A0A3Q0KKK6_SCHMA Loading...

Serine-rich repeat protein 2, putative

AlphaFold DB , UniProt , Accession A0A3Q0KKK6, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,090 aa.

						>A0A3Q0KKK6_SCHMA|A0A3Q0KKK6
MTTNQDNIKISSLFSDKSMSLKESHRYILSTLNDLTPIRSLDGSFSVNHSSKNQIGYFTPWSPIEATFCQCTSKGNSIYTAESNIHEDVVRKMSVPNNVTVNKTDNPLDYSIHSHFIDHQRLTSTSSKVTALQQSNYNRNSSLQFSNSLKFNNNNTSSLRKSECISEPVVCYTTNNETGDGRLSKRKYSKNHPSISRKHTGKYIKAGINNITGLNQPIVISNNITDISDRFEVIPADATNHSLTHNLLKETCSLNQNTVNEDGHLINGKKSKLDKNCPTLEKNSTNKQTIDMTFYPTPKDSQWNNDEDEQGKTNSDNQNNVKNTVVSTGAYKYLSWREKDRRRRFREEWKHLWLVIPHGLHEVMCLICHKVMTQRKLDTIKRHVIRRHPELIKMSDHDKYNLFNQLLIKQYNLIDNKNNNLITNIQYKLTEKTKELLNKPNWLINQTMNRNIFYKRSKDSLNELDQVVHSNGKVKQDLSLNESKCMPKINQEVMNTCDLNRLPLTLPEDWSNLLKVAESLLPIVKPSLNGTSDPLDYSTHSNRHNPMEISIQLSPPNSQPVYTSNISTESLLSSDVQATNCSSFHPFSSFTSSNLNINYKKSFTPMTYKSSESTNSLPLSSIVQPECFSNVQNLDKSSGFLESTSNSYDDTIKTNDESLTAVNCNVNFSDRNIYVENDNEINGYDNSQAAKIYLNSQFHLTTEYMEYGHIFNELNQRLRVSLNKATSHANRASTGFDPTLSKVPRLDEAQSLMIAAWYSALMNSAKNENQSVSDNESLNVHKPICDESVNMEQPLTFSFPFTNPKLFSTSLNVPNTSDESISSRLKQKEKLNNYPIDSLQFHNQEVDFQSPKQMNPSRQLKLNSDLNKFTISSLLNTEQRQIKTPVSKVAQKNDNSCLNVLSNLEITSCDSSTDSSLQLSNQQKYDKFKPIPECISCILCMIHDMNVRNSSGITNHSKSCRLNVDIPSNIYAKEADSYKRKYTTFTCPKNLSSSFYNSVKIQSKINTSNQFNDGNFTLQNQIPSIHSLDSNTQPIHQAQTFMKCYYDELSRYHFEHIQKENQSSEKVTSPYYRIPLNKENAICLNGSADI
					

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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	35.2	Very low	32.4	Very low	236 Å²	236	144.5 Å²	144.5	100%	1.163	77%	0.774	S	S	*	*				0	120	0	-72.2	167.1	162.1	0	0	107.6
2	T	40.3	Very low	31.8	Very low	136 Å²	136	138.5 Å²	138.5	83%	0.834	75%	0.751	S	S	*	*			cis	-146.3	127.3	-6.8	24	0	0	0	0	108.5
3	T	29.1	Very low	31.5	Very low	111 Å²	111	139.2 Å²	139.2	68%	0.681	75%	0.753	S	S	*	*			trans	-74.2	157.9	158.9	46.6	0	0	0	0	109.7
4	N	34.9	Very low	31.3	Very low	140 Å²	140	141.1 Å²	141.1	75%	0.749	75%	0.751	S	S	*	*				-173	118	121.7	-83.3	-6.2	0	0	0	105.4
5	Q	30.4	Very low	31	Very low	144 Å²	144	137.7 Å²	137.7	67%	0.673	74%	0.743	S	S	*	*				65.1	110.6	66.6	-69.7	-169.4	-17.4	0	0	112.7
6	D	39.8	Very low	30.7	Very low	174 Å²	174	137.3 Å²	137.3	93%	0.93	74%	0.741	S	S	*	*				-138.2	134.7	123.3	-96.4	-43.9	0	0	0	108.3
7	N	28.3	Very low	30.6	Very low	129 Å²	129	140.5 Å²	140.5	69%	0.69	75%	0.746	S	S	*	*			trans	-118.5	127.7	-177.1	-87	-57.7	0	0	0	109.6
8	I	36.7	Very low	30.3	Very low	183 Å²	183	138.7 Å²	138.7	94%	0.938	75%	0.747	S	S	*	*			trans	-126.9	126.9	157.8	-58.7	-178.3	0	0	0	107.3
9	K	27.5	Very low	30	Very low	131 Å²	131	140.5 Å²	140.5	57%	0.57	75%	0.752	S	S	*	*			trans	-136.6	115.8	-160.3	-175.7	-172.9	-178.6	-170.7	0	111.2	L898	K9-L898 PolarHBondContact NZ-O 3.47Å; K9-L898 VanDerWaalsContact NZ-O 3.11Å
10	I	29.3	Very low	29.9	Very low	84 Å²	84	137.6 Å²	137.6	43%	0.431	74%	0.743	S	S	.	*			trans	57.6	122.5	155.9	-56.9	169.9	0	0	0	117.2	V900	I10-V900 WeakPolarHBondContact CD1-O 3.42Å
11	S	25.1	Very low	29.8	Very low	122 Å²	122	137.6 Å²	137.6	85%	0.853	74%	0.742	S	S	*	*			trans	-163.3	139.8	138.8	-86.9	0	0	0	0	113
12	S	25.1	Very low	29.6	Very low	72 Å²	72	135.2 Å²	135.2	50%	0.503	73%	0.725	S	S	.	*			trans	-70.1	130.7	-174.4	51.1	0	0	0	0	116
13	L	28.4	Very low	29	Very low	147 Å²	147	134.2 Å²	134.2	77%	0.77	71%	0.711	S	S	*	*			trans	-146.3	145	146.7	-77.2	177.3	0	0	0	109
14	F	27.4	Very low	28.9	Very low	166 Å²	166	132.2 Å²	132.2	73%	0.728	70%	0.702	S	S	*	*			cis	-168.9	161.7	-41.7	-134.8	-97.9	0	0	0	106.5
15	S	27.7	Very low	28.6	Very low	91 Å²	91	134.2 Å²	134.2	64%	0.636	71%	0.706	S	S	*	*			trans	79.5	86.7	164	-151.8	0	0	0	0	121.6
16	D	25.4	Very low	28.5	Very low	131 Å²	131	135.4 Å²	135.4	70%	0.701	71%	0.705	S	S	*	*				77.3	141.5	116.1	-51.7	-44.3	0	0	0	125.5
17	K	29.3	Very low	27.9	Very low	192 Å²	192	136.1 Å²	136.1	84%	0.835	70%	0.696	S	S	*	*			trans	68.7	106.2	167.4	-60.9	158	-172	166.7	0	115
18	S	25.5	Very low	27.9	Very low	108 Å²	108	137.4 Å²	137.4	76%	0.755	70%	0.701	S	S	*	*			cis	60	106.5	33.8	94.6	0	0	0	0	115.2
19	M	25.2	Very low	27.6	Very low	172 Å²	172	135.8 Å²	135.8	85%	0.847	69%	0.693	S	S	*	*				-172.2	166.2	125.9	-100.4	-54.9	-76.7	0	0	113
20	S	27.3	Very low	27.6	Very low	82 Å²	82	131.5 Å²	131.5	57%	0.573	68%	0.68	S	S	*	*			trans	-53.4	145.8	-167	55.1	0	0	0	0	118.9
21	L	28.1	Very low	27.6	Very low	138 Å²	138	133.1 Å²	133.1	72%	0.723	69%	0.694	S	S	*	*			trans	-135.3	48.5	143.8	-130	175.8	0	0	0	113.7
22	K	31	Very low	27.9	Very low	186 Å²	186	135.2 Å²	135.2	81%	0.809	69%	0.694	S	S	*	*			trans	-61.9	158.4	132.4	-69.4	-180	178	178.5	0	106.8
23	E	27.4	Very low	28.1	Very low	115 Å²	115	138.3 Å²	138.3	54%	0.537	71%	0.706	S	S	.	*			trans	86.7	33.2	175.5	-131.8	58.6	-113.1	0	0	118.7	R26	E23-R26 VanDerWaalsContact CD-NH2 3.31Å; E23-R26 WeakPolarHBondContact OE1-CB 3.39Å; E23-R26 IonicContact OE1-CZ 2.68Å; E23-R26 IonicContact OE1-NE 3.5Å; E23-R26 PolarHBondContact OE1-NE 2.9Å; E23-R26 IonicContact OE1-NH2 2.88Å; E23-R26 PolarHBondContact OE1-NH2 3.13Å; E23-R26 IonicContact OE2-CZ 2.64Å; E23-R26 IonicContact OE2-NE 3.22Å; E23-R26 IonicContact OE2-NH2 2.72Å; E23-R26 PolarHBondContact OE2-NH2 2.94Å
24	S	26.8	Very low	28.1	Very low	70 Å²	70	138.4 Å²	138.4	49%	0.49	71%	0.707	S	S	.	*	S	Bend	trans	-109	-23.1	160	58.4	0	0	0	0	114.5	R26	S24-R26 PolarHBondContact O-N 3.47Å
25	H	28.2	Very low	28.2	Very low	181 Å²	181	138.5 Å²	138.5	84%	0.838	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.8	13.2	-179	-87.9	-96.6	0	0	0	115.2
26	R	29.6	Very low	28.3	Very low	170 Å²	170	140.7 Å²	140.7	64%	0.642	72%	0.724	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108	-4.9	171.4	-78.6	-159.8	-79.4	-167	-1.4	115.2	E23 S24	E23-R26 VanDerWaalsContact CD-NH2 3.31Å; E23-R26 WeakPolarHBondContact OE1-CB 3.39Å; E23-R26 IonicContact OE1-CZ 2.68Å; E23-R26 IonicContact OE1-NE 3.5Å; E23-R26 PolarHBondContact OE1-NE 2.9Å; E23-R26 IonicContact OE1-NH2 2.88Å; E23-R26 PolarHBondContact OE1-NH2 3.13Å; E23-R26 IonicContact OE2-CZ 2.64Å; E23-R26 IonicContact OE2-NE 3.22Å; E23-R26 IonicContact OE2-NH2 2.72Å; E23-R26 PolarHBondContact OE2-NH2 2.94Å; S24-R26 PolarHBondContact O-N 3.47Å
27	Y	26.8	Very low	28.6	Very low	189 Å²	189	140.4 Å²	140.4	74%	0.741	73%	0.729	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.4	12.2	-175.1	-135.3	-93	0	0	0	115.8
28	I	29.1	Very low	28.4	Very low	156 Å²	156	138.5 Å²	138.5	80%	0.8	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.3	0.2	167.5	-62.9	176.5	0	0	0	110.5
29	L	28.7	Very low	28.6	Very low	149 Å²	149	145 Å²	145	78%	0.78	73%	0.734	S	S	*	*	S	Bend	trans	-114.1	10.5	177.1	-70	170.7	0	0	0	112.9
30	S	28.2	Very low	28.6	Very low	41 Å²	41	140.8 Å²	140.8	29%	0.287	72%	0.722	S	S	.	*	S	Bend	trans	-106.4	-23.5	-179.9	46.1	0	0	0	0	113.8	L32	S30-L32 PolarHBondContact O-N 3.38Å; S30-L32 VanDerWaalsContact O-N 3.09Å
31	T	29.9	Very low	28.7	Very low	117 Å²	117	144.9 Å²	144.9	72%	0.718	74%	0.736	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.8	20.5	-170.8	4.6	0	0	0	0	115.6
32	L	30	Very low	28.6	Very low	166 Å²	166	146 Å²	146	87%	0.869	74%	0.743	S	S	*	*	T	Hydrogen-bonded Turn	trans	-129.3	2.7	-179.1	-89.4	170.6	0	0	0	114.7	S30	S30-L32 PolarHBondContact O-N 3.38Å; S30-L32 VanDerWaalsContact O-N 3.09Å
33	N	29.4	Very low	28.5	Very low	138 Å²	138	140.1 Å²	140.1	74%	0.738	74%	0.735	S	S	*	*	S	Bend	trans	-106.7	-13.2	-175.3	-77.2	-2.6	0	0	0	115.2	L35	N33-L35 PolarHBondContact O-N 3.35Å
34	D	28.3	Very low	28.3	Very low	149 Å²	149	140.1 Å²	140.1	80%	0.797	75%	0.748	S	S	*	*			trans	-95.5	84.6	-178.4	-68.8	-42.6	0	0	0	111.8
35	L	29.5	Very low	28.4	Very low	167 Å²	167	146.5 Å²	146.5	87%	0.874	77%	0.767	S	S	*	*	S	Bend	trans	-179.6	67.5	151.1	-102.8	171.3	0	0	0	113.4	N33	N33-L35 PolarHBondContact O-N 3.35Å
36	T	30.9	Very low	28.3	Very low	138 Å²	138	142.6 Å²	142.6	85%	0.847	76%	0.76	S	S	*	*	S	Bend	trans	-170.8	151	144.5	10.9	0	0	0	0	111.2
37	P	30.7	Very low	28	Very low	125 Å²	125	139.9 Å²	139.9	81%	0.812	76%	0.762	S	S	*	*			trans	-81.2	145.3	-165.9	-15	31.7	0	0	0	115.3
38	I	26.7	Very low	28.1	Very low	151 Å²	151	138.5 Å²	138.5	77%	0.774	77%	0.768	S	S	*	*			trans	-68.6	137.9	170.1	-64	165.2	0	0	0	110.5
39	R	27.9	Very low	27.9	Very low	245 Å²	245	138.4 Å²	138.4	93%	0.925	76%	0.763	S	S	*	*			trans	-130.8	92.9	151.4	-160.9	178.8	-160.4	-176.1	6.5	109.3
40	S	25.1	Very low	27.7	Very low	83 Å²	83	136.5 Å²	136.5	58%	0.58	76%	0.763	S	S	*	*			trans	-72.1	144.9	175.4	38.5	0	0	0	0	111
41	L	30.8	Very low	27.8	Very low	168 Å²	168	140.1 Å²	140.1	88%	0.88	79%	0.788	S	S	*	*			trans	-142.3	84.2	161.9	-148.9	87.1	0	0	0	108.3	G43	L41-G43 PolarHBondContact O-N 3.41Å; L41-G43 VanDerWaalsContact O-N 3.17Å
42	D	25.7	Very low	27.6	Very low	162 Å²	162	143.7 Å²	143.7	87%	0.866	79%	0.794	S	S	*	*			trans	-64.3	112.9	167.7	-71.5	-67.4	0	0	0	108.5
43	G	28.3	Very low	27.5	Very low	62 Å²	62	142.3 Å²	142.3	64%	0.639	79%	0.787	S	S	*	*			trans	-128.4	58.2	-170.9	0	0	0	0	0	111.7	L41 F45	L41-G43 PolarHBondContact O-N 3.41Å; L41-G43 VanDerWaalsContact O-N 3.17Å; G43-F45 PolarHBondContact O-N 3.47Å; G43-F45 VanDerWaalsContact O-N 3.12Å
44	S	24.1	Very low	27.5	Very low	115 Å²	115	143 Å²	143	80%	0.804	79%	0.786	S	S	*	*			trans	-65.5	108.1	179.7	57	0	0	0	0	111.5
45	F	27.4	Very low	27.4	Very low	204 Å²	204	142.6 Å²	142.6	90%	0.895	78%	0.782	S	S	*	*			trans	-128.2	129.1	163.7	-93.3	-79	0	0	0	111.9	G43	G43-F45 PolarHBondContact O-N 3.47Å; G43-F45 VanDerWaalsContact O-N 3.12Å
46	S	26.3	Very low	27.4	Very low	100 Å²	100	138.3 Å²	138.3	70%	0.699	78%	0.778	S	S	*	*			trans	-86.5	147.8	-178.5	54	0	0	0	0	112.2
47	V	25	Very low	27.2	Very low	113 Å²	113	141.4 Å²	141.4	69%	0.685	78%	0.776	S	S	*	*			trans	25.9	113.2	134.6	-174.4	0	0	0	0	116.4
48	N	27.6	Very low	27.1	Very low	160 Å²	160	145.4 Å²	145.4	86%	0.856	78%	0.781	S	S	*	*				-155	157.9	128.5	-118.2	-37	0	0	0	115.1
49	H	25.3	Very low	27.1	Very low	153 Å²	153	143.5 Å²	143.5	71%	0.708	78%	0.776	S	S	*	*			trans	-87.7	159.8	-166.5	-75.1	-107.5	0	0	0	115.4
50	S	24.6	Very low	27.2	Very low	109 Å²	109	137.6 Å²	137.6	76%	0.762	77%	0.77	S	S	*	*			trans	61.5	106.3	137.4	63.4	0	0	0	0	121.8
51	S	29.9	Very low	27.3	Very low	117 Å²	117	145.2 Å²	145.2	82%	0.818	79%	0.786	S	S	*	*				-164.5	127.2	126.4	7.9	0	0	0	0	106
52	K	26.4	Very low	27	Very low	193 Å²	193	141.2 Å²	141.2	84%	0.839	77%	0.772	S	S	*	*			cis	60.8	129.7	47	-79.5	-167.8	174.8	-179.5	0	114.3
53	N	28.5	Very low	27.2	Very low	137 Å²	137	139.9 Å²	139.9	73%	0.733	77%	0.772	S	S	*	*			trans	81.5	141.4	175	-53.3	-13.7	0	0	0	115.6
54	Q	28.6	Very low	27.2	Very low	153 Å²	153	143.5 Å²	143.5	72%	0.715	78%	0.775	S	S	*	*			cis	-160.9	149.6	-11.1	-117.1	172.8	-19	0	0	111.6
55	I	26.4	Very low	27.2	Very low	140 Å²	140	146.8 Å²	146.8	72%	0.718	78%	0.778	S	S	*	*			trans	40.8	122.6	142.7	-58.9	160.9	0	0	0	119.4
56	G	30.2	Very low	27.3	Very low	76 Å²	76	141.4 Å²	141.4	78%	0.784	77%	0.771	S	S	*	*			trans	-175.3	77.2	166.4	0	0	0	0	0	113.6
57	Y	25.3	Very low	27.2	Very low	204 Å²	204	140.5 Å²	140.5	80%	0.8	76%	0.761	S	S	*	*			trans	-70.9	141	179.4	-69.7	-97.7	0	0	0	112.7
58	F	28.8	Very low	27.4	Very low	208 Å²	208	143.1 Å²	143.1	91%	0.912	76%	0.764	S	S	*	*				-160.2	161.1	126.2	-108.9	-70.9	0	0	0	110.9
59	T	27.7	Very low	27.3	Very low	111 Å²	111	138.2 Å²	138.2	68%	0.681	74%	0.742	S	S	*	*			trans	-105.8	160.7	-158	31	0	0	0	0	115.4
60	P	28.1	Very low	27.4	Very low	121 Å²	121	139.1 Å²	139.1	79%	0.786	75%	0.746	S	S	*	*			trans	-91.8	144.1	-168.7	35.8	-35.2	0	0	0	114
61	W	27.9	Very low	27.4	Very low	244 Å²	244	139 Å²	139	92%	0.924	74%	0.744	S	S	*	*			trans	-129.9	153.5	171.9	-83.1	55.5	0	0	0	110.7
62	S	24.2	Very low	27.2	Very low	84 Å²	84	139.5 Å²	139.5	59%	0.587	74%	0.742	S	S	*	*			trans	-88.3	158.2	-165.5	49.2	0	0	0	0	115.2
63	P	30.5	Very low	27.3	Very low	133 Å²	133	135.9 Å²	135.9	86%	0.864	74%	0.741	S	S	*	*			trans	-71.2	131.6	157.3	31.6	-31.8	0	0	0	109.6
64	I	28.8	Very low	27.3	Very low	139 Å²	139	139.2 Å²	139.2	71%	0.713	75%	0.749	S	S	*	*			trans	-110.4	146.4	-178.7	-67.5	172.9	0	0	0	109.7
65	E	22.8	Very low	27.2	Very low	184 Å²	184	135 Å²	135	86%	0.86	75%	0.747	S	S	*	*			trans	-73.8	129.8	178	-58.5	172.2	120.9	0	0	112
66	A	29.9	Very low	27.4	Very low	90 Å²	90	135.9 Å²	135.9	74%	0.744	75%	0.753	S	S	*	*			trans	-153	64.7	-176.9	0	0	0	0	0	116.6
67	T	25.4	Very low	27.2	Very low	81 Å²	81	136.1 Å²	136.1	50%	0.497	74%	0.743	S	S	.	*				54.7	98.5	105.8	-55	0	0	0	0	121.6	L480	T67-L480 HydrophobicContact CG2-CD1 3.4Å; T67-L480 HydrophobicContact CG2-CD2 3.97Å; T67-L480 HydrophobicContact CG2-CG 4.06Å
68	F	28.4	Very low	27.2	Very low	168 Å²	168	133.3 Å²	133.3	74%	0.737	74%	0.74	S	S	*	*			trans	-155.9	138.9	145.7	-108.1	-69.1	0	0	0	117.7	S479 L480	F68-S479 CarbonylContact C-O 3.56Å; F68-S479 PolarHBondContact N-O 3.03Å; F68-S479 CarbonylContact O-C 3.56Å; F68-L480 VanDerWaalsContact N-CG 3.29Å; F68-L480 WeakPolarHBondContact O-CB 3.4Å; F68-L480 PolarHBondContact O-N 3.18Å
69	C	25.3	Very low	27.1	Very low	58 Å²	58	132.8 Å²	132.8	39%	0.392	73%	0.733	S	S	.	*			trans	-133.2	153.8	-174.1	-145.8	0	0	0	0	116.2	L480	C69-L480 HydrophobicContact CB-CB 3.48Å; C69-L480 VanDerWaalsContact CB-CB 3.48Å; C69-L480 HydrophobicContact CB-CD1 4.09Å; C69-L480 HydrophobicContact CB-CG 4.44Å; C69-L480 PolarHBondContact SG-O 3.45Å
70	Q	27	Very low	27	Very low	171 Å²	171	133 Å²	133	80%	0.799	74%	0.735	S	S	*	*			trans	51.3	133.5	151.6	-85.4	-179.8	-0.1	0	0	121.7
71	C	24.9	Very low	26.8	Very low	107 Å²	107	131.5 Å²	131.5	72%	0.723	73%	0.733	S	S	*	*				173.5	121.5	108.7	-90.5	0	0	0	0	117.7
72	T	25.1	Very low	26.8	Very low	128 Å²	128	128.9 Å²	128.9	79%	0.785	73%	0.731	S	S	*	*			trans	42.2	135.3	133.9	67.5	0	0	0	0	124.7
73	S	29.9	Very low	27	Very low	117 Å²	117	128.9 Å²	128.9	82%	0.818	73%	0.731	S	S	*	*				158.1	155.9	129.3	49.6	0	0	0	0	112.6
74	K	27.7	Very low	26.9	Very low	206 Å²	206	129.7 Å²	129.7	90%	0.896	73%	0.728	S	S	*	*			cis	-165.9	139.3	-35.5	-140.7	-179.4	-172.5	-179.8	0	110
75	G	27.8	Very low	26.9	Very low	64 Å²	64	129.9 Å²	129.9	66%	0.66	73%	0.729	S	S	*	*			trans	72.4	164	173.2	0	0	0	0	0	115.2
76	N	28.6	Very low	27.1	Very low	160 Å²	160	128.5 Å²	128.5	86%	0.856	72%	0.722	S	S	*	*			cis	-169	166.1	-1.9	-99.6	-2.4	0	0	0	107.3
77	S	26	Very low	27.1	Very low	81 Å²	81	131 Å²	131	57%	0.566	72%	0.719	S	S	*	*			cis	177.8	164.8	-19.9	55.5	0	0	0	0	108.4
78	I	25.6	Very low	27.2	Very low	144 Å²	144	133.6 Å²	133.6	74%	0.738	73%	0.729	S	S	*	*			trans	71.3	139.4	162.1	-66.4	163	0	0	0	114.9
79	Y	26.7	Very low	27.2	Very low	197 Å²	197	131 Å²	131	77%	0.773	73%	0.727	S	S	*	*			cis	-153.2	141.2	-8.3	-110.7	-164.1	0	0	0	106.1
80	T	25.5	Very low	27.4	Very low	116 Å²	116	132.9 Å²	132.9	71%	0.712	74%	0.736	S	S	*	*				42.8	137.9	88.1	57.8	0	0	0	0	116.5
81	A	25.6	Very low	27.4	Very low	90 Å²	90	135 Å²	135	74%	0.744	74%	0.737	S	S	*	*			cis	-166.4	-146.6	-7.8	0	0	0	0	0	110.2
82	E	28.1	Very low	27.7	Very low	188 Å²	188	138.8 Å²	138.8	88%	0.879	74%	0.741	S	S	*	*			trans	82.8	154.8	164.6	-56.3	-177.7	-172.5	0	0	119.6
83	S	27.6	Very low	27.9	Very low	85 Å²	85	140.7 Å²	140.7	59%	0.594	74%	0.743	S	S	*	*				-174.7	149.4	-73	49.7	0	0	0	0	113.5
84	N	27.5	Very low	27.8	Very low	150 Å²	150	139.5 Å²	139.5	80%	0.802	74%	0.735	S	S	*	*			trans	66.3	177.9	163.1	-52.5	-31.2	0	0	0	114.8
85	I	29.2	Very low	28	Very low	143 Å²	143	136.4 Å²	136.4	73%	0.733	73%	0.733	S	S	*	*			cis	-152.9	139.9	16.3	-35.9	161.2	0	0	0	111.1
86	H	27.9	Very low	28.4	Very low	155 Å²	155	137.8 Å²	137.8	72%	0.718	73%	0.73	S	S	*	*			trans	56.8	164.7	150.8	-82.5	-125.3	0	0	0	121.7
87	E	29.1	Very low	28.6	Very low	143 Å²	143	136.7 Å²	136.7	67%	0.668	73%	0.725	S	S	*	*			cis	-171.1	-168.8	-32.8	-151.2	173.3	-155.6	0	0	109.7
88	D	28.5	Very low	28.6	Very low	134 Å²	134	139.9 Å²	139.9	72%	0.717	74%	0.735	S	S	*	*			trans	70.1	161.8	152.7	-90.4	11.4	0	0	0	120.9
89	V	27.8	Very low	28.8	Very low	114 Å²	114	139.9 Å²	139.9	69%	0.691	74%	0.742	S	S	*	*			cis	-170.9	145.9	-30.4	124.1	0	0	0	0	107.1
90	V	29.8	Very low	28.7	Very low	98 Å²	98	136.1 Å²	136.1	59%	0.594	74%	0.739	S	S	*	*			cis	-165.4	169	-18.3	78.4	0	0	0	0	111.2
91	R	27.2	Very low	28.9	Very low	216 Å²	216	136.5 Å²	136.5	82%	0.815	74%	0.741	S	S	*	*			trans	-8	140.8	162.8	-68.2	169.1	-81	-121.9	-6.5	119.5
92	K	30.9	Very low	29.2	Very low	185 Å²	185	139.3 Å²	139.3	80%	0.804	74%	0.744	S	S	*	*			trans	-162.2	124.1	135.6	-110.3	163.6	-172.3	173	0	114.9
93	M	28.7	Very low	29.2	Very low	168 Å²	168	139.4 Å²	139.4	83%	0.828	74%	0.741	S	S	*	*			trans	55.7	154.7	146.5	-65.6	154.5	171.4	0	0	122.1
94	S	28.9	Very low	29.3	Very low	92 Å²	92	141.5 Å²	141.5	64%	0.643	75%	0.75	S	S	*	*				170.7	106.8	-57.9	51.1	0	0	0	0	112.2
95	V	30.8	Very low	29.5	Very low	141 Å²	141	141.7 Å²	141.7	86%	0.855	75%	0.752	S	S	*	*			trans	41.8	-173.5	141.1	-104.2	0	0	0	0	120.7
96	P	37.3	Very low	29.5	Very low	93 Å²	93	141.9 Å²	141.9	60%	0.604	75%	0.754	S	S	*	*			cis	-133	-166.9	-22.2	26.4	-1.7	0	0	0	114.9
97	N	31.9	Very low	29.7	Very low	138 Å²	138	139.9 Å²	139.9	74%	0.738	76%	0.755	S	S	*	*			trans	108.1	116.8	151.9	-55.4	-33.5	0	0	0	115.7
98	N	26.7	Very low	29.7	Very low	147 Å²	147	141.3 Å²	141.3	79%	0.786	77%	0.766	S	S	*	*			cis	85.3	109.7	36.2	-71.4	-10	0	0	0	115.8
99	V	29.1	Very low	29.8	Very low	145 Å²	145	140.9 Å²	140.9	88%	0.879	76%	0.764	S	S	*	*			trans	-139.1	142	151	179.8	0	0	0	0	107.3
100	T	25.6	Very low	29.9	Very low	117 Å²	117	145.5 Å²	145.5	72%	0.718	77%	0.77	S	S	*	*			trans	-133.2	-169.5	-178.9	49.2	0	0	0	0	110.2
101	V	28.6	Very low	29.9	Very low	125 Å²	125	145.8 Å²	145.8	76%	0.758	78%	0.777	S	S	*	*			trans	79.1	136.5	175.7	-170.4	0	0	0	0	112.1
102	N	31	Very low	30.1	Very low	149 Å²	149	141.4 Å²	141.4	80%	0.797	77%	0.768	S	S	*	*			cis	-137	176.5	17.2	-141.1	-15	0	0	0	114.4
103	K	29.5	Very low	30	Very low	190 Å²	190	140.9 Å²	140.9	83%	0.826	77%	0.768	S	S	*	*			trans	-118.2	130.5	166.3	-71.9	178.9	177.7	177.7	0	110.6
104	T	29.5	Very low	29.9	Very low	128 Å²	128	136.8 Å²	136.8	79%	0.785	76%	0.756	S	S	*	*			trans	-172.4	-179.4	144.1	28.8	0	0	0	0	109.2
105	D	31.8	Very low	29.9	Very low	155 Å²	155	139.2 Å²	139.2	83%	0.829	76%	0.757	S	S	*	*			trans	87	119.2	165.8	-52.9	-9.5	0	0	0	116.9
106	N	29.7	Very low	29.8	Very low	147 Å²	147	142.5 Å²	142.5	79%	0.786	76%	0.76	S	S	*	*			trans	-146.4	102.8	-179.6	178.9	55.3	0	0	0	109.6
107	P	30.8	Very low	29.4	Very low	113 Å²	113	144.3 Å²	144.3	73%	0.734	76%	0.764	S	S	*	*			trans	-115.2	112.3	169.4	32.8	-20.2	0	0	0	111.8	D109	P107-D109 PolarHBondContact O-N 3.08Å
108	L	29.6	Very low	29.4	Very low	172 Å²	172	144.4 Å²	144.4	90%	0.901	76%	0.764	S	S	*	*			trans	-89.4	82.6	158.6	-84.5	171.3	0	0	0	109.1
109	D	30.4	Very low	29.4	Very low	125 Å²	125	145.4 Å²	145.4	67%	0.668	76%	0.763	S	S	*	*			trans	-157.2	127.3	153.9	-162.9	-6.8	0	0	0	110.8	P107 S111	P107-D109 PolarHBondContact O-N 3.08Å; D109-S111 PolarHBondContact OD1-N 3.41Å
110	Y	30.2	Very low	29.6	Very low	211 Å²	211	147.8 Å²	147.8	83%	0.827	77%	0.765	S	S	*	*			trans	-162.6	73	159.1	-90.7	-54.9	0	0	0	110.7	I112	Y110-I112 HydrophobicContact CD1-CD1 3.75Å; Y110-I112 HydrophobicContact CD1-CG1 4.09Å; Y110-I112 HydrophobicContact CE1-CD1 4.23Å; Y110-I112 PolarHBondContact O-N 3.12Å
111	S	29.4	Very low	29.6	Very low	104 Å²	104	153.2 Å²	153.2	73%	0.727	77%	0.773	S	S	*	*			trans	-76.3	108.5	155.1	-174.2	0	0	0	0	109.8	D109	D109-S111 PolarHBondContact OD1-N 3.41Å
112	I	32.7	Very low	29.7	Very low	124 Å²	124	155 Å²	155	64%	0.636	78%	0.777	S	S	*	*			trans	-124.5	93.4	171.4	-57.4	-176	0	0	0	110.3	Y110 S114	Y110-I112 HydrophobicContact CD1-CD1 3.75Å; Y110-I112 HydrophobicContact CD1-CG1 4.09Å; Y110-I112 HydrophobicContact CE1-CD1 4.23Å; Y110-I112 PolarHBondContact O-N 3.12Å; I112-S114 WeakPolarHBondContact CG2-O 3.46Å
113	H	26.9	Very low	29.4	Very low	174 Å²	174	153.6 Å²	153.6	81%	0.806	77%	0.774	S	S	*	*			trans	-82.7	159.2	144.9	-93.5	63.7	0	0	0	109.3
114	S	26.7	Very low	29.5	Very low	83 Å²	83	149.1 Å²	149.1	58%	0.58	77%	0.767	S	S	*	*			trans	66.9	156.3	-178.4	82	0	0	0	0	113.7	I112	I112-S114 WeakPolarHBondContact CG2-O 3.46Å
115	H	29.9	Very low	29.6	Very low	143 Å²	143	148.7 Å²	148.7	66%	0.662	76%	0.764	S	S	*	*			cis	-130.1	125.8	17.1	-91.1	-77.4	0	0	0	113.7	I117	H115-I117 HydrophobicContact CB-CD1 3.99Å; H115-I117 HydrophobicContact CB-CG1 3.9Å; H115-I117 WeakPolarHBondContact ND1-CG1 3.45Å
116	F	27.7	Very low	29.4	Very low	210 Å²	210	146.5 Å²	146.5	92%	0.921	76%	0.761	S	S	*	*			trans	-84.8	113.5	135.8	-88.9	-97.8	0	0	0	106.4
117	I	30.1	Very low	29.5	Very low	131 Å²	131	145 Å²	145	67%	0.672	76%	0.761	S	S	*	*			trans	-103.8	103.5	165.7	-72.6	160.7	0	0	0	107	H115	H115-I117 HydrophobicContact CB-CD1 3.99Å; H115-I117 HydrophobicContact CB-CG1 3.9Å; H115-I117 WeakPolarHBondContact ND1-CG1 3.45Å
118	D	31.1	Very low	29.3	Very low	139 Å²	139	148.6 Å²	148.6	74%	0.743	77%	0.766	S	S	*	*			trans	-86.6	139.9	159.7	-111.4	-48.8	0	0	0	109.3
119	H	27.6	Very low	29.4	Very low	168 Å²	168	147.5 Å²	147.5	78%	0.778	77%	0.766	S	S	*	*			trans	-31.2	129	-170.8	-63.7	-84.4	0	0	0	118.6
120	Q	33	Very low	29.4	Very low	196 Å²	196	147.2 Å²	147.2	92%	0.916	77%	0.769	S	S	*	*			trans	-146.1	161.6	135	-118.9	155.7	103.9	0	0	113
121	R	25.6	Very low	29.4	Very low	231 Å²	231	141.8 Å²	141.8	87%	0.872	77%	0.767	S	S	*	*			trans	-69.2	148.1	-164	-61.6	167.7	168.5	175.9	-6.4	112.9
122	L	29.6	Very low	29.3	Very low	161 Å²	161	144 Å²	144	84%	0.843	77%	0.77	S	S	*	*				-170.3	167.6	101.6	-96.4	165.7	0	0	0	113.4
123	T	26.6	Very low	29.2	Very low	121 Å²	121	146.2 Å²	146.2	74%	0.742	78%	0.778	S	S	*	*			trans	-64.4	164.7	-179.8	46.2	0	0	0	0	113.2
124	S	30.4	Very low	29.5	Very low	96 Å²	96	147 Å²	147	67%	0.671	78%	0.782	S	S	*	*			cis	-167.6	169.3	24.7	10.3	0	0	0	0	112.2
125	T	31.6	Very low	29.4	Very low	119 Å²	119	147.5 Å²	147.5	73%	0.73	79%	0.785	S	S	*	*			trans	45.7	113.3	154.6	51.9	0	0	0	0	119.4
126	S	28.1	Very low	29.3	Very low	108 Å²	108	147.3 Å²	147.3	76%	0.755	79%	0.789	S	S	*	*				64.6	140.7	64.7	85.8	0	0	0	0	114.6
127	S	31.1	Very low	29.5	Very low	115 Å²	115	148 Å²	148	80%	0.804	79%	0.787	S	S	*	*			cis	-158.1	172.9	12.9	39.8	0	0	0	0	114.3
128	K	28.1	Very low	29.4	Very low	190 Å²	190	147.9 Å²	147.9	83%	0.826	79%	0.788	S	S	*	*			trans	-41.5	152.9	178.1	-54.9	170.4	179.3	176.2	0	117.3
129	V	31.4	Very low	29.4	Very low	149 Å²	149	152.6 Å²	152.6	90%	0.903	80%	0.796	S	S	*	*			trans	-129.4	148.7	146	177.1	0	0	0	0	108.6
130	T	28.7	Very low	29.3	Very low	119 Å²	119	152.2 Å²	152.2	73%	0.73	80%	0.799	S	S	*	*			trans	-141.6	126.4	-173	-41.2	0	0	0	0	110.7
131	A	31.3	Very low	29.2	Very low	96 Å²	96	148.7 Å²	148.7	79%	0.793	80%	0.796	S	S	*	*			trans	171.9	173.1	158.3	0	0	0	0	0	110.2
132	L	27.1	Very low	29.2	Very low	150 Å²	150	143 Å²	143	79%	0.785	79%	0.792	S	S	*	*				-177.5	161.8	-51.5	-144.1	137.7	0	0	0	105.8
133	Q	30.1	Very low	29.2	Very low	171 Å²	171	142.1 Å²	142.1	80%	0.799	79%	0.787	S	S	*	*			trans	69.9	157.5	178.2	-49.1	176.8	-31	0	0	113.1
134	Q	32.8	Very low	29.1	Very low	190 Å²	190	144.6 Å²	144.6	89%	0.888	79%	0.79	S	S	*	*			cis	-123	170.2	11.7	-66.3	172.4	-6.4	0	0	112.7
135	S	25.7	Very low	29	Very low	94 Å²	94	148.9 Å²	148.9	66%	0.657	80%	0.797	S	S	*	*			trans	-133.8	169.9	-178.6	57.9	0	0	0	0	112.2
136	N	27.3	Very low	28.7	Very low	140 Å²	140	147.7 Å²	147.7	75%	0.749	79%	0.794	S	S	*	*			trans	77.4	126.5	169.8	-49.9	-33.9	0	0	0	117.5
137	Y	32.1	Very low	28.8	Very low	223 Å²	223	149.5 Å²	149.5	88%	0.875	80%	0.795	S	S	*	*				167.7	89.4	127.7	-88.8	-64.5	0	0	0	107
138	N	28	Very low	28.5	Very low	129 Å²	129	148 Å²	148	69%	0.69	79%	0.785	S	S	*	*				68.5	100.6	70.2	-173.9	10.3	0	0	0	114.2
139	R	31.2	Very low	28.5	Very low	239 Å²	239	145.5 Å²	145.5	90%	0.902	78%	0.78	S	S	*	*			trans	-170.7	145.3	130.9	-105.7	167	-171.8	-163	1.3	113
140	N	25.9	Very low	28.4	Very low	159 Å²	159	145.5 Å²	145.5	85%	0.85	77%	0.767	S	S	*	*			trans	-86.1	153	174.5	-60.5	-35.9	0	0	0	111.4
141	S	30.3	Very low	28.3	Very low	123 Å²	123	147.8 Å²	147.8	86%	0.86	77%	0.767	S	S	*	*			trans	-145.3	101.4	152.6	57.3	0	0	0	0	110
142	S	25.9	Very low	28.2	Very low	110 Å²	110	149 Å²	149	77%	0.769	76%	0.761	S	S	*	*			trans	-75.4	151	172.5	54	0	0	0	0	111.6
143	L	29	Very low	28.3	Very low	144 Å²	144	147.3 Å²	147.3	75%	0.754	75%	0.753	S	S	*	*			trans	-155.2	119.1	139.4	-110.4	168.4	0	0	0	110	F145	L143-F145 HydrophobicContact CD1-CE2 4.44Å; L143-F145 HydrophobicContact CD2-CD2 4.45Å; L143-F145 HydrophobicContact CD2-CE2 3.91Å; L143-F145 HydrophobicContact CD2-CZ 4.46Å
144	Q	25.3	Very low	28.2	Very low	173 Å²	173	145.2 Å²	145.2	81%	0.808	75%	0.747	S	S	*	*			trans	-80	143.6	164.5	-70.2	176.6	-32	0	0	108.8
145	F	29.1	Very low	28.1	Very low	186 Å²	186	142.9 Å²	142.9	82%	0.816	74%	0.74	S	S	*	*			trans	-131.7	97.6	156.1	-90.9	-73.4	0	0	0	110.1	L143	L143-F145 HydrophobicContact CD1-CE2 4.44Å; L143-F145 HydrophobicContact CD2-CD2 4.45Å; L143-F145 HydrophobicContact CD2-CE2 3.91Å; L143-F145 HydrophobicContact CD2-CZ 4.46Å
146	S	24.8	Very low	28.1	Very low	94 Å²	94	144.3 Å²	144.3	66%	0.657	75%	0.745	S	S	*	*			trans	-91	115.5	174.3	52.6	0	0	0	0	110.9
147	N	30	Very low	28.3	Very low	145 Å²	145	142.9 Å²	142.9	78%	0.775	75%	0.746	S	S	*	*			trans	-146.4	104.1	160.5	-84	-38.3	0	0	0	105.5
148	S	24.2	Very low	28	Very low	84 Å²	84	137.4 Å²	137.4	59%	0.587	74%	0.74	S	S	*	*			cis	72.5	134.8	32.6	112.8	0	0	0	0	113.1
149	L	28.6	Very low	28.1	Very low	138 Å²	138	138.7 Å²	138.7	72%	0.723	75%	0.746	S	S	*	*			trans	74	140.4	-171	-69.4	67.9	0	0	0	115.4
150	K	29.9	Very low	27.8	Very low	149 Å²	149	138.7 Å²	138.7	65%	0.648	75%	0.746	S	S	*	*			cis	-171	148	-15	-118.6	170.6	-171.4	169	0	109.4
151	F	26.2	Very low	28.1	Very low	166 Å²	166	139.8 Å²	139.8	73%	0.728	74%	0.744	S	S	*	*			trans	53.9	161	147.5	-60.5	-34.9	0	0	0	118.4
152	N	28.1	Very low	27.8	Very low	122 Å²	122	138 Å²	138	65%	0.652	73%	0.731	S	S	*	*			cis	-166.3	173.4	-12.3	-101.3	0.2	0	0	0	104.3
153	N	30.8	Very low	27.9	Very low	115 Å²	115	140.7 Å²	140.7	62%	0.615	73%	0.732	S	S	*	*			cis	-153.5	147.7	4.1	-119.8	-11.1	0	0	0	109.3
154	N	27.1	Very low	27.8	Very low	126 Å²	126	138.4 Å²	138.4	67%	0.674	73%	0.727	S	S	*	*			trans	11.5	131.3	137.7	-45.1	-23	0	0	0	120
155	N	30.9	Very low	27.8	Very low	142 Å²	142	137.3 Å²	137.3	76%	0.759	73%	0.725	S	S	*	*				176.3	118.2	114.6	-85.2	-9.2	0	0	0	108.4
156	T	25.9	Very low	27.8	Very low	124 Å²	124	133.9 Å²	133.9	76%	0.761	72%	0.724	S	S	*	*				47.8	126.7	87.3	67.2	0	0	0	0	113.3
157	S	30.6	Very low	28	Very low	110 Å²	110	137.8 Å²	137.8	77%	0.769	73%	0.732	S	S	*	*			cis	-150.2	146.5	30.2	55.1	0	0	0	0	115.2
158	S	26.4	Very low	28.2	Very low	107 Å²	107	136.8 Å²	136.8	75%	0.748	73%	0.733	S	S	*	*				9.1	127.6	128.2	-173.7	0	0	0	0	118.8
159	L	31	Very low	28.4	Very low	156 Å²	156	138.3 Å²	138.3	82%	0.817	74%	0.739	S	S	*	*			trans	-160.1	108.6	132	-113.4	165.7	0	0	0	110.6
160	R	24.6	Very low	28.4	Very low	239 Å²	239	138.1 Å²	138.1	90%	0.902	74%	0.743	S	S	*	*			trans	-98.1	128.1	161.8	-76.8	-173.3	179.1	-171.6	1	108.8
161	K	31	Very low	28.4	Very low	182 Å²	182	136.2 Å²	136.2	79%	0.791	75%	0.747	S	S	*	*			trans	-146.5	122.8	147.1	-63	-169	178.7	-174.2	0	106
162	S	25	Very low	28.4	Very low	86 Å²	86	138.4 Å²	138.4	60%	0.601	75%	0.752	S	S	*	*			cis	78.1	131.6	37.2	85.6	0	0	0	0	114
163	E	27.5	Very low	28.5	Very low	166 Å²	166	139 Å²	139	78%	0.776	76%	0.76	S	S	*	*			trans	67.1	146.7	167.2	-65.7	131.8	143.5	0	0	117.1
164	C	26.4	Very low	28.2	Very low	96 Å²	96	138.5 Å²	138.5	65%	0.649	76%	0.761	S	S	*	*			cis	-154.4	144.4	-2.5	-124.9	0	0	0	0	114.1
165	I	25.1	Very low	28.4	Very low	151 Å²	151	138.8 Å²	138.8	77%	0.774	76%	0.763	S	S	*	*				28.1	124	128	-55.7	174.1	0	0	0	119
166	S	30.1	Very low	28.2	Very low	113 Å²	113	138.7 Å²	138.7	79%	0.79	76%	0.763	S	S	*	*				-177.6	130.8	114.9	45	0	0	0	0	114.3
167	E	28.7	Very low	28.6	Very low	176 Å²	176	141.1 Å²	141.1	82%	0.822	77%	0.765	S	S	*	*			trans	-123.8	147.4	164.8	-72.1	-176.1	159.3	0	0	109.6
168	P	34.4	Very low	28.6	Very low	124 Å²	124	142.5 Å²	142.5	81%	0.805	77%	0.769	S	S	*	*			trans	-111.4	128.1	149.9	33.7	-23.1	0	0	0	109.6
169	V	27.8	Very low	28.9	Very low	117 Å²	117	141 Å²	141	71%	0.709	77%	0.771	S	S	*	*			cis	71.7	141.6	33.8	-164.1	0	0	0	0	113.5
170	V	29.9	Very low	28.9	Very low	133 Å²	133	141.1 Å²	141.1	81%	0.806	77%	0.772	S	S	*	*			trans	90.3	129	173.8	-175.5	0	0	0	0	115.5
171	C	28.2	Very low	29.4	Very low	110 Å²	110	132.7 Å²	132.7	74%	0.743	76%	0.76	S	S	*	*			cis	-163.3	175.7	-16.3	-112.7	0	0	0	0	113.5
172	Y	26.2	Very low	29.3	Very low	212 Å²	212	134.1 Å²	134.1	83%	0.831	76%	0.76	S	S	*	*			trans	-84.4	155.2	-178.4	-46	-100.4	0	0	0	116.3
173	T	31	Very low	29.7	Very low	133 Å²	133	135.5 Å²	135.5	82%	0.816	76%	0.76	S	S	*	*			trans	-159.8	134.4	136.9	38.2	0	0	0	0	107.6
174	T	25.4	Very low	29.8	Very low	105 Å²	105	131.8 Å²	131.8	64%	0.644	75%	0.753	S	S	*	*			cis	89.9	137.7	31.6	66.7	0	0	0	0	116
175	N	30.8	Very low	30.4	Very low	132 Å²	132	134.9 Å²	134.9	71%	0.706	76%	0.755	S	S	*	*			trans	97.6	113.5	175.1	-51	-26.8	0	0	0	114.3
176	N	27.3	Very low	30.8	Very low	141 Å²	141	138.2 Å²	138.2	75%	0.754	76%	0.758	S	S	*	*				78	135.7	84.9	-56.1	-17.9	0	0	0	111
177	E	34.4	Very low	31.2	Very low	175 Å²	175	140.5 Å²	140.5	82%	0.818	75%	0.754	S	S	*	*			cis	-147.2	133.2	48.1	-75.4	167	172.5	0	0	110.2
178	T	29.7	Very low	31.3	Very low	139 Å²	139	140.3 Å²	140.3	85%	0.853	75%	0.746	S	S	*	*				64.1	124.4	79	54.3	0	0	0	0	118.4
179	G	32.3	Very low	31.1	Very low	75 Å²	75	139.2 Å²	139.2	77%	0.773	74%	0.742	S	S	*	*			trans	128.9	74.6	175	0	0	0	0	0	112.4
180	D	30.6	Very low	31.6	Very low	158 Å²	158	142.3 Å²	142.3	85%	0.845	75%	0.746	S	S	*	*				70.5	142.3	79.2	-162	23.8	0	0	0	115.1
181	G	34.9	Very low	31.7	Very low	63 Å²	63	142.9 Å²	142.9	65%	0.649	74%	0.744	S	S	*	*			trans	114.4	74	-166.5	0	0	0	0	0	112.9
182	R	30.7	Very low	31.7	Very low	211 Å²	211	146.4 Å²	146.4	80%	0.796	75%	0.749	S	S	*	*				45.8	129.8	77	-76.9	-165.9	160.1	-152.6	0.2	113.1
183	L	31.9	Very low	32	Very low	116 Å²	116	142 Å²	142	61%	0.607	75%	0.747	S	S	*	*			cis	-167.1	129.8	18.8	-110.5	162.5	0	0	0	113.9
184	S	31	Very low	31.8	Very low	88 Å²	88	140.3 Å²	140.3	62%	0.615	74%	0.741	S	S	*	*				72.5	159.3	127.6	-144.8	0	0	0	0	123.1
185	K	37.9	Very low	32.1	Very low	160 Å²	160	142.7 Å²	142.7	70%	0.696	75%	0.748	S	S	*	*			trans	75.9	151.3	169.1	-52.1	126.3	-163.5	168.5	0	113.6
186	R	33.9	Very low	32	Very low	221 Å²	221	140.9 Å²	140.9	83%	0.834	75%	0.745	S	S	*	*			cis	-164	148.5	-10.7	-105.4	164.7	-171.9	179.2	0.9	105.5
187	K	37.3	Very low	32.3	Very low	161 Å²	161	144.4 Å²	144.4	70%	0.7	75%	0.748	S	S	*	*			cis	-160.4	-157.2	-10.9	-134.7	-172.5	-173	-167.6	0	110
188	Y	31.7	Very low	32.1	Very low	172 Å²	172	144.6 Å²	144.6	68%	0.675	75%	0.746	S	S	*	*			trans	-62	157.5	-178.4	-42.7	-51.1	0	0	0	115.3
189	S	31	Very low	32.3	Very low	101 Å²	101	145.4 Å²	145.4	71%	0.706	74%	0.74	S	S	*	*			cis	74.7	130	28.5	90.9	0	0	0	0	117.1
190	K	36.5	Very low	32.2	Very low	182 Å²	182	148 Å²	148	79%	0.791	74%	0.741	S	S	*	*			trans	172.6	123.6	142.5	-97.7	172.1	-179.6	-174.6	0	115
191	N	32.5	Very low	32.4	Very low	145 Å²	145	143.2 Å²	143.2	78%	0.775	73%	0.728	S	S	*	*			trans	72	114.2	132.6	-58	7.3	0	0	0	123.3
192	H	28	Very low	32.4	Very low	184 Å²	184	144.5 Å²	144.5	85%	0.852	72%	0.716	S	S	*	*			trans	-37.7	162.2	136.7	-77.5	-65.9	0	0	0	114.7
193	P	33	Very low	32.5	Very low	120 Å²	120	144.1 Å²	144.1	78%	0.779	72%	0.716	S	S	*	*			cis	-151.6	-165.2	49.3	44.9	-22.8	0	0	0	118.7
194	S	27.6	Very low	32.5	Very low	98 Å²	98	145.8 Å²	145.8	69%	0.685	72%	0.724	S	S	*	*			trans	-64.2	163.5	179.6	49.1	0	0	0	0	116.3
195	I	30.4	Very low	32.6	Very low	155 Å²	155	150.7 Å²	150.7	80%	0.795	73%	0.734	S	S	*	*				178.4	167.2	124.7	-92.3	158.5	0	0	0	111.6
196	S	29.2	Very low	32.2	Very low	93 Å²	93	147.8 Å²	147.8	65%	0.65	74%	0.74	S	S	*	*			trans	-116.5	155.6	-163	59.8	0	0	0	0	116.5
197	R	32.9	Very low	31.9	Very low	215 Å²	215	140.4 Å²	140.4	81%	0.811	73%	0.733	S	S	*	*			trans	168.9	139.5	141.6	-93.6	159.8	-86	-162.8	-3.7	108.4
198	K	31.2	Very low	31.5	Very low	179 Å²	179	140.2 Å²	140.2	78%	0.778	74%	0.738	S	S	*	*			cis	101.3	144.4	34.1	-87.6	-164.8	173.4	-174.6	0	113.2
199	H	34.2	Very low	31.4	Very low	157 Å²	157	138 Å²	138	73%	0.727	74%	0.738	S	S	*	*			trans	78.1	130.6	178.1	-54.9	-71.5	0	0	0	115.7
200	T	30.1	Very low	31.4	Very low	130 Å²	130	139.6 Å²	139.6	80%	0.798	74%	0.738	S	S	*	*			cis	83	108.6	22.7	78.4	0	0	0	0	116.6
201	G	34.2	Very low	31.2	Very low	56 Å²	56	137.8 Å²	137.8	58%	0.577	74%	0.736	S	S	*	*			trans	-168.3	139.5	168.8	0	0	0	0	0	111.9	I1082	G201-I1082 WeakPolarHBondContact O-CD1 3.42Å
202	K	34.8	Very low	31	Very low	91 Å²	91	137.2 Å²	137.2	40%	0.396	74%	0.738	S	S	.	*			trans	-98.8	159.4	179.8	-70.9	138.7	72.5	165.1	0	110.3	E1079 N1080	K202-E1079 IonicContact NZ-OE2 2.77Å; K202-E1079 PolarHBondContact NZ-OE2 3.48Å; K202-N1080 HydrophobicContact CD-CB 3.94Å; K202-N1080 VanDerWaalsContact CE-ND2 3.32Å; K202-N1080 WeakPolarHBondContact CE-ND2 3.11Å; K202-N1080 HydrophobicContact CG-CB 3.68Å
203	Y	34	Very low	31.1	Very low	202 Å²	202	131.8 Å²	131.8	79%	0.792	73%	0.732	S	S	*	*				170.5	179.3	114.4	-85.5	-60.3	0	0	0	112.6
204	I	32.2	Very low	31	Very low	151 Å²	151	133.3 Å²	133.3	77%	0.774	73%	0.733	S	S	*	*			trans	-135.3	151.5	-155.4	-40.3	174.3	0	0	0	110.7
205	K	31.7	Very low	31.2	Very low	191 Å²	191	135.5 Å²	135.5	83%	0.83	74%	0.737	S	S	*	*			trans	116.8	126.3	131.6	-160.7	177.4	-179.2	-175.1	0	117.2
206	A	29.3	Very low	31.2	Very low	99 Å²	99	136.8 Å²	136.8	82%	0.818	74%	0.739	S	S	*	*			trans	40.8	134.5	154.5	0	0	0	0	0	119.3
207	G	27.7	Very low	31.4	Very low	66 Å²	66	137.3 Å²	137.3	68%	0.68	74%	0.741	S	S	*	*			cis	146	-172.7	29.5	0	0	0	0	0	109.2
208	I	29.6	Very low	31.3	Very low	157 Å²	157	134 Å²	134	81%	0.805	74%	0.737	S	S	*	*			trans	71.2	92	162.2	-57.5	178.9	0	0	0	116.7
209	N	30.3	Very low	31.1	Very low	127 Å²	127	131.5 Å²	131.5	68%	0.679	74%	0.737	S	S	*	*				73.7	121.1	123.4	-61.5	5.8	0	0	0	123.3
210	N	30.4	Very low	31	Very low	133 Å²	133	131.8 Å²	131.8	71%	0.711	74%	0.742	S	S	*	*				88.1	155.8	124.5	-66.7	1	0	0	0	122.1
211	I	31.5	Very low	30.8	Very low	144 Å²	144	129.7 Å²	129.7	74%	0.738	73%	0.732	S	S	*	*			trans	67	87.6	162.6	-64.6	145.9	0	0	0	114
212	T	28.7	Very low	30.7	Very low	133 Å²	133	134 Å²	134	82%	0.816	74%	0.743	S	S	*	*				56.9	115	78	71.3	0	0	0	0	114.9
213	G	29	Very low	30.4	Very low	70 Å²	70	136.8 Å²	136.8	72%	0.722	76%	0.762	S	S	*	*			trans	178.2	97.4	170.6	0	0	0	0	0	116.5
214	L	31.2	Very low	30.4	Very low	153 Å²	153	134.5 Å²	134.5	80%	0.801	76%	0.762	S	S	*	*			trans	61.6	116	136.3	-59.4	168.3	0	0	0	121.9
215	N	32.4	Very low	30.3	Very low	144 Å²	144	132.7 Å²	132.7	77%	0.77	76%	0.758	S	S	*	*				85.2	117.5	129	-57.6	-4.1	0	0	0	122.1
216	Q	29.5	Very low	30.4	Very low	182 Å²	182	130 Å²	130	85%	0.85	75%	0.752	S	S	*	*			trans	-92.2	-166.5	151	-38.6	170.8	-20.2	0	0	108.4
217	P	34.7	Very low	30.6	Very low	104 Å²	104	132.3 Å²	132.3	68%	0.675	75%	0.749	S	S	*	*			cis	-129.9	-136.3	-17.9	37.9	-17.2	0	0	0	110.9
218	I	29.8	Very low	30.7	Very low	144 Å²	144	133.4 Å²	133.4	74%	0.738	75%	0.747	S	S	*	*			trans	89.6	105.8	176.1	-56.6	165	0	0	0	112.3
219	V	26.9	Very low	31	Very low	127 Å²	127	131.8 Å²	131.8	77%	0.77	74%	0.74	S	S	*	*				75.7	116.2	51	-179.8	0	0	0	0	113.8
220	I	31.9	Very low	31.1	Very low	163 Å²	163	134.1 Å²	134.1	84%	0.836	74%	0.739	S	S	*	*			trans	-170.2	156.8	143.1	-99.5	151.8	0	0	0	109.5
221	S	26.8	Very low	31.2	Very low	86 Å²	86	135.8 Å²	135.8	60%	0.601	74%	0.74	S	S	*	*			trans	-86.9	177.2	-172.4	53.4	0	0	0	0	114.9
222	N	32.8	Very low	31.2	Very low	148 Å²	148	135.3 Å²	135.3	79%	0.791	74%	0.735	S	S	*	*				-170.5	157.9	110.3	-86.3	-12.1	0	0	0	113.4
223	N	28.5	Very low	31.5	Very low	149 Å²	149	135.5 Å²	135.5	80%	0.797	74%	0.736	S	S	*	*			trans	-106.8	169.1	-173.9	-57.1	-28.9	0	0	0	112.4
224	I	33.9	Very low	31.6	Very low	154 Å²	154	139.6 Å²	139.6	79%	0.79	74%	0.739	S	S	*	*			trans	170.8	112.1	150.5	-91.7	150.3	0	0	0	105.2
225	T	30.5	Very low	31.8	Very low	113 Å²	113	138.1 Å²	138.1	69%	0.693	74%	0.739	S	S	*	*				58.6	145.7	78	64	0	0	0	0	113.7
226	D	33	Very low	31.6	Very low	134 Å²	134	135.2 Å²	135.2	72%	0.717	74%	0.735	S	S	*	*			cis	-165.3	177.6	25.2	-142.8	-30	0	0	0	113.9
227	I	34.5	Very low	31.8	Very low	147 Å²	147	134.2 Å²	134.2	75%	0.754	74%	0.735	S	S	*	*			trans	71	149.8	155.1	-63.3	154.6	0	0	0	120
228	S	28.9	Very low	31.8	Very low	90 Å²	90	132.7 Å²	132.7	63%	0.629	73%	0.732	S	S	*	*			cis	-166.6	-175	-48.8	77.2	0	0	0	0	111.5
229	D	34.9	Very low	32	Very low	123 Å²	123	131.6 Å²	131.6	66%	0.658	73%	0.732	S	S	*	*			trans	78.6	108.9	160.9	-71.2	23.7	0	0	0	120
230	R	34	Very low	32.1	Very low	176 Å²	176	131.3 Å²	131.3	66%	0.664	73%	0.726	S	S	*	*				91.6	140	83.9	-79.3	174.4	-171.8	-93.1	3.9	112.2	E232	R230-E232 IonicContact NH1-OE1 3.22Å; R230-E232 PolarHBondContact NH1-OE1 3.12Å
231	F	32.7	Very low	32.2	Very low	168 Å²	168	131.3 Å²	131.3	74%	0.737	72%	0.722	S	S	*	*			cis	-126.8	145.1	26	-76	-100.2	0	0	0	111.4
232	E	30.7	Very low	32.2	Very low	133 Å²	133	131.5 Å²	131.5	62%	0.621	72%	0.723	S	S	*	*				58.7	135.9	86.9	-55.2	173.6	-173.5	0	0	113.8	R230	R230-E232 IonicContact NH1-OE1 3.22Å; R230-E232 PolarHBondContact NH1-OE1 3.12Å
233	V	34.5	Very low	32	Very low	137 Å²	137	131.2 Å²	131.2	83%	0.83	72%	0.721	S	S	*	*			cis	-140.5	162.9	39.1	179.2	0	0	0	0	113.1
234	I	31.4	Very low	32	Very low	157 Å²	157	129.4 Å²	129.4	81%	0.805	72%	0.716	S	S	*	*			trans	-103.7	-145.9	-179.7	-9.7	179.5	0	0	0	109.6
235	P	35.7	Very low	31.9	Very low	121 Å²	121	129.4 Å²	129.4	79%	0.786	71%	0.712	S	S	*	*			cis	-108.1	-162.3	-27.9	12.7	14.2	0	0	0	111.1
236	A	28.7	Very low	31.7	Very low	84 Å²	84	129.9 Å²	129.9	69%	0.694	71%	0.711	S	S	*	*			cis	-169.7	-150.6	-38.3	0	0	0	0	0	108.7
237	D	33.8	Very low	31.7	Very low	160 Å²	160	130 Å²	130	86%	0.856	71%	0.711	S	S	*	*			trans	65.1	138.8	164.6	-66.2	-2.9	0	0	0	121.3
238	A	33.8	Very low	31.4	Very low	72 Å²	72	130.3 Å²	130.3	60%	0.595	71%	0.713	S	S	*	*			cis	-166.2	140.5	-12.8	0	0	0	0	0	113.3
239	T	34.2	Very low	31.4	Very low	122 Å²	122	134 Å²	134	75%	0.748	72%	0.718	S	S	*	*			trans	60.5	160.7	149.6	60.5	0	0	0	0	121
240	N	29.4	Very low	31.3	Very low	120 Å²	120	134.4 Å²	134.4	64%	0.642	72%	0.715	S	S	*	*			cis	-168.3	177.4	-32.5	-98.4	-9.5	0	0	0	108.7
241	H	33.1	Very low	31.1	Very low	163 Å²	163	131.3 Å²	131.3	76%	0.755	72%	0.716	S	S	*	*			trans	77.5	122.5	160.4	-54.2	-59.7	0	0	0	116.8
242	S	27.5	Very low	30.8	Very low	90 Å²	90	129.1 Å²	129.1	63%	0.629	72%	0.72	S	S	*	*			cis	85.3	145.3	41.4	82.2	0	0	0	0	113.2
243	L	28.7	Very low	30.9	Very low	143 Å²	143	127.9 Å²	127.9	75%	0.749	73%	0.726	S	S	*	*			cis	-163.8	137	29.6	-116.9	139.8	0	0	0	112
244	T	27.7	Very low	30.5	Very low	111 Å²	111	127.7 Å²	127.7	68%	0.681	72%	0.72	S	S	*	*			trans	51.3	161.6	138.1	52	0	0	0	0	127.8
245	H	31.7	Very low	30.4	Very low	153 Å²	153	126 Å²	126	71%	0.708	71%	0.712	S	S	*	*			trans	85.4	144.8	145.1	-107.1	-121.8	0	0	0	117.8
246	N	27.7	Very low	30.2	Very low	124 Å²	124	127.4 Å²	127.4	66%	0.663	71%	0.708	S	S	*	*			cis	160.6	176.1	-26.2	-103.9	-22.7	0	0	0	106.6
247	L	31.7	Very low	30.2	Very low	137 Å²	137	128.7 Å²	128.7	72%	0.717	70%	0.704	S	S	*	*			trans	83.8	119	173.8	-48.9	174.9	0	0	0	113.8
248	L	27.9	Very low	30	Very low	152 Å²	152	126.8 Å²	126.8	80%	0.796	70%	0.698	S	S	*	*				63.3	115.8	67.5	-63.6	178.3	0	0	0	110.4
249	K	29.8	Very low	29.9	Very low	169 Å²	169	128.6 Å²	128.6	74%	0.735	70%	0.701	S	S	*	*				-165.6	-176.4	51.9	-105.5	155.8	152.9	-138.2	0	108.4
250	E	31.8	Very low	29.7	Very low	131 Å²	131	128.6 Å²	128.6	61%	0.612	70%	0.697	S	S	*	*			cis	-157.6	139.4	14.3	-137.1	137.4	-150.1	0	0	112.8
251	T	30.7	Very low	29.9	Very low	111 Å²	111	130 Å²	130	68%	0.681	70%	0.7	S	S	*	*			trans	38.6	129.6	141.1	60	0	0	0	0	125.9
252	C	26.2	Very low	30.1	Very low	121 Å²	121	129.8 Å²	129.8	82%	0.818	70%	0.704	S	S	*	*				61.9	148.8	125.5	-54.8	0	0	0	0	120.3
253	S	32	Very low	30.5	Very low	107 Å²	107	128.8 Å²	128.8	75%	0.748	71%	0.708	S	S	*	*			cis	-168.2	-179.6	15.6	-110.1	0	0	0	0	109
254	L	27.5	Very low	30.9	Very low	133 Å²	133	130 Å²	130	70%	0.696	71%	0.709	S	S	*	*			cis	174.4	144.9	-30.2	173.1	62.1	0	0	0	109.6
255	N	29.3	Very low	31.2	Very low	122 Å²	122	131.1 Å²	131.1	65%	0.652	71%	0.711	S	S	*	*			trans	66.8	165.1	164.1	-79.5	-11.1	0	0	0	118.2
256	Q	31.2	Very low	31.4	Very low	150 Å²	150	131.2 Å²	131.2	70%	0.701	71%	0.714	S	S	*	*			cis	-174.9	169.1	-27.6	-112.1	-169.6	76.1	0	0	108.6
257	N	29.4	Very low	31.5	Very low	112 Å²	112	132.6 Å²	132.6	60%	0.599	72%	0.722	S	S	*	*			cis	-168.4	174.1	-15.9	-151.9	-16.4	0	0	0	110.6
258	T	28.2	Very low	31.5	Very low	119 Å²	119	129.6 Å²	129.6	73%	0.73	73%	0.725	S	S	*	*			trans	64.1	160.8	152.9	51.2	0	0	0	0	119.8
259	V	32.1	Very low	31.9	Very low	110 Å²	110	131.9 Å²	131.9	67%	0.667	73%	0.728	S	S	*	*			cis	-160.6	146.8	1.3	110.3	0	0	0	0	112.5
260	N	29.8	Very low	31.9	Very low	122 Å²	122	133.4 Å²	133.4	65%	0.652	73%	0.734	S	S	*	*			trans	48.5	171.3	152	-50.5	0.2	0	0	0	122
261	E	34.9	Very low	32	Very low	151 Å²	151	132.8 Å²	132.8	71%	0.706	75%	0.745	S	S	*	*			cis	-158.8	158.8	0.9	-135.4	142.9	-124.6	0	0	111.9
262	D	36.7	Very low	32.1	Very low	157 Å²	157	136.9 Å²	136.9	84%	0.84	75%	0.753	S	S	*	*			trans	36.2	150.2	157.8	-59.1	-15	0	0	0	123.9
263	G	36.3	Very low	32.3	Very low	69 Å²	69	138.4 Å²	138.4	71%	0.711	75%	0.752	S	S	*	*			cis	-157.2	-152.1	3.2	0	0	0	0	0	109.3
264	H	36.4	Very low	32.5	Very low	168 Å²	168	139.3 Å²	139.3	78%	0.778	75%	0.749	S	S	*	*			cis	-160.4	157.8	-10.2	-110.9	50.8	0	0	0	106.2
265	L	33.2	Very low	33.1	Very low	136 Å²	136	141.5 Å²	141.5	71%	0.712	75%	0.753	S	S	*	*				70.9	130.4	56	-74.4	169.8	0	0	0	114.6
266	I	36.3	Very low	33.5	Very low	154 Å²	154	143.8 Å²	143.8	79%	0.79	77%	0.765	S	S	*	*			cis	-144.1	167.6	20.5	-59.1	-179.4	0	0	0	113.4
267	N	29.1	Very low	33.2	Very low	153 Å²	153	142.3 Å²	142.3	82%	0.818	77%	0.77	S	S	*	*			trans	-79.1	166.6	179.1	-57.7	-84.8	0	0	0	117.7
268	G	32.9	Very low	33.4	Very low	75 Å²	75	142.7 Å²	142.7	77%	0.773	78%	0.778	S	S	*	*			trans	-157	160.1	164.6	0	0	0	0	0	114.2
269	K	35.4	Very low	33.4	Very low	199 Å²	199	143.3 Å²	143.3	87%	0.865	78%	0.782	S	S	*	*			trans	-143.2	139.6	-169	-72.8	174.8	-179.7	165.6	0	117.2
270	K	30	Very low	33.4	Very low	201 Å²	201	145.4 Å²	145.4	87%	0.874	79%	0.789	S	S	*	*			trans	44	113	142.6	-65.4	-176	175	-176.8	0	122.9
271	S	34.9	Very low	33.5	Very low	118 Å²	118	146.2 Å²	146.2	83%	0.825	79%	0.789	S	S	*	*				168.1	139.3	127.4	51.1	0	0	0	0	107.9
272	K	31.8	Very low	33.5	Very low	197 Å²	197	146.3 Å²	146.3	86%	0.857	79%	0.787	S	S	*	*			cis	100.2	121.6	20.9	-156.4	-173.2	-171.2	-167.8	0	113
273	L	31.7	Very low	33.3	Very low	153 Å²	153	145.7 Å²	145.7	80%	0.801	78%	0.783	S	S	*	*			trans	74.2	150.6	-166.1	-62.1	158.4	0	0	0	112.8
274	D	36.3	Very low	33.1	Very low	127 Å²	127	147.4 Å²	147.4	68%	0.679	79%	0.785	S	S	*	*			cis	-137	-176.7	6.4	-139.5	-40.7	0	0	0	113.7
275	K	38.4	Very low	33	Very low	178 Å²	178	144.8 Å²	144.8	77%	0.774	78%	0.781	S	S	*	*			trans	-75.8	140	-178.1	-54.1	161.7	-170.7	165.5	0	112.3
276	N	38.1	Very low	33	Very low	171 Å²	171	144.5 Å²	144.5	91%	0.914	78%	0.78	S	S	*	*			trans	-168	153.8	139.7	-97.1	-32.4	0	0	0	110
277	C	24.7	Very low	32.7	Very low	119 Å²	119	146 Å²	146	80%	0.804	78%	0.781	S	S	*	*			trans	-146.9	128.1	180	-177.6	0	0	0	0	110.5
278	P	35.2	Very low	33	Very low	119 Å²	119	147 Å²	147	77%	0.773	78%	0.78	S	S	*	*			trans	-116.8	149.4	158.1	35.9	-26	0	0	0	112.5
279	T	26.9	Very low	32.8	Very low	132 Å²	132	150 Å²	150	81%	0.81	78%	0.784	S	S	*	*			trans	-81.8	143.5	-177.3	-24.6	0	0	0	0	112.9
280	L	32	Very low	32.8	Very low	155 Å²	155	148 Å²	148	81%	0.812	78%	0.781	S	S	*	*			trans	-159.3	115.5	147.4	-124.9	76.5	0	0	0	106
281	E	31.5	Very low	32.9	Very low	138 Å²	138	144.8 Å²	144.8	65%	0.645	77%	0.773	S	S	*	*				48.1	129	97.2	-59	-160.7	149.4	0	0	114.4
282	K	35.9	Very low	32.6	Very low	154 Å²	154	147.3 Å²	147.3	67%	0.67	77%	0.774	S	S	*	*			cis	-163.8	160.1	33	-119.6	142.5	-177.5	149.6	0	111.8
283	N	31.9	Very low	32.6	Very low	143 Å²	143	144.1 Å²	144.1	77%	0.765	77%	0.771	S	S	*	*			trans	63	113.6	155	-54.9	-12.1	0	0	0	118.7
284	S	32.5	Very low	32.7	Very low	106 Å²	106	146.2 Å²	146.2	74%	0.741	77%	0.774	S	S	*	*				86.1	135.6	94.7	-153.9	0	0	0	0	113.1
285	T	35	Very low	32.4	Very low	113 Å²	113	151 Å²	151	69%	0.693	79%	0.785	S	S	*	*			cis	-151.2	160.1	21.1	-34.4	0	0	0	0	111.3
286	N	32.1	Very low	32.2	Very low	130 Å²	130	148.3 Å²	148.3	70%	0.695	79%	0.785	S	S	*	*			trans	12.1	129.1	163.1	-71.2	-29.9	0	0	0	120.8
287	K	31.1	Very low	32	Very low	185 Å²	185	146.3 Å²	146.3	80%	0.804	78%	0.779	S	S	*	*				59.3	138.8	69.6	-64.9	-178.1	177.6	178.8	0	112.6
288	Q	34.9	Very low	32.5	Very low	173 Å²	173	146.2 Å²	146.2	81%	0.808	78%	0.777	S	S	*	*			cis	-137.8	150.6	34.3	-63.4	170.4	-7.6	0	0	114.2
289	T	29.1	Very low	32.4	Very low	138 Å²	138	150 Å²	150	85%	0.847	78%	0.781	S	S	*	*			trans	-101.5	130	158.5	-53.6	0	0	0	0	107.5	D291	T289-D291 PolarHBondContact O-N 3.2Å
290	I	35.1	Very low	32.8	Very low	157 Å²	157	150.8 Å²	150.8	81%	0.805	78%	0.781	S	S	*	*			trans	-88	103.7	175.7	-59.2	177.6	0	0	0	108.2
291	D	32.5	Very low	32.9	Very low	134 Å²	134	148.3 Å²	148.3	72%	0.717	78%	0.776	S	S	*	*			trans	-93.7	149.2	173.9	-159.8	-3.1	0	0	0	110.7	T289 T293	T289-D291 PolarHBondContact O-N 3.2Å; D291-T293 PolarHBondContact O-N 3.24Å
292	M	28.2	Very low	33	Very low	171 Å²	171	149.4 Å²	149.4	84%	0.842	78%	0.781	S	S	*	*			trans	-89.6	82.4	-177.9	-83.7	178.3	-79.4	0	0	110.9
293	T	32.4	Very low	32.9	Very low	130 Å²	130	154 Å²	154	80%	0.798	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-65.9	132.3	174.3	43.1	0	0	0	0	112.1	D291	D291-T293 PolarHBondContact O-N 3.24Å
294	F	32.9	Very low	32.8	Very low	198 Å²	198	152.4 Å²	152.4	87%	0.868	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-70.5	156.7	174.3	-86	-127.2	0	0	0	111.4
295	Y	30.3	Very low	33	Very low	228 Å²	228	154.8 Å²	154.8	89%	0.894	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-60.3	130.4	163.3	-75.1	-91.1	0	0	0	110.5
296	P	34.9	Very low	32.9	Very low	120 Å²	120	156.3 Å²	156.3	78%	0.779	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-77.4	137	172.1	31.5	-33.1	0	0	0	110.8
297	T	34.1	Very low	33.2	Very low	130 Å²	130	158.8 Å²	158.8	80%	0.798	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-86.2	135.4	161.5	32.3	0	0	0	0	109.9
298	P	34.2	Very low	33.7	Very low	116 Å²	116	157 Å²	157	75%	0.753	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-69.3	149.7	177.2	29.1	-34.4	0	0	0	111.7
299	K	33.9	Very low	33.8	Very low	199 Å²	199	157 Å²	157	87%	0.865	80%	0.801	S	S	*	*			trans	-138.1	125.6	168.1	-76.2	-174.2	175.4	-174.6	0	107.8
300	D	35.3	Very low	34	Very low	148 Å²	148	159 Å²	159	79%	0.791	80%	0.801	S	S	*	*			trans	-131.1	151.8	173.7	-73.1	-63.1	0	0	0	110.7
301	S	33.8	Very low	34.1	Very low	103 Å²	103	155.3 Å²	155.3	72%	0.72	80%	0.802	S	S	*	*			trans	41.7	108.1	-179.2	55.9	0	0	0	0	116.8
302	Q	33.3	Very low	34.3	Very low	162 Å²	162	158 Å²	158	76%	0.757	81%	0.807	S	S	*	*				58.9	129.6	60.4	-164.7	-178.3	1.7	0	0	113
303	W	33	Very low	34.7	Very low	249 Å²	249	156 Å²	156	94%	0.943	81%	0.805	S	S	*	*			trans	-168.6	160.7	130.2	-107.3	48.2	0	0	0	107.8
304	N	29.9	Very low	34.7	Very low	110 Å²	110	157.4 Å²	157.4	59%	0.588	81%	0.808	S	S	*	*			trans	-87.7	163.7	-155.3	-47.7	-24	0	0	0	113.8
305	N	36.1	Very low	35	Very low	157 Å²	157	153.5 Å²	153.5	84%	0.84	81%	0.805	S	S	*	*				-173.2	154.9	107.6	-86.3	-6.2	0	0	0	110.7
306	D	33.3	Very low	35.2	Very low	144 Å²	144	149.6 Å²	149.6	77%	0.77	80%	0.8	S	S	*	*			trans	-93.4	158.1	-172.6	-48	-90.8	0	0	0	112.7
307	E	38.6	Very low	35.3	Very low	182 Å²	182	150.7 Å²	150.7	85%	0.85	80%	0.799	S	S	*	*			trans	175.4	104.5	135.2	-98.1	174	-152.1	0	0	111.9
308	D	41.2	Very low	35.7	Very low	149 Å²	149	153.5 Å²	153.5	80%	0.797	80%	0.803	S	S	*	*				68.2	143.2	126.7	-65.1	-3.5	0	0	0	127.4
309	E	37.6	Very low	36	Very low	171 Å²	171	154.5 Å²	154.5	80%	0.799	80%	0.802	S	S	*	*			trans	55.1	93	152.7	-59.3	-130.3	112.2	0	0	123.3
310	Q	34	Very low	36.3	Very low	180 Å²	180	151.2 Å²	151.2	84%	0.841	79%	0.794	S	S	*	*				18.9	116.8	124.3	-55.7	-172.6	40.6	0	0	120.1
311	G	35.8	Very low	36.4	Very low	81 Å²	81	150.2 Å²	150.2	84%	0.835	79%	0.793	S	S	*	*			trans	-145.1	113.4	161.3	0	0	0	0	0	112.9
312	K	37.4	Very low	36.9	Very low	189 Å²	189	153.8 Å²	153.8	82%	0.822	80%	0.795	S	S	*	*			trans	-85.7	139.2	178	-64.8	167.2	-178	162.5	0	110.8
313	T	36.5	Very low	37.3	Very low	129 Å²	129	152.9 Å²	152.9	79%	0.791	80%	0.796	S	S	*	*				178.6	129.3	100.9	38.2	0	0	0	0	114
314	N	32.4	Very low	37.8	Very low	161 Å²	161	147.2 Å²	147.2	86%	0.861	79%	0.789	S	S	*	*			trans	0.4	128.7	151.7	-47	-10.4	0	0	0	120.4
315	S	39.1	Very low	38.7	Very low	115 Å²	115	147.8 Å²	147.8	80%	0.804	80%	0.796	S	S	*	*				-158.3	138.5	125.7	67.4	0	0	0	0	112
316	D	35.4	Very low	39.4	Very low	147 Å²	147	146.4 Å²	146.4	79%	0.786	79%	0.793	S	S	*	*			trans	-51.4	143.2	-169.6	-54.9	-71.8	0	0	0	118.1
317	N	36.7	Very low	40	Very low	143 Å²	143	143.9 Å²	143.9	77%	0.765	79%	0.786	S	S	*	*			trans	-157.2	90.1	143.7	-120.7	-72.6	0	0	0	113	N319	N317-N319 PolarHBondContact O-N 3.35Å; N317-N319 PolarHBondContact OD1-ND2 2.87Å; N317-N319 VanDerWaalsContact OD1-ND2 3.15Å
318	Q	41.9	Very low	41	Very low	189 Å²	189	139 Å²	139	88%	0.883	77%	0.769	S	S	*	*			trans	-78.7	104.6	167.2	-69.2	-172.5	6	0	0	110.3
319	N	40.7	Very low	41.6	Very low	137 Å²	137	134.3 Å²	134.3	73%	0.733	76%	0.756	S	S	*	*			trans	-129.8	61.6	170.5	-95.4	-62.5	0	0	0	113.3	N317	N317-N319 PolarHBondContact O-N 3.35Å; N317-N319 PolarHBondContact OD1-ND2 2.87Å; N317-N319 VanDerWaalsContact OD1-ND2 3.15Å
320	N	40.9	Very low	42.3	Very low	130 Å²	130	129.1 Å²	129.1	70%	0.695	74%	0.742	S	S	*	*			trans	29	113.7	137.4	-163.8	-2.1	0	0	0	118.2	K322	N320-K322 PolarHBondContact O-N 2.92Å; N320-K322 VanDerWaalsContact O-N 3.13Å
321	V	37.4	Very low	43.4	Very low	127 Å²	127	128.7 Å²	128.7	77%	0.77	73%	0.734	S	S	*	*			trans	-54.1	113.1	174.3	178.9	0	0	0	0	111.3
322	K	44.1	Very low	44.7	Very low	178 Å²	178	131.7 Å²	131.7	77%	0.774	72%	0.724	S	S	*	*			trans	-109.7	112.2	168.1	-79.1	-179.6	178.2	170.3	0	110.2	N320 T324	N320-K322 PolarHBondContact O-N 2.92Å; N320-K322 VanDerWaalsContact O-N 3.13Å; K322-T324 PolarHBondContact O-N 3.04Å; K322-T324 VanDerWaalsContact O-N 3.16Å
323	N	41.5	Very low	45.4	Very low	142 Å²	142	132 Å²	132	76%	0.759	72%	0.722	S	S	*	*			trans	-48.9	118.6	175.2	-65.3	-18.2	0	0	0	110.9	V325	N323-V325 PolarHBondContact O-N 3.2Å
324	T	43.4	Very low	46.3	Very low	130 Å²	130	127.8 Å²	127.8	80%	0.798	69%	0.694	S	S	*	*			trans	-67.1	96.8	-178.9	-49	0	0	0	0	110.1	K322 V326	K322-T324 PolarHBondContact O-N 3.04Å; K322-T324 VanDerWaalsContact O-N 3.16Å; T324-V326 PolarHBondContact O-N 2.95Å
325	V	49.3	Very low	48	Very low	122 Å²	122	123.4 Å²	123.4	74%	0.739	68%	0.676	S	S	*	*			trans	-59	105.3	175.6	177.8	0	0	0	0	108.8	N323 S327	N323-V325 PolarHBondContact O-N 3.2Å; V325-S327 PolarHBondContact O-N 3.39Å; V325-S327 PolarHBondContact O-OG 3.4Å
326	V	51.2	Low	49.2	Very low	129 Å²	129	127.9 Å²	127.9	78%	0.782	68%	0.675	S	S	*	*			trans	-59	105.3	-176.3	178.2	0	0	0	0	108.8	T324 T328	T324-V326 PolarHBondContact O-N 2.95Å; V326-T328 PolarHBondContact O-N 3.26Å
327	S	46.2	Very low	50.3	Low	90 Å²	90	127.9 Å²	127.9	63%	0.629	66%	0.664	S	S	*	*			trans	-71.1	105.5	-165.1	-78.2	0	0	0	0	111.9	V325 G329 A330	V325-S327 PolarHBondContact O-N 3.39Å; V325-S327 PolarHBondContact O-OG 3.4Å; S327-G329 PolarHBondContact O-N 3.38Å; S327-A330 WeakPolarHBondContact O-CB 3.32Å; S327-A330 PolarHBondContact O-N 3.47Å
328	T	59.5	Low	51.7	Low	80 Å²	80	124 Å²	124	49%	0.491	64%	0.641	S	S	.	*	T	Hydrogen-bonded Turn	trans	-66.3	14.9	177.7	45.5	0	0	0	0	114.8	V326 Y331 T870	V326-T328 PolarHBondContact O-N 3.26Å; T328-Y331 WeakPolarHBondContact O-CD1 3.45Å; T328-Y331 WeakPolarHBondContact O-CE1 3.43Å; T328-T870 HydrophobicContact CG2-CG2 4.07Å
329	G	52.7	Low	52.9	Low	50 Å²	50	118.8 Å²	118.8	52%	0.515	62%	0.616	S	S	.	*	T	Hydrogen-bonded Turn	trans	-94.5	-17.3	163.4	0	0	0	0	0	114.5	S327 Y331 K332	S327-G329 PolarHBondContact O-N 3.38Å; G329-Y331 PolarHBondContact O-N 3.29Å; G329-Y331 VanDerWaalsContact O-N 3.1Å; G329-K332 PolarHBondContact O-N 3.32Å
330	A	52.9	Low	54.2	Low	62 Å²	62	115 Å²	115	51%	0.512	60%	0.595	S	S	.	*	T	Hydrogen-bonded Turn	trans	-61.8	-25.4	-168.5	0	0	0	0	0	114.4	S327 K332 L334	S327-A330 WeakPolarHBondContact O-CB 3.32Å; S327-A330 PolarHBondContact O-N 3.47Å; A330-K332 PolarHBondContact O-N 3.39Å; A330-L334 PolarHBondContact O-N 3.25Å
331	Y	56.9	Low	55.4	Low	172 Å²	172	116.1 Å²	116.1	68%	0.675	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.5	-24.4	-179.8	62.8	-105.7	0	0	0	113.9	T328 G329	T328-Y331 WeakPolarHBondContact O-CD1 3.45Å; T328-Y331 WeakPolarHBondContact O-CE1 3.43Å; G329-Y331 PolarHBondContact O-N 3.29Å; G329-Y331 VanDerWaalsContact O-N 3.1Å
332	K	63.7	Low	56.7	Low	144 Å²	144	117.4 Å²	117.4	63%	0.626	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.4	-41.4	-177.1	-164.9	171	-177.1	177.8	0	111.6	G329 A330 K339	G329-K332 PolarHBondContact O-N 3.32Å; A330-K332 PolarHBondContact O-N 3.39Å; K332-K339 PolarHBondContact O-NZ 3.27Å
333	Y	50.8	Low	57.8	Low	195 Å²	195	115.5 Å²	115.5	77%	0.765	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108	19.4	-174.6	-61.2	-74.1	0	0	0	114.7	S335	Y333-S335 PolarHBondContact O-N 2.98Å; Y333-S335 VanDerWaalsContact O-N 3.11Å
334	L	56.3	Low	59.6	Low	40 Å²	40	115.1 Å²	115.1	21%	0.209	56%	0.557	C	S	.	*			trans	-54.4	122.7	162.8	-62.5	-178.3	0	0	0	108.6	A330 E338 K339	A330-L334 PolarHBondContact O-N 3.25Å; L334-E338 HydrophobicContact CB-CB 4.43Å; L334-E338 HydrophobicContact CD2-CG 4.01Å; L334-K339 HydrophobicContact CB-CG 4.01Å; L334-K339 VanDerWaalsContact O-CD 3.31Å; L334-K339 WeakPolarHBondContact O-CD 3.48Å; L334-K339 WeakPolarHBondContact O-CE 3.34Å; L334-K339 PolarHBondContact O-NZ 3.35Å
335	S	68.6	Low	61.6	Low	69 Å²	69	110.7 Å²	110.7	48%	0.483	53%	0.527	S	S	.	.			trans	-60.6	160.9	179.5	66.5	0	0	0	0	110.7	Y333 R337 E338 K339	Y333-S335 PolarHBondContact O-N 2.98Å; Y333-S335 VanDerWaalsContact O-N 3.11Å; S335-R337 PolarHBondContact O-N 3.48Å; S335-R337 VanDerWaalsContact O-N 3.13Å; S335-E338 PolarHBondContact O-N 3.1Å; S335-E338 PolarHBondContact OG-N 2.78Å; S335-K339 PolarHBondContact O-N 3.27Å
336	W	63.2	Low	63.4	Low	209 Å²	209	110.5 Å²	110.5	79%	0.792	51%	0.513	S	S	*	.	H	α-helix	trans	-53.7	-34.3	176	-81.4	106.8	0	0	0	112.4	K339 D340	W336-K339 PolarHBondContact O-N 2.85Å; W336-D340 VanDerWaalsContact O-CB 3.24Å; W336-D340 WeakPolarHBondContact O-CB 3.34Å; W336-D340 PolarHBondContact O-N 3.11Å
337	R	57.8	Low	65.1	Low	148 Å²	148	109.8 Å²	109.8	56%	0.558	50%	0.501	S	S	*	.	H	α-helix	trans	-60.7	-47.7	173.1	-69.7	176	164.6	101.5	-13.5	113.4	S335 D340 R341 Q1062	S335-R337 PolarHBondContact O-N 3.48Å; S335-R337 VanDerWaalsContact O-N 3.13Å; R337-D340 PolarHBondContact O-N 3.35Å; R337-R341 PolarHBondContact O-N 3.3Å; R337-Q1062 VanDerWaalsContact CZ-OE1 3.22Å; R337-Q1062 VanDerWaalsContact NH2-CD 3.34Å
338	E	67.6	Low	67	Low	60 Å²	60	108.9 Å²	108.9	28%	0.28	49%	0.487	S	S	.	.	H	α-helix	trans	-78.2	-23.4	-179.5	-173	51.9	-139.3	0	0	112.2	L334 S335 R341	L334-E338 HydrophobicContact CB-CB 4.43Å; L334-E338 HydrophobicContact CD2-CG 4.01Å; S335-E338 PolarHBondContact O-N 3.1Å; S335-E338 PolarHBondContact OG-N 2.78Å; E338-R341 WeakPolarHBondContact OE2-CD 3.34Å; E338-R341 IonicContact OE2-NH1 2.72Å; E338-R341 PolarHBondContact OE2-NH1 3.2Å
339	K	65.5	Low	68.5	Low	81 Å²	81	105.6 Å²	105.6	35%	0.352	47%	0.465	S	S	.	.	H	α-helix	trans	-70.9	-35.6	165.8	-74.9	168.4	174.6	144.8	0	112.1	K332 L334 S335 W336	K332-K339 PolarHBondContact O-NZ 3.27Å; L334-K339 HydrophobicContact CB-CG 4.01Å; L334-K339 VanDerWaalsContact O-CD 3.31Å; L334-K339 WeakPolarHBondContact O-CD 3.48Å; L334-K339 WeakPolarHBondContact O-CE 3.34Å; L334-K339 PolarHBondContact O-NZ 3.35Å; S335-K339 PolarHBondContact O-N 3.27Å; W336-K339 PolarHBondContact O-N 2.85Å
340	D	68.1	Low	70.4	Confident	56 Å²	56	105.6 Å²	105.6	30%	0.299	45%	0.451	S	S	.	.	H	α-helix	trans	-72.4	-36.6	174.7	178	60.1	0	0	0	112.7	W336 R337 R342 R343 R344	W336-D340 VanDerWaalsContact O-CB 3.24Å; W336-D340 WeakPolarHBondContact O-CB 3.34Å; W336-D340 PolarHBondContact O-N 3.11Å; R337-D340 PolarHBondContact O-N 3.35Å; D340-R342 PolarHBondContact O-N 3.36Å; D340-R343 CarbonylContact O-C 3.59Å; D340-R343 WeakPolarHBondContact O-CA 3.3Å; D340-R343 WeakPolarHBondContact O-CB 3.5Å; D340-R343 PolarHBondContact O-N 3.17Å; D340-R344 PolarHBondContact O-N 3.26Å; D340-R344 IonicContact OD2-CZ 2.88Å; D340-R344 VanDerWaalsContact OD2-CZ 3.22Å; D340-R344 IonicContact OD2-NE 3.85Å; D340-R344 PolarHBondContact OD2-NE 3.48Å; D340-R344 IonicContact OD2-NH2 3.84Å; D340-R344 PolarHBondContact OD2-NH2 3.21Å
341	R	66.5	Low	72.2	Confident	154 Å²	154	105.8 Å²	105.8	58%	0.581	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	-22.2	174.2	-162.8	-178.2	-176.1	-169.5	1.1	113.6	R337 E338	R337-R341 PolarHBondContact O-N 3.3Å; E338-R341 WeakPolarHBondContact OE2-CD 3.34Å; E338-R341 IonicContact OE2-NH1 2.72Å; E338-R341 PolarHBondContact OE2-NH1 3.2Å
342	R	64.4	Low	73.7	Confident	155 Å²	155	100.1 Å²	100.1	59%	0.585	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.2	-4.6	174	-58.8	-179.7	-176.2	-151.3	-2.7	114.6	D340	D340-R342 PolarHBondContact O-N 3.36Å
343	R	68.6	Low	75.1	Confident	137 Å²	137	95.7 Å²	95.7	52%	0.517	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.2	-11.7	176.7	-62.5	179.2	-178.1	-138.7	5.8	113.2	D340 R375	D340-R343 CarbonylContact O-C 3.59Å; D340-R343 WeakPolarHBondContact O-CA 3.3Å; D340-R343 WeakPolarHBondContact O-CB 3.5Å; D340-R343 PolarHBondContact O-N 3.17Å; R343-R375 WeakPolarHBondContact CA-O 3.25Å; R343-R375 WeakPolarHBondContact O-CB 3.33Å
344	R	79.1	Confident	77.1	Confident	134 Å²	134	86.4 Å²	86.4	51%	0.506	37%	0.365	S	S	.	.	S	Bend	trans	-64.9	137.2	171.2	-68.4	179.3	-173.1	-136.5	-8.3	109	D340 W349	D340-R344 PolarHBondContact O-N 3.26Å; D340-R344 IonicContact OD2-CZ 2.88Å; D340-R344 VanDerWaalsContact OD2-CZ 3.22Å; D340-R344 IonicContact OD2-NE 3.85Å; D340-R344 PolarHBondContact OD2-NE 3.48Å; D340-R344 IonicContact OD2-NH2 3.84Å; D340-R344 PolarHBondContact OD2-NH2 3.21Å; R344-W349 WeakPolarHBondContact O-CH2 3.16Å
345	F	85.7	Confident	78.9	Confident	38 Å²	38	84.5 Å²	84.5	17%	0.167	36%	0.355	C	S	.	.			trans	-60.2	147	166.7	-173	-94.8	0	0	0	108.3	W349 K350 V355 P357 V363	F345-W349 HydrophobicContact CD2-CE3 4.14Å; F345-W349 HydrophobicContact CE2-CB 4.49Å; F345-W349 HydrophobicContact CE2-CE3 4.38Å; F345-W349 HydrophobicContact CZ-CB 4.4Å; F345-K350 HydrophobicContact CE1-CG 3.91Å; F345-K350 HydrophobicContact CZ-CG 3.82Å; F345-V355 HydrophobicContact CE2-CG2 4.17Å; F345-P357 HydrophobicContact CD1-CG 4.44Å; F345-P357 HydrophobicContact CD2-CB 4.33Å; F345-P357 HydrophobicContact CG-CB 4.23Å; F345-V363 HydrophobicContact CD2-CG2 3.87Å; F345-V363 HydrophobicContact CE2-CG1 4.21Å; F345-V363 HydrophobicContact CE2-CG2 4.28Å
346	R	87.2	Confident	80	Confident	118 Å²	118	82.3 Å²	82.3	45%	0.445	34%	0.338	S	S	.	.			trans	-127.9	143.7	176.4	-55.8	-168	174.2	-164.6	-5.1	111.3	E348 W349	R346-E348 VanDerWaalsContact C-N 3.33Å; R346-E348 VanDerWaalsContact CB-OE2 3.25Å; R346-E348 WeakPolarHBondContact CB-OE2 3.38Å; R346-E348 WeakPolarHBondContact CD-OE1 3.32Å; R346-E348 IonicContact CZ-OE1 3.39Å; R346-E348 IonicContact NE-OE1 3.42Å; R346-E348 IonicContact NH1-OE1 2.96Å; R346-E348 PolarHBondContact NH1-OE1 2.95Å; R346-E348 PolarHBondContact O-N 3.13Å; R346-W349 HydrophobicContact CB-CD2 3.99Å; R346-W349 HydrophobicContact CB-CG 4.24Å; R346-W349 HydrophobicContact CB-CZ2 4.21Å; R346-W349 HydrophobicContact CG-CD2 4.42Å; R346-W349 HydrophobicContact CG-CH2 4.19Å; R346-W349 HydrophobicContact CG-CZ2 3.73Å; R346-W349 WeakPolarHBondContact O-CB 3.45Å; R346-W349 PolarHBondContact O-N 2.94Å
347	E	86.2	Confident	81.3	Confident	113 Å²	113	75.2 Å²	75.2	53%	0.528	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-33.6	-171.5	-162.8	65.7	179.9	0	0	112.3	W349 K350	E347-W349 PolarHBondContact O-N 2.74Å; E347-K350 WeakPolarHBondContact O-CB 3.48Å; E347-K350 PolarHBondContact O-N 2.77Å; E347-K350 WeakPolarHBondContact OE1-CD 3.38Å; E347-K350 WeakPolarHBondContact OE1-CE 3.27Å; E347-K350 IonicContact OE1-NZ 3.05Å; E347-K350 PolarHBondContact OE1-NZ 3.29Å; E347-K350 WeakPolarHBondContact OE2-CD 3.45Å; E347-K350 WeakPolarHBondContact OE2-CE 3.45Å; E347-K350 IonicContact OE2-NZ 3.77Å; E347-K350 PolarHBondContact OE2-NZ 2.96Å
348	E	86.5	Confident	82.7	Confident	71 Å²	71	71.6 Å²	71.6	33%	0.332	31%	0.308	S	S	.	.	H	α-helix	trans	-62.8	-16.4	174.8	74.8	-86.3	-164.9	0	0	113.1	R346 K350 L352	R346-E348 VanDerWaalsContact C-N 3.33Å; R346-E348 VanDerWaalsContact CB-OE2 3.25Å; R346-E348 WeakPolarHBondContact CB-OE2 3.38Å; R346-E348 WeakPolarHBondContact CD-OE1 3.32Å; R346-E348 IonicContact CZ-OE1 3.39Å; R346-E348 IonicContact NE-OE1 3.42Å; R346-E348 IonicContact NH1-OE1 2.96Å; R346-E348 PolarHBondContact NH1-OE1 2.95Å; R346-E348 PolarHBondContact O-N 3.13Å; E348-K350 VanDerWaalsContact C-N 3.31Å; E348-K350 PolarHBondContact O-N 3.4Å; E348-L352 HydrophobicContact CB-CD1 4.27Å; E348-L352 HydrophobicContact CG-CD1 4.33Å; E348-L352 VanDerWaalsContact O-CB 3.28Å; E348-L352 WeakPolarHBondContact O-CB 3.47Å; E348-L352 WeakPolarHBondContact O-CD1 3.36Å; E348-L352 WeakPolarHBondContact O-CG 3.38Å; E348-L352 PolarHBondContact O-N 3.07Å
349	W	90.9	Very high	83.6	Confident	11 Å²	11	71.8 Å²	71.8	4%	0.042	33%	0.326	C	S	.	.	H	α-helix	trans	-75.2	-21	176.6	-56.9	-10	0	0	0	113.1	R344 F345 R346 E347 W353 V355 L377 I380	R344-W349 WeakPolarHBondContact O-CH2 3.16Å; F345-W349 HydrophobicContact CD2-CE3 4.14Å; F345-W349 HydrophobicContact CE2-CB 4.49Å; F345-W349 HydrophobicContact CE2-CE3 4.38Å; F345-W349 HydrophobicContact CZ-CB 4.4Å; R346-W349 HydrophobicContact CB-CD2 3.99Å; R346-W349 HydrophobicContact CB-CG 4.24Å; R346-W349 HydrophobicContact CB-CZ2 4.21Å; R346-W349 HydrophobicContact CG-CD2 4.42Å; R346-W349 HydrophobicContact CG-CH2 4.19Å; R346-W349 HydrophobicContact CG-CZ2 3.73Å; R346-W349 WeakPolarHBondContact O-CB 3.45Å; R346-W349 PolarHBondContact O-N 2.94Å; E347-W349 PolarHBondContact O-N 2.74Å; W349-W353 PolarHBondContact O-N 3.11Å; W349-W353 VanDerWaalsContact O-N 3.11Å; W349-V355 HydrophobicContact CB-CG2 3.9Å; W349-V355 VanDerWaalsContact O-CG2 3.27Å; W349-V355 WeakPolarHBondContact O-CG2 3.26Å; W349-L377 HydrophobicContact CD2-CD1 4.49Å; W349-L377 HydrophobicContact CZ2-CB 4.15Å; W349-L377 HydrophobicContact CZ2-CD1 4.08Å; W349-I380 HydrophobicContact CD2-CD1 4.19Å; W349-I380 HydrophobicContact CE3-CD1 3.45Å; W349-I380 VanDerWaalsContact CE3-CD1 3.45Å; W349-I380 HydrophobicContact CZ3-CD1 3.75Å
350	K	91.8	Very high	84.2	Confident	51 Å²	51	74.9 Å²	74.9	22%	0.222	35%	0.345	C	S	.	.	H	α-helix	trans	-58.7	-58.8	-179.3	-75.7	-175.8	179.4	170.6	0	111.9	F345 E347 E348 L354 V355 F403	F345-K350 HydrophobicContact CE1-CG 3.91Å; F345-K350 HydrophobicContact CZ-CG 3.82Å; E347-K350 WeakPolarHBondContact O-CB 3.48Å; E347-K350 PolarHBondContact O-N 2.77Å; E347-K350 WeakPolarHBondContact OE1-CD 3.38Å; E347-K350 WeakPolarHBondContact OE1-CE 3.27Å; E347-K350 IonicContact OE1-NZ 3.05Å; E347-K350 PolarHBondContact OE1-NZ 3.29Å; E347-K350 WeakPolarHBondContact OE2-CD 3.45Å; E347-K350 WeakPolarHBondContact OE2-CE 3.45Å; E347-K350 IonicContact OE2-NZ 3.77Å; E347-K350 PolarHBondContact OE2-NZ 2.96Å; E348-K350 VanDerWaalsContact C-N 3.31Å; E348-K350 PolarHBondContact O-N 3.4Å; K350-L354 WeakPolarHBondContact O-CA 3.14Å; K350-L354 PolarHBondContact O-N 3.41Å; K350-L354 VanDerWaalsContact O-N 3.1Å; K350-V355 WeakPolarHBondContact CA-O 3.42Å; K350-V355 PolarHBondContact O-N 2.93Å; K350-F403 HydrophobicContact CB-CD2 4.22Å; K350-F403 HydrophobicContact CB-CE2 3.62Å; K350-F403 HydrophobicContact CB-CZ 3.83Å; K350-F403 HydrophobicContact CD-CE2 4.38Å; K350-F403 HydrophobicContact CD-CZ 3.89Å; K350-F403 HydrophobicContact CG-CE2 4.11Å; K350-F403 HydrophobicContact CG-CZ 4.13Å; K350-F403 VanDerWaalsContact O-CD2 3.24Å; K350-F403 WeakPolarHBondContact O-CD2 3.32Å
351	H	89.9	Confident	84.9	Confident	65 Å²	65	78.8 Å²	78.8	30%	0.301	36%	0.362	S	S	.	.	H	α-helix	trans	-79.9	-38.1	179.4	49.4	-95.6	0	0	0	112.6	W353 L354 K399 Y400	H351-W353 PolarHBondContact O-N 3.4Å; H351-L354 WeakPolarHBondContact O-CD2 3.39Å; H351-K399 WeakPolarHBondContact O-CB 3.5Å; H351-Y400 HydrophobicContact CB-CD2 4.12Å
352	L	90	Very high	86	Confident	53 Å²	53	74.3 Å²	74.3	28%	0.277	35%	0.347	S	S	.	.	H	α-helix	trans	-68.9	-29.9	-176.7	-66.5	176.7	0	0	0	114.5	E348	E348-L352 HydrophobicContact CB-CD1 4.27Å; E348-L352 HydrophobicContact CG-CD1 4.33Å; E348-L352 VanDerWaalsContact O-CB 3.28Å; E348-L352 WeakPolarHBondContact O-CB 3.47Å; E348-L352 WeakPolarHBondContact O-CD1 3.36Å; E348-L352 WeakPolarHBondContact O-CG 3.38Å; E348-L352 PolarHBondContact O-N 3.07Å
353	W	92.4	Very high	87.4	Confident	51 Å²	51	66.9 Å²	66.9	19%	0.193	32%	0.319	C	S	.	.	H	α-helix	trans	-128.2	4.4	-174.5	-53.6	97.8	0	0	0	114.1	W349 H351 V355 I380 K381 V384	W349-W353 PolarHBondContact O-N 3.11Å; W349-W353 VanDerWaalsContact O-N 3.11Å; H351-W353 PolarHBondContact O-N 3.4Å; W353-V355 HydrophobicContact CB-CG2 4.12Å; W353-V355 PolarHBondContact O-N 3.03Å; W353-I380 HydrophobicContact CB-CG2 3.5Å; W353-I380 HydrophobicContact CD2-CG2 4.43Å; W353-I380 HydrophobicContact CG-CG2 3.74Å; W353-K381 HydrophobicContact CD2-CG 4.2Å; W353-K381 HydrophobicContact CE3-CG 4.11Å; W353-K381 HydrophobicContact CH2-CD 4.17Å; W353-K381 HydrophobicContact CH2-CG 3.76Å; W353-K381 HydrophobicContact CZ2-CD 4.14Å; W353-K381 HydrophobicContact CZ2-CG 3.82Å; W353-K381 HydrophobicContact CZ3-CB 4.44Å; W353-K381 HydrophobicContact CZ3-CG 3.88Å; W353-V384 HydrophobicContact CB-CG2 4.22Å; W353-V384 HydrophobicContact CE3-CB 3.97Å; W353-V384 HydrophobicContact CE3-CG1 3.97Å; W353-V384 HydrophobicContact CE3-CG2 4.1Å; W353-V384 HydrophobicContact CZ3-CB 4.5Å; W353-V384 HydrophobicContact CZ3-CG1 4.27Å; W353-V384 WeakPolarHBondContact O-CG2 3.42Å
354	L	93.1	Very high	88.6	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	49.7	56.2	-176.7	-54.6	-164.7	0	0	0	112.7	K350 H351 L366 I367 L391 K399 L402 F403 L406	K350-L354 WeakPolarHBondContact O-CA 3.14Å; K350-L354 PolarHBondContact O-N 3.41Å; K350-L354 VanDerWaalsContact O-N 3.1Å; H351-L354 WeakPolarHBondContact O-CD2 3.39Å; L354-L366 HydrophobicContact CB-CB 4.47Å; L354-L366 PolarHBondContact O-N 2.99Å; L354-I367 HydrophobicContact CD1-CD1 4.12Å; L354-I367 HydrophobicContact CD1-CG1 4.18Å; L354-L391 HydrophobicContact CB-CD1 4.19Å; L354-L391 HydrophobicContact CD1-CD1 4.02Å; L354-L391 HydrophobicContact CD1-CD2 3.59Å; L354-L391 HydrophobicContact CD1-CG 4.45Å; L354-L391 HydrophobicContact CG-CD1 3.92Å; L354-L391 HydrophobicContact CG-CD2 4.19Å; L354-K399 HydrophobicContact CD2-CB 4.45Å; L354-K399 WeakPolarHBondContact CD2-O 3.38Å; L354-L402 HydrophobicContact CD1-CB 4.29Å; L354-L402 HydrophobicContact CD1-CD2 3.62Å; L354-L402 HydrophobicContact CD1-CG 3.74Å; L354-F403 HydrophobicContact CD2-CB 3.68Å; L354-F403 HydrophobicContact CD2-CD2 4.25Å; L354-F403 HydrophobicContact CD2-CG 4.47Å; L354-L406 HydrophobicContact CD1-CD1 3.98Å
355	V	93.6	Very high	89.3	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	148.4	-179	-71.1	0	0	0	0	113.3	F345 W349 K350 W353 V363 M364 C365 M372 I380	F345-V355 HydrophobicContact CE2-CG2 4.17Å; W349-V355 HydrophobicContact CB-CG2 3.9Å; W349-V355 VanDerWaalsContact O-CG2 3.27Å; W349-V355 WeakPolarHBondContact O-CG2 3.26Å; K350-V355 WeakPolarHBondContact CA-O 3.42Å; K350-V355 PolarHBondContact O-N 2.93Å; W353-V355 HydrophobicContact CB-CG2 4.12Å; W353-V355 PolarHBondContact O-N 3.03Å; V355-V363 HydrophobicContact CB-CG1 3.44Å; V355-V363 VanDerWaalsContact CB-CG1 3.44Å; V355-V363 HydrophobicContact CG1-CG1 3.8Å; V355-V363 HydrophobicContact CG2-CG1 3.93Å; V355-M364 CarbonylContact C-O 3.57Å; V355-M364 VanDerWaalsContact CA-O 3.23Å; V355-M364 WeakPolarHBondContact CA-O 3.3Å; V355-C365 HydrophobicContact CG1-CB 4.33Å; V355-M372 HydrophobicContact CG1-CE 3.89Å; V355-I380 HydrophobicContact CG1-CG2 4.03Å; V355-I380 HydrophobicContact CG2-CG2 4.15Å
356	I	92.3	Very high	89.7	Confident	23 Å²	23	53.4 Å²	53.4	12%	0.118	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	154.6	175.3	57.2	161.9	0	0	0	111.4	H358 V363 M364 L366 F403	I356-H358 PolarHBondContact O-N 3.37Å; I356-V363 CarbonylContact O-C 3.53Å; I356-V363 WeakPolarHBondContact O-CA 3.48Å; I356-M364 HydrophobicContact CG1-CB 4.09Å; I356-M364 PolarHBondContact N-O 3.42Å; I356-M364 PolarHBondContact O-N 3.43Å; I356-L366 HydrophobicContact CD1-CD2 3.93Å; I356-L366 HydrophobicContact CG1-CD2 3.87Å; I356-L366 HydrophobicContact CG2-CD1 4.2Å; I356-L366 HydrophobicContact CG2-CD2 3.91Å; I356-L366 HydrophobicContact CG2-CG 4.22Å; I356-F403 HydrophobicContact CG2-CE2 4.08Å; I356-F403 HydrophobicContact CG2-CZ 4.45Å
357	P	90.8	Very high	90	Very high	60 Å²	60	50.3 Å²	50.3	39%	0.39	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	131.2	172.7	27.7	-34.4	0	0	0	110.9	F345	F345-P357 HydrophobicContact CD1-CG 4.44Å; F345-P357 HydrophobicContact CD2-CB 4.33Å; F345-P357 HydrophobicContact CG-CB 4.23Å
358	H	87.5	Confident	90.4	Very high	73 Å²	73	47.2 Å²	47.2	34%	0.338	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	124.3	171	-166.8	-97.5	0	0	0	108	I356 E362 M364 R375	I356-H358 PolarHBondContact O-N 3.37Å; H358-E362 HydrophobicContact CB-CB 4.18Å; H358-E362 IonicContact CE1-OE2 2.79Å; H358-E362 IonicContact CG-OE2 3.69Å; H358-E362 PolarHBondContact N-O 2.89Å; H358-E362 IonicContact ND1-OE2 3Å; H358-E362 PolarHBondContact ND1-OE2 3.49Å; H358-E362 CarbonylContact O-C 3.57Å; H358-E362 VanDerWaalsContact O-C 3.27Å; H358-E362 VanDerWaalsContact O-CA 3.32Å; H358-E362 WeakPolarHBondContact O-CA 3.47Å; H358-E362 VanDerWaalsContact O-CB 3.22Å; H358-E362 WeakPolarHBondContact O-CB 3.43Å; H358-E362 PolarHBondContact O-N 3.44Å; H358-E362 VanDerWaalsContact O-N 3.12Å; H358-M364 HydrophobicContact CB-CB 4.18Å; H358-R375 PolarHBondContact O-NH2 3.34Å
359	G	85.4	Confident	90.7	Very high	63 Å²	63	48.2 Å²	48.2	65%	0.649	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.5	-147.2	-172.8	0	0	0	0	0	114.5	R375	G359-R375 PolarHBondContact O-NH2 2.93Å
360	L	79	Confident	90.8	Very high	146 Å²	146	53 Å²	53	76%	0.764	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.9	-34.6	-178.6	-67.1	175.7	0	0	0	114.1	R375	L360-R375 VanDerWaalsContact O-CZ 3.26Å; L360-R375 PolarHBondContact O-NH1 3.5Å
361	H	82.8	Confident	90.8	Very high	138 Å²	138	52.8 Å²	52.8	64%	0.639	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-132.4	5	-168.9	-62.2	-29.9	0	0	0	114.4	R375	H361-R375 VanDerWaalsContact C-CG 3.4Å; H361-R375 WeakPolarHBondContact O-CG 3.47Å; H361-R375 PolarHBondContact O-N 3.18Å
362	E	89.2	Confident	90.9	Very high	60 Å²	60	50.3 Å²	50.3	28%	0.28	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	163.8	-177.1	-29.7	-177.7	111.6	0	0	112.1	H358 V371 M372 R375	H358-E362 HydrophobicContact CB-CB 4.18Å; H358-E362 IonicContact CE1-OE2 2.79Å; H358-E362 IonicContact CG-OE2 3.69Å; H358-E362 PolarHBondContact N-O 2.89Å; H358-E362 IonicContact ND1-OE2 3Å; H358-E362 PolarHBondContact ND1-OE2 3.49Å; H358-E362 CarbonylContact O-C 3.57Å; H358-E362 VanDerWaalsContact O-C 3.27Å; H358-E362 VanDerWaalsContact O-CA 3.32Å; H358-E362 WeakPolarHBondContact O-CA 3.47Å; H358-E362 VanDerWaalsContact O-CB 3.22Å; H358-E362 WeakPolarHBondContact O-CB 3.43Å; H358-E362 PolarHBondContact O-N 3.44Å; H358-E362 VanDerWaalsContact O-N 3.12Å; E362-V371 HydrophobicContact CB-CG1 3.68Å; E362-V371 HydrophobicContact CG-CG1 4.29Å; E362-V371 WeakPolarHBondContact OE2-CG1 3.41Å; E362-M372 CarbonylContact C-O 3.56Å; E362-M372 WeakPolarHBondContact CA-O 3.36Å; E362-R375 PolarHBondContact O-NE 2.88Å; E362-R375 PolarHBondContact O-NH2 2.95Å
363	V	92.7	Very high	90.8	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	127	179.9	175.1	0	0	0	0	108.6	F345 V355 I356 V371 M372 R375 I380	F345-V363 HydrophobicContact CD2-CG2 3.87Å; F345-V363 HydrophobicContact CE2-CG1 4.21Å; F345-V363 HydrophobicContact CE2-CG2 4.28Å; V355-V363 HydrophobicContact CB-CG1 3.44Å; V355-V363 VanDerWaalsContact CB-CG1 3.44Å; V355-V363 HydrophobicContact CG1-CG1 3.8Å; V355-V363 HydrophobicContact CG2-CG1 3.93Å; I356-V363 CarbonylContact O-C 3.53Å; I356-V363 WeakPolarHBondContact O-CA 3.48Å; V363-V371 CarbonylContact O-C 3.27Å; V363-M372 HydrophobicContact CB-CE 4.32Å; V363-M372 HydrophobicContact CG1-CE 3.97Å; V363-M372 PolarHBondContact N-O 2.63Å; V363-M372 WeakPolarHBondContact O-CB 3.33Å; V363-M372 PolarHBondContact O-N 3.33Å; V363-R375 HydrophobicContact CG2-CB 4.26Å; V363-R375 HydrophobicContact CG2-CG 3.8Å; V363-I380 HydrophobicContact CG1-CD1 4.18Å; V363-I380 HydrophobicContact CG1-CG1 4.31Å; V363-I380 HydrophobicContact CG2-CD1 4.39Å
364	M	93.6	Very high	90.3	Very high	24 Å²	24	54.4 Å²	54.4	12%	0.118	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	133.5	175.8	178.5	-179.7	-76	0	0	110	V355 I356 H358 H369 K370 V371	V355-M364 CarbonylContact C-O 3.57Å; V355-M364 VanDerWaalsContact CA-O 3.23Å; V355-M364 WeakPolarHBondContact CA-O 3.3Å; I356-M364 HydrophobicContact CG1-CB 4.09Å; I356-M364 PolarHBondContact N-O 3.42Å; I356-M364 PolarHBondContact O-N 3.43Å; H358-M364 HydrophobicContact CB-CB 4.18Å; M364-H369 HydrophobicContact SD-CB 4.42Å; M364-K370 WeakPolarHBondContact CA-O 3.32Å; M364-V371 HydrophobicContact CB-CG2 4.43Å; M364-V371 HydrophobicContact CE-CG2 3.73Å
365	C	95.7	Very high	89.9	Confident	0 Å²	0	56 Å²	56	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	131.4	165.4	178.8	0	0	0	0	110.4	V355 I367 H369 K370 H383	V355-C365 HydrophobicContact CG1-CB 4.33Å; C365-I367 PolarHBondContact O-N 2.99Å; C365-H369 WeakPolarHBondContact O-CA 3.31Å; C365-H369 PolarHBondContact O-N 2.93Å; C365-K370 PolarHBondContact N-O 3.4Å; C365-H383 WeakPolarHBondContact CB-NE2 3.36Å
366	L	94	Very high	89.6	Confident	1 Å²	1	60 Å²	60	1%	0.005	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-23.6	-176.6	-68.4	179.6	0	0	0	114.2	L354 I356 H369 F403 L406	L354-L366 HydrophobicContact CB-CB 4.47Å; L354-L366 PolarHBondContact O-N 2.99Å; I356-L366 HydrophobicContact CD1-CD2 3.93Å; I356-L366 HydrophobicContact CG1-CD2 3.87Å; I356-L366 HydrophobicContact CG2-CD1 4.2Å; I356-L366 HydrophobicContact CG2-CD2 3.91Å; I356-L366 HydrophobicContact CG2-CG 4.22Å; L366-H369 PolarHBondContact O-CE1 3.31Å; L366-H369 VanDerWaalsContact O-CE1 3.3Å; L366-F403 HydrophobicContact CD1-CD2 3.47Å; L366-F403 VanDerWaalsContact CD1-CD2 3.47Å; L366-F403 HydrophobicContact CD1-CE2 3.53Å; L366-F403 HydrophobicContact CD1-CG 4.46Å; L366-L406 HydrophobicContact CB-CB 4.03Å; L366-L406 HydrophobicContact CB-CD1 3.87Å; L366-L406 HydrophobicContact CD1-CB 4.25Å
367	I	92.9	Very high	89.5	Confident	53 Å²	53	62.2 Å²	62.2	27%	0.272	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-51.6	-177.7	-54.1	167.1	0	0	0	111.4	L354 C365 H388 L391 L406	L354-I367 HydrophobicContact CD1-CD1 4.12Å; L354-I367 HydrophobicContact CD1-CG1 4.18Å; C365-I367 PolarHBondContact O-N 2.99Å; I367-H388 HydrophobicContact CD1-CB 4Å; I367-H388 WeakPolarHBondContact CG2-CE1 3.42Å; I367-L391 HydrophobicContact CD1-CD1 3.57Å; I367-L391 HydrophobicContact CD1-CD2 3.99Å; I367-L391 HydrophobicContact CD1-CG 3.76Å; I367-L406 HydrophobicContact CG1-CD1 3.89Å
368	C	94.2	Very high	89.5	Confident	48 Å²	48	63.3 Å²	63.3	32%	0.324	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.1	6.4	-176.7	65.8	0	0	0	0	114.2	K370 H383 H388	C368-K370 PolarHBondContact O-N 3.06Å; C368-H383 PolarHBondContact SG-CE1 3.48Å; C368-H383 PolarHBondContact SG-NE2 2.82Å; C368-H383 VanDerWaalsContact SG-NE2 3.43Å; C368-H388 WeakPolarHBondContact CB-NE2 3.48Å; C368-H388 PolarHBondContact SG-NE2 3.44Å
369	H	92.2	Very high	89.7	Confident	93 Å²	93	61.6 Å²	61.6	43%	0.431	33%	0.327	S	S	.	.			trans	52.3	16.1	-176.2	-57.7	-59.2	0	0	0	115.4	M364 C365 L366 V371	M364-H369 HydrophobicContact SD-CB 4.42Å; C365-H369 WeakPolarHBondContact O-CA 3.31Å; C365-H369 PolarHBondContact O-N 2.93Å; L366-H369 PolarHBondContact O-CE1 3.31Å; L366-H369 VanDerWaalsContact O-CE1 3.3Å; H369-V371 PolarHBondContact O-N 3.35Å
370	K	93.4	Very high	90	Very high	110 Å²	110	58.6 Å²	58.6	48%	0.478	30%	0.296	S	S	.	.			trans	-72.1	122.4	-179.9	-179	164.5	-176.9	165.6	0	110.8	M364 C365 C368	M364-K370 WeakPolarHBondContact CA-O 3.32Å; C365-K370 PolarHBondContact N-O 3.4Å; C368-K370 PolarHBondContact O-N 3.06Å
371	V	92.9	Very high	90.7	Very high	47 Å²	47	55.5 Å²	55.5	29%	0.285	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	135.2	168	-177.5	0	0	0	0	110.2	E362 V363 M364 H369	E362-V371 HydrophobicContact CB-CG1 3.68Å; E362-V371 HydrophobicContact CG-CG1 4.29Å; E362-V371 WeakPolarHBondContact OE2-CG1 3.41Å; V363-V371 CarbonylContact O-C 3.27Å; M364-V371 HydrophobicContact CB-CG2 4.43Å; M364-V371 HydrophobicContact CE-CG2 3.73Å; H369-V371 PolarHBondContact O-N 3.35Å
372	M	92.2	Very high	91.3	Very high	13 Å²	13	54.7 Å²	54.7	6%	0.064	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	114.9	175	-64.4	176.9	-79.4	0	0	109	V355 E362 V363 Q374 T379 I380 H383	V355-M372 HydrophobicContact CG1-CE 3.89Å; E362-M372 CarbonylContact C-O 3.56Å; E362-M372 WeakPolarHBondContact CA-O 3.36Å; V363-M372 HydrophobicContact CB-CE 4.32Å; V363-M372 HydrophobicContact CG1-CE 3.97Å; V363-M372 PolarHBondContact N-O 2.63Å; V363-M372 WeakPolarHBondContact O-CB 3.33Å; V363-M372 PolarHBondContact O-N 3.33Å; M372-Q374 PolarHBondContact O-N 3.41Å; M372-T379 HydrophobicContact SD-CG2 4.31Å; M372-I380 HydrophobicContact CE-CG1 3.98Å; M372-I380 HydrophobicContact SD-CG1 4.44Å; M372-H383 HydrophobicContact SD-CB 3.51Å; M372-H383 VanDerWaalsContact SD-CB 3.51Å; M372-H383 PolarHBondContact SD-CD2 3.31Å
373	T	87	Confident	91.6	Very high	103 Å²	103	52.8 Å²	52.8	63%	0.632	26%	0.259	S	S	*	.	S	Bend	trans	-69.6	5.6	-176.6	56.6	0	0	0	0	114.9
374	Q	82.5	Confident	91.6	Very high	88 Å²	88	52.9 Å²	52.9	41%	0.411	26%	0.26	S	S	.	.			trans	-133.9	111	179.8	-59.1	-171.1	28	0	0	110.8	M372 K376	M372-Q374 PolarHBondContact O-N 3.41Å; Q374-K376 HydrophobicContact CB-CD 4.36Å; Q374-K376 HydrophobicContact CB-CG 4.38Å; Q374-K376 PolarHBondContact O-N 3.33Å; Q374-K376 VanDerWaalsContact OE1-CE 3.25Å
375	R	85	Confident	91.7	Very high	34 Å²	34	56 Å²	56	13%	0.128	28%	0.276	C	S	.	.			trans	-67.1	54.7	170	-57.4	-129.4	165	134.9	2.1	113.2	R343 H358 G359 L360 H361 E362 V363	R343-R375 WeakPolarHBondContact CA-O 3.25Å; R343-R375 WeakPolarHBondContact O-CB 3.33Å; H358-R375 PolarHBondContact O-NH2 3.34Å; G359-R375 PolarHBondContact O-NH2 2.93Å; L360-R375 VanDerWaalsContact O-CZ 3.26Å; L360-R375 PolarHBondContact O-NH1 3.5Å; H361-R375 VanDerWaalsContact C-CG 3.4Å; H361-R375 WeakPolarHBondContact O-CG 3.47Å; H361-R375 PolarHBondContact O-N 3.18Å; E362-R375 PolarHBondContact O-NE 2.88Å; E362-R375 PolarHBondContact O-NH2 2.95Å; V363-R375 HydrophobicContact CG2-CB 4.26Å; V363-R375 HydrophobicContact CG2-CG 3.8Å
376	K	86.9	Confident	91.6	Very high	83 Å²	83	64.7 Å²	64.7	36%	0.361	31%	0.309	S	S	.	.			trans	-113.8	132.1	179.1	-68.5	175.5	-177.6	168	0	110	Q374 D378 T379 I380	Q374-K376 HydrophobicContact CB-CD 4.36Å; Q374-K376 HydrophobicContact CB-CG 4.38Å; Q374-K376 PolarHBondContact O-N 3.33Å; Q374-K376 VanDerWaalsContact OE1-CE 3.25Å; K376-D378 VanDerWaalsContact C-N 3.26Å; K376-D378 PolarHBondContact O-N 2.82Å; K376-T379 WeakPolarHBondContact O-CB 3.32Å; K376-T379 PolarHBondContact O-N 2.88Å; K376-I380 PolarHBondContact O-N 3.5Å
377	L	89.1	Confident	91.7	Very high	70 Å²	70	72.2 Å²	72.2	37%	0.366	34%	0.337	S	S	.	.	H	α-helix	trans	-50.9	-43.8	174.3	-172.4	81.8	0	0	0	112.3	W349 T379 I380 K381	W349-L377 HydrophobicContact CD2-CD1 4.49Å; W349-L377 HydrophobicContact CZ2-CB 4.15Å; W349-L377 HydrophobicContact CZ2-CD1 4.08Å; L377-T379 PolarHBondContact O-N 3.33Å; L377-I380 PolarHBondContact O-N 3.31Å; L377-K381 HydrophobicContact CD2-CD 4.33Å; L377-K381 HydrophobicContact CG-CD 4.11Å; L377-K381 HydrophobicContact CG-CG 4.3Å; L377-K381 VanDerWaalsContact O-CB 3.31Å; L377-K381 WeakPolarHBondContact O-CB 3.35Å; L377-K381 VanDerWaalsContact O-CG 3.31Å; L377-K381 WeakPolarHBondContact O-CG 3.28Å; L377-K381 PolarHBondContact O-N 2.94Å
378	D	91.4	Very high	91.8	Very high	82 Å²	82	70.2 Å²	70.2	44%	0.439	33%	0.327	S	S	.	.	H	α-helix	trans	-59.8	-43.5	176.1	164.9	79.1	0	0	0	112.4	K376 R382	K376-D378 VanDerWaalsContact C-N 3.26Å; K376-D378 PolarHBondContact O-N 2.82Å; D378-R382 WeakPolarHBondContact O-CB 3.46Å; D378-R382 PolarHBondContact O-N 3.46Å; D378-R382 IonicContact OD1-CZ 3.35Å; D378-R382 IonicContact OD1-NE 2.68Å; D378-R382 PolarHBondContact OD1-NE 3.01Å; D378-R382 IonicContact OD1-NH2 3.24Å; D378-R382 PolarHBondContact OD1-NH2 3.35Å; D378-R382 IonicContact OD2-CZ 3.54Å; D378-R382 IonicContact OD2-NE 3.47Å; D378-R382 PolarHBondContact OD2-NE 3.43Å; D378-R382 IonicContact OD2-NH2 2.76Å; D378-R382 PolarHBondContact OD2-NH2 3.14Å
379	T	91.4	Very high	91.7	Very high	37 Å²	37	71.2 Å²	71.2	23%	0.227	33%	0.333	C	S	.	.	H	α-helix	trans	-66.2	-42.3	179.6	-53.2	0	0	0	0	111.1	M372 K376 L377 H383	M372-T379 HydrophobicContact SD-CG2 4.31Å; K376-T379 WeakPolarHBondContact O-CB 3.32Å; K376-T379 PolarHBondContact O-N 2.88Å; L377-T379 PolarHBondContact O-N 3.33Å; T379-H383 VanDerWaalsContact O-CB 3.31Å; T379-H383 WeakPolarHBondContact O-CB 3.15Å; T379-H383 PolarHBondContact O-N 2.92Å
380	I	93	Very high	91.7	Very high	0 Å²	0	71 Å²	71	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-64.2	-52.9	176.5	-66.1	163.3	0	0	0	110.7	W349 W353 V355 V363 M372 K376 L377 R382 H383 V384	W349-I380 HydrophobicContact CD2-CD1 4.19Å; W349-I380 HydrophobicContact CE3-CD1 3.45Å; W349-I380 VanDerWaalsContact CE3-CD1 3.45Å; W349-I380 HydrophobicContact CZ3-CD1 3.75Å; W353-I380 HydrophobicContact CB-CG2 3.5Å; W353-I380 HydrophobicContact CD2-CG2 4.43Å; W353-I380 HydrophobicContact CG-CG2 3.74Å; V355-I380 HydrophobicContact CG1-CG2 4.03Å; V355-I380 HydrophobicContact CG2-CG2 4.15Å; V363-I380 HydrophobicContact CG1-CD1 4.18Å; V363-I380 HydrophobicContact CG1-CG1 4.31Å; V363-I380 HydrophobicContact CG2-CD1 4.39Å; M372-I380 HydrophobicContact CE-CG1 3.98Å; M372-I380 HydrophobicContact SD-CG1 4.44Å; K376-I380 PolarHBondContact O-N 3.5Å; L377-I380 PolarHBondContact O-N 3.31Å; I380-R382 PolarHBondContact O-N 3.48Å; I380-H383 WeakPolarHBondContact O-CB 3.33Å; I380-H383 PolarHBondContact O-N 3.12Å; I380-H383 VanDerWaalsContact O-N 3.17Å; I380-V384 PolarHBondContact O-N 3.44Å
381	K	93.6	Very high	91.5	Very high	82 Å²	82	65.9 Å²	65.9	36%	0.357	31%	0.31	S	S	.	.	H	α-helix	trans	-56	-49.2	176.3	-76.3	-172.6	169.8	-166.6	0	111.7	W353 L377 H383 V384 I385	W353-K381 HydrophobicContact CD2-CG 4.2Å; W353-K381 HydrophobicContact CE3-CG 4.11Å; W353-K381 HydrophobicContact CH2-CD 4.17Å; W353-K381 HydrophobicContact CH2-CG 3.76Å; W353-K381 HydrophobicContact CZ2-CD 4.14Å; W353-K381 HydrophobicContact CZ2-CG 3.82Å; W353-K381 HydrophobicContact CZ3-CB 4.44Å; W353-K381 HydrophobicContact CZ3-CG 3.88Å; L377-K381 HydrophobicContact CD2-CD 4.33Å; L377-K381 HydrophobicContact CG-CD 4.11Å; L377-K381 HydrophobicContact CG-CG 4.3Å; L377-K381 VanDerWaalsContact O-CB 3.31Å; L377-K381 WeakPolarHBondContact O-CB 3.35Å; L377-K381 VanDerWaalsContact O-CG 3.31Å; L377-K381 WeakPolarHBondContact O-CG 3.28Å; L377-K381 PolarHBondContact O-N 2.94Å; K381-H383 VanDerWaalsContact C-N 3.27Å; K381-H383 PolarHBondContact O-N 3.34Å; K381-V384 PolarHBondContact O-N 2.94Å; K381-I385 HydrophobicContact CB-CD1 4.39Å; K381-I385 WeakPolarHBondContact O-CB 3.47Å; K381-I385 WeakPolarHBondContact O-CD1 3.28Å; K381-I385 WeakPolarHBondContact O-CG1 3.06Å; K381-I385 PolarHBondContact O-N 3.36Å
382	R	94.2	Very high	91.3	Very high	120 Å²	120	68.5 Å²	68.5	45%	0.453	32%	0.321	S	S	.	.	H	α-helix	trans	-64.7	-29.7	-180	-173.1	-172.6	-56.9	-147.1	-4.4	112.6	D378 I380 R386	D378-R382 WeakPolarHBondContact O-CB 3.46Å; D378-R382 PolarHBondContact O-N 3.46Å; D378-R382 IonicContact OD1-CZ 3.35Å; D378-R382 IonicContact OD1-NE 2.68Å; D378-R382 PolarHBondContact OD1-NE 3.01Å; D378-R382 IonicContact OD1-NH2 3.24Å; D378-R382 PolarHBondContact OD1-NH2 3.35Å; D378-R382 IonicContact OD2-CZ 3.54Å; D378-R382 IonicContact OD2-NE 3.47Å; D378-R382 PolarHBondContact OD2-NE 3.43Å; D378-R382 IonicContact OD2-NH2 2.76Å; D378-R382 PolarHBondContact OD2-NH2 3.14Å; I380-R382 PolarHBondContact O-N 3.48Å; R382-R386 WeakPolarHBondContact O-CB 3.44Å; R382-R386 WeakPolarHBondContact O-CD 3.46Å; R382-R386 WeakPolarHBondContact O-CG 3.44Å; R382-R386 PolarHBondContact O-N 3.41Å
383	H	95.2	Very high	91.2	Very high	20 Å²	20	77 Å²	77	9%	0.093	36%	0.358	C	S	.	.	H	α-helix	trans	-71.2	-52.7	172.5	173.2	40.1	0	0	0	111.3	C365 C368 M372 T379 I380 K381 I385 R386 R387	C365-H383 WeakPolarHBondContact CB-NE2 3.36Å; C368-H383 PolarHBondContact SG-CE1 3.48Å; C368-H383 PolarHBondContact SG-NE2 2.82Å; C368-H383 VanDerWaalsContact SG-NE2 3.43Å; M372-H383 HydrophobicContact SD-CB 3.51Å; M372-H383 VanDerWaalsContact SD-CB 3.51Å; M372-H383 PolarHBondContact SD-CD2 3.31Å; T379-H383 VanDerWaalsContact O-CB 3.31Å; T379-H383 WeakPolarHBondContact O-CB 3.15Å; T379-H383 PolarHBondContact O-N 2.92Å; I380-H383 WeakPolarHBondContact O-CB 3.33Å; I380-H383 PolarHBondContact O-N 3.12Å; I380-H383 VanDerWaalsContact O-N 3.17Å; K381-H383 VanDerWaalsContact C-N 3.27Å; K381-H383 PolarHBondContact O-N 3.34Å; H383-I385 PolarHBondContact O-N 3.4Å; H383-R386 PolarHBondContact O-N 3.1Å; H383-R387 PolarHBondContact O-N 3.14Å
384	V	93.9	Very high	91.4	Very high	2 Å²	2	74.7 Å²	74.7	1%	0.012	34%	0.341	C	S	.	.	H	α-helix	trans	-57.6	-50.6	177.9	169.1	0	0	0	0	110.8	W353 I380 K381 R386 R387 H388 L391	W353-V384 HydrophobicContact CB-CG2 4.22Å; W353-V384 HydrophobicContact CE3-CB 3.97Å; W353-V384 HydrophobicContact CE3-CG1 3.97Å; W353-V384 HydrophobicContact CE3-CG2 4.1Å; W353-V384 HydrophobicContact CZ3-CB 4.5Å; W353-V384 HydrophobicContact CZ3-CG1 4.27Å; W353-V384 WeakPolarHBondContact O-CG2 3.42Å; I380-V384 PolarHBondContact O-N 3.44Å; K381-V384 PolarHBondContact O-N 2.94Å; V384-R386 PolarHBondContact O-N 2.84Å; V384-R387 PolarHBondContact O-N 3.16Å; V384-H388 HydrophobicContact CG1-CB 4.26Å; V384-H388 CarbonylContact O-C 3.08Å; V384-H388 WeakPolarHBondContact O-CA 3.47Å; V384-H388 PolarHBondContact O-N 3.48Å; V384-L391 HydrophobicContact CG1-CB 4.04Å; V384-L391 HydrophobicContact CG1-CD1 3.94Å; V384-L391 HydrophobicContact CG2-CD1 4.47Å
385	I	94.1	Very high	91.8	Very high	91 Å²	91	73.2 Å²	73.2	47%	0.467	34%	0.34	S	S	.	.	H	α-helix	trans	-58.9	-27.5	-179	-66.6	163	0	0	0	113.1	K381 H383 I392	K381-I385 HydrophobicContact CB-CD1 4.39Å; K381-I385 WeakPolarHBondContact O-CB 3.47Å; K381-I385 WeakPolarHBondContact O-CD1 3.28Å; K381-I385 WeakPolarHBondContact O-CG1 3.06Å; K381-I385 PolarHBondContact O-N 3.36Å; H383-I385 PolarHBondContact O-N 3.4Å; I385-I392 HydrophobicContact CB-CD1 4.34Å; I385-I392 HydrophobicContact CG1-CD1 3.95Å; I385-I392 HydrophobicContact CG2-CD1 4.31Å
386	R	95.3	Very high	92	Very high	182 Å²	182	76 Å²	76	69%	0.687	36%	0.357	S	S	*	.	H	α-helix	trans	-102.3	-14.2	-175.7	-66.9	178	179.8	-173.1	-4	115.3	R382 H383 V384	R382-R386 WeakPolarHBondContact O-CB 3.44Å; R382-R386 WeakPolarHBondContact O-CD 3.46Å; R382-R386 WeakPolarHBondContact O-CG 3.44Å; R382-R386 PolarHBondContact O-N 3.41Å; H383-R386 PolarHBondContact O-N 3.1Å; V384-R386 PolarHBondContact O-N 2.84Å
387	R	95.1	Very high	92.1	Very high	158 Å²	158	77.9 Å²	77.9	60%	0.596	37%	0.367	S	S	*	.	H	α-helix	trans	-123.6	-22.4	-179.7	-70.1	-58.2	-169.9	102	-10.8	113.6	H383 V384 P389	H383-R387 PolarHBondContact O-N 3.14Å; V384-R387 PolarHBondContact O-N 3.16Å; R387-P389 VanDerWaalsContact C-CD 3.49Å
388	H	94.7	Very high	92.3	Very high	11 Å²	11	78 Å²	78	5%	0.051	37%	0.368	C	S	.	.			trans	-135.7	53	-176.5	-60	-57.6	0	0	0	112.4	I367 C368 V384 E390 L391	I367-H388 HydrophobicContact CD1-CB 4Å; I367-H388 WeakPolarHBondContact CG2-CE1 3.42Å; C368-H388 WeakPolarHBondContact CB-NE2 3.48Å; C368-H388 PolarHBondContact SG-NE2 3.44Å; V384-H388 HydrophobicContact CG1-CB 4.26Å; V384-H388 CarbonylContact O-C 3.08Å; V384-H388 WeakPolarHBondContact O-CA 3.47Å; V384-H388 PolarHBondContact O-N 3.48Å; H388-E390 VanDerWaalsContact CA-CD 3.44Å; H388-E390 VanDerWaalsContact CA-OE1 3.22Å; H388-E390 WeakPolarHBondContact CA-OE1 3.38Å; H388-E390 WeakPolarHBondContact CA-OE2 3.46Å; H388-E390 WeakPolarHBondContact CB-OE1 3.27Å; H388-E390 IonicContact CG-OE1 3.65Å; H388-E390 IonicContact ND1-OE1 2.72Å; H388-E390 PolarHBondContact ND1-OE1 3.26Å; H388-E390 PolarHBondContact O-N 3.18Å; H388-L391 HydrophobicContact CB-CD1 4.11Å; H388-L391 HydrophobicContact CB-CG 4.1Å; H388-L391 WeakPolarHBondContact O-CB 3.39Å; H388-L391 PolarHBondContact O-N 2.75Å; H388-L391 VanDerWaalsContact O-N 3.09Å
389	P	92.4	Very high	92.3	Very high	70 Å²	70	75.1 Å²	75.1	46%	0.455	35%	0.352	S	S	.	.	G	3₁₀ helix	trans	-60.3	-21.1	177.7	28.8	-37	0	0	0	113.2	R387 L391 I392	R387-P389 VanDerWaalsContact C-CD 3.49Å; P389-L391 VanDerWaalsContact C-N 3.32Å; P389-L391 PolarHBondContact O-N 3.46Å; P389-I392 WeakPolarHBondContact O-CB 3.4Å; P389-I392 PolarHBondContact O-N 3.47Å
390	E	91.4	Very high	92.3	Very high	88 Å²	88	79 Å²	79	41%	0.411	36%	0.363	S	S	.	.	G	3₁₀ helix	trans	-57.8	-39.6	171.3	65.6	-75.9	177.2	0	0	112.7	H388 I392 K393	H388-E390 VanDerWaalsContact CA-CD 3.44Å; H388-E390 VanDerWaalsContact CA-OE1 3.22Å; H388-E390 WeakPolarHBondContact CA-OE1 3.38Å; H388-E390 WeakPolarHBondContact CA-OE2 3.46Å; H388-E390 WeakPolarHBondContact CB-OE1 3.27Å; H388-E390 IonicContact CG-OE1 3.65Å; H388-E390 IonicContact ND1-OE1 2.72Å; H388-E390 PolarHBondContact ND1-OE1 3.26Å; H388-E390 PolarHBondContact O-N 3.18Å; E390-I392 PolarHBondContact O-N 3.46Å; E390-K393 PolarHBondContact O-N 3.32Å
391	L	90	Very high	92.2	Very high	3 Å²	3	81.9 Å²	81.9	2%	0.016	38%	0.379	C	S	.	.	G	3₁₀ helix	trans	-62.2	-26.2	178.9	-72.9	-172.3	0	0	0	113.2	L354 I367 V384 H388 P389 K393 M394 K399 L402	L354-L391 HydrophobicContact CB-CD1 4.19Å; L354-L391 HydrophobicContact CD1-CD1 4.02Å; L354-L391 HydrophobicContact CD1-CD2 3.59Å; L354-L391 HydrophobicContact CD1-CG 4.45Å; L354-L391 HydrophobicContact CG-CD1 3.92Å; L354-L391 HydrophobicContact CG-CD2 4.19Å; I367-L391 HydrophobicContact CD1-CD1 3.57Å; I367-L391 HydrophobicContact CD1-CD2 3.99Å; I367-L391 HydrophobicContact CD1-CG 3.76Å; V384-L391 HydrophobicContact CG1-CB 4.04Å; V384-L391 HydrophobicContact CG1-CD1 3.94Å; V384-L391 HydrophobicContact CG2-CD1 4.47Å; H388-L391 HydrophobicContact CB-CD1 4.11Å; H388-L391 HydrophobicContact CB-CG 4.1Å; H388-L391 WeakPolarHBondContact O-CB 3.39Å; H388-L391 PolarHBondContact O-N 2.75Å; H388-L391 VanDerWaalsContact O-N 3.09Å; P389-L391 VanDerWaalsContact C-N 3.32Å; P389-L391 PolarHBondContact O-N 3.46Å; L391-K393 PolarHBondContact O-N 3.24Å; L391-M394 HydrophobicContact CD2-SD 3.69Å; L391-M394 PolarHBondContact O-N 2.88Å; L391-K399 WeakPolarHBondContact O-CE 3.43Å; L391-L402 HydrophobicContact CD2-CD2 4.11Å
392	I	89.3	Confident	92.1	Very high	101 Å²	101	80.1 Å²	80.1	52%	0.518	37%	0.373	S	S	.	.	G	3₁₀ helix	trans	-66.1	-27.5	179.4	-49.3	174.6	0	0	0	110.6	I385 P389 E390	I385-I392 HydrophobicContact CB-CD1 4.34Å; I385-I392 HydrophobicContact CG1-CD1 3.95Å; I385-I392 HydrophobicContact CG2-CD1 4.31Å; P389-I392 WeakPolarHBondContact O-CB 3.4Å; P389-I392 PolarHBondContact O-N 3.47Å; E390-I392 PolarHBondContact O-N 3.46Å
393	K	90.6	Very high	92	Very high	193 Å²	193	75.2 Å²	75.2	84%	0.839	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.8	-14.5	-176.2	-60.1	-175.7	179	-176.8	0	114.3	E390 L391	E390-K393 PolarHBondContact O-N 3.32Å; L391-K393 PolarHBondContact O-N 3.24Å
394	M	89.9	Confident	91.8	Very high	54 Å²	54	76 Å²	76	27%	0.266	36%	0.36	S	S	.	.	S	Bend	trans	-77.4	147.8	-178.7	-69.4	179	67.3	0	0	111.4	L391 D398 K399 L402	L391-M394 HydrophobicContact CD2-SD 3.69Å; L391-M394 PolarHBondContact O-N 2.88Å; M394-D398 HydrophobicContact CB-CB 4.2Å; M394-D398 HydrophobicContact CE-CB 3.51Å; M394-K399 HydrophobicContact CB-CG 4.07Å; M394-K399 PolarHBondContact O-NZ 3.42Å; M394-L402 HydrophobicContact CE-CB 4.25Å; M394-L402 HydrophobicContact CE-CD2 3.81Å; M394-L402 HydrophobicContact SD-CD2 4.09Å
395	S	91.4	Very high	91.7	Very high	57 Å²	57	81 Å²	81	40%	0.399	38%	0.383	S	S	.	.			trans	-67.8	159.6	169	78.3	0	0	0	0	110.5	H397 D398 K399	S395-H397 PolarHBondContact O-N 3.04Å; S395-H397 PolarHBondContact OG-N 2.95Å; S395-D398 WeakPolarHBondContact CB-OD2 3.17Å; S395-D398 PolarHBondContact N-OD2 3.08Å; S395-D398 PolarHBondContact O-N 3.06Å; S395-D398 PolarHBondContact OG-N 3.32Å; S395-D398 VanDerWaalsContact OG-N 3.12Å; S395-D398 PolarHBondContact OG-OD2 3.22Å; S395-K399 WeakPolarHBondContact O-CG 3.38Å; S395-K399 PolarHBondContact O-N 2.97Å
396	D	89.5	Confident	91.6	Very high	92 Å²	92	78 Å²	78	49%	0.492	37%	0.367	S	S	.	.	H	α-helix	trans	-67.7	-22	177.7	-66.7	-35.7	0	0	0	112.6	K399 Y400	D396-K399 IonicContact OD1-NZ 3.6Å; D396-K399 PolarHBondContact OD1-NZ 2.84Å; D396-Y400 WeakPolarHBondContact O-CB 3.41Å; D396-Y400 PolarHBondContact O-N 3.14Å
397	H	89.3	Confident	91.3	Very high	123 Å²	123	70.9 Å²	70.9	57%	0.569	34%	0.343	S	S	*	.	H	α-helix	trans	-70.2	-45.3	170	-175.2	73.2	0	0	0	111.7	S395 K399 Y400 N401	S395-H397 PolarHBondContact O-N 3.04Å; S395-H397 PolarHBondContact OG-N 2.95Å; H397-K399 VanDerWaalsContact C-N 3.28Å; H397-K399 PolarHBondContact O-N 3.01Å; H397-Y400 WeakPolarHBondContact O-CB 3.23Å; H397-Y400 PolarHBondContact O-N 3.17Å; H397-Y400 VanDerWaalsContact O-N 3.11Å; H397-N401 PolarHBondContact CD2-ND2 3.38Å; H397-N401 VanDerWaalsContact CD2-ND2 3.28Å; H397-N401 PolarHBondContact NE2-ND2 3.3Å; H397-N401 PolarHBondContact O-N 3.12Å
398	D	91.9	Very high	91	Very high	73 Å²	73	67.7 Å²	67.7	39%	0.39	34%	0.337	S	S	.	.	H	α-helix	trans	-61.9	-39	175.9	-52.5	-49.1	0	0	0	111.3	M394 S395 N401 L402	M394-D398 HydrophobicContact CB-CB 4.2Å; M394-D398 HydrophobicContact CE-CB 3.51Å; S395-D398 WeakPolarHBondContact CB-OD2 3.17Å; S395-D398 PolarHBondContact N-OD2 3.08Å; S395-D398 PolarHBondContact O-N 3.06Å; S395-D398 PolarHBondContact OG-N 3.32Å; S395-D398 VanDerWaalsContact OG-N 3.12Å; S395-D398 PolarHBondContact OG-OD2 3.22Å; D398-N401 PolarHBondContact O-N 2.84Å; D398-L402 VanDerWaalsContact O-CB 3.28Å; D398-L402 WeakPolarHBondContact O-CB 3.41Å; D398-L402 PolarHBondContact O-N 3.36Å
399	K	92.7	Very high	90.6	Very high	20 Å²	20	72.6 Å²	72.6	9%	0.087	36%	0.358	C	S	.	.	H	α-helix	trans	-63	-42.5	173.5	-64.7	179.7	-164.9	90.8	0	111.6	H351 L354 L391 M394 S395 D396 H397 L402 F403	H351-K399 WeakPolarHBondContact O-CB 3.5Å; L354-K399 HydrophobicContact CD2-CB 4.45Å; L354-K399 WeakPolarHBondContact CD2-O 3.38Å; L391-K399 WeakPolarHBondContact O-CE 3.43Å; M394-K399 HydrophobicContact CB-CG 4.07Å; M394-K399 PolarHBondContact O-NZ 3.42Å; S395-K399 WeakPolarHBondContact O-CG 3.38Å; S395-K399 PolarHBondContact O-N 2.97Å; D396-K399 IonicContact OD1-NZ 3.6Å; D396-K399 PolarHBondContact OD1-NZ 2.84Å; H397-K399 VanDerWaalsContact C-N 3.28Å; H397-K399 PolarHBondContact O-N 3.01Å; K399-L402 PolarHBondContact O-N 3.04Å; K399-F403 WeakPolarHBondContact O-CB 3.35Å; K399-F403 PolarHBondContact O-N 3.12Å
400	Y	90.4	Very high	90.2	Very high	119 Å²	119	70.8 Å²	70.8	47%	0.467	34%	0.344	S	S	.	.	H	α-helix	trans	-62.2	-43.6	176.3	-176.3	-96.6	0	0	0	112	H351 D396 H397 F403 N404	H351-Y400 HydrophobicContact CB-CD2 4.12Å; D396-Y400 WeakPolarHBondContact O-CB 3.41Å; D396-Y400 PolarHBondContact O-N 3.14Å; H397-Y400 WeakPolarHBondContact O-CB 3.23Å; H397-Y400 PolarHBondContact O-N 3.17Å; H397-Y400 VanDerWaalsContact O-N 3.11Å; Y400-F403 WeakPolarHBondContact O-CB 3.26Å; Y400-F403 PolarHBondContact O-N 3.3Å; Y400-N404 WeakPolarHBondContact CE1-ND2 3.39Å; Y400-N404 PolarHBondContact O-N 3.43Å; Y400-N404 VanDerWaalsContact O-N 3.12Å; Y400-N404 PolarHBondContact O-ND2 3.46Å
401	N	90.7	Very high	89.9	Confident	61 Å²	61	72.6 Å²	72.6	33%	0.326	35%	0.347	S	S	.	.	H	α-helix	trans	-65.3	-43	176.5	-65.7	-19.6	0	0	0	111.6	H397 D398 N404 Q405	H397-N401 PolarHBondContact CD2-ND2 3.38Å; H397-N401 VanDerWaalsContact CD2-ND2 3.28Å; H397-N401 PolarHBondContact NE2-ND2 3.3Å; H397-N401 PolarHBondContact O-N 3.12Å; D398-N401 PolarHBondContact O-N 2.84Å; N401-N404 PolarHBondContact O-N 3.44Å; N401-Q405 WeakPolarHBondContact O-CG 3.32Å; N401-Q405 PolarHBondContact O-N 2.72Å; N401-Q405 VanDerWaalsContact O-N 3.09Å
402	L	92.2	Very high	89.5	Confident	44 Å²	44	76.5 Å²	76.5	23%	0.23	37%	0.368	C	S	.	.	H	α-helix	trans	-65.8	-35.8	175.2	-177.7	57.5	0	0	0	112.3	L354 L391 M394 D398 K399 Q405 L406	L354-L402 HydrophobicContact CD1-CB 4.29Å; L354-L402 HydrophobicContact CD1-CD2 3.62Å; L354-L402 HydrophobicContact CD1-CG 3.74Å; L391-L402 HydrophobicContact CD2-CD2 4.11Å; M394-L402 HydrophobicContact CE-CB 4.25Å; M394-L402 HydrophobicContact CE-CD2 3.81Å; M394-L402 HydrophobicContact SD-CD2 4.09Å; D398-L402 VanDerWaalsContact O-CB 3.28Å; D398-L402 WeakPolarHBondContact O-CB 3.41Å; D398-L402 PolarHBondContact O-N 3.36Å; K399-L402 PolarHBondContact O-N 3.04Å; L402-Q405 PolarHBondContact O-N 2.85Å; L402-L406 HydrophobicContact CD1-CD1 4.01Å; L402-L406 HydrophobicContact CD1-CG 3.97Å; L402-L406 HydrophobicContact CG-CD1 3.91Å; L402-L406 HydrophobicContact CG-CG 4.32Å; L402-L406 WeakPolarHBondContact O-CB 3.22Å; L402-L406 VanDerWaalsContact O-CG 3.27Å; L402-L406 WeakPolarHBondContact O-CG 3.43Å; L402-L406 PolarHBondContact O-N 3.39Å
403	F	92.6	Very high	89.1	Confident	17 Å²	17	76 Å²	76	8%	0.075	37%	0.366	C	S	.	.	H	α-helix	trans	-57.1	-52	172.6	176.4	-96.7	0	0	0	110.8	K350 L354 I356 L366 K399 Y400 Q405 L406 L407	K350-F403 HydrophobicContact CB-CD2 4.22Å; K350-F403 HydrophobicContact CB-CE2 3.62Å; K350-F403 HydrophobicContact CB-CZ 3.83Å; K350-F403 HydrophobicContact CD-CE2 4.38Å; K350-F403 HydrophobicContact CD-CZ 3.89Å; K350-F403 HydrophobicContact CG-CE2 4.11Å; K350-F403 HydrophobicContact CG-CZ 4.13Å; K350-F403 VanDerWaalsContact O-CD2 3.24Å; K350-F403 WeakPolarHBondContact O-CD2 3.32Å; L354-F403 HydrophobicContact CD2-CB 3.68Å; L354-F403 HydrophobicContact CD2-CD2 4.25Å; L354-F403 HydrophobicContact CD2-CG 4.47Å; I356-F403 HydrophobicContact CG2-CE2 4.08Å; I356-F403 HydrophobicContact CG2-CZ 4.45Å; L366-F403 HydrophobicContact CD1-CD2 3.47Å; L366-F403 VanDerWaalsContact CD1-CD2 3.47Å; L366-F403 HydrophobicContact CD1-CE2 3.53Å; L366-F403 HydrophobicContact CD1-CG 4.46Å; K399-F403 WeakPolarHBondContact O-CB 3.35Å; K399-F403 PolarHBondContact O-N 3.12Å; Y400-F403 WeakPolarHBondContact O-CB 3.26Å; Y400-F403 PolarHBondContact O-N 3.3Å; F403-Q405 PolarHBondContact O-N 2.82Å; F403-L406 PolarHBondContact O-N 3.33Å; F403-L407 HydrophobicContact CE1-CD2 3.86Å; F403-L407 HydrophobicContact CZ-CD2 4.11Å; F403-L407 VanDerWaalsContact O-CB 3.27Å; F403-L407 WeakPolarHBondContact O-CB 3.49Å; F403-L407 PolarHBondContact O-N 3.27Å
404	N	90.2	Very high	88.6	Confident	37 Å²	37	70.1 Å²	70.1	20%	0.198	34%	0.343	C	S	.	.	H	α-helix	trans	-61.9	-43.9	-179.3	-65.8	-29.5	0	0	0	111.7	Y400 N401 L406 L407 I408	Y400-N404 WeakPolarHBondContact CE1-ND2 3.39Å; Y400-N404 PolarHBondContact O-N 3.43Å; Y400-N404 VanDerWaalsContact O-N 3.12Å; Y400-N404 PolarHBondContact O-ND2 3.46Å; N401-N404 PolarHBondContact O-N 3.44Å; N404-L406 PolarHBondContact O-N 3.42Å; N404-L407 PolarHBondContact O-N 2.98Å; N404-I408 WeakPolarHBondContact O-CG1 3.11Å; N404-I408 PolarHBondContact O-N 2.92Å
405	Q	91.1	Very high	87.8	Confident	107 Å²	107	71 Å²	71	50%	0.5	35%	0.349	S	S	.	.	H	α-helix	trans	-62.6	-42.3	176.2	-69.9	-178.4	25.6	0	0	113.1	N401 L402 F403 K409	N401-Q405 WeakPolarHBondContact O-CG 3.32Å; N401-Q405 PolarHBondContact O-N 2.72Å; N401-Q405 VanDerWaalsContact O-N 3.09Å; L402-Q405 PolarHBondContact O-N 2.85Å; F403-Q405 PolarHBondContact O-N 2.82Å; Q405-K409 WeakPolarHBondContact O-CB 3.33Å; Q405-K409 WeakPolarHBondContact O-CD 3.4Å; Q405-K409 VanDerWaalsContact O-CG 3.28Å; Q405-K409 WeakPolarHBondContact O-CG 3.47Å; Q405-K409 PolarHBondContact O-N 3.24Å; Q405-K409 VanDerWaalsContact O-N 3.1Å
406	L	92	Very high	86.9	Confident	27 Å²	27	72.6 Å²	72.6	14%	0.141	35%	0.353	C	S	.	.	H	α-helix	trans	-70.5	-35	177.9	-70.5	172.6	0	0	0	111.9	L354 L366 I367 L402 F403 N404 K409 Q410	L354-L406 HydrophobicContact CD1-CD1 3.98Å; L366-L406 HydrophobicContact CB-CB 4.03Å; L366-L406 HydrophobicContact CB-CD1 3.87Å; L366-L406 HydrophobicContact CD1-CB 4.25Å; I367-L406 HydrophobicContact CG1-CD1 3.89Å; L402-L406 HydrophobicContact CD1-CD1 4.01Å; L402-L406 HydrophobicContact CD1-CG 3.97Å; L402-L406 HydrophobicContact CG-CD1 3.91Å; L402-L406 HydrophobicContact CG-CG 4.32Å; L402-L406 WeakPolarHBondContact O-CB 3.22Å; L402-L406 VanDerWaalsContact O-CG 3.27Å; L402-L406 WeakPolarHBondContact O-CG 3.43Å; L402-L406 PolarHBondContact O-N 3.39Å; F403-L406 PolarHBondContact O-N 3.33Å; N404-L406 PolarHBondContact O-N 3.42Å; L406-K409 PolarHBondContact O-N 2.77Å; L406-Q410 WeakPolarHBondContact O-CB 3.49Å; L406-Q410 PolarHBondContact O-N 3.29Å
407	L	90.1	Very high	86.2	Confident	33 Å²	33	75.2 Å²	75.2	17%	0.173	36%	0.36	C	S	.	.	H	α-helix	trans	-65.7	-46	176.8	-174	67.1	0	0	0	111.5	F403 N404 K409 Q410 Y411	F403-L407 HydrophobicContact CE1-CD2 3.86Å; F403-L407 HydrophobicContact CZ-CD2 4.11Å; F403-L407 VanDerWaalsContact O-CB 3.27Å; F403-L407 WeakPolarHBondContact O-CB 3.49Å; F403-L407 PolarHBondContact O-N 3.27Å; N404-L407 PolarHBondContact O-N 2.98Å; L407-K409 PolarHBondContact O-N 3.32Å; L407-Q410 PolarHBondContact O-N 2.78Å; L407-Q410 VanDerWaalsContact O-N 3.13Å; L407-Y411 HydrophobicContact CD1-CD2 4.28Å; L407-Y411 HydrophobicContact CD1-CE2 3.69Å; L407-Y411 HydrophobicContact CD2-CE2 4.1Å; L407-Y411 HydrophobicContact CG-CD2 3.99Å; L407-Y411 HydrophobicContact CG-CE2 3.6Å; L407-Y411 VanDerWaalsContact O-CD2 3.28Å; L407-Y411 WeakPolarHBondContact O-CD2 3.41Å; L407-Y411 PolarHBondContact O-N 2.89Å
408	I	88.1	Confident	85.3	Confident	91 Å²	91	71.2 Å²	71.2	47%	0.467	34%	0.343	S	S	.	.	H	α-helix	trans	-59.9	-45.7	173.7	-67.5	164	0	0	0	110.6	N404 Q410 Y411 N412	N404-I408 WeakPolarHBondContact O-CG1 3.11Å; N404-I408 PolarHBondContact O-N 2.92Å; I408-Q410 VanDerWaalsContact C-N 3.27Å; I408-Q410 PolarHBondContact O-N 2.84Å; I408-Y411 PolarHBondContact O-N 3.02Å; I408-N412 WeakPolarHBondContact O-CB 3.2Å; I408-N412 VanDerWaalsContact O-CG 3.26Å; I408-N412 PolarHBondContact O-N 3.45Å; I408-N412 PolarHBondContact O-OD1 2.9Å
409	K	87.2	Confident	84.3	Confident	114 Å²	114	72 Å²	72	50%	0.496	35%	0.347	S	S	.	.	H	α-helix	trans	-59	-38.2	174.5	-74.7	168.2	-178.6	171	0	112	Q405 L406 L407 L413	Q405-K409 WeakPolarHBondContact O-CB 3.33Å; Q405-K409 WeakPolarHBondContact O-CD 3.4Å; Q405-K409 VanDerWaalsContact O-CG 3.28Å; Q405-K409 WeakPolarHBondContact O-CG 3.47Å; Q405-K409 PolarHBondContact O-N 3.24Å; Q405-K409 VanDerWaalsContact O-N 3.1Å; L406-K409 PolarHBondContact O-N 2.77Å; L407-K409 PolarHBondContact O-N 3.32Å; K409-L413 WeakPolarHBondContact O-CB 3.38Å; K409-L413 WeakPolarHBondContact O-CD1 3.33Å; K409-L413 VanDerWaalsContact O-CG 3.22Å; K409-L413 WeakPolarHBondContact O-CG 3.46Å; K409-L413 PolarHBondContact O-N 3.49Å
410	Q	84.8	Confident	83.2	Confident	33 Å²	33	75.6 Å²	75.6	15%	0.154	37%	0.367	C	S	.	.	H	α-helix	trans	-68.9	-43.8	177.2	-179.8	169.1	-3.3	0	0	112.7	L406 L407 I408 L413 I414	L406-Q410 WeakPolarHBondContact O-CB 3.49Å; L406-Q410 PolarHBondContact O-N 3.29Å; L407-Q410 PolarHBondContact O-N 2.78Å; L407-Q410 VanDerWaalsContact O-N 3.13Å; I408-Q410 VanDerWaalsContact C-N 3.27Å; I408-Q410 PolarHBondContact O-N 2.84Å; Q410-L413 PolarHBondContact O-N 2.88Å; Q410-I414 HydrophobicContact CG-CD1 3.97Å; Q410-I414 WeakPolarHBondContact O-CG1 3.48Å; Q410-I414 PolarHBondContact O-N 2.88Å
411	Y	83.7	Confident	82.4	Confident	125 Å²	125	72.3 Å²	72.3	49%	0.49	36%	0.357	S	S	.	.	H	α-helix	trans	-60.4	-49.8	174.7	-75.6	-62	0	0	0	110.7	L407 I408 L413 I414 D415	L407-Y411 HydrophobicContact CD1-CD2 4.28Å; L407-Y411 HydrophobicContact CD1-CE2 3.69Å; L407-Y411 HydrophobicContact CD2-CE2 4.1Å; L407-Y411 HydrophobicContact CG-CD2 3.99Å; L407-Y411 HydrophobicContact CG-CE2 3.6Å; L407-Y411 VanDerWaalsContact O-CD2 3.28Å; L407-Y411 WeakPolarHBondContact O-CD2 3.41Å; L407-Y411 PolarHBondContact O-N 2.89Å; I408-Y411 PolarHBondContact O-N 3.02Å; Y411-L413 PolarHBondContact O-N 3.12Å; Y411-L413 VanDerWaalsContact O-N 3.13Å; Y411-I414 CarbonylContact O-C 3.57Å; Y411-I414 WeakPolarHBondContact O-CA 3.32Å; Y411-I414 WeakPolarHBondContact O-CB 3.5Å; Y411-I414 PolarHBondContact O-N 3.09Å; Y411-D415 PolarHBondContact O-N 2.94Å
412	N	82.4	Confident	81.6	Confident	85 Å²	85	71.4 Å²	71.4	46%	0.455	35%	0.352	S	S	.	.	H	α-helix	trans	-57.5	-32.4	176	-65.9	-4.6	0	0	0	113	I408 N416	I408-N412 WeakPolarHBondContact O-CB 3.2Å; I408-N412 VanDerWaalsContact O-CG 3.26Å; I408-N412 PolarHBondContact O-N 3.45Å; I408-N412 PolarHBondContact O-OD1 2.9Å; N412-N416 WeakPolarHBondContact O-CB 3.37Å; N412-N416 VanDerWaalsContact O-CG 3.25Å; N412-N416 PolarHBondContact O-N 2.74Å; N412-N416 PolarHBondContact O-ND2 3.36Å
413	L	80.7	Confident	80.5	Confident	92 Å²	92	72 Å²	72	48%	0.482	36%	0.358	S	S	.	.	H	α-helix	trans	-76.2	-24.9	174	-76.3	168.3	0	0	0	113.9	K409 Q410 Y411 K417	K409-L413 WeakPolarHBondContact O-CB 3.38Å; K409-L413 WeakPolarHBondContact O-CD1 3.33Å; K409-L413 VanDerWaalsContact O-CG 3.22Å; K409-L413 WeakPolarHBondContact O-CG 3.46Å; K409-L413 PolarHBondContact O-N 3.49Å; Q410-L413 PolarHBondContact O-N 2.88Å; Y411-L413 PolarHBondContact O-N 3.12Å; Y411-L413 VanDerWaalsContact O-N 3.13Å; L413-K417 VanDerWaalsContact O-CD 3.31Å; L413-K417 WeakPolarHBondContact O-CD 3.42Å; L413-K417 WeakPolarHBondContact O-CG 3.44Å; L413-K417 PolarHBondContact O-N 3.02Å
414	I	79.1	Confident	79.5	Confident	68 Å²	68	76.2 Å²	76.2	35%	0.349	38%	0.381	S	S	.	.	H	α-helix	trans	-78.3	-46.2	172.3	-70.3	165	0	0	0	109.4	Q410 Y411 K417 N418	Q410-I414 HydrophobicContact CG-CD1 3.97Å; Q410-I414 WeakPolarHBondContact O-CG1 3.48Å; Q410-I414 PolarHBondContact O-N 2.88Å; Y411-I414 CarbonylContact O-C 3.57Å; Y411-I414 WeakPolarHBondContact O-CA 3.32Å; Y411-I414 WeakPolarHBondContact O-CB 3.5Å; Y411-I414 PolarHBondContact O-N 3.09Å; I414-K417 CarbonylContact O-C 3.58Å; I414-K417 WeakPolarHBondContact O-CA 3.4Å; I414-K417 WeakPolarHBondContact O-CB 3.41Å; I414-K417 PolarHBondContact O-N 2.78Å; I414-N418 VanDerWaalsContact O-CG 3.31Å; I414-N418 PolarHBondContact O-N 3.11Å; I414-N418 PolarHBondContact O-ND2 3.4Å
415	D	73.7	Confident	78.7	Confident	73 Å²	73	77.6 Å²	77.6	39%	0.39	39%	0.388	S	S	.	.	H	α-helix	trans	-69.6	-38.6	-178.2	-62	-35.2	0	0	0	111.7	Y411 K417 N418 N419	Y411-D415 PolarHBondContact O-N 2.94Å; D415-K417 VanDerWaalsContact C-N 3.28Å; D415-K417 PolarHBondContact O-N 3.24Å; D415-N418 PolarHBondContact O-N 2.89Å; D415-N419 VanDerWaalsContact O-CB 3.31Å; D415-N419 WeakPolarHBondContact O-CB 3.43Å; D415-N419 PolarHBondContact O-N 2.95Å; D415-N419 PolarHBondContact O-ND2 3.48Å
416	N	72.4	Confident	77.7	Confident	90 Å²	90	78.1 Å²	78.1	48%	0.481	39%	0.39	S	S	.	.	H	α-helix	trans	-64.3	-30	169.3	-76.6	-44.4	0	0	0	112.9	N412 N420	N412-N416 WeakPolarHBondContact O-CB 3.37Å; N412-N416 VanDerWaalsContact O-CG 3.25Å; N412-N416 PolarHBondContact O-N 2.74Å; N412-N416 PolarHBondContact O-ND2 3.36Å; N416-N420 VanDerWaalsContact O-CB 3.3Å; N416-N420 WeakPolarHBondContact O-CB 3.44Å; N416-N420 PolarHBondContact O-N 3.3Å; N416-N420 PolarHBondContact O-ND2 3.19Å
417	K	75	Confident	76.7	Confident	148 Å²	148	84.2 Å²	84.2	64%	0.643	41%	0.413	S	S	*	.	H	α-helix	trans	-72	-42.3	171.7	-77.5	170.5	-174.2	175.5	0	111.6	L413 I414 D415 N420 L421	L413-K417 VanDerWaalsContact O-CD 3.31Å; L413-K417 WeakPolarHBondContact O-CD 3.42Å; L413-K417 WeakPolarHBondContact O-CG 3.44Å; L413-K417 PolarHBondContact O-N 3.02Å; I414-K417 CarbonylContact O-C 3.58Å; I414-K417 WeakPolarHBondContact O-CA 3.4Å; I414-K417 WeakPolarHBondContact O-CB 3.41Å; I414-K417 PolarHBondContact O-N 2.78Å; D415-K417 VanDerWaalsContact C-N 3.28Å; D415-K417 PolarHBondContact O-N 3.24Å; K417-N420 PolarHBondContact O-N 2.98Å; K417-L421 WeakPolarHBondContact O-CB 3.49Å; K417-L421 PolarHBondContact O-N 3.32Å
418	N	71.5	Confident	75.9	Confident	39 Å²	39	90.7 Å²	90.7	21%	0.209	44%	0.439	C	S	.	.	H	α-helix	trans	-60.3	-52.3	175.3	-69	-29.8	0	0	0	110.3	I414 D415 N420 L421 I422	I414-N418 VanDerWaalsContact O-CG 3.31Å; I414-N418 PolarHBondContact O-N 3.11Å; I414-N418 PolarHBondContact O-ND2 3.4Å; D415-N418 PolarHBondContact O-N 2.89Å; N418-N420 PolarHBondContact O-N 3.29Å; N418-L421 CarbonylContact O-C 3.48Å; N418-L421 WeakPolarHBondContact O-CA 3.36Å; N418-L421 WeakPolarHBondContact O-CB 3.37Å; N418-L421 PolarHBondContact O-N 3.2Å; N418-I422 HydrophobicContact CB-CD1 4.48Å; N418-I422 WeakPolarHBondContact O-CB 3.31Å; N418-I422 WeakPolarHBondContact O-CD1 3.42Å; N418-I422 WeakPolarHBondContact O-CG1 3.27Å; N418-I422 PolarHBondContact O-N 2.92Å
419	N	69.7	Low	75.1	Confident	88 Å²	88	90.8 Å²	90.8	47%	0.471	44%	0.44	S	S	.	.	H	α-helix	trans	-58	-46.1	177.8	-67.6	-15.8	0	0	0	111.6	D415 L421 I422 T423	D415-N419 VanDerWaalsContact O-CB 3.31Å; D415-N419 WeakPolarHBondContact O-CB 3.43Å; D415-N419 PolarHBondContact O-N 2.95Å; D415-N419 PolarHBondContact O-ND2 3.48Å; N419-L421 VanDerWaalsContact C-N 3.33Å; N419-L421 PolarHBondContact O-N 2.95Å; N419-I422 PolarHBondContact O-N 2.92Å; N419-T423 VanDerWaalsContact O-CB 3.3Å; N419-T423 WeakPolarHBondContact O-CB 3.39Å; N419-T423 PolarHBondContact O-N 2.88Å; N419-T423 PolarHBondContact O-OG1 2.72Å
420	N	70.8	Confident	74.2	Confident	97 Å²	97	88 Å²	88	52%	0.519	43%	0.433	S	S	.	.	H	α-helix	trans	-63.4	-36	174	-80.8	-61.3	0	0	0	112.6	N416 K417 N418 N424	N416-N420 VanDerWaalsContact O-CB 3.3Å; N416-N420 WeakPolarHBondContact O-CB 3.44Å; N416-N420 PolarHBondContact O-N 3.3Å; N416-N420 PolarHBondContact O-ND2 3.19Å; K417-N420 PolarHBondContact O-N 2.98Å; N418-N420 PolarHBondContact O-N 3.29Å; N420-N424 VanDerWaalsContact O-CB 3.3Å; N420-N424 WeakPolarHBondContact O-CB 3.4Å; N420-N424 PolarHBondContact O-N 3.02Å; N420-N424 PolarHBondContact O-ND2 3.49Å
421	L	73.2	Confident	73.5	Confident	49 Å²	49	91 Å²	91	26%	0.257	45%	0.447	S	S	.	.	H	α-helix	trans	-67.3	-44.2	175.7	-163	92.6	0	0	0	111.4	K417 N418 N419 N424 I425	K417-L421 WeakPolarHBondContact O-CB 3.49Å; K417-L421 PolarHBondContact O-N 3.32Å; N418-L421 CarbonylContact O-C 3.48Å; N418-L421 WeakPolarHBondContact O-CA 3.36Å; N418-L421 WeakPolarHBondContact O-CB 3.37Å; N418-L421 PolarHBondContact O-N 3.2Å; N419-L421 VanDerWaalsContact C-N 3.33Å; N419-L421 PolarHBondContact O-N 2.95Å; L421-N424 PolarHBondContact O-N 2.87Å; L421-I425 HydrophobicContact CD2-CD1 4.13Å; L421-I425 HydrophobicContact CG-CD1 4.11Å; L421-I425 WeakPolarHBondContact O-CB 3.31Å; L421-I425 WeakPolarHBondContact O-CD1 3.44Å; L421-I425 VanDerWaalsContact O-CG1 3.26Å; L421-I425 WeakPolarHBondContact O-CG1 3.24Å; L421-I425 PolarHBondContact O-N 3.25Å
422	I	74.2	Confident	72.8	Confident	43 Å²	43	91.3 Å²	91.3	22%	0.221	45%	0.451	C	S	.	.	H	α-helix	trans	-61.3	-51.9	176.9	-66.2	158.9	0	0	0	109.6	N418 N419 N424 I425 Q426 C940	N418-I422 HydrophobicContact CB-CD1 4.48Å; N418-I422 WeakPolarHBondContact O-CB 3.31Å; N418-I422 WeakPolarHBondContact O-CD1 3.42Å; N418-I422 WeakPolarHBondContact O-CG1 3.27Å; N418-I422 PolarHBondContact O-N 2.92Å; N419-I422 PolarHBondContact O-N 2.92Å; I422-N424 VanDerWaalsContact C-N 3.34Å; I422-N424 PolarHBondContact O-N 3.5Å; I422-I425 CarbonylContact O-C 3Å; I422-I425 WeakPolarHBondContact O-CB 3.38Å; I422-I425 PolarHBondContact O-N 3.39Å; I422-I425 VanDerWaalsContact O-N 3.08Å; I422-Q426 WeakPolarHBondContact O-CB 3.38Å; I422-Q426 PolarHBondContact O-N 2.75Å; I422-C940 WeakPolarHBondContact CD1-SG 3.5Å; I422-C940 VanDerWaalsContact CG1-SG 3.6Å
423	T	69.2	Low	72.1	Confident	57 Å²	57	90.9 Å²	90.9	35%	0.35	45%	0.451	S	S	.	.	H	α-helix	trans	-57.1	-43.6	175.7	-65.3	0	0	0	0	111.9	N419 I425 Q426 Y427	N419-T423 VanDerWaalsContact O-CB 3.3Å; N419-T423 WeakPolarHBondContact O-CB 3.39Å; N419-T423 PolarHBondContact O-N 2.88Å; N419-T423 PolarHBondContact O-OG1 2.72Å; T423-I425 PolarHBondContact O-N 3.31Å; T423-Q426 PolarHBondContact O-N 2.64Å; T423-Y427 HydrophobicContact CG2-CD2 3.69Å; T423-Y427 HydrophobicContact CG2-CE2 3.46Å; T423-Y427 VanDerWaalsContact CG2-CE2 3.46Å; T423-Y427 WeakPolarHBondContact O-CD2 3.42Å; T423-Y427 PolarHBondContact O-N 2.83Å
424	N	70.5	Confident	71.6	Confident	104 Å²	104	91.7 Å²	91.7	56%	0.556	45%	0.451	S	S	*	.	H	α-helix	trans	-64.8	-37.2	175	-84	-63.8	0	0	0	112.9	N420 L421 I422 K428	N420-N424 VanDerWaalsContact O-CB 3.3Å; N420-N424 WeakPolarHBondContact O-CB 3.4Å; N420-N424 PolarHBondContact O-N 3.02Å; N420-N424 PolarHBondContact O-ND2 3.49Å; L421-N424 PolarHBondContact O-N 2.87Å; I422-N424 VanDerWaalsContact C-N 3.34Å; I422-N424 PolarHBondContact O-N 3.5Å; N424-K428 VanDerWaalsContact O-CB 3.23Å; N424-K428 WeakPolarHBondContact O-CB 3.12Å; N424-K428 PolarHBondContact O-N 3.39Å
425	I	74.3	Confident	71	Confident	67 Å²	67	94 Å²	94	34%	0.344	46%	0.46	S	S	.	.	H	α-helix	trans	-68.1	-41.5	174.3	-72.1	164.1	0	0	0	110.4	L421 I422 T423 K428 L429 C937	L421-I425 HydrophobicContact CD2-CD1 4.13Å; L421-I425 HydrophobicContact CG-CD1 4.11Å; L421-I425 WeakPolarHBondContact O-CB 3.31Å; L421-I425 WeakPolarHBondContact O-CD1 3.44Å; L421-I425 VanDerWaalsContact O-CG1 3.26Å; L421-I425 WeakPolarHBondContact O-CG1 3.24Å; L421-I425 PolarHBondContact O-N 3.25Å; I422-I425 CarbonylContact O-C 3Å; I422-I425 WeakPolarHBondContact O-CB 3.38Å; I422-I425 PolarHBondContact O-N 3.39Å; I422-I425 VanDerWaalsContact O-N 3.08Å; T423-I425 PolarHBondContact O-N 3.31Å; I425-K428 CarbonylContact O-C 3.58Å; I425-K428 PolarHBondContact O-N 2.88Å; I425-L429 HydrophobicContact CG2-CD1 3.87Å; I425-L429 HydrophobicContact CG2-CG 4.4Å; I425-L429 WeakPolarHBondContact O-CB 3.38Å; I425-L429 VanDerWaalsContact O-CG 3.32Å; I425-L429 WeakPolarHBondContact O-CG 3.26Å; I425-L429 PolarHBondContact O-N 3.05Å; I425-C937 HydrophobicContact CD1-CB 4.4Å; I425-C937 WeakPolarHBondContact CD1-SG 3.22Å
426	Q	69.5	Low	70.2	Confident	118 Å²	118	94.2 Å²	94.2	55%	0.551	46%	0.461	S	S	*	.	H	α-helix	trans	-63.8	-48	178.1	-170.8	174.3	-2	0	0	111.1	I422 T423 K428 L429 T430	I422-Q426 WeakPolarHBondContact O-CB 3.38Å; I422-Q426 PolarHBondContact O-N 2.75Å; T423-Q426 PolarHBondContact O-N 2.64Å; Q426-K428 VanDerWaalsContact C-N 3.33Å; Q426-K428 PolarHBondContact O-N 2.71Å; Q426-L429 PolarHBondContact O-N 2.85Å; Q426-T430 WeakPolarHBondContact O-CG2 3.22Å; Q426-T430 PolarHBondContact O-N 3.01Å; Q426-T430 PolarHBondContact O-OG1 2.72Å
427	Y	71.4	Confident	69.3	Low	155 Å²	155	96.5 Å²	96.5	61%	0.608	47%	0.473	S	S	*	.	H	α-helix	trans	-56.1	-47.1	171.4	-82.3	-60.3	0	0	0	111.7	T423 L429 T430 E431	T423-Y427 HydrophobicContact CG2-CD2 3.69Å; T423-Y427 HydrophobicContact CG2-CE2 3.46Å; T423-Y427 VanDerWaalsContact CG2-CE2 3.46Å; T423-Y427 WeakPolarHBondContact O-CD2 3.42Å; T423-Y427 PolarHBondContact O-N 2.83Å; Y427-L429 VanDerWaalsContact C-N 3.28Å; Y427-L429 PolarHBondContact O-N 2.85Å; Y427-T430 WeakPolarHBondContact CA-OG1 3.31Å; Y427-T430 PolarHBondContact O-N 3.22Å; Y427-T430 VanDerWaalsContact O-N 3.15Å; Y427-T430 PolarHBondContact O-OG1 3.38Å; Y427-E431 PolarHBondContact O-N 2.83Å
428	K	72.3	Confident	68.3	Low	168 Å²	168	95.7 Å²	95.7	73%	0.73	48%	0.475	S	S	*	.	H	α-helix	trans	-68.1	-26	-179.1	-162.1	165.5	-168.6	166.7	0	113.3	N424 I425 Q426 K432	N424-K428 VanDerWaalsContact O-CB 3.23Å; N424-K428 WeakPolarHBondContact O-CB 3.12Å; N424-K428 PolarHBondContact O-N 3.39Å; I425-K428 CarbonylContact O-C 3.58Å; I425-K428 PolarHBondContact O-N 2.88Å; Q426-K428 VanDerWaalsContact C-N 3.33Å; Q426-K428 PolarHBondContact O-N 2.71Å; K428-K432 WeakPolarHBondContact O-CB 3.36Å; K428-K432 PolarHBondContact O-N 3.32Å
429	L	70.7	Confident	67.3	Low	94 Å²	94	99.2 Å²	99.2	49%	0.492	49%	0.489	S	S	.	.	H	α-helix	trans	-74.8	-45.8	168.3	-76.2	167.5	0	0	0	111.1	I425 Q426 Y427 E431 K432 T433	I425-L429 HydrophobicContact CG2-CD1 3.87Å; I425-L429 HydrophobicContact CG2-CG 4.4Å; I425-L429 WeakPolarHBondContact O-CB 3.38Å; I425-L429 VanDerWaalsContact O-CG 3.32Å; I425-L429 WeakPolarHBondContact O-CG 3.26Å; I425-L429 PolarHBondContact O-N 3.05Å; Q426-L429 PolarHBondContact O-N 2.85Å; Y427-L429 VanDerWaalsContact C-N 3.28Å; Y427-L429 PolarHBondContact O-N 2.85Å; L429-E431 PolarHBondContact O-N 3.25Å; L429-K432 CarbonylContact O-C 3.46Å; L429-K432 PolarHBondContact O-N 3.48Å; L429-T433 WeakPolarHBondContact O-CG2 3.49Å; L429-T433 PolarHBondContact O-N 3.06Å; L429-T433 PolarHBondContact O-OG1 3.35Å
430	T	68.3	Low	66.1	Low	55 Å²	55	99.4 Å²	99.4	34%	0.337	50%	0.495	S	S	.	.	H	α-helix	trans	-61.7	-44.3	-179.2	52.1	0	0	0	0	112	Q426 Y427 K432 T433 K434	Q426-T430 WeakPolarHBondContact O-CG2 3.22Å; Q426-T430 PolarHBondContact O-N 3.01Å; Q426-T430 PolarHBondContact O-OG1 2.72Å; Y427-T430 WeakPolarHBondContact CA-OG1 3.31Å; Y427-T430 PolarHBondContact O-N 3.22Å; Y427-T430 VanDerWaalsContact O-N 3.15Å; Y427-T430 PolarHBondContact O-OG1 3.38Å; T430-K432 VanDerWaalsContact C-N 3.34Å; T430-K432 PolarHBondContact O-N 3.37Å; T430-T433 WeakPolarHBondContact CA-OG1 3.46Å; T430-T433 PolarHBondContact O-N 3.4Å; T430-T433 VanDerWaalsContact O-N 3.15Å; T430-T433 PolarHBondContact O-OG1 3.43Å; T430-K434 WeakPolarHBondContact O-CG 3.47Å; T430-K434 PolarHBondContact O-N 3.11Å
431	E	71.1	Confident	64.9	Low	95 Å²	95	100.8 Å²	100.8	44%	0.444	50%	0.502	S	S	.	.	H	α-helix	trans	-59.3	-45.9	174.5	-69.2	-48.3	112.5	0	0	111.4	Y427 L429 T433 K434 E435	Y427-E431 PolarHBondContact O-N 2.83Å; L429-E431 PolarHBondContact O-N 3.25Å; E431-T433 VanDerWaalsContact C-N 3.26Å; E431-T433 PolarHBondContact O-N 2.94Å; E431-K434 WeakPolarHBondContact O-CB 3.23Å; E431-K434 PolarHBondContact O-N 2.93Å; E431-K434 WeakPolarHBondContact OE1-CE 3.39Å; E431-K434 IonicContact OE1-NZ 2.65Å; E431-K434 PolarHBondContact OE1-NZ 3.4Å; E431-K434 IonicContact OE2-NZ 2.99Å; E431-E435 PolarHBondContact O-N 3.31Å
432	K	69.2	Low	63.6	Low	132 Å²	132	104.9 Å²	104.9	57%	0.574	51%	0.514	S	S	*	.	H	α-helix	trans	-65.9	-28	178.5	-151.9	172.9	-168.9	-179.1	0	112.9	K428 L429 T430 L436	K428-K432 WeakPolarHBondContact O-CB 3.36Å; K428-K432 PolarHBondContact O-N 3.32Å; L429-K432 CarbonylContact O-C 3.46Å; L429-K432 PolarHBondContact O-N 3.48Å; T430-K432 VanDerWaalsContact C-N 3.34Å; T430-K432 PolarHBondContact O-N 3.37Å; K432-L436 WeakPolarHBondContact O-CD1 3.16Å; K432-L436 VanDerWaalsContact O-CG 3.27Å; K432-L436 WeakPolarHBondContact O-CG 3.29Å; K432-L436 PolarHBondContact O-N 3.34Å
433	T	66.5	Low	62	Low	76 Å²	76	107.4 Å²	107.4	47%	0.466	53%	0.528	S	S	.	.	H	α-helix	trans	-74.3	-34.1	170.3	55.8	0	0	0	0	112.9	L429 T430 E431 L436 L437	L429-T433 WeakPolarHBondContact O-CG2 3.49Å; L429-T433 PolarHBondContact O-N 3.06Å; L429-T433 PolarHBondContact O-OG1 3.35Å; T430-T433 WeakPolarHBondContact CA-OG1 3.46Å; T430-T433 PolarHBondContact O-N 3.4Å; T430-T433 VanDerWaalsContact O-N 3.15Å; T430-T433 PolarHBondContact O-OG1 3.43Å; E431-T433 VanDerWaalsContact C-N 3.26Å; E431-T433 PolarHBondContact O-N 2.94Å; T433-L436 PolarHBondContact O-N 3.1Å; T433-L437 PolarHBondContact O-N 2.86Å
434	K	71.8	Confident	60.8	Low	110 Å²	110	108.5 Å²	108.5	48%	0.478	53%	0.531	S	S	.	.	H	α-helix	trans	-63.5	-45.5	171.1	-65.1	170.7	-173.9	173.4	0	111	T430 E431 L436 L437 N438	T430-K434 WeakPolarHBondContact O-CG 3.47Å; T430-K434 PolarHBondContact O-N 3.11Å; E431-K434 WeakPolarHBondContact O-CB 3.23Å; E431-K434 PolarHBondContact O-N 2.93Å; E431-K434 WeakPolarHBondContact OE1-CE 3.39Å; E431-K434 IonicContact OE1-NZ 2.65Å; E431-K434 PolarHBondContact OE1-NZ 3.4Å; E431-K434 IonicContact OE2-NZ 2.99Å; K434-L436 PolarHBondContact O-N 3.17Å; K434-L437 PolarHBondContact O-N 3.2Å; K434-N438 WeakPolarHBondContact O-CB 3.45Å; K434-N438 VanDerWaalsContact O-CG 3.28Å; K434-N438 PolarHBondContact O-N 2.86Å
435	E	65.6	Low	59.3	Low	115 Å²	115	108.7 Å²	108.7	54%	0.537	53%	0.531	S	S	.	.	H	α-helix	trans	-58.2	-28.7	174.5	-71.8	-169.9	140.5	0	0	113.9	E431	E431-E435 PolarHBondContact O-N 3.31Å
436	L	57.4	Low	57.7	Low	78 Å²	78	110.6 Å²	110.6	41%	0.408	54%	0.539	S	S	.	.	H	α-helix	trans	-87.5	-35.1	178	-72.1	170.3	0	0	0	112.6	K432 T433 K434 N438 K439	K432-L436 WeakPolarHBondContact O-CD1 3.16Å; K432-L436 VanDerWaalsContact O-CG 3.27Å; K432-L436 WeakPolarHBondContact O-CG 3.29Å; K432-L436 PolarHBondContact O-N 3.34Å; T433-L436 PolarHBondContact O-N 3.1Å; K434-L436 PolarHBondContact O-N 3.17Å; L436-N438 VanDerWaalsContact C-N 3.33Å; L436-K439 PolarHBondContact O-N 3.32Å
437	L	52.9	Low	56.3	Low	139 Å²	139	108.8 Å²	108.8	73%	0.728	54%	0.536	S	S	*	.	H	α-helix	trans	-65.1	-37.6	171.6	-115.2	69.6	0	0	0	111.7	T433 K434 K439	T433-L437 PolarHBondContact O-N 2.86Å; K434-L437 PolarHBondContact O-N 3.2Å; L437-K439 PolarHBondContact O-N 3.03Å
438	N	55	Low	54.5	Low	131 Å²	131	107.1 Å²	107.1	70%	0.701	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.7	14.6	178.2	-68.4	-5.9	0	0	0	114.1	K434 L436 P440	K434-N438 WeakPolarHBondContact O-CB 3.45Å; K434-N438 VanDerWaalsContact O-CG 3.28Å; K434-N438 PolarHBondContact O-N 2.86Å; L436-N438 VanDerWaalsContact C-N 3.33Å; N438-P440 VanDerWaalsContact C-CD 3.5Å; N438-P440 WeakPolarHBondContact O-CD 3.37Å
439	K	48.8	Very low	52.8	Low	113 Å²	113	104.5 Å²	104.5	49%	0.491	53%	0.529	S	S	.	.			trans	-120.9	70.1	176.2	-72.1	173.4	-177.2	159.9	0	111	L436 L437 N441 W442	L436-K439 PolarHBondContact O-N 3.32Å; L437-K439 PolarHBondContact O-N 3.03Å; K439-N441 VanDerWaalsContact C-N 3.26Å; K439-N441 PolarHBondContact O-N 3.31Å; K439-W442 PolarHBondContact O-N 3.38Å
440	P	45	Very low	51.3	Low	92 Å²	92	107.2 Å²	107.2	60%	0.597	53%	0.533	S	S	*	.	H	α-helix	trans	-58.7	-28.7	-166	20.4	-33.2	0	0	0	115.2	N438 I444	N438-P440 VanDerWaalsContact C-CD 3.5Å; N438-P440 WeakPolarHBondContact O-CD 3.37Å; P440-I444 WeakPolarHBondContact O-CD1 3Å; P440-I444 WeakPolarHBondContact O-CG1 3.44Å
441	N	46.7	Very low	49.7	Very low	126 Å²	126	109.8 Å²	109.8	67%	0.674	55%	0.545	S	S	*	.	H	α-helix	trans	-84.8	-7.2	-174	-74	-20.4	0	0	0	115.9	K439 N445	K439-N441 VanDerWaalsContact C-N 3.26Å; K439-N441 PolarHBondContact O-N 3.31Å; N441-N445 PolarHBondContact O-ND2 2.94Å; N441-N445 VanDerWaalsContact O-ND2 3.14Å
442	W	45.4	Very low	48.1	Very low	134 Å²	134	110.9 Å²	110.9	51%	0.508	55%	0.552	S	S	.	*	H	α-helix	trans	-89.2	-35.1	-175.8	-170.3	57.8	0	0	0	114.1	K439	K439-W442 PolarHBondContact O-N 3.38Å
443	L	41	Very low	46.4	Very low	96 Å²	96	113 Å²	113	50%	0.503	56%	0.562	S	S	.	*	H	α-helix	trans	-76.1	-36.1	178.5	-85	76.8	0	0	0	112.6	N445 Q446 T447	L443-N445 VanDerWaalsContact C-N 3.31Å; L443-N445 PolarHBondContact O-N 3.24Å; L443-Q446 PolarHBondContact O-N 3.47Å; L443-T447 PolarHBondContact O-N 2.88Å; L443-T447 VanDerWaalsContact O-N 3.11Å; L443-T447 PolarHBondContact O-OG1 3.28Å
444	I	44	Very low	44.8	Very low	81 Å²	81	115.2 Å²	115.2	42%	0.415	56%	0.562	S	S	.	*	H	α-helix	trans	-60.6	-39.6	-175.1	-61.2	174.8	0	0	0	111.7	P440 Q446 T447 M448	P440-I444 WeakPolarHBondContact O-CD1 3Å; P440-I444 WeakPolarHBondContact O-CG1 3.44Å; I444-Q446 VanDerWaalsContact C-N 3.3Å; I444-Q446 PolarHBondContact O-N 3.3Å; I444-T447 PolarHBondContact O-N 3.29Å; I444-T447 PolarHBondContact O-OG1 3.26Å; I444-M448 HydrophobicContact CG2-CE 4.06Å; I444-M448 PolarHBondContact O-N 3.45Å; I444-M448 VanDerWaalsContact O-N 3.17Å
445	N	38.5	Very low	43.1	Very low	107 Å²	107	118.3 Å²	118.3	57%	0.572	58%	0.576	S	S	*	*	H	α-helix	trans	-73.2	-19.4	178.8	-70.3	-46.4	0	0	0	113.7	N441 L443 N449	N441-N445 PolarHBondContact O-ND2 2.94Å; N441-N445 VanDerWaalsContact O-ND2 3.14Å; L443-N445 VanDerWaalsContact C-N 3.31Å; L443-N445 PolarHBondContact O-N 3.24Å; N445-N449 PolarHBondContact O-ND2 3.37Å
446	Q	41.6	Very low	41.6	Very low	107 Å²	107	123.4 Å²	123.4	50%	0.5	59%	0.59	S	S	.	*	H	α-helix	trans	-86.3	-29.9	174	-66.3	-175.9	50.5	0	0	112.4	L443 I444	L443-Q446 PolarHBondContact O-N 3.47Å; I444-Q446 VanDerWaalsContact C-N 3.3Å; I444-Q446 PolarHBondContact O-N 3.3Å
447	T	38.1	Very low	40.5	Very low	81 Å²	81	123.2 Å²	123.2	50%	0.497	60%	0.596	S	S	.	*	H	α-helix	trans	-77.2	-39.2	176.9	52.1	0	0	0	0	112.4	L443 I444 N449 R450 N451	L443-T447 PolarHBondContact O-N 2.88Å; L443-T447 VanDerWaalsContact O-N 3.11Å; L443-T447 PolarHBondContact O-OG1 3.28Å; I444-T447 PolarHBondContact O-N 3.29Å; I444-T447 PolarHBondContact O-OG1 3.26Å; T447-N449 VanDerWaalsContact C-N 3.34Å; T447-N449 PolarHBondContact O-N 3.18Å; T447-R450 PolarHBondContact O-N 2.86Å; T447-R450 VanDerWaalsContact O-N 3.1Å; T447-N451 PolarHBondContact O-N 3.05Å
448	M	34.5	Very low	39.7	Very low	119 Å²	119	125.2 Å²	125.2	59%	0.586	60%	0.598	S	S	*	*	H	α-helix	trans	-62.1	-37.2	179.1	-71	-163.7	177.7	0	0	113.4	I444 R450 N451	I444-M448 HydrophobicContact CG2-CE 4.06Å; I444-M448 PolarHBondContact O-N 3.45Å; I444-M448 VanDerWaalsContact O-N 3.17Å; M448-R450 PolarHBondContact O-N 2.95Å; M448-N451 PolarHBondContact O-N 2.73Å; M448-N451 VanDerWaalsContact O-N 3.11Å
449	N	37.1	Very low	38.7	Very low	113 Å²	113	125.3 Å²	125.3	60%	0.604	60%	0.599	S	S	*	*	H	α-helix	trans	-65.1	-22.8	175.9	-86.4	-54.1	0	0	0	114	N445 T447	N445-N449 PolarHBondContact O-ND2 3.37Å; T447-N449 VanDerWaalsContact C-N 3.34Å; T447-N449 PolarHBondContact O-N 3.18Å
450	R	37.9	Very low	37.9	Very low	152 Å²	152	123.8 Å²	123.8	57%	0.574	60%	0.603	S	S	*	*	H	α-helix	trans	-77.3	-28.2	172.6	-81.3	179.3	161.5	158.5	-4.1	113	T447 M448 I452 F453 S959	T447-R450 PolarHBondContact O-N 2.86Å; T447-R450 VanDerWaalsContact O-N 3.1Å; M448-R450 PolarHBondContact O-N 2.95Å; R450-I452 VanDerWaalsContact C-N 3.31Å; R450-I452 PolarHBondContact O-N 3.27Å; R450-F453 PolarHBondContact O-N 3.15Å; R450-S959 PolarHBondContact NH2-OG 2.96Å
451	N	35.9	Very low	37.3	Very low	109 Å²	109	125.9 Å²	125.9	58%	0.583	61%	0.608	S	S	*	*	H	α-helix	trans	-73.6	-22.1	-179.1	-70.4	-10.8	0	0	0	113.2	T447 M448 F453 Y454 K455	T447-N451 PolarHBondContact O-N 3.05Å; M448-N451 PolarHBondContact O-N 2.73Å; M448-N451 VanDerWaalsContact O-N 3.11Å; N451-F453 VanDerWaalsContact C-N 3.32Å; N451-F453 PolarHBondContact O-N 3.3Å; N451-Y454 PolarHBondContact O-N 3.43Å; N451-K455 PolarHBondContact O-N 3.49Å
452	I	37.8	Very low	36.8	Very low	117 Å²	117	126.4 Å²	126.4	60%	0.6	61%	0.611	S	S	*	*	H	α-helix	trans	-66.1	-34.4	175.7	-62	174.5	0	0	0	111.2	R450	R450-I452 VanDerWaalsContact C-N 3.31Å; R450-I452 PolarHBondContact O-N 3.27Å
453	F	33.2	Very low	36.1	Very low	178 Å²	178	127.6 Å²	127.6	78%	0.781	62%	0.622	S	S	*	*	H	α-helix	trans	-75.9	-25.4	177.5	-97.1	-89.2	0	0	0	114.4	R450 N451	R450-F453 PolarHBondContact O-N 3.15Å; N451-F453 VanDerWaalsContact C-N 3.32Å; N451-F453 PolarHBondContact O-N 3.3Å
454	Y	33	Very low	35.6	Very low	121 Å²	121	130.2 Å²	130.2	48%	0.475	64%	0.636	S	S	.	*	H	α-helix	trans	-85.2	-10.2	175.8	-85.7	-91.1	0	0	0	113.7	N451 R456	N451-Y454 PolarHBondContact O-N 3.43Å; Y454-R456 VanDerWaalsContact C-N 3.34Å
455	K	35.5	Very low	35.1	Very low	175 Å²	175	132.2 Å²	132.2	76%	0.761	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89	6.7	179.7	-150.2	176.5	179.8	-178.2	0	114.2	N451	N451-K455 PolarHBondContact O-N 3.49Å
456	R	33.6	Very low	34.8	Very low	222 Å²	222	134.7 Å²	134.7	84%	0.838	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120	14.4	178	-152.4	177	-174.8	168.3	2.5	113.5	Y454	Y454-R456 VanDerWaalsContact C-N 3.34Å
457	S	35.2	Very low	34.3	Very low	75 Å²	75	135 Å²	135	52%	0.524	66%	0.664	S	S	.	*	S	Bend	trans	-127.9	29.1	175.8	66.4	0	0	0	0	111.3
458	K	36.5	Very low	34	Very low	180 Å²	180	137 Å²	137	78%	0.783	68%	0.676	S	S	*	*	S	Bend	trans	-118.7	-7.7	176.4	-154.4	172.8	-176.9	-178.2	0	112.8	S460	K458-S460 VanDerWaalsContact C-N 3.33Å
459	D	32.7	Very low	33.8	Very low	134 Å²	134	139.2 Å²	139.2	72%	0.717	69%	0.685	S	S	*	*	S	Bend	trans	-96.5	13.7	177.2	-40.9	-61	0	0	0	112
460	S	31.9	Very low	33.5	Very low	81 Å²	81	137.7 Å²	137.7	57%	0.566	68%	0.683	S	S	*	*	S	Bend	trans	-153	110	-179.5	61.5	0	0	0	0	109.9	K458	K458-S460 VanDerWaalsContact C-N 3.33Å
461	L	34	Very low	33.1	Very low	136 Å²	136	138.1 Å²	138.1	71%	0.712	70%	0.697	S	S	*	*			cis	-149.4	153.4	-3.8	-118.9	138.8	0	0	0	109.3	E463	L461-E463 PolarHBondContact O-N 2.93Å
462	N	35.2	Very low	32.6	Very low	137 Å²	137	136.9 Å²	136.9	73%	0.733	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.5	41.3	-166.9	-62.6	-19.8	0	0	0	114.6
463	E	31.7	Very low	32.2	Very low	158 Å²	158	140.2 Å²	140.2	74%	0.738	72%	0.72	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.8	-17.5	-172.4	-67	-172.3	134.5	0	0	114.8	L461	L461-E463 PolarHBondContact O-N 2.93Å
464	L	30	Very low	32	Very low	152 Å²	152	137.3 Å²	137.3	80%	0.796	72%	0.716	S	S	*	*	S	Bend	trans	-94.6	-6.7	-179.4	-142.3	72.5	0	0	0	114.3	Q466	L464-Q466 VanDerWaalsContact C-N 3.34Å; L464-Q466 PolarHBondContact O-N 3.45Å
465	D	32.4	Very low	31.7	Very low	122 Å²	122	141.3 Å²	141.3	65%	0.652	74%	0.736	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.4	-4	-173.4	-128.3	17.4	0	0	0	113.7
466	Q	33.2	Very low	31.4	Very low	159 Å²	159	140.7 Å²	140.7	74%	0.743	74%	0.736	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.4	-8.8	179.8	-64.6	-167.8	16.8	0	0	114.6	L464	L464-Q466 VanDerWaalsContact C-N 3.34Å; L464-Q466 PolarHBondContact O-N 3.45Å
467	V	31.1	Very low	31.1	Very low	114 Å²	114	136.7 Å²	136.7	69%	0.691	73%	0.732	S	S	*	*	S	Bend	trans	-98.5	-18.6	-172.8	-176.6	0	0	0	0	113.2
468	V	31.9	Very low	30.7	Very low	123 Å²	123	140 Å²	140	75%	0.745	74%	0.743	S	S	*	*	S	Bend	trans	-93	-16.6	-175.4	-175.6	0	0	0	0	112.9	S470	V468-S470 PolarHBondContact O-N 3.5Å
469	H	30.4	Very low	30.2	Very low	166 Å²	166	135 Å²	135	77%	0.769	73%	0.73	S	S	*	*	S	Bend	trans	-87.8	7.8	-172.7	-85.8	-65.3	0	0	0	116.1
470	S	30	Very low	29.9	Very low	81 Å²	81	131.6 Å²	131.6	57%	0.566	71%	0.712	S	S	*	*	S	Bend	trans	-139.6	59.6	-171	48.7	0	0	0	0	114.9	V468	V468-S470 PolarHBondContact O-N 3.5Å
471	N	29	Very low	29.8	Very low	160 Å²	160	133.7 Å²	133.7	86%	0.856	72%	0.716	S	S	*	*			trans	-172.5	57.6	136.9	-95.4	-29.5	0	0	0	114.2	K473	N471-K473 PolarHBondContact O-N 3.45Å; N471-K473 VanDerWaalsContact O-N 3.16Å
472	G	26.1	Very low	29.4	Very low	84 Å²	84	135.7 Å²	135.7	87%	0.866	72%	0.722	S	S	*	*			trans	-77.8	87.6	162.7	0	0	0	0	0	111.3
473	K	30	Very low	29	Very low	187 Å²	187	134 Å²	134	81%	0.813	72%	0.721	S	S	*	*			trans	-154.1	142.4	172.8	-122.8	172.1	-173.8	177.3	0	114.5	N471	N471-K473 PolarHBondContact O-N 3.45Å; N471-K473 VanDerWaalsContact O-N 3.16Å
474	V	29.9	Very low	28.8	Very low	116 Å²	116	136.6 Å²	136.6	70%	0.703	73%	0.73	S	S	*	*			trans	63.1	89.1	169	-165.4	0	0	0	0	116.5	Q476	V474-Q476 HydrophobicContact CG1-CB 4.22Å
475	K	26.5	Very low	28.6	Very low	205 Å²	205	134.7 Å²	134.7	89%	0.891	73%	0.728	S	S	*	*			trans	-71.9	121.7	135.5	-72.6	176.8	174.9	179	0	107.6
476	Q	27.5	Very low	28.2	Very low	162 Å²	162	137.3 Å²	137.3	76%	0.757	74%	0.738	S	S	*	*			trans	-173.3	162.3	150.4	-110.6	151.6	-18	0	0	112.1	V474	V474-Q476 HydrophobicContact CG1-CB 4.22Å
477	D	28.1	Very low	28	Very low	139 Å²	139	134.1 Å²	134.1	74%	0.743	73%	0.731	S	S	*	*			trans	71.5	63.7	158	-49.2	-18.9	0	0	0	120.6
478	L	27.1	Very low	27.8	Very low	144 Å²	144	137.8 Å²	137.8	75%	0.754	74%	0.738	S	S	*	*				29.5	105.9	120.5	-75.3	157.2	0	0	0	121
479	S	25.2	Very low	27.7	Very low	74 Å²	74	140 Å²	140	52%	0.517	74%	0.744	S	S	.	*				54.9	101.8	122.2	63.5	0	0	0	0	124.9	F68	F68-S479 CarbonylContact C-O 3.56Å; F68-S479 PolarHBondContact N-O 3.03Å; F68-S479 CarbonylContact O-C 3.56Å
480	L	27.6	Very low	27.4	Very low	64 Å²	64	139.9 Å²	139.9	34%	0.335	75%	0.749	S	S	.	*			trans	-168	163.4	145.3	-115.2	-172.3	0	0	0	121.2	T67 F68 C69	T67-L480 HydrophobicContact CG2-CD1 3.4Å; T67-L480 HydrophobicContact CG2-CD2 3.97Å; T67-L480 HydrophobicContact CG2-CG 4.06Å; F68-L480 VanDerWaalsContact N-CG 3.29Å; F68-L480 WeakPolarHBondContact O-CB 3.4Å; F68-L480 PolarHBondContact O-N 3.18Å; C69-L480 HydrophobicContact CB-CB 3.48Å; C69-L480 VanDerWaalsContact CB-CB 3.48Å; C69-L480 HydrophobicContact CB-CD1 4.09Å; C69-L480 HydrophobicContact CB-CG 4.44Å; C69-L480 PolarHBondContact SG-O 3.45Å
481	N	29.1	Very low	27.3	Very low	124 Å²	124	144.9 Å²	144.9	66%	0.663	76%	0.763	S	S	*	*			trans	80.1	101.1	141.5	-91.6	-16.5	0	0	0	118.7
482	E	25.7	Very low	27.2	Very low	179 Å²	179	146.4 Å²	146.4	84%	0.836	77%	0.766	S	S	*	*			trans	-70.7	-175.9	162.9	-48.8	-176.5	121.4	0	0	112.8
483	S	25.7	Very low	27.2	Very low	101 Å²	101	149 Å²	149	71%	0.706	76%	0.764	S	S	*	*			trans	73.9	73.1	159	76.7	0	0	0	0	118.3
484	K	29.2	Very low	27	Very low	212 Å²	212	148.3 Å²	148.3	92%	0.922	77%	0.766	S	S	*	*			trans	-167.3	156.3	131	-103.1	141.8	-166.5	164.4	0	113.5
485	C	26	Very low	26.8	Very low	112 Å²	112	150.6 Å²	150.6	76%	0.757	77%	0.774	S	S	*	*			trans	73.5	70.4	167.4	-133.3	0	0	0	0	118.6
486	M	22.4	Very low	26.8	Very low	177 Å²	177	146.9 Å²	146.9	87%	0.872	77%	0.769	S	S	*	*				-81.1	145.9	128.8	-85	-72.9	109.7	0	0	108.3
487	P	28.8	Very low	26.8	Very low	92 Å²	92	145 Å²	145	60%	0.597	77%	0.772	S	S	*	*				-150.8	150.3	110.9	36.1	-19	0	0	0	117
488	K	27.1	Very low	26.8	Very low	191 Å²	191	145.7 Å²	145.7	83%	0.83	78%	0.776	S	S	*	*			trans	60.2	101.3	147.1	-63.3	167.2	-177.2	179.6	0	118.9
489	I	30.5	Very low	26.8	Very low	171 Å²	171	146.9 Å²	146.9	88%	0.877	78%	0.782	S	S	*	*				-154.9	101.2	105.9	-92	148.9	0	0	0	106.5
490	N	24.3	Very low	27	Very low	162 Å²	162	150.3 Å²	150.3	87%	0.866	80%	0.795	S	S	*	*			trans	-162.5	88.1	178.7	-107.9	-18.4	0	0	0	107.7
491	Q	27.3	Very low	27	Very low	186 Å²	186	158.7 Å²	158.7	87%	0.869	82%	0.822	S	S	*	*			trans	-151.6	11.1	-172	-154.5	67.2	72.1	0	0	114.6
492	E	26.2	Very low	27	Very low	193 Å²	193	159.6 Å²	159.6	90%	0.902	83%	0.826	S	S	*	*	S	Bend	trans	-128.9	-2.6	-170.1	-107	172.9	-171.6	0	0	116.5
493	V	27.2	Very low	27.1	Very low	138 Å²	138	156.3 Å²	156.3	84%	0.836	82%	0.82	S	S	*	*	S	Bend	trans	-129.7	59.8	178.8	-164.1	0	0	0	0	111.1
494	M	25.2	Very low	27.2	Very low	173 Å²	173	160 Å²	160	85%	0.852	83%	0.831	S	S	*	*			trans	-135.7	7.2	-178.3	-96.8	-69.9	173.4	0	0	115
495	N	27	Very low	27.3	Very low	164 Å²	164	156 Å²	156	88%	0.877	82%	0.824	S	S	*	*	S	Bend	trans	-127.5	42.5	-172.3	-79	-21.4	0	0	0	114.2
496	T	25.9	Very low	27.6	Very low	126 Å²	126	157.2 Å²	157.2	77%	0.773	82%	0.823	S	S	*	*	S	Bend	trans	-150.1	132.6	163.5	48.5	0	0	0	0	112.1
497	C	28	Very low	28.2	Very low	123 Å²	123	152.7 Å²	152.7	83%	0.831	81%	0.807	S	S	*	*			trans	75	118.8	169.7	-55.7	0	0	0	0	117.5
498	D	26.2	Very low	28.6	Very low	154 Å²	154	156.3 Å²	156.3	82%	0.824	82%	0.815	S	S	*	*			trans	-68.1	132.8	-179.7	-72.6	-84.4	0	0	0	114.7
499	L	28.4	Very low	29.1	Very low	168 Å²	168	152.6 Å²	152.6	88%	0.88	81%	0.805	S	S	*	*			trans	-104.7	14.3	175.1	-95.2	160.6	0	0	0	113.8	R501	L499-R501 PolarHBondContact O-N 3.33Å
500	N	28.2	Very low	29.6	Very low	147 Å²	147	152.3 Å²	152.3	79%	0.786	79%	0.793	S	S	*	*			trans	-95.1	22	-169.8	-71.1	-43.9	0	0	0	115.5
501	R	28.5	Very low	30.2	Very low	239 Å²	239	147.7 Å²	147.7	90%	0.902	77%	0.773	S	S	*	*			trans	-146.4	83	175.8	-76.3	-166.7	172.9	-155.5	-1.1	114	L499	L499-R501 PolarHBondContact O-N 3.33Å
502	L	28.8	Very low	30.9	Very low	143 Å²	143	143.1 Å²	143.1	75%	0.749	76%	0.755	S	S	*	*	S	Bend	trans	-166.9	144.9	147.7	-102.4	159.7	0	0	0	108.7
503	P	27.7	Very low	31.4	Very low	111 Å²	111	139.3 Å²	139.3	72%	0.721	74%	0.74	S	S	*	*			trans	-76.2	137.9	-168.4	-18.4	33	0	0	0	115.5	T505	P503-T505 PolarHBondContact O-N 3.35Å
504	L	27.6	Very low	31.9	Very low	178 Å²	178	137.9 Å²	137.9	93%	0.932	73%	0.727	S	S	*	*			trans	-89.3	70.9	173.6	-81.4	163.4	0	0	0	112.3
505	T	31.8	Very low	32.6	Very low	127 Å²	127	135.9 Å²	135.9	78%	0.779	71%	0.714	S	S	*	*			trans	-146.5	113.3	162.2	43.5	0	0	0	0	110.4	P503	P503-T505 PolarHBondContact O-N 3.35Å
506	L	33.4	Very low	33.2	Very low	139 Å²	139	131.9 Å²	131.9	73%	0.728	70%	0.695	S	S	*	*			trans	-110.4	121.8	175	-153.1	155.9	0	0	0	108	W510	L506-W510 HydrophobicContact CD2-CB 4.49Å; L506-W510 HydrophobicContact CD2-CG 4.1Å
507	P	33.7	Very low	33.4	Very low	81 Å²	81	128.8 Å²	128.8	53%	0.526	68%	0.682	S	S	.	*			trans	-61.2	142	-169.7	-27.3	35.6	0	0	0	114.8	D509 W510	P507-D509 PolarHBondContact O-N 3.33Å; P507-D509 VanDerWaalsContact O-N 3.1Å; P507-W510 PolarHBondContact O-N 3.32Å
508	E	37.4	Very low	33.8	Very low	168 Å²	168	129 Å²	129	79%	0.785	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.5	-18.3	-174.3	-64.1	176	110.3	0	0	113.7	W510 S511	E508-W510 PolarHBondContact O-N 2.9Å; E508-S511 WeakPolarHBondContact O-CB 3.19Å; E508-S511 PolarHBondContact O-N 3.35Å; E508-S511 PolarHBondContact O-OG 2.75Å
509	D	39	Very low	34.3	Very low	113 Å²	113	125.8 Å²	125.8	60%	0.604	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.3	-30.1	179.3	-62	-54.3	0	0	0	114.3	P507 S511 N512 L513	P507-D509 PolarHBondContact O-N 3.33Å; P507-D509 VanDerWaalsContact O-N 3.1Å; D509-S511 PolarHBondContact O-N 2.89Å; D509-N512 PolarHBondContact O-N 2.88Å; D509-L513 PolarHBondContact O-N 3.24Å
510	W	39.4	Very low	34.4	Very low	165 Å²	165	124.5 Å²	124.5	63%	0.625	65%	0.654	S	S	*	*	H	α-helix	trans	-62	-28.3	177.4	-77.3	79.1	0	0	0	112.5	L506 P507 E508 N512 L513 L514	L506-W510 HydrophobicContact CD2-CB 4.49Å; L506-W510 HydrophobicContact CD2-CG 4.1Å; P507-W510 PolarHBondContact O-N 3.32Å; E508-W510 PolarHBondContact O-N 2.9Å; W510-N512 PolarHBondContact O-N 3.46Å; W510-L513 PolarHBondContact O-N 3.48Å; W510-L514 PolarHBondContact O-N 2.92Å
511	S	38	Very low	34.5	Very low	66 Å²	66	123.2 Å²	123.2	46%	0.462	65%	0.646	S	S	.	*	H	α-helix	trans	-61.9	-30.5	174.5	-39.6	0	0	0	0	112.8	E508 D509 K515	E508-S511 WeakPolarHBondContact O-CB 3.19Å; E508-S511 PolarHBondContact O-N 3.35Å; E508-S511 PolarHBondContact O-OG 2.75Å; D509-S511 PolarHBondContact O-N 2.89Å; S511-K515 WeakPolarHBondContact O-CG 3.48Å
512	N	41	Very low	34.5	Very low	90 Å²	90	117.2 Å²	117.2	48%	0.481	64%	0.639	S	S	.	*	H	α-helix	trans	-86.5	-34.1	-176.4	-64.2	-35.7	0	0	0	111.1	D509 W510 L514 K515 V516	D509-N512 PolarHBondContact O-N 2.88Å; W510-N512 PolarHBondContact O-N 3.46Å; N512-L514 PolarHBondContact O-N 3.3Å; N512-K515 PolarHBondContact O-N 3.35Å; N512-V516 WeakPolarHBondContact O-CG2 3.38Å; N512-V516 PolarHBondContact O-N 2.95Å
513	L	36.8	Very low	34.5	Very low	112 Å²	112	116.2 Å²	116.2	59%	0.586	63%	0.633	S	S	*	*	H	α-helix	trans	-63.6	-37.6	175.3	-77.5	169.2	0	0	0	113.1	D509 W510 V516 A517	D509-L513 PolarHBondContact O-N 3.24Å; W510-L513 PolarHBondContact O-N 3.48Å; L513-V516 PolarHBondContact O-N 2.85Å; L513-A517 PolarHBondContact O-N 3.04Å
514	L	37.7	Very low	34.6	Very low	108 Å²	108	117.3 Å²	117.3	57%	0.565	64%	0.637	S	S	*	*	H	α-helix	trans	-64.7	-44.3	172.7	-91.9	80.2	0	0	0	111.9	W510 N512 V516 A517 E518	W510-L514 PolarHBondContact O-N 2.92Å; N512-L514 PolarHBondContact O-N 3.3Å; L514-V516 VanDerWaalsContact C-N 3.26Å; L514-V516 PolarHBondContact O-N 3.03Å; L514-A517 WeakPolarHBondContact O-CB 3.3Å; L514-A517 PolarHBondContact O-N 2.81Å; L514-E518 WeakPolarHBondContact O-CG 3.22Å; L514-E518 PolarHBondContact O-N 2.77Å
515	K	40	Very low	34.7	Very low	131 Å²	131	117 Å²	117	57%	0.57	63%	0.628	S	S	*	*	H	α-helix	trans	-62.2	-32.8	177.3	-68.8	171.8	-175.9	170.4	0	112.7	S511 N512 S519	S511-K515 WeakPolarHBondContact O-CG 3.48Å; N512-K515 PolarHBondContact O-N 3.35Å; K515-S519 WeakPolarHBondContact O-CB 3.46Å; K515-S519 PolarHBondContact O-N 2.93Å; K515-S519 PolarHBondContact O-OG 3.43Å
516	V	39.4	Very low	34.6	Very low	80 Å²	80	117 Å²	117	49%	0.485	63%	0.63	S	S	.	*	H	α-helix	trans	-72.2	-37.8	172.7	172.9	0	0	0	0	111.5	N512 L513 L514 S519 L520	N512-V516 WeakPolarHBondContact O-CG2 3.38Å; N512-V516 PolarHBondContact O-N 2.95Å; L513-V516 PolarHBondContact O-N 2.85Å; L514-V516 VanDerWaalsContact C-N 3.26Å; L514-V516 PolarHBondContact O-N 3.03Å; V516-S519 WeakPolarHBondContact CA-OG 3.49Å; V516-S519 PolarHBondContact O-OG 3.25Å; V516-L520 HydrophobicContact CG1-CD1 4.24Å; V516-L520 WeakPolarHBondContact O-CG 3.48Å; V516-L520 PolarHBondContact O-N 2.78Å
517	A	31.5	Very low	34.3	Very low	62 Å²	62	115.7 Å²	115.7	51%	0.512	63%	0.633	S	S	.	*	H	α-helix	trans	-66.7	-40.9	174.5	0	0	0	0	0	112.6	L513 L514 S519 L520	L513-A517 PolarHBondContact O-N 3.04Å; L514-A517 WeakPolarHBondContact O-CB 3.3Å; L514-A517 PolarHBondContact O-N 2.81Å; A517-S519 VanDerWaalsContact C-N 3.34Å; A517-S519 PolarHBondContact O-N 3.43Å; A517-L520 PolarHBondContact O-N 3.45Å
518	E	35.5	Very low	34.2	Very low	128 Å²	128	120 Å²	120	60%	0.598	65%	0.65	S	S	*	*	H	α-helix	trans	-68	-30.4	177.9	-71.6	-179.4	151.2	0	0	113.2	L514	L514-E518 WeakPolarHBondContact O-CG 3.22Å; L514-E518 PolarHBondContact O-N 2.77Å
519	S	36.6	Very low	33.9	Very low	86 Å²	86	119.7 Å²	119.7	60%	0.601	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.5	-4.1	179.6	49.2	0	0	0	0	114.7	K515 V516 A517	K515-S519 WeakPolarHBondContact O-CB 3.46Å; K515-S519 PolarHBondContact O-N 2.93Å; K515-S519 PolarHBondContact O-OG 3.43Å; V516-S519 WeakPolarHBondContact CA-OG 3.49Å; V516-S519 PolarHBondContact O-OG 3.25Å; A517-S519 VanDerWaalsContact C-N 3.34Å; A517-S519 PolarHBondContact O-N 3.43Å
520	L	31.4	Very low	33.5	Very low	141 Å²	141	117 Å²	117	74%	0.738	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.7	0.1	175.1	-69	172.5	0	0	0	114	V516 A517	V516-L520 HydrophobicContact CG1-CD1 4.24Å; V516-L520 WeakPolarHBondContact O-CG 3.48Å; V516-L520 PolarHBondContact O-N 2.78Å; A517-L520 PolarHBondContact O-N 3.45Å
521	L	30.3	Very low	33	Very low	119 Å²	119	115.9 Å²	115.9	62%	0.623	67%	0.665	S	S	*	*	S	Bend	trans	-79.5	133.5	170.4	-83.6	158.6	0	0	0	110.8	I523	L521-I523 PolarHBondContact O-N 3.18Å
522	P	28.3	Very low	32.7	Very low	114 Å²	114	117.8 Å²	117.8	74%	0.74	68%	0.678	S	S	*	*			trans	-72.3	96.2	179.3	28.5	-33.9	0	0	0	111.3	V524	P522-V524 VanDerWaalsContact C-N 3.34Å; P522-V524 PolarHBondContact O-N 3.43Å
523	I	28.6	Very low	32.3	Very low	122 Å²	122	120.5 Å²	120.5	63%	0.626	69%	0.693	S	S	*	*			trans	-70.8	85.2	179.3	-58.3	178.2	0	0	0	110.5	L521 K525	L521-I523 PolarHBondContact O-N 3.18Å; I523-K525 VanDerWaalsContact C-N 3.31Å; I523-K525 HydrophobicContact CG2-CB 4.48Å; I523-K525 HydrophobicContact CG2-CD 3.88Å; I523-K525 HydrophobicContact CG2-CG 3.71Å; I523-K525 PolarHBondContact O-N 3.33Å
524	V	28.2	Very low	31.9	Very low	134 Å²	134	120.8 Å²	120.8	81%	0.812	70%	0.702	S	S	*	*			trans	-78.1	82.7	166.5	-175.6	0	0	0	0	108.8	P522 P526	P522-V524 VanDerWaalsContact C-N 3.34Å; P522-V524 PolarHBondContact O-N 3.43Å; V524-P526 VanDerWaalsContact O-CD 3.29Å; V524-P526 WeakPolarHBondContact O-CD 3.32Å
525	K	31	Very low	31.7	Very low	171 Å²	171	123.3 Å²	123.3	74%	0.743	72%	0.715	S	S	*	*			trans	-77.4	114.1	167.9	-88.1	167.6	-179.5	177.3	0	109.6	I523 S527	I523-K525 VanDerWaalsContact C-N 3.31Å; I523-K525 HydrophobicContact CG2-CB 4.48Å; I523-K525 HydrophobicContact CG2-CD 3.88Å; I523-K525 HydrophobicContact CG2-CG 3.71Å; I523-K525 PolarHBondContact O-N 3.33Å; K525-S527 PolarHBondContact O-N 3.04Å
526	P	28.9	Very low	31.3	Very low	126 Å²	126	124 Å²	124	82%	0.818	73%	0.725	S	S	*	*			trans	-73.7	107.7	170.6	30.1	-32.5	0	0	0	109.5	V524 L528	V524-P526 VanDerWaalsContact O-CD 3.29Å; V524-P526 WeakPolarHBondContact O-CD 3.32Å; P526-L528 PolarHBondContact O-N 3.11Å
527	S	27.1	Very low	30.7	Very low	113 Å²	113	130.5 Å²	130.5	79%	0.79	74%	0.742	S	S	*	*			trans	-80	111.4	174.5	56.7	0	0	0	0	110.8	K525	K525-S527 PolarHBondContact O-N 3.04Å
528	L	31	Very low	30.7	Very low	170 Å²	170	133.5 Å²	133.5	89%	0.89	76%	0.759	S	S	*	*			trans	-150.4	108.6	160.4	-145.4	75.8	0	0	0	111.1	P526	P526-L528 PolarHBondContact O-N 3.11Å
529	N	32.5	Very low	30.4	Very low	162 Å²	162	132.8 Å²	132.8	87%	0.866	76%	0.764	S	S	*	*			trans	-64.9	142.8	157.9	-61.7	-17.5	0	0	0	107
530	G	29.1	Very low	30.2	Very low	58 Å²	58	136.9 Å²	136.9	60%	0.598	77%	0.773	S	S	*	*				96.3	66.4	53.5	0	0	0	0	0	108.3
531	T	29.2	Very low	30.2	Very low	141 Å²	141	134.6 Å²	134.6	87%	0.865	77%	0.769	S	S	*	*				88	85.7	91.3	51.7	0	0	0	0	114.9
532	S	32.1	Very low	30.1	Very low	105 Å²	105	135.8 Å²	135.8	73%	0.734	78%	0.776	S	S	*	*			trans	-178.4	146.5	150.9	48	0	0	0	0	108.3
533	D	32.1	Very low	30.4	Very low	148 Å²	148	141.3 Å²	141.3	79%	0.791	78%	0.782	S	S	*	*			cis	-144.9	154.9	-23.1	-87.4	-44.1	0	0	0	108.5
534	P	30	Very low	30.5	Very low	118 Å²	118	142.9 Å²	142.9	77%	0.766	79%	0.786	S	S	*	*			trans	-96.9	102.1	176.4	34.6	-29	0	0	0	112.5
535	L	32.3	Very low	30.6	Very low	160 Å²	160	142.8 Å²	142.8	84%	0.838	78%	0.781	S	S	*	*			trans	175	129.6	157.4	-93	154.5	0	0	0	104.4
536	D	32.6	Very low	30.4	Very low	146 Å²	146	140.6 Å²	140.6	78%	0.781	78%	0.784	S	S	*	*				-155.3	172.5	52.5	-148.7	-19.5	0	0	0	113.1
537	Y	26.1	Very low	30.5	Very low	217 Å²	217	142.3 Å²	142.3	85%	0.851	78%	0.783	S	S	*	*			trans	-92.6	128.8	175.5	-91.9	-107.5	0	0	0	112.2
538	S	32.3	Very low	30.5	Very low	125 Å²	125	145.8 Å²	145.8	87%	0.874	79%	0.787	S	S	*	*			trans	-165.9	148.9	134.3	-92.4	0	0	0	0	115.6
539	T	27.8	Very low	30.6	Very low	112 Å²	112	144.2 Å²	144.2	69%	0.687	78%	0.778	S	S	*	*			trans	-70.9	145.8	176.1	41.8	0	0	0	0	113.6
540	H	34.3	Very low	30.3	Very low	172 Å²	172	141.5 Å²	141.5	80%	0.796	77%	0.772	S	S	*	*				160.6	104.2	124.9	-80.4	-58	0	0	0	108.9
541	S	30.1	Very low	30.6	Very low	93 Å²	93	146 Å²	146	65%	0.65	78%	0.781	S	S	*	*				84.7	95.4	81.8	178.1	0	0	0	0	114.7
542	N	28.8	Very low	30.5	Very low	144 Å²	144	147 Å²	147	77%	0.77	78%	0.775	S	S	*	*			trans	44	117.6	144.2	-58.1	-46.9	0	0	0	119.8
543	R	33.3	Very low	30.3	Very low	231 Å²	231	149 Å²	149	87%	0.872	78%	0.778	S	S	*	*				-174.4	162.1	97	-99.3	173.9	179.5	177	0.9	114.4
544	H	30.8	Very low	30.2	Very low	155 Å²	155	147 Å²	147	72%	0.718	78%	0.775	S	S	*	*			trans	-17	153.8	154.3	-59.1	-63.1	0	0	0	118
545	N	30.8	Very low	30.5	Very low	132 Å²	132	147.6 Å²	147.6	71%	0.706	78%	0.779	S	S	*	*			cis	-161	162	-2.7	-109.7	1.1	0	0	0	108.4
546	P	27.2	Very low	30.4	Very low	125 Å²	125	145.4 Å²	145.4	81%	0.812	77%	0.774	S	S	*	*			trans	-73.8	143	168.4	32.4	-34	0	0	0	111.2
547	M	31.9	Very low	30.1	Very low	161 Å²	161	146.5 Å²	146.5	79%	0.793	78%	0.78	S	S	*	*			trans	-144.6	110.4	162.6	-172.9	170.3	-176.6	0	0	109.2	I549	M547-I549 HydrophobicContact CE-CD1 4.05Å; M547-I549 HydrophobicContact CE-CG1 4.21Å; M547-I549 HydrophobicContact CG-CG1 4.34Å
548	E	26.7	Very low	30.3	Very low	186 Å²	186	140.9 Å²	140.9	87%	0.869	77%	0.772	S	S	*	*			trans	-74.6	127.6	170.4	-64.2	175.8	123.8	0	0	109.2
549	I	33.7	Very low	30.3	Very low	138 Å²	138	143.3 Å²	143.3	71%	0.708	77%	0.77	S	S	*	*			trans	-128.7	95.4	160.4	-58.4	-177.5	0	0	0	107.4	M547	M547-I549 HydrophobicContact CE-CD1 4.05Å; M547-I549 HydrophobicContact CE-CG1 4.21Å; M547-I549 HydrophobicContact CG-CG1 4.34Å
550	S	25.9	Very low	30.5	Very low	105 Å²	105	143.6 Å²	143.6	73%	0.734	77%	0.774	S	S	*	*			trans	-68.2	129.6	167.1	-55.7	0	0	0	0	109.8
551	I	33.8	Very low	30.2	Very low	152 Å²	152	140.5 Å²	140.5	78%	0.779	77%	0.767	S	S	*	*			trans	-165.5	109.8	146.2	-101.9	148.1	0	0	0	110.9
552	Q	29.1	Very low	30.3	Very low	161 Å²	161	146.4 Å²	146.4	75%	0.752	78%	0.776	S	S	*	*			trans	36.4	130.6	136.6	-76	-179.7	-20.4	0	0	123.6
553	L	27.6	Very low	30.2	Very low	149 Å²	149	144.9 Å²	144.9	78%	0.78	77%	0.772	S	S	*	*			trans	82.4	143.3	132	-68.2	167.2	0	0	0	121.5
554	S	29.7	Very low	30.1	Very low	106 Å²	106	138.1 Å²	138.1	74%	0.741	76%	0.76	S	S	*	*			trans	85	116.9	163.7	-46.8	0	0	0	0	118.1
555	P	35.6	Very low	30	Very low	129 Å²	129	137.3 Å²	137.3	84%	0.838	76%	0.761	S	S	*	*			trans	-87.6	141.8	163.4	35	-31.2	0	0	0	111.5
556	P	31.1	Very low	30.1	Very low	115 Å²	115	138.3 Å²	138.3	75%	0.747	77%	0.765	S	S	*	*			trans	-117.7	123.7	161.1	32.9	-20.9	0	0	0	112.1
557	N	26.4	Very low	30.4	Very low	169 Å²	169	136.9 Å²	136.9	90%	0.904	76%	0.758	S	S	*	*			trans	-85.4	108.1	165.3	170.9	32.3	0	0	0	109.2
558	S	28.8	Very low	30.6	Very low	98 Å²	98	134.2 Å²	134.2	69%	0.685	75%	0.751	S	S	*	*			trans	-164.7	140.5	167.1	46.4	0	0	0	0	114
559	Q	32.5	Very low	30.9	Very low	176 Å²	176	133.3 Å²	133.3	82%	0.822	75%	0.747	S	S	*	*			trans	-88.9	156.1	162.7	-65.9	178.5	-21.7	0	0	110.6
560	P	32.8	Very low	30.9	Very low	119 Å²	119	131.9 Å²	131.9	77%	0.773	75%	0.749	S	S	*	*			trans	-112	118.7	135.1	31.6	-23.1	0	0	0	108.9
561	V	27.1	Very low	31.3	Very low	107 Å²	107	134 Å²	134	65%	0.648	75%	0.751	S	S	*	*				64.1	101.4	71.8	178.3	0	0	0	0	112.6
562	Y	32	Very low	31.2	Very low	217 Å²	217	133.2 Å²	133.2	85%	0.851	75%	0.748	S	S	*	*			trans	170.1	127.1	142.8	-86.4	-60.9	0	0	0	107.1
563	T	27.4	Very low	31.3	Very low	112 Å²	112	130.2 Å²	130.2	69%	0.687	75%	0.745	S	S	*	*			cis	-165.7	174.8	-17	-0.6	0	0	0	0	107.8
564	S	30.9	Very low	31.5	Very low	89 Å²	89	127.1 Å²	127.1	62%	0.622	74%	0.736	S	S	*	*			trans	61.6	98.3	153.1	58.5	0	0	0	0	120.3
565	N	30.2	Very low	31.6	Very low	138 Å²	138	129.2 Å²	129.2	74%	0.738	74%	0.739	S	S	*	*				90.2	137.2	109.7	-67.4	-4.1	0	0	0	121.5
566	I	32.9	Very low	31.4	Very low	152 Å²	152	127.7 Å²	127.7	78%	0.779	73%	0.727	S	S	*	*			trans	66.6	130.1	140.6	-68.9	166.5	0	0	0	115.2
567	S	32.8	Very low	31.3	Very low	95 Å²	95	130 Å²	130	66%	0.664	73%	0.728	S	S	*	*			cis	-179.3	174.1	-2.1	-95.8	0	0	0	0	105.6
568	T	35.2	Very low	31.3	Very low	105 Å²	105	125.9 Å²	125.9	64%	0.644	72%	0.717	S	S	*	*			cis	-154.7	155.3	-0.7	2.6	0	0	0	0	108.1
569	E	34.3	Very low	31.3	Very low	167 Å²	167	126.7 Å²	126.7	78%	0.78	72%	0.718	S	S	*	*			trans	55.3	134.8	140.1	-70.8	162.3	170.1	0	0	123.3
570	S	33.7	Very low	31	Very low	109 Å²	109	124.8 Å²	124.8	76%	0.762	71%	0.713	S	S	*	*				101.2	137.4	128.3	73.8	0	0	0	0	120.4
571	L	32.8	Very low	30.7	Very low	149 Å²	149	124.5 Å²	124.5	78%	0.78	71%	0.713	S	S	*	*			cis	-159.8	166.3	-21	-112.7	-176.3	0	0	0	109.5
572	L	32	Very low	30.8	Very low	135 Å²	135	123.7 Å²	123.7	71%	0.707	71%	0.712	S	S	*	*			trans	59.7	105.2	151.5	-69.1	164.6	0	0	0	119.1
573	S	31.6	Very low	30.8	Very low	98 Å²	98	117.5 Å²	117.5	69%	0.685	70%	0.7	S	S	*	*				81.6	157.6	114.2	-71.2	0	0	0	0	121.3
574	S	31.4	Very low	31.2	Very low	85 Å²	85	120.8 Å²	120.8	59%	0.594	71%	0.705	S	S	*	*			cis	179.9	164.7	-26.1	-92.2	0	0	0	0	106.7
575	D	31.6	Very low	31.2	Very low	149 Å²	149	124.2 Å²	124.2	80%	0.797	71%	0.711	S	S	*	*			trans	68	155.4	147.8	-66	-27.5	0	0	0	116.7
576	V	31.3	Very low	31.6	Very low	98 Å²	98	121.5 Å²	121.5	59%	0.594	70%	0.702	S	S	*	*			cis	-151.8	154.4	-4	102.4	0	0	0	0	110.8
577	Q	29.9	Very low	31.6	Very low	163 Å²	163	122.9 Å²	122.9	76%	0.762	70%	0.702	S	S	*	*			trans	24.9	126.9	152.8	-60.4	150.9	23.1	0	0	119.1
578	A	27	Very low	31.6	Very low	82 Å²	82	122.3 Å²	122.3	68%	0.678	70%	0.698	S	S	*	*				52.9	133.5	89.2	0	0	0	0	0	114.3
579	T	27.3	Very low	31.3	Very low	115 Å²	115	121.1 Å²	121.1	71%	0.706	69%	0.694	S	S	*	*				-175.8	170.3	74.3	37.4	0	0	0	0	112.1
580	N	27.5	Very low	31.1	Very low	136 Å²	136	121.6 Å²	121.6	73%	0.727	69%	0.694	S	S	*	*			trans	69.3	125.8	143.5	-71.6	-10.4	0	0	0	122
581	C	26.8	Very low	30.8	Very low	114 Å²	114	121.4 Å²	121.4	77%	0.77	69%	0.688	S	S	*	*			trans	73.5	148.3	133.5	-66.1	0	0	0	0	119.8
582	S	29.1	Very low	30.5	Very low	89 Å²	89	119.1 Å²	119.1	62%	0.622	69%	0.685	S	S	*	*			cis	-172.2	142.8	-17.6	47.8	0	0	0	0	110.6
583	S	31.8	Very low	30.2	Very low	87 Å²	87	117 Å²	117	61%	0.608	68%	0.681	S	S	*	*			trans	57.8	168	156.7	61.4	0	0	0	0	117.2
584	F	34.3	Very low	30	Very low	181 Å²	181	119 Å²	119	79%	0.794	68%	0.684	S	S	*	*			cis	-111.3	135.6	-8.9	-81.7	-95.8	0	0	0	108.8
585	H	32.4	Very low	29.7	Very low	161 Å²	161	122 Å²	122	75%	0.745	69%	0.693	S	S	*	*				78	159.2	74.8	-108.2	-31.5	0	0	0	113.2
586	P	38.5	Very low	29.4	Very low	82 Å²	82	121.4 Å²	121.4	53%	0.532	69%	0.69	S	S	.	*				-113.2	-165.5	-121.9	42.3	-26.7	0	0	0	111.8
587	F	33.4	Very low	29.3	Very low	181 Å²	181	123.2 Å²	123.2	79%	0.794	70%	0.695	S	S	*	*				-157.2	119.8	74.4	-94.2	-86.9	0	0	0	108.1
588	S	30.9	Very low	29.1	Very low	82 Å²	82	121.9 Å²	121.9	57%	0.573	69%	0.693	S	S	*	*				76.7	113.9	92	85.9	0	0	0	0	112.8
589	S	30.7	Very low	29	Very low	80 Å²	80	126.8 Å²	126.8	56%	0.559	70%	0.695	S	S	*	*				99	161.3	80.5	69.7	0	0	0	0	111.5
590	F	30.2	Very low	29	Very low	177 Å²	177	129.7 Å²	129.7	78%	0.776	70%	0.698	S	S	*	*			cis	-122	127.7	-4.6	-84.1	-76.8	0	0	0	106.9
591	T	26.9	Very low	29	Very low	105 Å²	105	131.8 Å²	131.8	64%	0.644	70%	0.7	S	S	*	*				46.3	145.1	96.9	76.3	0	0	0	0	116.3
592	S	26.4	Very low	29.1	Very low	102 Å²	102	130.2 Å²	130.2	71%	0.713	69%	0.691	S	S	*	*			trans	61.6	141.3	141.4	59.7	0	0	0	0	120.8
593	S	26.2	Very low	29	Very low	90 Å²	90	134.7 Å²	134.7	63%	0.629	70%	0.699	S	S	*	*			cis	-178.2	170.3	-12.1	52.8	0	0	0	0	109.3
594	N	25.7	Very low	28.9	Very low	139 Å²	139	136.3 Å²	136.3	74%	0.743	71%	0.706	S	S	*	*			trans	66.2	145.3	141.6	-71.3	-16.2	0	0	0	121.1
595	L	26.1	Very low	28.9	Very low	148 Å²	148	133.3 Å²	133.3	78%	0.775	71%	0.705	S	S	*	*			trans	66.5	111	157.5	-62.4	158.4	0	0	0	115.4
596	N	25.7	Very low	28.8	Very low	137 Å²	137	133.9 Å²	133.9	73%	0.733	71%	0.71	S	S	*	*				74.9	161.6	71.8	-166.8	15.6	0	0	0	112.2
597	I	27.9	Very low	28.3	Very low	137 Å²	137	135.2 Å²	135.2	70%	0.703	72%	0.716	S	S	*	*			trans	82.6	87.8	178.7	-47.7	170.9	0	0	0	114.9
598	N	25.5	Very low	28.3	Very low	134 Å²	134	137.3 Å²	137.3	72%	0.717	72%	0.721	S	S	*	*				48.7	151.4	118.1	-86.1	-38.8	0	0	0	123.5
599	Y	26.2	Very low	28.2	Very low	185 Å²	185	142.9 Å²	142.9	73%	0.725	73%	0.734	S	S	*	*			trans	83.3	103.2	155.3	-69.7	-57	0	0	0	121.5
600	K	26.2	Very low	28.1	Very low	177 Å²	177	144.2 Å²	144.2	77%	0.77	74%	0.744	S	S	*	*				58.8	141.3	119.6	-83.4	-179.2	-179.9	168.3	0	121.5
601	K	28.4	Very low	28.2	Very low	179 Å²	179	140.5 Å²	140.5	78%	0.778	74%	0.74	S	S	*	*			trans	90.7	92.5	137.3	-90.8	-171.8	171.4	-170.3	0	121
602	S	27.7	Very low	28.3	Very low	82 Å²	82	144.1 Å²	144.1	57%	0.573	75%	0.749	S	S	*	*				72.9	164	111	61	0	0	0	0	122.1
603	F	27.9	Very low	28.6	Very low	183 Å²	183	144.6 Å²	144.6	80%	0.803	75%	0.753	S	S	*	*			trans	76.2	136.8	175.1	-63	-91.7	0	0	0	115.5
604	T	30.1	Very low	28.8	Very low	121 Å²	121	145.4 Å²	145.4	74%	0.742	75%	0.754	S	S	*	*			cis	-161	160.9	-11.6	2.9	0	0	0	0	110.8
605	P	33.2	Very low	29	Very low	118 Å²	118	145.6 Å²	145.6	77%	0.766	76%	0.755	S	S	*	*			trans	-105.1	168.9	172.6	39.4	-32	0	0	0	114.6
606	M	31.5	Very low	29	Very low	173 Å²	173	143.1 Å²	143.1	85%	0.852	75%	0.75	S	S	*	*			trans	-139.5	123.7	165.1	-90.5	-168.5	164.2	0	0	108.4
607	T	27.6	Very low	29.2	Very low	109 Å²	109	144.1 Å²	144.1	67%	0.669	76%	0.755	S	S	*	*				51	122.9	89.6	62.1	0	0	0	0	113.5
608	Y	32.9	Very low	29.5	Very low	226 Å²	226	142.6 Å²	142.6	89%	0.886	75%	0.754	S	S	*	*				-137.9	168.9	57.8	-99.7	-99.3	0	0	0	116.3
609	K	28.6	Very low	29.5	Very low	198 Å²	198	144 Å²	144	86%	0.861	76%	0.761	S	S	*	*			trans	-112.4	151.8	166.4	-70.5	-177.2	173.8	-172.6	0	110.6
610	S	29.4	Very low	29.5	Very low	108 Å²	108	139.5 Å²	139.5	76%	0.755	76%	0.756	S	S	*	*			trans	-161.5	131.2	138.9	50.9	0	0	0	0	113.2
611	S	31.7	Very low	29.5	Very low	100 Å²	100	135.8 Å²	135.8	70%	0.699	75%	0.752	S	S	*	*			trans	38.6	118.4	151.8	55	0	0	0	0	119.9
612	E	30.5	Very low	29.4	Very low	180 Å²	180	134.8 Å²	134.8	84%	0.841	75%	0.754	S	S	*	*			cis	67.5	102.6	47.2	-56.8	-173	138.4	0	0	116.4
613	S	32	Very low	29.5	Very low	112 Å²	112	137.3 Å²	137.3	78%	0.783	77%	0.766	S	S	*	*				-169.8	99.4	127.1	13.8	0	0	0	0	107.7
614	T	29.2	Very low	29.7	Very low	108 Å²	108	137 Å²	137	66%	0.663	77%	0.766	S	S	*	*				74.8	146.7	72.4	62.7	0	0	0	0	114.8
615	N	31.5	Very low	30	Very low	142 Å²	142	136.2 Å²	136.2	76%	0.759	76%	0.763	S	S	*	*			trans	74.1	113.7	176.2	-49.8	-24.5	0	0	0	115
616	S	26.5	Very low	29.9	Very low	97 Å²	97	139.2 Å²	139.2	68%	0.678	77%	0.767	S	S	*	*			cis	62.2	124.8	12.6	119.1	0	0	0	0	112.9
617	L	28.4	Very low	29.7	Very low	157 Å²	157	136.1 Å²	136.1	82%	0.822	76%	0.761	S	S	*	*			cis	-146.4	169.8	20.4	-91.4	153	0	0	0	110.3
618	P	34.2	Very low	29.8	Very low	106 Å²	106	141.1 Å²	141.1	69%	0.688	77%	0.774	S	S	*	*			trans	-85	162.1	178.4	36.3	-36.2	0	0	0	112.9
619	L	26.3	Very low	29.5	Very low	164 Å²	164	134.7 Å²	134.7	86%	0.859	76%	0.762	S	S	*	*			trans	-171.8	115.8	145.9	-120.2	66.7	0	0	0	106.7
620	S	25.8	Very low	29.6	Very low	90 Å²	90	132.6 Å²	132.6	63%	0.629	76%	0.76	S	S	*	*				84.5	126.7	86.7	79.6	0	0	0	0	116.3
621	S	25.4	Very low	29.4	Very low	98 Å²	98	133.4 Å²	133.4	69%	0.685	76%	0.761	S	S	*	*			trans	73.8	112.8	139.2	-56.9	0	0	0	0	122
622	I	26.8	Very low	29.5	Very low	158 Å²	158	136.9 Å²	136.9	81%	0.81	77%	0.766	S	S	*	*				59.5	114.5	127.8	-48.6	162	0	0	0	118.3
623	V	30.3	Very low	29.3	Very low	136 Å²	136	134.5 Å²	134.5	82%	0.824	76%	0.759	S	S	*	*				-170.4	153.5	112.4	148.6	0	0	0	0	108.6
624	Q	31.4	Very low	29.1	Very low	176 Å²	176	135.8 Å²	135.8	82%	0.822	76%	0.756	S	S	*	*			trans	-97.1	-151.8	-179	-62.4	-176.4	-60.6	0	0	112
625	P	36.3	Very low	29.3	Very low	104 Å²	104	135.9 Å²	135.9	68%	0.675	75%	0.753	S	S	*	*				-123.5	-173.7	-97.7	40.5	-23.9	0	0	0	112.4
626	E	32.2	Very low	29.2	Very low	182 Å²	182	136.7 Å²	136.7	85%	0.85	75%	0.749	S	S	*	*				-166.8	173.4	125.9	-110.4	166.7	-153.4	0	0	112.1
627	C	26	Very low	29.6	Very low	107 Å²	107	137.4 Å²	137.4	72%	0.723	76%	0.755	S	S	*	*			trans	-83	163.9	-169.7	-53.2	0	0	0	0	113.3
628	F	31.2	Very low	29.6	Very low	214 Å²	214	135.7 Å²	135.7	94%	0.939	76%	0.756	S	S	*	*				-167.4	159.9	107.6	-97.6	-65.1	0	0	0	111.4
629	S	25.7	Very low	29.7	Very low	92 Å²	92	133.7 Å²	133.7	64%	0.643	76%	0.755	S	S	*	*			trans	-118.9	144.7	-171.2	55.1	0	0	0	0	112.4
630	N	30.7	Very low	30	Very low	153 Å²	153	135.2 Å²	135.2	82%	0.818	76%	0.755	S	S	*	*			trans	173.3	124.3	148.6	-82.4	-23.8	0	0	0	105.9
631	V	25.3	Very low	30.4	Very low	126 Å²	126	137.1 Å²	137.1	76%	0.764	76%	0.757	S	S	*	*			cis	76.3	132.9	48.5	-175.6	0	0	0	0	112.3
632	Q	33.2	Very low	30.7	Very low	172 Å²	172	140.4 Å²	140.4	80%	0.804	76%	0.762	S	S	*	*			trans	80.8	149.4	-173.4	-51.8	-173.4	13.6	0	0	115.7
633	N	27.8	Very low	30.8	Very low	130 Å²	130	137.7 Å²	137.7	70%	0.695	76%	0.756	S	S	*	*			cis	-172.8	142.8	-32.2	-106.7	-14.1	0	0	0	109.9
634	L	27.4	Very low	31	Very low	140 Å²	140	138.5 Å²	138.5	73%	0.733	76%	0.762	S	S	*	*			trans	62.1	166.7	157.5	-84.4	63.2	0	0	0	116.5
635	D	32.5	Very low	30.8	Very low	109 Å²	109	134.5 Å²	134.5	58%	0.583	75%	0.753	S	S	*	*			cis	-145.4	154.5	-3.2	-135.3	-1.1	0	0	0	116.2
636	K	30.7	Very low	30.6	Very low	159 Å²	159	136.9 Å²	136.9	69%	0.691	76%	0.76	S	S	*	*			trans	4.1	161.2	158.6	-65.6	167.3	-159.4	81.3	0	125.1
637	S	33.8	Very low	30.3	Very low	113 Å²	113	132.6 Å²	132.6	79%	0.79	75%	0.751	S	S	*	*			trans	97.6	147.8	142	77.9	0	0	0	0	119.5
638	S	29.6	Very low	30.6	Very low	121 Å²	121	137.7 Å²	137.7	85%	0.846	76%	0.756	S	S	*	*			cis	-175	147.1	-26.3	52.6	0	0	0	0	112.5
639	G	35.1	Very low	30.5	Very low	64 Å²	64	134 Å²	134	66%	0.66	75%	0.746	S	S	*	*			trans	142.8	127.1	167.6	0	0	0	0	0	112
640	F	32.1	Very low	30.9	Very low	196 Å²	196	136.9 Å²	136.9	86%	0.86	75%	0.754	S	S	*	*				63.6	130.7	61.9	-75.8	-124.1	0	0	0	111.9
641	L	34.1	Very low	30.8	Very low	130 Å²	130	134.8 Å²	134.8	68%	0.681	75%	0.747	S	S	*	*			cis	-161	169.7	-2.4	-104.9	-178.6	0	0	0	107.3
642	E	33.4	Very low	31	Very low	167 Å²	167	135.4 Å²	135.4	78%	0.78	75%	0.745	S	S	*	*			cis	-148.2	-157.7	4.3	-162.9	140.4	-116.7	0	0	109.8
643	S	28.8	Very low	31	Very low	100 Å²	100	136.2 Å²	136.2	70%	0.699	75%	0.746	S	S	*	*			trans	-128.3	149.1	177.4	60.9	0	0	0	0	114.1
644	T	32.8	Very low	31	Very low	153 Å²	153	135.7 Å²	135.7	94%	0.939	75%	0.747	S	S	*	*			trans	-157.6	147.7	149.3	-6.5	0	0	0	0	112.2
645	S	27.6	Very low	31.1	Very low	92 Å²	92	135.8 Å²	135.8	64%	0.643	75%	0.749	S	S	*	*			trans	-99.6	162.3	179.8	56	0	0	0	0	112.4
646	N	31.5	Very low	31	Very low	154 Å²	154	137 Å²	137	82%	0.824	76%	0.755	S	S	*	*				-177.2	155.6	112.7	-85.6	-10	0	0	0	112
647	S	27.5	Very low	31	Very low	93 Å²	93	137.3 Å²	137.3	65%	0.65	76%	0.759	S	S	*	*			trans	-82.3	158.4	174.9	53.3	0	0	0	0	112.3
648	Y	31.4	Very low	30.7	Very low	213 Å²	213	137.2 Å²	137.2	84%	0.835	76%	0.758	S	S	*	*				-164.2	158.5	110.8	-110.3	-72.1	0	0	0	111.1
649	D	29.1	Very low	30.6	Very low	136 Å²	136	138.3 Å²	138.3	73%	0.727	75%	0.754	S	S	*	*			trans	-66.2	154.7	178.1	-48.2	-96.9	0	0	0	112.7
650	D	34.5	Very low	30.2	Very low	153 Å²	153	141.3 Å²	141.3	82%	0.818	76%	0.76	S	S	*	*				-150.7	153.5	117.5	-139.7	-26.6	0	0	0	112.2
651	T	28.2	Very low	29.9	Very low	110 Å²	110	136.1 Å²	136.1	68%	0.675	75%	0.753	S	S	*	*			trans	-92.8	158.9	179.6	62.4	0	0	0	0	111.3
652	I	30.4	Very low	29.5	Very low	139 Å²	139	136.7 Å²	136.7	71%	0.713	76%	0.761	S	S	*	*				176.8	118.1	125	-93.4	158.2	0	0	0	114
653	K	31.6	Very low	29.2	Very low	189 Å²	189	134.8 Å²	134.8	82%	0.822	76%	0.757	S	S	*	*			trans	60.6	135.4	143.9	-60.7	174.1	-171.9	168.5	0	122.7
654	T	28.2	Very low	29	Very low	118 Å²	118	135.3 Å²	135.3	72%	0.724	76%	0.759	S	S	*	*			trans	-70.9	166.4	167.2	49	0	0	0	0	113.7
655	N	31	Very low	28.7	Very low	142 Å²	142	133.7 Å²	133.7	76%	0.759	75%	0.745	S	S	*	*				154.4	148.3	126.7	-81.8	21.2	0	0	0	110.7
656	D	30	Very low	28.7	Very low	136 Å²	136	134.7 Å²	134.7	73%	0.727	75%	0.747	S	S	*	*			cis	-166.8	-175.4	-32.4	-146	-33.1	0	0	0	109
657	E	31	Very low	28.4	Very low	164 Å²	164	133.1 Å²	133.1	77%	0.766	74%	0.738	S	S	*	*			trans	70.4	103.9	154	-72.3	-178.5	165.2	0	0	121.3
658	S	27.5	Very low	28.4	Very low	111 Å²	111	138 Å²	138	78%	0.776	75%	0.748	S	S	*	*			trans	78	152	141.1	88.6	0	0	0	0	117.7
659	L	26	Very low	28.2	Very low	145 Å²	145	132.4 Å²	132.4	76%	0.759	74%	0.74	S	S	*	*			cis	-158.6	162.7	30.9	-132.6	170.9	0	0	0	111
660	T	26.9	Very low	28	Very low	127 Å²	127	133.4 Å²	133.4	78%	0.779	75%	0.745	S	S	*	*			trans	79.8	154.1	164.2	72.7	0	0	0	0	121.8
661	A	26.8	Very low	27.8	Very low	87 Å²	87	137.4 Å²	137.4	72%	0.719	75%	0.749	S	S	*	*			trans	66.5	76.7	161.3	0	0	0	0	0	119.5	N663	A661-N663 VanDerWaalsContact C-N 3.29Å; A661-N663 PolarHBondContact O-N 2.79Å
662	V	26	Very low	27.6	Very low	141 Å²	141	139.4 Å²	139.4	86%	0.855	76%	0.756	S	S	*	*			trans	-70	87.7	156.5	-178.6	0	0	0	0	109.4
663	N	26.7	Very low	27.6	Very low	128 Å²	128	140 Å²	140	68%	0.684	76%	0.759	S	S	*	*			trans	-105.5	104.3	172.9	-173.9	23.1	0	0	0	108.4	A661 N665	A661-N663 VanDerWaalsContact C-N 3.29Å; A661-N663 PolarHBondContact O-N 2.79Å; N663-N665 PolarHBondContact O-N 3.45Å
664	C	25	Very low	27.3	Very low	111 Å²	111	139.7 Å²	139.7	75%	0.75	75%	0.754	S	S	*	*			trans	-75.1	59.4	-171.4	-63.2	0	0	0	0	113.5	V666	C664-V666 PolarHBondContact O-N 3.13Å
665	N	25	Very low	27.5	Very low	118 Å²	118	140.4 Å²	140.4	63%	0.631	76%	0.758	S	S	*	*			trans	-90.4	85.4	177	-137.7	28.3	0	0	0	108.8	N663 N667	N663-N665 PolarHBondContact O-N 3.45Å; N665-N667 PolarHBondContact O-N 2.82Å
666	V	28.2	Very low	27.4	Very low	113 Å²	113	140.1 Å²	140.1	69%	0.685	75%	0.752	S	S	*	*			trans	-76	76.8	-179.1	-173.3	0	0	0	0	110.2	C664 F668	C664-V666 PolarHBondContact O-N 3.13Å; V666-F668 HydrophobicContact CG1-CD2 3.69Å; V666-F668 HydrophobicContact CG1-CE2 3.55Å; V666-F668 PolarHBondContact O-N 2.93Å
667	N	25.3	Very low	27.5	Very low	122 Å²	122	141.4 Å²	141.4	65%	0.652	76%	0.758	S	S	*	*			trans	-76.4	97.6	166.4	-81.5	-4.3	0	0	0	109.3	N665 S669	N665-N667 PolarHBondContact O-N 2.82Å; N667-S669 PolarHBondContact O-N 3.27Å
668	F	26.8	Very low	27.5	Very low	196 Å²	196	140.2 Å²	140.2	86%	0.86	76%	0.758	S	S	*	*			trans	-76.9	96.7	155.6	-81.7	-75.5	0	0	0	108.3	V666	V666-F668 HydrophobicContact CG1-CD2 3.69Å; V666-F668 HydrophobicContact CG1-CE2 3.55Å; V666-F668 PolarHBondContact O-N 2.93Å
669	S	28.9	Very low	27.8	Very low	95 Å²	95	142.9 Å²	142.9	66%	0.664	76%	0.763	S	S	*	*			trans	-94	131.5	169.4	-59.5	0	0	0	0	109.6	N667 R671	N667-S669 PolarHBondContact O-N 3.27Å; S669-R671 PolarHBondContact O-N 3.14Å
670	D	24.6	Very low	28	Very low	156 Å²	156	144.2 Å²	144.2	83%	0.834	77%	0.766	S	S	*	*			trans	-59	134.1	-176.8	-57.1	-74	0	0	0	112.7
671	R	29.4	Very low	28.3	Very low	237 Å²	237	145.1 Å²	145.1	89%	0.894	76%	0.764	S	S	*	*			trans	-133.2	100	160.7	-80.4	-167	170.4	-167.3	-2.6	109.6	S669 I673	S669-R671 PolarHBondContact O-N 3.14Å; R671-I673 PolarHBondContact O-N 3.34Å
672	N	25.4	Very low	28.5	Very low	152 Å²	152	148.5 Å²	148.5	81%	0.813	77%	0.77	S	S	*	*			trans	-58.3	133.5	165.4	-65.1	-35.1	0	0	0	109.3
673	I	30.3	Very low	28.7	Very low	152 Å²	152	145.3 Å²	145.3	78%	0.779	77%	0.765	S	S	*	*			trans	-117.1	111.2	162	-62.7	-179.6	0	0	0	106.3	R671 V675	R671-I673 PolarHBondContact O-N 3.34Å; I673-V675 HydrophobicContact CG2-CG2 4.43Å
674	Y	23.9	Very low	28.9	Very low	182 Å²	182	150.1 Å²	150.1	71%	0.714	78%	0.776	S	S	*	*			trans	-74.1	134.9	170.1	-113.7	-111.1	0	0	0	109	E676	Y674-E676 HydrophobicContact CD1-CG 3.86Å; Y674-E676 HydrophobicContact CE1-CG 3.98Å
675	V	32.3	Very low	29.1	Very low	133 Å²	133	151.1 Å²	151.1	81%	0.806	77%	0.774	S	S	*	*			trans	-137.4	96.1	156.6	-177.5	0	0	0	0	106.8	I673	I673-V675 HydrophobicContact CG2-CG2 4.43Å
676	E	28.8	Very low	29.5	Very low	137 Å²	137	152.4 Å²	152.4	64%	0.64	78%	0.781	S	S	*	*			trans	-79.6	141.6	162.7	-73.3	166.3	147.8	0	0	109	Y674	Y674-E676 HydrophobicContact CD1-CG 3.86Å; Y674-E676 HydrophobicContact CE1-CG 3.98Å
677	N	33.1	Very low	29.8	Very low	162 Å²	162	150.7 Å²	150.7	87%	0.866	77%	0.774	S	S	*	*			trans	-168	120.2	133.3	-100.8	-36.2	0	0	0	108.3
678	D	30.6	Very low	30.3	Very low	140 Å²	140	152.8 Å²	152.8	75%	0.749	78%	0.779	S	S	*	*			trans	-69.5	153.7	176.7	-53.1	-77.4	0	0	0	111.3
679	N	34.5	Very low	30.6	Very low	166 Å²	166	146.9 Å²	146.9	89%	0.888	77%	0.766	S	S	*	*				-164.5	150.4	114.9	-100.4	-71.3	0	0	0	110
680	E	30.3	Very low	30.7	Very low	174 Å²	174	145.4 Å²	145.4	81%	0.813	76%	0.76	S	S	*	*			trans	-83.5	168.2	-166	-57.9	176.3	115.9	0	0	114.2
681	I	33.3	Very low	31.3	Very low	146 Å²	146	145.4 Å²	145.4	75%	0.749	75%	0.753	S	S	*	*			trans	133.9	100.9	141.2	-68.2	163.2	0	0	0	114.2
682	N	30.2	Very low	31.5	Very low	157 Å²	157	139.9 Å²	139.9	84%	0.84	74%	0.74	S	S	*	*			trans	46.1	115.4	141.6	-53.9	-18.4	0	0	0	120.8
683	G	30.8	Very low	31.6	Very low	74 Å²	74	140.2 Å²	140.2	76%	0.763	73%	0.731	S	S	*	*			trans	169.5	69.3	158.7	0	0	0	0	0	120.8
684	Y	30.3	Very low	31.7	Very low	230 Å²	230	138.8 Å²	138.8	90%	0.902	72%	0.724	S	S	*	*			trans	66.1	151.5	156	-118.2	-100.1	0	0	0	120.4
685	D	30.2	Very low	32.1	Very low	132 Å²	132	135.5 Å²	135.5	71%	0.706	72%	0.719	S	S	*	*			trans	-71.6	125.5	-173.8	-85.2	-70.2	0	0	0	114.9
686	N	31.5	Very low	32.1	Very low	145 Å²	145	132.2 Å²	132.2	78%	0.775	70%	0.702	S	S	*	*			trans	-135.5	15.7	165.5	-87.1	-68	0	0	0	113.1	Q688	N686-Q688 VanDerWaalsContact C-N 3.26Å; N686-Q688 PolarHBondContact O-N 3.28Å
687	S	34.8	Very low	32.2	Very low	77 Å²	77	132.4 Å²	132.4	54%	0.538	70%	0.702	S	S	.	*	H	α-helix	trans	-73.5	-8.1	-169.6	66	0	0	0	0	115.5
688	Q	36.1	Very low	31.9	Very low	166 Å²	166	132.5 Å²	132.5	78%	0.776	70%	0.696	S	S	*	*	H	α-helix	trans	-84.3	-26.8	-173.5	-141.4	163.4	12.8	0	0	113.6	N686	N686-Q688 VanDerWaalsContact C-N 3.26Å; N686-Q688 PolarHBondContact O-N 3.28Å
689	A	32.7	Very low	31.8	Very low	71 Å²	71	132.2 Å²	132.2	59%	0.587	69%	0.689	S	S	*	*	H	α-helix	trans	-72.4	-41.4	177.9	0	0	0	0	0	112.9	K691 I692 Y693	A689-K691 VanDerWaalsContact C-N 3.28Å; A689-K691 PolarHBondContact O-N 3Å; A689-I692 PolarHBondContact O-N 3.47Å; A689-Y693 PolarHBondContact O-N 3.45Å
690	A	32.1	Very low	31.5	Very low	64 Å²	64	129.7 Å²	129.7	53%	0.529	68%	0.675	S	S	.	*	H	α-helix	trans	-63.3	-31.8	-178	0	0	0	0	0	113.3	I692	A690-I692 VanDerWaalsContact C-N 3.29Å; A690-I692 PolarHBondContact O-N 3.25Å
691	K	36.2	Very low	31.3	Very low	157 Å²	157	126.2 Å²	126.2	68%	0.683	67%	0.666	S	S	*	*	H	α-helix	trans	-73.6	-15.1	175.9	-77.8	179.9	175.8	171.9	0	114.1	A689 N695	A689-K691 VanDerWaalsContact C-N 3.28Å; A689-K691 PolarHBondContact O-N 3Å; K691-N695 PolarHBondContact O-ND2 2.65Å
692	I	33.2	Very low	31.2	Very low	121 Å²	121	123.3 Å²	123.3	62%	0.621	66%	0.655	S	S	*	*	H	α-helix	trans	-81.4	-43.8	174.5	-63.9	171.1	0	0	0	109.5	A689 A690 L694 N695 S696	A689-I692 PolarHBondContact O-N 3.47Å; A690-I692 VanDerWaalsContact C-N 3.29Å; A690-I692 PolarHBondContact O-N 3.25Å; I692-L694 PolarHBondContact O-N 3.45Å; I692-N695 PolarHBondContact O-N 3.21Å; I692-N695 VanDerWaalsContact O-N 3.16Å; I692-S696 PolarHBondContact O-N 3.29Å; I692-S696 VanDerWaalsContact O-N 3.17Å; I692-S696 PolarHBondContact O-OG 3.36Å
693	Y	28.3	Very low	31.2	Very low	159 Å²	159	122.3 Å²	122.3	62%	0.624	65%	0.645	S	S	*	*	H	α-helix	trans	-63.3	-37.7	-174.5	-153.3	-99.5	0	0	0	114	A689 S696	A689-Y693 PolarHBondContact O-N 3.45Å; Y693-S696 WeakPolarHBondContact CA-OG 3.34Å; Y693-S696 PolarHBondContact O-OG 3.31Å
694	L	32	Very low	31.1	Very low	122 Å²	122	127 Å²	127	64%	0.639	64%	0.641	S	S	*	*	H	α-helix	trans	-72.8	-29.2	176.1	-80.5	164.4	0	0	0	113.5	I692	I692-L694 PolarHBondContact O-N 3.45Å
695	N	32.7	Very low	31	Very low	113 Å²	113	122.4 Å²	122.4	60%	0.604	63%	0.63	S	S	*	*	H	α-helix	trans	-75.6	-30.7	176.5	-79.9	-41.8	0	0	0	112.4	K691 I692 Q697	K691-N695 PolarHBondContact O-ND2 2.65Å; I692-N695 PolarHBondContact O-N 3.21Å; I692-N695 VanDerWaalsContact O-N 3.16Å; N695-Q697 VanDerWaalsContact C-N 3.28Å; N695-Q697 PolarHBondContact O-N 2.81Å
696	S	31.6	Very low	31.1	Very low	64 Å²	64	121.6 Å²	121.6	45%	0.448	62%	0.622	S	S	.	*	H	α-helix	trans	-63.5	-30	173.6	29.3	0	0	0	0	113.7	I692 Y693	I692-S696 PolarHBondContact O-N 3.29Å; I692-S696 VanDerWaalsContact O-N 3.17Å; I692-S696 PolarHBondContact O-OG 3.36Å; Y693-S696 WeakPolarHBondContact CA-OG 3.34Å; Y693-S696 PolarHBondContact O-OG 3.31Å
697	Q	30.7	Very low	31.1	Very low	140 Å²	140	121.6 Å²	121.6	65%	0.654	61%	0.612	S	S	*	*	H	α-helix	trans	-83.4	-22.2	-175.8	-149.8	165	24.4	0	0	113.5	N695	N695-Q697 VanDerWaalsContact C-N 3.28Å; N695-Q697 PolarHBondContact O-N 2.81Å
698	F	28.7	Very low	31	Very low	165 Å²	165	119.9 Å²	119.9	72%	0.724	61%	0.606	S	S	*	*	H	α-helix	trans	-83.4	-15.5	172.7	-100.1	-86.5	0	0	0	114.2	T701	F698-T701 PolarHBondContact O-OG1 3.27Å
699	H	28.5	Very low	30.9	Very low	133 Å²	133	118.7 Å²	118.7	62%	0.616	60%	0.601	S	S	*	*	G	3₁₀ helix	trans	-76.1	-22.7	-179.3	-118.3	-72.5	0	0	0	113.9	T701 T702	H699-T701 VanDerWaalsContact C-N 3.29Å; H699-T701 PolarHBondContact O-N 3.48Å; H699-T702 PolarHBondContact O-N 2.9Å; H699-T702 PolarHBondContact O-OG1 3.06Å
700	L	26.7	Very low	30.9	Very low	113 Å²	113	119.2 Å²	119.2	59%	0.592	59%	0.593	S	S	*	*	G	3₁₀ helix	trans	-77.6	-5.6	-176.7	-74.7	164.1	0	0	0	114.7
701	T	27.5	Very low	30.8	Very low	101 Å²	101	121.5 Å²	121.5	62%	0.62	59%	0.591	S	S	*	*	G	3₁₀ helix	trans	-103.4	-5.8	176	55.3	0	0	0	0	113.6	F698 H699	F698-T701 PolarHBondContact O-OG1 3.27Å; H699-T701 VanDerWaalsContact C-N 3.29Å; H699-T701 PolarHBondContact O-N 3.48Å
702	T	30.8	Very low	30.7	Very low	85 Å²	85	118.6 Å²	118.6	52%	0.521	58%	0.583	S	S	.	*	T	Hydrogen-bonded Turn	trans	-92.5	-25.6	178.1	3.2	0	0	0	0	113.7	H699 Y704 M705	H699-T702 PolarHBondContact O-N 2.9Å; H699-T702 PolarHBondContact O-OG1 3.06Å; T702-Y704 PolarHBondContact O-N 3.15Å; T702-M705 PolarHBondContact O-N 2.83Å; T702-M705 VanDerWaalsContact O-N 3.13Å
703	E	29.1	Very low	30.7	Very low	136 Å²	136	117.3 Å²	117.3	64%	0.636	57%	0.574	S	S	*	*	G	3₁₀ helix	trans	-61	-25.8	178.3	-63.6	-171.6	129.1	0	0	113	M705 E706	E703-M705 PolarHBondContact O-N 3.35Å; E703-M705 VanDerWaalsContact O-N 3.15Å; E703-E706 PolarHBondContact O-N 3.21Å
704	Y	30.3	Very low	31	Very low	173 Å²	173	114.3 Å²	114.3	68%	0.678	57%	0.568	S	S	*	*	G	3₁₀ helix	trans	-71.7	-0.9	177.1	-75.5	-83.8	0	0	0	115	T702 Y707	T702-Y704 PolarHBondContact O-N 3.15Å; Y704-Y707 HydrophobicContact CD1-CE2 4.22Å
705	M	28.2	Very low	31	Very low	134 Å²	134	109.3 Å²	109.3	66%	0.66	54%	0.542	S	S	*	.	G	3₁₀ helix	trans	-102.8	-5.8	175.3	-64.8	-155.3	178.2	0	0	115.4	T702 E703 Y707	T702-M705 PolarHBondContact O-N 2.83Å; T702-M705 VanDerWaalsContact O-N 3.13Å; E703-M705 PolarHBondContact O-N 3.35Å; E703-M705 VanDerWaalsContact O-N 3.15Å; M705-Y707 VanDerWaalsContact C-N 3.31Å; M705-Y707 PolarHBondContact O-N 3.41Å
706	E	31.3	Very low	31.2	Very low	115 Å²	115	110 Å²	110	54%	0.537	54%	0.542	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-0.5	176.2	-76.6	-141.8	129	0	0	114.7	E703 G708 H709	E703-E706 PolarHBondContact O-N 3.21Å; E706-G708 PolarHBondContact O-N 2.96Å; E706-H709 PolarHBondContact O-N 2.85Å
707	Y	32.3	Very low	31.2	Very low	144 Å²	144	114.3 Å²	114.3	57%	0.565	55%	0.549	S	S	*	.	H	α-helix	trans	-55.8	-23.1	-178.2	-89.6	-88.5	0	0	0	115	Y704 M705 H709 I710 F711	Y704-Y707 HydrophobicContact CD1-CE2 4.22Å; M705-Y707 VanDerWaalsContact C-N 3.31Å; M705-Y707 PolarHBondContact O-N 3.41Å; Y707-H709 VanDerWaalsContact C-N 3.28Å; Y707-H709 PolarHBondContact O-N 2.87Å; Y707-I710 HydrophobicContact CD1-CD1 4.41Å; Y707-I710 HydrophobicContact CE1-CD1 4.47Å; Y707-I710 PolarHBondContact O-N 2.97Å; Y707-F711 PolarHBondContact O-N 3.39Å; Y707-F711 VanDerWaalsContact O-N 3.17Å
708	G	32.8	Very low	31.1	Very low	41 Å²	41	110.9 Å²	110.9	42%	0.423	53%	0.534	S	S	.	.	H	α-helix	trans	-66.1	-23	172.5	0	0	0	0	0	115.1	E706 N712	E706-G708 PolarHBondContact O-N 2.96Å; G708-N712 PolarHBondContact O-ND2 3.05Å
709	H	33.1	Very low	31.2	Very low	142 Å²	142	110 Å²	110	66%	0.657	53%	0.526	S	S	*	.	H	α-helix	trans	-84.8	-43.4	173.8	-86.6	-95.1	0	0	0	111.8	E706 Y707 F711 N712 E713	E706-H709 PolarHBondContact O-N 2.85Å; Y707-H709 VanDerWaalsContact C-N 3.28Å; Y707-H709 PolarHBondContact O-N 2.87Å; H709-F711 VanDerWaalsContact C-N 3.27Å; H709-F711 PolarHBondContact O-N 3.28Å; H709-N712 PolarHBondContact O-N 2.66Å; H709-E713 PolarHBondContact O-N 2.88Å
710	I	32.4	Very low	31.4	Very low	82 Å²	82	108.2 Å²	108.2	42%	0.421	52%	0.524	S	S	.	.	H	α-helix	trans	-56.9	-41.8	177	-59.3	174.7	0	0	0	110.9	Y707 N712 E713 L714	Y707-I710 HydrophobicContact CD1-CD1 4.41Å; Y707-I710 HydrophobicContact CE1-CD1 4.47Å; Y707-I710 PolarHBondContact O-N 2.97Å; I710-N712 VanDerWaalsContact C-N 3.34Å; I710-N712 PolarHBondContact O-N 3.48Å; I710-E713 PolarHBondContact O-N 3.41Å; I710-L714 HydrophobicContact CG2-CD1 4.24Å; I710-L714 PolarHBondContact O-N 3.43Å
711	F	30.6	Very low	31.5	Very low	112 Å²	112	106.8 Å²	106.8	49%	0.491	52%	0.524	S	S	.	.	H	α-helix	trans	-65.1	-34.6	177.1	-164.3	-102	0	0	0	113.1	Y707 H709 N715 L939	Y707-F711 PolarHBondContact O-N 3.39Å; Y707-F711 VanDerWaalsContact O-N 3.17Å; H709-F711 VanDerWaalsContact C-N 3.27Å; H709-F711 PolarHBondContact O-N 3.28Å; F711-N715 WeakPolarHBondContact CD1-ND2 3.42Å; F711-N715 VanDerWaalsContact CE1-ND2 3.27Å; F711-N715 WeakPolarHBondContact CE1-ND2 3.06Å; F711-N715 WeakPolarHBondContact O-CB 3.03Å; F711-N715 PolarHBondContact O-N 2.76Å; F711-N715 VanDerWaalsContact O-N 3.1Å; F711-N715 PolarHBondContact O-ND2 3.17Å; F711-L939 HydrophobicContact CE2-CD1 3.79Å; F711-L939 HydrophobicContact CZ-CD1 3.67Å
712	N	34.1	Very low	31.7	Very low	95 Å²	95	109 Å²	109	51%	0.508	53%	0.531	S	S	.	.	H	α-helix	trans	-73.2	-35	173.8	-86.9	-62	0	0	0	112.4	G708 H709 I710 N715 Q716	G708-N712 PolarHBondContact O-ND2 3.05Å; H709-N712 PolarHBondContact O-N 2.66Å; I710-N712 VanDerWaalsContact C-N 3.34Å; I710-N712 PolarHBondContact O-N 3.48Å; N712-N715 PolarHBondContact O-N 2.98Å; N712-Q716 WeakPolarHBondContact O-CG 3.38Å; N712-Q716 PolarHBondContact O-N 3.03Å
713	E	34	Very low	31.5	Very low	94 Å²	94	111.7 Å²	111.7	44%	0.439	54%	0.543	S	S	.	.	H	α-helix	trans	-70.9	-42.5	178.3	-154.2	-173.3	162.4	0	0	111.6	H709 I710 N715 Q716 R717	H709-E713 PolarHBondContact O-N 2.88Å; I710-E713 PolarHBondContact O-N 3.41Å; E713-N715 PolarHBondContact O-N 3.2Å; E713-Q716 PolarHBondContact O-N 3.04Å; E713-R717 WeakPolarHBondContact O-CB 3.38Å; E713-R717 VanDerWaalsContact O-CG 3.26Å; E713-R717 WeakPolarHBondContact O-CG 3.46Å; E713-R717 PolarHBondContact O-N 3.28Å; E713-R717 IonicContact OE1-CZ 2.66Å; E713-R717 IonicContact OE1-NE 3.92Å; E713-R717 PolarHBondContact OE1-NE 2.88Å; E713-R717 IonicContact OE1-NH2 3.41Å; E713-R717 PolarHBondContact OE1-NH2 3.27Å
714	L	33.9	Very low	31.5	Very low	96 Å²	96	107 Å²	107	50%	0.503	52%	0.52	S	S	.	.	H	α-helix	trans	-58.5	-44.9	169.5	-88.2	163.4	0	0	0	111.7	I710 Q716 R717 L718	I710-L714 HydrophobicContact CG2-CD1 4.24Å; I710-L714 PolarHBondContact O-N 3.43Å; L714-Q716 VanDerWaalsContact C-N 3.31Å; L714-Q716 PolarHBondContact O-N 2.8Å; L714-R717 PolarHBondContact O-N 3Å; L714-L718 WeakPolarHBondContact O-CB 3.3Å; L714-L718 VanDerWaalsContact O-CG 3.32Å; L714-L718 WeakPolarHBondContact O-CG 3.21Å; L714-L718 PolarHBondContact O-N 2.74Å
715	N	31.6	Very low	31.3	Very low	18 Å²	18	101.7 Å²	101.7	10%	0.096	51%	0.512	C	S	.	.	H	α-helix	trans	-66.1	-29.5	177.5	-88.3	-74.5	0	0	0	113.8	F711 N712 E713 R719 I935	F711-N715 WeakPolarHBondContact CD1-ND2 3.42Å; F711-N715 VanDerWaalsContact CE1-ND2 3.27Å; F711-N715 WeakPolarHBondContact CE1-ND2 3.06Å; F711-N715 WeakPolarHBondContact O-CB 3.03Å; F711-N715 PolarHBondContact O-N 2.76Å; F711-N715 VanDerWaalsContact O-N 3.1Å; F711-N715 PolarHBondContact O-ND2 3.17Å; N712-N715 PolarHBondContact O-N 2.98Å; E713-N715 PolarHBondContact O-N 3.2Å; N715-R719 WeakPolarHBondContact O-CB 3.49Å; N715-R719 VanDerWaalsContact O-CG 3.22Å; N715-R719 WeakPolarHBondContact O-CG 3.43Å; N715-R719 PolarHBondContact O-N 3.37Å; N715-R719 VanDerWaalsContact O-N 3.09Å; N715-I935 WeakPolarHBondContact OD1-CG2 3.36Å
716	Q	36.2	Very low	31.4	Very low	128 Å²	128	101.9 Å²	101.9	60%	0.598	52%	0.521	S	S	*	.	H	α-helix	trans	-78.8	-42.2	173.7	-74.5	-176.1	79.2	0	0	112	N712 E713 L714 L718 R719 V720	N712-Q716 WeakPolarHBondContact O-CG 3.38Å; N712-Q716 PolarHBondContact O-N 3.03Å; E713-Q716 PolarHBondContact O-N 3.04Å; L714-Q716 VanDerWaalsContact C-N 3.31Å; L714-Q716 PolarHBondContact O-N 2.8Å; Q716-L718 VanDerWaalsContact C-N 3.28Å; Q716-L718 PolarHBondContact O-N 2.96Å; Q716-R719 PolarHBondContact O-N 2.8Å; Q716-R719 VanDerWaalsContact O-N 3.12Å; Q716-V720 WeakPolarHBondContact O-CG2 3.2Å; Q716-V720 PolarHBondContact O-N 3.33Å
717	R	31.6	Very low	31.2	Very low	154 Å²	154	100.7 Å²	100.7	58%	0.581	53%	0.525	S	S	*	.	H	α-helix	trans	-58	-39.9	172.6	-70	170.4	179.3	-140.7	4.2	111.4	E713 L714 S721	E713-R717 WeakPolarHBondContact O-CB 3.38Å; E713-R717 VanDerWaalsContact O-CG 3.26Å; E713-R717 WeakPolarHBondContact O-CG 3.46Å; E713-R717 PolarHBondContact O-N 3.28Å; E713-R717 IonicContact OE1-CZ 2.66Å; E713-R717 IonicContact OE1-NE 3.92Å; E713-R717 PolarHBondContact OE1-NE 2.88Å; E713-R717 IonicContact OE1-NH2 3.41Å; E713-R717 PolarHBondContact OE1-NH2 3.27Å; L714-R717 PolarHBondContact O-N 3Å; R717-S721 PolarHBondContact O-N 3.41Å
718	L	28.8	Very low	31.1	Very low	68 Å²	68	102.8 Å²	102.8	36%	0.356	54%	0.54	S	S	.	.	H	α-helix	trans	-72.1	-31.7	173.9	-73.8	167.5	0	0	0	114.3	L714 Q716 S721 L939	L714-L718 WeakPolarHBondContact O-CB 3.3Å; L714-L718 VanDerWaalsContact O-CG 3.32Å; L714-L718 WeakPolarHBondContact O-CG 3.21Å; L714-L718 PolarHBondContact O-N 2.74Å; Q716-L718 VanDerWaalsContact C-N 3.28Å; Q716-L718 PolarHBondContact O-N 2.96Å; L718-S721 WeakPolarHBondContact CA-OG 3.31Å; L718-S721 PolarHBondContact O-N 3.02Å; L718-S721 PolarHBondContact O-OG 2.77Å; L718-L939 HydrophobicContact CD1-CD2 3.75Å
719	R	30.9	Very low	30.9	Very low	146 Å²	146	104.8 Å²	104.8	55%	0.551	55%	0.552	S	S	*	*	H	α-helix	trans	-70.8	-30.5	173.8	-80.4	175.1	-173.6	-154.1	4.1	112.9	N715 Q716	N715-R719 WeakPolarHBondContact O-CB 3.49Å; N715-R719 VanDerWaalsContact O-CG 3.22Å; N715-R719 WeakPolarHBondContact O-CG 3.43Å; N715-R719 PolarHBondContact O-N 3.37Å; N715-R719 VanDerWaalsContact O-N 3.09Å; Q716-R719 PolarHBondContact O-N 2.8Å; Q716-R719 VanDerWaalsContact O-N 3.12Å
720	V	32.5	Very low	30.6	Very low	95 Å²	95	105.4 Å²	105.4	58%	0.576	56%	0.56	S	S	*	*	H	α-helix	trans	-75.9	-26.2	175.7	175.3	0	0	0	0	111.8	Q716 L722	Q716-V720 WeakPolarHBondContact O-CG2 3.2Å; Q716-V720 PolarHBondContact O-N 3.33Å; V720-L722 PolarHBondContact O-N 3.03Å
721	S	30.1	Very low	30.4	Very low	84 Å²	84	113.4 Å²	113.4	59%	0.587	59%	0.585	S	S	*	*	S	Bend	trans	-80.1	-8.7	-177.4	61.7	0	0	0	0	116.2	R717 L718	R717-S721 PolarHBondContact O-N 3.41Å; L718-S721 WeakPolarHBondContact CA-OG 3.31Å; L718-S721 PolarHBondContact O-N 3.02Å; L718-S721 PolarHBondContact O-OG 2.77Å
722	L	30.4	Very low	30.4	Very low	147 Å²	147	112.3 Å²	112.3	77%	0.77	60%	0.597	S	S	*	*	S	Bend	trans	-101.7	-12.8	-169.6	-149.9	70.8	0	0	0	115.6	V720 K724	V720-L722 PolarHBondContact O-N 3.03Å; L722-K724 PolarHBondContact O-N 2.84Å
723	N	28	Very low	30	Very low	142 Å²	142	112.5 Å²	112.5	76%	0.759	61%	0.606	S	S	*	*	S	Bend	trans	-98.3	35.6	-166.6	-71.7	-16.5	0	0	0	114.8
724	K	27.7	Very low	29.9	Very low	36 Å²	36	115.1 Å²	115.1	16%	0.157	63%	0.628	C	S	.	*			trans	-148.2	49.3	-165.8	-134.5	165.2	-177.8	-172.1	0	120.2	L722 P967 Y971	L722-K724 PolarHBondContact O-N 2.84Å; K724-P967 HydrophobicContact CB-CB 4.21Å; K724-P967 HydrophobicContact CB-CG 4.26Å; K724-P967 HydrophobicContact CD-CB 4.08Å; K724-P967 WeakPolarHBondContact CE-O 3.33Å; K724-P967 HydrophobicContact CG-CB 4.28Å; K724-P967 PolarHBondContact NZ-O 3.38Å; K724-Y971 HydrophobicContact CD-CD2 4.17Å; K724-Y971 HydrophobicContact CD-CE2 3.63Å
725	A	27.8	Very low	29.6	Very low	62 Å²	62	113.6 Å²	113.6	51%	0.512	64%	0.636	S	S	.	*			trans	-154.7	90.5	162	0	0	0	0	0	114.2
726	T	29.2	Very low	29.5	Very low	139 Å²	139	122.6 Å²	122.6	85%	0.853	68%	0.675	S	S	*	*			trans	-176.8	107.7	152.7	11.9	0	0	0	0	113.2
727	S	27.2	Very low	29.1	Very low	89 Å²	89	124 Å²	124	62%	0.622	69%	0.686	S	S	*	*			trans	-175.9	157.6	150.7	25.5	0	0	0	0	110.2
728	H	30.6	Very low	29.1	Very low	189 Å²	189	122 Å²	122	88%	0.875	69%	0.693	S	S	*	*			trans	79.7	84.8	-161.9	-57.5	-68.8	0	0	0	113.3
729	A	28.6	Very low	29.3	Very low	83 Å²	83	125 Å²	125	69%	0.686	72%	0.715	S	S	*	*			cis	93.8	107.6	41.1	0	0	0	0	0	114.8
730	N	26.6	Very low	29.1	Very low	155 Å²	155	125.5 Å²	125.5	83%	0.829	73%	0.727	S	S	*	*			trans	55.3	104	142.3	-54.2	-6.3	0	0	0	120.7
731	R	27.4	Very low	28.8	Very low	250 Å²	250	125.8 Å²	125.8	94%	0.943	73%	0.733	S	S	*	*				-165.7	149.3	124.8	-118.9	176.8	175.7	-178.5	-2	113.8
732	A	30.5	Very low	28.8	Very low	89 Å²	89	131.3 Å²	131.3	74%	0.736	75%	0.747	S	S	*	*			trans	56.1	120.8	171.2	0	0	0	0	0	117.2
733	S	26.1	Very low	28.9	Very low	99 Å²	99	129.3 Å²	129.3	69%	0.692	74%	0.74	S	S	*	*			cis	91.8	137.1	32.9	78.6	0	0	0	0	114.7
734	T	31.5	Very low	29.2	Very low	149 Å²	149	128 Å²	128	91%	0.914	74%	0.74	S	S	*	*			trans	70.8	142	-167.1	75.3	0	0	0	0	113.7
735	G	28.1	Very low	29.2	Very low	64 Å²	64	138.1 Å²	138.1	66%	0.66	78%	0.777	S	S	*	*			cis	175.5	162.5	-8.8	0	0	0	0	0	112
736	F	29.7	Very low	29.7	Very low	207 Å²	207	141 Å²	141	91%	0.908	78%	0.783	S	S	*	*			trans	68.6	90.9	173	-65.5	-82	0	0	0	119.4
737	D	28.5	Very low	30.3	Very low	157 Å²	157	138.3 Å²	138.3	84%	0.84	76%	0.764	S	S	*	*				34.2	155	109.9	-85.4	-7.2	0	0	0	123.4
738	P	31.6	Very low	31	Very low	113 Å²	113	141.5 Å²	141.5	73%	0.734	77%	0.769	S	S	*	*			trans	-124.2	154.1	-140.2	40.1	-26.6	0	0	0	116.1
739	T	31.5	Very low	31.7	Very low	131 Å²	131	134.9 Å²	134.9	80%	0.804	75%	0.747	S	S	*	*			trans	-141.4	128.1	168	35.8	0	0	0	0	114.9
740	L	27.9	Very low	32.8	Very low	155 Å²	155	135.5 Å²	135.5	81%	0.812	74%	0.736	S	S	*	*			trans	67	74.9	139.2	-61.3	169	0	0	0	121.8
741	S	26.7	Very low	33.9	Very low	101 Å²	101	130.9 Å²	130.9	71%	0.706	72%	0.716	S	S	*	*				88.9	153	113.8	83.9	0	0	0	0	123
742	K	30.3	Very low	35.3	Very low	200 Å²	200	124.6 Å²	124.6	87%	0.87	70%	0.7	S	S	*	*			trans	67.1	68.6	158.6	-65.4	-178.6	179.8	177.7	0	119.5
743	V	30.9	Very low	36.6	Very low	105 Å²	105	126.7 Å²	126.7	64%	0.636	70%	0.696	S	S	*	*	S	Bend	trans	-129.7	147.6	149.6	178.5	0	0	0	0	107.8
744	P	34.6	Very low	38.3	Very low	116 Å²	116	126.7 Å²	126.7	75%	0.753	69%	0.687	S	S	*	*			trans	-61.3	137.4	-169.6	-26.1	36.1	0	0	0	114.2	L746	P744-L746 PolarHBondContact O-N 2.77Å
745	R	28.6	Very low	39.6	Very low	248 Å²	248	122 Å²	122	94%	0.936	66%	0.664	S	S	*	*			trans	-66	102.3	174.7	-71	179	173.4	168.5	-4.1	110.1
746	L	36.9	Very low	41.4	Very low	121 Å²	121	121.8 Å²	121.8	63%	0.634	66%	0.655	S	S	*	*			trans	-67.4	127.9	145.1	-166.6	75	0	0	0	105.7	P744 E748	P744-L746 PolarHBondContact O-N 2.77Å; L746-E748 PolarHBondContact O-N 3.08Å
747	D	43.4	Very low	43	Very low	84 Å²	84	119.6 Å²	119.6	45%	0.449	64%	0.641	S	S	.	*			trans	-60.4	132.6	-167.9	-175.4	15.6	0	0	0	111.4	A749 Q750 S751	D747-A749 PolarHBondContact O-N 3.41Å; D747-A749 PolarHBondContact OD1-N 3.12Å; D747-Q750 HydrophobicContact CB-CB 4.3Å; D747-Q750 HydrophobicContact CB-CG 3.92Å; D747-Q750 WeakPolarHBondContact O-CA 3.31Å; D747-Q750 WeakPolarHBondContact O-CB 3.3Å; D747-Q750 PolarHBondContact O-N 3.2Å; D747-S751 PolarHBondContact O-N 3.44Å; D747-S751 VanDerWaalsContact O-N 3.12Å; D747-S751 PolarHBondContact O-OG 3.37Å
748	E	40.4	Very low	44.4	Very low	155 Å²	155	119.1 Å²	119.1	72%	0.724	63%	0.629	S	S	*	*	H	α-helix	trans	-65.3	-34	-174.5	-164.6	158	-144.4	0	0	110	L746 Q750 S751 L752	L746-E748 PolarHBondContact O-N 3.08Å; E748-Q750 VanDerWaalsContact C-N 3.35Å; E748-Q750 PolarHBondContact O-N 3.37Å; E748-S751 PolarHBondContact O-N 2.78Å; E748-L752 HydrophobicContact CG-CD1 4.45Å; E748-L752 WeakPolarHBondContact O-CB 3.49Å; E748-L752 WeakPolarHBondContact O-CG 3.21Å; E748-L752 PolarHBondContact O-N 2.97Å
749	A	46.4	Very low	45.9	Very low	51 Å²	51	116.8 Å²	116.8	42%	0.421	62%	0.615	S	S	.	*	H	α-helix	trans	-61.5	-36.3	169.6	0	0	0	0	0	113.1	D747 M753	D747-A749 PolarHBondContact O-N 3.41Å; D747-A749 PolarHBondContact OD1-N 3.12Å; A749-M753 WeakPolarHBondContact O-CB 2.96Å; A749-M753 PolarHBondContact O-N 2.76Å
750	Q	51.7	Low	47.6	Very low	96 Å²	96	113.5 Å²	113.5	45%	0.449	60%	0.601	S	S	.	*	H	α-helix	trans	-69.8	-40.9	176.2	-68.4	175	23.5	0	0	111.4	D747 E748 M753 I754	D747-Q750 HydrophobicContact CB-CB 4.3Å; D747-Q750 HydrophobicContact CB-CG 3.92Å; D747-Q750 WeakPolarHBondContact O-CA 3.31Å; D747-Q750 WeakPolarHBondContact O-CB 3.3Å; D747-Q750 PolarHBondContact O-N 3.2Å; E748-Q750 VanDerWaalsContact C-N 3.35Å; E748-Q750 PolarHBondContact O-N 3.37Å; Q750-M753 PolarHBondContact O-N 3.15Å; Q750-I754 VanDerWaalsContact O-CG1 3.31Å; Q750-I754 WeakPolarHBondContact O-CG1 3.47Å; Q750-I754 PolarHBondContact O-N 3.15Å
751	S	49.1	Very low	49	Very low	58 Å²	58	110.6 Å²	110.6	41%	0.406	59%	0.586	S	S	.	*	H	α-helix	trans	-64.8	-44.8	177.4	-58	0	0	0	0	111.4	D747 E748 I754 A755	D747-S751 PolarHBondContact O-N 3.44Å; D747-S751 VanDerWaalsContact O-N 3.12Å; D747-S751 PolarHBondContact O-OG 3.37Å; E748-S751 PolarHBondContact O-N 2.78Å; S751-I754 PolarHBondContact O-N 2.87Å; S751-A755 WeakPolarHBondContact O-CB 3.48Å; S751-A755 PolarHBondContact O-N 3.45Å
752	L	57.4	Low	50.6	Low	118 Å²	118	110.7 Å²	110.7	62%	0.618	58%	0.577	S	S	*	*	H	α-helix	trans	-63.7	-39.5	173.5	-72.2	168.4	0	0	0	112.3	E748 A755 A756	E748-L752 HydrophobicContact CG-CD1 4.45Å; E748-L752 WeakPolarHBondContact O-CB 3.49Å; E748-L752 WeakPolarHBondContact O-CG 3.21Å; E748-L752 PolarHBondContact O-N 2.97Å; L752-A755 PolarHBondContact O-N 3.42Å; L752-A756 VanDerWaalsContact O-CB 3.26Å; L752-A756 WeakPolarHBondContact O-CB 3.44Å; L752-A756 PolarHBondContact O-N 2.99Å
753	M	56.6	Low	51.7	Low	132 Å²	132	105.4 Å²	105.4	65%	0.65	56%	0.558	S	S	*	*	H	α-helix	trans	-65.2	-40.3	177.6	-169.6	-171.8	-49.2	0	0	112.1	A749 Q750 W757	A749-M753 WeakPolarHBondContact O-CB 2.96Å; A749-M753 PolarHBondContact O-N 2.76Å; Q750-M753 PolarHBondContact O-N 3.15Å; M753-W757 VanDerWaalsContact O-CB 3.3Å; M753-W757 WeakPolarHBondContact O-CB 3.25Å; M753-W757 PolarHBondContact O-N 2.65Å
754	I	62.6	Low	52.5	Low	100 Å²	100	104.1 Å²	104.1	51%	0.513	55%	0.553	S	S	.	*	H	α-helix	trans	-66.2	-43.8	174.5	-68.1	165	0	0	0	110.7	Q750 S751 W757 Y758	Q750-I754 VanDerWaalsContact O-CG1 3.31Å; Q750-I754 WeakPolarHBondContact O-CG1 3.47Å; Q750-I754 PolarHBondContact O-N 3.15Å; S751-I754 PolarHBondContact O-N 2.87Å; I754-W757 PolarHBondContact O-N 2.95Å; I754-Y758 HydrophobicContact CG2-CD2 4.36Å; I754-Y758 PolarHBondContact O-N 3.37Å
755	A	58.1	Low	52.7	Low	50 Å²	50	101.8 Å²	101.8	41%	0.413	54%	0.544	S	S	.	.	H	α-helix	trans	-64.4	-41.1	177.5	0	0	0	0	0	112.5	S751 L752 S759	S751-A755 WeakPolarHBondContact O-CB 3.48Å; S751-A755 PolarHBondContact O-N 3.45Å; L752-A755 PolarHBondContact O-N 3.42Å; A755-S759 WeakPolarHBondContact O-CB 2.92Å; A755-S759 PolarHBondContact O-N 2.85Å; A755-S759 PolarHBondContact O-OG 2.96Å
756	A	66.6	Low	53.4	Low	59 Å²	59	96.2 Å²	96.2	49%	0.488	53%	0.526	S	S	.	.	H	α-helix	trans	-65.2	-40.3	174.5	0	0	0	0	0	111.9	L752 S759 A760	L752-A756 VanDerWaalsContact O-CB 3.26Å; L752-A756 WeakPolarHBondContact O-CB 3.44Å; L752-A756 PolarHBondContact O-N 2.99Å; A756-S759 PolarHBondContact O-N 3Å; A756-A760 WeakPolarHBondContact O-CB 3.41Å; A756-A760 PolarHBondContact O-N 3.44Å
757	W	63.9	Low	53.5	Low	162 Å²	162	96.9 Å²	96.9	61%	0.614	53%	0.531	S	S	*	.	H	α-helix	trans	-65	-44.7	176.5	-171.1	65.5	0	0	0	112.2	M753 I754 S759 A760 L761	M753-W757 VanDerWaalsContact O-CB 3.3Å; M753-W757 WeakPolarHBondContact O-CB 3.25Å; M753-W757 PolarHBondContact O-N 2.65Å; I754-W757 PolarHBondContact O-N 2.95Å; W757-S759 PolarHBondContact O-N 2.88Å; W757-A760 PolarHBondContact O-N 2.9Å; W757-L761 WeakPolarHBondContact O-CB 3.33Å; W757-L761 PolarHBondContact O-N 3.05Å
758	Y	57.5	Low	53.2	Low	146 Å²	146	100.9 Å²	100.9	57%	0.573	55%	0.547	S	S	*	.	H	α-helix	trans	-60.4	-43.7	172	-107.3	-83	0	0	0	112.2	I754 L761 M762	I754-Y758 HydrophobicContact CG2-CD2 4.36Å; I754-Y758 PolarHBondContact O-N 3.37Å; Y758-L761 PolarHBondContact O-N 3.45Å; Y758-M762 WeakPolarHBondContact O-CB 3.35Å; Y758-M762 VanDerWaalsContact O-CG 3.27Å; Y758-M762 WeakPolarHBondContact O-CG 3.37Å; Y758-M762 PolarHBondContact O-N 3.36Å
759	S	63.1	Low	53	Low	65 Å²	65	100.2 Å²	100.2	46%	0.455	55%	0.548	S	S	.	.	H	α-helix	trans	-63.7	-42.3	178.8	-59	0	0	0	0	112	A755 A756 W757 N763	A755-S759 WeakPolarHBondContact O-CB 2.92Å; A755-S759 PolarHBondContact O-N 2.85Å; A755-S759 PolarHBondContact O-OG 2.96Å; A756-S759 PolarHBondContact O-N 3Å; W757-S759 PolarHBondContact O-N 2.88Å; S759-N763 WeakPolarHBondContact O-CB 3.35Å; S759-N763 VanDerWaalsContact O-CG 3.23Å; S759-N763 PolarHBondContact O-N 2.82Å; S759-N763 PolarHBondContact O-ND2 3.1Å
760	A	65.9	Low	52.3	Low	61 Å²	61	106.6 Å²	106.6	50%	0.504	57%	0.569	S	S	.	*	H	α-helix	trans	-63.2	-42.8	175	0	0	0	0	0	111.9	A756 W757 N763 S764	A756-A760 WeakPolarHBondContact O-CB 3.41Å; A756-A760 PolarHBondContact O-N 3.44Å; W757-A760 PolarHBondContact O-N 2.9Å; A760-N763 PolarHBondContact O-N 3Å; A760-S764 WeakPolarHBondContact O-CB 3.27Å; A760-S764 PolarHBondContact O-N 3.47Å
761	L	59.1	Low	51.3	Low	95 Å²	95	107.3 Å²	107.3	50%	0.497	59%	0.585	S	S	.	*	H	α-helix	trans	-65.5	-44	178.8	-166.3	127.4	0	0	0	111.9	W757 Y758 N763 S764 A765	W757-L761 WeakPolarHBondContact O-CB 3.33Å; W757-L761 PolarHBondContact O-N 3.05Å; Y758-L761 PolarHBondContact O-N 3.45Å; L761-N763 PolarHBondContact O-N 3.05Å; L761-S764 PolarHBondContact O-N 2.78Å; L761-A765 PolarHBondContact O-N 3.23Å
762	M	58.6	Low	50.4	Low	103 Å²	103	111.1 Å²	111.1	51%	0.507	61%	0.605	S	S	.	*	H	α-helix	trans	-69.6	-29.1	177.6	-67.4	-63.5	-73.3	0	0	113.5	Y758 K766	Y758-M762 WeakPolarHBondContact O-CB 3.35Å; Y758-M762 VanDerWaalsContact O-CG 3.27Å; Y758-M762 WeakPolarHBondContact O-CG 3.37Å; Y758-M762 PolarHBondContact O-N 3.36Å; M762-K766 WeakPolarHBondContact O-CG 3.28Å
763	N	54.8	Low	49.2	Very low	89 Å²	89	110.2 Å²	110.2	48%	0.476	61%	0.609	S	S	.	*	H	α-helix	trans	-80.4	-35.9	174.5	-71.1	-16.8	0	0	0	112.1	S759 A760 L761 A765 K766 N767	S759-N763 WeakPolarHBondContact O-CB 3.35Å; S759-N763 VanDerWaalsContact O-CG 3.23Å; S759-N763 PolarHBondContact O-N 2.82Å; S759-N763 PolarHBondContact O-ND2 3.1Å; A760-N763 PolarHBondContact O-N 3Å; L761-N763 PolarHBondContact O-N 3.05Å; N763-A765 VanDerWaalsContact C-N 3.26Å; N763-A765 PolarHBondContact O-N 2.77Å; N763-K766 PolarHBondContact O-N 2.98Å; N763-K766 VanDerWaalsContact O-N 3.07Å; N763-N767 PolarHBondContact O-N 2.91Å
764	S	47	Very low	48	Very low	77 Å²	77	111.1 Å²	111.1	54%	0.538	62%	0.616	S	S	.	*	H	α-helix	trans	-58.2	-40.5	172	-164.9	0	0	0	0	111.5	A760 L761 K766	A760-S764 WeakPolarHBondContact O-CB 3.27Å; A760-S764 PolarHBondContact O-N 3.47Å; L761-S764 PolarHBondContact O-N 2.78Å; S764-K766 PolarHBondContact O-N 2.79Å
765	A	38.8	Very low	46.3	Very low	67 Å²	67	113.6 Å²	113.6	55%	0.554	63%	0.631	S	S	*	*	H	α-helix	trans	-70.6	-11.3	177.4	0	0	0	0	0	114.8	L761 N763	L761-A765 PolarHBondContact O-N 3.23Å; N763-A765 VanDerWaalsContact C-N 3.26Å; N763-A765 PolarHBondContact O-N 2.77Å
766	K	43.5	Very low	45.1	Very low	131 Å²	131	120.7 Å²	120.7	57%	0.57	66%	0.655	S	S	*	*	H	α-helix	trans	-97.8	-34.5	177.8	-74.3	177	178.2	179.1	0	113.1	M762 N763 S764 E768 N769	M762-K766 WeakPolarHBondContact O-CG 3.28Å; N763-K766 PolarHBondContact O-N 2.98Å; N763-K766 VanDerWaalsContact O-N 3.07Å; S764-K766 PolarHBondContact O-N 2.79Å; K766-E768 VanDerWaalsContact C-N 3.28Å; K766-E768 PolarHBondContact O-N 2.98Å; K766-N769 PolarHBondContact O-N 2.77Å
767	N	38.6	Very low	43.1	Very low	136 Å²	136	123.2 Å²	123.2	73%	0.727	67%	0.669	S	S	*	*	H	α-helix	trans	-76.6	-8.4	-172.3	-73.2	3.9	0	0	0	114.8	N763	N763-N767 PolarHBondContact O-N 2.91Å
768	E	38	Very low	41.6	Very low	168 Å²	168	123.7 Å²	123.7	79%	0.785	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.3	-3.6	173.8	-66.1	-173.1	138.4	0	0	113.6	K766	K766-E768 VanDerWaalsContact C-N 3.28Å; K766-E768 PolarHBondContact O-N 2.98Å
769	N	35	Very low	40	Very low	141 Å²	141	124 Å²	124	75%	0.754	69%	0.694	S	S	*	*	S	Bend	trans	-126.1	42.6	-173.9	-78.3	-72.8	0	0	0	114.4	K766	K766-N769 PolarHBondContact O-N 2.77Å
770	Q	32.1	Very low	38.5	Very low	185 Å²	185	126.8 Å²	126.8	86%	0.864	71%	0.709	S	S	*	*			trans	-146.9	111.5	170.8	-158.1	122.6	36	0	0	112
771	S	31.5	Very low	36.8	Very low	110 Å²	110	132.4 Å²	132.4	77%	0.769	72%	0.724	S	S	*	*			trans	-146.1	136.9	177	60.3	0	0	0	0	113.1
772	V	29.5	Very low	35.2	Very low	138 Å²	138	136.4 Å²	136.4	84%	0.836	74%	0.737	S	S	*	*			trans	71.4	152	173.3	-166.7	0	0	0	0	115.8
773	S	31.6	Very low	33.8	Very low	100 Å²	100	137.1 Å²	137.1	70%	0.699	75%	0.749	S	S	*	*			trans	65.9	127.8	-166.6	63.1	0	0	0	0	114.8
774	D	31.8	Very low	32.4	Very low	151 Å²	151	139.5 Å²	139.5	81%	0.807	76%	0.761	S	S	*	*			cis	-145.6	172.6	-5	-102.6	-37.4	0	0	0	112.5
775	N	27.5	Very low	31.5	Very low	152 Å²	152	140.6 Å²	140.6	81%	0.813	77%	0.767	S	S	*	*			trans	-76.2	132.3	-175.7	-44.4	-89.4	0	0	0	112.5
776	E	31.5	Very low	31	Very low	198 Å²	198	144.5 Å²	144.5	93%	0.925	78%	0.779	S	S	*	*			trans	-156.8	145.9	136.7	-125	170.6	-159.1	0	0	111.4
777	S	26	Very low	30.3	Very low	112 Å²	112	146.6 Å²	146.6	78%	0.783	79%	0.791	S	S	*	*			trans	-124.3	115.1	-169.3	61.2	0	0	0	0	112.1
778	L	31.2	Very low	29.7	Very low	173 Å²	173	145.2 Å²	145.2	91%	0.906	79%	0.792	S	S	*	*			trans	-142.8	108.3	169.5	-103.7	155	0	0	0	110.4
779	N	25.1	Very low	29.2	Very low	152 Å²	152	143 Å²	143	81%	0.813	79%	0.789	S	S	*	*			trans	-65.8	157.5	157.4	-78.9	-60.8	0	0	0	109.3
780	V	31.6	Very low	29	Very low	124 Å²	124	144 Å²	144	75%	0.752	80%	0.795	S	S	*	*				174.3	145.6	123.8	148.7	0	0	0	0	112.3
781	H	29.6	Very low	28.7	Very low	179 Å²	179	143.3 Å²	143.3	83%	0.829	79%	0.794	S	S	*	*			trans	62.8	116.7	168.5	-75.4	-53	0	0	0	122.7
782	K	25.1	Very low	28.6	Very low	179 Å²	179	147.4 Å²	147.4	78%	0.778	80%	0.801	S	S	*	*			trans	-84.1	156.2	143.8	-74.5	-176.7	173.1	-175.1	0	110.6
783	P	29.4	Very low	28.6	Very low	117 Å²	117	149.4 Å²	149.4	76%	0.76	80%	0.801	S	S	*	*				-108.9	155.2	111.5	33.8	-34.4	0	0	0	110.7
784	I	25.9	Very low	28.5	Very low	139 Å²	139	149.3 Å²	149.3	71%	0.713	80%	0.798	S	S	*	*			cis	88	133.9	24	-58.3	176.2	0	0	0	113.2
785	C	28.1	Very low	28.3	Very low	100 Å²	100	149.8 Å²	149.8	68%	0.676	80%	0.8	S	S	*	*			trans	70.5	143.8	-176	-60.6	0	0	0	0	117.2
786	D	28.6	Very low	28.1	Very low	150 Å²	150	148.2 Å²	148.2	80%	0.802	80%	0.796	S	S	*	*			cis	-158.6	-177.3	-23	-104.7	-21.1	0	0	0	111.2
787	E	28.1	Very low	27.9	Very low	175 Å²	175	147.3 Å²	147.3	82%	0.818	79%	0.789	S	S	*	*			trans	-86.6	160.3	-166.1	-60.1	-176.8	109.4	0	0	117
788	S	27	Very low	27.8	Very low	106 Å²	106	146.9 Å²	146.9	74%	0.741	79%	0.786	S	S	*	*			trans	75.8	110.9	144.4	66.1	0	0	0	0	122.1
789	V	27.2	Very low	27.6	Very low	122 Å²	122	147.3 Å²	147.3	74%	0.739	78%	0.781	S	S	*	*				46.2	119.7	116.4	-179.2	0	0	0	0	119.2
790	N	29.9	Very low	27.7	Very low	163 Å²	163	144.6 Å²	144.6	87%	0.872	77%	0.771	S	S	*	*				-153.3	160.9	117.4	-108	-36.9	0	0	0	113.4
791	M	26.8	Very low	27.4	Very low	169 Å²	169	149 Å²	149	83%	0.833	78%	0.78	S	S	*	*			trans	-125.9	143	-178	-77	-111	-164.5	0	0	109.6
792	E	29.8	Very low	27.3	Very low	197 Å²	197	146 Å²	146	92%	0.921	78%	0.775	S	S	*	*			trans	-133.9	145.1	154.4	-71.1	-160.5	135.5	0	0	111.2
793	Q	29.3	Very low	27.4	Very low	180 Å²	180	144.7 Å²	144.7	84%	0.841	78%	0.777	S	S	*	*			trans	-106.5	-160.6	169.6	-46.8	179.3	-32.3	0	0	107
794	P	29.4	Very low	27.4	Very low	98 Å²	98	144.1 Å²	144.1	64%	0.636	77%	0.773	S	S	*	*			cis	-127.3	161.9	-25.5	36.8	-23.1	0	0	0	112.6
795	L	27	Very low	27.4	Very low	161 Å²	161	146.8 Å²	146.8	84%	0.843	78%	0.78	S	S	*	*			trans	-141.6	100.5	146.7	-88.5	-173.1	0	0	0	111
796	T	24.1	Very low	27.4	Very low	119 Å²	119	148.7 Å²	148.7	73%	0.73	78%	0.782	S	S	*	*			trans	-74.7	116.6	168.8	45.8	0	0	0	0	110.6
797	F	27.4	Very low	27.3	Very low	179 Å²	179	150.3 Å²	150.3	79%	0.785	78%	0.782	S	S	*	*			trans	-108.6	98.4	161.4	-98	-78.1	0	0	0	110.2	F799	F797-F799 HydrophobicContact CD1-CE2 4.46Å
798	S	23.3	Very low	27.2	Very low	102 Å²	102	146.1 Å²	146.1	71%	0.713	77%	0.773	S	S	*	*			trans	-87.2	122.2	178.5	-56	0	0	0	0	110.8
799	F	27.4	Very low	27.1	Very low	183 Å²	183	147.4 Å²	147.4	80%	0.803	78%	0.776	S	S	*	*			trans	-133.6	149.9	158.8	-82.6	-76.6	0	0	0	109.6	F797	F797-F799 HydrophobicContact CD1-CE2 4.46Å
800	P	27.2	Very low	27.2	Very low	94 Å²	94	146.1 Å²	146.1	61%	0.61	77%	0.772	S	S	*	*			trans	-96.3	143.7	-133	33.1	-37.2	0	0	0	116	T802	P800-T802 WeakPolarHBondContact CG-OG1 3.47Å; P800-T802 PolarHBondContact O-N 3.09Å
801	F	25	Very low	27.1	Very low	216 Å²	216	145 Å²	145	95%	0.947	77%	0.766	S	S	*	*			trans	-73	108.9	146.7	-88.1	-96.5	0	0	0	108.4
802	T	27.9	Very low	27.3	Very low	116 Å²	116	144.4 Å²	144.4	71%	0.712	77%	0.766	S	S	*	*			trans	-116.5	90.5	179.9	-6.8	0	0	0	0	112	P800	P800-T802 WeakPolarHBondContact CG-OG1 3.47Å; P800-T802 PolarHBondContact O-N 3.09Å
803	N	26.5	Very low	27.4	Very low	152 Å²	152	139.6 Å²	139.6	81%	0.813	75%	0.75	S	S	*	*			trans	42	140.2	155.3	-75.6	-25.8	0	0	0	123
804	P	29.3	Very low	27.5	Very low	106 Å²	106	136.8 Å²	136.8	69%	0.688	75%	0.747	S	S	*	*			trans	-87.5	156.3	168.1	37.4	-34.7	0	0	0	112.9
805	K	26.4	Very low	27.5	Very low	195 Å²	195	138.5 Å²	138.5	85%	0.848	75%	0.751	S	S	*	*			trans	67.3	135.1	173.2	-52.2	173.7	-178.3	175.8	0	115.5
806	L	28.3	Very low	27.6	Very low	139 Å²	139	136.9 Å²	136.9	73%	0.728	75%	0.748	S	S	*	*				171.8	133.7	121.5	-89.5	-168.9	0	0	0	110.2
807	F	26.4	Very low	27.8	Very low	184 Å²	184	135.4 Å²	135.4	81%	0.807	74%	0.743	S	S	*	*			trans	52	152.1	153	-59.4	-50.2	0	0	0	121.1
808	S	24.9	Very low	27.8	Very low	88 Å²	88	133.1 Å²	133.1	62%	0.615	74%	0.738	S	S	*	*			cis	-174.6	138.1	-19.7	51.2	0	0	0	0	111.4
809	T	26.7	Very low	28.1	Very low	133 Å²	133	136.4 Å²	136.4	82%	0.816	74%	0.743	S	S	*	*			trans	61.5	167.1	157.6	19.6	0	0	0	0	117.3
810	S	28	Very low	28.2	Very low	94 Å²	94	131.7 Å²	131.7	66%	0.657	73%	0.732	S	S	*	*			cis	-155.3	143.1	-1.1	33.4	0	0	0	0	112.4
811	L	27.4	Very low	28.2	Very low	141 Å²	141	134.4 Å²	134.4	74%	0.738	74%	0.74	S	S	*	*			trans	31.7	130	136.9	-64.4	152.7	0	0	0	120.4
812	N	31.6	Very low	28.3	Very low	156 Å²	156	129.2 Å²	129.2	83%	0.834	73%	0.73	S	S	*	*				-166.2	166.4	93.3	-100.5	-44.9	0	0	0	114.4
813	V	32.9	Very low	28.4	Very low	96 Å²	96	128.8 Å²	128.8	58%	0.582	73%	0.732	S	S	*	*			trans	-144.6	149.4	-166.1	169.1	0	0	0	0	110.4
814	P	31.4	Very low	28.4	Very low	120 Å²	120	132.1 Å²	132.1	78%	0.779	73%	0.733	S	S	*	*			trans	-117.6	124.7	140	34	-24.9	0	0	0	109.5
815	N	27.7	Very low	28.4	Very low	135 Å²	135	134.7 Å²	134.7	72%	0.722	74%	0.741	S	S	*	*				54.7	119	52.5	-57.6	-15.3	0	0	0	110.2
816	T	30.5	Very low	28.4	Very low	126 Å²	126	134.5 Å²	134.5	77%	0.773	74%	0.74	S	S	*	*			cis	-136.2	142.4	44.9	44.7	0	0	0	0	112.1
817	S	27.4	Very low	28.3	Very low	89 Å²	89	135 Å²	135	62%	0.622	74%	0.738	S	S	*	*				71.7	140.1	75.8	111.3	0	0	0	0	112.7
818	D	28.4	Very low	28.4	Very low	130 Å²	130	133.9 Å²	133.9	70%	0.695	73%	0.733	S	S	*	*			cis	-154.8	161.8	15.7	-101.7	-43.7	0	0	0	114.3
819	E	30	Very low	28.5	Very low	172 Å²	172	136.9 Å²	136.9	80%	0.804	74%	0.738	S	S	*	*			trans	57.4	156.2	144.3	-69.4	-170.5	169.1	0	0	123.3
820	S	27.8	Very low	28.6	Very low	84 Å²	84	139.4 Å²	139.4	59%	0.587	74%	0.737	S	S	*	*			cis	-167.5	159.5	-25.8	61.4	0	0	0	0	114
821	I	27.1	Very low	28.4	Very low	151 Å²	151	141.4 Å²	141.4	77%	0.774	74%	0.74	S	S	*	*			trans	59.7	113.6	134.9	-71.5	166.6	0	0	0	121
822	S	27.3	Very low	28.3	Very low	106 Å²	106	140.7 Å²	140.7	74%	0.741	74%	0.737	S	S	*	*			trans	68.7	148.6	132.9	-135.9	0	0	0	0	119.1
823	S	30.2	Very low	28.2	Very low	108 Å²	108	140.1 Å²	140.1	76%	0.755	73%	0.734	S	S	*	*			cis	-159.2	149.9	37.2	47	0	0	0	0	117.9
824	R	27.5	Very low	27.9	Very low	221 Å²	221	144.4 Å²	144.4	83%	0.834	74%	0.741	S	S	*	*			trans	-26.1	135.4	156.8	-73.4	168.3	162.5	169.4	-7	115.1
825	L	28.5	Very low	27.9	Very low	160 Å²	160	144 Å²	144	84%	0.838	74%	0.738	S	S	*	*				48.6	104.7	85.2	-90.3	172.7	0	0	0	114.8
826	K	26.3	Very low	27.9	Very low	191 Å²	191	143 Å²	143	83%	0.83	73%	0.732	S	S	*	*			trans	179.3	153.6	135.4	-106.3	168.6	-176.9	-176	0	112.8
827	Q	27.3	Very low	27.7	Very low	150 Å²	150	143.6 Å²	143.6	70%	0.701	73%	0.73	S	S	*	*			trans	70.7	146.1	165.2	-66.1	176	89.4	0	0	115.8
828	K	28.5	Very low	27.8	Very low	160 Å²	160	143.4 Å²	143.4	70%	0.696	73%	0.729	S	S	*	*			cis	-154	169.5	-3.8	-133.3	162.1	-174.8	160	0	112.6
829	E	26.2	Very low	27.7	Very low	152 Å²	152	143 Å²	143	71%	0.71	73%	0.726	S	S	*	*			trans	-66.7	147.3	168.4	-37.1	102.2	106.8	0	0	112
830	K	28.6	Very low	27.7	Very low	185 Å²	185	141.6 Å²	141.6	80%	0.804	72%	0.719	S	S	*	*			trans	170.4	119.7	131.8	-92.4	160	-174.5	-170.8	0	109.8
831	L	25.1	Very low	27.6	Very low	136 Å²	136	145.1 Å²	145.1	71%	0.712	72%	0.724	S	S	*	*				74.9	121.7	86.6	-100.3	74.5	0	0	0	114
832	N	25	Very low	27.7	Very low	127 Å²	127	144.4 Å²	144.4	68%	0.679	72%	0.718	S	S	*	*			trans	60.9	134	146.6	-48.8	-1.4	0	0	0	117.4
833	N	28.6	Very low	27.7	Very low	143 Å²	143	146.3 Å²	146.3	77%	0.765	72%	0.719	S	S	*	*			cis	-157.3	157.7	46.8	-80.4	-71.2	0	0	0	114.6
834	Y	27.3	Very low	27.6	Very low	186 Å²	186	149.3 Å²	149.3	73%	0.729	72%	0.722	S	S	*	*			trans	-13.7	167.3	138.9	-72.2	-61.5	0	0	0	120.5	I836	Y834-I836 HydrophobicContact CD1-CB 4.47Å; Y834-I836 HydrophobicContact CD1-CD1 3.55Å; Y834-I836 HydrophobicContact CD1-CG1 3.83Å; Y834-I836 HydrophobicContact CE1-CD1 3.44Å; Y834-I836 VanDerWaalsContact CE1-CD1 3.44Å; Y834-I836 HydrophobicContact CE1-CG1 4.05Å; Y834-I836 HydrophobicContact CG-CD1 4.48Å
835	P	31.2	Very low	27.5	Very low	112 Å²	112	146.1 Å²	146.1	73%	0.727	72%	0.716	S	S	*	*			cis	-126.8	170	22.4	46.3	-30.7	0	0	0	114.4
836	I	26.6	Very low	27.5	Very low	114 Å²	114	144 Å²	144	59%	0.585	71%	0.709	S	S	*	*			cis	60.2	116.2	46.3	-69.3	178.6	0	0	0	109.5	Y834	Y834-I836 HydrophobicContact CD1-CB 4.47Å; Y834-I836 HydrophobicContact CD1-CD1 3.55Å; Y834-I836 HydrophobicContact CD1-CG1 3.83Å; Y834-I836 HydrophobicContact CE1-CD1 3.44Å; Y834-I836 VanDerWaalsContact CE1-CD1 3.44Å; Y834-I836 HydrophobicContact CE1-CG1 4.05Å; Y834-I836 HydrophobicContact CG-CD1 4.48Å
837	D	27.3	Very low	27.6	Very low	138 Å²	138	141 Å²	141	74%	0.738	70%	0.702	S	S	*	*				-170.3	176.1	71.5	-120.9	-49.6	0	0	0	106.3
838	S	28.6	Very low	27.7	Very low	86 Å²	86	141.8 Å²	141.8	60%	0.601	70%	0.704	S	S	*	*			cis	-171.4	165.4	9.7	-108.2	0	0	0	0	104.9
839	L	27.6	Very low	27.6	Very low	120 Å²	120	142 Å²	142	63%	0.628	71%	0.707	S	S	*	*			cis	-167.7	139.1	-9.4	-107.9	164.4	0	0	0	107.4
840	Q	28.9	Very low	27.8	Very low	144 Å²	144	138.8 Å²	138.8	67%	0.673	70%	0.702	S	S	*	*			trans	54.9	162.2	145.8	-72.5	170.5	-1.2	0	0	119.7
841	F	27.1	Very low	27.9	Very low	157 Å²	157	136.1 Å²	136.1	69%	0.689	70%	0.704	S	S	*	*			cis	-154.1	176	-8.3	-113.9	-26.4	0	0	0	106.9
842	H	29.1	Very low	28.1	Very low	137 Å²	137	138 Å²	138	63%	0.634	71%	0.706	S	S	*	*			cis	-140.1	-155.2	1.5	-152.2	68.6	0	0	0	108.6
843	N	26.2	Very low	28.3	Very low	145 Å²	145	139.2 Å²	139.2	78%	0.775	71%	0.707	S	S	*	*			trans	-130.7	158.2	164.4	-68.3	-62.6	0	0	0	110.5
844	Q	28.1	Very low	28.2	Very low	172 Å²	172	141.4 Å²	141.4	80%	0.804	72%	0.716	S	S	*	*			trans	156.8	150.1	145.8	-88.7	-168.2	-59.2	0	0	109.5
845	E	25.7	Very low	28.3	Very low	153 Å²	153	139.1 Å²	139.1	72%	0.715	72%	0.716	S	S	*	*			cis	-168.5	-179.2	-25.7	-163.7	152.4	-157.7	0	0	108.1
846	V	28.8	Very low	28.6	Very low	116 Å²	116	138.6 Å²	138.6	70%	0.703	71%	0.712	S	S	*	*			trans	73.7	87.9	162.6	-167.6	0	0	0	0	118.9
847	D	28.4	Very low	28.6	Very low	127 Å²	127	138.3 Å²	138.3	68%	0.679	72%	0.72	S	S	*	*				67.4	126.9	114.2	-63.5	-4.1	0	0	0	126
848	F	27.9	Very low	28.8	Very low	167 Å²	167	142.9 Å²	142.9	73%	0.732	73%	0.727	S	S	*	*				53	147.7	124.5	-66.4	-50.9	0	0	0	123.1
849	Q	28	Very low	29	Very low	164 Å²	164	146.9 Å²	146.9	77%	0.766	74%	0.737	S	S	*	*			cis	-159.1	164.7	-15.3	-155.9	161.6	34.8	0	0	110.6
850	S	30.2	Very low	28.9	Very low	86 Å²	86	148.6 Å²	148.6	60%	0.601	75%	0.746	S	S	*	*			trans	-81.3	164.4	173.1	61.7	0	0	0	0	114.1
851	P	30.6	Very low	28.9	Very low	129 Å²	129	150.6 Å²	150.6	84%	0.838	75%	0.752	S	S	*	*			trans	-105.7	158.4	142	35.2	-30.6	0	0	0	113.2
852	K	29	Very low	29.1	Very low	174 Å²	174	150.4 Å²	150.4	76%	0.757	76%	0.757	S	S	*	*			trans	-128.1	152.2	179.6	-84.2	-178.1	178.7	174.4	0	111.4
853	Q	28.3	Very low	29.3	Very low	153 Å²	153	150.8 Å²	150.8	72%	0.715	76%	0.764	S	S	*	*			trans	54	126.5	147.9	-67.9	173.6	-66.2	0	0	120.2
854	M	28.2	Very low	29.5	Very low	190 Å²	190	148.9 Å²	148.9	94%	0.936	76%	0.762	S	S	*	*				-110.2	161.9	129.7	-75.1	-164.6	75.8	0	0	109.7
855	N	29.1	Very low	29.7	Very low	138 Å²	138	147.5 Å²	147.5	74%	0.738	76%	0.76	S	S	*	*			trans	-124.7	-166.4	-175	-142.7	-1.3	0	0	0	109.6
856	P	36	Very low	30.3	Very low	100 Å²	100	147.5 Å²	147.5	65%	0.649	76%	0.764	S	S	*	*				-119.6	-173.5	-127.9	39.4	-21.6	0	0	0	114.8
857	S	27.3	Very low	30.6	Very low	108 Å²	108	148.8 Å²	148.8	76%	0.755	77%	0.768	S	S	*	*			trans	115.8	118.2	153.2	-51	0	0	0	0	116.5
858	R	31.6	Very low	31	Very low	235 Å²	235	151.2 Å²	151.2	89%	0.887	77%	0.772	S	S	*	*			trans	-166.9	109.2	134.9	-106.5	164.5	-161.7	-133.7	3.5	113.5
859	Q	32	Very low	31.4	Very low	170 Å²	170	152.5 Å²	152.5	79%	0.794	78%	0.778	S	S	*	*			trans	47.7	105.1	136.3	-63.4	-178.5	-9.2	0	0	121.7
860	L	26.9	Very low	32.1	Very low	156 Å²	156	147 Å²	147	82%	0.817	76%	0.755	S	S	*	*				63.1	143.1	112.6	-78.4	165.6	0	0	0	123.6
861	K	28.5	Very low	32.6	Very low	185 Å²	185	150 Å²	150	80%	0.804	76%	0.763	S	S	*	*			trans	69.2	111.7	155.4	-74.1	178.4	175.5	178.6	0	118.9
862	L	32	Very low	33	Very low	153 Å²	153	148.5 Å²	148.5	80%	0.801	76%	0.755	S	S	*	*				-170.2	102.1	119.8	-95.1	165.6	0	0	0	106
863	N	31.9	Very low	33.8	Very low	145 Å²	145	144.8 Å²	144.8	78%	0.775	75%	0.751	S	S	*	*				89.4	146.4	101.3	-82.5	17.9	0	0	0	113.8
864	S	31.9	Very low	34.5	Very low	106 Å²	106	144.8 Å²	144.8	74%	0.741	76%	0.755	S	S	*	*			trans	-75.4	124.6	-176.9	50.9	0	0	0	0	112.4
865	D	32.6	Very low	35	Very low	143 Å²	143	143 Å²	143	77%	0.765	75%	0.749	S	S	*	*			trans	-178.1	106.1	130	-100.1	-24.8	0	0	0	111.6
866	L	36.5	Very low	35.2	Very low	152 Å²	152	143.5 Å²	143.5	80%	0.796	75%	0.752	S	S	*	*			trans	-155.6	77	155.1	-143.9	72.2	0	0	0	113.3
867	N	35.3	Very low	35.3	Very low	144 Å²	144	145.6 Å²	145.6	77%	0.77	76%	0.763	S	S	*	*			trans	-62.7	152.4	158.2	-88.3	-73.1	0	0	0	110.5
868	K	36.6	Very low	35.6	Very low	178 Å²	178	148 Å²	148	77%	0.774	76%	0.762	S	S	*	*			trans	83.8	53.8	175.5	-48.6	173.5	-177.9	173.1	0	118.1	T870	K868-T870 PolarHBondContact O-N 3.4Å; K868-T870 PolarHBondContact O-OG1 3.48Å
869	F	37.8	Very low	35.6	Very low	194 Å²	194	144.7 Å²	144.7	85%	0.851	76%	0.756	S	S	*	*			trans	-60.2	119.1	147.7	-85.1	-82.6	0	0	0	109.2
870	T	41.5	Very low	35.7	Very low	49 Å²	49	148.8 Å²	148.8	30%	0.301	77%	0.765	S	S	.	*			trans	-118.7	140.8	-175.5	-54.6	0	0	0	0	109.3	T328 K868 S872 S873	T328-T870 HydrophobicContact CG2-CG2 4.07Å; K868-T870 PolarHBondContact O-N 3.4Å; K868-T870 PolarHBondContact O-OG1 3.48Å; T870-S872 PolarHBondContact O-N 3Å; T870-S873 PolarHBondContact O-N 3.27Å
871	I	41.1	Very low	36	Very low	149 Å²	149	149.3 Å²	149.3	76%	0.764	76%	0.763	S	S	*	*	G	3₁₀ helix	trans	-59.2	-21.3	-168.7	-64.4	173.2	0	0	0	113.2	S873 L874	I871-S873 PolarHBondContact O-N 3.35Å; I871-S873 VanDerWaalsContact O-N 3.09Å; I871-L874 PolarHBondContact O-N 3.32Å
872	S	40.1	Very low	36.1	Very low	96 Å²	96	146.4 Å²	146.4	67%	0.671	76%	0.755	S	S	*	*	G	3₁₀ helix	trans	-59.2	-14.2	175.8	-49.3	0	0	0	0	115.6	T870	T870-S872 PolarHBondContact O-N 3Å
873	S	45.6	Very low	36	Very low	96 Å²	96	148.6 Å²	148.6	67%	0.671	76%	0.758	S	S	*	*	G	3₁₀ helix	trans	-88.3	5.2	-177.3	-58.7	0	0	0	0	115.4	T870 I871	T870-S873 PolarHBondContact O-N 3.27Å; I871-S873 PolarHBondContact O-N 3.35Å; I871-S873 VanDerWaalsContact O-N 3.09Å
874	L	42.6	Very low	35.8	Very low	153 Å²	153	147.7 Å²	147.7	80%	0.801	76%	0.758	S	S	*	*	G	3₁₀ helix	trans	-116.8	11.9	-174.2	-79.2	169.5	0	0	0	115.2	I871	I871-L874 PolarHBondContact O-N 3.32Å
875	L	37.5	Very low	35.7	Very low	152 Å²	152	148 Å²	148	80%	0.796	76%	0.757	S	S	*	*	S	Bend	trans	-131.3	15.7	-175.6	-73.4	173.1	0	0	0	115.2
876	N	34.9	Very low	35.5	Very low	150 Å²	150	147.5 Å²	147.5	80%	0.802	76%	0.759	S	S	*	*			trans	-116.3	62.1	179.7	-78.8	8.1	0	0	0	113
877	T	37.2	Very low	35.1	Very low	143 Å²	143	144.8 Å²	144.8	88%	0.877	75%	0.753	S	S	*	*			trans	-144.4	72.7	162.1	53	0	0	0	0	110.5
878	E	34.3	Very low	34.9	Very low	160 Å²	160	148 Å²	148	75%	0.748	76%	0.76	S	S	*	*			trans	-86.8	156	164.4	-89.5	-160.6	-171.2	0	0	111.7
879	Q	31.3	Very low	34.5	Very low	164 Å²	164	145.1 Å²	145.1	77%	0.766	76%	0.757	S	S	*	*			trans	54	94.5	154.8	-62.7	173.4	49.7	0	0	118.4
880	R	34.6	Very low	34.1	Very low	257 Å²	257	140.4 Å²	140.4	97%	0.97	75%	0.754	S	S	*	*			trans	-131.7	140.8	137.1	-84.9	-164.2	171.3	-166.2	-3.4	110.5
881	Q	33.3	Very low	33.5	Very low	166 Å²	166	145.7 Å²	145.7	78%	0.776	78%	0.775	S	S	*	*			trans	-104.5	153.6	-169.5	-81.9	179.8	-21.1	0	0	113.2
882	I	28.7	Very low	33	Very low	124 Å²	124	148 Å²	148	64%	0.636	78%	0.78	S	S	*	*			trans	53.1	100.1	138.4	-59.7	164.4	0	0	0	118
883	K	31.5	Very low	32.4	Very low	199 Å²	199	148.9 Å²	148.9	87%	0.865	78%	0.777	S	S	*	*				175.6	117.9	109.7	-107.6	144.2	-174	174.7	0	114.1
884	T	27.5	Very low	31.7	Very low	127 Å²	127	150 Å²	150	78%	0.779	78%	0.776	S	S	*	*			trans	-71.6	160.4	150.4	7.1	0	0	0	0	109.4
885	P	29.7	Very low	31	Very low	112 Å²	112	149.5 Å²	149.5	73%	0.727	77%	0.773	S	S	*	*				-142.7	145.3	55.8	42.3	-23.1	0	0	0	116.2
886	V	27.3	Very low	30.6	Very low	133 Å²	133	147 Å²	147	81%	0.806	77%	0.769	S	S	*	*				95.6	150.4	104.3	170.1	0	0	0	0	115.4
887	S	29.2	Very low	30.2	Very low	94 Å²	94	145.3 Å²	145.3	66%	0.657	77%	0.767	S	S	*	*			trans	-76	169.9	-160	56.7	0	0	0	0	117.6
888	K	31.2	Very low	29.6	Very low	212 Å²	212	144.5 Å²	144.5	92%	0.922	76%	0.757	S	S	*	*				-148.9	160.4	113.8	-108.3	168.7	-174.7	178.4	0	111.6
889	V	28	Very low	29.2	Very low	117 Å²	117	143.2 Å²	143.2	71%	0.709	76%	0.756	S	S	*	*			trans	-135.7	144.5	-166.1	172.1	0	0	0	0	110.3	Q891	V889-Q891 HydrophobicContact CG1-CG 4.28Å
890	A	29.4	Very low	28.9	Very low	96 Å²	96	140.2 Å²	140.2	79%	0.793	75%	0.748	S	S	*	*			trans	-147.4	112.2	153.9	0	0	0	0	0	106.6
891	Q	29.2	Very low	28.5	Very low	159 Å²	159	135 Å²	135	74%	0.743	74%	0.739	S	S	*	*				62.7	91.7	57.9	-77.2	-170.3	-42.3	0	0	115.5	V889	V889-Q891 HydrophobicContact CG1-CG 4.28Å
892	K	30.9	Very low	28.2	Very low	199 Å²	199	130.5 Å²	130.5	87%	0.865	73%	0.726	S	S	*	*				-126.4	135.1	112.8	-75.7	-174.3	175.4	-179.7	0	106.4
893	N	27.2	Very low	28	Very low	114 Å²	114	130.7 Å²	130.7	61%	0.61	73%	0.728	S	S	*	*				65.2	122	62.7	-75.3	66.2	0	0	0	110.9
894	D	30.5	Very low	27.7	Very low	120 Å²	120	127.3 Å²	127.3	64%	0.642	72%	0.718	S	S	*	*			cis	-141.6	152.5	16.9	-75.2	-64.7	0	0	0	115
895	N	28.1	Very low	27.7	Very low	141 Å²	141	128.9 Å²	128.9	75%	0.754	72%	0.717	S	S	*	*			trans	28.4	144	132.6	-54	-41.7	0	0	0	121.3
896	S	29.2	Very low	27.6	Very low	99 Å²	99	129.6 Å²	129.6	69%	0.692	71%	0.714	S	S	*	*			cis	-172.9	164	-4.4	50.8	0	0	0	0	112
897	C	25.6	Very low	27.5	Very low	115 Å²	115	129.8 Å²	129.8	78%	0.777	72%	0.715	S	S	*	*			trans	53.4	161.4	149.6	-69.1	0	0	0	0	122.4
898	L	25.6	Very low	27.3	Very low	126 Å²	126	130 Å²	130	66%	0.66	72%	0.716	S	S	*	*			cis	-166.5	-167.6	-44	-122.9	169.5	0	0	0	108.8	K9	K9-L898 PolarHBondContact NZ-O 3.47Å; K9-L898 VanDerWaalsContact NZ-O 3.11Å
899	N	25.7	Very low	26.9	Very low	134 Å²	134	124.8 Å²	124.8	72%	0.717	71%	0.706	S	S	*	*			trans	-60.2	170.6	179.3	-60.2	-30.9	0	0	0	112.9
900	V	24.6	Very low	26.8	Very low	101 Å²	101	125.7 Å²	125.7	61%	0.612	71%	0.707	S	S	*	*				-163.5	146.6	54.1	164.5	0	0	0	0	112.8	I10	I10-V900 WeakPolarHBondContact CD1-O 3.42Å
901	L	25.9	Very low	26.7	Very low	147 Å²	147	125.4 Å²	125.4	77%	0.77	70%	0.699	S	S	*	*			trans	-3.8	147.8	159.3	-64.2	151.3	0	0	0	123.7
902	S	26.3	Very low	26.5	Very low	72 Å²	72	123 Å²	123	50%	0.503	70%	0.699	S	S	.	*				141.5	148.4	111.4	63.5	0	0	0	0	118.4
903	N	24.9	Very low	26.5	Very low	128 Å²	128	118.8 Å²	118.8	68%	0.684	69%	0.691	S	S	*	*			trans	70.8	154.4	163.4	-54.3	-16.5	0	0	0	118.4
904	L	26.5	Very low	26.5	Very low	127 Å²	127	119.9 Å²	119.9	67%	0.665	70%	0.696	S	S	*	*			cis	-143.4	-161.6	3.8	-154.9	74	0	0	0	111.8
905	E	26.9	Very low	26.3	Very low	161 Å²	161	118.4 Å²	118.4	75%	0.752	70%	0.696	S	S	*	*			trans	-122.8	148.2	-162.9	-86.8	-172.5	126.7	0	0	117.1
906	I	27.8	Very low	26.3	Very low	127 Å²	127	116.7 Å²	116.7	65%	0.651	70%	0.695	S	S	*	*			trans	69.1	135.8	136	-64.3	170.7	0	0	0	122.6
907	T	25.4	Very low	26.3	Very low	137 Å²	137	120 Å²	120	84%	0.84	70%	0.703	S	S	*	*			trans	66.7	156.9	166.9	46.6	0	0	0	0	118.1
908	S	23.8	Very low	26.6	Very low	97 Å²	97	123 Å²	123	68%	0.678	71%	0.706	S	S	*	*			cis	-149.3	160.3	15.6	54.9	0	0	0	0	113.8
909	C	24.4	Very low	26.6	Very low	104 Å²	104	125.6 Å²	125.6	70%	0.703	72%	0.72	S	S	*	*			trans	68.6	149	154.4	-67	0	0	0	0	118.2
910	D	26	Very low	26.7	Very low	136 Å²	136	123.9 Å²	123.9	73%	0.727	72%	0.719	S	S	*	*			cis	-154	168.1	-8.2	-116	-29.5	0	0	0	113.4
911	S	26.4	Very low	26.8	Very low	90 Å²	90	126.7 Å²	126.7	63%	0.629	73%	0.73	S	S	*	*			trans	27.7	111.5	152.8	70.2	0	0	0	0	119.6
912	S	26	Very low	27	Very low	108 Å²	108	129.1 Å²	129.1	76%	0.755	74%	0.737	S	S	*	*				79	156.9	101.2	80.7	0	0	0	0	114.7
913	T	29.7	Very low	27	Very low	111 Å²	111	135 Å²	135	68%	0.681	76%	0.757	S	S	*	*			cis	-134.7	172.3	9.2	45.2	0	0	0	0	112.1
914	D	27.5	Very low	27.1	Very low	136 Å²	136	137.8 Å²	137.8	73%	0.727	76%	0.763	S	S	*	*			trans	37.3	149.4	139.1	-71.2	-56.1	0	0	0	123.6
915	S	26.7	Very low	27.2	Very low	90 Å²	90	141.3 Å²	141.3	63%	0.629	77%	0.769	S	S	*	*			cis	-174.5	168.6	-21.7	-112.6	0	0	0	0	109.3
916	S	27.3	Very low	27.2	Very low	105 Å²	105	141.7 Å²	141.7	73%	0.734	78%	0.776	S	S	*	*			trans	63.7	115.5	159.7	-57.3	0	0	0	0	119.2
917	L	29.7	Very low	27.3	Very low	167 Å²	167	145.2 Å²	145.2	87%	0.874	79%	0.787	S	S	*	*				-177	160.2	96.6	-95.5	171.3	0	0	0	113.4
918	Q	32.6	Very low	27.5	Very low	180 Å²	180	147.2 Å²	147.2	84%	0.841	78%	0.784	S	S	*	*			trans	65.8	72.9	168.8	-56.5	-133.6	-6.2	0	0	118.3
919	L	25.7	Very low	28	Very low	179 Å²	179	149.2 Å²	149.2	94%	0.937	78%	0.78	S	S	*	*			trans	-78.3	125	159.6	-170.4	81.5	0	0	0	110.6
920	S	27.8	Very low	28.4	Very low	99 Å²	99	148 Å²	148	69%	0.692	77%	0.771	S	S	*	*			trans	-152.4	123.4	162.5	62.5	0	0	0	0	115.5
921	N	25.5	Very low	28.7	Very low	159 Å²	159	146.6 Å²	146.6	85%	0.85	76%	0.763	S	S	*	*			trans	48.8	68.5	149.9	-61.3	-18.6	0	0	0	120.3
922	Q	30.5	Very low	29	Very low	198 Å²	198	146.7 Å²	146.7	93%	0.925	76%	0.761	S	S	*	*			trans	-149.8	64	153.9	-134.1	165	79.1	0	0	114.3
923	Q	26.5	Very low	29.3	Very low	196 Å²	196	144.4 Å²	144.4	92%	0.916	74%	0.738	S	S	*	*			trans	-132.3	95.2	171.3	-75.8	-170.9	-9.3	0	0	112.4
924	K	27.6	Very low	29.3	Very low	187 Å²	187	142.5 Å²	142.5	81%	0.813	73%	0.729	S	S	*	*			trans	-165.4	156.4	159.1	-115.2	172	-177	175.4	0	109.1
925	Y	27.1	Very low	29.7	Very low	200 Å²	200	137.5 Å²	137.5	78%	0.784	70%	0.702	S	S	*	*			trans	78.1	49.3	177.8	-51.6	-72.5	0	0	0	118.6
926	D	28.1	Very low	30	Very low	170 Å²	170	134 Å²	134	91%	0.909	68%	0.678	S	S	*	*			trans	-132.9	63	157.2	-102.2	-42.3	0	0	0	111
927	K	30	Very low	30.4	Very low	201 Å²	201	130.6 Å²	130.6	87%	0.874	65%	0.653	S	S	*	*			trans	-160.8	40.8	178.2	-128.8	169.3	-170.5	175.9	0	116.8
928	F	29.8	Very low	30.7	Very low	179 Å²	179	127 Å²	127	79%	0.785	63%	0.634	S	S	*	*			trans	-127.3	114.8	169	-81	-78.5	0	0	0	111.8
929	K	34.2	Very low	30.9	Very low	138 Å²	138	120.9 Å²	120.9	60%	0.6	61%	0.607	S	S	*	*			trans	-62.8	147.1	160.6	-101.4	-167.1	166.6	-150.6	0	109.4	I931 E933	K929-I931 PolarHBondContact O-N 3.13Å; K929-E933 VanDerWaalsContact CD-OE2 3.31Å; K929-E933 WeakPolarHBondContact CD-OE2 3.23Å; K929-E933 VanDerWaalsContact CE-OE2 3.22Å; K929-E933 WeakPolarHBondContact CE-OE2 3.47Å; K929-E933 IonicContact NZ-OE2 3.63Å; K929-E933 PolarHBondContact NZ-OE2 3.16Å
930	P	32.7	Very low	31.5	Very low	78 Å²	78	114 Å²	114	51%	0.506	57%	0.573	S	S	.	*			trans	-66.8	128.2	178.5	29.2	-34.5	0	0	0	110.4	P932 E933	P930-P932 VanDerWaalsContact C-N 3.29Å; P930-P932 WeakPolarHBondContact O-CD 3.44Å; P930-P932 VanDerWaalsContact O-N 3.09Å; P930-E933 HydrophobicContact CG-CG 4.39Å; P930-E933 PolarHBondContact O-N 3.13Å; P930-E933 VanDerWaalsContact O-N 3.14Å
931	I	30.9	Very low	31.9	Very low	108 Å²	108	114.3 Å²	114.3	55%	0.554	57%	0.565	S	S	*	*	H	α-helix	trans	-49.4	-33.4	-174.9	-67.1	169.7	0	0	0	115.2	K929 E933 C934 I935	K929-I931 PolarHBondContact O-N 3.13Å; I931-E933 VanDerWaalsContact C-N 3.29Å; I931-E933 PolarHBondContact O-N 3.43Å; I931-C934 PolarHBondContact O-N 3.18Å; I931-I935 HydrophobicContact CG2-CD1 3.8Å; I931-I935 HydrophobicContact CG2-CG1 4.34Å; I931-I935 PolarHBondContact O-N 2.87Å
932	P	33.1	Very low	32.4	Very low	92 Å²	92	110.1 Å²	110.1	60%	0.597	54%	0.542	S	S	*	.	H	α-helix	trans	-55.2	-34.7	176.2	-30.3	37.9	0	0	0	115.6	P930 C934 I935 S936	P930-P932 VanDerWaalsContact C-N 3.29Å; P930-P932 WeakPolarHBondContact O-CD 3.44Å; P930-P932 VanDerWaalsContact O-N 3.09Å; P932-C934 PolarHBondContact O-N 2.9Å; P932-I935 PolarHBondContact O-N 3.41Å; P932-S936 PolarHBondContact O-N 2.92Å
933	E	32.5	Very low	32.6	Very low	59 Å²	59	106.4 Å²	106.4	28%	0.276	52%	0.524	S	S	.	.	H	α-helix	trans	-64	-41.5	-179.6	-69.9	-175.8	-170	0	0	111.7	K929 P930 I931 I935 S936 C937	K929-E933 VanDerWaalsContact CD-OE2 3.31Å; K929-E933 WeakPolarHBondContact CD-OE2 3.23Å; K929-E933 VanDerWaalsContact CE-OE2 3.22Å; K929-E933 WeakPolarHBondContact CE-OE2 3.47Å; K929-E933 IonicContact NZ-OE2 3.63Å; K929-E933 PolarHBondContact NZ-OE2 3.16Å; P930-E933 HydrophobicContact CG-CG 4.39Å; P930-E933 PolarHBondContact O-N 3.13Å; P930-E933 VanDerWaalsContact O-N 3.14Å; I931-E933 VanDerWaalsContact C-N 3.29Å; I931-E933 PolarHBondContact O-N 3.43Å; E933-I935 VanDerWaalsContact C-N 3.32Å; E933-I935 PolarHBondContact O-N 3.05Å; E933-S936 PolarHBondContact O-N 3.39Å; E933-C937 PolarHBondContact O-N 3.48Å; E933-C937 PolarHBondContact O-SG 3.48Å
934	C	30.5	Very low	33.1	Very low	72 Å²	72	101.7 Å²	101.7	49%	0.486	51%	0.505	S	S	.	.	H	α-helix	trans	-68.1	-33.1	177.8	-62.8	0	0	0	0	112.3	I931 P932 I938	I931-C934 PolarHBondContact O-N 3.18Å; P932-C934 PolarHBondContact O-N 2.9Å; C934-I938 WeakPolarHBondContact O-CD1 3.2Å; C934-I938 WeakPolarHBondContact O-CG1 3.4Å; C934-I938 PolarHBondContact O-N 2.79Å
935	I	35	Very low	33.5	Very low	31 Å²	31	98.9 Å²	98.9	16%	0.159	50%	0.497	C	S	.	.	H	α-helix	trans	-67.8	-45.1	176.8	-70.7	172.5	0	0	0	110.6	N715 I931 P932 E933 C937 I938 L939	N715-I935 WeakPolarHBondContact OD1-CG2 3.36Å; I931-I935 HydrophobicContact CG2-CD1 3.8Å; I931-I935 HydrophobicContact CG2-CG1 4.34Å; I931-I935 PolarHBondContact O-N 2.87Å; P932-I935 PolarHBondContact O-N 3.41Å; E933-I935 VanDerWaalsContact C-N 3.32Å; E933-I935 PolarHBondContact O-N 3.05Å; I935-C937 PolarHBondContact O-N 3.06Å; I935-I938 PolarHBondContact O-N 2.91Å; I935-L939 HydrophobicContact CG2-CD1 3.75Å; I935-L939 HydrophobicContact CG2-CG 4.26Å; I935-L939 WeakPolarHBondContact O-CG 3.31Å; I935-L939 PolarHBondContact O-N 2.95Å
936	S	33.4	Very low	33.9	Very low	17 Å²	17	94.1 Å²	94.1	12%	0.119	49%	0.485	C	S	.	.	H	α-helix	trans	-53.3	-51.9	175.5	-179	0	0	0	0	111.4	P932 E933 I938 L939 C940	P932-S936 PolarHBondContact O-N 2.92Å; E933-S936 PolarHBondContact O-N 3.39Å; S936-I938 VanDerWaalsContact C-N 3.3Å; S936-I938 PolarHBondContact O-N 3.49Å; S936-L939 PolarHBondContact O-N 3.35Å; S936-C940 PolarHBondContact O-N 3.48Å; S936-C940 PolarHBondContact O-SG 2.97Å; S936-C940 VanDerWaalsContact O-SG 3.33Å
937	C	34.7	Very low	34.5	Very low	32 Å²	32	89.8 Å²	89.8	22%	0.216	46%	0.464	C	S	.	.	H	α-helix	trans	-57.1	-39.6	178.1	-59.3	0	0	0	0	113.7	I425 E933 I935 M941	I425-C937 HydrophobicContact CD1-CB 4.4Å; I425-C937 WeakPolarHBondContact CD1-SG 3.22Å; E933-C937 PolarHBondContact O-N 3.48Å; E933-C937 PolarHBondContact O-SG 3.48Å; I935-C937 PolarHBondContact O-N 3.06Å; C937-M941 WeakPolarHBondContact O-CG 3.48Å; C937-M941 PolarHBondContact O-N 3.49Å
938	I	36.9	Very low	34.7	Very low	93 Å²	93	90 Å²	90	48%	0.477	46%	0.46	S	S	.	.	H	α-helix	trans	-73.6	-41	-178.9	-68.1	166.9	0	0	0	111	C934 I935 S936 C940 M941 I942	C934-I938 WeakPolarHBondContact O-CD1 3.2Å; C934-I938 WeakPolarHBondContact O-CG1 3.4Å; C934-I938 PolarHBondContact O-N 2.79Å; I935-I938 PolarHBondContact O-N 2.91Å; S936-I938 VanDerWaalsContact C-N 3.3Å; S936-I938 PolarHBondContact O-N 3.49Å; I938-C940 VanDerWaalsContact C-N 3.34Å; I938-C940 PolarHBondContact O-N 3.07Å; I938-M941 HydrophobicContact CG1-CE 4.21Å; I938-M941 PolarHBondContact O-N 3.31Å; I938-I942 HydrophobicContact CG2-CD1 3.87Å; I938-I942 WeakPolarHBondContact O-CG1 3.31Å; I938-I942 PolarHBondContact O-N 3.13Å
939	L	36.5	Very low	34.8	Very low	50 Å²	50	87.1 Å²	87.1	26%	0.262	45%	0.453	S	S	.	.	H	α-helix	trans	-63.1	-39.2	176.7	-71.4	172.8	0	0	0	111.8	F711 L718 I935 S936 I942 H943	F711-L939 HydrophobicContact CE2-CD1 3.79Å; F711-L939 HydrophobicContact CZ-CD1 3.67Å; L718-L939 HydrophobicContact CD1-CD2 3.75Å; I935-L939 HydrophobicContact CG2-CD1 3.75Å; I935-L939 HydrophobicContact CG2-CG 4.26Å; I935-L939 WeakPolarHBondContact O-CG 3.31Å; I935-L939 PolarHBondContact O-N 2.95Å; S936-L939 PolarHBondContact O-N 3.35Å; L939-I942 PolarHBondContact O-N 3.13Å; L939-H943 WeakPolarHBondContact O-CB 3.44Å; L939-H943 PolarHBondContact O-N 2.87Å
940	C	37.6	Very low	34.7	Very low	35 Å²	35	85 Å²	85	24%	0.236	46%	0.455	C	S	.	.	H	α-helix	trans	-62.7	-44.5	174.2	-64.9	0	0	0	0	112.4	I422 S936 I938 I942 H943 D944	I422-C940 WeakPolarHBondContact CD1-SG 3.5Å; I422-C940 VanDerWaalsContact CG1-SG 3.6Å; S936-C940 PolarHBondContact O-N 3.48Å; S936-C940 PolarHBondContact O-SG 2.97Å; S936-C940 VanDerWaalsContact O-SG 3.33Å; I938-C940 VanDerWaalsContact C-N 3.34Å; I938-C940 PolarHBondContact O-N 3.07Å; C940-I942 VanDerWaalsContact C-N 3.3Å; C940-I942 PolarHBondContact O-N 2.82Å; C940-H943 WeakPolarHBondContact O-CB 3.09Å; C940-H943 PolarHBondContact O-N 3.02Å; C940-D944 PolarHBondContact O-N 3.23Å
941	M	36.6	Very low	34.6	Very low	106 Å²	106	86 Å²	86	52%	0.522	46%	0.463	S	S	.	.	H	α-helix	trans	-63.1	-35.3	175.9	-70	-174.8	-67.6	0	0	112.8	C937 I938 M945	C937-M941 WeakPolarHBondContact O-CG 3.48Å; C937-M941 PolarHBondContact O-N 3.49Å; I938-M941 HydrophobicContact CG1-CE 4.21Å; I938-M941 PolarHBondContact O-N 3.31Å; M941-M945 WeakPolarHBondContact O-CG 3.38Å; M941-M945 PolarHBondContact O-N 2.87Å; M941-M945 VanDerWaalsContact O-N 3.17Å
942	I	35.6	Very low	34.5	Very low	71 Å²	71	84.3 Å²	84.3	36%	0.364	47%	0.473	S	S	.	.	H	α-helix	trans	-70.5	-39.2	174.8	-66.9	167.4	0	0	0	111	I938 L939 C940 M945 N946	I938-I942 HydrophobicContact CG2-CD1 3.87Å; I938-I942 WeakPolarHBondContact O-CG1 3.31Å; I938-I942 PolarHBondContact O-N 3.13Å; L939-I942 PolarHBondContact O-N 3.13Å; C940-I942 VanDerWaalsContact C-N 3.3Å; C940-I942 PolarHBondContact O-N 2.82Å; I942-M945 PolarHBondContact O-N 3.01Å; I942-N946 WeakPolarHBondContact O-CB 3.44Å; I942-N946 PolarHBondContact O-N 3.24Å
943	H	35.1	Very low	34.1	Very low	119 Å²	119	88 Å²	88	55%	0.551	49%	0.486	S	S	*	.	H	α-helix	trans	-62.4	-47.2	175.2	-172.2	-94.2	0	0	0	111.5	L939 C940 M945 N946 V947	L939-H943 WeakPolarHBondContact O-CB 3.44Å; L939-H943 PolarHBondContact O-N 2.87Å; C940-H943 WeakPolarHBondContact O-CB 3.09Å; C940-H943 PolarHBondContact O-N 3.02Å; H943-M945 VanDerWaalsContact C-N 3.27Å; H943-M945 PolarHBondContact O-N 2.87Å; H943-N946 PolarHBondContact O-N 3.39Å; H943-N946 VanDerWaalsContact O-N 3.11Å; H943-V947 WeakPolarHBondContact O-CB 3.48Å; H943-V947 WeakPolarHBondContact O-CG2 3.45Å; H943-V947 PolarHBondContact O-N 2.93Å
944	D	37.1	Very low	33.9	Very low	97 Å²	97	91.1 Å²	91.1	52%	0.519	51%	0.509	S	S	.	.	H	α-helix	trans	-60.9	-33	176.4	-74.6	-14.1	0	0	0	112.9	C940 R948	C940-D944 PolarHBondContact O-N 3.23Å; D944-R948 WeakPolarHBondContact O-CB 3.39Å; D944-R948 PolarHBondContact O-N 2.95Å
945	M	37.3	Very low	33.8	Very low	129 Å²	129	94.7 Å²	94.7	64%	0.635	52%	0.524	S	S	*	.	H	α-helix	trans	-75.1	-37.5	173.3	-71.7	-166.5	75.6	0	0	112.7	M941 I942 H943 N949	M941-M945 WeakPolarHBondContact O-CG 3.38Å; M941-M945 PolarHBondContact O-N 2.87Å; M941-M945 VanDerWaalsContact O-N 3.17Å; I942-M945 PolarHBondContact O-N 3.01Å; H943-M945 VanDerWaalsContact C-N 3.27Å; H943-M945 PolarHBondContact O-N 2.87Å; M945-N949 PolarHBondContact O-N 3.47Å; M945-N949 PolarHBondContact O-ND2 2.84Å; M945-N949 VanDerWaalsContact O-ND2 3.11Å
946	N	35	Very low	33.4	Very low	100 Å²	100	101 Å²	101	54%	0.535	55%	0.552	S	S	.	*	H	α-helix	trans	-73.3	-42.5	179.5	-74.1	-14.7	0	0	0	112.5	I942 H943 R948 N949 S950	I942-N946 WeakPolarHBondContact O-CB 3.44Å; I942-N946 PolarHBondContact O-N 3.24Å; H943-N946 PolarHBondContact O-N 3.39Å; H943-N946 VanDerWaalsContact O-N 3.11Å; N946-R948 PolarHBondContact O-N 3.01Å; N946-N949 PolarHBondContact O-N 2.98Å; N946-S950 PolarHBondContact O-N 3.47Å
947	V	39.5	Very low	33.2	Very low	79 Å²	79	105.4 Å²	105.4	48%	0.479	58%	0.583	S	S	.	*	H	α-helix	trans	-64.3	-30.2	174.3	173.6	0	0	0	0	111.6	H943 N949 S950	H943-V947 WeakPolarHBondContact O-CB 3.48Å; H943-V947 WeakPolarHBondContact O-CG2 3.45Å; H943-V947 PolarHBondContact O-N 2.93Å; V947-N949 VanDerWaalsContact C-N 3.3Å; V947-S950 PolarHBondContact O-OG 3Å; V947-S950 VanDerWaalsContact O-OG 3.06Å
948	R	35.1	Very low	32.8	Very low	205 Å²	205	113.2 Å²	113.2	77%	0.774	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.7	-11.9	173.1	-165.7	174.1	-61.8	-143.1	-0.8	113.8	D944 N946	D944-R948 WeakPolarHBondContact O-CB 3.39Å; D944-R948 PolarHBondContact O-N 2.95Å; N946-R948 PolarHBondContact O-N 3.01Å
949	N	32.6	Very low	32.3	Very low	119 Å²	119	111.9 Å²	111.9	64%	0.636	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.2	-5.9	177.8	-73.2	-22.8	0	0	0	113.5	M945 N946 V947	M945-N949 PolarHBondContact O-N 3.47Å; M945-N949 PolarHBondContact O-ND2 2.84Å; M945-N949 VanDerWaalsContact O-ND2 3.11Å; N946-N949 PolarHBondContact O-N 2.98Å; V947-N949 VanDerWaalsContact C-N 3.3Å
950	S	31	Very low	31.8	Very low	94 Å²	94	115.2 Å²	115.2	66%	0.657	64%	0.638	S	S	*	*	S	Bend	trans	-93.6	12.2	-176.3	54.1	0	0	0	0	115.2	N946 V947	N946-S950 PolarHBondContact O-N 3.47Å; V947-S950 PolarHBondContact O-OG 3Å; V947-S950 VanDerWaalsContact O-OG 3.06Å
951	S	31.3	Very low	31.2	Very low	97 Å²	97	124.9 Å²	124.9	68%	0.678	67%	0.67	S	S	*	*	S	Bend	trans	-147.2	131.4	174.3	54.9	0	0	0	0	112.8
952	G	27.9	Very low	30.7	Very low	73 Å²	73	127.3 Å²	127.3	75%	0.753	68%	0.684	S	S	*	*			trans	76	76.3	168.6	0	0	0	0	0	116.7	T954	G952-T954 PolarHBondContact O-N 2.97Å
953	I	24.5	Very low	30.3	Very low	169 Å²	169	129.7 Å²	129.7	87%	0.867	70%	0.698	S	S	*	*			trans	-77.5	98.6	170.6	-57.9	174.6	0	0	0	110.3
954	T	29.7	Very low	30.1	Very low	125 Å²	125	129.5 Å²	129.5	77%	0.767	71%	0.705	S	S	*	*			trans	-140	102	162.8	42.4	0	0	0	0	112.8	G952 H956	G952-T954 PolarHBondContact O-N 2.97Å; T954-H956 PolarHBondContact O-N 3.47Å
955	N	27.5	Very low	29.6	Very low	148 Å²	148	130.5 Å²	130.5	79%	0.791	71%	0.71	S	S	*	*			trans	21.7	95	149	-61.1	-31.7	0	0	0	119
956	H	27	Very low	29.4	Very low	163 Å²	163	127.3 Å²	127.3	76%	0.755	70%	0.695	S	S	*	*			trans	-179.9	100.6	135.6	-97.1	-64.3	0	0	0	113.1	T954	T954-H956 PolarHBondContact O-N 3.47Å
957	S	28.3	Very low	29.1	Very low	109 Å²	109	124.5 Å²	124.5	76%	0.762	68%	0.682	S	S	*	*			trans	-179.4	68.7	148.1	42.5	0	0	0	0	114.1	S959	S957-S959 PolarHBondContact O-N 3.32Å
958	K	27.2	Very low	28.6	Very low	196 Å²	196	124.5 Å²	124.5	85%	0.852	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.4	71.4	161.3	-72.1	179.1	179	172.8	0	110.5
959	S	25.4	Very low	28.3	Very low	66 Å²	66	120.2 Å²	120.2	46%	0.462	68%	0.678	S	S	.	*	T	Hydrogen-bonded Turn	trans	-153.9	5.1	-179.6	-166.8	0	0	0	0	116.1	R450 S957	R450-S959 PolarHBondContact NH2-OG 2.96Å; S957-S959 PolarHBondContact O-N 3.32Å
960	C	26.3	Very low	28.3	Very low	120 Å²	120	118 Å²	118	81%	0.811	67%	0.665	S	S	*	*			trans	-131.6	54.7	176.8	-71.7	0	0	0	0	112.2	L962	C960-L962 PolarHBondContact O-N 3.42Å
961	R	24.1	Very low	28.3	Very low	237 Å²	237	119.1 Å²	119.1	89%	0.894	66%	0.656	S	S	*	*			trans	-82.9	92.1	169.7	-79.2	-173.6	171	-174.7	-4.6	110.2
962	L	26.9	Very low	28.3	Very low	157 Å²	157	116.9 Å²	116.9	82%	0.822	64%	0.643	S	S	*	*			trans	-100.8	124.9	159.2	-71.2	170.3	0	0	0	107.4	C960	C960-L962 PolarHBondContact O-N 3.42Å
963	N	27.7	Very low	28.6	Very low	122 Å²	122	121.1 Å²	121.1	65%	0.652	64%	0.641	S	S	*	*			trans	-70.2	131.7	-167.9	-66	-13.7	0	0	0	112.1
964	V	30	Very low	29.1	Very low	115 Å²	115	118 Å²	118	70%	0.697	62%	0.623	S	S	*	*			trans	-98.3	4.3	-172.2	-174.6	0	0	0	0	112	P967	V964-P967 WeakPolarHBondContact O-CD 3.4Å
965	D	27.9	Very low	29.2	Very low	117 Å²	117	114.6 Å²	114.6	63%	0.626	61%	0.607	S	S	*	*			trans	-89.6	-6.1	-168.4	-49.6	-71.8	0	0	0	115.3
966	I	31.5	Very low	29.6	Very low	62 Å²	62	111.3 Å²	111.3	32%	0.318	59%	0.59	S	S	.	*	H	α-helix	trans	-77.3	-33.8	-177.2	-59.2	179.5	0	0	0	114.3	S968 I970	I966-S968 PolarHBondContact O-N 2.92Å; I966-I970 HydrophobicContact CG2-CD1 4.42Å
967	P	29.5	Very low	30	Very low	41 Å²	41	106.2 Å²	106.2	27%	0.266	57%	0.573	S	S	.	*	H	α-helix	trans	-59.9	-39.1	-179.2	-25	34	0	0	0	115.2	K724 V964 Y971	K724-P967 HydrophobicContact CB-CB 4.21Å; K724-P967 HydrophobicContact CB-CG 4.26Å; K724-P967 HydrophobicContact CD-CB 4.08Å; K724-P967 WeakPolarHBondContact CE-O 3.33Å; K724-P967 HydrophobicContact CG-CB 4.28Å; K724-P967 PolarHBondContact NZ-O 3.38Å; V964-P967 WeakPolarHBondContact O-CD 3.4Å; P967-Y971 WeakPolarHBondContact O-CD2 3.28Å
968	S	28.2	Very low	30.1	Very low	80 Å²	80	108.5 Å²	108.5	56%	0.559	57%	0.565	S	S	*	*	H	α-helix	trans	-72.8	-49.3	-164.9	-48.5	0	0	0	0	113.1	I966 I970 Y971 A972	I966-S968 PolarHBondContact O-N 2.92Å; S968-I970 VanDerWaalsContact C-N 3.31Å; S968-I970 PolarHBondContact O-N 3.48Å; S968-Y971 PolarHBondContact O-N 3.16Å; S968-A972 PolarHBondContact O-N 3.37Å
969	N	29.4	Very low	30.7	Very low	114 Å²	114	106.8 Å²	106.8	61%	0.61	56%	0.558	S	S	*	*	H	α-helix	trans	-67.7	-27.1	-172.3	-83.6	-53.8	0	0	0	114.2	K973	N969-K973 PolarHBondContact O-N 2.75Å
970	I	32.8	Very low	31.3	Very low	72 Å²	72	112.9 Å²	112.9	37%	0.369	57%	0.571	S	S	.	*	H	α-helix	trans	-76	-43	178.1	-65.8	168.9	0	0	0	110.4	I966 S968 A972 K973 E974	I966-I970 HydrophobicContact CG2-CD1 4.42Å; S968-I970 VanDerWaalsContact C-N 3.31Å; S968-I970 PolarHBondContact O-N 3.48Å; I970-A972 VanDerWaalsContact C-N 3.32Å; I970-A972 PolarHBondContact O-N 3.22Å; I970-K973 PolarHBondContact O-N 3.3Å; I970-E974 HydrophobicContact CG2-CG 4.4Å; I970-E974 WeakPolarHBondContact CG2-OE2 3.2Å; I970-E974 WeakPolarHBondContact O-CG 3.27Å; I970-E974 PolarHBondContact O-N 3.42Å
971	Y	30.5	Very low	32	Very low	119 Å²	119	114.6 Å²	114.6	47%	0.467	57%	0.565	S	S	.	*	H	α-helix	trans	-65.2	-35.2	178.4	-77.9	-45.8	0	0	0	112.3	K724 P967 S968 A975	K724-Y971 HydrophobicContact CD-CD2 4.17Å; K724-Y971 HydrophobicContact CD-CE2 3.63Å; P967-Y971 WeakPolarHBondContact O-CD2 3.28Å; S968-Y971 PolarHBondContact O-N 3.16Å; Y971-A975 VanDerWaalsContact O-CB 3.25Å; Y971-A975 WeakPolarHBondContact O-CB 3.24Å; Y971-A975 PolarHBondContact O-N 3.48Å
972	A	33	Very low	32.3	Very low	49 Å²	49	108.7 Å²	108.7	41%	0.405	54%	0.543	S	S	.	.	H	α-helix	trans	-60.6	-49.3	173.2	0	0	0	0	0	112	S968 I970 E974 A975 D976	S968-A972 PolarHBondContact O-N 3.37Å; I970-A972 VanDerWaalsContact C-N 3.32Å; I970-A972 PolarHBondContact O-N 3.22Å; A972-E974 PolarHBondContact O-N 3.17Å; A972-A975 PolarHBondContact O-N 3.38Å; A972-D976 WeakPolarHBondContact O-CB 3.35Å; A972-D976 PolarHBondContact O-N 3.24Å
973	K	34.3	Very low	32.5	Very low	162 Å²	162	106.9 Å²	106.9	70%	0.704	54%	0.539	S	S	*	.	H	α-helix	trans	-67.7	-34	-179.5	-74.2	-177	177	179.8	0	113.4	N969 I970 S977	N969-K973 PolarHBondContact O-N 2.75Å; I970-K973 PolarHBondContact O-N 3.3Å; K973-S977 VanDerWaalsContact O-CB 3.32Å; K973-S977 WeakPolarHBondContact O-CB 3.37Å; K973-S977 PolarHBondContact O-N 3.42Å
974	E	33.2	Very low	32.6	Very low	104 Å²	104	106.9 Å²	106.9	49%	0.486	54%	0.544	S	S	.	.	H	α-helix	trans	-72.4	-40.4	175.3	-70.4	176.6	135.6	0	0	111.8	I970 A972 S977 Y978	I970-E974 HydrophobicContact CG2-CG 4.4Å; I970-E974 WeakPolarHBondContact CG2-OE2 3.2Å; I970-E974 WeakPolarHBondContact O-CG 3.27Å; I970-E974 PolarHBondContact O-N 3.42Å; A972-E974 PolarHBondContact O-N 3.17Å; E974-S977 WeakPolarHBondContact O-CB 3.48Å; E974-S977 PolarHBondContact O-N 3.32Å; E974-Y978 PolarHBondContact O-N 2.97Å
975	A	32.4	Very low	32.6	Very low	54 Å²	54	110.6 Å²	110.6	45%	0.446	55%	0.551	S	S	.	*	H	α-helix	trans	-62.2	-43.2	173.2	0	0	0	0	0	112.1	Y971 A972 S977 Y978 K979	Y971-A975 VanDerWaalsContact O-CB 3.25Å; Y971-A975 WeakPolarHBondContact O-CB 3.24Å; Y971-A975 PolarHBondContact O-N 3.48Å; A972-A975 PolarHBondContact O-N 3.38Å; A975-S977 VanDerWaalsContact C-N 3.26Å; A975-S977 PolarHBondContact O-N 3.07Å; A975-Y978 PolarHBondContact O-N 3.31Å; A975-K979 WeakPolarHBondContact O-CB 3.4Å; A975-K979 PolarHBondContact O-N 3.41Å
976	D	35.1	Very low	32.8	Very low	78 Å²	78	111.1 Å²	111.1	42%	0.417	56%	0.558	S	S	.	*	H	α-helix	trans	-72.7	-15.7	176	-80	-15.4	0	0	0	114	A972 R980	A972-D976 WeakPolarHBondContact O-CB 3.35Å; A972-D976 PolarHBondContact O-N 3.24Å; D976-R980 PolarHBondContact O-NE 2.71Å
977	S	35.6	Very low	32.7	Very low	57 Å²	57	111.6 Å²	111.6	40%	0.399	57%	0.566	S	S	.	*	H	α-helix	trans	-81.1	-45.3	169.8	-172.4	0	0	0	0	110.5	K973 E974 A975 R980 K981	K973-S977 VanDerWaalsContact O-CB 3.32Å; K973-S977 WeakPolarHBondContact O-CB 3.37Å; K973-S977 PolarHBondContact O-N 3.42Å; E974-S977 WeakPolarHBondContact O-CB 3.48Å; E974-S977 PolarHBondContact O-N 3.32Å; A975-S977 VanDerWaalsContact C-N 3.26Å; A975-S977 PolarHBondContact O-N 3.07Å; S977-R980 PolarHBondContact O-N 2.99Å; S977-K981 PolarHBondContact O-N 3.21Å; S977-K981 VanDerWaalsContact O-N 3.12Å
978	Y	32.3	Very low	32.8	Very low	156 Å²	156	114.5 Å²	114.5	61%	0.612	59%	0.585	S	S	*	*	H	α-helix	trans	-60.6	-46.4	172.9	-102.7	-92.4	0	0	0	112.2	E974 A975 R980 K981 Y982	E974-Y978 PolarHBondContact O-N 2.97Å; A975-Y978 PolarHBondContact O-N 3.31Å; Y978-R980 PolarHBondContact O-N 3.27Å; Y978-K981 PolarHBondContact O-N 3.23Å; Y978-K981 VanDerWaalsContact O-N 3.12Å; Y978-Y982 AromaticContact CD1-CD2 3.73Å; Y978-Y982 HydrophobicContact CD1-CD2 3.73Å; Y978-Y982 AromaticContact CD1-CE2 3.84Å; Y978-Y982 HydrophobicContact CD1-CE2 3.84Å; Y978-Y982 HydrophobicContact CE1-CD2 4.11Å; Y978-Y982 AromaticContact CE1-CE2 3.78Å; Y978-Y982 HydrophobicContact CE1-CE2 3.78Å; Y978-Y982 PolarHBondContact O-N 3.27Å; Y978-Y982 VanDerWaalsContact O-N 3.13Å
979	K	38.8	Very low	33.2	Very low	161 Å²	161	120.1 Å²	120.1	70%	0.7	60%	0.6	S	S	*	*	H	α-helix	trans	-58.4	-31	174.8	-102.7	178.6	176.6	172.2	0	113.6	A975 T983	A975-K979 WeakPolarHBondContact O-CB 3.4Å; A975-K979 PolarHBondContact O-N 3.41Å; K979-T983 WeakPolarHBondContact O-CG2 3.17Å
980	R	38.4	Very low	33.3	Very low	193 Å²	193	122.5 Å²	122.5	73%	0.728	61%	0.612	S	S	*	*	H	α-helix	trans	-83.9	-18.2	177.6	-94.3	178.9	-77.9	-162.2	-10.1	114.5	D976 S977 Y978	D976-R980 PolarHBondContact O-NE 2.71Å; S977-R980 PolarHBondContact O-N 2.99Å; Y978-R980 PolarHBondContact O-N 3.27Å
981	K	39.5	Very low	33.3	Very low	157 Å²	157	123.9 Å²	123.9	68%	0.683	62%	0.62	S	S	*	*	H	α-helix	trans	-96.8	-19.7	178.2	-74.5	-171.7	174.2	-174.6	0	114.5	S977 Y978	S977-K981 PolarHBondContact O-N 3.21Å; S977-K981 VanDerWaalsContact O-N 3.12Å; Y978-K981 PolarHBondContact O-N 3.23Å; Y978-K981 VanDerWaalsContact O-N 3.12Å
982	Y	32.5	Very low	33.3	Very low	112 Å²	112	121.6 Å²	121.6	44%	0.439	62%	0.621	S	S	.	*			trans	-128.4	56.4	-172.4	-62.9	-72.1	0	0	0	113.6	Y978 T984	Y978-Y982 AromaticContact CD1-CD2 3.73Å; Y978-Y982 HydrophobicContact CD1-CD2 3.73Å; Y978-Y982 AromaticContact CD1-CE2 3.84Å; Y978-Y982 HydrophobicContact CD1-CE2 3.84Å; Y978-Y982 HydrophobicContact CE1-CD2 4.11Å; Y978-Y982 AromaticContact CE1-CE2 3.78Å; Y978-Y982 HydrophobicContact CE1-CE2 3.78Å; Y978-Y982 PolarHBondContact O-N 3.27Å; Y978-Y982 VanDerWaalsContact O-N 3.13Å; Y982-T984 PolarHBondContact O-N 3.39Å
983	T	30.6	Very low	33.2	Very low	120 Å²	120	123.9 Å²	123.9	74%	0.736	63%	0.634	S	S	*	*			trans	-78.6	44.6	178.2	55.9	0	0	0	0	113.7	K979	K979-T983 WeakPolarHBondContact O-CG2 3.17Å
984	T	30.3	Very low	33.2	Very low	122 Å²	122	119.5 Å²	119.5	75%	0.748	62%	0.624	S	S	*	*			trans	-140.5	45.1	176.4	57.7	0	0	0	0	112	Y982	Y982-T984 PolarHBondContact O-N 3.39Å
985	F	28.2	Very low	33	Very low	192 Å²	192	121 Å²	121	84%	0.842	63%	0.629	S	S	*	*			trans	-95.1	100.2	171.2	-99.8	-84.7	0	0	0	111	C987	F985-C987 PolarHBondContact O-N 3.11Å
986	T	33.5	Very low	33	Very low	128 Å²	128	125 Å²	125	79%	0.785	63%	0.634	S	S	*	*			trans	-81.2	108.7	178.6	-40.2	0	0	0	0	110.1
987	C	28.5	Very low	32.7	Very low	73 Å²	73	126.6 Å²	126.6	49%	0.493	64%	0.642	S	S	.	*			trans	-70.7	143.4	179.1	-163.7	0	0	0	0	111.4	F985 K989	F985-C987 PolarHBondContact O-N 3.11Å; C987-K989 PolarHBondContact O-N 3.49Å
988	P	32.4	Very low	32.5	Very low	101 Å²	101	128.8 Å²	128.8	66%	0.656	66%	0.658	S	S	*	*			trans	-58.9	131.6	176.8	-25.2	35.4	0	0	0	112.7	N990	P988-N990 VanDerWaalsContact C-N 3.26Å; P988-N990 PolarHBondContact O-N 3.36Å; P988-N990 VanDerWaalsContact O-N 3.12Å
989	K	35.3	Very low	32.5	Very low	199 Å²	199	127.5 Å²	127.5	87%	0.865	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.6	-0.5	-166.7	-72.1	-175	174.4	180	0	116.5	C987	C987-K989 PolarHBondContact O-N 3.49Å
990	N	32.7	Very low	32	Very low	163 Å²	163	126.1 Å²	126.1	87%	0.872	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.3	23.2	-167.9	-67.4	16	0	0	0	114.5	P988	P988-N990 VanDerWaalsContact C-N 3.26Å; P988-N990 PolarHBondContact O-N 3.36Å; P988-N990 VanDerWaalsContact O-N 3.12Å
991	L	32.2	Very low	31.5	Very low	101 Å²	101	123.9 Å²	123.9	53%	0.529	66%	0.66	S	S	.	*			trans	-92.6	126.4	175.6	-84.9	154.5	0	0	0	111.4
992	S	30.5	Very low	30.9	Very low	72 Å²	72	124.8 Å²	124.8	50%	0.503	67%	0.667	S	S	.	*			trans	-60.3	146.4	-174.6	-174.8	0	0	0	0	113.3	S994 F995	S992-S994 PolarHBondContact O-N 3.5Å; S992-S994 VanDerWaalsContact O-N 3.12Å; S992-S994 PolarHBondContact OG-OG 3.35Å; S992-F995 PolarHBondContact O-N 3.1Å
993	S	31.2	Very low	30.6	Very low	96 Å²	96	124.2 Å²	124.2	67%	0.671	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62	-18.1	-178.7	51.2	0	0	0	0	114.2	Y996	S993-Y996 PolarHBondContact O-N 2.86Å
994	S	33.5	Very low	30.4	Very low	70 Å²	70	127.2 Å²	127.2	49%	0.49	68%	0.682	S	S	.	*	T	Hydrogen-bonded Turn	trans	-61.2	-41.6	173	54.6	0	0	0	0	112.8	S992 Y996 N997	S992-S994 PolarHBondContact O-N 3.5Å; S992-S994 VanDerWaalsContact O-N 3.12Å; S992-S994 PolarHBondContact OG-OG 3.35Å; S994-Y996 VanDerWaalsContact C-N 3.27Å; S994-Y996 PolarHBondContact O-N 3.29Å; S994-N997 PolarHBondContact O-N 2.94Å
995	F	30.2	Very low	30.2	Very low	136 Å²	136	128.7 Å²	128.7	60%	0.596	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.1	-25.7	-178.7	-102.5	-88.5	0	0	0	113.5	S992 N997	S992-F995 PolarHBondContact O-N 3.1Å; F995-N997 VanDerWaalsContact C-N 3.34Å; F995-N997 PolarHBondContact O-N 3.45Å
996	Y	31.2	Very low	30.1	Very low	139 Å²	139	126.5 Å²	126.5	55%	0.545	68%	0.681	S	S	.	*	T	Hydrogen-bonded Turn	trans	-80.5	-10.6	-177.2	-106.8	-73.5	0	0	0	114.7	S993 S994 K1000	S993-Y996 PolarHBondContact O-N 2.86Å; S994-Y996 VanDerWaalsContact C-N 3.27Å; S994-Y996 PolarHBondContact O-N 3.29Å; Y996-K1000 VanDerWaalsContact O-CB 3.3Å; Y996-K1000 WeakPolarHBondContact O-CB 3.5Å
997	N	30.1	Very low	29.8	Very low	110 Å²	110	127.5 Å²	127.5	59%	0.588	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.2	-36.6	178.2	-71.6	-25.6	0	0	0	112.4	S994 F995 V999 K1000	S994-N997 PolarHBondContact O-N 2.94Å; F995-N997 VanDerWaalsContact C-N 3.34Å; F995-N997 PolarHBondContact O-N 3.45Å; N997-V999 PolarHBondContact O-N 3.46Å; N997-V999 VanDerWaalsContact O-N 3.14Å; N997-K1000 PolarHBondContact O-N 3.09Å; N997-K1000 VanDerWaalsContact O-N 3.1Å
998	S	31.5	Very low	29.8	Very low	104 Å²	104	129.4 Å²	129.4	73%	0.727	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.8	-10.5	-176.3	-49.6	0	0	0	0	115.4
999	V	31.2	Very low	29.6	Very low	128 Å²	128	131.1 Å²	131.1	78%	0.776	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121.7	19.4	175.8	-163	0	0	0	0	111	N997	N997-V999 PolarHBondContact O-N 3.46Å; N997-V999 VanDerWaalsContact O-N 3.14Å
1000	K	27.7	Very low	29.3	Very low	132 Å²	132	131 Å²	131	57%	0.574	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-134.9	7.8	-174.7	-138.3	168.1	-171.7	174.4	0	115.3	Y996 N997	Y996-K1000 VanDerWaalsContact O-CB 3.3Å; Y996-K1000 WeakPolarHBondContact O-CB 3.5Å; N997-K1000 PolarHBondContact O-N 3.09Å; N997-K1000 VanDerWaalsContact O-N 3.1Å
1001	I	28.5	Very low	29	Very low	146 Å²	146	132 Å²	132	75%	0.749	71%	0.705	S	S	*	*	S	Bend	trans	-91.9	120	154	-55.7	165.6	0	0	0	104.4
1002	Q	26.6	Very low	28.8	Very low	176 Å²	176	132.8 Å²	132.8	82%	0.822	71%	0.71	S	S	*	*	S	Bend	cis	-137.5	47.4	20.8	-158.3	168.5	5	0	0	112.5	K1004	Q1002-K1004 PolarHBondContact O-N 3.01Å; Q1002-K1004 VanDerWaalsContact O-N 3.08Å
1003	S	26.1	Very low	28.7	Very low	101 Å²	101	136.3 Å²	136.3	71%	0.706	72%	0.723	S	S	*	*			trans	-86	48.4	179.6	51.4	0	0	0	0	113.8
1004	K	26.6	Very low	28.5	Very low	182 Å²	182	135.1 Å²	135.1	79%	0.791	73%	0.726	S	S	*	*			trans	-139.8	149.4	166.9	-86.8	-173.8	174	-179.5	0	109.2	Q1002	Q1002-K1004 PolarHBondContact O-N 3.01Å; Q1002-K1004 VanDerWaalsContact O-N 3.08Å
1005	I	27.4	Very low	28.2	Very low	153 Å²	153	139.2 Å²	139.2	79%	0.785	74%	0.742	S	S	*	*	S	Bend	trans	84.2	106.5	178.2	-53.2	175.6	0	0	0	114.1
1006	N	26.3	Very low	28	Very low	147 Å²	147	141.8 Å²	141.8	79%	0.786	75%	0.753	S	S	*	*			trans	68.8	91.1	150	-58.1	-1.3	0	0	0	120.7	S1008	N1006-S1008 PolarHBondContact O-N 3.36Å
1007	T	25.5	Very low	27.7	Very low	148 Å²	148	142 Å²	142	91%	0.908	77%	0.769	S	S	*	*			trans	-61.4	116	137.2	47.7	0	0	0	0	111.3
1008	S	29.1	Very low	27.6	Very low	114 Å²	114	143.3 Å²	143.3	80%	0.797	78%	0.776	S	S	*	*			trans	-172.1	158.8	131	-157.8	0	0	0	0	110.9	N1006	N1006-S1008 PolarHBondContact O-N 3.36Å
1009	N	27.4	Very low	27.3	Very low	137 Å²	137	146.9 Å²	146.9	73%	0.733	78%	0.781	S	S	*	*			trans	-88.1	142.8	-176	-49.1	-50.9	0	0	0	112.4
1010	Q	29.6	Very low	26.9	Very low	196 Å²	196	149 Å²	149	92%	0.916	79%	0.788	S	S	*	*				-160.7	174.6	126.4	-113.3	151.1	109.9	0	0	112.4
1011	F	26.2	Very low	26.9	Very low	183 Å²	183	150 Å²	150	80%	0.803	79%	0.794	S	S	*	*			trans	-118	165	-156.1	-100.2	-99	0	0	0	112.9
1012	N	28.3	Very low	26.7	Very low	119 Å²	119	150 Å²	150	64%	0.636	80%	0.795	S	S	*	*			trans	83.7	123.6	155	-78.4	42.2	0	0	0	121.9
1013	D	28	Very low	26.6	Very low	146 Å²	146	146.8 Å²	146.8	78%	0.781	79%	0.789	S	S	*	*			trans	66.6	113.3	132.6	-48.8	-22.4	0	0	0	121.1
1014	G	28	Very low	26.5	Very low	71 Å²	71	146.2 Å²	146.2	73%	0.732	79%	0.785	S	S	*	*			trans	167.4	62.2	173.3	0	0	0	0	0	116.1
1015	N	26.3	Very low	26.4	Very low	156 Å²	156	143.9 Å²	143.9	83%	0.834	78%	0.779	S	S	*	*			trans	28.6	94.5	163.9	-71.3	-13.3	0	0	0	119.2
1016	F	26.8	Very low	26.3	Very low	189 Å²	189	144.5 Å²	144.5	83%	0.829	78%	0.779	S	S	*	*			trans	-134.2	104	148.8	-110.9	-85.3	0	0	0	110.8	L1018	F1016-L1018 PolarHBondContact O-N 3.1Å; F1016-L1018 VanDerWaalsContact O-N 3.13Å
1017	T	23.8	Very low	26.3	Very low	143 Å²	143	142.7 Å²	142.7	88%	0.877	78%	0.778	S	S	*	*			trans	-83	81.6	175.4	49.3	0	0	0	0	110.8
1018	L	28.4	Very low	26.5	Very low	139 Å²	139	142.9 Å²	142.9	73%	0.728	77%	0.772	S	S	*	*			trans	-107.1	116.5	161.9	-87.7	164.9	0	0	0	109.3	F1016	F1016-L1018 PolarHBondContact O-N 3.1Å; F1016-L1018 VanDerWaalsContact O-N 3.13Å
1019	Q	25.8	Very low	26.4	Very low	179 Å²	179	144.8 Å²	144.8	84%	0.836	77%	0.773	S	S	*	*			trans	-58.5	155.2	173.7	-81.5	179.5	-32.3	0	0	111.3	Q1021	Q1019-Q1021 PolarHBondContact O-N 3.41Å
1020	N	23.3	Very low	26.4	Very low	172 Å²	172	143.4 Å²	143.4	92%	0.92	78%	0.775	S	S	*	*			trans	-40.8	91.4	173.8	-63.7	-38.6	0	0	0	113.5
1021	Q	26.6	Very low	26.5	Very low	153 Å²	153	140.8 Å²	140.8	72%	0.715	77%	0.767	S	S	*	*			trans	-116.1	94.1	167	-71.1	-170.1	-3.7	0	0	108.5	Q1019	Q1019-Q1021 PolarHBondContact O-N 3.41Å
1022	I	24.8	Very low	26.9	Very low	147 Å²	147	137.8 Å²	137.8	75%	0.754	76%	0.764	S	S	*	*			trans	-44.8	137.6	146.5	-61.2	167.3	0	0	0	106.6	S1024	I1022-S1024 PolarHBondContact O-N 2.84Å
1023	P	23.9	Very low	27.3	Very low	108 Å²	108	139 Å²	139	70%	0.701	77%	0.766	S	S	*	*			trans	-53	105.5	179.6	-28.6	36.2	0	0	0	111.5	I1025	P1023-I1025 PolarHBondContact O-N 3.48Å
1024	S	24.3	Very low	27.6	Very low	88 Å²	88	136.1 Å²	136.1	62%	0.615	76%	0.755	S	S	*	*			trans	-72.8	79.3	178.6	-66.8	0	0	0	0	109.3	I1022 H1026	I1022-S1024 PolarHBondContact O-N 2.84Å; S1024-H1026 PolarHBondContact O-N 3.3Å
1025	I	25.4	Very low	28	Very low	133 Å²	133	137.7 Å²	137.7	68%	0.682	75%	0.746	S	S	*	*			trans	-74.8	60.5	165.2	-47.2	-179.5	0	0	0	108.2	P1023 L1028	P1023-I1025 PolarHBondContact O-N 3.48Å; I1025-L1028 HydrophobicContact CG2-CD1 3.75Å
1026	H	25.3	Very low	28.5	Very low	166 Å²	166	136.3 Å²	136.3	77%	0.769	73%	0.734	S	S	*	*			trans	-76.5	146.6	148.8	-90.4	-95.5	0	0	0	107.4	S1024	S1024-H1026 PolarHBondContact O-N 3.3Å
1027	S	26.1	Very low	29	Very low	109 Å²	109	133 Å²	133	76%	0.762	72%	0.721	S	S	*	*			trans	64	67.1	178.9	-49.5	0	0	0	0	115.2
1028	L	29.5	Very low	29.7	Very low	152 Å²	152	128.6 Å²	128.6	80%	0.796	70%	0.699	S	S	*	*			trans	-116.3	122.7	134	-95.6	99.2	0	0	0	108.3	I1025	I1025-L1028 HydrophobicContact CG2-CD1 3.75Å
1029	D	27.6	Very low	30.3	Very low	154 Å²	154	127.5 Å²	127.5	82%	0.824	69%	0.69	S	S	*	*			trans	-72.6	168.4	-175.7	-80.3	-58.4	0	0	0	114.1	N1031	D1029-N1031 PolarHBondContact O-N 3.25Å
1030	S	27	Very low	31.5	Very low	109 Å²	109	122.1 Å²	122.1	76%	0.762	67%	0.67	S	S	*	*			trans	-47	110.8	-179.7	42.7	0	0	0	0	114.7
1031	N	30.7	Very low	32.2	Very low	140 Å²	140	120.9 Å²	120.9	75%	0.749	66%	0.656	S	S	*	*			trans	-151.8	108.3	150.4	-102.9	-56.5	0	0	0	110.2	D1029 Q1033 P1034	D1029-N1031 PolarHBondContact O-N 3.25Å; N1031-Q1033 PolarHBondContact O-N 3.18Å; N1031-P1034 WeakPolarHBondContact O-CD 3.28Å
1032	T	35.5	Very low	33	Very low	120 Å²	120	118.6 Å²	118.6	74%	0.736	65%	0.647	S	S	*	*			trans	-79.1	-6.1	-162.8	15.6	0	0	0	0	116
1033	Q	35.3	Very low	34.4	Very low	145 Å²	145	117.7 Å²	117.7	68%	0.678	64%	0.637	S	S	*	*	H	α-helix	trans	-66.6	-42.1	-171.3	-65.1	-163.3	-0.3	0	0	117.4	N1031 I1035 H1036 Q1037	N1031-Q1033 PolarHBondContact O-N 3.18Å; Q1033-I1035 VanDerWaalsContact C-N 3.29Å; Q1033-I1035 PolarHBondContact O-N 2.97Å; Q1033-H1036 PolarHBondContact O-N 3.18Å; Q1033-Q1037 PolarHBondContact O-N 2.76Å
1034	P	36.1	Very low	35.6	Very low	86 Å²	86	116.1 Å²	116.1	56%	0.558	63%	0.628	S	S	*	*	H	α-helix	trans	-70.5	-26.9	-172.4	27.6	-33.6	0	0	0	112.7	N1031 Q1037 A1038	N1031-P1034 WeakPolarHBondContact O-CD 3.28Å; P1034-Q1037 PolarHBondContact O-N 2.85Å; P1034-A1038 WeakPolarHBondContact O-CB 3.41Å; P1034-A1038 PolarHBondContact O-N 2.97Å
1035	I	35.4	Very low	36.7	Very low	104 Å²	104	118.1 Å²	118.1	53%	0.533	62%	0.623	S	S	.	*	H	α-helix	trans	-65.7	-45.2	177.4	-60.4	175.7	0	0	0	110.1	Q1033 Q1037 A1038 Q1039	Q1033-I1035 VanDerWaalsContact C-N 3.29Å; Q1033-I1035 PolarHBondContact O-N 2.97Å; I1035-Q1037 PolarHBondContact O-N 3.36Å; I1035-A1038 PolarHBondContact O-N 3.43Å; I1035-Q1039 HydrophobicContact CG2-CG 4.41Å; I1035-Q1039 WeakPolarHBondContact O-CB 3.48Å; I1035-Q1039 VanDerWaalsContact O-CG 3.31Å; I1035-Q1039 WeakPolarHBondContact O-CG 3.31Å; I1035-Q1039 PolarHBondContact O-N 3.47Å
1036	H	36.9	Very low	37.9	Very low	126 Å²	126	118.2 Å²	118.2	58%	0.583	62%	0.616	S	S	*	*	H	α-helix	trans	-65.9	-37.7	179.7	-164.7	-88.7	0	0	0	112	Q1033 T1040	Q1033-H1036 PolarHBondContact O-N 3.18Å; H1036-T1040 WeakPolarHBondContact O-CB 3.48Å; H1036-T1040 PolarHBondContact O-N 3.42Å; H1036-T1040 PolarHBondContact O-OG1 2.86Å
1037	Q	37.3	Very low	39.4	Very low	119 Å²	119	115.1 Å²	115.1	56%	0.556	61%	0.605	S	S	*	*	H	α-helix	trans	-66.5	-42	174.3	-68.2	-173.9	3.5	0	0	112.2	Q1033 P1034 I1035 T1040 F1041	Q1033-Q1037 PolarHBondContact O-N 2.76Å; P1034-Q1037 PolarHBondContact O-N 2.85Å; I1035-Q1037 PolarHBondContact O-N 3.36Å; Q1037-T1040 PolarHBondContact O-N 3.31Å; Q1037-F1041 WeakPolarHBondContact O-CB 3.37Å; Q1037-F1041 PolarHBondContact O-N 3.17Å
1038	A	38.5	Very low	40.7	Very low	51 Å²	51	114.6 Å²	114.6	42%	0.421	59%	0.591	S	S	.	*	H	α-helix	trans	-64.4	-42	175.3	0	0	0	0	0	112.4	P1034 I1035 F1041 M1042	P1034-A1038 WeakPolarHBondContact O-CB 3.41Å; P1034-A1038 PolarHBondContact O-N 2.97Å; I1035-A1038 PolarHBondContact O-N 3.43Å; A1038-F1041 PolarHBondContact O-N 3.19Å; A1038-M1042 WeakPolarHBondContact O-CG 3.47Å; A1038-M1042 PolarHBondContact O-N 2.68Å
1039	Q	41.5	Very low	42.1	Very low	117 Å²	117	110.4 Å²	110.4	55%	0.547	57%	0.569	S	S	.	*	H	α-helix	trans	-61.5	-44.6	172.9	-74.8	170.7	-22.2	0	0	111.6	I1035 F1041 M1042 K1043	I1035-Q1039 HydrophobicContact CG2-CG 4.41Å; I1035-Q1039 WeakPolarHBondContact O-CB 3.48Å; I1035-Q1039 VanDerWaalsContact O-CG 3.31Å; I1035-Q1039 WeakPolarHBondContact O-CG 3.31Å; I1035-Q1039 PolarHBondContact O-N 3.47Å; Q1039-F1041 PolarHBondContact O-N 3.45Å; Q1039-M1042 PolarHBondContact O-N 3.19Å; Q1039-K1043 WeakPolarHBondContact O-CB 3.2Å; Q1039-K1043 PolarHBondContact O-N 3.5Å
1040	T	49.5	Very low	43.3	Very low	65 Å²	65	106.5 Å²	106.5	40%	0.399	55%	0.554	S	S	.	*	H	α-helix	trans	-60.1	-46.3	175.8	-57.6	0	0	0	0	111.1	H1036 Q1037 M1042 K1043 C1044	H1036-T1040 WeakPolarHBondContact O-CB 3.48Å; H1036-T1040 PolarHBondContact O-N 3.42Å; H1036-T1040 PolarHBondContact O-OG1 2.86Å; Q1037-T1040 PolarHBondContact O-N 3.31Å; T1040-M1042 PolarHBondContact O-N 3.3Å; T1040-K1043 PolarHBondContact O-N 3.42Å; T1040-C1044 PolarHBondContact O-N 2.96Å; T1040-C1044 PolarHBondContact O-SG 3.07Å; T1040-C1044 VanDerWaalsContact O-SG 3.35Å
1041	F	38.6	Very low	44.9	Very low	146 Å²	146	107.2 Å²	107.2	64%	0.64	54%	0.539	S	S	*	.	H	α-helix	trans	-63.5	-41.5	177.4	-171.6	-90.1	0	0	0	112.4	Q1037 A1038 Q1039 Y1045	Q1037-F1041 WeakPolarHBondContact O-CB 3.37Å; Q1037-F1041 PolarHBondContact O-N 3.17Å; A1038-F1041 PolarHBondContact O-N 3.19Å; Q1039-F1041 PolarHBondContact O-N 3.45Å; F1041-Y1045 WeakPolarHBondContact O-CB 3.24Å; F1041-Y1045 PolarHBondContact O-N 3.24Å
1042	M	43.3	Very low	46	Very low	105 Å²	105	106.4 Å²	106.4	52%	0.517	53%	0.527	S	S	.	.	H	α-helix	trans	-62.6	-42.9	172.9	-73.7	-170.3	-172.3	0	0	112	A1038 Q1039 T1040 Y1045 Y1046	A1038-M1042 WeakPolarHBondContact O-CG 3.47Å; A1038-M1042 PolarHBondContact O-N 2.68Å; Q1039-M1042 PolarHBondContact O-N 3.19Å; T1040-M1042 PolarHBondContact O-N 3.3Å; M1042-Y1045 PolarHBondContact O-N 3.44Å; M1042-Y1046 HydrophobicContact CB-CD2 4.38Å; M1042-Y1046 HydrophobicContact CB-CE2 4.43Å; M1042-Y1046 WeakPolarHBondContact O-CD2 3.22Å; M1042-Y1046 PolarHBondContact O-N 3.48Å
1043	K	54.3	Low	46.6	Very low	128 Å²	128	105.3 Å²	105.3	56%	0.557	51%	0.513	S	S	*	.	H	α-helix	trans	-58.9	-51.1	177.3	-166.6	171.3	-176.1	174.6	0	110.4	Q1039 T1040 Y1045 Y1046 D1047	Q1039-K1043 WeakPolarHBondContact O-CB 3.2Å; Q1039-K1043 PolarHBondContact O-N 3.5Å; T1040-K1043 PolarHBondContact O-N 3.42Å; K1043-Y1045 PolarHBondContact O-N 3.29Å; K1043-Y1046 PolarHBondContact O-N 2.91Å; K1043-D1047 WeakPolarHBondContact O-CB 3Å; K1043-D1047 PolarHBondContact O-N 3.46Å
1044	C	48.7	Very low	47.7	Very low	75 Å²	75	103.9 Å²	103.9	51%	0.507	51%	0.505	S	S	.	.	H	α-helix	trans	-60.1	-40.2	174.9	-64.3	0	0	0	0	113.3	T1040 E1048	T1040-C1044 PolarHBondContact O-N 2.96Å; T1040-C1044 PolarHBondContact O-SG 3.07Å; T1040-C1044 VanDerWaalsContact O-SG 3.35Å; C1044-E1048 PolarHBondContact O-N 3.1Å
1045	Y	48.9	Very low	48.6	Very low	131 Å²	131	102.9 Å²	102.9	51%	0.514	49%	0.493	S	S	.	.	H	α-helix	trans	-64.9	-44.8	177.2	176.9	-98.4	0	0	0	112.3	F1041 M1042 K1043 L1049	F1041-Y1045 WeakPolarHBondContact O-CB 3.24Å; F1041-Y1045 PolarHBondContact O-N 3.24Å; M1042-Y1045 PolarHBondContact O-N 3.44Å; K1043-Y1045 PolarHBondContact O-N 3.29Å; Y1045-L1049 HydrophobicContact CE1-CD1 3.91Å; Y1045-L1049 HydrophobicContact CE2-CD1 4.16Å; Y1045-L1049 WeakPolarHBondContact O-CB 3.34Å; Y1045-L1049 PolarHBondContact O-N 3.36Å
1046	Y	50.2	Low	49.6	Very low	134 Å²	134	101.3 Å²	101.3	53%	0.525	48%	0.483	S	S	.	.	H	α-helix	trans	-73.1	-31.4	178	-76	-63.3	0	0	0	113.2	M1042 K1043 L1049 S1050	M1042-Y1046 HydrophobicContact CB-CD2 4.38Å; M1042-Y1046 HydrophobicContact CB-CE2 4.43Å; M1042-Y1046 WeakPolarHBondContact O-CD2 3.22Å; M1042-Y1046 PolarHBondContact O-N 3.48Å; K1043-Y1046 PolarHBondContact O-N 2.91Å; Y1046-L1049 PolarHBondContact O-N 3.03Å; Y1046-S1050 VanDerWaalsContact O-CB 3.23Å; Y1046-S1050 WeakPolarHBondContact O-CB 3.41Å; Y1046-S1050 PolarHBondContact O-N 3.22Å; Y1046-S1050 PolarHBondContact O-OG 2.93Å
1047	D	56	Low	50.3	Low	101 Å²	101	99.7 Å²	99.7	54%	0.54	48%	0.478	S	S	.	.	H	α-helix	trans	-66.5	-43.3	171.7	-80.1	-28.2	0	0	0	111.3	K1043 S1050 R1051	K1043-D1047 WeakPolarHBondContact O-CB 3Å; K1043-D1047 PolarHBondContact O-N 3.46Å; D1047-S1050 PolarHBondContact O-N 3Å; D1047-R1051 WeakPolarHBondContact O-CB 3.41Å; D1047-R1051 PolarHBondContact O-N 3.43Å
1048	E	53.2	Low	50.8	Low	99 Å²	99	97.2 Å²	97.2	46%	0.463	47%	0.466	S	S	.	.	H	α-helix	trans	-64.1	-41.8	172	-89.5	-65.2	109.8	0	0	112.2	C1044 S1050 R1051 Y1052	C1044-E1048 PolarHBondContact O-N 3.1Å; E1048-S1050 VanDerWaalsContact C-N 3.29Å; E1048-S1050 PolarHBondContact O-N 2.73Å; E1048-R1051 PolarHBondContact O-N 3.17Å; E1048-R1051 IonicContact OE1-CZ 3.68Å; E1048-R1051 VanDerWaalsContact OE1-CZ 3.23Å; E1048-R1051 IonicContact OE1-NE 2.65Å; E1048-R1051 PolarHBondContact OE1-NE 3.03Å; E1048-R1051 IonicContact OE1-NH2 2.75Å; E1048-R1051 PolarHBondContact OE1-NH2 3.11Å; E1048-R1051 IonicContact OE2-CZ 3.85Å; E1048-R1051 IonicContact OE2-NE 2.78Å; E1048-R1051 IonicContact OE2-NH2 3.23Å; E1048-R1051 PolarHBondContact OE2-NH2 3.37Å; E1048-Y1052 WeakPolarHBondContact O-CB 3.22Å; E1048-Y1052 PolarHBondContact O-N 2.68Å
1049	L	59	Low	51.7	Low	64 Å²	64	100.2 Å²	100.2	34%	0.335	47%	0.47	S	S	.	.	H	α-helix	trans	-61.9	-40	175.2	-133.3	98.3	0	0	0	111.3	Y1045 Y1046 Y1052 H1053	Y1045-L1049 HydrophobicContact CE1-CD1 3.91Å; Y1045-L1049 HydrophobicContact CE2-CD1 4.16Å; Y1045-L1049 WeakPolarHBondContact O-CB 3.34Å; Y1045-L1049 PolarHBondContact O-N 3.36Å; Y1046-L1049 PolarHBondContact O-N 3.03Å; L1049-Y1052 PolarHBondContact O-N 2.79Å; L1049-H1053 WeakPolarHBondContact O-CB 3.36Å; L1049-H1053 PolarHBondContact O-CD2 3.04Å; L1049-H1053 VanDerWaalsContact O-CD2 3.27Å; L1049-H1053 PolarHBondContact O-N 3.39Å
1050	S	52.7	Low	52.1	Low	72 Å²	72	99.1 Å²	99.1	50%	0.503	47%	0.465	S	S	.	.	H	α-helix	trans	-68.8	-40.3	177.9	-61.2	0	0	0	0	111.7	Y1046 D1047 E1048 F1054	Y1046-S1050 VanDerWaalsContact O-CB 3.23Å; Y1046-S1050 WeakPolarHBondContact O-CB 3.41Å; Y1046-S1050 PolarHBondContact O-N 3.22Å; Y1046-S1050 PolarHBondContact O-OG 2.93Å; D1047-S1050 PolarHBondContact O-N 3Å; E1048-S1050 VanDerWaalsContact C-N 3.29Å; E1048-S1050 PolarHBondContact O-N 2.73Å; S1050-F1054 WeakPolarHBondContact O-CB 3.44Å; S1050-F1054 PolarHBondContact O-N 2.89Å
1051	R	60.3	Low	51.8	Low	123 Å²	123	100.5 Å²	100.5	46%	0.464	47%	0.47	S	S	.	.	H	α-helix	trans	-63.1	-43.7	171.9	-172.2	178.5	67.5	87.4	-4.4	110.9	D1047 E1048 F1054 E1055	D1047-R1051 WeakPolarHBondContact O-CB 3.41Å; D1047-R1051 PolarHBondContact O-N 3.43Å; E1048-R1051 PolarHBondContact O-N 3.17Å; E1048-R1051 IonicContact OE1-CZ 3.68Å; E1048-R1051 VanDerWaalsContact OE1-CZ 3.23Å; E1048-R1051 IonicContact OE1-NE 2.65Å; E1048-R1051 PolarHBondContact OE1-NE 3.03Å; E1048-R1051 IonicContact OE1-NH2 2.75Å; E1048-R1051 PolarHBondContact OE1-NH2 3.11Å; E1048-R1051 IonicContact OE2-CZ 3.85Å; E1048-R1051 IonicContact OE2-NE 2.78Å; E1048-R1051 IonicContact OE2-NH2 3.23Å; E1048-R1051 PolarHBondContact OE2-NH2 3.37Å; R1051-F1054 PolarHBondContact O-N 3.31Å; R1051-E1055 IonicContact CZ-OE1 2.72Å; R1051-E1055 IonicContact NH1-OE1 2.78Å; R1051-E1055 PolarHBondContact NH1-OE1 3.3Å; R1051-E1055 WeakPolarHBondContact O-CB 3.17Å; R1051-E1055 PolarHBondContact O-N 3.12Å
1052	Y	53.9	Low	52.1	Low	123 Å²	123	96.8 Å²	96.8	48%	0.482	45%	0.454	S	S	.	.	H	α-helix	trans	-63.9	-46.2	177.5	-173.1	-91.7	0	0	0	111.8	E1048 L1049 E1055 H1056	E1048-Y1052 WeakPolarHBondContact O-CB 3.22Å; E1048-Y1052 PolarHBondContact O-N 2.68Å; L1049-Y1052 PolarHBondContact O-N 2.79Å; Y1052-E1055 CarbonylContact O-C 3.57Å; Y1052-E1055 PolarHBondContact O-N 3.47Å; Y1052-H1056 WeakPolarHBondContact O-CB 3.27Å; Y1052-H1056 PolarHBondContact O-N 3.05Å
1053	H	49.4	Very low	52.2	Low	97 Å²	97	94.8 Å²	94.8	45%	0.449	45%	0.45	S	S	.	.	H	α-helix	trans	-62.2	-42.5	174.2	-86.3	-68.4	0	0	0	112.3	L1049 E1055 H1056 I1057	L1049-H1053 WeakPolarHBondContact O-CB 3.36Å; L1049-H1053 PolarHBondContact O-CD2 3.04Å; L1049-H1053 VanDerWaalsContact O-CD2 3.27Å; L1049-H1053 PolarHBondContact O-N 3.39Å; H1053-E1055 VanDerWaalsContact C-N 3.34Å; H1053-E1055 PolarHBondContact O-N 3.49Å; H1053-H1056 PolarHBondContact O-N 2.88Å; H1053-I1057 WeakPolarHBondContact O-CB 3.44Å; H1053-I1057 VanDerWaalsContact O-CG1 3.28Å; H1053-I1057 WeakPolarHBondContact O-CG1 3.39Å; H1053-I1057 PolarHBondContact O-N 2.59Å
1054	F	57.1	Low	51.6	Low	115 Å²	115	91.7 Å²	91.7	50%	0.504	45%	0.445	S	S	.	.	H	α-helix	trans	-64	-40	175.7	-169.5	-91.9	0	0	0	111.6	S1050 R1051 Q1058	S1050-F1054 WeakPolarHBondContact O-CB 3.44Å; S1050-F1054 PolarHBondContact O-N 2.89Å; R1051-F1054 PolarHBondContact O-N 3.31Å; F1054-Q1058 HydrophobicContact CD1-CG 3.88Å; F1054-Q1058 HydrophobicContact CE1-CG 3.67Å; F1054-Q1058 HydrophobicContact CZ-CG 4.33Å; F1054-Q1058 VanDerWaalsContact O-CB 3.28Å; F1054-Q1058 WeakPolarHBondContact O-CB 3.05Å; F1054-Q1058 WeakPolarHBondContact O-CG 3.35Å; F1054-Q1058 PolarHBondContact O-N 3.09Å
1055	E	55.9	Low	51.3	Low	66 Å²	66	96.2 Å²	96.2	31%	0.308	46%	0.459	S	S	.	.	H	α-helix	trans	-67	-35.8	172.5	-84.1	-168.1	-140.4	0	0	113.4	R1051 Y1052 H1053 Q1058 K1059	R1051-E1055 IonicContact CZ-OE1 2.72Å; R1051-E1055 IonicContact NH1-OE1 2.78Å; R1051-E1055 PolarHBondContact NH1-OE1 3.3Å; R1051-E1055 WeakPolarHBondContact O-CB 3.17Å; R1051-E1055 PolarHBondContact O-N 3.12Å; Y1052-E1055 CarbonylContact O-C 3.57Å; Y1052-E1055 PolarHBondContact O-N 3.47Å; H1053-E1055 VanDerWaalsContact C-N 3.34Å; H1053-E1055 PolarHBondContact O-N 3.49Å; E1055-Q1058 PolarHBondContact O-N 3.17Å; E1055-K1059 WeakPolarHBondContact O-CB 3.49Å; E1055-K1059 WeakPolarHBondContact O-CD 3.21Å; E1055-K1059 WeakPolarHBondContact O-CG 3.22Å; E1055-K1059 PolarHBondContact O-N 2.74Å; E1055-K1059 IonicContact OE2-NZ 3.89Å; E1055-K1059 PolarHBondContact OE2-NZ 3.28Å
1056	H	55.8	Low	50.9	Low	71 Å²	71	98.6 Å²	98.6	33%	0.329	47%	0.472	S	S	.	.	H	α-helix	trans	-66.2	-51	176.8	-160.9	-83.2	0	0	0	110	Y1052 H1053 Q1058 K1059 E1060	Y1052-H1056 WeakPolarHBondContact O-CB 3.27Å; Y1052-H1056 PolarHBondContact O-N 3.05Å; H1053-H1056 PolarHBondContact O-N 2.88Å; H1056-Q1058 VanDerWaalsContact C-N 3.28Å; H1056-Q1058 PolarHBondContact O-N 3.26Å; H1056-K1059 CarbonylContact O-C 3.49Å; H1056-K1059 WeakPolarHBondContact O-CA 3.39Å; H1056-K1059 PolarHBondContact O-N 3.17Å; H1056-E1060 IonicContact CE1-OE1 3.44Å; H1056-E1060 PolarHBondContact CE1-OE1 3.46Å; H1056-E1060 VanDerWaalsContact CE1-OE1 3.26Å; H1056-E1060 IonicContact CE1-OE2 2.63Å; H1056-E1060 PolarHBondContact CE1-OE2 3.32Å; H1056-E1060 IonicContact CG-OE2 3.46Å; H1056-E1060 IonicContact ND1-OE1 2.75Å; H1056-E1060 PolarHBondContact ND1-OE1 3.42Å; H1056-E1060 IonicContact ND1-OE2 3.26Å; H1056-E1060 PolarHBondContact ND1-OE2 2.96Å; H1056-E1060 PolarHBondContact O-N 2.72Å
1057	I	51.3	Low	50.1	Low	91 Å²	91	97.6 Å²	97.6	47%	0.467	48%	0.479	S	S	.	.	H	α-helix	trans	-60.2	-38.4	174.9	-66.1	165.4	0	0	0	110.6	H1053 N1061	H1053-I1057 WeakPolarHBondContact O-CB 3.44Å; H1053-I1057 VanDerWaalsContact O-CG1 3.28Å; H1053-I1057 WeakPolarHBondContact O-CG1 3.39Å; H1053-I1057 PolarHBondContact O-N 2.59Å; I1057-N1061 WeakPolarHBondContact CG2-ND2 3.42Å; I1057-N1061 WeakPolarHBondContact O-CB 3.28Å; I1057-N1061 PolarHBondContact O-N 3.48Å; I1057-N1061 PolarHBondContact O-ND2 3.12Å
1058	Q	48	Very low	48.9	Very low	68 Å²	68	98.8 Å²	98.8	32%	0.318	49%	0.49	S	S	.	.	H	α-helix	trans	-62.3	-44.3	171.5	-75.3	-88.5	-52.8	0	0	111.9	F1054 E1055 H1056 Q1062	F1054-Q1058 HydrophobicContact CD1-CG 3.88Å; F1054-Q1058 HydrophobicContact CE1-CG 3.67Å; F1054-Q1058 HydrophobicContact CZ-CG 4.33Å; F1054-Q1058 VanDerWaalsContact O-CB 3.28Å; F1054-Q1058 WeakPolarHBondContact O-CB 3.05Å; F1054-Q1058 WeakPolarHBondContact O-CG 3.35Å; F1054-Q1058 PolarHBondContact O-N 3.09Å; E1055-Q1058 PolarHBondContact O-N 3.17Å; H1056-Q1058 VanDerWaalsContact C-N 3.28Å; H1056-Q1058 PolarHBondContact O-N 3.26Å; Q1058-Q1062 PolarHBondContact O-N 3.32Å; Q1058-Q1062 PolarHBondContact O-NE2 3.05Å
1059	K	58.8	Low	47.7	Very low	113 Å²	113	99.2 Å²	99.2	49%	0.491	50%	0.504	S	S	.	.	H	α-helix	trans	-68.2	-44.1	-179.2	-74.7	160.1	-168.4	161.4	0	111.3	E1055 H1056 Q1062 S1063	E1055-K1059 WeakPolarHBondContact O-CB 3.49Å; E1055-K1059 WeakPolarHBondContact O-CD 3.21Å; E1055-K1059 WeakPolarHBondContact O-CG 3.22Å; E1055-K1059 PolarHBondContact O-N 2.74Å; E1055-K1059 IonicContact OE2-NZ 3.89Å; E1055-K1059 PolarHBondContact OE2-NZ 3.28Å; H1056-K1059 CarbonylContact O-C 3.49Å; H1056-K1059 WeakPolarHBondContact O-CA 3.39Å; H1056-K1059 PolarHBondContact O-N 3.17Å; K1059-Q1062 CarbonylContact O-C 3.51Å; K1059-Q1062 WeakPolarHBondContact O-CA 3.36Å; K1059-Q1062 PolarHBondContact O-N 3.23Å; K1059-S1063 PolarHBondContact O-N 3.17Å; K1059-S1063 PolarHBondContact O-OG 3.47Å
1060	E	48.1	Very low	46.3	Very low	95 Å²	95	101.3 Å²	101.3	44%	0.444	52%	0.522	S	S	.	.	H	α-helix	trans	-60.8	-44.4	174.6	-74.8	173.6	129	0	0	112.1	H1056 Q1062 S1063 S1064	H1056-E1060 IonicContact CE1-OE1 3.44Å; H1056-E1060 PolarHBondContact CE1-OE1 3.46Å; H1056-E1060 VanDerWaalsContact CE1-OE1 3.26Å; H1056-E1060 IonicContact CE1-OE2 2.63Å; H1056-E1060 PolarHBondContact CE1-OE2 3.32Å; H1056-E1060 IonicContact CG-OE2 3.46Å; H1056-E1060 IonicContact ND1-OE1 2.75Å; H1056-E1060 PolarHBondContact ND1-OE1 3.42Å; H1056-E1060 IonicContact ND1-OE2 3.26Å; H1056-E1060 PolarHBondContact ND1-OE2 2.96Å; H1056-E1060 PolarHBondContact O-N 2.72Å; E1060-Q1062 PolarHBondContact O-N 3.34Å; E1060-S1063 WeakPolarHBondContact CA-OG 3.47Å; E1060-S1063 PolarHBondContact O-N 3.27Å; E1060-S1063 PolarHBondContact O-OG 3.09Å; E1060-S1063 VanDerWaalsContact O-OG 3.08Å; E1060-S1064 WeakPolarHBondContact O-CB 3.22Å; E1060-S1064 PolarHBondContact O-N 2.7Å; E1060-S1064 PolarHBondContact O-OG 2.95Å; E1060-S1064 VanDerWaalsContact O-OG 3.14Å
1061	N	44.1	Very low	45.3	Very low	94 Å²	94	107.2 Å²	107.2	50%	0.503	53%	0.534	S	S	.	.	H	α-helix	trans	-67.7	-16	174.5	-76.6	-70.8	0	0	0	113.6	I1057 S1064	I1057-N1061 WeakPolarHBondContact CG2-ND2 3.42Å; I1057-N1061 WeakPolarHBondContact O-CB 3.28Å; I1057-N1061 PolarHBondContact O-N 3.48Å; I1057-N1061 PolarHBondContact O-ND2 3.12Å; N1061-S1064 WeakPolarHBondContact CA-OG 3.32Å; N1061-S1064 PolarHBondContact O-OG 3.12Å
1062	Q	44.8	Very low	43.8	Very low	68 Å²	68	110.3 Å²	110.3	32%	0.318	55%	0.547	S	S	.	.	H	α-helix	trans	-97.6	-16.7	174.3	-84.4	160.8	97.3	0	0	114	R337 Q1058 K1059 E1060	R337-Q1062 VanDerWaalsContact CZ-OE1 3.22Å; R337-Q1062 VanDerWaalsContact NH2-CD 3.34Å; Q1058-Q1062 PolarHBondContact O-N 3.32Å; Q1058-Q1062 PolarHBondContact O-NE2 3.05Å; K1059-Q1062 CarbonylContact O-C 3.51Å; K1059-Q1062 WeakPolarHBondContact O-CA 3.36Å; K1059-Q1062 PolarHBondContact O-N 3.23Å; E1060-Q1062 PolarHBondContact O-N 3.34Å
1063	S	44.8	Very low	42.5	Very low	62 Å²	62	116.4 Å²	116.4	43%	0.434	57%	0.569	S	S	.	*	H	α-helix	trans	-87.7	-34.2	167.5	56.9	0	0	0	0	111.4	K1059 E1060 K1066 V1067	K1059-S1063 PolarHBondContact O-N 3.17Å; K1059-S1063 PolarHBondContact O-OG 3.47Å; E1060-S1063 WeakPolarHBondContact CA-OG 3.47Å; E1060-S1063 PolarHBondContact O-N 3.27Å; E1060-S1063 PolarHBondContact O-OG 3.09Å; E1060-S1063 VanDerWaalsContact O-OG 3.08Å; S1063-K1066 CarbonylContact O-C 3.6Å; S1063-K1066 WeakPolarHBondContact O-CA 3.21Å; S1063-K1066 PolarHBondContact O-N 3.26Å; S1063-V1067 WeakPolarHBondContact O-CG2 3.45Å; S1063-V1067 PolarHBondContact O-N 2.76Å
1064	S	41.6	Very low	41.5	Very low	64 Å²	64	117.3 Å²	117.3	45%	0.448	58%	0.576	S	S	.	*	H	α-helix	trans	-65	-43.4	173.1	67.1	0	0	0	0	112.1	E1060 N1061 K1066 V1067	E1060-S1064 WeakPolarHBondContact O-CB 3.22Å; E1060-S1064 PolarHBondContact O-N 2.7Å; E1060-S1064 PolarHBondContact O-OG 2.95Å; E1060-S1064 VanDerWaalsContact O-OG 3.14Å; N1061-S1064 WeakPolarHBondContact CA-OG 3.32Å; N1061-S1064 PolarHBondContact O-OG 3.12Å; S1064-K1066 PolarHBondContact O-N 2.87Å; S1064-V1067 PolarHBondContact O-N 2.92Å
1065	E	43.8	Very low	40.1	Very low	169 Å²	169	117.6 Å²	117.6	79%	0.79	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.5	-3	168.7	-86	-161.9	145.5	0	0	114.2
1066	K	39.4	Very low	39	Very low	182 Å²	182	121.8 Å²	121.8	79%	0.791	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-126	-8.4	-179.7	-76.1	-172.4	172.7	-176.4	0	116.1	S1063 S1064	S1063-K1066 CarbonylContact O-C 3.6Å; S1063-K1066 WeakPolarHBondContact O-CA 3.21Å; S1063-K1066 PolarHBondContact O-N 3.26Å; S1064-K1066 PolarHBondContact O-N 2.87Å
1067	V	33.6	Very low	37.8	Very low	113 Å²	113	125.8 Å²	125.8	69%	0.685	64%	0.637	S	S	*	*	S	Bend	trans	-137.4	57.3	-174.3	-163.8	0	0	0	0	112.5	S1063 S1064	S1063-V1067 WeakPolarHBondContact O-CG2 3.45Å; S1063-V1067 PolarHBondContact O-N 2.76Å; S1064-V1067 PolarHBondContact O-N 2.92Å
1068	T	32.1	Very low	36.8	Very low	125 Å²	125	130.9 Å²	130.9	77%	0.767	66%	0.656	S	S	*	*			trans	-171.6	121.5	150.1	13.3	0	0	0	0	106.2
1069	S	28.1	Very low	36	Very low	109 Å²	109	134.1 Å²	134.1	76%	0.762	67%	0.671	S	S	*	*			cis	-119.6	138.5	38.5	177.9	0	0	0	0	114.4
1070	P	29.4	Very low	34.8	Very low	107 Å²	107	133.6 Å²	133.6	70%	0.695	67%	0.674	S	S	*	*			trans	-98.3	83.2	176.1	37.3	-32	0	0	0	112.7
1071	Y	31.4	Very low	34.1	Very low	196 Å²	196	132.2 Å²	132.2	77%	0.769	68%	0.679	S	S	*	*			trans	-138.1	133.3	160.8	-98.1	-78.4	0	0	0	112.2
1072	Y	28.6	Very low	33.5	Very low	189 Å²	189	133.8 Å²	133.8	74%	0.741	69%	0.686	S	S	*	*			trans	52.9	77.7	175.3	-70.2	-73.4	0	0	0	118.2	I1074	Y1072-I1074 HydrophobicContact CD1-CD1 3.93Å; Y1072-I1074 HydrophobicContact CD1-CG1 3.77Å; Y1072-I1074 PolarHBondContact O-N 3.46Å
1073	R	26.1	Very low	32.9	Very low	250 Å²	250	135.8 Å²	135.8	94%	0.943	71%	0.706	S	S	*	*			trans	-69	114.9	132.4	-81.7	-174.4	176.1	-179.9	-0.3	108.2
1074	I	29.3	Very low	32.4	Very low	117 Å²	117	140.4 Å²	140.4	60%	0.6	73%	0.725	S	S	*	*			trans	-108.5	111.9	158.3	-60.6	-179	0	0	0	107	Y1072 L1076	Y1072-I1074 HydrophobicContact CD1-CD1 3.93Å; Y1072-I1074 HydrophobicContact CD1-CG1 3.77Å; Y1072-I1074 PolarHBondContact O-N 3.46Å; I1074-L1076 HydrophobicContact CG2-CD1 3.91Å; I1074-L1076 HydrophobicContact CG2-CG 4.01Å; I1074-L1076 PolarHBondContact O-N 3.22Å
1075	P	27.2	Very low	31.9	Very low	120 Å²	120	144.9 Å²	144.9	78%	0.779	74%	0.744	S	S	*	*			trans	-85.6	94.2	-178.7	32.9	-31.8	0	0	0	110.2
1076	L	32.3	Very low	31.3	Very low	154 Å²	154	140 Å²	140	81%	0.806	74%	0.739	S	S	*	*			trans	-124.7	141.8	174.1	-75.9	174.6	0	0	0	112.6	I1074	I1074-L1076 HydrophobicContact CG2-CD1 3.91Å; I1074-L1076 HydrophobicContact CG2-CG 4.01Å; I1074-L1076 PolarHBondContact O-N 3.22Å
1077	N	30.6	Very low	31	Very low	156 Å²	156	137.1 Å²	137.1	83%	0.834	74%	0.742	S	S	*	*			trans	-77.7	169.8	-169.2	-85.1	-59.7	0	0	0	113.5	E1079	N1077-E1079 PolarHBondContact O-N 3.11Å
1078	K	30.6	Very low	31	Very low	197 Å²	197	135.9 Å²	135.9	86%	0.857	74%	0.743	S	S	*	*			trans	-37.2	123.2	161.9	-56.5	166.4	-177.5	173.8	0	111.4
1079	E	32.1	Very low	31.2	Very low	136 Å²	136	137.4 Å²	137.4	64%	0.636	75%	0.747	S	S	*	*				173.6	108.8	115.6	-98.1	-163.6	-144.7	0	0	113.9	K202 N1077	K202-E1079 IonicContact NZ-OE2 2.77Å; K202-E1079 PolarHBondContact NZ-OE2 3.48Å; N1077-E1079 PolarHBondContact O-N 3.11Å
1080	N	32.9	Very low	31.5	Very low	103 Å²	103	144 Å²	144	55%	0.551	77%	0.771	S	S	*	*			trans	67.6	164.3	151.4	-56.3	-67.1	0	0	0	118.8	K202	K202-N1080 HydrophobicContact CD-CB 3.94Å; K202-N1080 VanDerWaalsContact CE-ND2 3.32Å; K202-N1080 WeakPolarHBondContact CE-ND2 3.11Å; K202-N1080 HydrophobicContact CG-CB 3.68Å
1081	A	32.5	Very low	31.6	Very low	66 Å²	66	145.8 Å²	145.8	55%	0.545	78%	0.775	S	S	.	*			cis	-172.3	169	-37.4	0	0	0	0	0	109.6
1082	I	33.4	Very low	31.6	Very low	127 Å²	127	143.2 Å²	143.2	65%	0.651	78%	0.775	S	S	*	*			trans	80.4	137.3	164.1	-55.3	176.6	0	0	0	116.9	G201	G201-I1082 WeakPolarHBondContact O-CD1 3.42Å
1083	C	30.4	Very low	31.8	Very low	110 Å²	110	140.6 Å²	140.6	74%	0.743	78%	0.777	S	S	*	*			trans	-126.9	152.6	176.3	-48.2	0	0	0	0	110.3
1084	L	34.5	Very low	32.1	Very low	159 Å²	159	134.2 Å²	134.2	83%	0.832	77%	0.767	S	S	*	*			trans	-141.9	127.3	154.2	-66.7	174.8	0	0	0	105.8
1085	N	32.4	Very low	32.3	Very low	157 Å²	157	135.3 Å²	135.3	84%	0.84	78%	0.778	S	S	*	*				79.9	134.5	51	-72.5	5.1	0	0	0	113.8
1086	G	31.1	Very low	32.6	Very low	68 Å²	68	136.3 Å²	136.3	70%	0.701	78%	0.777	S	S	*	*			trans	108.5	93.9	-165	0	0	0	0	0	111
1087	S	31.9	Very low	32.6	Very low	120 Å²	120	135 Å²	135	84%	0.839	78%	0.775	S	S	*	*			cis	74.1	99.5	24.8	83.9	0	0	0	0	116.4
1088	A	34.8	Very low	32.8	Very low	87 Å²	87	133.4 Å²	133.4	72%	0.719	77%	0.771	S	S	*	*			trans	-174.3	107.2	140.7	0	0	0	0	0	111.3
1089	D	35.7	Very low	33	Very low	158 Å²	158	128.1 Å²	128.1	85%	0.845	76%	0.764	S	S	*	*			trans	48.6	99.5	131	-43.9	-21.1	0	0	0	121.3
1090	I	33.9	Very low	33	Very low	246 Å²	246	127.4 Å²	127.4	100%	1.262	78%	0.775	S	S	*	*				-128.5	0	114.8	-60.7	-175.7	0	0	0	107

Retrieved 1,090 of 1,090 residues in 442.7 ms (Link to these results)

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