Å; R866-I870 WeakPolarHBondContact O-CD1 3.39Å; R866-I870 VanDerWaalsContact O-CG1 3.27Å; R866-I870 WeakPolarHBondContact O-CG1 3.4Å; R866-I870 PolarHBondContact O-N 2.95Å; F867-I870 PolarHBondContact O-N 3.43Å; F867-I870 VanDerWaalsContact O-N 3.11Å; L868-I870 VanDerWaalsContact C-N 3.32Å; L868-I870 PolarHBondContact O-N 3.18Å; I870-A872 VanDerWaalsContact C-N 3.32Å; I870-A872 PolarHBondContact O-N 3.19Å; I870-I873 PolarHBondContact O-N 2.92Å; I870-L874 HydrophobicContact CG2-CD1 3.69Å; I870-L874 HydrophobicContact CG2-CG 4.19Å; I870-L874 WeakPolarHBondContact O-CB 3.21Å; I870-L874 WeakPolarHBondContact O-CG 3.34Å; I870-L874 PolarHBondContact O-N 3.46Å
871	E	98.8	Very high	97.7	Very high	60 Å²	60	42.8 Å²	42.8	28%	0.28	19%	0.192	S	C	.	.	H	α-helix	trans	-66.4	-31.6	179.1	-68	-57.8	136.9	0	0	112.9	F867 L868 A875 L909 Q913	F867-E871 HydrophobicContact CD1-CG 4.46Å; F867-E871 HydrophobicContact CD2-CG 3.93Å; F867-E871 HydrophobicContact CE1-CG 4.05Å; F867-E871 HydrophobicContact CE2-CG 3.46Å; F867-E871 VanDerWaalsContact CE2-CG 3.46Å; F867-E871 HydrophobicContact CG-CG 4.42Å; F867-E871 HydrophobicContact CZ-CG 3.54Å; F867-E871 WeakPolarHBondContact O-CG 3.14Å; F867-E871 PolarHBondContact O-N 2.97Å; L868-E871 PolarHBondContact O-N 3.35Å; E871-A875 WeakPolarHBondContact O-CB 3.16Å; E871-A875 PolarHBondContact O-N 2.67Å; E871-L909 HydrophobicContact CB-CD1 3.98Å; E871-L909 HydrophobicContact CB-CD2 4.26Å; E871-L909 HydrophobicContact CG-CD2 4.31Å; E871-Q913 PolarHBondContact O-NE2 3.29Å
872	A	98.8	Very high	97.8	Very high	3 Å²	3	45.6 Å²	45.6	3%	0.025	20%	0.204	C	C	.	.	H	α-helix	trans	-70.1	-44.2	173.2	0	0	0	0	0	112.2	A800 L868 I870 A875 I916	A800-A872 HydrophobicContact CB-CB 3.58Å; L868-A872 WeakPolarHBondContact O-CB 3.26Å; L868-A872 PolarHBondContact O-N 3.33Å; I870-A872 VanDerWaalsContact C-N 3.32Å; I870-A872 PolarHBondContact O-N 3.19Å; A872-A875 WeakPolarHBondContact O-CB 3.4Å; A872-A875 PolarHBondContact O-N 3.11Å; A872-I916 HydrophobicContact CB-CG2 4.44Å
873	I	98.9	Very high	97.7	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-68.1	-44.9	177.9	-60.9	162.7	0	0	0	110.9	A800 M803 H804 E834 H837 A838 V869 I870 A875 T876	A800-I873 HydrophobicContact CB-CG1 3.97Å; M803-I873 HydrophobicContact CG-CD1 3.54Å; M803-I873 HydrophobicContact CG-CG1 4.43Å; M803-I873 HydrophobicContact SD-CD1 3.81Å; H804-I873 HydrophobicContact CB-CG1 4.29Å; H804-I873 HydrophobicContact CB-CG2 4.41Å; E834-I873 HydrophobicContact CB-CG2 4.5Å; H837-I873 HydrophobicContact CB-CG2 4.39Å; A838-I873 HydrophobicContact CB-CB 4.3Å; A838-I873 HydrophobicContact CB-CD1 3.84Å; A838-I873 HydrophobicContact CB-CG2 4.07Å; V869-I873 HydrophobicContact CG1-CD1 3.75Å; V869-I873 WeakPolarHBondContact O-CD1 3.4Å; V869-I873 VanDerWaalsContact O-CG1 3.23Å; V869-I873 WeakPolarHBondContact O-CG1 3.41Å; V869-I873 PolarHBondContact O-N 3.25Å; V869-I873 VanDerWaalsContact O-N 3.12Å; I870-I873 PolarHBondContact O-N 2.92Å; I873-A875 PolarHBondContact O-N 3.32Å; I873-A875 VanDerWaalsContact O-N 3.07Å; I873-T876 PolarHBondContact O-N 3.02Å; I873-T876 VanDerWaalsContact O-N 3.08Å; I873-T876 PolarHBondContact O-OG1 2.65Å
874	L	98.8	Very high	97.7	Very high	34 Å²	34	41.8 Å²	41.8	18%	0.178	19%	0.192	C	C	.	.	H	α-helix	trans	-68.9	-4	176.5	-65.5	-179.3	0	0	0	113.5	E834 N835 I870	E834-L874 HydrophobicContact CB-CD2 3.94Å; N835-L874 HydrophobicContact CB-CD2 4.5Å; I870-L874 HydrophobicContact CG2-CD1 3.69Å; I870-L874 HydrophobicContact CG2-CG 4.19Å; I870-L874 WeakPolarHBondContact O-CB 3.21Å; I870-L874 WeakPolarHBondContact O-CG 3.34Å; I870-L874 PolarHBondContact O-N 3.46Å
875	A	98.6	Very high	97.6	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-84.5	-23.4	169.7	0	0	0	0	0	113.6	E871 A872 I873 D877 F884 Q913 K917	E871-A875 WeakPolarHBondContact O-CB 3.16Å; E871-A875 PolarHBondContact O-N 2.67Å; A872-A875 WeakPolarHBondContact O-CB 3.4Å; A872-A875 PolarHBondContact O-N 3.11Å; I873-A875 PolarHBondContact O-N 3.32Å; I873-A875 VanDerWaalsContact O-N 3.07Å; A875-D877 VanDerWaalsContact C-N 3.33Å; A875-D877 PolarHBondContact O-N 3.43Å; A875-F884 HydrophobicContact CB-CE1 4.21Å; A875-F884 HydrophobicContact CB-CE2 3.84Å; A875-F884 HydrophobicContact CB-CZ 3.58Å; A875-Q913 HydrophobicContact CB-CB 3.78Å; A875-Q913 HydrophobicContact CB-CG 3.72Å; A875-K917 HydrophobicContact CB-CD 4.47Å; A875-K917 HydrophobicContact CB-CG 4.43Å; A875-K917 WeakPolarHBondContact O-CD 3.46Å; A875-K917 WeakPolarHBondContact O-CE 3.37Å; A875-K917 WeakPolarHBondContact O-CG 3.46Å; A875-K917 PolarHBondContact O-NZ 3Å
876	T	98.7	Very high	97.4	Very high	8 Å²	8	43.1 Å²	43.1	5%	0.049	21%	0.211	C	C	.	.	H	α-helix	trans	-63.1	-38.5	-176.9	60.9	0	0	0	0	111.8	H804 I873 L878 I916 K917	H804-T876 HydrophobicContact CB-CG2 4.32Å; I873-T876 PolarHBondContact O-N 3.02Å; I873-T876 VanDerWaalsContact O-N 3.08Å; I873-T876 PolarHBondContact O-OG1 2.65Å; T876-L878 PolarHBondContact O-N 3.24Å; T876-I916 HydrophobicContact CG2-CD1 4.46Å; T876-I916 HydrophobicContact CG2-CG1 4.4Å; T876-K917 PolarHBondContact O-NZ 3.49Å
877	D	98.5	Very high	97.3	Very high	5 Å²	5	44.2 Å²	44.2	3%	0.027	22%	0.22	C	C	.	.			trans	-37.4	106.6	179.3	-175.1	-1.2	0	0	0	112.4	S831 E834 A875 K879 K880	S831-D877 VanDerWaalsContact CB-OD2 3.29Å; S831-D877 WeakPolarHBondContact CB-OD2 3.39Å; S831-D877 PolarHBondContact OG-OD2 2.94Å; E834-D877 HydrophobicContact CG-CB 3.9Å; E834-D877 WeakPolarHBondContact OE1-CA 3.47Å; E834-D877 WeakPolarHBondContact OE1-CB 3.39Å; A875-D877 VanDerWaalsContact C-N 3.33Å; A875-D877 PolarHBondContact O-N 3.43Å; D877-K879 PolarHBondContact O-N 3.46Å; D877-K879 VanDerWaalsContact O-N 3.15Å; D877-K879 WeakPolarHBondContact OD1-CB 3.24Å; D877-K879 PolarHBondContact OD1-N 3.31Å; D877-K880 PolarHBondContact O-N 3.35Å
878	L	94.8	Very high	97.1	Very high	71 Å²	71	40 Å²	40	37%	0.372	20%	0.202	S	C	.	.	G	3₁₀ helix	trans	-65.3	-17.8	-177	-64.4	179	0	0	0	112.5	T876 K880 H881 I921 I978	T876-L878 PolarHBondContact O-N 3.24Å; L878-K880 PolarHBondContact O-N 3.25Å; L878-H881 WeakPolarHBondContact O-CB 3.31Å; L878-H881 PolarHBondContact O-N 3.02Å; L878-H881 VanDerWaalsContact O-N 3.12Å; L878-I921 HydrophobicContact CD2-CG2 4.19Å; L878-I978 HydrophobicContact CD2-CG2 4.46Å
879	K	94.3	Very high	96.9	Very high	119 Å²	119	41.6 Å²	41.6	52%	0.517	21%	0.21	S	C	.	.	G	3₁₀ helix	trans	-61.7	-28.5	171.1	-171.2	179.3	176.5	177.8	0	112.6	D877	D877-K879 PolarHBondContact O-N 3.46Å; D877-K879 VanDerWaalsContact O-N 3.15Å; D877-K879 WeakPolarHBondContact OD1-CB 3.24Å; D877-K879 PolarHBondContact OD1-N 3.31Å
880	K	93.9	Very high	96.5	Very high	73 Å²	73	44.5 Å²	44.5	32%	0.317	23%	0.234	S	C	.	.	G	3₁₀ helix	trans	-96.3	4.9	176.8	-61.7	-173.6	71.2	-136.3	0	113.4	D877 L878 F882 D883 F884	D877-K880 PolarHBondContact O-N 3.35Å; L878-K880 PolarHBondContact O-N 3.25Å; K880-F882 PolarHBondContact O-N 3.48Å; K880-D883 WeakPolarHBondContact O-CB 3.4Å; K880-D883 PolarHBondContact O-N 3.01Å; K880-D883 VanDerWaalsContact O-N 3.14Å; K880-F884 HydrophobicContact CB-CD2 3.97Å; K880-F884 HydrophobicContact CB-CE2 3.86Å; K880-F884 HydrophobicContact CD-CE2 4.25Å; K880-F884 WeakPolarHBondContact O-CD2 3.32Å; K880-F884 PolarHBondContact O-N 2.97Å
881	H	95.9	Very high	96	Very high	1 Å²	1	45.2 Å²	45.2	1%	0.005	24%	0.236	C	C	.	.	H	α-helix	trans	-54.5	-50	-171.8	177.4	101.9	0	0	0	112.5	L878 D883 F884 L885 I978	L878-H881 WeakPolarHBondContact O-CB 3.31Å; L878-H881 PolarHBondContact O-N 3.02Å; L878-H881 VanDerWaalsContact O-N 3.12Å; H881-D883 VanDerWaalsContact C-N 3.34Å; H881-D883 PolarHBondContact O-N 3.28Å; H881-F884 PolarHBondContact O-N 3.2Å; H881-L885 WeakPolarHBondContact O-CB 3.43Å; H881-L885 PolarHBondContact O-N 2.8Å; H881-I978 WeakPolarHBondContact CE1-CG2 3.48Å; H881-I978 PolarHBondContact CE1-O 2.63Å; H881-I978 VanDerWaalsContact CE1-O 3.3Å; H881-I978 PolarHBondContact NE2-O 3.2Å
882	F	96.4	Very high	95.4	Very high	108 Å²	108	43.7 Å²	43.7	47%	0.474	23%	0.231	S	C	.	.	H	α-helix	trans	-70.6	-26.6	-178.8	-60.1	-67.9	0	0	0	113.6	K880 A886 I978	K880-F882 PolarHBondContact O-N 3.48Å; F882-A886 VanDerWaalsContact O-CB 3.27Å; F882-A886 WeakPolarHBondContact O-CB 3.12Å; F882-A886 PolarHBondContact O-N 2.95Å; F882-I978 HydrophobicContact CE2-CD1 4.34Å; F882-I978 HydrophobicContact CZ-CD1 3.87Å
883	D	97	Very high	94.3	Very high	101 Å²	101	47.4 Å²	47.4	54%	0.54	25%	0.25	S	S	.	.	H	α-helix	trans	-63.9	-53	175.1	-56.8	-34.5	0	0	0	110	K880 H881 L885 A886 E887	K880-D883 WeakPolarHBondContact O-CB 3.4Å; K880-D883 PolarHBondContact O-N 3.01Å; K880-D883 VanDerWaalsContact O-N 3.14Å; H881-D883 VanDerWaalsContact C-N 3.34Å; H881-D883 PolarHBondContact O-N 3.28Å; D883-L885 VanDerWaalsContact C-N 3.34Å; D883-L885 PolarHBondContact O-N 2.83Å; D883-A886 PolarHBondContact O-N 3.35Å; D883-E887 PolarHBondContact O-N 2.8Å
884	F	97.1	Very high	93.2	Very high	11 Å²	11	51.1 Å²	51.1	5%	0.048	27%	0.27	C	S	.	.	H	α-helix	trans	-63	-39.7	177.1	-74.4	-69.5	0	0	0	112.2	A875 K880 H881 E887 F888 L910 Q913 K917	A875-F884 HydrophobicContact CB-CE1 4.21Å; A875-F884 HydrophobicContact CB-CE2 3.84Å; A875-F884 HydrophobicContact CB-CZ 3.58Å; K880-F884 HydrophobicContact CB-CD2 3.97Å; K880-F884 HydrophobicContact CB-CE2 3.86Å; K880-F884 HydrophobicContact CD-CE2 4.25Å; K880-F884 WeakPolarHBondContact O-CD2 3.32Å; K880-F884 PolarHBondContact O-N 2.97Å; H881-F884 PolarHBondContact O-N 3.2Å; F884-E887 PolarHBondContact O-N 3.33Å; F884-F888 VanDerWaalsContact O-CB 3.3Å; F884-F888 WeakPolarHBondContact O-CB 3.16Å; F884-F888 PolarHBondContact O-N 3.43Å; F884-L910 HydrophobicContact CD1-CD1 4.18Å; F884-Q913 HydrophobicContact CE1-CB 4.34Å; F884-Q913 HydrophobicContact CE1-CG 4.48Å; F884-K917 HydrophobicContact CB-CD 4.37Å; F884-K917 HydrophobicContact CD2-CD 4.05Å; F884-K917 HydrophobicContact CG-CD 4.37Å
885	L	96.1	Very high	91.9	Very high	14 Å²	14	56.3 Å²	56.3	7%	0.073	30%	0.303	C	S	.	.	H	α-helix	trans	-66.6	-37.4	179.5	-168.1	63.5	0	0	0	111.7	H881 D883 N889 P981 L982 S985	H881-L885 WeakPolarHBondContact O-CB 3.43Å; H881-L885 PolarHBondContact O-N 2.8Å; D883-L885 VanDerWaalsContact C-N 3.34Å; D883-L885 PolarHBondContact O-N 2.83Å; L885-N889 VanDerWaalsContact O-CB 3.27Å; L885-N889 WeakPolarHBondContact O-CB 3.48Å; L885-N889 PolarHBondContact O-N 3.21Å; L885-N889 PolarHBondContact O-ND2 2.87Å; L885-P981 HydrophobicContact CD2-CB 3.74Å; L885-L982 HydrophobicContact CD1-CD1 4.01Å; L885-S985 WeakPolarHBondContact CD1-OG 3.41Å
886	A	95.2	Very high	90.8	Very high	62 Å²	62	63.2 Å²	63.2	51%	0.512	34%	0.34	S	S	.	.	H	α-helix	trans	-69.7	-42.5	174.3	0	0	0	0	0	112.1	F882 D883 N889 A890	F882-A886 VanDerWaalsContact O-CB 3.27Å; F882-A886 WeakPolarHBondContact O-CB 3.12Å; F882-A886 PolarHBondContact O-N 2.95Å; D883-A886 PolarHBondContact O-N 3.35Å; A886-N889 PolarHBondContact O-N 3.49Å; A886-A890 WeakPolarHBondContact O-CB 3.47Å; A886-A890 PolarHBondContact O-N 3.34Å
887	E	95.2	Very high	89.8	Confident	115 Å²	115	64.3 Å²	64.3	54%	0.537	35%	0.348	S	S	.	.	H	α-helix	trans	-62.7	-42.2	177.2	-169.7	173.8	179.6	0	0	111.9	D883 F884 A890 K891 L910	D883-E887 PolarHBondContact O-N 2.8Å; F884-E887 PolarHBondContact O-N 3.33Å; E887-A890 PolarHBondContact O-N 3.21Å; E887-K891 PolarHBondContact O-N 3.05Å; E887-L910 HydrophobicContact CB-CD1 4.45Å; E887-L910 HydrophobicContact CG-CD1 4.33Å; E887-L910 HydrophobicContact CG-CD2 3.95Å
888	F	95.9	Very high	88.5	Confident	1 Å²	1	70.5 Å²	70.5	0%	0.004	39%	0.388	C	S	.	.	H	α-helix	trans	-67.4	-45.4	175.9	-174.6	-108.8	0	0	0	112.4	F884 A890 K891 V892 I900 L910 V911 V914 S985 Y986 A989 L991	F884-F888 VanDerWaalsContact O-CB 3.3Å; F884-F888 WeakPolarHBondContact O-CB 3.16Å; F884-F888 PolarHBondContact O-N 3.43Å; F888-A890 VanDerWaalsContact C-N 3.27Å; F888-A890 PolarHBondContact O-N 3.32Å; F888-K891 PolarHBondContact O-N 3.35Å; F888-V892 HydrophobicContact CD1-CG2 4.33Å; F888-V892 HydrophobicContact CD2-CG2 4.38Å; F888-V892 HydrophobicContact CE1-CG2 3.98Å; F888-V892 HydrophobicContact CE2-CG2 4.03Å; F888-V892 HydrophobicContact CZ-CG2 3.82Å; F888-V892 PolarHBondContact O-N 3.05Å; F888-I900 HydrophobicContact CE2-CD1 4.24Å; F888-L910 HydrophobicContact CB-CD2 4.36Å; F888-L910 HydrophobicContact CB-CG 4.45Å; F888-L910 HydrophobicContact CD2-CD2 4.38Å; F888-L910 HydrophobicContact CD2-CG 4.22Å; F888-V911 HydrophobicContact CE2-CG2 4.25Å; F888-V914 HydrophobicContact CB-CG2 3.93Å; F888-V914 HydrophobicContact CD1-CG1 4.29Å; F888-V914 HydrophobicContact CD1-CG2 4.42Å; F888-V914 HydrophobicContact CD2-CB 4.43Å; F888-V914 HydrophobicContact CD2-CG2 3.87Å; F888-V914 HydrophobicContact CE1-CG1 4.27Å; F888-V914 HydrophobicContact CE2-CG2 4.48Å; F888-V914 HydrophobicContact CG-CG1 4.45Å; F888-V914 HydrophobicContact CG-CG2 3.83Å; F888-V914 HydrophobicContact CZ-CG1 4.42Å; F888-S985 WeakPolarHBondContact CE1-O 3.28Å; F888-Y986 HydrophobicContact CE1-CD2 4.37Å; F888-Y986 HydrophobicContact CZ-CD2 4.07Å; F888-A989 HydrophobicContact CE1-CB 3.88Å; F888-A989 HydrophobicContact CZ-CB 3.56Å; F888-L991 HydrophobicContact CE2-CD1 4.25Å; F888-L991 HydrophobicContact CZ-CD1 3.86Å
889	N	93.6	Very high	88.1	Confident	41 Å²	41	68.2 Å²	68.2	22%	0.219	38%	0.382	C	S	.	.	H	α-helix	trans	-62.3	-33.2	176.2	-83.3	-54.4	0	0	0	112.8	L885 A886 K891 V892 N893 S985	L885-N889 VanDerWaalsContact O-CB 3.27Å; L885-N889 WeakPolarHBondContact O-CB 3.48Å; L885-N889 PolarHBondContact O-N 3.21Å; L885-N889 PolarHBondContact O-ND2 2.87Å; A886-N889 PolarHBondContact O-N 3.49Å; N889-K891 PolarHBondContact O-N 2.04Å; N889-V892 PolarHBondContact O-N 2.76Å; N889-N893 PolarHBondContact O-N 3.3Å; N889-N893 PolarHBondContact OD1-ND2 3.19Å; N889-S985 PolarHBondContact ND2-OG 3.09Å; N889-S985 PolarHBondContact OD1-OG 3.11Å
890	A	91.7	Very high	87.9	Confident	61 Å²	61	63.9 Å²	63.9	50%	0.504	36%	0.364	S	S	.	.	H	α-helix	trans	-66.5	-19.6	173.4	0	0	0	0	0	113.8	A886 E887 F888	A886-A890 WeakPolarHBondContact O-CB 3.47Å; A886-A890 PolarHBondContact O-N 3.34Å; E887-A890 PolarHBondContact O-N 3.21Å; F888-A890 VanDerWaalsContact C-N 3.27Å; F888-A890 PolarHBondContact O-N 3.32Å
891	K	88.1	Confident	87.7	Confident	61 Å²	61	63.8 Å²	63.8	27%	0.265	37%	0.367	S	S	.	.	H	α-helix	trans	-88.1	-38	170.5	-65.2	-46.1	-153.9	94.3	0	113.4	E887 F888 N889 S897 G899 D907 L910	E887-K891 PolarHBondContact O-N 3.05Å; F888-K891 PolarHBondContact O-N 3.35Å; N889-K891 PolarHBondContact O-N 2.04Å; K891-S897 VanDerWaalsContact O-CB 3.32Å; K891-S897 WeakPolarHBondContact O-CB 3.43Å; K891-S897 PolarHBondContact O-OG 2.86Å; K891-G899 WeakPolarHBondContact O-CA 3.45Å; K891-D907 IonicContact NZ-OD1 2.76Å; K891-D907 PolarHBondContact NZ-OD1 3.45Å; K891-D907 IonicContact NZ-OD2 2.73Å; K891-D907 PolarHBondContact NZ-OD2 3.14Å; K891-L910 HydrophobicContact CG-CD2 4.3Å
892	V	85.1	Confident	87.5	Confident	29 Å²	29	65 Å²	65	18%	0.176	37%	0.371	C	S	.	.	H	α-helix	trans	-92.7	-47.5	-168.7	171.4	0	0	0	0	113	F888 N889 I900 A989	F888-V892 HydrophobicContact CD1-CG2 4.33Å; F888-V892 HydrophobicContact CD2-CG2 4.38Å; F888-V892 HydrophobicContact CE1-CG2 3.98Å; F888-V892 HydrophobicContact CE2-CG2 4.03Å; F888-V892 HydrophobicContact CZ-CG2 3.82Å; F888-V892 PolarHBondContact O-N 3.05Å; N889-V892 PolarHBondContact O-N 2.76Å; V892-I900 HydrophobicContact CG2-CD1 4.14Å; V892-I900 HydrophobicContact CG2-CG1 4.21Å; V892-A989 HydrophobicContact CB-CB 4.32Å; V892-A989 VanDerWaalsContact CG1-CA 3.44Å; V892-A989 HydrophobicContact CG1-CB 3.65Å; V892-A989 HydrophobicContact CG2-CB 3.7Å
893	N	76	Confident	87.2	Confident	81 Å²	81	64.8 Å²	64.8	43%	0.433	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.2	-2.5	-162.6	-77.9	-43.2	0	0	0	114.3	N889 V895	N889-N893 PolarHBondContact O-N 3.3Å; N889-N893 PolarHBondContact OD1-ND2 3.19Å; N893-V895 PolarHBondContact O-N 2.87Å
894	D	76.6	Confident	87.1	Confident	77 Å²	77	62.2 Å²	62.2	41%	0.412	37%	0.366	S	S	.	.			trans	-77	118.9	164.8	-177.9	0.2	0	0	0	109.9	N896 S897	D894-N896 PolarHBondContact O-N 3.08Å; D894-N896 WeakPolarHBondContact OD1-CB 3.44Å; D894-N896 PolarHBondContact OD1-N 3.03Å; D894-N896 PolarHBondContact OD1-ND2 2.69Å; D894-S897 VanDerWaalsContact O-CB 3.23Å; D894-S897 WeakPolarHBondContact O-CB 3.22Å; D894-S897 PolarHBondContact O-N 3.02Å
895	V	70.8	Confident	86.9	Confident	144 Å²	144	66.7 Å²	66.7	87%	0.873	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-18.4	176.7	-175.4	0	0	0	0	112.8	N893	N893-V895 PolarHBondContact O-N 2.87Å
896	N	75.2	Confident	86.9	Confident	145 Å²	145	71.5 Å²	71.5	78%	0.775	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.4	-7.8	177	-52.6	-87.9	0	0	0	113.5	D894	D894-N896 PolarHBondContact O-N 3.08Å; D894-N896 WeakPolarHBondContact OD1-CB 3.44Å; D894-N896 PolarHBondContact OD1-N 3.03Å; D894-N896 PolarHBondContact OD1-ND2 2.69Å
897	S	77.5	Confident	87	Confident	31 Å²	31	69 Å²	69	22%	0.217	39%	0.39	C	S	.	.	S	Bend	trans	-78.8	144.3	177.2	-177.9	0	0	0	0	111.2	K891 D894 G899	K891-S897 VanDerWaalsContact O-CB 3.32Å; K891-S897 WeakPolarHBondContact O-CB 3.43Å; K891-S897 PolarHBondContact O-OG 2.86Å; D894-S897 VanDerWaalsContact O-CB 3.23Å; D894-S897 WeakPolarHBondContact O-CB 3.22Å; D894-S897 PolarHBondContact O-N 3.02Å; S897-G899 PolarHBondContact O-N 2.71Å; S897-G899 PolarHBondContact OG-N 3.38Å
898	P	72.5	Confident	87.1	Confident	134 Å²	134	64.3 Å²	64.3	87%	0.87	37%	0.368	S	S	*	.			trans	-74.8	3.9	170	34	-37.5	0	0	0	113.7
899	G	85.2	Confident	87.2	Confident	24 Å²	24	65 Å²	65	25%	0.247	37%	0.371	C	S	.	.			trans	84.3	-154.8	-172.2	0	0	0	0	0	112.9	K891 S897	K891-G899 WeakPolarHBondContact O-CA 3.45Å; S897-G899 PolarHBondContact O-N 2.71Å; S897-G899 PolarHBondContact OG-N 3.38Å
900	I	90.4	Very high	87.4	Confident	28 Å²	28	63.5 Å²	63.5	14%	0.144	36%	0.363	C	S	.	.			trans	-82.3	118.3	179.9	-62.7	164.6	0	0	0	109.6	F888 V892 W902 D907 V911 L991	F888-I900 HydrophobicContact CE2-CD1 4.24Å; V892-I900 HydrophobicContact CG2-CD1 4.14Å; V892-I900 HydrophobicContact CG2-CG1 4.21Å; I900-W902 HydrophobicContact CB-CZ2 4.22Å; I900-W902 HydrophobicContact CD1-CZ2 4.14Å; I900-W902 HydrophobicContact CG2-CD2 3.91Å; I900-W902 HydrophobicContact CG2-CE3 4.38Å; I900-W902 HydrophobicContact CG2-CG 4.33Å; I900-W902 HydrophobicContact CG2-CH2 4.22Å; I900-W902 HydrophobicContact CG2-CZ2 3.75Å; I900-W902 VanDerWaalsContact O-CD1 3.3Å; I900-W902 PolarHBondContact O-N 3.34Å; I900-D907 HydrophobicContact CG2-CB 4.29Å; I900-V911 HydrophobicContact CD1-CG2 3.87Å; I900-V911 HydrophobicContact CG1-CG2 4.47Å; I900-V911 HydrophobicContact CG2-CG2 4.02Å; I900-L991 HydrophobicContact CD1-CD1 3.9Å; I900-L991 HydrophobicContact CD1-CD2 4.28Å; I900-L991 HydrophobicContact CD1-CG 4.48Å
901	D	90.8	Very high	87.7	Confident	70 Å²	70	60.7 Å²	60.7	37%	0.374	34%	0.34	S	S	.	.			trans	-86.2	95.8	172.2	176.7	5.5	0	0	0	110.3	T903 N904 D907	D901-T903 PolarHBondContact O-N 2.85Å; D901-T903 VanDerWaalsContact O-N 3.11Å; D901-T903 WeakPolarHBondContact OD1-CA 3.33Å; D901-T903 WeakPolarHBondContact OD1-CB 3.45Å; D901-T903 PolarHBondContact OD1-N 2.73Å; D901-T903 PolarHBondContact OD1-OG1 3.4Å; D901-T903 PolarHBondContact OD2-OG1 2.96Å; D901-N904 HydrophobicContact CB-CB 4.07Å; D901-N904 WeakPolarHBondContact O-CB 3.4Å; D901-N904 PolarHBondContact O-N 2.89Å; D901-D907 PolarHBondContact N-OD2 2.82Å; D901-D907 VanDerWaalsContact N-OD2 3.13Å; D901-D907 WeakPolarHBondContact O-CB 3.35Å
902	W	91.8	Very high	88.2	Confident	26 Å²	26	58 Å²	58	10%	0.098	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-13.1	179	-56.4	88.5	0	0	0	114	F743 I746 L785 N788 I789 I900 R908 V911 L991	F743-W902 HydrophobicContact CE2-CH2 4.09Å; F743-W902 AromaticContact CE2-CZ2 3.6Å; F743-W902 HydrophobicContact CE2-CZ2 3.6Å; F743-W902 AromaticContact CZ-CH2 3.91Å; F743-W902 HydrophobicContact CZ-CH2 3.91Å; F743-W902 AromaticContact CZ-CZ2 3.65Å; F743-W902 HydrophobicContact CZ-CZ2 3.65Å; I746-W902 HydrophobicContact CD1-CB 4.05Å; I746-W902 VanDerWaalsContact CD1-CD1 3.48Å; I746-W902 HydrophobicContact CD1-CG 4.04Å; L785-W902 HydrophobicContact CD2-CH2 3.95Å; N788-W902 HydrophobicContact CB-CB 4.26Å; N788-W902 HydrophobicContact CB-CD2 3.76Å; N788-W902 HydrophobicContact CB-CE3 3.63Å; N788-W902 HydrophobicContact CB-CG 4.02Å; N788-W902 HydrophobicContact CB-CZ3 4.34Å; I789-W902 HydrophobicContact CD1-CZ3 4.15Å; I789-W902 HydrophobicContact CG1-CE3 4.21Å; I789-W902 HydrophobicContact CG1-CZ3 3.86Å; I900-W902 HydrophobicContact CB-CZ2 4.22Å; I900-W902 HydrophobicContact CD1-CZ2 4.14Å; I900-W902 HydrophobicContact CG2-CD2 3.91Å; I900-W902 HydrophobicContact CG2-CE3 4.38Å; I900-W902 HydrophobicContact CG2-CG 4.33Å; I900-W902 HydrophobicContact CG2-CH2 4.22Å; I900-W902 HydrophobicContact CG2-CZ2 3.75Å; I900-W902 VanDerWaalsContact O-CD1 3.3Å; I900-W902 PolarHBondContact O-N 3.34Å; W902-R908 HydrophobicContact CE3-CG 4.25Å; W902-R908 VanDerWaalsContact O-CD 3.23Å; W902-R908 WeakPolarHBondContact O-CD 3.44Å; W902-R908 WeakPolarHBondContact O-CG 3.37Å; W902-R908 PolarHBondContact O-NH1 3.19Å; W902-V911 HydrophobicContact CH2-CB 4.5Å; W902-V911 HydrophobicContact CH2-CG1 3.97Å; W902-V911 HydrophobicContact CH2-CG2 4.01Å; W902-V911 HydrophobicContact CZ3-CB 4.47Å; W902-V911 HydrophobicContact CZ3-CG1 4.08Å; W902-V911 HydrophobicContact CZ3-CG2 4.27Å; W902-L991 HydrophobicContact CH2-CD2 4.01Å; W902-L991 HydrophobicContact CZ2-CD2 3.87Å
903	T	90.5	Very high	88.9	Confident	104 Å²	104	57.2 Å²	57.2	64%	0.638	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.5	-27.7	171.7	76.6	0	0	0	0	111.8	D901 R908	D901-T903 PolarHBondContact O-N 2.85Å; D901-T903 VanDerWaalsContact O-N 3.11Å; D901-T903 WeakPolarHBondContact OD1-CA 3.33Å; D901-T903 WeakPolarHBondContact OD1-CB 3.45Å; D901-T903 PolarHBondContact OD1-N 2.73Å; D901-T903 PolarHBondContact OD1-OG1 3.4Å; D901-T903 PolarHBondContact OD2-OG1 2.96Å; T903-R908 PolarHBondContact O-NH1 3.16Å
904	N	93.1	Very high	89.9	Confident	48 Å²	48	53.4 Å²	53.4	26%	0.257	30%	0.303	S	S	.	.	S	Bend	trans	-81.3	123.1	-178.4	175.7	1.2	0	0	0	111.9	D901 N906 D907 R908	D901-N904 HydrophobicContact CB-CB 4.07Å; D901-N904 WeakPolarHBondContact O-CB 3.4Å; D901-N904 PolarHBondContact O-N 2.89Å; N904-N906 PolarHBondContact O-N 3.44Å; N904-N906 PolarHBondContact OD1-N 3.11Å; N904-N906 PolarHBondContact OD1-ND2 3.49Å; N904-D907 HydrophobicContact CB-CB 4.23Å; N904-D907 PolarHBondContact ND2-OD1 3.29Å; N904-D907 PolarHBondContact O-N 3.25Å; N904-R908 PolarHBondContact O-N 3.39Å
905	E	94.8	Very high	91	Very high	105 Å²	105	49.8 Å²	49.8	49%	0.491	28%	0.284	S	S	.	.	H	α-helix	trans	-62.1	-27.6	-178.3	-56.5	-166.8	172.9	0	0	114.3	R864 L909	R864-E905 IonicContact CZ-OE2 3.49Å; R864-E905 IonicContact NH1-OE2 3.24Å; R864-E905 IonicContact NH2-OE2 2.69Å; E905-L909 VanDerWaalsContact O-CB 3.3Å; E905-L909 WeakPolarHBondContact O-CB 3.3Å; E905-L909 PolarHBondContact O-N 2.83Å; E905-L909 VanDerWaalsContact O-N 3.08Å
906	N	96.1	Very high	92.3	Very high	114 Å²	114	43 Å²	43	61%	0.61	24%	0.242	S	C	*	.	H	α-helix	trans	-77.6	-39.1	-178.8	-52	-79.1	0	0	0	110.9	N904 L909 L910	N904-N906 PolarHBondContact O-N 3.44Å; N904-N906 PolarHBondContact OD1-N 3.11Å; N904-N906 PolarHBondContact OD1-ND2 3.49Å; N906-L909 PolarHBondContact O-N 3.45Å; N906-L910 WeakPolarHBondContact O-CB 3.34Å; N906-L910 PolarHBondContact O-N 3.03Å
907	D	95.9	Very high	93.4	Very high	9 Å²	9	36.2 Å²	36.2	5%	0.048	21%	0.206	C	C	.	.	H	α-helix	trans	-66.2	-44	177.3	-76.7	41.7	0	0	0	110.7	K891 I900 D901 N904 L910 V911	K891-D907 IonicContact NZ-OD1 2.76Å; K891-D907 PolarHBondContact NZ-OD1 3.45Å; K891-D907 IonicContact NZ-OD2 2.73Å; K891-D907 PolarHBondContact NZ-OD2 3.14Å; I900-D907 HydrophobicContact CG2-CB 4.29Å; D901-D907 PolarHBondContact N-OD2 2.82Å; D901-D907 VanDerWaalsContact N-OD2 3.13Å; D901-D907 WeakPolarHBondContact O-CB 3.35Å; N904-D907 HydrophobicContact CB-CB 4.23Å; N904-D907 PolarHBondContact ND2-OD1 3.29Å; N904-D907 PolarHBondContact O-N 3.25Å; D907-L910 PolarHBondContact O-N 2.88Å; D907-V911 WeakPolarHBondContact O-CG2 3.17Å; D907-V911 PolarHBondContact O-N 2.95Å
908	R	97	Very high	94.5	Very high	17 Å²	17	34.8 Å²	34.8	6%	0.064	20%	0.196	C	C	.	.	H	α-helix	trans	-63.3	-39.8	172.3	-65.1	-161.5	-52.7	-80.4	-4.8	112.8	N788 E793 W902 T903 N904 V911 C912	N788-R908 WeakPolarHBondContact O-CD 3.41Å; E793-R908 IonicContact OE1-CZ 2.84Å; E793-R908 IonicContact OE1-NE 3.62Å; E793-R908 IonicContact OE1-NH2 2.73Å; E793-R908 PolarHBondContact OE1-NH2 3.45Å; E793-R908 IonicContact OE2-CZ 3.59Å; E793-R908 IonicContact OE2-NE 3.73Å; E793-R908 PolarHBondContact OE2-NE 2.97Å; E793-R908 IonicContact OE2-NH2 2.83Å; E793-R908 PolarHBondContact OE2-NH2 2.56Å; W902-R908 HydrophobicContact CE3-CG 4.25Å; W902-R908 VanDerWaalsContact O-CD 3.23Å; W902-R908 WeakPolarHBondContact O-CD 3.44Å; W902-R908 WeakPolarHBondContact O-CG 3.37Å; W902-R908 PolarHBondContact O-NH1 3.19Å; T903-R908 PolarHBondContact O-NH1 3.16Å; N904-R908 PolarHBondContact O-N 3.39Å; R908-V911 PolarHBondContact O-N 3.02Å; R908-C912 PolarHBondContact O-N 3.33Å; R908-C912 PolarHBondContact O-SG 3.3Å
909	L	98.1	Very high	95.7	Very high	16 Å²	16	28.4 Å²	28.4	8%	0.084	15%	0.154	C	C	.	.	H	α-helix	trans	-62.7	-44.7	175.1	173.9	57.3	0	0	0	111.3	F867 L868 E871 E905 N906 V911 C912 Q913	F867-L909 HydrophobicContact CE1-CD2 4.1Å; F867-L909 HydrophobicContact CZ-CD2 4.26Å; L868-L909 HydrophobicContact CD2-CD1 4.11Å; E871-L909 HydrophobicContact CB-CD1 3.98Å; E871-L909 HydrophobicContact CB-CD2 4.26Å; E871-L909 HydrophobicContact CG-CD2 4.31Å; E905-L909 VanDerWaalsContact O-CB 3.3Å; E905-L909 WeakPolarHBondContact O-CB 3.3Å; E905-L909 PolarHBondContact O-N 2.83Å; E905-L909 VanDerWaalsContact O-N 3.08Å; N906-L909 PolarHBondContact O-N 3.45Å; L909-V911 VanDerWaalsContact C-N 3.34Å; L909-V911 PolarHBondContact O-N 3.44Å; L909-C912 CarbonylContact O-C 3.6Å; L909-C912 WeakPolarHBondContact O-CB 3.5Å; L909-C912 PolarHBondContact O-N 3.11Å; L909-C912 VanDerWaalsContact O-N 3.11Å; L909-Q913 HydrophobicContact CD1-CG 3.99Å; L909-Q913 HydrophobicContact CG-CG 4.4Å; L909-Q913 WeakPolarHBondContact O-CG 3.36Å; L909-Q913 PolarHBondContact O-N 2.87Å
910	L	98.3	Very high	96.4	Very high	9 Å²	9	28.1 Å²	28.1	5%	0.047	15%	0.147	C	C	.	.	H	α-helix	trans	-61.7	-41.5	177.4	-176.5	62.7	0	0	0	111.4	F884 E887 F888 K891 N906 D907 Q913 V914	F884-L910 HydrophobicContact CD1-CD1 4.18Å; E887-L910 HydrophobicContact CB-CD1 4.45Å; E887-L910 HydrophobicContact CG-CD1 4.33Å; E887-L910 HydrophobicContact CG-CD2 3.95Å; F888-L910 HydrophobicContact CB-CD2 4.36Å; F888-L910 HydrophobicContact CB-CG 4.45Å; F888-L910 HydrophobicContact CD2-CD2 4.38Å; F888-L910 HydrophobicContact CD2-CG 4.22Å; K891-L910 HydrophobicContact CG-CD2 4.3Å; N906-L910 WeakPolarHBondContact O-CB 3.34Å; N906-L910 PolarHBondContact O-N 3.03Å; D907-L910 PolarHBondContact O-N 2.88Å; L910-Q913 PolarHBondContact O-N 3.42Å; L910-V914 HydrophobicContact CD1-CG2 4.43Å; L910-V914 WeakPolarHBondContact O-CG2 3.47Å; L910-V914 PolarHBondContact O-N 3.03Å
911	V	98.2	Very high	96.7	Very high	2 Å²	2	27.2 Å²	27.2	1%	0.012	14%	0.143	C	C	.	.	H	α-helix	trans	-59.1	-45.9	170.9	169.9	0	0	0	0	111.4	L785 I789 F888 I900 W902 D907 R908 L909 Q913 V914 C915 L991	L785-V911 HydrophobicContact CD1-CG1 4.4Å; I789-V911 HydrophobicContact CD1-CG1 4.22Å; F888-V911 HydrophobicContact CE2-CG2 4.25Å; I900-V911 HydrophobicContact CD1-CG2 3.87Å; I900-V911 HydrophobicContact CG1-CG2 4.47Å; I900-V911 HydrophobicContact CG2-CG2 4.02Å; W902-V911 HydrophobicContact CH2-CB 4.5Å; W902-V911 HydrophobicContact CH2-CG1 3.97Å; W902-V911 HydrophobicContact CH2-CG2 4.01Å; W902-V911 HydrophobicContact CZ3-CB 4.47Å; W902-V911 HydrophobicContact CZ3-CG1 4.08Å; W902-V911 HydrophobicContact CZ3-CG2 4.27Å; D907-V911 WeakPolarHBondContact O-CG2 3.17Å; D907-V911 PolarHBondContact O-N 2.95Å; R908-V911 PolarHBondContact O-N 3.02Å; L909-V911 VanDerWaalsContact C-N 3.34Å; L909-V911 PolarHBondContact O-N 3.44Å; V911-Q913 VanDerWaalsContact C-N 3.33Å; V911-Q913 PolarHBondContact O-N 3.15Å; V911-V914 PolarHBondContact O-N 3.27Å; V911-C915 WeakPolarHBondContact O-CB 3.33Å; V911-C915 PolarHBondContact O-N 3.19Å; V911-L991 HydrophobicContact CG1-CD1 4.18Å; V911-L991 HydrophobicContact CG2-CD1 4.26Å
912	C	98.7	Very high	97.1	Very high	5 Å²	5	24 Å²	24	3%	0.034	13%	0.125	C	C	.	.	H	α-helix	trans	-62	-40	177	-65.6	0	0	0	0	112.2	L797 R908 L909 C915 I916	L797-C912 HydrophobicContact CD1-CB 4.3Å; L797-C912 WeakPolarHBondContact CD1-O 3.48Å; L797-C912 HydrophobicContact CD2-CB 4.48Å; R908-C912 PolarHBondContact O-N 3.33Å; R908-C912 PolarHBondContact O-SG 3.3Å; L909-C912 CarbonylContact O-C 3.6Å; L909-C912 WeakPolarHBondContact O-CB 3.5Å; L909-C912 PolarHBondContact O-N 3.11Å; L909-C912 VanDerWaalsContact O-N 3.11Å; C912-C915 PolarHBondContact O-N 2.85Å; C912-I916 PolarHBondContact O-N 3.41Å
913	Q	98.8	Very high	97.4	Very high	13 Å²	13	23 Å²	23	6%	0.061	12%	0.123	C	C	.	.	H	α-helix	trans	-67.1	-44.1	177.5	-73.7	175.3	-47.4	0	0	111.7	E871 A875 F884 L909 L910 V911 C915 I916 K917	E871-Q913 PolarHBondContact O-NE2 3.29Å; A875-Q913 HydrophobicContact CB-CB 3.78Å; A875-Q913 HydrophobicContact CB-CG 3.72Å; F884-Q913 HydrophobicContact CE1-CB 4.34Å; F884-Q913 HydrophobicContact CE1-CG 4.48Å; L909-Q913 HydrophobicContact CD1-CG 3.99Å; L909-Q913 HydrophobicContact CG-CG 4.4Å; L909-Q913 WeakPolarHBondContact O-CG 3.36Å; L909-Q913 PolarHBondContact O-N 2.87Å; L910-Q913 PolarHBondContact O-N 3.42Å; V911-Q913 VanDerWaalsContact C-N 3.33Å; V911-Q913 PolarHBondContact O-N 3.15Å; Q913-C915 VanDerWaalsContact C-N 3.34Å; Q913-I916 VanDerWaalsContact O-CG2 3.31Å; Q913-I916 WeakPolarHBondContact O-CG2 3.34Å; Q913-K917 WeakPolarHBondContact O-CB 3.42Å; Q913-K917 VanDerWaalsContact O-CG 3.26Å; Q913-K917 WeakPolarHBondContact O-CG 3.46Å; Q913-K917 PolarHBondContact O-N 3.27Å
914	V	98.6	Very high	97.8	Very high	1 Å²	1	18.3 Å²	18.3	1%	0.006	10%	0.095	C	C	.	.	H	α-helix	trans	-67.3	-36.3	175.4	176.9	0	0	0	0	111.1	F888 L910 V911 K917 L918 L982 Y986	F888-V914 HydrophobicContact CB-CG2 3.93Å; F888-V914 HydrophobicContact CD1-CG1 4.29Å; F888-V914 HydrophobicContact CD1-CG2 4.42Å; F888-V914 HydrophobicContact CD2-CB 4.43Å; F888-V914 HydrophobicContact CD2-CG2 3.87Å; F888-V914 HydrophobicContact CE1-CG1 4.27Å; F888-V914 HydrophobicContact CE2-CG2 4.48Å; F888-V914 HydrophobicContact CG-CG1 4.45Å; F888-V914 HydrophobicContact CG-CG2 3.83Å; F888-V914 HydrophobicContact CZ-CG1 4.42Å; L910-V914 HydrophobicContact CD1-CG2 4.43Å; L910-V914 WeakPolarHBondContact O-CG2 3.47Å; L910-V914 PolarHBondContact O-N 3.03Å; V911-V914 PolarHBondContact O-N 3.27Å; V914-K917 PolarHBondContact O-N 3.05Å; V914-L918 PolarHBondContact O-N 3.33Å; V914-L982 HydrophobicContact CG1-CD1 3.88Å; V914-Y986 HydrophobicContact CB-CD2 4.48Å; V914-Y986 HydrophobicContact CG1-CD2 3.56Å; V914-Y986 HydrophobicContact CG1-CE2 4.07Å
915	C	98.8	Very high	98	Very high	1 Å²	1	16 Å²	16	1%	0.007	8%	0.082	C	C	.	.	H	α-helix	trans	-61.8	-50.8	174.8	-176.3	0	0	0	0	112.4	V911 C912 Q913 K917 L918 A919 Y986	V911-C915 WeakPolarHBondContact O-CB 3.33Å; V911-C915 PolarHBondContact O-N 3.19Å; C912-C915 PolarHBondContact O-N 2.85Å; Q913-C915 VanDerWaalsContact C-N 3.34Å; C915-K917 VanDerWaalsContact C-N 3.32Å; C915-K917 PolarHBondContact O-N 2.92Å; C915-L918 PolarHBondContact O-N 3.24Å; C915-A919 WeakPolarHBondContact O-CB 3.46Å; C915-A919 PolarHBondContact O-N 3.22Å; C915-Y986 HydrophobicContact CB-CE2 4.47Å
916	I	98.8	Very high	98.2	Very high	0 Å²	0	11 Å²	11	0%	0	6%	0.059	C	C	.	.	H	α-helix	trans	-64.8	-35.1	175.5	-168.3	167.9	0	0	0	111.9	V728 V732 L797 A800 A801 A872 T876 C912 Q913 L918 A919 D920	V728-I916 HydrophobicContact CG1-CG1 4.24Å; V732-I916 HydrophobicContact CG1-CB 4.12Å; V732-I916 HydrophobicContact CG1-CG1 4.27Å; L797-I916 HydrophobicContact CD1-CB 3.79Å; L797-I916 HydrophobicContact CD1-CG2 4.37Å; A800-I916 HydrophobicContact CB-CD1 4.17Å; A801-I916 HydrophobicContact CB-CD1 4.25Å; A872-I916 HydrophobicContact CB-CG2 4.44Å; T876-I916 HydrophobicContact CG2-CD1 4.46Å; T876-I916 HydrophobicContact CG2-CG1 4.4Å; C912-I916 PolarHBondContact O-N 3.41Å; Q913-I916 VanDerWaalsContact O-CG2 3.31Å; Q913-I916 WeakPolarHBondContact O-CG2 3.34Å; I916-L918 VanDerWaalsContact C-N 3.33Å; I916-L918 PolarHBondContact O-N 2.92Å; I916-A919 PolarHBondContact O-N 3.27Å; I916-D920 VanDerWaalsContact O-CB 3.22Å; I916-D920 WeakPolarHBondContact O-CB 3.36Å; I916-D920 PolarHBondContact O-N 3.27Å
917	K	98.8	Very high	98.3	Very high	4 Å²	4	7.4 Å²	7.4	2%	0.017	4%	0.041	C	C	.	.	H	α-helix	trans	-64.7	-34.2	175	-73.1	-173.4	79	59.8	0	113.3	A875 T876 F884 Q913 V914 C915 I921 L982	A875-K917 HydrophobicContact CB-CD 4.47Å; A875-K917 HydrophobicContact CB-CG 4.43Å; A875-K917 WeakPolarHBondContact O-CD 3.46Å; A875-K917 WeakPolarHBondContact O-CE 3.37Å; A875-K917 WeakPolarHBondContact O-CG 3.46Å; A875-K917 PolarHBondContact O-NZ 3Å; T876-K917 PolarHBondContact O-NZ 3.49Å; F884-K917 HydrophobicContact CB-CD 4.37Å; F884-K917 HydrophobicContact CD2-CD 4.05Å; F884-K917 HydrophobicContact CG-CD 4.37Å; Q913-K917 WeakPolarHBondContact O-CB 3.42Å; Q913-K917 VanDerWaalsContact O-CG 3.26Å; Q913-K917 WeakPolarHBondContact O-CG 3.46Å; Q913-K917 PolarHBondContact O-N 3.27Å; V914-K917 PolarHBondContact O-N 3.05Å; C915-K917 VanDerWaalsContact C-N 3.32Å; C915-K917 PolarHBondContact O-N 2.92Å; K917-I921 WeakPolarHBondContact O-CG1 3.36Å; K917-I921 PolarHBondContact O-N 3.28Å; K917-L982 HydrophobicContact CB-CD2 4.22Å
918	L	98.8	Very high	98.4	Very high	1 Å²	1	13.1 Å²	13.1	1%	0.005	6%	0.062	C	C	.	.	H	α-helix	trans	-74.2	-41.1	175.2	-165.3	156.7	0	0	0	110.6	W660 L735 V914 C915 I916 N922 L982 Y986 L992	W660-L918 HydrophobicContact CH2-CD2 4.44Å; L735-L918 HydrophobicContact CD1-CD2 3.88Å; L735-L918 HydrophobicContact CD2-CD2 4.32Å; V914-L918 PolarHBondContact O-N 3.33Å; C915-L918 PolarHBondContact O-N 3.24Å; I916-L918 VanDerWaalsContact C-N 3.33Å; I916-L918 PolarHBondContact O-N 2.92Å; L918-N922 WeakPolarHBondContact O-CA 3.3Å; L918-N922 WeakPolarHBondContact O-CB 3.47Å; L918-N922 PolarHBondContact O-N 3.42Å; L918-L982 HydrophobicContact CB-CD2 4.03Å; L918-L982 HydrophobicContact CB-CG 4.41Å; L918-L982 HydrophobicContact CG-CD2 4.49Å; L918-Y986 HydrophobicContact CD1-CD1 3.88Å; L918-Y986 HydrophobicContact CD1-CG 3.93Å; L918-L992 HydrophobicContact CD1-CD2 4.29Å
919	A	98.8	Very high	98.4	Very high	0 Å²	0	16.2 Å²	16.2	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-63.6	-37.4	175.3	0	0	0	0	0	113.3	V728 A731 V732 L735 C915 I916 N922	V728-A919 HydrophobicContact CG1-CB 3.97Å; A731-A919 HydrophobicContact CB-CB 3.63Å; V732-A919 HydrophobicContact CB-CB 4.45Å; V732-A919 HydrophobicContact CG1-CB 3.41Å; V732-A919 VanDerWaalsContact CG1-CB 3.41Å; L735-A919 HydrophobicContact CD1-CB 4.33Å; C915-A919 WeakPolarHBondContact O-CB 3.46Å; C915-A919 PolarHBondContact O-N 3.22Å; I916-A919 PolarHBondContact O-N 3.27Å; A919-N922 WeakPolarHBondContact O-CB 3.49Å; A919-N922 PolarHBondContact O-ND2 3.39Å
920	D	98.9	Very high	98.3	Very high	17 Å²	17	15.4 Å²	15.4	9%	0.091	8%	0.075	C	C	.	.	H	α-helix	trans	-61.8	-52.6	177	-178.1	26	0	0	0	111.2	H724 H804 I916 N922	H724-D920 PolarHBondContact CE1-O 3.43Å; H724-D920 IonicContact CE1-OD1 3.41Å; H724-D920 IonicContact NE2-OD1 2.75Å; H724-D920 PolarHBondContact NE2-OD1 3.18Å; H804-D920 IonicContact NE2-OD1 2.66Å; I916-D920 VanDerWaalsContact O-CB 3.22Å; I916-D920 WeakPolarHBondContact O-CB 3.36Å; I916-D920 PolarHBondContact O-N 3.27Å; D920-N922 VanDerWaalsContact C-N 3.31Å; D920-N922 PolarHBondContact O-N 2.87Å
921	I	98.5	Very high	98.3	Very high	10 Å²	10	15.1 Å²	15.1	5%	0.051	7%	0.074	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.7	24	-178	73.1	-172.9	0	0	0	113.9	L878 K917 G923 P924 F974 I978 V979 L982	L878-I921 HydrophobicContact CD2-CG2 4.19Å; K917-I921 WeakPolarHBondContact O-CG1 3.36Å; K917-I921 PolarHBondContact O-N 3.28Å; I921-G923 PolarHBondContact O-N 3.34Å; I921-G923 VanDerWaalsContact O-N 3.1Å; I921-P924 WeakPolarHBondContact O-CD 3.2Å; I921-F974 HydrophobicContact CB-CE1 4.3Å; I921-F974 HydrophobicContact CB-CZ 3.93Å; I921-F974 HydrophobicContact CG2-CZ 3.92Å; I921-I978 HydrophobicContact CD1-CG2 3.7Å; I921-V979 HydrophobicContact CB-CG2 4.42Å; I921-V979 HydrophobicContact CD1-CB 4.46Å; I921-V979 HydrophobicContact CD1-CG2 3.93Å; I921-V979 HydrophobicContact CG1-CG2 4.07Å; I921-L982 HydrophobicContact CD1-CD2 3.68Å; I921-L982 HydrophobicContact CG1-CD2 4.19Å
922	N	98.4	Very high	98.3	Very high	2 Å²	2	18 Å²	18	1%	0.011	9%	0.089	C	C	.	.			trans	-65.1	-19.1	-167.1	80.8	70.2	0	0	0	115.2	W660 D727 L918 A919 D920 A925 K926	W660-N922 HydrophobicContact CH2-CB 4Å; W660-N922 HydrophobicContact CZ2-CB 4.07Å; D727-N922 PolarHBondContact OD2-ND2 2.8Å; D727-N922 PolarHBondContact OD2-OD1 3.28Å; L918-N922 WeakPolarHBondContact O-CA 3.3Å; L918-N922 WeakPolarHBondContact O-CB 3.47Å; L918-N922 PolarHBondContact O-N 3.42Å; A919-N922 WeakPolarHBondContact O-CB 3.49Å; A919-N922 PolarHBondContact O-ND2 3.39Å; D920-N922 VanDerWaalsContact C-N 3.31Å; D920-N922 PolarHBondContact O-N 2.87Å; N922-A925 CarbonylContact O-C 3.56Å; N922-A925 WeakPolarHBondContact O-CA 3.42Å; N922-A925 WeakPolarHBondContact O-CB 3.47Å; N922-A925 PolarHBondContact O-N 3.27Å; N922-K926 PolarHBondContact O-N 3.43Å; N922-K926 WeakPolarHBondContact OD1-CE 3.46Å; N922-K926 WeakPolarHBondContact OD1-CG 3.5Å; N922-K926 PolarHBondContact OD1-NZ 3.28Å
923	G	98.1	Very high	98.3	Very high	5 Å²	5	21.8 Å²	21.8	5%	0.052	11%	0.105	C	C	.	.	G	3₁₀ helix	trans	-46.5	-53	-169.2	0	0	0	0	0	115	I921 A925 K926 H931	I921-G923 PolarHBondContact O-N 3.34Å; I921-G923 VanDerWaalsContact O-N 3.1Å; G923-A925 PolarHBondContact O-N 3.02Å; G923-A925 VanDerWaalsContact O-N 3.15Å; G923-K926 WeakPolarHBondContact O-CB 3.32Å; G923-K926 PolarHBondContact O-N 3.47Å; G923-H931 WeakPolarHBondContact O-CB 3.25Å; G923-H931 PolarHBondContact O-ND1 3.21Å
924	P	98.4	Very high	98.3	Very high	6 Å²	6	21.6 Å²	21.6	4%	0.039	10%	0.103	C	C	.	.	G	3₁₀ helix	trans	-65.3	-13.3	177.7	-23.8	35.9	0	0	0	115.7	I921 H931 F974 I975 V979 L1046 N1049	I921-P924 WeakPolarHBondContact O-CD 3.2Å; P924-H931 VanDerWaalsContact CA-ND1 3.29Å; P924-H931 WeakPolarHBondContact CA-ND1 3.38Å; P924-F974 HydrophobicContact CG-CD1 4.31Å; P924-F974 HydrophobicContact CG-CE1 4.39Å; P924-I975 HydrophobicContact CB-CD1 3.92Å; P924-I975 HydrophobicContact CB-CG1 3.67Å; P924-I975 HydrophobicContact CG-CG1 4.08Å; P924-V979 HydrophobicContact CG-CG2 4.18Å; P924-L1046 HydrophobicContact CB-CD1 4.02Å; P924-L1046 WeakPolarHBondContact O-CA 3.3Å; P924-N1049 PolarHBondContact O-ND2 3.29Å
925	A	98.3	Very high	98.3	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	10%	0.104	C	C	.	.	G	3₁₀ helix	trans	-101	1.4	174.5	0	0	0	0	0	113.3	W660 N922 G923 I1042 H1045 L1046	W660-A925 PolarHBondContact NE1-O 2.69Å; N922-A925 CarbonylContact O-C 3.56Å; N922-A925 WeakPolarHBondContact O-CA 3.42Å; N922-A925 WeakPolarHBondContact O-CB 3.47Å; N922-A925 PolarHBondContact O-N 3.27Å; G923-A925 PolarHBondContact O-N 3.02Å; G923-A925 VanDerWaalsContact O-N 3.15Å; A925-I1042 HydrophobicContact CB-CG2 3.77Å; A925-H1045 WeakPolarHBondContact O-CB 3.38Å; A925-L1046 HydrophobicContact CB-CB 4.24Å; A925-L1046 HydrophobicContact CB-CD1 4.48Å
926	K	98.3	Very high	98.2	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	13%	0.132	C	C	.	.	S	Bend	trans	-87.9	162.1	166	-64.2	-84.5	175.6	66.3	0	110.1	W660 D727 N922 G923 L930 N1049	W660-K926 HydrophobicContact CD2-CD 4.29Å; W660-K926 HydrophobicContact CG-CD 4.46Å; W660-K926 HydrophobicContact CZ2-CD 4.33Å; W660-K926 WeakPolarHBondContact O-CD 3.35Å; W660-K926 WeakPolarHBondContact O-CE 3.28Å; D727-K926 IonicContact OD1-NZ 3.74Å; D727-K926 PolarHBondContact OD1-NZ 3.41Å; D727-K926 IonicContact OD2-NZ 3.77Å; D727-K926 PolarHBondContact OD2-NZ 3.37Å; N922-K926 PolarHBondContact O-N 3.43Å; N922-K926 WeakPolarHBondContact OD1-CE 3.46Å; N922-K926 WeakPolarHBondContact OD1-CG 3.5Å; N922-K926 PolarHBondContact OD1-NZ 3.28Å; G923-K926 WeakPolarHBondContact O-CB 3.32Å; G923-K926 PolarHBondContact O-N 3.47Å; K926-L930 HydrophobicContact CB-CB 3.96Å; K926-L930 HydrophobicContact CB-CD1 4.32Å; K926-L930 HydrophobicContact CD-CD1 4.24Å; K926-N1049 PolarHBondContact O-ND2 3.13Å
927	V	97.9	Very high	98.2	Very high	38 Å²	38	28 Å²	28	23%	0.23	14%	0.136	C	C	.	.			trans	-50.3	141.8	172.5	66.1	0	0	0	0	111	N661 D929 L930 H931	N661-V927 HydrophobicContact CB-CB 4.32Å; N661-V927 HydrophobicContact CB-CG1 3.83Å; N661-V927 WeakPolarHBondContact OD1-CB 3.22Å; N661-V927 PolarHBondContact OD1-N 2.84Å; V927-D929 PolarHBondContact O-N 3.5Å; V927-L930 HydrophobicContact CG1-CB 4.32Å; V927-L930 HydrophobicContact CG1-CD1 4Å; V927-L930 HydrophobicContact CG1-CG 3.94Å; V927-L930 PolarHBondContact O-N 3.1Å; V927-H931 PolarHBondContact O-N 2.76Å
928	R	97.1	Very high	98.1	Very high	128 Å²	128	29.2 Å²	29.2	48%	0.483	14%	0.142	S	C	.	.	H	α-helix	trans	-41.6	-40.2	-173	-169.1	-156.2	70	122.9	1.7	114.8	H931 L932 N1049	R928-H931 PolarHBondContact O-N 3.16Å; R928-L932 HydrophobicContact CG-CD1 3.97Å; R928-L932 HydrophobicContact CG-CG 4.42Å; R928-L932 WeakPolarHBondContact O-CB 3.09Å; R928-L932 VanDerWaalsContact O-CG 3.26Å; R928-L932 WeakPolarHBondContact O-CG 3.41Å; R928-L932 PolarHBondContact O-N 2.83Å; R928-N1049 WeakPolarHBondContact CA-OD1 3.4Å
929	D	97.1	Very high	98.1	Very high	82 Å²	82	29.8 Å²	29.8	44%	0.439	15%	0.145	S	C	.	.	H	α-helix	trans	-74.7	-26.8	-175.5	-70	27.3	0	0	0	113	V927 K933	V927-D929 PolarHBondContact O-N 3.5Å; D929-K933 WeakPolarHBondContact O-CD 3.46Å; D929-K933 VanDerWaalsContact O-CG 3.3Å; D929-K933 WeakPolarHBondContact O-CG 3.06Å
930	L	97.8	Very high	98	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-79.6	-43.3	167.9	-65.3	179.1	0	0	0	110.7	N661 F662 F665 K926 V927 L932 K933 W934	N661-L930 HydrophobicContact CB-CD1 4.43Å; F662-L930 WeakPolarHBondContact O-CD1 3.26Å; F665-L930 HydrophobicContact CD2-CD2 3.77Å; F665-L930 HydrophobicContact CE2-CD2 4.01Å; K926-L930 HydrophobicContact CB-CB 3.96Å; K926-L930 HydrophobicContact CB-CD1 4.32Å; K926-L930 HydrophobicContact CD-CD1 4.24Å; V927-L930 HydrophobicContact CG1-CB 4.32Å; V927-L930 HydrophobicContact CG1-CD1 4Å; V927-L930 HydrophobicContact CG1-CG 3.94Å; V927-L930 PolarHBondContact O-N 3.1Å; L930-L932 VanDerWaalsContact C-N 3.31Å; L930-L932 PolarHBondContact O-N 3.09Å; L930-K933 PolarHBondContact O-N 3.02Å; L930-W934 PolarHBondContact O-N 3.31Å
931	H	98.4	Very high	98	Very high	3 Å²	3	32 Å²	32	1%	0.014	16%	0.157	C	C	.	.	H	α-helix	trans	-53.9	-46.9	175.8	174.9	50.1	0	0	0	112.2	G923 P924 V927 R928 W934 T935 Q971 W1053	G923-H931 WeakPolarHBondContact O-CB 3.25Å; G923-H931 PolarHBondContact O-ND1 3.21Å; P924-H931 VanDerWaalsContact CA-ND1 3.29Å; P924-H931 WeakPolarHBondContact CA-ND1 3.38Å; V927-H931 PolarHBondContact O-N 2.76Å; R928-H931 PolarHBondContact O-N 3.16Å; H931-W934 PolarHBondContact O-N 3.31Å; H931-T935 PolarHBondContact CE1-OG1 3.21Å; H931-T935 PolarHBondContact NE2-OG1 2.87Å; H931-T935 VanDerWaalsContact O-CB 3.27Å; H931-T935 WeakPolarHBondContact O-CB 3.25Å; H931-T935 PolarHBondContact O-N 3.02Å; H931-T935 PolarHBondContact O-OG1 3.14Å; H931-Q971 PolarHBondContact CE1-OE1 3.48Å; H931-Q971 VanDerWaalsContact CE1-OE1 3.3Å; H931-W1053 AromaticContact CD2-NE1 3.69Å; H931-W1053 AromaticContact NE2-CE2 3.55Å; H931-W1053 AromaticContact NE2-CZ2 3.52Å; H931-W1053 AromaticContact NE2-NE1 3.03Å; H931-W1053 PolarHBondContact NE2-NE1 3Å
932	L	97.9	Very high	98	Very high	62 Å²	62	33.5 Å²	33.5	33%	0.325	16%	0.163	S	C	.	.	H	α-helix	trans	-67.7	-36.5	-179.6	-71.3	171.7	0	0	0	112.8	R928 L930 T935 E936 W1053	R928-L932 HydrophobicContact CG-CD1 3.97Å; R928-L932 HydrophobicContact CG-CG 4.42Å; R928-L932 WeakPolarHBondContact O-CB 3.09Å; R928-L932 VanDerWaalsContact O-CG 3.26Å; R928-L932 WeakPolarHBondContact O-CG 3.41Å; R928-L932 PolarHBondContact O-N 2.83Å; L930-L932 VanDerWaalsContact C-N 3.31Å; L930-L932 PolarHBondContact O-N 3.09Å; L932-T935 WeakPolarHBondContact O-CB 3.37Å; L932-T935 PolarHBondContact O-N 3.08Å; L932-E936 PolarHBondContact O-N 3.32Å; L932-W1053 HydrophobicContact CD2-CH2 3.83Å; L932-W1053 HydrophobicContact CD2-CZ2 3.71Å
933	K	97.8	Very high	98	Very high	84 Å²	84	34.7 Å²	34.7	37%	0.365	17%	0.168	S	C	.	.	H	α-helix	trans	-64.1	-44.6	173.5	-73.4	172.3	-174.1	173.4	0	111.6	F665 D929 L930 E936 G937	F665-K933 HydrophobicContact CD2-CB 4.38Å; F665-K933 HydrophobicContact CD2-CD 3.49Å; F665-K933 VanDerWaalsContact CD2-CD 3.49Å; F665-K933 HydrophobicContact CE2-CB 3.75Å; F665-K933 HydrophobicContact CE2-CD 3.74Å; F665-K933 HydrophobicContact CE2-CG 4.4Å; F665-K933 HydrophobicContact CG-CD 3.93Å; F665-K933 HydrophobicContact CZ-CB 3.83Å; F665-K933 HydrophobicContact CZ-CD 4.37Å; D929-K933 WeakPolarHBondContact O-CD 3.46Å; D929-K933 VanDerWaalsContact O-CG 3.3Å; D929-K933 WeakPolarHBondContact O-CG 3.06Å; L930-K933 PolarHBondContact O-N 3.02Å; K933-E936 PolarHBondContact O-N 2.81Å; K933-G937 PolarHBondContact O-N 3.48Å; K933-G937 VanDerWaalsContact O-N 3.16Å
934	W	98.4	Very high	98	Very high	9 Å²	9	38.4 Å²	38.4	3%	0.034	18%	0.184	C	C	.	.	H	α-helix	trans	-66	-41.4	175.5	-73.2	133.7	0	0	0	112.3	I664 F665 Y719 V723 H724 D727 L930 H931 E936 G937 I938	I664-W934 HydrophobicContact CG2-CZ2 4.16Å; F665-W934 HydrophobicContact CE1-CH2 4.3Å; F665-W934 HydrophobicContact CE1-CZ3 4.45Å; F665-W934 HydrophobicContact CE2-CD2 4.44Å; F665-W934 HydrophobicContact CE2-CZ2 4.15Å; F665-W934 AromaticContact CZ-CD2 3.89Å; F665-W934 HydrophobicContact CZ-CD2 3.89Å; F665-W934 AromaticContact CZ-CE2 3.74Å; F665-W934 HydrophobicContact CZ-CE3 4.02Å; F665-W934 AromaticContact CZ-CH2 3.87Å; F665-W934 HydrophobicContact CZ-CH2 3.87Å; F665-W934 AromaticContact CZ-CZ2 3.72Å; F665-W934 HydrophobicContact CZ-CZ2 3.72Å; F665-W934 HydrophobicContact CZ-CZ3 4.03Å; Y719-W934 AromaticContact CD2-CE3 3.69Å; Y719-W934 HydrophobicContact CD2-CE3 3.69Å; Y719-W934 HydrophobicContact CD2-CZ3 4.18Å; Y719-W934 HydrophobicContact CE2-CB 4.38Å; Y719-W934 HydrophobicContact CE2-CD2 4.16Å; Y719-W934 AromaticContact CE2-CE3 3.57Å; Y719-W934 HydrophobicContact CE2-CE3 3.57Å; Y719-W934 HydrophobicContact CE2-CZ3 4.21Å; V723-W934 HydrophobicContact CB-CH2 4.17Å; V723-W934 HydrophobicContact CG1-CH2 3.87Å; V723-W934 HydrophobicContact CG1-CZ2 4.47Å; H724-W934 HydrophobicContact CB-CH2 4.2Å; H724-W934 HydrophobicContact CB-CZ3 4.13Å; D727-W934 HydrophobicContact CB-CH2 4.43Å; D727-W934 HydrophobicContact CB-CZ2 3.66Å; D727-W934 PolarHBondContact OD2-NE1 3.24Å; L930-W934 PolarHBondContact O-N 3.31Å; H931-W934 PolarHBondContact O-N 3.31Å; W934-E936 VanDerWaalsContact C-N 3.34Å; W934-E936 PolarHBondContact O-N 3.1Å; W934-G937 PolarHBondContact O-N 3.44Å; W934-G937 VanDerWaalsContact O-N 3.16Å; W934-I938 WeakPolarHBondContact O-CG1 3.43Å; W934-I938 PolarHBondContact O-N 2.8Å
935	T	98.4	Very high	98	Very high	5 Å²	5	38.2 Å²	38.2	3%	0.031	18%	0.183	C	C	.	.	H	α-helix	trans	-56.4	-44.9	173.5	-65.7	0	0	0	0	112.1	H931 L932 I938 V939 L967 Q971 W1053	H931-T935 PolarHBondContact CE1-OG1 3.21Å; H931-T935 PolarHBondContact NE2-OG1 2.87Å; H931-T935 VanDerWaalsContact O-CB 3.27Å; H931-T935 WeakPolarHBondContact O-CB 3.25Å; H931-T935 PolarHBondContact O-N 3.02Å; H931-T935 PolarHBondContact O-OG1 3.14Å; L932-T935 WeakPolarHBondContact O-CB 3.37Å; L932-T935 PolarHBondContact O-N 3.08Å; T935-I938 PolarHBondContact O-N 3Å; T935-V939 WeakPolarHBondContact O-CG2 3.36Å; T935-V939 PolarHBondContact O-N 3.36Å; T935-L967 HydrophobicContact CG2-CD1 3.52Å; T935-Q971 HydrophobicContact CG2-CG 4.03Å; T935-W1053 HydrophobicContact CG2-CH2 4.3Å; T935-W1053 HydrophobicContact CG2-CZ2 4.23Å
936	E	98	Very high	98	Very high	124 Å²	124	38.3 Å²	38.3	58%	0.579	18%	0.183	S	C	*	.	H	α-helix	trans	-61	-42.4	175.9	179.1	172.1	-153.9	0	0	111.8	L932 K933 W934 N940	L932-E936 PolarHBondContact O-N 3.32Å; K933-E936 PolarHBondContact O-N 2.81Å; W934-E936 VanDerWaalsContact C-N 3.34Å; W934-E936 PolarHBondContact O-N 3.1Å; E936-N940 VanDerWaalsContact CG-ND2 3.34Å; E936-N940 WeakPolarHBondContact CG-ND2 3.24Å; E936-N940 WeakPolarHBondContact O-CB 3.45Å; E936-N940 PolarHBondContact O-N 3.4Å; E936-N940 VanDerWaalsContact O-N 3.12Å; E936-N940 PolarHBondContact O-ND2 2.92Å
937	G	97.9	Very high	98	Very high	8 Å²	8	40.9 Å²	40.9	8%	0.082	20%	0.197	C	C	.	.	H	α-helix	trans	-57.5	-54.7	173.4	0	0	0	0	0	112.1	P718 K933 W934 V939 N940 E941	P718-G937 WeakPolarHBondContact CB-O 3.32Å; K933-G937 PolarHBondContact O-N 3.48Å; K933-G937 VanDerWaalsContact O-N 3.16Å; W934-G937 PolarHBondContact O-N 3.44Å; W934-G937 VanDerWaalsContact O-N 3.16Å; G937-V939 PolarHBondContact O-N 2.93Å; G937-N940 PolarHBondContact O-N 2.99Å; G937-E941 PolarHBondContact O-N 3.46Å; G937-E941 VanDerWaalsContact O-N 3.11Å
938	I	97.8	Very high	98.1	Very high	30 Å²	30	42.3 Å²	42.3	15%	0.154	20%	0.201	C	C	.	.	H	α-helix	trans	-56.1	-51.3	-177.4	-65.9	164.1	0	0	0	111	Y719 W934 T935 N940 E941 F942	Y719-I938 HydrophobicContact CD1-CG1 3.73Å; Y719-I938 HydrophobicContact CD2-CD1 4.33Å; Y719-I938 HydrophobicContact CD2-CG1 3.55Å; Y719-I938 HydrophobicContact CE1-CD1 4.29Å; Y719-I938 HydrophobicContact CE1-CG1 3.85Å; Y719-I938 HydrophobicContact CE2-CD1 3.99Å; Y719-I938 HydrophobicContact CE2-CG1 3.71Å; Y719-I938 HydrophobicContact CG-CG1 3.57Å; W934-I938 WeakPolarHBondContact O-CG1 3.43Å; W934-I938 PolarHBondContact O-N 2.8Å; T935-I938 PolarHBondContact O-N 3Å; I938-N940 PolarHBondContact O-N 3.34Å; I938-E941 PolarHBondContact O-N 2.85Å; I938-F942 HydrophobicContact CG2-CD1 4.25Å; I938-F942 HydrophobicContact CG2-CD2 4.33Å; I938-F942 HydrophobicContact CG2-CE1 3.9Å; I938-F942 HydrophobicContact CG2-CE2 3.98Å; I938-F942 HydrophobicContact CG2-CG 4.46Å; I938-F942 HydrophobicContact CG2-CZ 3.75Å; I938-F942 WeakPolarHBondContact O-CD1 3.4Å; I938-F942 WeakPolarHBondContact O-CG 3.3Å; I938-F942 PolarHBondContact O-N 3.1Å
939	V	97.5	Very high	98.1	Very high	12 Å²	12	36.5 Å²	36.5	7%	0.073	18%	0.179	C	C	.	.	H	α-helix	trans	-71.1	-33.1	-175.7	-58.7	0	0	0	0	112.9	T935 G937 E941 F942 Y943 L967 L970	T935-V939 WeakPolarHBondContact O-CG2 3.36Å; T935-V939 PolarHBondContact O-N 3.36Å; G937-V939 PolarHBondContact O-N 2.93Å; V939-E941 VanDerWaalsContact C-N 3.31Å; V939-E941 PolarHBondContact O-N 2.98Å; V939-F942 PolarHBondContact O-N 3.37Å; V939-Y943 HydrophobicContact CB-CD2 4.44Å; V939-Y943 HydrophobicContact CB-CE2 3.89Å; V939-Y943 HydrophobicContact CG2-CE2 3.92Å; V939-Y943 WeakPolarHBondContact O-CB 3.23Å; V939-Y943 WeakPolarHBondContact O-CD2 3.49Å; V939-Y943 PolarHBondContact O-N 3.47Å; V939-L967 HydrophobicContact CG1-CD1 3.76Å; V939-L970 HydrophobicContact CG1-CD2 3.79Å
940	N	98.3	Very high	98.2	Very high	59 Å²	59	35.1 Å²	35.1	32%	0.316	18%	0.18	S	C	.	.	H	α-helix	trans	-63	-39.1	173.6	-82.5	-57.5	0	0	0	111.8	P718 E936 G937 I938 Y943 E944	P718-N940 HydrophobicContact CB-CB 3.94Å; P718-N940 HydrophobicContact CG-CB 4.16Å; E936-N940 VanDerWaalsContact CG-ND2 3.34Å; E936-N940 WeakPolarHBondContact CG-ND2 3.24Å; E936-N940 WeakPolarHBondContact O-CB 3.45Å; E936-N940 PolarHBondContact O-N 3.4Å; E936-N940 VanDerWaalsContact O-N 3.12Å; E936-N940 PolarHBondContact O-ND2 2.92Å; G937-N940 PolarHBondContact O-N 2.99Å; I938-N940 PolarHBondContact O-N 3.34Å; N940-Y943 PolarHBondContact O-N 3.18Å; N940-E944 PolarHBondContact O-N 3.12Å
941	E	98.3	Very high	98.2	Very high	4 Å²	4	42.6 Å²	42.6	2%	0.019	21%	0.212	C	C	.	.	H	α-helix	trans	-70.6	-41.1	176.5	-159.8	174.5	121.1	0	0	112.4	P718 Y719 H720 H808 G810 G937 I938 V939 Y943 E944 Q945	P718-E941 HydrophobicContact CB-CB 4.14Å; P718-E941 HydrophobicContact CG-CB 4.18Å; Y719-E941 PolarHBondContact N-OE2 3.47Å; H720-E941 IonicContact CE1-OE1 3.05Å; H720-E941 PolarHBondContact CE1-OE1 2.92Å; H720-E941 IonicContact CG-OE1 2.69Å; H720-E941 PolarHBondContact N-OE2 3.22Å; H720-E941 IonicContact ND1-OE1 2.71Å; H720-E941 PolarHBondContact ND1-OE1 3.43Å; H720-E941 IonicContact ND1-OE2 3.89Å; H808-E941 IonicContact CE1-OE1 3.78Å; H808-E941 PolarHBondContact CE1-OE1 2.99Å; H808-E941 IonicContact ND1-OE1 3.15Å; G810-E941 WeakPolarHBondContact CA-OE1 3.4Å; G937-E941 PolarHBondContact O-N 3.46Å; G937-E941 VanDerWaalsContact O-N 3.11Å; I938-E941 PolarHBondContact O-N 2.85Å; V939-E941 VanDerWaalsContact C-N 3.31Å; V939-E941 PolarHBondContact O-N 2.98Å; E941-Y943 VanDerWaalsContact C-N 3.33Å; E941-Y943 PolarHBondContact O-N 3.01Å; E941-E944 WeakPolarHBondContact O-CB 3.27Å; E941-E944 PolarHBondContact O-N 2.98Å; E941-E944 VanDerWaalsContact O-N 3.13Å; E941-Q945 PolarHBondContact O-N 3.09Å
942	F	98.4	Very high	98.1	Very high	42 Å²	42	47 Å²	47	18%	0.184	24%	0.235	C	C	.	.	H	α-helix	trans	-57.8	-45.1	171	-78.2	12.5	0	0	0	111.4	I938 V939 E944 Q945 G946 M960 L970	I938-F942 HydrophobicContact CG2-CD1 4.25Å; I938-F942 HydrophobicContact CG2-CD2 4.33Å; I938-F942 HydrophobicContact CG2-CE1 3.9Å; I938-F942 HydrophobicContact CG2-CE2 3.98Å; I938-F942 HydrophobicContact CG2-CG 4.46Å; I938-F942 HydrophobicContact CG2-CZ 3.75Å; I938-F942 WeakPolarHBondContact O-CD1 3.4Å; I938-F942 WeakPolarHBondContact O-CG 3.3Å; I938-F942 PolarHBondContact O-N 3.1Å; V939-F942 PolarHBondContact O-N 3.37Å; F942-E944 VanDerWaalsContact C-N 3.28Å; F942-E944 PolarHBondContact O-N 2.69Å; F942-Q945 WeakPolarHBondContact O-CA 3.3Å; F942-Q945 WeakPolarHBondContact O-CB 3.46Å; F942-Q945 PolarHBondContact O-N 3.39Å; F942-G946 PolarHBondContact O-N 3.33Å; F942-M960 HydrophobicContact CB-CB 4.42Å; F942-M960 HydrophobicContact CB-CE 4.36Å; F942-M960 HydrophobicContact CB-CG 3.92Å; F942-M960 HydrophobicContact CB-SD 4.15Å; F942-M960 HydrophobicContact CD1-CE 3.81Å; F942-M960 HydrophobicContact CD2-CE 4Å; F942-M960 HydrophobicContact CD2-CG 4.3Å; F942-M960 HydrophobicContact CE1-CE 4.04Å; F942-M960 HydrophobicContact CE2-CE 4.22Å; F942-M960 HydrophobicContact CG-CE 3.79Å; F942-M960 HydrophobicContact CG-CG 4.2Å; F942-M960 HydrophobicContact CG-SD 4.24Å; F942-M960 HydrophobicContact CZ-CE 4.24Å; F942-M960 WeakPolarHBondContact O-CB 3.42Å; F942-L970 HydrophobicContact CD2-CD2 4.2Å; F942-L970 HydrophobicContact CE2-CD1 4.25Å; F942-L970 HydrophobicContact CE2-CD2 4.08Å
943	Y	98.4	Very high	98.1	Very high	27 Å²	27	47.2 Å²	47.2	11%	0.106	25%	0.253	C	S	.	.	H	α-helix	trans	-65.5	-28.9	176.4	-62.9	-31	0	0	0	113	V939 N940 E941 D947 R962 P965	V939-Y943 HydrophobicContact CB-CD2 4.44Å; V939-Y943 HydrophobicContact CB-CE2 3.89Å; V939-Y943 HydrophobicContact CG2-CE2 3.92Å; V939-Y943 WeakPolarHBondContact O-CB 3.23Å; V939-Y943 WeakPolarHBondContact O-CD2 3.49Å; V939-Y943 PolarHBondContact O-N 3.47Å; N940-Y943 PolarHBondContact O-N 3.18Å; E941-Y943 VanDerWaalsContact C-N 3.33Å; E941-Y943 PolarHBondContact O-N 3.01Å; Y943-D947 WeakPolarHBondContact O-CB 3.42Å; Y943-D947 PolarHBondContact O-N 2.83Å; Y943-R962 HydrophobicContact CD1-CB 3.74Å; Y943-R962 HydrophobicContact CD2-CB 4.04Å; Y943-R962 HydrophobicContact CE1-CB 4.26Å; Y943-R962 HydrophobicContact CG-CB 3.64Å; Y943-R962 PolarHBondContact O-NH2 3.21Å; Y943-P965 WeakPolarHBondContact OH-CB 3.42Å
944	E	98.5	Very high	98	Very high	84 Å²	84	46.1 Å²	46.1	39%	0.393	25%	0.251	S	S	.	.	H	α-helix	trans	-70	-32.6	168.9	-75.3	-166.2	-173.1	0	0	113	R811 N940 E941 F942 E948	R811-E944 PolarHBondContact NH2-O 2.96Å; R811-E944 VanDerWaalsContact NH2-O 3.1Å; N940-E944 PolarHBondContact O-N 3.12Å; E941-E944 WeakPolarHBondContact O-CB 3.27Å; E941-E944 PolarHBondContact O-N 2.98Å; E941-E944 VanDerWaalsContact O-N 3.13Å; F942-E944 VanDerWaalsContact C-N 3.28Å; F942-E944 PolarHBondContact O-N 2.69Å; E944-E948 PolarHBondContact O-N 2.92Å
945	Q	98.5	Very high	98	Very high	2 Å²	2	51.3 Å²	51.3	1%	0.009	29%	0.285	C	S	.	.	H	α-helix	trans	-68.7	-49.8	171.7	-179	177.4	-56.7	0	0	111.2	T812 F815 E941 F942 D947 E948 E949 M960	T812-Q945 PolarHBondContact OG1-NE2 3.5Å; T812-Q945 PolarHBondContact OG1-OE1 3.08Å; F815-Q945 HydrophobicContact CB-CG 4.38Å; F815-Q945 HydrophobicContact CD2-CG 3.73Å; F815-Q945 HydrophobicContact CE2-CG 4.26Å; F815-Q945 HydrophobicContact CG-CG 4.15Å; E941-Q945 PolarHBondContact O-N 3.09Å; F942-Q945 WeakPolarHBondContact O-CA 3.3Å; F942-Q945 WeakPolarHBondContact O-CB 3.46Å; F942-Q945 PolarHBondContact O-N 3.39Å; Q945-D947 VanDerWaalsContact C-N 3.29Å; Q945-D947 PolarHBondContact O-N 3.41Å; Q945-E948 CarbonylContact O-C 3.6Å; Q945-E948 WeakPolarHBondContact O-CA 3.5Å; Q945-E948 WeakPolarHBondContact O-CB 3.27Å; Q945-E948 PolarHBondContact O-N 2.88Å; Q945-E949 HydrophobicContact CG-CG 4.24Å; Q945-E949 PolarHBondContact NE2-OE1 2.76Å; Q945-E949 WeakPolarHBondContact O-CG 3.37Å; Q945-E949 PolarHBondContact O-N 3.15Å; Q945-M960 HydrophobicContact CB-SD 3.88Å; Q945-M960 VanDerWaalsContact CD-SD 3.54Å; Q945-M960 HydrophobicContact CG-SD 3.91Å; Q945-M960 PolarHBondContact NE2-SD 3.2Å
946	G	98.3	Very high	97.9	Very high	1 Å²	1	54 Å²	54	1%	0.01	30%	0.299	C	S	.	.	H	α-helix	trans	-61.5	-38.2	-179.9	0	0	0	0	0	112.9	F942 E948 E949 A950	F942-G946 PolarHBondContact O-N 3.33Å; G946-E948 PolarHBondContact O-N 3.17Å; G946-E949 PolarHBondContact O-N 2.89Å; G946-A950 WeakPolarHBondContact O-CB 3.46Å; G946-A950 PolarHBondContact O-N 3.05Å
947	D	98.4	Very high	97.9	Very high	55 Å²	55	49.6 Å²	49.6	29%	0.294	28%	0.282	S	S	.	.	H	α-helix	trans	-56.4	-29.2	168.1	-95.1	13.7	0	0	0	113.5	Y943 Q945 K951 R962	Y943-D947 WeakPolarHBondContact O-CB 3.42Å; Y943-D947 PolarHBondContact O-N 2.83Å; Q945-D947 VanDerWaalsContact C-N 3.29Å; Q945-D947 PolarHBondContact O-N 3.41Å; D947-K951 WeakPolarHBondContact O-CD 3.27Å; D947-K951 WeakPolarHBondContact O-CE 3.37Å; D947-K951 WeakPolarHBondContact O-CG 3.45Å; D947-K951 PolarHBondContact O-NZ 3.3Å; D947-R962 VanDerWaalsContact CG-NE 3.3Å; D947-R962 VanDerWaalsContact CG-NH2 3.31Å; D947-R962 IonicContact OD1-CZ 3.92Å; D947-R962 IonicContact OD1-NE 3.61Å; D947-R962 PolarHBondContact OD1-NE 3.44Å; D947-R962 IonicContact OD1-NH2 2.04Å; D947-R962 IonicContact OD2-CZ 3.17Å; D947-R962 IonicContact OD2-NE 3.64Å; D947-R962 PolarHBondContact OD2-NE 2.65Å; D947-R962 IonicContact OD2-NH2 3.19Å; D947-R962 PolarHBondContact OD2-NH2 3.49Å
948	E	98.4	Very high	97.8	Very high	67 Å²	67	53.1 Å²	53.1	31%	0.313	30%	0.303	S	S	.	.	H	α-helix	trans	-89.3	-40.6	178.4	-170.1	169.5	178	0	0	111.9	R811 F815 E944 Q945 G946 A950 K951 L952	R811-E948 IonicContact CZ-OE2 2.64Å; R811-E948 VanDerWaalsContact CZ-OE2 3.24Å; R811-E948 IonicContact NE-OE2 3.34Å; R811-E948 PolarHBondContact NE-OE2 2.93Å; R811-E948 IonicContact NH2-OE2 3.89Å; R811-E948 PolarHBondContact NH2-OE2 3.02Å; F815-E948 HydrophobicContact CE2-CG 4.42Å; F815-E948 HydrophobicContact CZ-CB 4.42Å; F815-E948 HydrophobicContact CZ-CG 3.95Å; E944-E948 PolarHBondContact O-N 2.92Å; Q945-E948 CarbonylContact O-C 3.6Å; Q945-E948 WeakPolarHBondContact O-CA 3.5Å; Q945-E948 WeakPolarHBondContact O-CB 3.27Å; Q945-E948 PolarHBondContact O-N 2.88Å; G946-E948 PolarHBondContact O-N 3.17Å; E948-A950 VanDerWaalsContact C-N 3.29Å; E948-A950 PolarHBondContact O-N 2.78Å; E948-K951 PolarHBondContact O-N 2.69Å; E948-K951 VanDerWaalsContact O-N 3.08Å; E948-L952 HydrophobicContact CG-CD1 4.13Å; E948-L952 HydrophobicContact CG-CG 4.46Å; E948-L952 WeakPolarHBondContact O-CG 3.24Å; E948-L952 PolarHBondContact O-N 2.94Å
949	E	98.5	Very high	97.7	Very high	6 Å²	6	54.6 Å²	54.6	3%	0.028	31%	0.309	C	S	.	.	H	α-helix	trans	-53.4	-47.9	170.6	-68.6	169.7	158.6	0	0	110.8	F815 Q945 G946 K951 L952 G953 L954 I956 S957	F815-E949 HydrophobicContact CD2-CG 3.68Å; F815-E949 HydrophobicContact CE2-CG 3.7Å; Q945-E949 HydrophobicContact CG-CG 4.24Å; Q945-E949 PolarHBondContact NE2-OE1 2.76Å; Q945-E949 WeakPolarHBondContact O-CG 3.37Å; Q945-E949 PolarHBondContact O-N 3.15Å; G946-E949 PolarHBondContact O-N 2.89Å; E949-K951 PolarHBondContact O-N 3.43Å; E949-L952 CarbonylContact O-C 3.3Å; E949-L952 PolarHBondContact O-N 3.06Å; E949-L952 VanDerWaalsContact O-N 3.16Å; E949-G953 PolarHBondContact O-N 3.11Å; E949-G953 VanDerWaalsContact O-N 3.08Å; E949-L954 HydrophobicContact CB-CB 4.15Å; E949-L954 PolarHBondContact O-N 3.13Å; E949-I956 WeakPolarHBondContact OE2-CA 3.28Å; E949-S957 WeakPolarHBondContact OE1-CB 3.48Å; E949-S957 PolarHBondContact OE1-OG 2.98Å; E949-S957 WeakPolarHBondContact OE2-CB 3.14Å; E949-S957 PolarHBondContact OE2-N 2.64Å; E949-S957 PolarHBondContact OE2-OG 3.34Å
950	A	97.6	Very high	97.7	Very high	54 Å²	54	54.7 Å²	54.7	45%	0.446	31%	0.309	S	S	.	.	H	α-helix	trans	-60	-40.8	175	0	0	0	0	0	113.2	G946 E948 L952 G953 I956	G946-A950 WeakPolarHBondContact O-CB 3.46Å; G946-A950 PolarHBondContact O-N 3.05Å; E948-A950 VanDerWaalsContact C-N 3.29Å; E948-A950 PolarHBondContact O-N 2.78Å; A950-L952 VanDerWaalsContact C-N 3.31Å; A950-L952 PolarHBondContact O-N 2.89Å; A950-G953 PolarHBondContact O-N 3.33Å; A950-I956 HydrophobicContact CB-CD1 4.05Å; A950-I956 HydrophobicContact CB-CG1 4.11Å
951	K	98.1	Very high	97.7	Very high	156 Å²	156	54.2 Å²	54.2	68%	0.678	31%	0.306	S	S	*	.	H	α-helix	trans	-68.7	-29	176.8	-71.5	165.4	-161.5	122.8	0	112.6	D947 E948 E949 G953	D947-K951 WeakPolarHBondContact O-CD 3.27Å; D947-K951 WeakPolarHBondContact O-CE 3.37Å; D947-K951 WeakPolarHBondContact O-CG 3.45Å; D947-K951 PolarHBondContact O-NZ 3.3Å; E948-K951 PolarHBondContact O-N 2.69Å; E948-K951 VanDerWaalsContact O-N 3.08Å; E949-K951 PolarHBondContact O-N 3.43Å; K951-G953 VanDerWaalsContact C-N 3.33Å
952	L	97.6	Very high	97.5	Very high	95 Å²	95	59.3 Å²	59.3	50%	0.497	33%	0.325	S	S	.	.	H	α-helix	trans	-84.1	-7.1	176	-67.1	172.8	0	0	0	113	F815 T819 E948 E949 A950 L954	F815-L952 HydrophobicContact CE2-CD1 4.22Å; F815-L952 HydrophobicContact CZ-CD1 4.01Å; T819-L952 HydrophobicContact CG2-CD1 3.88Å; E948-L952 HydrophobicContact CG-CD1 4.13Å; E948-L952 HydrophobicContact CG-CG 4.46Å; E948-L952 WeakPolarHBondContact O-CG 3.24Å; E948-L952 PolarHBondContact O-N 2.94Å; E949-L952 CarbonylContact O-C 3.3Å; E949-L952 PolarHBondContact O-N 3.06Å; E949-L952 VanDerWaalsContact O-N 3.16Å; A950-L952 VanDerWaalsContact C-N 3.31Å; A950-L952 PolarHBondContact O-N 2.89Å; L952-L954 VanDerWaalsContact C-N 3.29Å; L952-L954 HydrophobicContact CB-CD1 4.22Å; L952-L954 HydrophobicContact CB-CG 4.04Å; L952-L954 HydrophobicContact CD1-CD1 4.27Å
953	G	97	Very high	97.3	Very high	67 Å²	67	62.1 Å²	62.1	69%	0.691	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.7	21.7	-175.3	0	0	0	0	0	113.5	E949 A950 K951	E949-G953 PolarHBondContact O-N 3.11Å; E949-G953 VanDerWaalsContact O-N 3.08Å; A950-G953 PolarHBondContact O-N 3.33Å; K951-G953 VanDerWaalsContact C-N 3.33Å
954	L	96.6	Very high	97	Very high	62 Å²	62	63.3 Å²	63.3	33%	0.325	37%	0.366	S	S	.	.	P	Polyproline II helix	trans	-83.7	155.1	171.1	-59.8	177	0	0	0	109.8	T819 E949 L952 I956	T819-L954 HydrophobicContact CG2-CD1 4.09Å; E949-L954 HydrophobicContact CB-CB 4.15Å; E949-L954 PolarHBondContact O-N 3.13Å; L952-L954 VanDerWaalsContact C-N 3.29Å; L952-L954 HydrophobicContact CB-CD1 4.22Å; L952-L954 HydrophobicContact CB-CG 4.04Å; L952-L954 HydrophobicContact CD1-CD1 4.27Å; L954-I956 PolarHBondContact O-N 2.65Å
955	P	97.2	Very high	96.6	Very high	118 Å²	118	62.8 Å²	62.8	77%	0.766	37%	0.369	S	S	*	.	P	Polyproline II helix	trans	-58.2	134.3	163	-17.8	31.4	0	0	0	109.4
956	I	97.5	Very high	96.3	Very high	60 Å²	60	67.3 Å²	67.3	31%	0.308	39%	0.39	S	S	.	.	P	Polyproline II helix	trans	-67.5	134	173.8	-57.3	172.6	0	0	0	108.5	E949 A950 L954 M960 D961	E949-I956 WeakPolarHBondContact OE2-CA 3.28Å; A950-I956 HydrophobicContact CB-CD1 4.05Å; A950-I956 HydrophobicContact CB-CG1 4.11Å; L954-I956 PolarHBondContact O-N 2.65Å; I956-M960 HydrophobicContact CG2-CB 4.05Å; I956-D961 HydrophobicContact CD1-CB 4.26Å; I956-D961 HydrophobicContact CG2-CB 3.9Å
957	S	96.6	Very high	96.1	Very high	33 Å²	33	70 Å²	70	23%	0.231	40%	0.404	C	S	.	.	P	Polyproline II helix	trans	-63.3	149.5	178.9	-75.5	0	0	0	0	111.6	E949 F959 M960	E949-S957 WeakPolarHBondContact OE1-CB 3.48Å; E949-S957 PolarHBondContact OE1-OG 2.98Å; E949-S957 WeakPolarHBondContact OE2-CB 3.14Å; E949-S957 PolarHBondContact OE2-N 2.64Å; E949-S957 PolarHBondContact OE2-OG 3.34Å; S957-F959 PolarHBondContact O-N 3.47Å; S957-M960 WeakPolarHBondContact O-CB 3.43Å; S957-M960 PolarHBondContact O-N 3.31Å
958	P	96	Very high	96	Very high	81 Å²	81	67.4 Å²	67.4	53%	0.526	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.3	138.7	176.6	-27.3	35.4	0	0	0	112.2	C291 M960	C291-P958 HydrophobicContact CB-CG 4.41Å; P958-M960 WeakPolarHBondContact O-CG 3.37Å; P958-M960 PolarHBondContact O-N 2.99Å; P958-M960 VanDerWaalsContact O-N 3.11Å
959	F	96.1	Very high	95.8	Very high	62 Å²	62	69.7 Å²	69.7	27%	0.272	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.2	-0.2	-176.3	-41.8	-79.1	0	0	0	116.2	S957 Q966 K969 L970	S957-F959 PolarHBondContact O-N 3.47Å; F959-Q966 HydrophobicContact CD1-CB 3.93Å; F959-Q966 HydrophobicContact CE1-CB 4.26Å; F959-K969 HydrophobicContact CE1-CB 4.33Å; F959-K969 HydrophobicContact CE1-CG 4.16Å; F959-L970 HydrophobicContact CB-CB 4.26Å; F959-L970 HydrophobicContact CB-CD1 4.12Å; F959-L970 HydrophobicContact CB-CD2 4.16Å; F959-L970 HydrophobicContact CB-CG 4.41Å; F959-L970 HydrophobicContact CD1-CB 3.67Å; F959-L970 HydrophobicContact CD1-CD1 4.41Å; F959-L970 HydrophobicContact CD2-CD1 3.83Å; F959-L970 HydrophobicContact CE1-CB 4.13Å; F959-L970 HydrophobicContact CE2-CD1 4.34Å; F959-L970 HydrophobicContact CG-CB 3.93Å; F959-L970 HydrophobicContact CG-CD1 3.87Å; F959-L970 HydrophobicContact CG-CG 4.34Å
960	M	97.9	Very high	95.6	Very high	14 Å²	14	70.4 Å²	70.4	7%	0.069	40%	0.403	C	S	.	.			trans	-96.9	0.1	-177	-53.3	-151.9	177.5	0	0	114.4	T812 F942 Q945 I956 S957 P958 R962	T812-M960 HydrophobicContact CG2-CE 4.08Å; F942-M960 HydrophobicContact CB-CB 4.42Å; F942-M960 HydrophobicContact CB-CE 4.36Å; F942-M960 HydrophobicContact CB-CG 3.92Å; F942-M960 HydrophobicContact CB-SD 4.15Å; F942-M960 HydrophobicContact CD1-CE 3.81Å; F942-M960 HydrophobicContact CD2-CE 4Å; F942-M960 HydrophobicContact CD2-CG 4.3Å; F942-M960 HydrophobicContact CE1-CE 4.04Å; F942-M960 HydrophobicContact CE2-CE 4.22Å; F942-M960 HydrophobicContact CG-CE 3.79Å; F942-M960 HydrophobicContact CG-CG 4.2Å; F942-M960 HydrophobicContact CG-SD 4.24Å; F942-M960 HydrophobicContact CZ-CE 4.24Å; F942-M960 WeakPolarHBondContact O-CB 3.42Å; Q945-M960 HydrophobicContact CB-SD 3.88Å; Q945-M960 VanDerWaalsContact CD-SD 3.54Å; Q945-M960 HydrophobicContact CG-SD 3.91Å; Q945-M960 PolarHBondContact NE2-SD 3.2Å; I956-M960 HydrophobicContact CG2-CB 4.05Å; S957-M960 WeakPolarHBondContact O-CB 3.43Å; S957-M960 PolarHBondContact O-N 3.31Å; P958-M960 WeakPolarHBondContact O-CG 3.37Å; P958-M960 PolarHBondContact O-N 2.99Å; P958-M960 VanDerWaalsContact O-N 3.11Å; M960-R962 PolarHBondContact O-N 3.46Å
961	D	96.9	Very high	95.6	Very high	49 Å²	49	68.1 Å²	68.1	26%	0.262	38%	0.383	S	S	.	.			trans	-88.2	106.5	176.1	-169.7	-17.5	0	0	0	111.6	I956 S963 A964	I956-D961 HydrophobicContact CD1-CB 4.26Å; I956-D961 HydrophobicContact CG2-CB 3.9Å; D961-S963 PolarHBondContact O-N 3.33Å; D961-S963 WeakPolarHBondContact OD1-CA 3.4Å; D961-S963 VanDerWaalsContact OD1-CB 3.31Å; D961-S963 WeakPolarHBondContact OD1-CB 3.48Å; D961-S963 PolarHBondContact OD1-N 3.43Å; D961-S963 PolarHBondContact OD1-OG 3.12Å; D961-S963 PolarHBondContact OD2-OG 3.07Å; D961-A964 HydrophobicContact CB-CB 4.46Å; D961-A964 CarbonylContact O-C 3.48Å; D961-A964 VanDerWaalsContact O-C 3.3Å; D961-A964 PolarHBondContact O-N 2.96Å; D961-A964 VanDerWaalsContact O-N 3.15Å
962	R	95.7	Very high	95.6	Very high	110 Å²	110	62.2 Å²	62.2	42%	0.415	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-12.3	176.5	69.2	169.2	81.7	-115.5	10.1	114.6	Y943 D947 M960	Y943-R962 HydrophobicContact CD1-CB 3.74Å; Y943-R962 HydrophobicContact CD2-CB 4.04Å; Y943-R962 HydrophobicContact CE1-CB 4.26Å; Y943-R962 HydrophobicContact CG-CB 3.64Å; Y943-R962 PolarHBondContact O-NH2 3.21Å; D947-R962 VanDerWaalsContact CG-NE 3.3Å; D947-R962 VanDerWaalsContact CG-NH2 3.31Å; D947-R962 IonicContact OD1-CZ 3.92Å; D947-R962 IonicContact OD1-NE 3.61Å; D947-R962 PolarHBondContact OD1-NE 3.44Å; D947-R962 IonicContact OD1-NH2 2.04Å; D947-R962 IonicContact OD2-CZ 3.17Å; D947-R962 IonicContact OD2-NE 3.64Å; D947-R962 PolarHBondContact OD2-NE 2.65Å; D947-R962 IonicContact OD2-NH2 3.19Å; D947-R962 PolarHBondContact OD2-NH2 3.49Å; M960-R962 PolarHBondContact O-N 3.46Å
963	S	94.4	Very high	95.5	Very high	101 Å²	101	59.2 Å²	59.2	71%	0.706	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.2	-17.3	175.5	76.2	0	0	0	0	113.4	D961 P965	D961-S963 PolarHBondContact O-N 3.33Å; D961-S963 WeakPolarHBondContact OD1-CA 3.4Å; D961-S963 VanDerWaalsContact OD1-CB 3.31Å; D961-S963 WeakPolarHBondContact OD1-CB 3.48Å; D961-S963 PolarHBondContact OD1-N 3.43Å; D961-S963 PolarHBondContact OD1-OG 3.12Å; D961-S963 PolarHBondContact OD2-OG 3.07Å; S963-P965 VanDerWaalsContact C-CD 3.49Å
964	A	90.5	Very high	95.5	Very high	53 Å²	53	58.3 Å²	58.3	44%	0.438	32%	0.322	S	S	.	.	S	Bend	trans	-132.9	57.9	175.9	0	0	0	0	0	111.5	D961	D961-A964 HydrophobicContact CB-CB 4.46Å; D961-A964 CarbonylContact O-C 3.48Å; D961-A964 VanDerWaalsContact O-C 3.3Å; D961-A964 PolarHBondContact O-N 2.96Å; D961-A964 VanDerWaalsContact O-N 3.15Å
965	P	91.4	Very high	95.6	Very high	73 Å²	73	55.4 Å²	55.4	47%	0.474	31%	0.307	S	S	.	.			trans	-64.8	142	-173.4	29.1	-36.9	0	0	0	112.1	Y943 S963	Y943-P965 WeakPolarHBondContact OH-CB 3.42Å; S963-P965 VanDerWaalsContact C-CD 3.49Å
966	Q	92.2	Very high	95.6	Very high	96 Å²	96	52 Å²	52	45%	0.449	28%	0.284	S	S	.	.			trans	-131.6	49.2	177.1	-66.2	-177.7	26.5	0	0	110.2	F959 A968 K969 L970	F959-Q966 HydrophobicContact CD1-CB 3.93Å; F959-Q966 HydrophobicContact CE1-CB 4.26Å; Q966-A968 PolarHBondContact O-N 3.23Å; Q966-K969 HydrophobicContact CB-CB 4.45Å; Q966-K969 PolarHBondContact O-N 3.42Å; Q966-L970 PolarHBondContact O-N 2.94Å
967	L	93.9	Very high	95.6	Very high	57 Å²	57	52.8 Å²	52.8	30%	0.298	29%	0.286	S	S	.	.	H	α-helix	trans	-57.4	-49	-170	170.1	61.2	0	0	0	113.1	T935 V939 K969 L970 Q971 W1053	T935-L967 HydrophobicContact CG2-CD1 3.52Å; V939-L967 HydrophobicContact CG1-CD1 3.76Å; L967-K969 VanDerWaalsContact C-N 3.31Å; L967-K969 PolarHBondContact O-N 2.92Å; L967-L970 WeakPolarHBondContact O-CB 3.32Å; L967-L970 PolarHBondContact O-N 2.86Å; L967-Q971 HydrophobicContact CD1-CG 3.97Å; L967-Q971 PolarHBondContact O-N 3.31Å; L967-Q971 VanDerWaalsContact O-N 3.07Å; L967-W1053 HydrophobicContact CD1-CH2 4.35Å; L967-W1053 HydrophobicContact CD2-CH2 4.1Å; L967-W1053 HydrophobicContact CD2-CZ3 4.16Å; L967-W1053 HydrophobicContact CG-CH2 4.07Å; L967-W1053 HydrophobicContact CG-CZ3 3.94Å
968	A	94.8	Very high	95.6	Very high	1 Å²	1	52.6 Å²	52.6	1%	0.008	28%	0.283	C	S	.	.	H	α-helix	trans	-64.2	-39.2	-176.8	0	0	0	0	0	111.8	Q966 Q971 E972 W1053 I1056 I1057	Q966-A968 PolarHBondContact O-N 3.23Å; A968-Q971 PolarHBondContact O-N 3.33Å; A968-E972 WeakPolarHBondContact O-CB 3.48Å; A968-E972 PolarHBondContact O-N 3.33Å; A968-W1053 HydrophobicContact CB-CE3 3.87Å; A968-W1053 HydrophobicContact CB-CZ3 4.43Å; A968-I1056 HydrophobicContact CB-CB 4.05Å; A968-I1056 HydrophobicContact CB-CG2 3.6Å; A968-I1057 HydrophobicContact CB-CG1 3.76Å
969	K	95	Very high	95.7	Very high	115 Å²	115	48.8 Å²	48.8	50%	0.5	26%	0.258	S	S	.	.	H	α-helix	trans	-67.9	-36.7	175.1	-172.6	173.1	-177.4	172.9	0	113.3	F959 Q966 L967 S973	F959-K969 HydrophobicContact CE1-CB 4.33Å; F959-K969 HydrophobicContact CE1-CG 4.16Å; Q966-K969 HydrophobicContact CB-CB 4.45Å; Q966-K969 PolarHBondContact O-N 3.42Å; L967-K969 VanDerWaalsContact C-N 3.31Å; L967-K969 PolarHBondContact O-N 2.92Å; K969-S973 WeakPolarHBondContact O-CB 3.42Å; K969-S973 PolarHBondContact O-N 3.06Å; K969-S973 VanDerWaalsContact O-N 3.09Å
970	L	95	Very high	95.8	Very high	21 Å²	21	46.3 Å²	46.3	11%	0.11	25%	0.25	C	C	.	.	H	α-helix	trans	-58.7	-49.8	172	171	62.5	0	0	0	110.4	V939 F942 F959 Q966 L967 F974	V939-L970 HydrophobicContact CG1-CD2 3.79Å; F942-L970 HydrophobicContact CD2-CD2 4.2Å; F942-L970 HydrophobicContact CE2-CD1 4.25Å; F942-L970 HydrophobicContact CE2-CD2 4.08Å; F959-L970 HydrophobicContact CB-CB 4.26Å; F959-L970 HydrophobicContact CB-CD1 4.12Å; F959-L970 HydrophobicContact CB-CD2 4.16Å; F959-L970 HydrophobicContact CB-CG 4.41Å; F959-L970 HydrophobicContact CD1-CB 3.67Å; F959-L970 HydrophobicContact CD1-CD1 4.41Å; F959-L970 HydrophobicContact CD2-CD1 3.83Å; F959-L970 HydrophobicContact CE1-CB 4.13Å; F959-L970 HydrophobicContact CE2-CD1 4.34Å; F959-L970 HydrophobicContact CG-CB 3.93Å; F959-L970 HydrophobicContact CG-CD1 3.87Å; F959-L970 HydrophobicContact CG-CG 4.34Å; Q966-L970 PolarHBondContact O-N 2.94Å; L967-L970 WeakPolarHBondContact O-CB 3.32Å; L967-L970 PolarHBondContact O-N 2.86Å; L970-F974 VanDerWaalsContact O-CB 3.23Å; L970-F974 WeakPolarHBondContact O-CB 3.48Å; L970-F974 PolarHBondContact O-N 2.76Å
971	Q	97.4	Very high	95.8	Very high	6 Å²	6	47.6 Å²	47.6	3%	0.028	26%	0.259	C	S	.	.	H	α-helix	trans	-72.9	-42.7	-174.3	-67.3	-61.8	-34.9	0	0	112.7	H931 T935 L967 A968 F974 I975 W1053	H931-Q971 PolarHBondContact CE1-OE1 3.48Å; H931-Q971 VanDerWaalsContact CE1-OE1 3.3Å; T935-Q971 HydrophobicContact CG2-CG 4.03Å; L967-Q971 HydrophobicContact CD1-CG 3.97Å; L967-Q971 PolarHBondContact O-N 3.31Å; L967-Q971 VanDerWaalsContact O-N 3.07Å; A968-Q971 PolarHBondContact O-N 3.33Å; Q971-F974 PolarHBondContact O-N 3.1Å; Q971-I975 WeakPolarHBondContact O-CB 3.33Å; Q971-I975 WeakPolarHBondContact O-CD1 3.39Å; Q971-I975 VanDerWaalsContact O-CG1 3.22Å; Q971-I975 WeakPolarHBondContact O-CG1 3.47Å; Q971-I975 PolarHBondContact O-N 2.82Å; Q971-W1053 HydrophobicContact CB-CD2 3.63Å; Q971-W1053 HydrophobicContact CB-CE3 4.29Å; Q971-W1053 HydrophobicContact CB-CG 3.72Å; Q971-W1053 HydrophobicContact CB-CZ2 4.15Å; Q971-W1053 HydrophobicContact CG-CD2 4.23Å; Q971-W1053 HydrophobicContact CG-CH2 4.29Å; Q971-W1053 HydrophobicContact CG-CZ2 3.86Å
972	E	97.1	Very high	95.8	Very high	32 Å²	32	45.4 Å²	45.4	15%	0.15	25%	0.248	C	C	.	.	H	α-helix	trans	-59.5	-48.4	173.5	-171.3	-76	149.1	0	0	111.2	A968 F974 I975 T976 H1050 W1053 K1054 I1057	A968-E972 WeakPolarHBondContact O-CB 3.48Å; A968-E972 PolarHBondContact O-N 3.33Å; E972-F974 PolarHBondContact O-N 3.37Å; E972-I975 PolarHBondContact O-N 3.46Å; E972-T976 WeakPolarHBondContact O-CB 3.47Å; E972-T976 PolarHBondContact O-N 3.09Å; E972-T976 PolarHBondContact O-OG1 2.85Å; E972-T976 PolarHBondContact OE1-OG1 2.97Å; E972-H1050 IonicContact OE1-NE2 2.65Å; E972-W1053 HydrophobicContact CB-CB 4.21Å; E972-K1054 HydrophobicContact CG-CD 4.33Å; E972-K1054 HydrophobicContact CG-CG 3.67Å; E972-K1054 WeakPolarHBondContact OE1-CE 3.45Å; E972-K1054 IonicContact OE1-NZ 3.31Å; E972-K1054 PolarHBondContact OE1-NZ 3.44Å; E972-I1057 HydrophobicContact CB-CD1 3.61Å; E972-I1057 HydrophobicContact CG-CD1 3.92Å
973	S	96.4	Very high	95.9	Very high	33 Å²	33	40.2 Å²	40.2	23%	0.231	23%	0.228	C	C	.	.	H	α-helix	trans	-66.8	-36.8	-177.7	-168.3	0	0	0	0	112.3	K969 H977	K969-S973 WeakPolarHBondContact O-CB 3.42Å; K969-S973 PolarHBondContact O-N 3.06Å; K969-S973 VanDerWaalsContact O-N 3.09Å; S973-H977 WeakPolarHBondContact O-CB 3.48Å; S973-H977 PolarHBondContact O-CD2 3.29Å; S973-H977 VanDerWaalsContact O-CD2 3.24Å; S973-H977 PolarHBondContact O-N 3.18Å; S973-H977 PolarHBondContact OG-CD2 3.25Å; S973-H977 VanDerWaalsContact OG-CD2 3.31Å
974	F	97.6	Very high	96	Very high	47 Å²	47	39.7 Å²	39.7	21%	0.206	22%	0.217	C	C	.	.	H	α-helix	trans	-67.1	-41	174.9	-174.7	-111.9	0	0	0	112.4	I921 P924 L970 Q971 E972 I978 V979	I921-F974 HydrophobicContact CB-CE1 4.3Å; I921-F974 HydrophobicContact CB-CZ 3.93Å; I921-F974 HydrophobicContact CG2-CZ 3.92Å; P924-F974 HydrophobicContact CG-CD1 4.31Å; P924-F974 HydrophobicContact CG-CE1 4.39Å; L970-F974 VanDerWaalsContact O-CB 3.23Å; L970-F974 WeakPolarHBondContact O-CB 3.48Å; L970-F974 PolarHBondContact O-N 2.76Å; Q971-F974 PolarHBondContact O-N 3.1Å; E972-F974 PolarHBondContact O-N 3.37Å; F974-I978 HydrophobicContact CD2-CB 4.02Å; F974-I978 HydrophobicContact CD2-CG1 3.82Å; F974-I978 HydrophobicContact CE2-CB 4Å; F974-I978 HydrophobicContact CE2-CG1 4.09Å; F974-I978 HydrophobicContact CE2-CG2 4Å; F974-I978 HydrophobicContact CZ-CG2 4.49Å; F974-I978 WeakPolarHBondContact O-CA 3.38Å; F974-I978 WeakPolarHBondContact O-CB 3.41Å; F974-I978 PolarHBondContact O-N 3.4Å; F974-V979 HydrophobicContact CD1-CG2 3.67Å; F974-V979 HydrophobicContact CE1-CG2 3.41Å; F974-V979 VanDerWaalsContact CE1-CG2 3.41Å; F974-V979 HydrophobicContact CG-CG2 4.48Å; F974-V979 HydrophobicContact CZ-CG2 4.05Å; F974-V979 PolarHBondContact O-N 3.29Å; F974-V979 VanDerWaalsContact O-N 3.11Å
975	I	98	Very high	96.2	Very high	2 Å²	2	37.7 Å²	37.7	1%	0.01	20%	0.2	C	C	.	.	I	π-helix	trans	-66	-50.4	174.2	-67.4	164.1	0	0	0	110.4	P924 Q971 E972 H977 G980 L1046 H1050	P924-I975 HydrophobicContact CB-CD1 3.92Å; P924-I975 HydrophobicContact CB-CG1 3.67Å; P924-I975 HydrophobicContact CG-CG1 4.08Å; Q971-I975 WeakPolarHBondContact O-CB 3.33Å; Q971-I975 WeakPolarHBondContact O-CD1 3.39Å; Q971-I975 VanDerWaalsContact O-CG1 3.22Å; Q971-I975 WeakPolarHBondContact O-CG1 3.47Å; Q971-I975 PolarHBondContact O-N 2.82Å; E972-I975 PolarHBondContact O-N 3.46Å; I975-H977 PolarHBondContact O-N 3.26Å; I975-G980 WeakPolarHBondContact O-CA 3.33Å; I975-G980 PolarHBondContact O-N 3.38Å; I975-L1046 HydrophobicContact CG1-CD1 4.5Å; I975-L1046 HydrophobicContact CG2-CD1 3.89Å; I975-H1050 HydrophobicContact CD1-CB 4.47Å; I975-H1050 HydrophobicContact CG2-CB 3.94Å
976	T	97.6	Very high	96.4	Very high	45 Å²	45	34.2 Å²	34.2	28%	0.276	18%	0.177	S	C	.	.	I	π-helix	trans	-65	-33.8	-175.6	-69.7	0	0	0	0	113.2	E972 H1050	E972-T976 WeakPolarHBondContact O-CB 3.47Å; E972-T976 PolarHBondContact O-N 3.09Å; E972-T976 PolarHBondContact O-OG1 2.85Å; E972-T976 PolarHBondContact OE1-OG1 2.97Å; T976-H1050 PolarHBondContact OG1-CE1 3.4Å; T976-H1050 VanDerWaalsContact OG1-CE1 3.28Å; T976-H1050 PolarHBondContact OG1-NE2 3.48Å; T976-H1050 VanDerWaalsContact OG1-NE2 3.13Å
977	H	96	Very high	96.5	Very high	77 Å²	77	32 Å²	32	36%	0.356	17%	0.169	S	C	.	.	I	π-helix	trans	-108.9	-18.2	-174.3	-56.6	-48.5	0	0	0	116.2	S973 I975	S973-H977 WeakPolarHBondContact O-CB 3.48Å; S973-H977 PolarHBondContact O-CD2 3.29Å; S973-H977 VanDerWaalsContact O-CD2 3.24Å; S973-H977 PolarHBondContact O-N 3.18Å; S973-H977 PolarHBondContact OG-CD2 3.25Å; S973-H977 VanDerWaalsContact OG-CD2 3.31Å; I975-H977 PolarHBondContact O-N 3.26Å
978	I	97.8	Very high	96.4	Very high	30 Å²	30	32 Å²	32	15%	0.154	18%	0.177	C	C	.	.	I	π-helix	trans	-121.7	-59.9	-175	-46	-65.4	0	0	0	111.3	L878 H881 F882 I921 F974 L982	L878-I978 HydrophobicContact CD2-CG2 4.46Å; H881-I978 WeakPolarHBondContact CE1-CG2 3.48Å; H881-I978 PolarHBondContact CE1-O 2.63Å; H881-I978 VanDerWaalsContact CE1-O 3.3Å; H881-I978 PolarHBondContact NE2-O 3.2Å; F882-I978 HydrophobicContact CE2-CD1 4.34Å; F882-I978 HydrophobicContact CZ-CD1 3.87Å; I921-I978 HydrophobicContact CD1-CG2 3.7Å; F974-I978 HydrophobicContact CD2-CB 4.02Å; F974-I978 HydrophobicContact CD2-CG1 3.82Å; F974-I978 HydrophobicContact CE2-CB 4Å; F974-I978 HydrophobicContact CE2-CG1 4.09Å; F974-I978 HydrophobicContact CE2-CG2 4Å; F974-I978 HydrophobicContact CZ-CG2 4.49Å; F974-I978 WeakPolarHBondContact O-CA 3.38Å; F974-I978 WeakPolarHBondContact O-CB 3.41Å; F974-I978 PolarHBondContact O-N 3.4Å; I978-L982 WeakPolarHBondContact O-CB 3.26Å; I978-L982 PolarHBondContact O-N 2.99Å
979	V	98.3	Very high	96.3	Very high	1 Å²	1	33 Å²	33	1%	0.006	19%	0.186	C	C	.	.	I	π-helix	trans	-74.8	-45.9	-173	-168.7	0	0	0	0	111.8	I921 P924 F974 L982 C983 L1046	I921-V979 HydrophobicContact CB-CG2 4.42Å; I921-V979 HydrophobicContact CD1-CB 4.46Å; I921-V979 HydrophobicContact CD1-CG2 3.93Å; I921-V979 HydrophobicContact CG1-CG2 4.07Å; P924-V979 HydrophobicContact CG-CG2 4.18Å; F974-V979 HydrophobicContact CD1-CG2 3.67Å; F974-V979 HydrophobicContact CE1-CG2 3.41Å; F974-V979 VanDerWaalsContact CE1-CG2 3.41Å; F974-V979 HydrophobicContact CG-CG2 4.48Å; F974-V979 HydrophobicContact CZ-CG2 4.05Å; F974-V979 PolarHBondContact O-N 3.29Å; F974-V979 VanDerWaalsContact O-N 3.11Å; V979-L982 PolarHBondContact O-N 2.58Å; V979-C983 WeakPolarHBondContact O-CB 3.2Å; V979-C983 PolarHBondContact O-N 3.19Å; V979-C983 PolarHBondContact O-SG 2.81Å; V979-L1046 HydrophobicContact CB-CD1 4.14Å; V979-L1046 HydrophobicContact CG1-CD1 3.61Å; V979-L1046 HydrophobicContact CG1-CD2 4.3Å
980	G	97.6	Very high	96.1	Very high	10 Å²	10	29.2 Å²	29.2	10%	0.103	18%	0.179	C	C	.	.	H	α-helix	trans	-56.1	-57.5	178.1	0	0	0	0	0	113.1	I975 L982 C983 N984	I975-G980 WeakPolarHBondContact O-CA 3.33Å; I975-G980 PolarHBondContact O-N 3.38Å; G980-L982 VanDerWaalsContact C-N 3.27Å; G980-L982 PolarHBondContact O-N 3.26Å; G980-C983 PolarHBondContact O-N 2.76Å; G980-N984 VanDerWaalsContact O-CB 3.28Å; G980-N984 WeakPolarHBondContact O-CB 3.39Å; G980-N984 PolarHBondContact O-N 2.98Å; G980-N984 PolarHBondContact O-OD1 3.13Å
981	P	97.8	Very high	96.1	Very high	40 Å²	40	28.3 Å²	28.3	26%	0.26	17%	0.174	S	C	.	.	H	α-helix	trans	-57.5	-36.6	178.2	-28.2	37.6	0	0	0	113.8	L885 S985	L885-P981 HydrophobicContact CD2-CB 3.74Å; P981-S985 WeakPolarHBondContact O-CB 3.3Å; P981-S985 PolarHBondContact O-N 3.22Å; P981-S985 VanDerWaalsContact O-N 3.09Å; P981-S985 PolarHBondContact O-OG 3.02Å
982	L	97.9	Very high	96	Very high	4 Å²	4	28.2 Å²	28.2	2%	0.021	17%	0.174	C	C	.	.	H	α-helix	trans	-67.6	-52.9	177	-175.5	65.1	0	0	0	112.1	L885 V914 K917 L918 I921 I978 V979 G980 N984 S985 Y986	L885-L982 HydrophobicContact CD1-CD1 4.01Å; V914-L982 HydrophobicContact CG1-CD1 3.88Å; K917-L982 HydrophobicContact CB-CD2 4.22Å; L918-L982 HydrophobicContact CB-CD2 4.03Å; L918-L982 HydrophobicContact CB-CG 4.41Å; L918-L982 HydrophobicContact CG-CD2 4.49Å; I921-L982 HydrophobicContact CD1-CD2 3.68Å; I921-L982 HydrophobicContact CG1-CD2 4.19Å; I978-L982 WeakPolarHBondContact O-CB 3.26Å; I978-L982 PolarHBondContact O-N 2.99Å; V979-L982 PolarHBondContact O-N 2.58Å; G980-L982 VanDerWaalsContact C-N 3.27Å; G980-L982 PolarHBondContact O-N 3.26Å; L982-N984 PolarHBondContact O-N 3.35Å; L982-S985 PolarHBondContact O-N 2.9Å; L982-Y986 WeakPolarHBondContact O-CB 3.4Å; L982-Y986 PolarHBondContact O-N 3.13Å
983	C	97.6	Very high	96	Very high	1 Å²	1	26.9 Å²	26.9	1%	0.007	17%	0.168	C	C	.	.	H	α-helix	trans	-62	-43.3	178.4	-70	0	0	0	0	111.7	V979 G980 S985 Y986 D987 M1043 L1046	V979-C983 WeakPolarHBondContact O-CB 3.2Å; V979-C983 PolarHBondContact O-N 3.19Å; V979-C983 PolarHBondContact O-SG 2.81Å; G980-C983 PolarHBondContact O-N 2.76Å; C983-S985 VanDerWaalsContact C-N 3.31Å; C983-S985 PolarHBondContact O-N 2.65Å; C983-Y986 PolarHBondContact O-N 3.5Å; C983-D987 VanDerWaalsContact O-CB 3.32Å; C983-D987 WeakPolarHBondContact O-CB 3.41Å; C983-D987 PolarHBondContact O-N 3.08Å; C983-M1043 HydrophobicContact CB-CE 4.14Å; C983-L1046 HydrophobicContact CB-CD2 3.6Å
984	N	95.6	Very high	95.8	Very high	89 Å²	89	26.2 Å²	26.2	48%	0.476	17%	0.166	S	C	.	.	H	α-helix	trans	-61.6	-39	177.3	-67.5	-1.7	0	0	0	112	G980 L982 A988 M1043	G980-N984 VanDerWaalsContact O-CB 3.28Å; G980-N984 WeakPolarHBondContact O-CB 3.39Å; G980-N984 PolarHBondContact O-N 2.98Å; G980-N984 PolarHBondContact O-OD1 3.13Å; L982-N984 PolarHBondContact O-N 3.35Å; N984-A988 VanDerWaalsContact O-CB 3.27Å; N984-A988 WeakPolarHBondContact O-CB 3.39Å; N984-A988 PolarHBondContact O-N 2.97Å; N984-M1043 WeakPolarHBondContact OD1-CE 3.46Å
985	S	95.4	Very high	95.4	Very high	11 Å²	11	28.1 Å²	28.1	8%	0.077	18%	0.175	C	C	.	.	H	α-helix	trans	-68.8	-37.3	177.3	-56.5	0	0	0	0	111.7	L885 F888 N889 P981 L982 C983 A989	L885-S985 WeakPolarHBondContact CD1-OG 3.41Å; F888-S985 WeakPolarHBondContact CE1-O 3.28Å; N889-S985 PolarHBondContact ND2-OG 3.09Å; N889-S985 PolarHBondContact OD1-OG 3.11Å; P981-S985 WeakPolarHBondContact O-CB 3.3Å; P981-S985 PolarHBondContact O-N 3.22Å; P981-S985 VanDerWaalsContact O-N 3.09Å; P981-S985 PolarHBondContact O-OG 3.02Å; L982-S985 PolarHBondContact O-N 2.9Å; C983-S985 VanDerWaalsContact C-N 3.31Å; C983-S985 PolarHBondContact O-N 2.65Å; S985-A989 WeakPolarHBondContact O-CB 3.45Å; S985-A989 PolarHBondContact O-N 3.26Å; S985-A989 VanDerWaalsContact O-N 3.12Å
986	Y	96.2	Very high	94.9	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-77.1	-29.1	179.7	-159.5	-100	0	0	0	113.1	L735 L785 F888 V914 C915 L918 L982 C983 L991 L992	L735-Y986 HydrophobicContact CD2-CE1 4.43Å; L785-Y986 VanDerWaalsContact CD1-OH 3.32Å; L785-Y986 WeakPolarHBondContact CD1-OH 3.32Å; F888-Y986 HydrophobicContact CE1-CD2 4.37Å; F888-Y986 HydrophobicContact CZ-CD2 4.07Å; V914-Y986 HydrophobicContact CB-CD2 4.48Å; V914-Y986 HydrophobicContact CG1-CD2 3.56Å; V914-Y986 HydrophobicContact CG1-CE2 4.07Å; C915-Y986 HydrophobicContact CB-CE2 4.47Å; L918-Y986 HydrophobicContact CD1-CD1 3.88Å; L918-Y986 HydrophobicContact CD1-CG 3.93Å; L982-Y986 WeakPolarHBondContact O-CB 3.4Å; L982-Y986 PolarHBondContact O-N 3.13Å; C983-Y986 PolarHBondContact O-N 3.5Å; Y986-L991 HydrophobicContact CD1-CB 3.83Å; Y986-L991 HydrophobicContact CD2-CB 4.25Å; Y986-L991 HydrophobicContact CD2-CD1 4.03Å; Y986-L991 HydrophobicContact CE1-CB 3.54Å; Y986-L991 VanDerWaalsContact CE1-O 3.25Å; Y986-L991 WeakPolarHBondContact CE1-O 3.49Å; Y986-L991 HydrophobicContact CE2-CB 4.01Å; Y986-L991 HydrophobicContact CE2-CD1 3.73Å; Y986-L991 HydrophobicContact CG-CB 4.2Å; Y986-L991 PolarHBondContact O-N 3.3Å; Y986-L992 HydrophobicContact CD1-CD2 3.63Å; Y986-L992 HydrophobicContact CD1-CG 3.95Å; Y986-L992 HydrophobicContact CE1-CD2 4.16Å
987	D	94	Very high	94.4	Very high	50 Å²	50	32.1 Å²	32.1	27%	0.267	19%	0.192	S	C	.	.	H	α-helix	trans	-70.3	-47.3	169.9	-168.7	47	0	0	0	111.3	C983 A989 G990 L992 M1043	C983-D987 VanDerWaalsContact O-CB 3.32Å; C983-D987 WeakPolarHBondContact O-CB 3.41Å; C983-D987 PolarHBondContact O-N 3.08Å; D987-A989 PolarHBondContact O-N 3.44Å; D987-G990 WeakPolarHBondContact O-CA 3.23Å; D987-G990 PolarHBondContact O-N 2.97Å; D987-L992 HydrophobicContact CB-CD1 3.67Å; D987-L992 HydrophobicContact CB-CG 4.28Å; D987-M1043 HydrophobicContact CB-CE 3.67Å
988	A	91.1	Very high	93.2	Very high	58 Å²	58	32.9 Å²	32.9	48%	0.479	20%	0.199	S	C	.	.	H	α-helix	trans	-60.1	-26.1	173.2	0	0	0	0	0	113.1	N984 G990	N984-A988 VanDerWaalsContact O-CB 3.27Å; N984-A988 WeakPolarHBondContact O-CB 3.39Å; N984-A988 PolarHBondContact O-N 2.97Å; A988-G990 PolarHBondContact O-N 3.1Å
989	A	91.8	Very high	91.1	Very high	22 Å²	22	35.7 Å²	35.7	18%	0.182	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-7.5	172.4	0	0	0	0	0	114.4	F888 V892 S985 D987 L991	F888-A989 HydrophobicContact CE1-CB 3.88Å; F888-A989 HydrophobicContact CZ-CB 3.56Å; V892-A989 HydrophobicContact CB-CB 4.32Å; V892-A989 VanDerWaalsContact CG1-CA 3.44Å; V892-A989 HydrophobicContact CG1-CB 3.65Å; V892-A989 HydrophobicContact CG2-CB 3.7Å; S985-A989 WeakPolarHBondContact O-CB 3.45Å; S985-A989 PolarHBondContact O-N 3.26Å; S985-A989 VanDerWaalsContact O-N 3.12Å; D987-A989 PolarHBondContact O-N 3.44Å; A989-L991 VanDerWaalsContact C-N 3.32Å; A989-L991 HydrophobicContact CB-CD1 3.91Å; A989-L991 HydrophobicContact CB-CG 3.69Å
990	G	92.3	Very high	88.4	Confident	34 Å²	34	40.1 Å²	40.1	35%	0.351	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	64.1	35.7	-174.6	0	0	0	0	0	112.7	I740 D987 A988	I740-G990 WeakPolarHBondContact CG2-O 3.32Å; D987-G990 WeakPolarHBondContact O-CA 3.23Å; D987-G990 PolarHBondContact O-N 2.97Å; A988-G990 PolarHBondContact O-N 3.1Å
991	L	95	Very high	85.8	Confident	2 Å²	2	48.7 Å²	48.7	1%	0.01	28%	0.279	C	S	.	.			trans	-112.8	-5.3	-176.5	-52.4	-176	0	0	0	114.2	I740 F743 L785 F888 I900 W902 V911 Y986 A989	I740-L991 WeakPolarHBondContact CD1-O 3.4Å; F743-L991 HydrophobicContact CD2-CD2 4.18Å; F743-L991 HydrophobicContact CE2-CD2 3.63Å; L785-L991 HydrophobicContact CD2-CB 4.47Å; L785-L991 HydrophobicContact CD2-CD2 3.88Å; F888-L991 HydrophobicContact CE2-CD1 4.25Å; F888-L991 HydrophobicContact CZ-CD1 3.86Å; I900-L991 HydrophobicContact CD1-CD1 3.9Å; I900-L991 HydrophobicContact CD1-CD2 4.28Å; I900-L991 HydrophobicContact CD1-CG 4.48Å; W902-L991 HydrophobicContact CH2-CD2 4.01Å; W902-L991 HydrophobicContact CZ2-CD2 3.87Å; V911-L991 HydrophobicContact CG1-CD1 4.18Å; V911-L991 HydrophobicContact CG2-CD1 4.26Å; Y986-L991 HydrophobicContact CD1-CB 3.83Å; Y986-L991 HydrophobicContact CD2-CB 4.25Å; Y986-L991 HydrophobicContact CD2-CD1 4.03Å; Y986-L991 HydrophobicContact CE1-CB 3.54Å; Y986-L991 VanDerWaalsContact CE1-O 3.25Å; Y986-L991 WeakPolarHBondContact CE1-O 3.49Å; Y986-L991 HydrophobicContact CE2-CB 4.01Å; Y986-L991 HydrophobicContact CE2-CD1 3.73Å; Y986-L991 HydrophobicContact CG-CB 4.2Å; Y986-L991 PolarHBondContact O-N 3.3Å; A989-L991 VanDerWaalsContact C-N 3.32Å; A989-L991 HydrophobicContact CB-CD1 3.91Å; A989-L991 HydrophobicContact CB-CG 3.69Å
992	L	95.9	Very high	83	Confident	5 Å²	5	51 Å²	51	3%	0.026	30%	0.297	C	S	.	.	S	Bend	trans	-77.3	131.5	173.6	-76.4	-176	0	0	0	111.2	L735 L918 Y986 D987 I1042 M1043	L735-L992 HydrophobicContact CD2-CD2 4.28Å; L918-L992 HydrophobicContact CD1-CD2 4.29Å; Y986-L992 HydrophobicContact CD1-CD2 3.63Å; Y986-L992 HydrophobicContact CD1-CG 3.95Å; Y986-L992 HydrophobicContact CE1-CD2 4.16Å; D987-L992 HydrophobicContact CB-CD1 3.67Å; D987-L992 HydrophobicContact CB-CG 4.28Å; L992-I1042 HydrophobicContact CD2-CB 4.46Å; L992-I1042 HydrophobicContact CD2-CD1 4.04Å; L992-I1042 HydrophobicContact CD2-CG2 4.21Å; L992-M1043 HydrophobicContact CD1-CE 4.17Å
993	P	95.2	Very high	80.3	Confident	4 Å²	4	57.3 Å²	57.3	3%	0.026	33%	0.33	C	S	.	.			trans	-58.9	146.6	165.5	-24.5	35	0	0	0	112.3	Y734 R738 P739 I740 S1040	Y734-P993 HydrophobicContact CD1-CG 4.41Å; Y734-P993 HydrophobicContact CE1-CB 4.2Å; Y734-P993 HydrophobicContact CE1-CG 4.33Å; R738-P993 HydrophobicContact CB-CB 3.85Å; R738-P993 HydrophobicContact CB-CG 4.07Å; P739-P993 VanDerWaalsContact O-CA 3.25Å; P739-P993 WeakPolarHBondContact O-CA 3.42Å; I740-P993 HydrophobicContact CG1-CG 4.27Å; P993-S1040 WeakPolarHBondContact O-CB 3.36Å; P993-S1040 PolarHBondContact O-OG 2.89Å
994	G	92.5	Very high	77.6	Confident	18 Å²	18	66.6 Å²	66.6	19%	0.186	37%	0.373	C	S	.	.			trans	178.6	-168.6	-172.9	0	0	0	0	0	112.7	P739 P741 F1039	P739-G994 PolarHBondContact O-N 2.73Å; P739-G994 VanDerWaalsContact O-N 3.1Å; P741-G994 VanDerWaalsContact CG-C 3.43Å; P741-G994 WeakPolarHBondContact CG-O 3.41Å; G994-F1039 CarbonylContact C-O 3.47Å; G994-F1039 WeakPolarHBondContact CA-O 3.49Å
995	H	89.5	Confident	75	Confident	87 Å²	87	71 Å²	71	40%	0.403	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	161.7	174.5	58.2	-108.1	0	0	0	113.1	Y782 F1039	Y782-H995 HydrophobicContact CE1-CB 4.47Å; Y782-H995 WeakPolarHBondContact OH-CA 3.33Å; H995-F1039 AromaticContact CE1-CD1 3.24Å; H995-F1039 WeakPolarHBondContact CE1-CD1 3.48Å; H995-F1039 AromaticContact CE1-CE1 3.67Å; H995-F1039 PolarHBondContact N-O 2.88Å; H995-F1039 AromaticContact ND1-CD1 3.88Å; H995-F1039 AromaticContact NE2-CD1 3.42Å; H995-F1039 WeakPolarHBondContact NE2-CD1 3.36Å; H995-F1039 AromaticContact NE2-CG 3.79Å; H995-F1039 PolarHBondContact O-N 2.92Å
996	W	88.7	Confident	72.3	Confident	71 Å²	71	78.4 Å²	78.4	27%	0.269	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	131.5	172.7	-62.9	118.7	0	0	0	111.4	P741 S781 Y782 R1036 L1038	P741-W996 HydrophobicContact CB-CD2 3.96Å; P741-W996 VanDerWaalsContact CB-CE2 3.48Å; P741-W996 HydrophobicContact CB-CE3 4.43Å; P741-W996 HydrophobicContact CB-CG 4.48Å; P741-W996 HydrophobicContact CB-CH2 4.07Å; P741-W996 HydrophobicContact CB-CZ2 3.56Å; P741-W996 HydrophobicContact CB-CZ3 4.48Å; S781-W996 PolarHBondContact O-NE1 3.37Å; S781-W996 PolarHBondContact OG-NE1 2.58Å; Y782-W996 AromaticContact CE2-CD1 3.82Å; Y782-W996 AromaticContact CZ-CD1 3.75Å; Y782-W996 PolarHBondContact OH-N 2.89Å; W996-R1036 HydrophobicContact CD2-CB 4.37Å; W996-R1036 HydrophobicContact CE3-CB 3.82Å; W996-R1036 HydrophobicContact CZ3-CB 4.42Å; W996-L1038 HydrophobicContact CE3-CD1 4.5Å; W996-L1038 HydrophobicContact CH2-CD1 4.4Å; W996-L1038 HydrophobicContact CZ3-CD1 4.11Å
997	V	85.3	Confident	69.5	Low	61 Å²	61	86.8 Å²	86.8	37%	0.37	48%	0.475	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	135.5	170.2	-177.2	0	0	0	0	109.6	R1037 F1039	V997-R1037 PolarHBondContact N-O 2.78Å; V997-R1037 PolarHBondContact O-N 3.26Å; V997-F1039 HydrophobicContact CG2-CB 3.68Å
998	N	71.9	Confident	66.8	Low	93 Å²	93	93.8 Å²	93.8	50%	0.497	51%	0.506	S	S	.	.			trans	-97.8	136.9	174.5	-59.5	-54	0	0	0	109.8	S1000	N998-S1000 PolarHBondContact O-N 2.98Å
999	E	54.3	Low	64.1	Low	89 Å²	89	95.6 Å²	95.6	42%	0.416	52%	0.52	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.9	49.3	-175.2	-57	172.7	120.3	0	0	112	R1037	E999-R1037 HydrophobicContact CG-CG 4.43Å; E999-R1037 IonicContact OE1-CZ 3.69Å; E999-R1037 IonicContact OE1-NE 3.67Å; E999-R1037 PolarHBondContact OE1-NE 3.29Å; E999-R1037 IonicContact OE1-NH2 3.6Å; E999-R1037 PolarHBondContact OE1-NH2 3.25Å
1000	S	41	Very low	61.3	Low	93 Å²	93	102.5 Å²	102.5	65%	0.65	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-135	6.1	-169.7	63.9	0	0	0	0	116.1	N998	N998-S1000 PolarHBondContact O-N 2.98Å
1001	E	43.9	Very low	58.6	Low	191 Å²	191	109.7 Å²	109.7	89%	0.893	57%	0.574	S	S	*	*	S	Bend	trans	-141.6	17.9	-175.3	-63.6	-175.3	154.2	0	0	113.1
1002	S	38.3	Very low	55.6	Low	89 Å²	89	115.6 Å²	115.6	62%	0.622	61%	0.605	S	S	*	*	S	Bend	trans	-122	-6.7	-171.5	50.3	0	0	0	0	116.6
1003	D	41.3	Very low	52.5	Low	136 Å²	136	120.4 Å²	120.4	73%	0.727	64%	0.635	S	S	*	*	S	Bend	trans	-123	30.7	-158.7	-63.1	28.4	0	0	0	113.2
1004	E	41.5	Very low	49.5	Very low	196 Å²	196	127.2 Å²	127.2	92%	0.916	67%	0.671	S	S	*	*	S	Bend	trans	-127.9	-2	176.7	-76.2	-166.5	-173.9	0	0	116
1005	E	40.5	Very low	46.7	Very low	181 Å²	181	135.6 Å²	135.6	85%	0.846	71%	0.705	S	S	*	*	S	Bend	trans	-137.3	90.7	176.6	-68.4	-171.8	172.2	0	0	112.2
1006	D	38.7	Very low	44	Very low	166 Å²	166	140 Å²	140	89%	0.888	73%	0.726	S	S	*	*	S	Bend	trans	178.5	-14.4	142.3	-103.1	-14.5	0	0	0	115	E1008	D1006-E1008 PolarHBondContact O-N 3.12Å
1007	D	35.8	Very low	41.3	Very low	176 Å²	176	143.6 Å²	143.6	94%	0.941	75%	0.751	S	S	*	*			trans	-83.2	63.3	-178.2	-83.2	-35.3	0	0	0	114.6
1008	E	37.4	Very low	38.9	Very low	198 Å²	198	148.2 Å²	148.2	93%	0.925	77%	0.773	S	S	*	*			trans	-131.9	71.4	164.7	-107.1	-158.9	-141	0	0	112.4	D1006	D1006-E1008 PolarHBondContact O-N 3.12Å
1009	A	35.5	Very low	37.1	Very low	95 Å²	95	152.9 Å²	152.9	79%	0.785	79%	0.792	S	S	*	*			trans	-159.8	132.6	157.8	0	0	0	0	0	114.8
1010	Q	33.2	Very low	36.1	Very low	167 Å²	167	157.3 Å²	157.3	78%	0.78	81%	0.813	S	S	*	*			trans	72.2	76.7	152.4	-147	77.9	56	0	0	118
1011	E	34.3	Very low	35.8	Very low	186 Å²	186	159.6 Å²	159.6	87%	0.869	82%	0.818	S	S	*	*			trans	-56.9	139.7	139.8	-61.5	174.7	123.1	0	0	109.3
1012	D	32.3	Very low	35.3	Very low	126 Å²	126	158.3 Å²	158.3	67%	0.674	81%	0.812	S	S	*	*			trans	-166	110.5	140.5	-116.3	-39.9	0	0	0	113.4
1013	T	31.3	Very low	35.1	Very low	106 Å²	106	161.6 Å²	161.6	65%	0.65	82%	0.821	S	S	*	*			trans	59.5	131.4	141.7	32.3	0	0	0	0	124.7
1014	D	32.8	Very low	34.5	Very low	146 Å²	146	164.6 Å²	164.6	78%	0.781	83%	0.831	S	S	*	*			trans	71.6	142.8	148.4	-48.4	-19.9	0	0	0	119.2
1015	E	32.9	Very low	34	Very low	194 Å²	194	160.9 Å²	160.9	91%	0.907	82%	0.821	S	S	*	*			cis	-128.3	-167.5	9.9	-71.7	-174.9	152.5	0	0	113.6
1016	E	32.9	Very low	33.5	Very low	180 Å²	180	158.8 Å²	158.8	84%	0.841	82%	0.816	S	S	*	*			trans	-101.4	-179.2	-154.6	-56.4	172.3	124.5	0	0	117.1
1017	D	33.1	Very low	33	Very low	147 Å²	147	158.8 Å²	158.8	79%	0.786	82%	0.815	S	S	*	*			trans	66.6	140	166	-57.1	-22.1	0	0	0	119.2
1018	D	33.3	Very low	33	Very low	158 Å²	158	154.5 Å²	154.5	85%	0.845	80%	0.804	S	S	*	*			cis	-132	164.4	18.5	-88.3	-55.3	0	0	0	113.6
1019	E	34.8	Very low	32.5	Very low	191 Å²	191	151.7 Å²	151.7	89%	0.893	80%	0.801	S	S	*	*			trans	-100.4	-167.3	176.4	-63.4	-166	133.3	0	0	114.5
1020	E	33.7	Very low	32.4	Very low	182 Å²	182	150.7 Å²	150.7	85%	0.85	80%	0.799	S	S	*	*			trans	78.5	128	171.7	-61.6	-173	-176.6	0	0	118.1
1021	D	35.3	Very low	32.3	Very low	140 Å²	140	154.1 Å²	154.1	75%	0.749	81%	0.805	S	S	*	*			cis	-165.1	176.5	-12.2	-145.4	-17.9	0	0	0	114.3
1022	E	33.4	Very low	32.2	Very low	165 Å²	165	152.1 Å²	152.1	77%	0.771	81%	0.806	S	S	*	*			trans	67.2	84.5	158.5	-64.9	-162.3	142.2	0	0	122.5
1023	L	32.4	Very low	32.4	Very low	157 Å²	157	155.8 Å²	155.8	82%	0.822	82%	0.816	S	S	*	*				33.8	122.5	112.8	-59	169.4	0	0	0	121.8
1024	E	30	Very low	32.6	Very low	199 Å²	199	153.3 Å²	153.3	93%	0.93	81%	0.811	S	S	*	*				-162.3	174.9	105.6	-132.2	-175.2	-176.6	0	0	112.1
1025	V	30.1	Very low	33.3	Very low	118 Å²	118	157.1 Å²	157.1	72%	0.715	82%	0.815	S	S	*	*			trans	-126.6	143.5	-153.9	-179.5	0	0	0	0	114.8
1026	D	29.6	Very low	34.8	Very low	137 Å²	137	154.1 Å²	154.1	73%	0.733	80%	0.795	S	S	*	*			trans	55.3	124.1	164.7	-93.8	-40.9	0	0	0	121.4
1027	L	28.7	Very low	36.7	Very low	167 Å²	167	153 Å²	153	87%	0.874	78%	0.783	S	S	*	*				-156.9	84.6	126.3	-117	173.7	0	0	0	111.8	T1029	L1027-T1029 PolarHBondContact O-N 3.03Å
1028	A	35.8	Very low	39.1	Very low	85 Å²	85	149.8 Å²	149.8	70%	0.702	77%	0.766	S	S	*	*			trans	-65.9	122.1	-178.5	0	0	0	0	0	113.7
1029	T	27.1	Very low	41.8	Very low	140 Å²	140	145.6 Å²	145.6	86%	0.859	74%	0.74	S	S	*	*			trans	-135.6	74.5	156.1	27.4	0	0	0	0	110.1	L1027 R1031	L1027-T1029 PolarHBondContact O-N 3.03Å; T1029-R1031 PolarHBondContact O-N 2.85Å
1030	G	33.4	Very low	44.5	Very low	73 Å²	73	137 Å²	137	75%	0.753	70%	0.7	S	S	*	*			trans	-65.3	117.7	-176.5	0	0	0	0	0	113.4
1031	R	30.9	Very low	47.3	Very low	240 Å²	240	129.7 Å²	129.7	91%	0.906	67%	0.669	S	S	*	*			trans	-160.4	54.8	155.7	-117.3	173.2	-173.2	-171.3	1.6	112.3	T1029 K1033	T1029-R1031 PolarHBondContact O-N 2.85Å; R1031-K1033 PolarHBondContact O-N 3.27Å
1032	T	32	Very low	50.2	Low	144 Å²	144	123 Å²	123	88%	0.883	63%	0.634	S	S	*	*			trans	-54.2	107.9	158.5	25.3	0	0	0	0	108.7	G1034	T1032-G1034 PolarHBondContact O-N 3.17Å; T1032-G1034 VanDerWaalsContact O-N 3.12Å
1033	K	36.9	Very low	53.2	Low	203 Å²	203	116.9 Å²	116.9	88%	0.883	61%	0.605	S	S	*	*			trans	-67.9	107.4	166.3	-84.9	-173.7	170.8	-174.7	0	107.3	R1031 R1035	R1031-K1033 PolarHBondContact O-N 3.27Å; K1033-R1035 PolarHBondContact O-N 3.33Å
1034	G	35.1	Very low	56.3	Low	54 Å²	54	112.7 Å²	112.7	56%	0.557	58%	0.582	S	S	*	*			trans	-49.3	127.9	172.7	0	0	0	0	0	110.4	T1032 R1036	T1032-G1034 PolarHBondContact O-N 3.17Å; T1032-G1034 VanDerWaalsContact O-N 3.12Å; G1034-R1036 PolarHBondContact O-N 3.32Å; G1034-R1036 VanDerWaalsContact O-N 3.1Å
1035	R	48.6	Very low	59.5	Low	225 Å²	225	104.6 Å²	104.6	85%	0.849	54%	0.544	S	S	*	.			trans	-87.1	83.9	-173.5	-173.9	-177.8	-176.8	-174.8	0.1	107.6	K1033 R1037	K1033-R1035 PolarHBondContact O-N 3.33Å; R1035-R1037 PolarHBondContact O-N 3.03Å; R1035-R1037 VanDerWaalsContact O-N 3.13Å
1036	R	64	Low	62.7	Low	131 Å²	131	99.3 Å²	99.3	49%	0.494	51%	0.512	S	S	.	.			trans	-32.3	117.6	177.6	-75.1	-176.3	174.3	178.8	0.2	110.5	W996 G1034	W996-R1036 HydrophobicContact CD2-CB 4.37Å; W996-R1036 HydrophobicContact CE3-CB 3.82Å; W996-R1036 HydrophobicContact CZ3-CB 4.42Å; G1034-R1036 PolarHBondContact O-N 3.32Å; G1034-R1036 VanDerWaalsContact O-N 3.1Å
1037	R	73.7	Confident	66	Low	158 Å²	158	95.8 Å²	95.8	60%	0.596	50%	0.495	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.7	139.6	-177.8	-60.1	-172.4	-168.8	176.5	9.9	108.6	V997 E999 R1035	V997-R1037 PolarHBondContact N-O 2.78Å; V997-R1037 PolarHBondContact O-N 3.26Å; E999-R1037 HydrophobicContact CG-CG 4.43Å; E999-R1037 IonicContact OE1-CZ 3.69Å; E999-R1037 IonicContact OE1-NE 3.67Å; E999-R1037 PolarHBondContact OE1-NE 3.29Å; E999-R1037 IonicContact OE1-NH2 3.6Å; E999-R1037 PolarHBondContact OE1-NH2 3.25Å; R1035-R1037 PolarHBondContact O-N 3.03Å; R1035-R1037 VanDerWaalsContact O-N 3.13Å
1038	L	83	Confident	69.3	Low	79 Å²	79	91.4 Å²	91.4	41%	0.414	47%	0.47	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	130.7	171.2	-170	84.7	0	0	0	108.2	P741 W996	P741-L1038 HydrophobicContact CB-CD1 3.57Å; P741-L1038 HydrophobicContact CG-CD1 3.54Å; W996-L1038 HydrophobicContact CE3-CD1 4.5Å; W996-L1038 HydrophobicContact CH2-CD1 4.4Å; W996-L1038 HydrophobicContact CZ3-CD1 4.11Å
1039	F	89.5	Confident	72.2	Confident	70 Å²	70	87.5 Å²	87.5	31%	0.307	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	127.9	168.6	175.8	-85.4	0	0	0	110.1	G994 H995 V997 C1041 Q1044	G994-F1039 CarbonylContact C-O 3.47Å; G994-F1039 WeakPolarHBondContact CA-O 3.49Å; H995-F1039 AromaticContact CE1-CD1 3.24Å; H995-F1039 WeakPolarHBondContact CE1-CD1 3.48Å; H995-F1039 AromaticContact CE1-CE1 3.67Å; H995-F1039 PolarHBondContact N-O 2.88Å; H995-F1039 AromaticContact ND1-CD1 3.88Å; H995-F1039 AromaticContact NE2-CD1 3.42Å; H995-F1039 WeakPolarHBondContact NE2-CD1 3.36Å; H995-F1039 AromaticContact NE2-CG 3.79Å; H995-F1039 PolarHBondContact O-N 2.92Å; V997-F1039 HydrophobicContact CG2-CB 3.68Å; F1039-C1041 HydrophobicContact CE1-CB 4.21Å; F1039-Q1044 VanDerWaalsContact CE2-OE1 3.28Å
1040	S	92.2	Very high	75.6	Confident	9 Å²	9	82.9 Å²	82.9	6%	0.063	41%	0.406	C	S	.	.			trans	-130.6	121	168.7	-174.1	0	0	0	0	110.2	P993 I1042 M1043 Q1044	P993-S1040 WeakPolarHBondContact O-CB 3.36Å; P993-S1040 PolarHBondContact O-OG 2.89Å; S1040-I1042 PolarHBondContact O-N 3.44Å; S1040-M1043 PolarHBondContact O-N 2.92Å; S1040-M1043 VanDerWaalsContact O-N 3.14Å; S1040-Q1044 PolarHBondContact O-N 3.02Å; S1040-Q1044 VanDerWaalsContact O-N 3.16Å
1041	C	92.4	Very high	78.6	Confident	29 Å²	29	86.2 Å²	86.2	20%	0.196	40%	0.4	C	S	.	.	H	α-helix	trans	-59.5	-29.1	178.5	60.5	0	0	0	0	112.8	F1039 M1043 Q1044 H1045	F1039-C1041 HydrophobicContact CE1-CB 4.21Å; C1041-M1043 VanDerWaalsContact C-N 3.35Å; C1041-M1043 PolarHBondContact O-N 3.4Å; C1041-Q1044 PolarHBondContact O-N 3.09Å; C1041-H1045 PolarHBondContact O-CD2 3.36Å; C1041-H1045 PolarHBondContact O-N 3.06Å
1042	I	95.8	Very high	81.7	Confident	1 Å²	1	77.7 Å²	77.7	1%	0.005	37%	0.374	C	S	.	.	H	α-helix	trans	-62	-44.2	178.1	-55.1	-174.2	0	0	0	110	W660 L735 A925 L992 S1040 L1046	W660-I1042 HydrophobicContact CD2-CD1 3.93Å; W660-I1042 HydrophobicContact CD2-CG1 3.92Å; W660-I1042 HydrophobicContact CE3-CD1 4.03Å; W660-I1042 HydrophobicContact CG-CG1 4.12Å; W660-I1042 HydrophobicContact CH2-CD1 4.14Å; W660-I1042 HydrophobicContact CZ2-CD1 4.06Å; W660-I1042 HydrophobicContact CZ2-CG1 4.15Å; W660-I1042 HydrophobicContact CZ2-CG2 4.13Å; W660-I1042 HydrophobicContact CZ3-CD1 4.12Å; L735-I1042 HydrophobicContact CD2-CD1 3.8Å; A925-I1042 HydrophobicContact CB-CG2 3.77Å; L992-I1042 HydrophobicContact CD2-CB 4.46Å; L992-I1042 HydrophobicContact CD2-CD1 4.04Å; L992-I1042 HydrophobicContact CD2-CG2 4.21Å; S1040-I1042 PolarHBondContact O-N 3.44Å; I1042-L1046 WeakPolarHBondContact O-CB 3.36Å; I1042-L1046 PolarHBondContact O-N 3.1Å
1043	M	96.7	Very high	84.8	Confident	35 Å²	35	71.4 Å²	71.4	17%	0.172	33%	0.334	C	S	.	.	H	α-helix	trans	-75	-34.1	178.7	-165.7	60.7	75.1	0	0	112.5	C983 N984 D987 L992 S1040 C1041 L1046 T1047	C983-M1043 HydrophobicContact CB-CE 4.14Å; N984-M1043 WeakPolarHBondContact OD1-CE 3.46Å; D987-M1043 HydrophobicContact CB-CE 3.67Å; L992-M1043 HydrophobicContact CD1-CE 4.17Å; S1040-M1043 PolarHBondContact O-N 2.92Å; S1040-M1043 VanDerWaalsContact O-N 3.14Å; C1041-M1043 VanDerWaalsContact C-N 3.35Å; C1041-M1043 PolarHBondContact O-N 3.4Å; M1043-L1046 HydrophobicContact SD-CD2 4.32Å; M1043-T1047 WeakPolarHBondContact O-CB 3.31Å; M1043-T1047 PolarHBondContact O-N 3.49Å; M1043-T1047 VanDerWaalsContact O-N 3.09Å; M1043-T1047 PolarHBondContact O-OG1 3.26Å
1044	Q	96.3	Very high	87.6	Confident	69 Å²	69	65.9 Å²	65.9	32%	0.322	31%	0.31	S	S	.	.	H	α-helix	trans	-60.4	-56.4	172.7	178	-176.9	-4.3	0	0	111.1	F1039 S1040 C1041 L1046 T1047 E1048	F1039-Q1044 VanDerWaalsContact CE2-OE1 3.28Å; S1040-Q1044 PolarHBondContact O-N 3.02Å; S1040-Q1044 VanDerWaalsContact O-N 3.16Å; C1041-Q1044 PolarHBondContact O-N 3.09Å; Q1044-L1046 VanDerWaalsContact C-N 3.29Å; Q1044-L1046 PolarHBondContact O-N 3.45Å; Q1044-T1047 CarbonylContact O-C 3.59Å; Q1044-T1047 WeakPolarHBondContact O-CA 3.28Å; Q1044-T1047 WeakPolarHBondContact O-CB 3.3Å; Q1044-T1047 PolarHBondContact O-N 3.43Å; Q1044-E1048 HydrophobicContact CG-CG 4.27Å; Q1044-E1048 WeakPolarHBondContact CG-OE1 3.35Å; Q1044-E1048 PolarHBondContact NE2-OE1 3.24Å; Q1044-E1048 WeakPolarHBondContact O-CG 3.35Å; Q1044-E1048 PolarHBondContact O-N 3.32Å
1045	H	97.9	Very high	90.5	Very high	30 Å²	30	69.3 Å²	69.3	14%	0.139	31%	0.31	C	S	.	.	H	α-helix	trans	-62.8	-36.8	-177	-67.6	-34.9	0	0	0	112.6	A925 C1041 T1047 E1048 N1049	A925-H1045 WeakPolarHBondContact O-CB 3.38Å; C1041-H1045 PolarHBondContact O-CD2 3.36Å; C1041-H1045 PolarHBondContact O-N 3.06Å; H1045-T1047 VanDerWaalsContact C-N 3.3Å; H1045-T1047 PolarHBondContact O-N 3.34Å; H1045-E1048 IonicContact CE1-OE1 2.75Å; H1045-E1048 IonicContact CE1-OE2 3.15Å; H1045-E1048 PolarHBondContact CE1-OE2 3.09Å; H1045-E1048 IonicContact ND1-OE2 2.75Å; H1045-E1048 PolarHBondContact ND1-OE2 3.03Å; H1045-E1048 IonicContact NE2-OE2 2.94Å; H1045-E1048 PolarHBondContact O-N 3.32Å; H1045-N1049 WeakPolarHBondContact O-CB 3.21Å; H1045-N1049 PolarHBondContact O-N 3.4Å; H1045-N1049 PolarHBondContact O-ND2 3.22Å; H1045-N1049 VanDerWaalsContact O-ND2 3.12Å
1046	L	98.1	Very high	92.7	Very high	7 Å²	7	61.2 Å²	61.2	4%	0.037	28%	0.283	C	S	.	.	H	α-helix	trans	-59	-43.1	172.6	-171.7	60.2	0	0	0	111.6	P924 A925 I975 V979 C983 I1042 M1043 Q1044 H1050	P924-L1046 HydrophobicContact CB-CD1 4.02Å; P924-L1046 WeakPolarHBondContact O-CA 3.3Å; A925-L1046 HydrophobicContact CB-CB 4.24Å; A925-L1046 HydrophobicContact CB-CD1 4.48Å; I975-L1046 HydrophobicContact CG1-CD1 4.5Å; I975-L1046 HydrophobicContact CG2-CD1 3.89Å; V979-L1046 HydrophobicContact CB-CD1 4.14Å; V979-L1046 HydrophobicContact CG1-CD1 3.61Å; V979-L1046 HydrophobicContact CG1-CD2 4.3Å; C983-L1046 HydrophobicContact CB-CD2 3.6Å; I1042-L1046 WeakPolarHBondContact O-CB 3.36Å; I1042-L1046 PolarHBondContact O-N 3.1Å; M1043-L1046 HydrophobicContact SD-CD2 4.32Å; Q1044-L1046 VanDerWaalsContact C-N 3.29Å; Q1044-L1046 PolarHBondContact O-N 3.45Å; L1046-H1050 WeakPolarHBondContact O-CB 3.36Å; L1046-H1050 PolarHBondContact O-N 3Å; L1046-H1050 VanDerWaalsContact O-N 3.11Å
1047	T	97.4	Very high	94.1	Very high	62 Å²	62	56.9 Å²	56.9	38%	0.38	27%	0.269	S	S	.	.	H	α-helix	trans	-67.5	-40.7	176.5	-58.6	0	0	0	0	112.4	M1043 Q1044 H1045 K1051	M1043-T1047 WeakPolarHBondContact O-CB 3.31Å; M1043-T1047 PolarHBondContact O-N 3.49Å; M1043-T1047 VanDerWaalsContact O-N 3.09Å; M1043-T1047 PolarHBondContact O-OG1 3.26Å; Q1044-T1047 CarbonylContact O-C 3.59Å; Q1044-T1047 WeakPolarHBondContact O-CA 3.28Å; Q1044-T1047 WeakPolarHBondContact O-CB 3.3Å; Q1044-T1047 PolarHBondContact O-N 3.43Å; H1045-T1047 VanDerWaalsContact C-N 3.3Å; H1045-T1047 PolarHBondContact O-N 3.34Å; T1047-K1051 HydrophobicContact CG2-CD 4.37Å; T1047-K1051 VanDerWaalsContact O-CG 3.3Å; T1047-K1051 WeakPolarHBondContact O-CG 3.42Å; T1047-K1051 PolarHBondContact O-N 3.47Å; T1047-K1051 VanDerWaalsContact O-N 3.09Å
1048	E	97.6	Very high	95	Very high	75 Å²	75	54.2 Å²	54.2	35%	0.35	26%	0.263	S	S	.	.	H	α-helix	trans	-66.8	-51.9	178.6	-71.5	170.3	164.7	0	0	112.2	Q1044 H1045 H1050 K1051 V1052	Q1044-E1048 HydrophobicContact CG-CG 4.27Å; Q1044-E1048 WeakPolarHBondContact CG-OE1 3.35Å; Q1044-E1048 PolarHBondContact NE2-OE1 3.24Å; Q1044-E1048 WeakPolarHBondContact O-CG 3.35Å; Q1044-E1048 PolarHBondContact O-N 3.32Å; H1045-E1048 IonicContact CE1-OE1 2.75Å; H1045-E1048 IonicContact CE1-OE2 3.15Å; H1045-E1048 PolarHBondContact CE1-OE2 3.09Å; H1045-E1048 IonicContact ND1-OE2 2.75Å; H1045-E1048 PolarHBondContact ND1-OE2 3.03Å; H1045-E1048 IonicContact NE2-OE2 2.94Å; H1045-E1048 PolarHBondContact O-N 3.32Å; E1048-H1050 VanDerWaalsContact C-N 3.26Å; E1048-H1050 PolarHBondContact O-N 2.76Å; E1048-K1051 PolarHBondContact O-N 3.34Å; E1048-V1052 WeakPolarHBondContact O-CG2 3.45Å; E1048-V1052 PolarHBondContact O-N 3.03Å; E1048-V1052 VanDerWaalsContact O-N 3.08Å
1049	N	98.3	Very high	95.5	Very high	3 Å²	3	54.8 Å²	54.8	2%	0.016	26%	0.264	C	S	.	.	H	α-helix	trans	-60.2	-39	178.2	-72.8	-43	0	0	0	110.9	P924 K926 R928 H1045 V1052 W1053	P924-N1049 PolarHBondContact O-ND2 3.29Å; K926-N1049 PolarHBondContact O-ND2 3.13Å; R928-N1049 WeakPolarHBondContact CA-OD1 3.4Å; H1045-N1049 WeakPolarHBondContact O-CB 3.21Å; H1045-N1049 PolarHBondContact O-N 3.4Å; H1045-N1049 PolarHBondContact O-ND2 3.22Å; H1045-N1049 VanDerWaalsContact O-ND2 3.12Å; N1049-V1052 PolarHBondContact O-N 3.32Å; N1049-W1053 PolarHBondContact O-N 3.09Å; N1049-W1053 VanDerWaalsContact O-N 3.16Å
1050	H	97.9	Very high	95.6	Very high	44 Å²	44	55 Å²	55	20%	0.204	27%	0.266	C	S	.	.	H	α-helix	trans	-60.9	-47.8	174.7	-168.2	174.5	0	0	0	112.7	E972 I975 T976 L1046 E1048 V1052 W1053 K1054	E972-H1050 IonicContact OE1-NE2 2.65Å; I975-H1050 HydrophobicContact CD1-CB 4.47Å; I975-H1050 HydrophobicContact CG2-CB 3.94Å; T976-H1050 PolarHBondContact OG1-CE1 3.4Å; T976-H1050 VanDerWaalsContact OG1-CE1 3.28Å; T976-H1050 PolarHBondContact OG1-NE2 3.48Å; T976-H1050 VanDerWaalsContact OG1-NE2 3.13Å; L1046-H1050 WeakPolarHBondContact O-CB 3.36Å; L1046-H1050 PolarHBondContact O-N 3Å; L1046-H1050 VanDerWaalsContact O-N 3.11Å; E1048-H1050 VanDerWaalsContact C-N 3.26Å; E1048-H1050 PolarHBondContact O-N 2.76Å; H1050-V1052 VanDerWaalsContact C-N 3.27Å; H1050-V1052 PolarHBondContact O-N 2.82Å; H1050-W1053 PolarHBondContact O-N 2.76Å; H1050-K1054 PolarHBondContact CE1-NZ 3.4Å; H1050-K1054 PolarHBondContact NE2-NZ 3.27Å; H1050-K1054 PolarHBondContact O-N 3.46Å
1051	K	97.1	Very high	95.5	Very high	143 Å²	143	58.2 Å²	58.2	62%	0.622	28%	0.282	S	S	*	.	H	α-helix	trans	-57.1	-40.8	175.9	-74.8	168.3	178	178	0	111.7	T1047 E1048 K1055	T1047-K1051 HydrophobicContact CG2-CD 4.37Å; T1047-K1051 VanDerWaalsContact O-CG 3.3Å; T1047-K1051 WeakPolarHBondContact O-CG 3.42Å; T1047-K1051 PolarHBondContact O-N 3.47Å; T1047-K1051 VanDerWaalsContact O-N 3.09Å; E1048-K1051 PolarHBondContact O-N 3.34Å; K1051-K1055 WeakPolarHBondContact O-CB 3.3Å; K1051-K1055 PolarHBondContact O-N 3.1Å
1052	V	96.1	Very high	95.4	Very high	61 Å²	61	61.9 Å²	61.9	37%	0.37	30%	0.295	S	S	.	.	H	α-helix	trans	-61.2	-48.9	177.2	171.9	0	0	0	0	111.5	E1048 N1049 H1050 K1055 I1056	E1048-V1052 WeakPolarHBondContact O-CG2 3.45Å; E1048-V1052 PolarHBondContact O-N 3.03Å; E1048-V1052 VanDerWaalsContact O-N 3.08Å; N1049-V1052 PolarHBondContact O-N 3.32Å; H1050-V1052 VanDerWaalsContact C-N 3.27Å; H1050-V1052 PolarHBondContact O-N 2.82Å; V1052-K1055 PolarHBondContact O-N 3.36Å; V1052-I1056 HydrophobicContact CG1-CD1 3.83Å; V1052-I1056 VanDerWaalsContact O-CG1 3.31Å; V1052-I1056 WeakPolarHBondContact O-CG1 3.42Å; V1052-I1056 PolarHBondContact O-N 2.92Å
1053	W	97.1	Very high	95	Very high	11 Å²	11	66.9 Å²	66.9	4%	0.042	32%	0.322	C	S	.	.	H	α-helix	trans	-67.4	-37.4	-179.6	-63.2	115.7	0	0	0	113.3	H931 L932 T935 L967 A968 Q971 E972 N1049 H1050 I1056 I1057	H931-W1053 AromaticContact CD2-NE1 3.69Å; H931-W1053 AromaticContact NE2-CE2 3.55Å; H931-W1053 AromaticContact NE2-CZ2 3.52Å; H931-W1053 AromaticContact NE2-NE1 3.03Å; H931-W1053 PolarHBondContact NE2-NE1 3Å; L932-W1053 HydrophobicContact CD2-CH2 3.83Å; L932-W1053 HydrophobicContact CD2-CZ2 3.71Å; T935-W1053 HydrophobicContact CG2-CH2 4.3Å; T935-W1053 HydrophobicContact CG2-CZ2 4.23Å; L967-W1053 HydrophobicContact CD1-CH2 4.35Å; L967-W1053 HydrophobicContact CD2-CH2 4.1Å; L967-W1053 HydrophobicContact CD2-CZ3 4.16Å; L967-W1053 HydrophobicContact CG-CH2 4.07Å; L967-W1053 HydrophobicContact CG-CZ3 3.94Å; A968-W1053 HydrophobicContact CB-CE3 3.87Å; A968-W1053 HydrophobicContact CB-CZ3 4.43Å; Q971-W1053 HydrophobicContact CB-CD2 3.63Å; Q971-W1053 HydrophobicContact CB-CE3 4.29Å; Q971-W1053 HydrophobicContact CB-CG 3.72Å; Q971-W1053 HydrophobicContact CB-CZ2 4.15Å; Q971-W1053 HydrophobicContact CG-CD2 4.23Å; Q971-W1053 HydrophobicContact CG-CH2 4.29Å; Q971-W1053 HydrophobicContact CG-CZ2 3.86Å; E972-W1053 HydrophobicContact CB-CB 4.21Å; N1049-W1053 PolarHBondContact O-N 3.09Å; N1049-W1053 VanDerWaalsContact O-N 3.16Å; H1050-W1053 PolarHBondContact O-N 2.76Å; W1053-I1056 HydrophobicContact CE3-CD1 3.72Å; W1053-I1056 HydrophobicContact CZ3-CD1 3.91Å; W1053-I1056 PolarHBondContact O-N 3.41Å; W1053-I1057 WeakPolarHBondContact O-CG1 3.43Å; W1053-I1057 PolarHBondContact O-N 2.97Å
1054	K	95.4	Very high	94.5	Very high	87 Å²	87	69.7 Å²	69.7	38%	0.378	33%	0.333	S	S	.	.	H	α-helix	trans	-61.8	-45.5	173.8	-84.3	-176.3	156.7	134.5	0	112.3	E972 H1050 I1056 I1057 E1058	E972-K1054 HydrophobicContact CG-CD 4.33Å; E972-K1054 HydrophobicContact CG-CG 3.67Å; E972-K1054 WeakPolarHBondContact OE1-CE 3.45Å; E972-K1054 IonicContact OE1-NZ 3.31Å; E972-K1054 PolarHBondContact OE1-NZ 3.44Å; H1050-K1054 PolarHBondContact CE1-NZ 3.4Å; H1050-K1054 PolarHBondContact NE2-NZ 3.27Å; H1050-K1054 PolarHBondContact O-N 3.46Å; K1054-I1056 VanDerWaalsContact C-N 3.31Å; K1054-I1056 PolarHBondContact O-N 2.98Å; K1054-I1057 PolarHBondContact O-N 2.93Å; K1054-E1058 PolarHBondContact O-N 2.95Å
1055	K	95.8	Very high	93.9	Very high	126 Å²	126	72 Å²	72	55%	0.548	34%	0.343	S	S	.	.	H	α-helix	trans	-58.9	-40.8	174.1	179.4	170.5	173.9	172	0	112.5	K1051 V1052 E1058 E1059	K1051-K1055 WeakPolarHBondContact O-CB 3.3Å; K1051-K1055 PolarHBondContact O-N 3.1Å; V1052-K1055 PolarHBondContact O-N 3.36Å; K1055-E1058 PolarHBondContact O-N 2.99Å; K1055-E1059 WeakPolarHBondContact CE-OE1 3.45Å; K1055-E1059 IonicContact NZ-OE1 2.62Å; K1055-E1059 WeakPolarHBondContact O-CG 3.46Å; K1055-E1059 PolarHBondContact O-N 2.98Å
1056	I	94.4	Very high	93	Very high	56 Å²	56	74.7 Å²	74.7	29%	0.287	36%	0.359	S	S	.	.	H	α-helix	trans	-65.3	-40.3	177	-65.7	162.8	0	0	0	111.3	A968 V1052 W1053 K1054 E1059 E1060	A968-I1056 HydrophobicContact CB-CB 4.05Å; A968-I1056 HydrophobicContact CB-CG2 3.6Å; V1052-I1056 HydrophobicContact CG1-CD1 3.83Å; V1052-I1056 VanDerWaalsContact O-CG1 3.31Å; V1052-I1056 WeakPolarHBondContact O-CG1 3.42Å; V1052-I1056 PolarHBondContact O-N 2.92Å; W1053-I1056 HydrophobicContact CE3-CD1 3.72Å; W1053-I1056 HydrophobicContact CZ3-CD1 3.91Å; W1053-I1056 PolarHBondContact O-N 3.41Å; K1054-I1056 VanDerWaalsContact C-N 3.31Å; K1054-I1056 PolarHBondContact O-N 2.98Å; I1056-E1059 PolarHBondContact O-N 3.2Å; I1056-E1060 HydrophobicContact CG2-CG 4.46Å; I1056-E1060 WeakPolarHBondContact O-CB 3.48Å; I1056-E1060 WeakPolarHBondContact O-CG 3.38Å; I1056-E1060 PolarHBondContact O-N 3.49Å
1057	I	93.5	Very high	91.7	Very high	39 Å²	39	76.2 Å²	76.2	20%	0.2	38%	0.376	C	S	.	.	H	α-helix	trans	-61.8	-45.9	175.3	-67.1	166.1	0	0	0	110.7	A968 E972 W1053 K1054 E1059 E1060 D1061	A968-I1057 HydrophobicContact CB-CG1 3.76Å; E972-I1057 HydrophobicContact CB-CD1 3.61Å; E972-I1057 HydrophobicContact CG-CD1 3.92Å; W1053-I1057 WeakPolarHBondContact O-CG1 3.43Å; W1053-I1057 PolarHBondContact O-N 2.97Å; K1054-I1057 PolarHBondContact O-N 2.93Å; I1057-E1059 PolarHBondContact O-N 3.12Å; I1057-E1060 PolarHBondContact O-N 3.42Å; I1057-D1061 PolarHBondContact O-N 2.96Å
1058	E	93.5	Very high	90.5	Very high	102 Å²	102	80.8 Å²	80.8	48%	0.477	39%	0.391	S	S	.	.	H	α-helix	trans	-59.8	-43.6	175.5	-75.1	-176.8	-132.5	0	0	112.7	K1054 K1055 D1061 K1062	K1054-E1058 PolarHBondContact O-N 2.95Å; K1055-E1058 PolarHBondContact O-N 2.99Å; E1058-D1061 PolarHBondContact O-N 3.47Å; E1058-K1062 WeakPolarHBondContact O-CB 3.13Å; E1058-K1062 VanDerWaalsContact O-CD 3.28Å; E1058-K1062 WeakPolarHBondContact O-CD 3.49Å; E1058-K1062 WeakPolarHBondContact O-CG 3.5Å; E1058-K1062 PolarHBondContact O-N 3.03Å; E1058-K1062 IonicContact OE2-NZ 3.46Å; E1058-K1062 PolarHBondContact OE2-NZ 3Å
1059	E	92.6	Very high	88.9	Confident	92 Å²	92	84.6 Å²	84.6	43%	0.43	41%	0.409	S	S	.	.	H	α-helix	trans	-65.9	-41.5	177.2	-74.7	176.1	-172.5	0	0	111.3	K1055 I1056 I1057 N1063	K1055-E1059 WeakPolarHBondContact CE-OE1 3.45Å; K1055-E1059 IonicContact NZ-OE1 2.62Å; K1055-E1059 WeakPolarHBondContact O-CG 3.46Å; K1055-E1059 PolarHBondContact O-N 2.98Å; I1056-E1059 PolarHBondContact O-N 3.2Å; I1057-E1059 PolarHBondContact O-N 3.12Å; E1059-N1063 WeakPolarHBondContact O-CB 3.18Å; E1059-N1063 PolarHBondContact O-N 3.31Å; E1059-N1063 PolarHBondContact O-ND2 3.28Å
1060	E	90.8	Very high	86.8	Confident	74 Å²	74	91.8 Å²	91.8	35%	0.346	44%	0.442	S	S	.	.	H	α-helix	trans	-60	-44.9	173	-79.6	-170.3	-157.4	0	0	112.2	I1056 I1057 N1063 K1064	I1056-E1060 HydrophobicContact CG2-CG 4.46Å; I1056-E1060 WeakPolarHBondContact O-CB 3.48Å; I1056-E1060 WeakPolarHBondContact O-CG 3.38Å; I1056-E1060 PolarHBondContact O-N 3.49Å; I1057-E1060 PolarHBondContact O-N 3.42Å; E1060-N1063 PolarHBondContact O-N 2.96Å; E1060-K1064 WeakPolarHBondContact O-CD 3.47Å; E1060-K1064 VanDerWaalsContact O-CE 3.31Å; E1060-K1064 WeakPolarHBondContact O-CE 3.49Å; E1060-K1064 VanDerWaalsContact O-CG 3.26Å; E1060-K1064 WeakPolarHBondContact O-CG 3.33Å; E1060-K1064 PolarHBondContact O-N 2.82Å; E1060-K1064 IonicContact OE2-NZ 3.01Å; E1060-K1064 PolarHBondContact OE2-NZ 3.11Å
1061	D	89.9	Confident	84.2	Confident	76 Å²	76	97.6 Å²	97.6	41%	0.406	47%	0.47	S	S	.	.	H	α-helix	trans	-73.7	-40	-176.3	-74.7	-13.3	0	0	0	112.1	I1057 E1058 N1063 K1064 E1065	I1057-D1061 PolarHBondContact O-N 2.96Å; E1058-D1061 PolarHBondContact O-N 3.47Å; D1061-N1063 VanDerWaalsContact C-N 3.26Å; D1061-N1063 PolarHBondContact O-N 3.27Å; D1061-K1064 WeakPolarHBondContact O-CB 3.36Å; D1061-K1064 PolarHBondContact O-N 3.27Å; D1061-K1064 VanDerWaalsContact OD1-CD 3.31Å; D1061-K1064 WeakPolarHBondContact OD1-CD 3.45Å; D1061-K1064 WeakPolarHBondContact OD1-CE 3.4Å; D1061-K1064 IonicContact OD1-NZ 3.24Å; D1061-K1064 PolarHBondContact OD1-NZ 3.22Å; D1061-E1065 PolarHBondContact O-N 3.36Å
1062	K	91	Very high	82	Confident	107 Å²	107	96.2 Å²	96.2	47%	0.465	48%	0.475	S	S	.	.	H	α-helix	trans	-56.8	-40.3	169.4	-70.4	161.5	-165.6	167.5	0	111.3	E1058 E1065 L1066	E1058-K1062 WeakPolarHBondContact O-CB 3.13Å; E1058-K1062 VanDerWaalsContact O-CD 3.28Å; E1058-K1062 WeakPolarHBondContact O-CD 3.49Å; E1058-K1062 WeakPolarHBondContact O-CG 3.5Å; E1058-K1062 PolarHBondContact O-N 3.03Å; E1058-K1062 IonicContact OE2-NZ 3.46Å; E1058-K1062 PolarHBondContact OE2-NZ 3Å; K1062-E1065 PolarHBondContact O-N 2.67Å; K1062-L1066 WeakPolarHBondContact O-CG 3.46Å; K1062-L1066 PolarHBondContact O-N 3.26Å
1063	N	87.1	Confident	79.9	Confident	105 Å²	105	101.2 Å²	101.2	56%	0.561	50%	0.5	S	S	*	.	H	α-helix	trans	-67.2	-35.9	174.2	-79.4	-55.7	0	0	0	113.2	E1059 E1060 D1061 E1065 G1067	E1059-N1063 WeakPolarHBondContact O-CB 3.18Å; E1059-N1063 PolarHBondContact O-N 3.31Å; E1059-N1063 PolarHBondContact O-ND2 3.28Å; E1060-N1063 PolarHBondContact O-N 2.96Å; D1061-N1063 VanDerWaalsContact C-N 3.26Å; D1061-N1063 PolarHBondContact O-N 3.27Å; N1063-E1065 VanDerWaalsContact C-N 3.31Å; N1063-E1065 PolarHBondContact O-N 2.98Å; N1063-G1067 PolarHBondContact O-N 2.96Å
1064	K	85.9	Confident	77	Confident	95 Å²	95	106.4 Å²	106.4	41%	0.413	54%	0.538	S	S	.	.	H	α-helix	trans	-67.4	-30.6	174.5	-67.9	158.9	-149.6	160.5	0	112	E1060 D1061 K1068	E1060-K1064 WeakPolarHBondContact O-CD 3.47Å; E1060-K1064 VanDerWaalsContact O-CE 3.31Å; E1060-K1064 WeakPolarHBondContact O-CE 3.49Å; E1060-K1064 VanDerWaalsContact O-CG 3.26Å; E1060-K1064 WeakPolarHBondContact O-CG 3.33Å; E1060-K1064 PolarHBondContact O-N 2.82Å; E1060-K1064 IonicContact OE2-NZ 3.01Å; E1060-K1064 PolarHBondContact OE2-NZ 3.11Å; D1061-K1064 WeakPolarHBondContact O-CB 3.36Å; D1061-K1064 PolarHBondContact O-N 3.27Å; D1061-K1064 VanDerWaalsContact OD1-CD 3.31Å; D1061-K1064 WeakPolarHBondContact OD1-CD 3.45Å; D1061-K1064 WeakPolarHBondContact OD1-CE 3.4Å; D1061-K1064 IonicContact OD1-NZ 3.24Å; D1061-K1064 PolarHBondContact OD1-NZ 3.22Å; K1064-K1068 WeakPolarHBondContact O-CG 3.44Å; K1064-K1068 PolarHBondContact O-N 3.41Å
1065	E	83.9	Confident	74.2	Confident	116 Å²	116	110 Å²	110	54%	0.542	56%	0.56	S	S	.	*	H	α-helix	trans	-76	-46.9	174.9	-68.6	-175.5	158.5	0	0	112.4	D1061 K1062 N1063 G1067 K1068 Q1069	D1061-E1065 PolarHBondContact O-N 3.36Å; K1062-E1065 PolarHBondContact O-N 2.67Å; N1063-E1065 VanDerWaalsContact C-N 3.31Å; N1063-E1065 PolarHBondContact O-N 2.98Å; E1065-G1067 VanDerWaalsContact C-N 3.27Å; E1065-G1067 PolarHBondContact O-N 2.82Å; E1065-K1068 WeakPolarHBondContact O-CB 3.33Å; E1065-K1068 PolarHBondContact O-N 3Å; E1065-Q1069 PolarHBondContact O-N 3.26Å; E1065-Q1069 VanDerWaalsContact O-N 3.07Å
1066	L	79.7	Confident	71.8	Confident	87 Å²	87	109.9 Å²	109.9	46%	0.455	57%	0.573	S	S	.	*	H	α-helix	trans	-56.2	-41.9	172.3	-73.5	164.4	0	0	0	111.7	K1062 K1068 Q1069 Q1070	K1062-L1066 WeakPolarHBondContact O-CG 3.46Å; K1062-L1066 PolarHBondContact O-N 3.26Å; L1066-K1068 VanDerWaalsContact C-N 3.3Å; L1066-K1068 PolarHBondContact O-N 3.03Å; L1066-Q1069 PolarHBondContact O-N 2.76Å; L1066-Q1070 WeakPolarHBondContact O-CG 3.26Å; L1066-Q1070 PolarHBondContact O-N 3.38Å
1067	G	71.1	Confident	68.9	Low	40 Å²	40	113.7 Å²	113.7	41%	0.412	60%	0.598	S	S	.	*	H	α-helix	trans	-62.9	-29.8	175.8	0	0	0	0	0	114.5	N1063 E1065	N1063-G1067 PolarHBondContact O-N 2.96Å; E1065-G1067 VanDerWaalsContact C-N 3.27Å; E1065-G1067 PolarHBondContact O-N 2.82Å
1068	K	72.5	Confident	66.1	Low	158 Å²	158	116.6 Å²	116.6	69%	0.687	62%	0.622	S	S	*	*	H	α-helix	trans	-75.4	-37.2	172.7	-69.8	165.2	-173.7	170.8	0	111.9	K1064 E1065 L1066 Q1070	K1064-K1068 WeakPolarHBondContact O-CG 3.44Å; K1064-K1068 PolarHBondContact O-N 3.41Å; E1065-K1068 WeakPolarHBondContact O-CB 3.33Å; E1065-K1068 PolarHBondContact O-N 3Å; L1066-K1068 VanDerWaalsContact C-N 3.3Å; L1066-K1068 PolarHBondContact O-N 3.03Å; K1068-Q1070 VanDerWaalsContact C-N 3.28Å; K1068-Q1070 PolarHBondContact O-N 2.97Å
1069	Q	62.7	Low	63.7	Low	155 Å²	155	118 Å²	118	72%	0.724	64%	0.64	S	S	*	*	H	α-helix	trans	-71.2	-22.7	177.7	-66.9	-179.9	3.3	0	0	112.9	E1065 L1066	E1065-Q1069 PolarHBondContact O-N 3.26Å; E1065-Q1069 VanDerWaalsContact O-N 3.07Å; L1066-Q1069 PolarHBondContact O-N 2.76Å
1070	Q	54.5	Low	60.9	Low	153 Å²	153	118.7 Å²	118.7	72%	0.715	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.3	11	-179.7	-70.1	-176.6	5.5	0	0	115.2	L1066 K1068 P1072	L1066-Q1070 WeakPolarHBondContact O-CG 3.26Å; L1066-Q1070 PolarHBondContact O-N 3.38Å; K1068-Q1070 VanDerWaalsContact C-N 3.28Å; K1068-Q1070 PolarHBondContact O-N 2.97Å; Q1070-P1072 VanDerWaalsContact C-CD 3.46Å; Q1070-P1072 WeakPolarHBondContact O-CD 3.4Å
1071	Q	44.6	Very low	58.2	Low	167 Å²	167	122.6 Å²	122.6	78%	0.78	68%	0.679	S	S	*	*			trans	-106.3	87	169	-75.8	-162.7	-19.4	0	0	112.7
1072	P	50.9	Low	55.5	Low	113 Å²	113	126.8 Å²	126.8	73%	0.734	70%	0.701	S	S	*	*			trans	-77.7	132.8	165.4	31.9	-32.9	0	0	0	111.5	Q1070	Q1070-P1072 VanDerWaalsContact C-CD 3.46Å; Q1070-P1072 WeakPolarHBondContact O-CD 3.4Å
1073	D	50.2	Low	52.8	Low	167 Å²	167	129.3 Å²	129.3	89%	0.893	72%	0.718	S	S	*	*			trans	42.1	96.8	162.3	-67.4	-29.6	0	0	0	119.6
1074	S	37	Very low	50.2	Low	120 Å²	120	133 Å²	133	84%	0.839	73%	0.732	S	S	*	*			trans	-128.6	119.1	145.3	71.8	0	0	0	0	110.9
1075	L	37.5	Very low	47.6	Very low	161 Å²	161	135 Å²	135	84%	0.843	75%	0.752	S	S	*	*			trans	-29.7	147	-170.6	-72.2	160.4	0	0	0	118.9
1076	P	45	Very low	45.1	Very low	125 Å²	125	136.3 Å²	136.3	81%	0.812	76%	0.761	S	S	*	*			trans	-68	135	-174.1	29.2	-36.1	0	0	0	113.1
1077	T	33.3	Very low	42.8	Very low	135 Å²	135	140.8 Å²	140.8	83%	0.828	78%	0.779	S	S	*	*			trans	-104.4	151.4	166.2	-56.1	0	0	0	0	109.5
1078	S	34.1	Very low	41	Very low	101 Å²	101	147.6 Å²	147.6	71%	0.706	80%	0.801	S	S	*	*			trans	-58.7	146.8	-165.2	52.1	0	0	0	0	115.9
1079	P	44.3	Very low	39	Very low	131 Å²	131	148.8 Å²	148.8	85%	0.851	81%	0.809	S	S	*	*			trans	-69.7	149.1	177.7	31.3	-36.6	0	0	0	112.7
1080	S	32.6	Very low	37.6	Very low	106 Å²	106	151 Å²	151	74%	0.741	82%	0.819	S	S	*	*			trans	-158.9	88.9	174.3	174.2	0	0	0	0	111.3
1081	D	34.5	Very low	36.7	Very low	157 Å²	157	153 Å²	153	84%	0.84	83%	0.828	S	S	*	*			trans	50.8	68.1	156.5	-56.6	-5.9	0	0	0	118.4
1082	D	32.9	Very low	36.1	Very low	164 Å²	164	148.2 Å²	148.2	88%	0.877	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-81	130	150.1	-88.5	-47.7	0	0	0	109.8	Q1084	D1082-Q1084 PolarHBondContact O-N 2.99Å
1083	I	34.6	Very low	35.4	Very low	160 Å²	160	151.5 Å²	151.5	82%	0.821	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-82.6	118.4	177.4	-65.1	176.4	0	0	0	108.9	V1085	I1083-V1085 PolarHBondContact O-N 2.83Å
1084	Q	32.1	Very low	34.6	Very low	182 Å²	182	149.1 Å²	149.1	85%	0.85	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-60.7	121.1	173.9	-68.2	174.9	-34.4	0	0	110.6	D1082	D1082-Q1084 PolarHBondContact O-N 2.99Å
1085	V	30.9	Very low	34.6	Very low	138 Å²	138	153 Å²	153	84%	0.836	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-82.9	126.5	160.7	177.7	0	0	0	0	106.9	I1083 Q1087	I1083-V1085 PolarHBondContact O-N 2.83Å; V1085-Q1087 PolarHBondContact O-N 3.19Å
1086	I	32.4	Very low	34.4	Very low	143 Å²	143	158.3 Å²	158.3	73%	0.733	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-68.6	131.4	177.6	-63.6	169.7	0	0	0	108.3	E1088	I1086-E1088 HydrophobicContact CG2-CG 4.13Å
1087	Q	31.4	Very low	33.8	Very low	181 Å²	181	160 Å²	160	85%	0.846	83%	0.83	S	S	*	*			trans	-98.7	108	169.9	-168.8	167.9	2.6	0	0	106	V1085	V1085-Q1087 PolarHBondContact O-N 3.19Å
1088	E	32.8	Very low	33.9	Very low	183 Å²	183	161.3 Å²	161.3	86%	0.855	83%	0.83	S	S	*	*			trans	-77.6	121.4	177.1	-67.6	-176.8	144.6	0	0	108.6	I1086	I1086-E1088 HydrophobicContact CG2-CG 4.13Å
1089	E	31.8	Very low	33.9	Very low	183 Å²	183	164.6 Å²	164.6	86%	0.855	84%	0.837	S	S	*	*			trans	-78.6	137	176.3	-68.8	177.8	117.4	0	0	109.9	E1091	E1089-E1091 PolarHBondContact O-N 2.95Å; E1089-E1091 VanDerWaalsContact O-N 3.08Å
1090	E	33	Very low	33.2	Very low	200 Å²	200	166.6 Å²	166.6	94%	0.935	84%	0.836	S	S	*	*			trans	-83.1	83.4	-177.9	-167.4	166.9	-147.9	0	0	109.9	G1092	E1090-G1092 PolarHBondContact O-N 3.25Å
1091	E	33.9	Very low	33.3	Very low	197 Å²	197	170.4 Å²	170.4	92%	0.921	84%	0.842	S	S	*	*			trans	-64.6	96.7	170.9	-83.4	-166.7	146.1	0	0	110.6	E1089	E1089-E1091 PolarHBondContact O-N 2.95Å; E1089-E1091 VanDerWaalsContact O-N 3.08Å
1092	G	32.8	Very low	33.2	Very low	66 Å²	66	171.3 Å²	171.3	68%	0.68	84%	0.842	S	S	*	*			trans	-97.4	126.2	157.2	0	0	0	0	0	110.5	E1090	E1090-G1092 PolarHBondContact O-N 3.25Å
1093	E	36.8	Very low	33.2	Very low	181 Å²	181	171.8 Å²	171.8	85%	0.846	84%	0.84	S	S	*	*			trans	-156.7	139.8	146.3	-111.4	-170.1	-173.8	0	0	113.7
1094	E	33.2	Very low	33.1	Very low	118 Å²	118	172.7 Å²	172.7	55%	0.551	84%	0.841	S	S	*	*			trans	45.8	118.5	148.6	-54	-140	148.7	0	0	124.8
1095	R	36.3	Very low	33.2	Very low	200 Å²	200	171.9 Å²	171.9	76%	0.755	84%	0.841	S	S	*	*				56.9	110.2	123.6	-57.9	175.7	-178.9	136.1	10.8	120.3
1096	Q	33.1	Very low	33.4	Very low	273 Å²	273	175 Å²	175	100%	1.276	84%	0.841	S	S	*	*				-158.5	0	102.2	-112.7	173.5	44.2	0	0	113.1

Retrieved 1,096 of 1,096 residues in 737.3 ms (Link to these results)

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