A0A5K4FBR7_SCHMA Loading...

SMP-LTD domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4FBR7, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,266 aa.

						>A0A5K4FBR7_SCHMA|A0A5K4FBR7
MSAKKPKLPGLNLRSGSSRHDWDSVGTIKFFTDKDDDISGLDEAMRTISMGTRQSGEANVHSPSSHTSDKDSTSYTGYIDGFSGQNKLDVEIAVEAIAAESFSPMDLIDSTESVKETHDCKNESSFSQQTNESLGVFSFNNDLNTNSNLLSNSIDVFRTADRHNSLDLDDSRDISSSTGSHVVHSLKPNVDSNLTKTVLLDENLDVHLHSNVLPDSSPDCTETTTPSTILINPSRINTLSLSTSSKPVNSVMGNQHDTHVPVFNDSFKPPMNVNVDKTRNVSDHMPPCLSSSKMKIDSSPPTSTLATDSNDQIPNKVTEPIRLPVSIPNTRNPTSISLAPVPHSSSLITPALSENPQIRQRHVTTTTTTTSTTTITNNNNNIPGATGSKVSRSKSHRLSVVKKSHPWMRYTFCSLTVFLIYWLFNGFLLGLTVGCILTYTFITVYNYLHSRTSYSNQILCPISGLPLDHLCCSLHYRQEQEGQYQGSQWWPIYSPAMPNLTSILTNNANSTNKCMQLRNLPNFTVPNMLEEDVNKSTISGPLGNSLGFKYDNNGRPVYKGWLNEIIHYDPETHHIGKTFSVFLTLDGTQLRLQRPEHNITRRSLWNDEIPSTTTIRFKQQHIYDLTNATVTLLPCGLVGKRLWSRKYPICITVPTESRFKRKNERLDSLPSSTSFPNIILSTSSNVPVIETSDLSVDTSIPSAGDMEFPDDTTINVLQASSKSNAKNLYLFGRTCREKETWYRRLKAASLGTPLIWTPQMAVQHYLLASDINTSNNNVGLSDYLIGTATATSNTISNHNDSTLSDDESQPDRNTSSNLVTCCDSTASTANTDVATTSINSNNSNSIPTGLSSTTNTNSTHSSSINLSNSGVPIPGHREPVYVSYVRYMAKFMPANWLVRSAQALKLNVNQISCDTNMIWLNALIGRLLWDFLREPYWLEKIKNKIQAKLKKIHLPNFINELTVVDIDLGSEIPVLRRVGCPYLDAHGLWIEVDVGYAGGFSFALETSVNLMRWNQKLREEKDINYSSDNFAQNSLSNESLPKVNSRSITKMAAYLSDEEDSADSTTDSELDETTNISQNSSPINSLRTGRNLPSTGLILGGIKSGDNERGNPEDNRSFNRLSPVSPNRPVNLQPVLPSRRRIIRIVDRITKSSYFQRAVDTKLVQRGMERLSNTPIILQVEIQMLSGTLLVNIPPPPSDRLWYGFRPVPNIRLKARPRVGEKVVTMSRILEWIERKMILEFQHLVVLPNMDDLKVGLLLSDTTSTT
					

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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	35.9	Very low	36	Very low	239 Å²	239	153.2 Å²	153.2	100%	1.177	85%	0.848	S	S	*	*				0	109.3	0	-67.1	155.9	160.7	0	0	106.2
2	S	32.9	Very low	35.6	Very low	121 Å²	121	153.5 Å²	153.5	85%	0.846	85%	0.847	S	S	*	*				68.7	120.8	63	-170.2	0	0	0	0	112.6
3	A	31.8	Very low	35.1	Very low	83 Å²	83	153.8 Å²	153.8	69%	0.686	85%	0.845	S	S	*	*			cis	-168.8	175.5	-9.3	0	0	0	0	0	112.3
4	K	36.4	Very low	34.7	Very low	205 Å²	205	160.4 Å²	160.4	89%	0.891	85%	0.851	S	S	*	*			trans	97.2	113.1	155.3	-60	-178	176.6	178.9	0	120.3
5	K	37	Very low	34.2	Very low	205 Å²	205	157.9 Å²	157.9	89%	0.891	85%	0.852	S	S	*	*			trans	-85.6	156	152	-73.2	178.6	172.2	177.9	0	111.1
6	P	45.3	Very low	33.9	Very low	121 Å²	121	152.8 Å²	152.8	79%	0.786	85%	0.848	S	S	*	*			trans	-110.8	132.6	133.1	33.9	-26.1	0	0	0	109.3
7	K	39.4	Very low	33.6	Very low	199 Å²	199	150.7 Å²	150.7	87%	0.865	85%	0.847	S	S	*	*				68	112.9	58.6	-83.7	-160	171.3	-170.9	0	115.2
8	L	31.3	Very low	33.4	Very low	165 Å²	165	147.8 Å²	147.8	86%	0.864	84%	0.838	S	S	*	*			trans	-79.9	155.4	170.9	-89	74.7	0	0	0	112.4
9	P	40.4	Very low	33.1	Very low	124 Å²	124	151.3 Å²	151.3	81%	0.805	84%	0.836	S	S	*	*			trans	-100.8	167.3	133.1	37.2	-28.8	0	0	0	111
10	G	35.4	Very low	33	Very low	69 Å²	69	150.8 Å²	150.8	71%	0.711	83%	0.827	S	S	*	*			trans	-144.8	-174.5	-174.8	0	0	0	0	0	116
11	L	29.8	Very low	32.8	Very low	154 Å²	154	150 Å²	150	81%	0.806	82%	0.822	S	S	*	*			trans	58.7	106.9	170.3	-64.9	170.4	0	0	0	118.2
12	N	32.2	Very low	32.4	Very low	157 Å²	157	150.5 Å²	150.5	84%	0.84	81%	0.811	S	S	*	*				-167.8	159.7	96.7	-101.4	-63.9	0	0	0	112.4
13	L	28.7	Very low	32.3	Very low	157 Å²	157	152.5 Å²	152.5	82%	0.822	81%	0.812	S	S	*	*			trans	-79.3	134.6	-173.6	-75.1	74.4	0	0	0	112.9
14	R	29.2	Very low	32.4	Very low	246 Å²	246	154 Å²	154	93%	0.928	82%	0.818	S	S	*	*			trans	-156.3	147.8	141.1	-132.4	176.7	-178.2	-159.1	-1.9	111.9
15	S	27.8	Very low	32.4	Very low	123 Å²	123	149.2 Å²	149.2	86%	0.86	81%	0.805	S	S	*	*			trans	-74.9	143.4	-177.6	45.9	0	0	0	0	113.2
16	G	29.2	Very low	32	Very low	77 Å²	77	143 Å²	143	79%	0.794	80%	0.799	S	S	*	*			trans	165.7	78	172.3	0	0	0	0	0	118.7
17	S	29.2	Very low	31.3	Very low	117 Å²	117	142.7 Å²	142.7	82%	0.818	80%	0.795	S	S	*	*			trans	30.3	135	144.8	-159.6	0	0	0	0	123.4
18	S	29.4	Very low	31	Very low	98 Å²	98	139.8 Å²	139.8	69%	0.685	79%	0.788	S	S	*	*			trans	103	140.9	139.2	81.2	0	0	0	0	121
19	R	27.6	Very low	30.9	Very low	214 Å²	214	140.5 Å²	140.5	81%	0.808	78%	0.784	S	S	*	*			trans	66.9	142	177.2	-56.6	-175.1	158.1	101.7	-3.3	114.6
20	H	30.2	Very low	30.6	Very low	142 Å²	142	141.4 Å²	141.4	66%	0.657	78%	0.776	S	S	*	*			cis	-140.7	165.7	35.3	-104.3	-86	0	0	0	115.5
21	D	29.6	Very low	30.4	Very low	135 Å²	135	147.5 Å²	147.5	72%	0.722	78%	0.783	S	S	*	*			trans	51.3	116.8	153	-51.9	-8.7	0	0	0	120.8
22	W	28	Very low	30.6	Very low	248 Å²	248	144.5 Å²	144.5	94%	0.939	77%	0.771	S	S	*	*			trans	-129.6	77.4	164	-86.9	80.3	0	0	0	109.8
23	D	29.8	Very low	30.8	Very low	164 Å²	164	143.7 Å²	143.7	88%	0.877	77%	0.766	S	S	*	*			trans	-108.5	86.6	165.9	-102.1	-31.6	0	0	0	109
24	S	34.1	Very low	31.1	Very low	114 Å²	114	145 Å²	145	80%	0.797	77%	0.766	S	S	*	*	S	Bend	trans	-172.3	145.5	154.3	-88.6	0	0	0	0	114
25	V	37.1	Very low	31.5	Very low	104 Å²	104	139.4 Å²	139.4	63%	0.63	75%	0.754	S	S	*	*			trans	-37.2	129.4	174.8	-178.3	0	0	0	0	114	T27	V25-T27 PolarHBondContact O-N 3.41Å
26	G	28.1	Very low	31.9	Very low	74 Å²	74	140.2 Å²	140.2	76%	0.763	75%	0.749	S	S	*	*			trans	-74.3	83.1	175.3	0	0	0	0	0	113.5	I28	G26-I28 PolarHBondContact O-N 3.13Å
27	T	31.3	Very low	32.2	Very low	115 Å²	115	144.1 Å²	144.1	71%	0.706	75%	0.751	S	S	*	*			trans	-69.8	121.8	162.2	-60	0	0	0	0	109.4	V25 K29	V25-T27 PolarHBondContact O-N 3.41Å; T27-K29 PolarHBondContact O-N 3.18Å
28	I	33.6	Very low	32.4	Very low	139 Å²	139	144.4 Å²	144.4	71%	0.713	74%	0.743	S	S	*	*			trans	-72.5	95.2	171.8	-58.1	179.8	0	0	0	108	G26 F30	G26-I28 PolarHBondContact O-N 3.13Å; I28-F30 PolarHBondContact O-N 3.08Å; I28-F30 VanDerWaalsContact O-N 3.08Å
29	K	29.3	Very low	32.6	Very low	179 Å²	179	145.6 Å²	145.6	78%	0.778	75%	0.751	S	S	*	*			trans	-65.3	106.9	165.6	-83.1	-171.4	173.3	-176.2	0	108.7	T27 F31	T27-K29 PolarHBondContact O-N 3.18Å; K29-F31 PolarHBondContact O-N 3.04Å
30	F	32.9	Very low	33	Very low	144 Å²	144	138.1 Å²	138.1	63%	0.632	74%	0.741	S	S	*	*			trans	-59.4	123	157.4	-70.8	-87.9	0	0	0	108	I28 T32	I28-F30 PolarHBondContact O-N 3.08Å; I28-F30 VanDerWaalsContact O-N 3.08Å; F30-T32 PolarHBondContact O-N 3.22Å
31	F	30.6	Very low	33.2	Very low	196 Å²	196	135.6 Å²	135.6	86%	0.86	73%	0.731	S	S	*	*			trans	-68.6	96.8	171.9	-81	-102.7	0	0	0	108.7	K29	K29-F31 PolarHBondContact O-N 3.04Å
32	T	35.3	Very low	33.7	Very low	91 Å²	91	134 Å²	134	56%	0.558	72%	0.723	S	S	*	*			trans	-89.9	99.7	159.2	55.6	0	0	0	0	107.1	F30	F30-T32 PolarHBondContact O-N 3.22Å
33	D	36.2	Very low	34.2	Very low	140 Å²	140	128.6 Å²	128.6	75%	0.749	71%	0.708	S	S	*	*			trans	-65.9	153	175.9	-119.8	-39.9	0	0	0	111.7
34	K	35	Very low	34.4	Very low	185 Å²	185	123.6 Å²	123.6	80%	0.804	69%	0.69	S	S	*	*			trans	-105.7	84.9	-178.9	-82	-168.2	163.1	-153.2	0	110.2	D36	K34-D36 VanDerWaalsContact C-N 3.31Å; K34-D36 PolarHBondContact O-N 3Å
35	D	38.3	Very low	34.6	Very low	129 Å²	129	124.5 Å²	124.5	69%	0.69	68%	0.683	S	S	*	*			trans	-95.9	52.6	169.9	-66.8	-38.7	0	0	0	111.4
36	D	36.1	Very low	34.6	Very low	140 Å²	140	127.4 Å²	127.4	75%	0.749	68%	0.682	S	S	*	*			trans	-124.1	145	164.5	-59.2	-66.7	0	0	0	105.9	K34	K34-D36 VanDerWaalsContact C-N 3.31Å; K34-D36 PolarHBondContact O-N 3Å
37	D	34.3	Very low	35	Very low	158 Å²	158	129.3 Å²	129.3	85%	0.845	68%	0.679	S	S	*	*			trans	74.4	56.6	-169.6	-57.2	-28.9	0	0	0	118.1
38	I	34.6	Very low	35.1	Very low	124 Å²	124	131.1 Å²	131.1	64%	0.636	68%	0.683	S	S	*	*			trans	-116.1	65.8	160.1	-47.8	-174.4	0	0	0	111.2	L41	I38-L41 HydrophobicContact CG2-CB 3.67Å; I38-L41 HydrophobicContact CG2-CD2 4.34Å
39	S	33.5	Very low	35	Very low	123 Å²	123	130.2 Å²	130.2	86%	0.86	69%	0.689	S	S	*	*	S	Bend	trans	-104	-4.2	171.4	52.5	0	0	0	0	113.7
40	G	36.1	Very low	35.1	Very low	57 Å²	57	131.1 Å²	131.1	59%	0.588	70%	0.699	S	S	*	*	S	Bend	trans	-119.8	0.6	-175.7	0	0	0	0	0	116.9
41	L	34.3	Very low	35	Very low	88 Å²	88	127.5 Å²	127.5	46%	0.461	70%	0.702	S	S	.	*	H	α-helix	trans	-94.2	-25	-170.5	-154.6	74.6	0	0	0	114.8	I38 E43 A44 M45	I38-L41 HydrophobicContact CG2-CB 3.67Å; I38-L41 HydrophobicContact CG2-CD2 4.34Å; L41-E43 VanDerWaalsContact C-N 3.29Å; L41-E43 PolarHBondContact O-N 2.84Å; L41-A44 PolarHBondContact O-N 3.5Å; L41-M45 HydrophobicContact CD2-CE 4.04Å; L41-M45 HydrophobicContact CG-CE 4.12Å; L41-M45 PolarHBondContact O-N 3.05Å
42	D	39.1	Very low	35.3	Very low	101 Å²	101	124.9 Å²	124.9	54%	0.54	70%	0.702	S	S	.	*	H	α-helix	trans	-64.7	-33.5	179.5	-166.3	60.4	0	0	0	112.1	R46	D42-R46 IonicContact OD1-NH2 3.32Å; D42-R46 IonicContact OD2-CZ 2.82Å; D42-R46 IonicContact OD2-NH1 2.71Å; D42-R46 PolarHBondContact OD2-NH1 3.42Å; D42-R46 IonicContact OD2-NH2 3.16Å; D42-R46 PolarHBondContact OD2-NH2 3.09Å
43	E	38.7	Very low	35	Very low	135 Å²	135	131.5 Å²	131.5	63%	0.631	72%	0.717	S	S	*	*	H	α-helix	trans	-77.4	-31	177.2	-161.7	63.3	-175	0	0	112.4	L41 R46	L41-E43 VanDerWaalsContact C-N 3.29Å; L41-E43 PolarHBondContact O-N 2.84Å; E43-R46 IonicContact OE2-NH1 2.71Å
44	A	34	Very low	34.9	Very low	60 Å²	60	133.3 Å²	133.3	50%	0.496	72%	0.721	S	S	.	*	H	α-helix	trans	-68.6	-35.7	176.7	0	0	0	0	0	112.4	L41	L41-A44 PolarHBondContact O-N 3.5Å
45	M	37.6	Very low	34.8	Very low	132 Å²	132	130.2 Å²	130.2	65%	0.65	72%	0.723	S	S	*	*	H	α-helix	trans	-82.6	-13	-177.5	-69	-169.9	-68.9	0	0	114.6	L41 T47	L41-M45 HydrophobicContact CD2-CE 4.04Å; L41-M45 HydrophobicContact CG-CE 4.12Å; L41-M45 PolarHBondContact O-N 3.05Å; M45-T47 PolarHBondContact O-N 2.86Å
46	R	37.5	Very low	34.4	Very low	165 Å²	165	127.9 Å²	127.9	62%	0.623	73%	0.729	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.8	-10	174.6	-81.9	-166.6	178.8	85.3	22	115.1	D42 E43	D42-R46 IonicContact OD1-NH2 3.32Å; D42-R46 IonicContact OD2-CZ 2.82Å; D42-R46 IonicContact OD2-NH1 2.71Å; D42-R46 PolarHBondContact OD2-NH1 3.42Å; D42-R46 IonicContact OD2-NH2 3.16Å; D42-R46 PolarHBondContact OD2-NH2 3.09Å; E43-R46 IonicContact OE2-NH1 2.71Å
47	T	36.2	Very low	34.1	Very low	114 Å²	114	130.7 Å²	130.7	70%	0.699	74%	0.738	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.7	16.2	-160.2	-43.6	0	0	0	0	114.5	M45	M45-T47 PolarHBondContact O-N 2.86Å
48	I	33.5	Very low	34	Very low	153 Å²	153	127.2 Å²	127.2	79%	0.785	73%	0.731	S	S	*	*	S	Bend	trans	-133.3	137.7	175.3	-57	-178.3	0	0	0	110.5
49	S	32.6	Very low	33.9	Very low	121 Å²	121	128.4 Å²	128.4	85%	0.846	74%	0.739	S	S	*	*			trans	80.2	47.1	177.1	-146.8	0	0	0	0	117.9
50	M	31.2	Very low	33.9	Very low	197 Å²	197	128 Å²	128	97%	0.97	73%	0.731	S	S	*	*			trans	-110.3	122.7	141.9	-79.7	-141.8	-71.9	0	0	109.4
51	G	31.5	Very low	33.8	Very low	68 Å²	68	132.9 Å²	132.9	70%	0.701	74%	0.738	S	S	*	*			trans	-167.4	75.7	-171.3	0	0	0	0	0	115.3
52	T	34.9	Very low	33.5	Very low	142 Å²	142	133.6 Å²	133.6	87%	0.871	75%	0.75	S	S	*	*			trans	-167.8	142.1	133.6	10.6	0	0	0	0	113.6
53	R	30.6	Very low	33.3	Very low	230 Å²	230	134 Å²	134	87%	0.868	76%	0.759	S	S	*	*			trans	77.7	120.7	159.5	-73.5	-177.7	165.8	174.3	-3.7	121
54	Q	33.7	Very low	32.9	Very low	177 Å²	177	132.6 Å²	132.6	83%	0.827	76%	0.764	S	S	*	*			trans	95.5	96.4	145.7	-72.5	179.9	-20.3	0	0	120.8
55	S	31.7	Very low	32.7	Very low	121 Å²	121	134.5 Å²	134.5	85%	0.846	77%	0.773	S	S	*	*			trans	60.4	115.6	134.1	57	0	0	0	0	120.9
56	G	31.3	Very low	32.4	Very low	80 Å²	80	136.4 Å²	136.4	83%	0.825	78%	0.78	S	S	*	*			trans	167.8	119.6	162.4	0	0	0	0	0	111.8
57	E	29	Very low	32.1	Very low	199 Å²	199	134.5 Å²	134.5	93%	0.93	79%	0.787	S	S	*	*			trans	-90.3	163.4	172.7	-52.3	160.6	105.7	0	0	108.8
58	A	32.2	Very low	31.8	Very low	84 Å²	84	133.5 Å²	133.5	69%	0.694	79%	0.785	S	S	*	*			cis	-160.9	160.7	7	0	0	0	0	0	111.5
59	N	31.8	Very low	31.8	Very low	150 Å²	150	132.4 Å²	132.4	80%	0.802	78%	0.781	S	S	*	*			trans	51.3	143.7	134.2	-96.8	-8.5	0	0	0	121.8
60	V	33.7	Very low	31.7	Very low	114 Å²	114	133.4 Å²	133.4	69%	0.691	77%	0.77	S	S	*	*			cis	-151.7	165.7	21.9	-176.3	0	0	0	0	112.1
61	H	34	Very low	31.6	Very low	159 Å²	159	130.6 Å²	130.6	74%	0.736	76%	0.758	S	S	*	*			trans	-25.5	155.2	166.5	-50.5	-32.4	0	0	0	120.4
62	S	28.5	Very low	31.5	Very low	103 Å²	103	132.2 Å²	132.2	72%	0.72	76%	0.759	S	S	*	*			cis	99.5	168.2	24.2	90.7	0	0	0	0	115.9
63	P	35.5	Very low	31.2	Very low	111 Å²	111	131.7 Å²	131.7	72%	0.721	76%	0.756	S	S	*	*				-139.3	-178.8	-100	42.3	-23.2	0	0	0	119.7
64	S	29.6	Very low	30.9	Very low	105 Å²	105	125.7 Å²	125.7	73%	0.734	75%	0.749	S	S	*	*			trans	89.3	134.3	144.2	78.2	0	0	0	0	124.2
65	S	29.4	Very low	30.6	Very low	100 Å²	100	128.4 Å²	128.4	70%	0.699	75%	0.754	S	S	*	*				138.3	140.3	111.5	71.2	0	0	0	0	120.9
66	H	31.9	Very low	30.4	Very low	171 Å²	171	128.9 Å²	128.9	79%	0.792	75%	0.751	S	S	*	*			trans	81.4	136.8	140.5	-80.6	-51	0	0	0	127.9
67	T	31	Very low	30.4	Very low	125 Å²	125	128.5 Å²	128.5	77%	0.767	75%	0.748	S	S	*	*			trans	74.2	162	152.4	54.9	0	0	0	0	121.5
68	S	30.9	Very low	30.3	Very low	94 Å²	94	130.1 Å²	130.1	66%	0.657	75%	0.747	S	S	*	*				179.9	159.4	-59.5	52.3	0	0	0	0	111.9
69	D	32.6	Very low	30.1	Very low	130 Å²	130	133.4 Å²	133.4	70%	0.695	75%	0.751	S	S	*	*			trans	70.1	151.2	170.1	-78	2.2	0	0	0	117.6
70	K	30.5	Very low	30.1	Very low	142 Å²	142	134.1 Å²	134.1	62%	0.617	76%	0.755	S	S	*	*			cis	-170	162.7	-21.6	-119.9	-170.1	-159.7	73.9	0	111.4
71	D	29.6	Very low	29.8	Very low	137 Å²	137	131.5 Å²	131.5	73%	0.733	75%	0.751	S	S	*	*			trans	58.7	171.9	150.8	-55.1	-13.1	0	0	0	120.9
72	S	28.3	Very low	29.6	Very low	102 Å²	102	133.9 Å²	133.9	71%	0.713	76%	0.759	S	S	*	*				-172.5	123.2	-71.5	57.4	0	0	0	0	112.3
73	T	28.7	Very low	29.5	Very low	132 Å²	132	134.2 Å²	134.2	81%	0.81	76%	0.762	S	S	*	*			trans	-153.5	116.2	161.9	47.3	0	0	0	0	109
74	S	25.9	Very low	29.3	Very low	103 Å²	103	132.5 Å²	132.5	72%	0.72	76%	0.764	S	S	*	*				82.1	111	50.4	78.2	0	0	0	0	114.6
75	Y	26.5	Very low	29.3	Very low	235 Å²	235	135.9 Å²	135.9	92%	0.922	77%	0.769	S	S	*	*			trans	-141.4	144.7	152.1	-143.4	-91.2	0	0	0	109.4
76	T	28.3	Very low	29.4	Very low	130 Å²	130	138.9 Å²	138.9	80%	0.798	78%	0.777	S	S	*	*			trans	-136.3	142.1	-161.6	51.5	0	0	0	0	113.7
77	G	30.8	Very low	29.2	Very low	73 Å²	73	138.6 Å²	138.6	75%	0.753	77%	0.773	S	S	*	*			trans	168.5	135.7	168.6	0	0	0	0	0	108.2
78	Y	27.7	Very low	29.2	Very low	232 Å²	232	140.2 Å²	140.2	91%	0.91	78%	0.776	S	S	*	*			cis	-125.7	160.4	17.7	-108.8	-107.8	0	0	0	112.8
79	I	27.7	Very low	29.1	Very low	153 Å²	153	140.8 Å²	140.8	79%	0.785	77%	0.772	S	S	*	*			trans	-131.6	126.9	162.2	-67.1	178.1	0	0	0	108
80	D	30.6	Very low	28.9	Very low	166 Å²	166	140.8 Å²	140.8	89%	0.888	78%	0.776	S	S	*	*			trans	-179.4	141.6	146.8	-96.8	-27.5	0	0	0	107.4
81	G	29	Very low	28.7	Very low	58 Å²	58	142.4 Å²	142.4	60%	0.598	79%	0.786	S	S	*	*			cis	-171	-151.7	-0.9	0	0	0	0	0	111.1
82	F	29.8	Very low	28.5	Very low	209 Å²	209	143.3 Å²	143.3	92%	0.917	79%	0.789	S	S	*	*			trans	65.9	79.5	175.5	-70.1	-79.9	0	0	0	118.2
83	S	26.3	Very low	28.4	Very low	110 Å²	110	142.6 Å²	142.6	77%	0.769	79%	0.79	S	S	*	*			trans	-62.6	136.2	136.9	173.6	0	0	0	0	109.8
84	G	30.7	Very low	28.2	Very low	75 Å²	75	142.2 Å²	142.2	77%	0.773	79%	0.787	S	S	*	*			trans	-140.4	115.6	173.9	0	0	0	0	0	111
85	Q	28.9	Very low	28.3	Very low	177 Å²	177	145 Å²	145	83%	0.827	79%	0.789	S	S	*	*			trans	-99.1	125.6	176.7	-66.1	172	-71.7	0	0	110.2
86	N	32.4	Very low	28.2	Very low	162 Å²	162	137.7 Å²	137.7	87%	0.866	78%	0.776	S	S	*	*			trans	179.8	121.4	157.8	-84	-30.8	0	0	0	104.2
87	K	27.2	Very low	28.1	Very low	166 Å²	166	139.2 Å²	139.2	72%	0.722	78%	0.778	S	S	*	*			cis	69.1	79.9	40.3	-155.5	-147.4	167.8	-167.8	0	115
88	L	30.6	Very low	27.9	Very low	158 Å²	158	140.1 Å²	140.1	83%	0.827	78%	0.779	S	S	*	*			trans	-152.3	124.3	133.1	-85.7	125.5	0	0	0	104.8
89	D	30	Very low	27.8	Very low	107 Å²	107	133.9 Å²	133.9	57%	0.572	78%	0.775	S	S	*	*				66.1	101.3	73.2	-54.7	-39.6	0	0	0	109.6
90	V	26.5	Very low	27.7	Very low	129 Å²	129	135.7 Å²	135.7	78%	0.782	78%	0.78	S	S	*	*				75.6	89.6	69.8	178.2	0	0	0	0	113.1
91	E	27.8	Very low	27.6	Very low	176 Å²	176	133.8 Å²	133.8	82%	0.822	78%	0.78	S	S	*	*			trans	-166.6	126	139.1	-98.8	176.2	137.7	0	0	105.7
92	I	25.9	Very low	27.5	Very low	156 Å²	156	140.3 Å²	140.3	80%	0.8	79%	0.792	S	S	*	*				78	139.3	65	-63.3	172.1	0	0	0	112
93	A	24.6	Very low	27.4	Very low	88 Å²	88	135.4 Å²	135.4	73%	0.727	78%	0.784	S	S	*	*			trans	-85.5	163.8	-169.3	0	0	0	0	0	113.2
94	V	26	Very low	27.9	Very low	123 Å²	123	135.5 Å²	135.5	75%	0.745	78%	0.782	S	S	*	*			trans	-163.1	157.7	139	130.8	0	0	0	0	110.3
95	E	27.2	Very low	27.9	Very low	163 Å²	163	140 Å²	140	76%	0.762	79%	0.785	S	S	*	*			trans	3.9	149.3	169.1	-74.5	127	-148.2	0	0	122.7
96	A	25.2	Very low	28	Very low	80 Å²	80	138.1 Å²	138.1	66%	0.661	78%	0.78	S	S	*	*			cis	75.4	93.4	20.4	0	0	0	0	0	117.4
97	I	24.9	Very low	27.8	Very low	162 Å²	162	138 Å²	138	83%	0.831	78%	0.779	S	S	*	*			trans	75.1	69.2	160.8	-40.4	174.8	0	0	0	115.7
98	A	26.7	Very low	28.2	Very low	93 Å²	93	137.5 Å²	137.5	77%	0.769	78%	0.782	S	S	*	*			trans	-146.1	122.8	151.5	0	0	0	0	0	106.1
99	A	26.4	Very low	28.3	Very low	101 Å²	101	136.4 Å²	136.4	84%	0.835	78%	0.777	S	S	*	*				82.3	145.8	71.3	0	0	0	0	0	112.7
100	E	25.3	Very low	28.3	Very low	190 Å²	190	135.4 Å²	135.4	89%	0.888	78%	0.779	S	S	*	*			trans	-75.9	148.8	-178.4	-58.9	144.8	116.9	0	0	111.4
101	S	27.7	Very low	28.6	Very low	126 Å²	126	135.2 Å²	135.2	88%	0.881	78%	0.778	S	S	*	*			trans	-179.7	168.7	143.9	34.7	0	0	0	0	112.4
102	F	26.8	Very low	28.8	Very low	196 Å²	196	135.1 Å²	135.1	86%	0.86	78%	0.778	S	S	*	*			trans	-124	126.5	-173	-132.5	-98.3	0	0	0	108.8
103	S	28.4	Very low	29	Very low	106 Å²	106	132.6 Å²	132.6	74%	0.741	77%	0.774	S	S	*	*			trans	52.9	-167.5	162.9	75.7	0	0	0	0	116.2
104	P	36	Very low	29.4	Very low	112 Å²	112	133.8 Å²	133.8	73%	0.727	77%	0.772	S	S	*	*			cis	-127.4	172.5	-23	39.9	-25.9	0	0	0	114.2
105	M	30.5	Very low	29.8	Very low	169 Å²	169	135.3 Å²	135.3	83%	0.833	77%	0.769	S	S	*	*			trans	-178.5	152.3	146.5	-102.5	176.4	153.7	0	0	108
106	D	32.8	Very low	30.1	Very low	137 Å²	137	134 Å²	134	73%	0.733	76%	0.763	S	S	*	*			cis	-143.4	167.5	4.4	-118.9	-37.8	0	0	0	110.7
107	L	26.9	Very low	30.4	Very low	159 Å²	159	135.4 Å²	135.4	83%	0.832	76%	0.763	S	S	*	*			trans	-141.8	116	-174.4	-178.2	142.2	0	0	0	114.5
108	I	35.7	Very low	30.9	Very low	156 Å²	156	135.5 Å²	135.5	80%	0.8	76%	0.759	S	S	*	*			trans	-156.7	133.1	177.7	-66.6	-172.4	0	0	0	106.6
109	D	32.1	Very low	31	Very low	135 Å²	135	137.1 Å²	137.1	72%	0.722	76%	0.755	S	S	*	*			cis	-153.5	170.4	-6.7	-137.9	-46	0	0	0	113.2
110	S	31.6	Very low	31.1	Very low	87 Å²	87	136.6 Å²	136.6	61%	0.608	74%	0.744	S	S	*	*			trans	3.6	129.7	156	-63.5	0	0	0	0	125
111	T	31.7	Very low	31.2	Very low	124 Å²	124	136 Å²	136	76%	0.761	74%	0.739	S	S	*	*				86.2	133.6	126.6	52.9	0	0	0	0	125.2
112	E	32	Very low	31.2	Very low	174 Å²	174	137.5 Å²	137.5	81%	0.813	74%	0.737	S	S	*	*			trans	62.3	117.7	148	-67.7	-175.4	155.3	0	0	120.5
113	S	30	Very low	31.3	Very low	104 Å²	104	137.1 Å²	137.1	73%	0.727	74%	0.738	S	S	*	*				100.5	149.6	67.4	96	0	0	0	0	111.6
114	V	33.5	Very low	31.3	Very low	113 Å²	113	137.2 Å²	137.2	69%	0.685	74%	0.738	S	S	*	*			cis	-163.6	159.5	3.4	82.9	0	0	0	0	111.9
115	K	33.9	Very low	31	Very low	155 Å²	155	137.4 Å²	137.4	67%	0.674	74%	0.743	S	S	*	*			trans	65.1	159.3	160.5	-69.7	172.8	162.4	-84.3	0	118.6
116	E	33.2	Very low	30.7	Very low	136 Å²	136	138.5 Å²	138.5	64%	0.636	74%	0.743	S	S	*	*			cis	-171.8	159.8	-15.7	-106.2	164.6	172.5	0	0	107.7
117	T	32	Very low	30.5	Very low	108 Å²	108	136.7 Å²	136.7	66%	0.663	74%	0.741	S	S	*	*			cis	-166.5	-180	-24.6	18.4	0	0	0	0	108.9
118	H	35.3	Very low	30.7	Very low	164 Å²	164	136.8 Å²	136.8	76%	0.759	74%	0.737	S	S	*	*			trans	72.5	137.9	169.4	-68.7	-84.1	0	0	0	117.3
119	D	30	Very low	30.3	Very low	127 Å²	127	137.2 Å²	137.2	68%	0.679	74%	0.736	S	S	*	*			cis	-159.5	173.8	0.3	-144.7	-62.5	0	0	0	112.8
120	C	26.7	Very low	30.1	Very low	90 Å²	90	137.1 Å²	137.1	61%	0.608	74%	0.741	S	S	*	*			trans	74	98.9	153	-82.5	0	0	0	0	123.1
121	K	28.4	Very low	29.9	Very low	178 Å²	178	140.2 Å²	140.2	77%	0.774	75%	0.75	S	S	*	*				65.3	93.9	129.9	-61.6	173.1	-177.7	170.8	0	120
122	N	27.2	Very low	29.9	Very low	157 Å²	157	143.2 Å²	143.2	84%	0.84	76%	0.756	S	S	*	*				165.9	118.5	106	-85.6	-15.7	0	0	0	111.7
123	E	28.2	Very low	29.8	Very low	188 Å²	188	140 Å²	140	88%	0.879	75%	0.753	S	S	*	*			trans	158.4	155.8	136.5	-88.4	-171.4	164.8	0	0	112
124	S	29.1	Very low	29.6	Very low	108 Å²	108	142.6 Å²	142.6	76%	0.755	76%	0.758	S	S	*	*			trans	43.2	95.6	169.5	59.5	0	0	0	0	119.5
125	S	30.1	Very low	29.4	Very low	117 Å²	117	140.3 Å²	140.3	82%	0.818	76%	0.756	S	S	*	*			trans	-64	141.3	133.1	39.6	0	0	0	0	108.5
126	F	23.9	Very low	28.9	Very low	192 Å²	192	137.8 Å²	137.8	84%	0.842	75%	0.754	S	S	*	*			cis	70.3	94.1	25.2	-158.6	-81.9	0	0	0	115.4
127	S	29.6	Very low	28.6	Very low	99 Å²	99	140 Å²	140	69%	0.692	76%	0.761	S	S	*	*			trans	-164.2	111.6	147.3	58	0	0	0	0	111.1
128	Q	30.6	Very low	28.2	Very low	161 Å²	161	138 Å²	138	75%	0.752	75%	0.752	S	S	*	*			trans	46.7	125.6	145.5	-68.6	154	-42.7	0	0	120.3
129	Q	26.7	Very low	27.8	Very low	164 Å²	164	140 Å²	140	77%	0.766	76%	0.759	S	S	*	*			cis	78.4	83	48.5	-171	-165.5	7.2	0	0	113.8
130	T	29.2	Very low	27.5	Very low	134 Å²	134	140.5 Å²	140.5	82%	0.822	76%	0.761	S	S	*	*			trans	-151.6	126.4	137	35.2	0	0	0	0	110.9
131	N	25.9	Very low	27.5	Very low	152 Å²	152	142.8 Å²	142.8	81%	0.813	77%	0.768	S	S	*	*			trans	-18.2	124.8	157.1	-42.5	-24.7	0	0	0	116.1
132	E	32.6	Very low	27.5	Very low	186 Å²	186	141.6 Å²	141.6	87%	0.869	77%	0.77	S	S	*	*				-156.1	119.5	127.9	-117.6	167	-152.1	0	0	112.3
133	S	30.1	Very low	27.4	Very low	108 Å²	108	140.5 Å²	140.5	76%	0.755	76%	0.763	S	S	*	*			trans	15.7	131.9	160.8	43.4	0	0	0	0	122.5
134	L	24.8	Very low	27.3	Very low	158 Å²	158	138.1 Å²	138.1	83%	0.827	76%	0.757	S	S	*	*			trans	-48.1	136.8	158	-80.1	71.8	0	0	0	112.6	V136	L134-V136 HydrophobicContact CB-CG2 4.42Å; L134-V136 HydrophobicContact CD2-CG2 4.13Å; L134-V136 HydrophobicContact CG-CG2 4.42Å
135	G	28.9	Very low	27.1	Very low	64 Å²	64	138.3 Å²	138.3	66%	0.66	75%	0.753	S	S	*	*			trans	-120.4	53.2	164.9	0	0	0	0	0	111.7
136	V	25.1	Very low	27	Very low	102 Å²	102	140.4 Å²	140.4	62%	0.618	76%	0.756	S	S	*	*			trans	-84.8	118.2	179.9	-179.5	0	0	0	0	110.1	L134	L134-V136 HydrophobicContact CB-CG2 4.42Å; L134-V136 HydrophobicContact CD2-CG2 4.13Å; L134-V136 HydrophobicContact CG-CG2 4.42Å
137	F	27	Very low	27	Very low	182 Å²	182	136.5 Å²	136.5	80%	0.798	75%	0.752	S	S	*	*			trans	-128.4	99.7	166.9	-59.5	-76.2	0	0	0	106.2
138	S	23	Very low	26.9	Very low	66 Å²	66	138.3 Å²	138.3	46%	0.462	75%	0.754	S	S	.	*			cis	58.1	98.2	36.1	-165.8	0	0	0	0	112.7
139	F	26.4	Very low	27	Very low	207 Å²	207	139 Å²	139	91%	0.908	76%	0.762	S	S	*	*			trans	-119.4	80.9	143.5	-89.4	-76.2	0	0	0	107.5
140	N	24.1	Very low	27	Very low	137 Å²	137	137.6 Å²	137.6	73%	0.733	76%	0.759	S	S	*	*			trans	-62.2	165.2	158.4	-91.1	-19.9	0	0	0	110.2
141	N	25.8	Very low	26.8	Very low	138 Å²	138	135.7 Å²	135.7	74%	0.738	75%	0.751	S	S	*	*			trans	-52.6	136.6	177.8	-57.1	-52	0	0	0	113.7
142	D	29.3	Very low	26.8	Very low	154 Å²	154	135.9 Å²	135.9	82%	0.824	75%	0.752	S	S	*	*				-135.6	107.8	129.3	-83.8	-48.3	0	0	0	105.7
143	L	25.4	Very low	26.6	Very low	133 Å²	133	131.8 Å²	131.8	70%	0.696	74%	0.744	S	S	*	*				47.8	81.1	74	-64.6	169	0	0	0	111.1
144	N	25.2	Very low	26.5	Very low	139 Å²	139	134.2 Å²	134.2	74%	0.743	75%	0.747	S	S	*	*				-168.8	152.3	85.8	-98.6	-56.4	0	0	0	115.4
145	T	25.4	Very low	26.5	Very low	111 Å²	111	133.5 Å²	133.5	68%	0.681	74%	0.744	S	S	*	*			trans	25.4	106.6	149.3	61.9	0	0	0	0	119.5
146	N	28.2	Very low	26.6	Very low	162 Å²	162	136.2 Å²	136.2	87%	0.866	75%	0.747	S	S	*	*				-154.7	91.7	110.7	-103.7	-30.7	0	0	0	111.2	N148	N146-N148 PolarHBondContact O-N 3.49Å
147	S	24.1	Very low	26.5	Very low	109 Å²	109	141.4 Å²	141.4	76%	0.762	76%	0.762	S	S	*	*			trans	-73.2	87.3	170.3	52.2	0	0	0	0	110.1
148	N	27.1	Very low	26.6	Very low	137 Å²	137	142.4 Å²	142.4	73%	0.733	76%	0.76	S	S	*	*			trans	-169.1	90.9	162.4	-97.1	-30.6	0	0	0	111.7	N146	N146-N148 PolarHBondContact O-N 3.49Å
149	L	32.9	Very low	26.9	Very low	176 Å²	176	145.5 Å²	145.5	92%	0.921	78%	0.776	S	S	*	*			trans	-170.7	97.1	141	-104.2	161.5	0	0	0	109.1
150	L	25.9	Very low	27	Very low	135 Å²	135	140 Å²	140	71%	0.707	77%	0.77	S	S	*	*			trans	-61.2	133.2	-177.5	-85.8	69.6	0	0	0	111
151	S	25.3	Very low	27.3	Very low	94 Å²	94	140 Å²	140	66%	0.657	77%	0.769	S	S	*	*				55.5	85.6	78.5	88.1	0	0	0	0	114.4
152	N	26.9	Very low	27.5	Very low	155 Å²	155	142.8 Å²	142.8	83%	0.829	77%	0.77	S	S	*	*			trans	-163.9	130	161	-86.8	-44.8	0	0	0	106
153	S	27.6	Very low	27.7	Very low	101 Å²	101	142.5 Å²	142.5	71%	0.706	76%	0.763	S	S	*	*	S	Bend	cis	-145.7	113.8	8.1	-54.2	0	0	0	0	112.1
154	I	27.2	Very low	28	Very low	158 Å²	158	142.7 Å²	142.7	81%	0.81	77%	0.765	S	S	*	*	S	Bend	trans	-135.8	140.2	150.3	-63.2	-175.9	0	0	0	105.3
155	D	26.5	Very low	28.2	Very low	144 Å²	144	140 Å²	140	77%	0.77	76%	0.757	S	S	*	*			trans	62.7	156.8	-165.6	-55.6	-46.9	0	0	0	112.4
156	V	29.4	Very low	28.6	Very low	120 Å²	120	141.9 Å²	141.9	73%	0.727	76%	0.762	S	S	*	*			cis	-133.2	145.9	22.8	169.4	0	0	0	0	111.7
157	F	24.6	Very low	28.8	Very low	211 Å²	211	139.7 Å²	139.7	93%	0.925	75%	0.75	S	S	*	*			trans	-142.5	68	160.7	-122.2	-67.4	0	0	0	112.2
158	R	28.8	Very low	29.5	Very low	204 Å²	204	140.5 Å²	140.5	77%	0.77	75%	0.746	S	S	*	*			trans	-164.8	93.9	162	-108.6	150.7	-173.6	160.7	1.3	113.8
159	T	28.3	Very low	29.9	Very low	130 Å²	130	140.5 Å²	140.5	80%	0.798	75%	0.745	S	S	*	*			trans	9	138.6	139.5	53.7	0	0	0	0	121.6
160	A	29.4	Very low	30.1	Very low	93 Å²	93	138 Å²	138	77%	0.769	73%	0.733	S	S	*	*			trans	76.7	145.9	148.9	0	0	0	0	0	117.8
161	D	31	Very low	30.4	Very low	135 Å²	135	134.4 Å²	134.4	72%	0.722	72%	0.719	S	S	*	*			cis	-148.5	175.9	-2.5	-137.5	-43.9	0	0	0	113.2
162	R	28.9	Very low	30.7	Very low	198 Å²	198	139.2 Å²	139.2	75%	0.747	72%	0.723	S	S	*	*			trans	-55.8	152.6	-175.2	-56	144.1	174.9	169.9	-0.6	115.6
163	H	34.4	Very low	31	Very low	147 Å²	147	137.6 Å²	137.6	68%	0.681	71%	0.714	S	S	*	*				179.6	147.1	92.1	-106.9	-77.7	0	0	0	116.2
164	N	30.9	Very low	31	Very low	137 Å²	137	139.3 Å²	139.3	73%	0.733	71%	0.714	S	S	*	*			trans	69.8	149.7	153.5	-64.9	-0.5	0	0	0	120.1
165	S	29.8	Very low	30.9	Very low	84 Å²	84	136.3 Å²	136.3	59%	0.587	71%	0.707	S	S	*	*			cis	-178.6	159.5	-24.1	52.9	0	0	0	0	110.1
166	L	32.8	Very low	30.8	Very low	149 Å²	149	134.4 Å²	134.4	78%	0.78	71%	0.705	S	S	*	*			trans	71.6	148.2	168.8	-49.1	175.5	0	0	0	114.2
167	D	33.3	Very low	30.7	Very low	117 Å²	117	133.4 Å²	133.4	63%	0.626	70%	0.704	S	S	*	*			cis	-167	160.6	-10.1	-95.8	-10.8	0	0	0	106.1
168	L	37.9	Very low	30.7	Very low	126 Å²	126	130 Å²	130	66%	0.66	70%	0.7	S	S	*	*			cis	-161.4	158.2	-7.2	-102.9	160.4	0	0	0	108.2
169	D	36.1	Very low	30.6	Very low	136 Å²	136	123.8 Å²	123.8	73%	0.727	70%	0.7	S	S	*	*			trans	48	148.6	142.6	-63.9	0.9	0	0	0	123.1
170	D	36	Very low	30.5	Very low	123 Å²	123	123.1 Å²	123.1	66%	0.658	70%	0.7	S	S	*	*			cis	-152.5	153.8	0.6	-151.1	-2	0	0	0	114.9	R172	D170-R172 IonicContact OD2-NH2 3.68Å
171	S	33.5	Very low	30.4	Very low	61 Å²	61	126.6 Å²	126.6	43%	0.427	70%	0.7	S	S	.	*			trans	50.4	126.5	137.2	-77.2	0	0	0	0	126.2
172	R	32.3	Very low	30.3	Very low	195 Å²	195	126.7 Å²	126.7	74%	0.736	71%	0.706	S	S	*	*				75.9	152.3	126.1	-67.2	179.6	-112.8	172.4	6.2	119.4	D170	D170-R172 IonicContact OD2-NH2 3.68Å
173	D	31.4	Very low	30.1	Very low	120 Å²	120	122.8 Å²	122.8	64%	0.642	70%	0.703	S	S	*	*			cis	-159.9	153.5	-9.8	-111.8	-21.5	0	0	0	114.1
174	I	28.4	Very low	30	Very low	137 Å²	137	124.3 Å²	124.3	70%	0.703	71%	0.711	S	S	*	*			trans	54.2	110.8	136.7	-62.9	165.8	0	0	0	122.2
175	S	24.9	Very low	29.7	Very low	96 Å²	96	122.2 Å²	122.2	67%	0.671	71%	0.707	S	S	*	*			trans	69.5	120.2	136.1	81.6	0	0	0	0	125.1
176	S	25.4	Very low	29.6	Very low	104 Å²	104	125 Å²	125	73%	0.727	71%	0.714	S	S	*	*				82.7	147.1	118	76.3	0	0	0	0	124
177	S	25.6	Very low	29.3	Very low	99 Å²	99	126.5 Å²	126.5	69%	0.692	71%	0.714	S	S	*	*			trans	85.6	122.6	150.9	75.6	0	0	0	0	120.2
178	T	26.1	Very low	29.4	Very low	139 Å²	139	126.8 Å²	126.8	85%	0.853	72%	0.722	S	S	*	*			trans	43.3	130.4	138.8	56.5	0	0	0	0	121.3
179	G	26.6	Very low	28.9	Very low	74 Å²	74	127.9 Å²	127.9	76%	0.763	73%	0.729	S	S	*	*			trans	154.9	101.2	140.5	0	0	0	0	0	117.4
180	S	26.2	Very low	28.6	Very low	115 Å²	115	126.2 Å²	126.2	80%	0.804	72%	0.724	S	S	*	*			trans	50.4	133.4	146.6	-154.1	0	0	0	0	121.9
181	H	26.1	Very low	28.3	Very low	166 Å²	166	127.2 Å²	127.2	77%	0.769	73%	0.729	S	S	*	*			trans	-38.6	138.1	143	-68.1	-118.1	0	0	0	112.7
182	V	29.3	Very low	28.1	Very low	138 Å²	138	128.3 Å²	128.3	84%	0.836	74%	0.736	S	S	*	*				-140.7	127.8	125.7	166	0	0	0	0	108.9
183	V	25.5	Very low	28	Very low	115 Å²	115	125.8 Å²	125.8	70%	0.697	74%	0.738	S	S	*	*			trans	-58.5	138.9	170.9	170.4	0	0	0	0	111.4
184	H	31.3	Very low	28	Very low	180 Å²	180	127.5 Å²	127.5	83%	0.833	75%	0.746	S	S	*	*			trans	-146.7	140.4	140.1	-118.7	-79.8	0	0	0	112.5
185	S	25.9	Very low	28	Very low	93 Å²	93	126.5 Å²	126.5	65%	0.65	75%	0.747	S	S	*	*			trans	-107.9	-175.7	176.8	-174	0	0	0	0	110
186	L	26.6	Very low	28.4	Very low	141 Å²	141	131.4 Å²	131.4	74%	0.738	76%	0.756	S	S	*	*			trans	78	143.4	178.8	-45.7	164.1	0	0	0	113.4
187	K	26.1	Very low	28.6	Very low	182 Å²	182	131.8 Å²	131.8	79%	0.791	75%	0.754	S	S	*	*			cis	-157.2	149.9	-8.2	-137.3	166.2	-179.9	174.2	0	109.1
188	P	37.3	Very low	28.6	Very low	122 Å²	122	133 Å²	133	79%	0.792	76%	0.757	S	S	*	*			trans	-76.3	177.6	166.6	34.4	-38.6	0	0	0	112.1
189	N	25.8	Very low	28.8	Very low	150 Å²	150	132 Å²	132	80%	0.802	75%	0.746	S	S	*	*			trans	134.6	169.4	148.3	-166.9	29.6	0	0	0	113.6
190	V	29.5	Very low	28.9	Very low	101 Å²	101	134.1 Å²	134.1	61%	0.612	74%	0.739	S	S	*	*			trans	90.6	95.5	158.9	-169.6	0	0	0	0	117.5
191	D	29.9	Very low	29.2	Very low	144 Å²	144	131.8 Å²	131.8	77%	0.77	72%	0.717	S	S	*	*			trans	75.2	148.5	132	-65.9	7.6	0	0	0	122.3
192	S	30.2	Very low	29.5	Very low	83 Å²	83	129.7 Å²	129.7	58%	0.58	71%	0.708	S	S	*	*			cis	-166.8	165.3	-14.6	51.6	0	0	0	0	112.9
193	N	29.9	Very low	29.7	Very low	143 Å²	143	127.3 Å²	127.3	77%	0.765	69%	0.691	S	S	*	*			trans	70.7	148.9	160.6	-56.8	-51.5	0	0	0	117.7
194	L	32.1	Very low	30	Very low	155 Å²	155	127.3 Å²	127.3	81%	0.812	69%	0.686	S	S	*	*			cis	-132.8	142.9	4.2	-168	66.6	0	0	0	112.4
195	T	28.3	Very low	29.9	Very low	117 Å²	117	124.4 Å²	124.4	72%	0.718	68%	0.676	S	S	*	*			trans	-86	147.9	-174	37.4	0	0	0	0	115.5
196	K	32.7	Very low	30	Very low	198 Å²	198	125.9 Å²	125.9	86%	0.861	68%	0.682	S	S	*	*			trans	166.9	144.2	136.8	-91.2	157	-177.9	-179.6	0	109.9
197	T	28.8	Very low	30.1	Very low	113 Å²	113	126.5 Å²	126.5	69%	0.693	68%	0.68	S	S	*	*			cis	-167.4	116.3	-14.8	-100.2	0	0	0	0	108.6
198	V	27	Very low	30.1	Very low	125 Å²	125	125 Å²	125	76%	0.758	68%	0.68	S	S	*	*				45.7	131	109.9	159.1	0	0	0	0	117.6
199	L	30.5	Very low	29.8	Very low	117 Å²	117	125.7 Å²	125.7	61%	0.613	67%	0.673	S	S	*	*			cis	-121.1	173.1	4.5	-76.5	96.9	0	0	0	111.5	P1126	L199-P1126 HydrophobicContact CB-CG 4.15Å; L199-P1126 VanDerWaalsContact O-CG 3.29Å; L199-P1126 WeakPolarHBondContact O-CG 3.42Å
200	L	28.7	Very low	29.9	Very low	119 Å²	119	122.8 Å²	122.8	62%	0.623	66%	0.664	S	S	*	*			cis	94.5	91.6	5.2	-149.8	178.8	0	0	0	118.7	E202	L200-E202 HydrophobicContact CD2-CG 3.95Å
201	D	32	Very low	29.8	Very low	66 Å²	66	124.4 Å²	124.4	35%	0.353	67%	0.669	S	S	.	*			trans	-163.6	110.6	158.3	-155.3	16	0	0	0	106.5	P1126 N1127 R1128	D201-P1126 WeakPolarHBondContact CB-O 3.42Å; D201-P1126 PolarHBondContact N-O 2.78Å; D201-N1127 CarbonylContact O-C 3.55Å; D201-R1128 PolarHBondContact O-N 3.31Å
202	E	31.8	Very low	29.7	Very low	122 Å²	122	123.7 Å²	123.7	57%	0.57	67%	0.669	S	S	*	*				59.2	145.1	61	-53.3	-168.4	166.7	0	0	112.5	L200	L200-E202 HydrophobicContact CD2-CG 3.95Å
203	N	33	Very low	29.8	Very low	88 Å²	88	126.6 Å²	126.6	47%	0.471	68%	0.678	S	S	.	*			cis	-149.8	160.3	28.5	-103.9	-68.5	0	0	0	114.7	R1128	N203-R1128 VanDerWaalsContact O-CZ 3.22Å; N203-R1128 PolarHBondContact O-NH1 3.22Å; N203-R1128 PolarHBondContact O-NH2 3.09Å
204	L	32.2	Very low	29.8	Very low	115 Å²	115	125.1 Å²	125.1	60%	0.602	68%	0.676	S	S	*	*			trans	54.6	144.2	155.9	-86.5	65.4	0	0	0	120.9	R1128	L204-R1128 PolarHBondContact O-NH2 3.22Å
205	D	30	Very low	29.5	Very low	118 Å²	118	124.1 Å²	124.1	63%	0.631	67%	0.672	S	S	*	*			cis	-130	138.2	8.1	-96.5	-58.5	0	0	0	113.3
206	V	27.5	Very low	29.4	Very low	125 Å²	125	124.2 Å²	124.2	76%	0.758	68%	0.677	S	S	*	*			trans	-141.2	104.5	162.6	174	0	0	0	0	107.2	L208	V206-L208 VanDerWaalsContact C-N 3.26Å; V206-L208 HydrophobicContact CG1-CB 4.44Å; V206-L208 PolarHBondContact O-N 3.43Å
207	H	29.1	Very low	29.2	Very low	153 Å²	153	119.7 Å²	119.7	71%	0.708	67%	0.67	S	S	*	*			trans	-81.7	73.2	175.7	-100.8	-48.5	0	0	0	112	H209	H207-H209 AromaticContact CE1-CD2 3.5Å; H207-H209 AromaticContact CE1-NE2 3.61Å; H207-H209 AromaticContact ND1-CD2 3.34Å; H207-H209 PolarHBondContact ND1-CD2 3.44Å; H207-H209 VanDerWaalsContact ND1-CD2 3.34Å; H207-H209 AromaticContact ND1-NE2 3.83Å; H207-H209 PolarHBondContact O-N 3.37Å
208	L	25.8	Very low	29.4	Very low	150 Å²	150	119.1 Å²	119.1	79%	0.785	67%	0.669	S	S	*	*			trans	-88	87.5	155.1	-121.6	166.8	0	0	0	107.2	V206 S210	V206-L208 VanDerWaalsContact C-N 3.26Å; V206-L208 HydrophobicContact CG1-CB 4.44Å; V206-L208 PolarHBondContact O-N 3.43Å; L208-S210 PolarHBondContact O-N 2.81Å; L208-S210 VanDerWaalsContact O-N 3.13Å
209	H	30.2	Very low	29.2	Very low	138 Å²	138	120.2 Å²	120.2	64%	0.639	67%	0.67	S	S	*	*			trans	-84.7	84.9	177.5	-118.8	-44.6	0	0	0	111.3	H207	H207-H209 AromaticContact CE1-CD2 3.5Å; H207-H209 AromaticContact CE1-NE2 3.61Å; H207-H209 AromaticContact ND1-CD2 3.34Å; H207-H209 PolarHBondContact ND1-CD2 3.44Å; H207-H209 VanDerWaalsContact ND1-CD2 3.34Å; H207-H209 AromaticContact ND1-NE2 3.83Å; H207-H209 PolarHBondContact O-N 3.37Å
210	S	29.4	Very low	28.9	Very low	89 Å²	89	119.5 Å²	119.5	62%	0.622	67%	0.674	S	S	*	*			trans	-59.3	147	147.1	54.2	0	0	0	0	109.9	L208	L208-S210 PolarHBondContact O-N 2.81Å; L208-S210 VanDerWaalsContact O-N 3.13Å
211	N	25.7	Very low	28.7	Very low	135 Å²	135	119.5 Å²	119.5	72%	0.722	68%	0.679	S	S	*	*			trans	-173.4	146.3	145.1	-101.8	-19.9	0	0	0	114.6
212	V	29	Very low	28.5	Very low	128 Å²	128	124.8 Å²	124.8	78%	0.776	70%	0.701	S	S	*	*			trans	73.8	102.1	155.1	178.9	0	0	0	0	119.1
213	L	32.7	Very low	28.2	Very low	145 Å²	145	124.2 Å²	124.2	76%	0.759	71%	0.707	S	S	*	*			trans	-71.4	151.4	142.5	-117.7	78.7	0	0	0	109
214	P	29.5	Very low	28.1	Very low	111 Å²	111	126.3 Å²	126.3	72%	0.721	72%	0.723	S	S	*	*				-133.5	164.8	76.1	23.2	-1.5	0	0	0	113.1
215	D	24.7	Very low	27.9	Very low	135 Å²	135	126.8 Å²	126.8	72%	0.722	73%	0.73	S	S	*	*			cis	79.5	138.7	39.3	-132.6	-9.5	0	0	0	113.8
216	S	26.2	Very low	28.3	Very low	118 Å²	118	126.6 Å²	126.6	83%	0.825	74%	0.736	S	S	*	*			trans	67.1	148	-165.7	78.4	0	0	0	0	116.5
217	S	29.1	Very low	28.3	Very low	104 Å²	104	126.6 Å²	126.6	73%	0.727	74%	0.741	S	S	*	*			cis	-140.1	154.1	2.5	60.9	0	0	0	0	112.8
218	P	32.5	Very low	28.1	Very low	101 Å²	101	125.6 Å²	125.6	66%	0.656	75%	0.746	S	S	*	*			trans	-82.4	-172	164.8	38.4	-36.7	0	0	0	111.7
219	D	24.6	Very low	28.1	Very low	148 Å²	148	126.2 Å²	126.2	79%	0.791	75%	0.749	S	S	*	*			trans	67.9	143.3	170.1	-56.8	-20.2	0	0	0	115.8
220	C	23.2	Very low	27.8	Very low	102 Å²	102	126.8 Å²	126.8	69%	0.689	76%	0.755	S	S	*	*			cis	-152.7	177.7	-6.1	-131.3	0	0	0	0	111.6
221	T	24.8	Very low	27.6	Very low	118 Å²	118	130 Å²	130	72%	0.724	76%	0.764	S	S	*	*			trans	0.7	137.8	155.9	58.1	0	0	0	0	118.4
222	E	27.9	Very low	27.6	Very low	177 Å²	177	130.8 Å²	130.8	83%	0.827	77%	0.768	S	S	*	*				-153.4	166.7	59	-85.8	-171.4	158	0	0	116.5
223	T	25.9	Very low	28	Very low	111 Å²	111	129.8 Å²	129.8	68%	0.681	76%	0.764	S	S	*	*			trans	-27.2	152.4	159.3	26.1	0	0	0	0	117.1
224	T	30.2	Very low	27.7	Very low	132 Å²	132	128 Å²	128	81%	0.81	76%	0.764	S	S	*	*				-155	155.7	55.3	-48.8	0	0	0	0	113.5
225	T	27.4	Very low	27.5	Very low	124 Å²	124	133.3 Å²	133.3	76%	0.761	77%	0.77	S	S	*	*			trans	-103	-152.7	-176.9	53.9	0	0	0	0	112
226	P	38.4	Very low	27.6	Very low	115 Å²	115	133.9 Å²	133.9	75%	0.747	77%	0.771	S	S	*	*				-120.8	160.7	-113.7	37	-19	0	0	0	115.4
227	S	27.6	Very low	27.7	Very low	125 Å²	125	135.5 Å²	135.5	87%	0.874	77%	0.77	S	S	*	*			trans	-144.5	112.2	168.2	-77.3	0	0	0	0	113.9
228	T	25.1	Very low	27.6	Very low	132 Å²	132	136.6 Å²	136.6	81%	0.81	77%	0.773	S	S	*	*			trans	-51.2	141.4	157.8	-54.7	0	0	0	0	112.2
229	I	25.9	Very low	27.3	Very low	163 Å²	163	139.7 Å²	139.7	84%	0.836	78%	0.783	S	S	*	*				-166	143.4	129.9	-100.2	154.1	0	0	0	112.6
230	L	23.6	Very low	27.3	Very low	149 Å²	149	137.7 Å²	137.7	78%	0.78	78%	0.781	S	S	*	*			trans	-70.6	156.1	-179.3	-165.3	78.8	0	0	0	112.7
231	I	26.6	Very low	27.5	Very low	157 Å²	157	140.8 Å²	140.8	81%	0.805	79%	0.789	S	S	*	*				174.2	138.7	123.9	-87.6	154.7	0	0	0	113.7
232	N	25.6	Very low	27.4	Very low	151 Å²	151	139.9 Å²	139.9	81%	0.807	79%	0.788	S	S	*	*			trans	-29.3	165.7	179.2	-90.9	-20.6	0	0	0	123.5
233	P	36.8	Very low	27.4	Very low	108 Å²	108	138.2 Å²	138.2	70%	0.701	79%	0.79	S	S	*	*			trans	-93.8	-176.9	176.2	40.9	-38.4	0	0	0	114.8
234	S	25.3	Very low	27.4	Very low	107 Å²	107	138.2 Å²	138.2	75%	0.748	80%	0.795	S	S	*	*			trans	116.2	158.9	153.8	78.9	0	0	0	0	117.8
235	R	27.2	Very low	27.4	Very low	223 Å²	223	137.6 Å²	137.6	84%	0.842	80%	0.796	S	S	*	*			trans	77.4	110.2	-179	-54.9	-174.4	178.4	-165.5	-3.2	114.2
236	I	25.9	Very low	27.4	Very low	147 Å²	147	141 Å²	141	75%	0.754	80%	0.8	S	S	*	*				72.2	101	64.2	-61.7	162.3	0	0	0	111.6
237	N	28.7	Very low	27.4	Very low	151 Å²	151	141.4 Å²	141.4	81%	0.807	80%	0.803	S	S	*	*				-163.6	148.6	111.4	-104.1	-34.8	0	0	0	112.8
238	T	25.8	Very low	27.5	Very low	127 Å²	127	142.2 Å²	142.2	78%	0.779	80%	0.802	S	S	*	*			trans	-75.6	147	170	47.7	0	0	0	0	111.4
239	L	27.5	Very low	27.5	Very low	166 Å²	166	143.5 Å²	143.5	87%	0.869	80%	0.804	S	S	*	*			trans	-154.1	122.1	144.9	-112.7	170.9	0	0	0	110.6
240	S	24.6	Very low	27.6	Very low	106 Å²	106	141.1 Å²	141.1	74%	0.741	80%	0.802	S	S	*	*			trans	-91.8	140.7	173.4	53.4	0	0	0	0	110.6
241	L	26.6	Very low	27.7	Very low	167 Å²	167	139.3 Å²	139.3	87%	0.874	80%	0.797	S	S	*	*			trans	-151.7	131.7	155.8	-119.1	127.3	0	0	0	111.9
242	S	23.6	Very low	27.7	Very low	99 Å²	99	140.4 Å²	140.4	69%	0.692	80%	0.801	S	S	*	*			trans	-93.8	152.4	170	54.5	0	0	0	0	110.4
243	T	27	Very low	27.8	Very low	143 Å²	143	136.6 Å²	136.6	88%	0.877	80%	0.797	S	S	*	*			trans	-169.2	143.6	130.4	22	0	0	0	0	113.8
244	S	26	Very low	27.3	Very low	110 Å²	110	137.9 Å²	137.9	77%	0.769	80%	0.798	S	S	*	*			trans	-60.8	153.4	167.7	135.9	0	0	0	0	114.4
245	S	30	Very low	27.5	Very low	120 Å²	120	139.5 Å²	139.5	84%	0.839	79%	0.794	S	S	*	*			trans	-165.4	179.3	132.3	48.5	0	0	0	0	112.5
246	K	27.8	Very low	27.9	Very low	194 Å²	194	137.4 Å²	137.4	84%	0.843	79%	0.793	S	S	*	*			trans	-112.7	162.3	-160.8	-82.9	179.3	177.3	177.2	0	113.8
247	P	37.8	Very low	28	Very low	124 Å²	124	135.8 Å²	135.8	81%	0.805	79%	0.786	S	S	*	*			trans	-87.5	162.7	-169.6	35.7	-38.1	0	0	0	115.4
248	V	29.9	Very low	28.2	Very low	143 Å²	143	135.5 Å²	135.5	87%	0.867	79%	0.79	S	S	*	*			trans	-142	152.8	172.8	-176.5	0	0	0	0	110.2
249	N	26.4	Very low	28.3	Very low	158 Å²	158	137.6 Å²	137.6	85%	0.845	79%	0.791	S	S	*	*			trans	-82.1	-169.3	179.7	-67.9	-34.7	0	0	0	113.7
250	S	27	Very low	28.4	Very low	114 Å²	114	136 Å²	136	80%	0.797	79%	0.787	S	S	*	*			trans	87.9	143.8	166.5	-109.6	0	0	0	0	117.2
251	V	26.7	Very low	28.6	Very low	110 Å²	110	136.1 Å²	136.1	67%	0.667	79%	0.786	S	S	*	*			cis	-175.4	146.5	-31.8	121.6	0	0	0	0	109.1
252	M	24.8	Very low	28.6	Very low	181 Å²	181	133.4 Å²	133.4	89%	0.892	78%	0.776	S	S	*	*			trans	52.9	131.7	163.1	-77.1	-174.8	-74.4	0	0	122.9
253	G	28.4	Very low	28.9	Very low	71 Å²	71	138.5 Å²	138.5	73%	0.732	79%	0.786	S	S	*	*			trans	98.7	152.1	144.4	0	0	0	0	0	117.4
254	N	27.1	Very low	28.9	Very low	135 Å²	135	138.1 Å²	138.1	72%	0.722	78%	0.778	S	S	*	*			cis	-164.8	158.3	-20.3	-139.2	25	0	0	0	110.6
255	Q	28.6	Very low	29.2	Very low	141 Å²	141	140.6 Å²	140.6	66%	0.659	78%	0.783	S	S	*	*			trans	53.4	118.6	155.2	-68.2	161.2	-51.3	0	0	120.5
256	H	36.1	Very low	29.2	Very low	178 Å²	178	138.9 Å²	138.9	82%	0.824	77%	0.771	S	S	*	*				-165.7	164.5	94	-106.9	-53.5	0	0	0	113.5
257	D	26.9	Very low	29.4	Very low	114 Å²	114	140 Å²	140	61%	0.61	78%	0.777	S	S	*	*			trans	-109.5	154.5	-154.8	-41.1	-100.8	0	0	0	114.2
258	T	33.8	Very low	29.1	Very low	145 Å²	145	143.1 Å²	143.1	89%	0.89	78%	0.777	S	S	*	*			trans	-159.9	128.3	135.8	-2.7	0	0	0	0	111.1
259	H	28	Very low	29	Very low	171 Å²	171	141.4 Å²	141.4	79%	0.792	77%	0.769	S	S	*	*			trans	-76.9	166.9	170.9	-71.2	-124.3	0	0	0	109.8
260	V	28.9	Very low	29.5	Very low	132 Å²	132	140.4 Å²	140.4	80%	0.8	77%	0.771	S	S	*	*				173.9	152.7	67.3	171.4	0	0	0	0	106.3
261	P	29.6	Very low	29.5	Very low	109 Å²	109	142.9 Å²	142.9	71%	0.708	77%	0.772	S	S	*	*			cis	-121.7	-173	-27.9	38.1	-20.8	0	0	0	112.5
262	V	25.9	Very low	29.8	Very low	110 Å²	110	145.4 Å²	145.4	67%	0.667	78%	0.782	S	S	*	*			trans	-101.7	142	171.5	170.8	0	0	0	0	111.3
263	F	29.8	Very low	30	Very low	206 Å²	206	142 Å²	142	90%	0.904	77%	0.771	S	S	*	*			trans	-120.2	125.7	150.9	-99.3	-86.3	0	0	0	109.8
264	N	27.8	Very low	30.3	Very low	134 Å²	134	146.3 Å²	146.3	72%	0.717	78%	0.777	S	S	*	*			trans	-91.5	153.3	171.9	-73.6	-42.8	0	0	0	109.6
265	D	32.6	Very low	30.5	Very low	163 Å²	163	145.1 Å²	145.1	87%	0.872	78%	0.775	S	S	*	*			trans	-132.2	149.1	141.6	-143.8	-23.9	0	0	0	110.1
266	S	29.4	Very low	30.7	Very low	83 Å²	83	144.3 Å²	144.3	58%	0.58	78%	0.775	S	S	*	*			trans	-134.9	130.4	-162.7	-80.1	0	0	0	0	113.3
267	F	31.5	Very low	30.4	Very low	219 Å²	219	143 Å²	143	96%	0.961	77%	0.767	S	S	*	*			trans	-109.6	121.1	154.4	-91.3	-86.2	0	0	0	110.8
268	K	31.7	Very low	30.5	Very low	189 Å²	189	143.3 Å²	143.3	82%	0.822	77%	0.773	S	S	*	*			trans	-110.6	139.2	-155.3	-164.4	176.2	-174.1	176.6	0	111.2
269	P	29	Very low	30.3	Very low	107 Å²	107	147.2 Å²	147.2	70%	0.695	77%	0.771	S	S	*	*			trans	-78.2	144.5	174.1	32.1	-34.3	0	0	0	111.5	M271	P269-M271 PolarHBondContact O-N 3.01Å
270	P	35	Very low	30.2	Very low	136 Å²	136	145.4 Å²	145.4	88%	0.883	77%	0.768	S	S	*	*			trans	-88.4	92.3	168.9	33.7	-30.6	0	0	0	110.3
271	M	28.8	Very low	30.4	Very low	167 Å²	167	144.4 Å²	144.4	82%	0.823	76%	0.762	S	S	*	*			trans	-121.9	117.9	160.9	-161.3	176.9	-166.6	0	0	107.5	P269	P269-M271 PolarHBondContact O-N 3.01Å
272	N	31.9	Very low	30.3	Very low	162 Å²	162	143.4 Å²	143.4	87%	0.866	76%	0.757	S	S	*	*			trans	-138.1	87.5	-178.7	-153	18.5	0	0	0	109.4
273	V	29.9	Very low	30.6	Very low	111 Å²	111	144.4 Å²	144.4	67%	0.673	76%	0.759	S	S	*	*			trans	-84.6	120.2	167.9	175.5	0	0	0	0	106.7	V275	V273-V275 HydrophobicContact CG1-CG2 4.43Å
274	N	33.5	Very low	30.8	Very low	161 Å²	161	143 Å²	143	86%	0.861	76%	0.755	S	S	*	*			trans	-98.6	138.9	168.4	-153	5.6	0	0	0	109.5
275	V	31.5	Very low	30.8	Very low	110 Å²	110	144.3 Å²	144.3	67%	0.667	76%	0.759	S	S	*	*			trans	-109.8	130.7	-167.8	172.6	0	0	0	0	109.5	V273	V273-V275 HydrophobicContact CG1-CG2 4.43Å
276	D	32.2	Very low	30.9	Very low	124 Å²	124	142.2 Å²	142.2	66%	0.663	75%	0.754	S	S	*	*			trans	-159.9	135.2	138.8	-119.2	-7.3	0	0	0	118.4
277	K	31.7	Very low	31.2	Very low	150 Å²	150	143 Å²	143	65%	0.652	76%	0.757	S	S	*	*			trans	56	99.1	141.1	-75.6	168.6	-169.4	80.9	0	124
278	T	28.2	Very low	30.8	Very low	121 Å²	121	138.1 Å²	138.1	74%	0.742	75%	0.749	S	S	*	*				70.1	143.6	117.4	59.4	0	0	0	0	124
279	R	29.2	Very low	30.5	Very low	226 Å²	226	136.9 Å²	136.9	85%	0.853	75%	0.75	S	S	*	*			trans	71.3	147.8	151.5	-84.5	179.6	167.7	158.2	-3.7	117
280	N	26.8	Very low	30.3	Very low	134 Å²	134	136.9 Å²	136.9	72%	0.717	75%	0.753	S	S	*	*			cis	-165.7	171.4	-18.9	-133.5	33.8	0	0	0	108.5
281	V	32.7	Very low	30.1	Very low	111 Å²	111	136.5 Å²	136.5	67%	0.673	75%	0.753	S	S	*	*			trans	60.2	95.7	158.3	171.4	0	0	0	0	114.6
282	S	26.9	Very low	30	Very low	88 Å²	88	133.9 Å²	133.9	62%	0.615	75%	0.752	S	S	*	*				55	122.2	83.1	83.2	0	0	0	0	114.9
283	D	32.3	Very low	30	Very low	131 Å²	131	136.2 Å²	136.2	70%	0.701	75%	0.754	S	S	*	*				169.2	149.7	118.7	-82.1	1.2	0	0	0	114.4
284	H	33.5	Very low	29.8	Very low	177 Å²	177	138.8 Å²	138.8	82%	0.819	76%	0.76	S	S	*	*			trans	53.1	117.7	156.2	-67.3	-60.1	0	0	0	125.1
285	M	29.6	Very low	29.6	Very low	161 Å²	161	140.7 Å²	140.7	79%	0.793	76%	0.761	S	S	*	*			trans	-39.3	162.5	140.3	-94.6	175.1	65.1	0	0	114.9
286	P	34.5	Very low	29.6	Very low	118 Å²	118	142 Å²	142	77%	0.766	76%	0.763	S	S	*	*			cis	-146	-173.7	49.8	39.3	-16.7	0	0	0	116.4
287	P	34.9	Very low	29.3	Very low	99 Å²	99	143.5 Å²	143.5	64%	0.643	77%	0.771	S	S	*	*			trans	-112.9	175.3	-168.1	42.3	-34.6	0	0	0	116.5
288	C	23.5	Very low	29.3	Very low	118 Å²	118	142.2 Å²	142.2	80%	0.797	78%	0.781	S	S	*	*			trans	82.1	154.1	156.8	-66.7	0	0	0	0	121.3
289	L	25.8	Very low	29.4	Very low	162 Å²	162	141.7 Å²	141.7	85%	0.848	78%	0.782	S	S	*	*			trans	79.3	114.3	158.7	-73.2	162.5	0	0	0	121.6
290	S	24.7	Very low	30	Very low	108 Å²	108	135.9 Å²	135.9	76%	0.755	77%	0.774	S	S	*	*			trans	51.2	115.2	138.7	63.3	0	0	0	0	121.3
291	S	30.4	Very low	30.5	Very low	127 Å²	127	135.1 Å²	135.1	89%	0.888	78%	0.776	S	S	*	*			trans	-146.7	117.1	130.2	-171.5	0	0	0	0	110.4
292	S	26.8	Very low	30.6	Very low	113 Å²	113	135.6 Å²	135.6	79%	0.79	78%	0.78	S	S	*	*			trans	-110.4	128.1	178.3	49.6	0	0	0	0	110.2
293	K	31.2	Very low	31	Very low	210 Å²	210	135.9 Å²	135.9	91%	0.913	78%	0.782	S	S	*	*			trans	-150.6	136.9	165.9	-149.8	152.3	-170.9	168.7	0	113.5
294	M	26.1	Very low	30.9	Very low	165 Å²	165	135.3 Å²	135.3	81%	0.813	78%	0.783	S	S	*	*			trans	-83.8	144.2	-173.2	-59.7	153.9	75.9	0	0	112.8
295	K	29.5	Very low	30.7	Very low	201 Å²	201	134.5 Å²	134.5	87%	0.874	78%	0.784	S	S	*	*			trans	-162	103.6	148.8	-113.4	179	173.6	-174.8	0	105.6
296	I	32	Very low	30.8	Very low	137 Å²	137	129.8 Å²	129.8	70%	0.703	77%	0.77	S	S	*	*				66.1	129.6	65.1	-55.4	177.3	0	0	0	111.1
297	D	25.3	Very low	30.6	Very low	157 Å²	157	131 Å²	131	84%	0.84	78%	0.776	S	S	*	*			trans	-76.4	154.3	-149.7	-47.5	-88.5	0	0	0	117
298	S	30.8	Very low	30.5	Very low	123 Å²	123	133.9 Å²	133.9	86%	0.86	79%	0.786	S	S	*	*			trans	-170.9	126.4	144.2	58.9	0	0	0	0	113.1
299	S	30.9	Very low	30.8	Very low	110 Å²	110	133.2 Å²	133.2	77%	0.769	78%	0.782	S	S	*	*			trans	-102.6	-174.7	160.9	59.1	0	0	0	0	110
300	P	41.4	Very low	31	Very low	104 Å²	104	133.4 Å²	133.4	68%	0.675	78%	0.784	S	S	*	*			cis	-121.3	-139	-13	35.3	-13.9	0	0	0	110.7
301	P	38.5	Very low	31.4	Very low	117 Å²	117	134.7 Å²	134.7	76%	0.76	78%	0.783	S	S	*	*				-134.7	131.1	101.1	21.8	-2.4	0	0	0	113.4
302	T	33.7	Very low	31.4	Very low	122 Å²	122	135.8 Å²	135.8	75%	0.748	77%	0.774	S	S	*	*				75.7	120.1	90.7	-52.5	0	0	0	0	113
303	S	34.6	Very low	31.5	Very low	94 Å²	94	137.3 Å²	137.3	66%	0.657	77%	0.772	S	S	*	*			cis	-160.4	-163.2	-12.4	63.2	0	0	0	0	106.8
304	T	30.9	Very low	31.6	Very low	118 Å²	118	132.3 Å²	132.3	72%	0.724	76%	0.761	S	S	*	*			cis	-151.7	175.1	6.2	-3.8	0	0	0	0	105.4
305	L	30.5	Very low	31.9	Very low	160 Å²	160	130.8 Å²	130.8	84%	0.838	76%	0.756	S	S	*	*			cis	-140.8	-161	11.8	-160.4	118.1	0	0	0	110
306	A	30.5	Very low	32	Very low	62 Å²	62	130.9 Å²	130.9	51%	0.512	76%	0.756	S	S	.	*			trans	-76.2	142.7	-172.6	0	0	0	0	0	116.2
307	T	30.7	Very low	31.9	Very low	145 Å²	145	129.3 Å²	129.3	89%	0.89	75%	0.753	S	S	*	*			trans	-122.6	87.4	132.8	45.3	0	0	0	0	107.8
308	D	31.8	Very low	32	Very low	158 Å²	158	127.4 Å²	127.4	85%	0.845	75%	0.747	S	S	*	*			trans	-84.1	129.9	170.9	-91	-51.6	0	0	0	109.8
309	S	29.6	Very low	32.1	Very low	104 Å²	104	130.2 Å²	130.2	73%	0.727	75%	0.747	S	S	*	*			trans	-133.4	91	173.4	62.9	0	0	0	0	109.7
310	N	30	Very low	32.1	Very low	166 Å²	166	129.4 Å²	129.4	89%	0.888	74%	0.739	S	S	*	*			trans	-167.2	101	155.3	-98	-35.3	0	0	0	109.7
311	D	33.1	Very low	31.3	Very low	136 Å²	136	130.9 Å²	130.9	73%	0.727	74%	0.739	S	S	*	*			trans	-147.8	126.1	143.3	-131.4	-9.5	0	0	0	111.6
312	Q	31.6	Very low	30.8	Very low	149 Å²	149	135.5 Å²	135.5	70%	0.696	74%	0.742	S	S	*	*			trans	43.5	104.7	152.3	-67.3	166.6	68.7	0	0	120.2
313	I	28.3	Very low	30.4	Very low	145 Å²	145	136.4 Å²	136.4	74%	0.744	74%	0.741	S	S	*	*				56.7	127.9	102.6	-68.2	162.3	0	0	0	116.5
314	P	34.5	Very low	30.4	Very low	106 Å²	106	138 Å²	138	69%	0.688	75%	0.749	S	S	*	*			cis	-142.4	151	40	37	-17	0	0	0	119.4
315	N	31.2	Very low	30.2	Very low	133 Å²	133	136.7 Å²	136.7	71%	0.711	74%	0.741	S	S	*	*			trans	36	96.3	131.8	-50.8	-16.2	0	0	0	120.8	V317	N315-V317 HydrophobicContact CB-CG2 4.44Å
316	K	33	Very low	30.3	Very low	203 Å²	203	134.5 Å²	134.5	88%	0.883	74%	0.739	S	S	*	*				-153.7	113.1	117.3	-115.3	-172.7	172.8	-169.5	0	108.3
317	V	28.4	Very low	30	Very low	103 Å²	103	137 Å²	137	62%	0.624	74%	0.743	S	S	*	*			cis	64.8	89.1	44.8	-168.3	0	0	0	0	111.5	N315	N315-V317 HydrophobicContact CB-CG2 4.44Å
318	T	28.8	Very low	30	Very low	118 Å²	118	135.7 Å²	135.7	72%	0.724	74%	0.737	S	S	*	*			trans	64.4	115.1	143.3	-37.6	0	0	0	0	117.5
319	E	31.4	Very low	29.8	Very low	182 Å²	182	134.4 Å²	134.4	85%	0.85	73%	0.73	S	S	*	*				-160.1	156.9	92.6	-98.8	-170.5	163.8	0	0	112.6
320	P	31.4	Very low	29.8	Very low	93 Å²	93	134.8 Å²	134.8	60%	0.604	73%	0.728	S	S	*	*			trans	-92.2	-166.4	172.9	40.3	-35.8	0	0	0	111
321	I	25.4	Very low	29.8	Very low	134 Å²	134	137.6 Å²	137.6	69%	0.687	73%	0.726	S	S	*	*			trans	74.7	152.8	158.3	-68.9	168.1	0	0	0	116.3
322	R	27.2	Very low	29.5	Very low	215 Å²	215	138.3 Å²	138.3	81%	0.811	73%	0.73	S	S	*	*			trans	69.8	101.3	161.8	-83.6	160	-155.9	155.7	5.2	120.7
323	L	26.1	Very low	29.6	Very low	141 Å²	141	136 Å²	136	74%	0.738	73%	0.727	S	S	*	*				7.3	142.7	104	-61.3	164.5	0	0	0	118.3	V325	L323-V325 HydrophobicContact CB-CG2 3.66Å; L323-V325 HydrophobicContact CD1-CG2 4.29Å
324	P	34.9	Very low	29.5	Very low	126 Å²	126	134.8 Å²	134.8	82%	0.818	73%	0.727	S	S	*	*				-101	114.5	120.4	32	-26.3	0	0	0	108.2
325	V	26.7	Very low	29.1	Very low	92 Å²	92	133.9 Å²	133.9	56%	0.558	72%	0.723	S	S	*	*			cis	63.5	74.5	48.9	-164.3	0	0	0	0	113.8	L323 I327	L323-V325 HydrophobicContact CB-CG2 3.66Å; L323-V325 HydrophobicContact CD1-CG2 4.29Å; V325-I327 HydrophobicContact CG1-CD1 3.65Å; V325-I327 HydrophobicContact CG1-CG1 4.19Å
326	S	31.4	Very low	28.9	Very low	114 Å²	114	135 Å²	135	80%	0.797	73%	0.728	S	S	*	*			trans	-152.5	114	140.9	41.7	0	0	0	0	105.6
327	I	24.7	Very low	28.6	Very low	114 Å²	114	129.8 Å²	129.8	59%	0.585	72%	0.717	S	S	*	*			cis	57.1	116.1	39.8	-49.8	-175.8	0	0	0	109.3	V325	V325-I327 HydrophobicContact CG1-CD1 3.65Å; V325-I327 HydrophobicContact CG1-CG1 4.19Å
328	P	30.6	Very low	28.7	Very low	118 Å²	118	132.6 Å²	132.6	77%	0.766	73%	0.728	S	S	*	*			cis	-83	149.3	27.5	-11	31	0	0	0	114
329	N	27.4	Very low	28.5	Very low	131 Å²	131	131.1 Å²	131.1	70%	0.701	73%	0.727	S	S	*	*				56.7	126	63.8	-56.2	-29.9	0	0	0	111.6
330	T	29.2	Very low	28.5	Very low	111 Å²	111	127.8 Å²	127.8	68%	0.681	72%	0.721	S	S	*	*			cis	-154.5	156.8	27.8	48.7	0	0	0	0	113
331	R	30.4	Very low	28.7	Very low	226 Å²	226	128.8 Å²	128.8	85%	0.853	73%	0.725	S	S	*	*			trans	55.8	119.8	139.5	-71.1	174.2	175.2	165.1	-2.5	117.9
332	N	26.3	Very low	29.1	Very low	151 Å²	151	128.3 Å²	128.3	81%	0.807	73%	0.731	S	S	*	*				43.6	146.7	71.7	-84.4	6.8	0	0	0	116
333	P	33.7	Very low	29.3	Very low	99 Å²	99	125.8 Å²	125.8	64%	0.643	73%	0.728	S	S	*	*			cis	-118.8	-150.5	-27.5	35	-15.6	0	0	0	108.5
334	T	26.6	Very low	29.7	Very low	121 Å²	121	123.9 Å²	123.9	74%	0.742	73%	0.726	S	S	*	*			trans	51.4	136.1	149.8	52	0	0	0	0	119.6
335	S	26	Very low	29.6	Very low	87 Å²	87	122.9 Å²	122.9	61%	0.608	72%	0.722	S	S	*	*			cis	179.3	-167.2	0.6	50.1	0	0	0	0	105.7
336	I	27.3	Very low	29.9	Very low	156 Å²	156	123.6 Å²	123.6	80%	0.8	73%	0.731	S	S	*	*			trans	40.4	117.1	148.7	-61.8	162.7	0	0	0	115.8
337	S	26.9	Very low	29.8	Very low	94 Å²	94	125.4 Å²	125.4	66%	0.657	73%	0.732	S	S	*	*			cis	154.5	-179.2	19.7	-173.2	0	0	0	0	104.3
338	L	30	Very low	30.3	Very low	162 Å²	162	127.2 Å²	127.2	85%	0.848	74%	0.741	S	S	*	*			trans	66.6	124.8	155.7	-70.9	151.3	0	0	0	119.3
339	A	25	Very low	30.3	Very low	87 Å²	87	127.6 Å²	127.6	72%	0.719	74%	0.741	S	S	*	*			trans	-67.2	-177.1	156.6	0	0	0	0	0	110.5
340	P	32	Very low	30.8	Very low	111 Å²	111	127.2 Å²	127.2	72%	0.721	75%	0.746	S	S	*	*			cis	-147.2	178.4	19.1	43.4	-22.2	0	0	0	119.3
341	V	34.6	Very low	31	Very low	114 Å²	114	125.3 Å²	125.3	69%	0.691	74%	0.741	S	S	*	*			trans	-6.4	130.1	145.5	-178.5	0	0	0	0	116.4
342	P	34.1	Very low	31.2	Very low	124 Å²	124	122.7 Å²	122.7	81%	0.805	74%	0.743	S	S	*	*				-138.2	169.8	116.6	37.3	-25.1	0	0	0	115.6
343	H	32.4	Very low	31.4	Very low	163 Å²	163	120 Å²	120	76%	0.755	74%	0.736	S	S	*	*			trans	-93.3	150.9	-163.5	-61.2	-107.9	0	0	0	116.3
344	S	32.6	Very low	31.5	Very low	100 Å²	100	124.4 Å²	124.4	70%	0.699	75%	0.748	S	S	*	*			trans	65.4	127.5	130.9	67.3	0	0	0	0	124.3
345	S	33.2	Very low	31.8	Very low	105 Å²	105	125.9 Å²	125.9	73%	0.734	75%	0.752	S	S	*	*				92.9	150.9	126	76.9	0	0	0	0	122.6
346	S	32.7	Very low	32.5	Very low	107 Å²	107	126 Å²	126	75%	0.748	75%	0.75	S	S	*	*			trans	76.5	147.8	160.6	89.7	0	0	0	0	116.4
347	L	30.5	Very low	32.8	Very low	153 Å²	153	126.6 Å²	126.6	80%	0.801	75%	0.75	S	S	*	*			cis	-168.5	-174.7	-18.4	-140.6	126.5	0	0	0	109.8
348	I	35.3	Very low	33.1	Very low	152 Å²	152	128.4 Å²	128.4	78%	0.779	75%	0.751	S	S	*	*			trans	97.5	137.5	154.8	-66	146.1	0	0	0	120
349	T	31.1	Very low	33.1	Very low	125 Å²	125	131.1 Å²	131.1	77%	0.767	75%	0.75	S	S	*	*			trans	-106.5	-157.2	-179.9	40.6	0	0	0	0	110.3
350	P	37.8	Very low	33.4	Very low	123 Å²	123	135.4 Å²	135.4	80%	0.799	76%	0.755	S	S	*	*			cis	-123.9	-138	-6.4	27.5	1.2	0	0	0	111
351	A	32.5	Very low	33.3	Very low	71 Å²	71	141.3 Å²	141.3	59%	0.587	76%	0.763	S	S	*	*			cis	-167.5	166.3	7.3	0	0	0	0	0	113.5
352	L	34.1	Very low	33.1	Very low	171 Å²	171	144.5 Å²	144.5	90%	0.895	77%	0.77	S	S	*	*			trans	65.8	162	156.4	-62.3	157.6	0	0	0	117.2
353	S	32.1	Very low	33.1	Very low	94 Å²	94	144.8 Å²	144.8	66%	0.657	77%	0.769	S	S	*	*			cis	-176.7	136.6	-28.8	170.9	0	0	0	0	109.5
354	E	34.3	Very low	33.1	Very low	192 Å²	192	142.2 Å²	142.2	90%	0.897	77%	0.765	S	S	*	*				173.7	-178.7	128.8	-95.5	-178	178.4	0	0	114.1
355	N	32.5	Very low	32.9	Very low	152 Å²	152	143.1 Å²	143.1	81%	0.813	77%	0.766	S	S	*	*			trans	-149.7	-166	-159.7	-150.1	6.1	0	0	0	106.5
356	P	42.1	Very low	32.9	Very low	90 Å²	90	143 Å²	143	58%	0.584	76%	0.761	S	S	*	*			cis	-145.2	-175.8	-10	46.5	-28.4	0	0	0	117.4
357	Q	33.8	Very low	32.9	Very low	168 Å²	168	143.6 Å²	143.6	79%	0.785	76%	0.76	S	S	*	*			trans	64.5	135.8	147.7	-60.6	-122.4	21.3	0	0	119.8
358	I	32.8	Very low	33	Very low	132 Å²	132	142 Å²	142	68%	0.677	76%	0.757	S	S	*	*				-178.5	149.8	62.6	-124.3	142.2	0	0	0	112.3
359	R	30.2	Very low	32.8	Very low	220 Å²	220	140.2 Å²	140.2	83%	0.83	75%	0.754	S	S	*	*			trans	53.5	139.1	164.3	-69.5	171.8	178.9	165	0.5	120
360	Q	30.2	Very low	33	Very low	177 Å²	177	140 Å²	140	83%	0.827	75%	0.752	S	S	*	*			cis	81	105.6	22.6	-64.2	-166.6	-21.9	0	0	119.4
361	R	30.9	Very low	32.8	Very low	235 Å²	235	138.7 Å²	138.7	89%	0.887	75%	0.746	S	S	*	*				177.5	134.1	124.7	-92.8	158.1	177.6	-176.5	-3	108.2
362	H	29.7	Very low	33	Very low	180 Å²	180	140.4 Å²	140.4	83%	0.833	75%	0.75	S	S	*	*				73.3	155.6	56.3	-90.5	-70.2	0	0	0	115.4
363	V	34.1	Very low	33.1	Very low	130 Å²	130	138.1 Å²	138.1	79%	0.788	74%	0.743	S	S	*	*			trans	85	128.3	-177	-179.8	0	0	0	0	112.8
364	T	33	Very low	33.3	Very low	109 Å²	109	139.2 Å²	139.2	67%	0.669	75%	0.746	S	S	*	*			cis	-151.7	154.6	-12.8	19.7	0	0	0	0	106.7
365	T	28.8	Very low	33.4	Very low	119 Å²	119	136.8 Å²	136.8	73%	0.73	74%	0.737	S	S	*	*				53	135.9	70.1	-24.1	0	0	0	0	111.4
366	T	32.6	Very low	33.6	Very low	102 Å²	102	134.5 Å²	134.5	63%	0.626	73%	0.729	S	S	*	*				-174	148.8	52.3	-40.3	0	0	0	0	110.8
367	T	31.8	Very low	33.4	Very low	120 Å²	120	136.8 Å²	136.8	74%	0.736	74%	0.736	S	S	*	*			trans	60.5	158.9	152.9	41.9	0	0	0	0	120.5
368	T	33.3	Very low	33.5	Very low	119 Å²	119	134.8 Å²	134.8	73%	0.73	73%	0.731	S	S	*	*			cis	-144.9	168.4	5.8	-12.8	0	0	0	0	113.5
369	T	31.6	Very low	33.7	Very low	116 Å²	116	134.1 Å²	134.1	71%	0.712	73%	0.729	S	S	*	*			trans	-41.1	162	159.2	49.7	0	0	0	0	115.3
370	T	35.4	Very low	34.2	Very low	119 Å²	119	129.5 Å²	129.5	73%	0.73	72%	0.721	S	S	*	*				-153.6	129.8	53.3	20.2	0	0	0	0	111.8
371	S	33.2	Very low	34.6	Very low	97 Å²	97	127.3 Å²	127.3	68%	0.678	72%	0.715	S	S	*	*				79.2	158.5	87.4	87.7	0	0	0	0	113.8
372	T	36.4	Very low	35	Very low	107 Å²	107	123.4 Å²	123.4	66%	0.656	71%	0.71	S	S	*	*			cis	-159.7	157.7	24.6	-22.3	0	0	0	0	112.1
373	T	36.6	Very low	35.5	Very low	122 Å²	122	121 Å²	121	75%	0.748	71%	0.71	S	S	*	*			trans	61	143.8	154.7	49	0	0	0	0	118.8
374	T	36.7	Very low	35.6	Very low	118 Å²	118	118.1 Å²	118.1	72%	0.724	71%	0.706	S	S	*	*			cis	-164.7	175.6	1	12.8	0	0	0	0	107.8
375	I	36.8	Very low	35.7	Very low	141 Å²	141	117.8 Å²	117.8	72%	0.723	72%	0.715	S	S	*	*			cis	-148.1	139.3	7.9	-133.9	151	0	0	0	111.2
376	T	36.5	Very low	36	Very low	104 Å²	104	119.1 Å²	119.1	64%	0.638	72%	0.723	S	S	*	*			trans	0.6	160.1	140.8	67.3	0	0	0	0	121.3
377	N	37.5	Very low	36.1	Very low	137 Å²	137	117.8 Å²	117.8	73%	0.733	73%	0.73	S	S	*	*			cis	-167.3	-177.9	6.5	-111.6	1.9	0	0	0	107.7
378	N	35.9	Very low	36.1	Very low	127 Å²	127	117.4 Å²	117.4	68%	0.679	73%	0.732	S	S	*	*			cis	178.8	-172.8	-38.8	-169.8	14	0	0	0	107.8
379	N	37.6	Very low	36	Very low	118 Å²	118	121 Å²	121	63%	0.631	74%	0.737	S	S	*	*			trans	80.9	141.5	163.2	-55	-11.3	0	0	0	117.2
380	N	38.7	Very low	36	Very low	122 Å²	122	121.4 Å²	121.4	65%	0.652	74%	0.739	S	S	*	*			cis	-162.1	157.2	-11.3	-106.9	-15.8	0	0	0	112.4
381	N	39.2	Very low	35.8	Very low	132 Å²	132	120.3 Å²	120.3	71%	0.706	74%	0.736	S	S	*	*			trans	64.5	127.7	161.5	-52.8	-18.2	0	0	0	118.4
382	I	40.8	Very low	35.7	Very low	153 Å²	153	126.5 Å²	126.5	79%	0.785	75%	0.745	S	S	*	*			cis	77.4	133.6	31.6	-52.8	168	0	0	0	112.6
383	P	38.7	Very low	35.4	Very low	130 Å²	130	125.8 Å²	125.8	84%	0.844	74%	0.744	S	S	*	*			cis	-109.3	-164.4	-2.3	38.9	-25.1	0	0	0	112
384	G	35.8	Very low	35.1	Very low	68 Å²	68	129 Å²	129	70%	0.701	75%	0.748	S	S	*	*			cis	147.4	155	-10.8	0	0	0	0	0	113.1
385	A	36.8	Very low	34.8	Very low	103 Å²	103	127.8 Å²	127.8	85%	0.851	74%	0.744	S	S	*	*			trans	60	139.7	176.9	0	0	0	0	0	118.3
386	T	35.2	Very low	34.6	Very low	147 Å²	147	128 Å²	128	90%	0.902	74%	0.742	S	S	*	*			cis	-142.6	171.4	-36	49.5	0	0	0	0	105.4
387	G	33.5	Very low	34.3	Very low	74 Å²	74	132.8 Å²	132.8	76%	0.763	75%	0.748	S	S	*	*			cis	172.2	151.2	-4.6	0	0	0	0	0	107.1
388	S	31.6	Very low	34	Very low	111 Å²	111	133.7 Å²	133.7	78%	0.776	75%	0.752	S	S	*	*	S	Bend	cis	-118.4	132.2	1	-176.4	0	0	0	0	110.5	V390	S388-V390 PolarHBondContact O-N 3.23Å
389	K	32.6	Very low	33.6	Very low	195 Å²	195	131.9 Å²	131.9	85%	0.848	75%	0.749	S	S	*	*	S	Bend	trans	39	65.5	172.9	-62.5	-173	179.1	-178.1	0	115.4
390	V	30.8	Very low	33.5	Very low	125 Å²	125	133 Å²	133	76%	0.758	76%	0.76	S	S	*	*				67.4	100.2	90.6	176.4	0	0	0	0	112.1	S388	S388-V390 PolarHBondContact O-N 3.23Å
391	S	30.5	Very low	33.4	Very low	95 Å²	95	132.8 Å²	132.8	66%	0.664	76%	0.763	S	S	*	*				77.1	139.9	83.7	139.7	0	0	0	0	113.9
392	R	30.9	Very low	33	Very low	227 Å²	227	135.7 Å²	135.7	86%	0.857	77%	0.769	S	S	*	*			cis	-151	146.6	6.5	-119.5	167.3	166.8	155.3	-6.1	109.6
393	S	31.3	Very low	32.8	Very low	92 Å²	92	137.3 Å²	137.3	64%	0.643	77%	0.771	S	S	*	*				49.2	113.7	104	-159.3	0	0	0	0	114.6
394	K	30	Very low	32.7	Very low	189 Å²	189	136.6 Å²	136.6	82%	0.822	77%	0.769	S	S	*	*				48.3	106.8	80.5	-71.2	179.3	178.6	177.9	0	111.3
395	S	29.7	Very low	33.3	Very low	94 Å²	94	139.4 Å²	139.4	66%	0.657	76%	0.764	S	S	*	*				72.7	123	83	159.7	0	0	0	0	113.3
396	H	33.4	Very low	34.2	Very low	144 Å²	144	138.4 Å²	138.4	67%	0.667	75%	0.748	S	S	*	*				-173.3	137.8	122.1	-100	-69	0	0	0	112.1
397	R	29.9	Very low	35.3	Very low	205 Å²	205	139.2 Å²	139.2	77%	0.774	74%	0.735	S	S	*	*			trans	35.5	152.4	138.6	-60.9	174.1	-178.1	175.7	-2.9	119.9
398	L	31.2	Very low	36.2	Very low	157 Å²	157	141.5 Å²	141.5	82%	0.822	73%	0.727	S	S	*	*			cis	-122.9	151.3	16.1	-74.1	77.5	0	0	0	109.8
399	S	28.5	Very low	37.5	Very low	88 Å²	88	146.9 Å²	146.9	62%	0.615	73%	0.731	S	S	*	*			cis	98.2	68	23.1	83.6	0	0	0	0	117.2
400	V	35.2	Very low	39.4	Very low	141 Å²	141	145.7 Å²	145.7	86%	0.855	72%	0.722	S	S	*	*			trans	-136.7	93.6	157.6	-176.4	0	0	0	0	107.4
401	V	35.7	Very low	41.4	Very low	119 Å²	119	142.5 Å²	142.5	72%	0.721	70%	0.703	S	S	*	*				73.1	98.8	91.4	177.9	0	0	0	0	115.2
402	K	31.5	Very low	43.6	Very low	192 Å²	192	144.6 Å²	144.6	84%	0.835	70%	0.7	S	S	*	*			trans	47.3	110.5	143.4	-58.6	176.7	-178.2	177.3	0	119.7
403	K	35.9	Very low	45.8	Very low	188 Å²	188	137.3 Å²	137.3	82%	0.817	68%	0.683	S	S	*	*				-160	119.5	98	-104	169.9	-176.7	177.9	0	111
404	S	37.1	Very low	48	Very low	115 Å²	115	136.3 Å²	136.3	80%	0.804	68%	0.676	S	S	*	*			trans	-75.3	134.4	168.1	-178.5	0	0	0	0	108.8
405	H	48.3	Very low	50.6	Low	126 Å²	126	132.6 Å²	132.6	58%	0.583	67%	0.665	S	S	*	*			trans	-119.5	96.5	-176.4	-113.4	-73.9	0	0	0	109.1	W407	H405-W407 VanDerWaalsContact C-N 3.25Å; H405-W407 AromaticContact CG-CD1 3.68Å; H405-W407 AromaticContact CG-NE1 3.44Å; H405-W407 AromaticContact ND1-CD1 3.22Å; H405-W407 AromaticContact ND1-NE1 3.13Å; H405-W407 PolarHBondContact ND1-NE1 2.74Å; H405-W407 VanDerWaalsContact ND1-NE1 3.13Å; H405-W407 PolarHBondContact O-N 3.32Å
406	P	55.1	Low	53.1	Low	82 Å²	82	131.6 Å²	131.6	53%	0.532	66%	0.655	S	S	.	*	T	Hydrogen-bonded Turn	trans	-60.9	-31	-170.2	-26.4	35.3	0	0	0	114.6	M408 R409 Y410	P406-M408 PolarHBondContact O-N 2.86Å; P406-M408 VanDerWaalsContact O-N 3.08Å; P406-R409 PolarHBondContact O-N 3.31Å; P406-Y410 HydrophobicContact CB-CD2 4.43Å; P406-Y410 HydrophobicContact CB-CE2 4.12Å; P406-Y410 WeakPolarHBondContact O-CD2 3.5Å
407	W	58.4	Low	55.6	Low	164 Å²	164	129.1 Å²	129.1	62%	0.621	65%	0.649	S	S	*	*	H	α-helix	trans	-49.6	-36.3	-174.7	69.6	-59.3	0	0	0	114.5	H405 R409 Y410 T411	H405-W407 VanDerWaalsContact C-N 3.25Å; H405-W407 AromaticContact CG-CD1 3.68Å; H405-W407 AromaticContact CG-NE1 3.44Å; H405-W407 AromaticContact ND1-CD1 3.22Å; H405-W407 AromaticContact ND1-NE1 3.13Å; H405-W407 PolarHBondContact ND1-NE1 2.74Å; H405-W407 VanDerWaalsContact ND1-NE1 3.13Å; H405-W407 PolarHBondContact O-N 3.32Å; W407-R409 VanDerWaalsContact C-N 3.25Å; W407-R409 PolarHBondContact O-N 3Å; W407-Y410 CarbonylContact O-C 3.55Å; W407-Y410 WeakPolarHBondContact O-CA 3.46Å; W407-Y410 WeakPolarHBondContact O-CB 3.4Å; W407-Y410 PolarHBondContact O-N 3.49Å; W407-T411 HydrophobicContact CE3-CG2 4.23Å; W407-T411 PolarHBondContact O-N 2.99Å; W407-T411 PolarHBondContact O-OG1 3.24Å
408	M	51.8	Low	58.1	Low	122 Å²	122	126 Å²	126	60%	0.601	64%	0.642	S	S	*	*	H	α-helix	trans	-66.4	-23.9	-177.9	-154.1	-154.7	-69.5	0	0	113.6	P406 T411 F412	P406-M408 PolarHBondContact O-N 2.86Å; P406-M408 VanDerWaalsContact O-N 3.08Å; M408-T411 WeakPolarHBondContact CA-OG1 3.36Å; M408-T411 PolarHBondContact O-OG1 3.36Å; M408-T411 VanDerWaalsContact O-OG1 3.05Å; M408-F412 HydrophobicContact CG-CD2 4.46Å; M408-F412 WeakPolarHBondContact O-CD2 3.45Å; M408-F412 PolarHBondContact O-N 3.5Å; M408-F412 HydrophobicContact SD-CE2 4.48Å
409	R	60.4	Low	60.6	Low	224 Å²	224	123.3 Å²	123.3	85%	0.845	63%	0.628	S	S	*	*	H	α-helix	trans	-77.4	-34.2	170.8	-72.9	-171.8	174.8	-168.9	-2.3	111.9	P406 W407 C413	P406-R409 PolarHBondContact O-N 3.31Å; W407-R409 VanDerWaalsContact C-N 3.25Å; W407-R409 PolarHBondContact O-N 3Å; R409-C413 WeakPolarHBondContact O-CB 3.39Å; R409-C413 PolarHBondContact O-N 3.4Å; R409-C413 VanDerWaalsContact O-N 3.09Å
410	Y	71.3	Confident	63.2	Low	170 Å²	170	124.5 Å²	124.5	67%	0.667	63%	0.626	S	S	*	*	H	α-helix	trans	-70.5	-36.9	174.6	-68.4	-78.8	0	0	0	112.3	P406 W407 C413 S414	P406-Y410 HydrophobicContact CB-CD2 4.43Å; P406-Y410 HydrophobicContact CB-CE2 4.12Å; P406-Y410 WeakPolarHBondContact O-CD2 3.5Å; W407-Y410 CarbonylContact O-C 3.55Å; W407-Y410 WeakPolarHBondContact O-CA 3.46Å; W407-Y410 WeakPolarHBondContact O-CB 3.4Å; W407-Y410 PolarHBondContact O-N 3.49Å; Y410-C413 PolarHBondContact O-N 3.46Å; Y410-S414 WeakPolarHBondContact O-CB 3.42Å; Y410-S414 PolarHBondContact O-N 2.89Å
411	T	74.2	Confident	65.6	Low	58 Å²	58	124.9 Å²	124.9	36%	0.356	61%	0.613	S	S	.	*	H	α-helix	trans	-65.4	-44.7	176	55.8	0	0	0	0	111.8	W407 M408 S414 L415	W407-T411 HydrophobicContact CE3-CG2 4.23Å; W407-T411 PolarHBondContact O-N 2.99Å; W407-T411 PolarHBondContact O-OG1 3.24Å; M408-T411 WeakPolarHBondContact CA-OG1 3.36Å; M408-T411 PolarHBondContact O-OG1 3.36Å; M408-T411 VanDerWaalsContact O-OG1 3.05Å; T411-S414 PolarHBondContact O-N 3.31Å; T411-L415 WeakPolarHBondContact O-CB 3.15Å; T411-L415 WeakPolarHBondContact O-CG 3.37Å; T411-L415 PolarHBondContact O-N 2.85Å
412	F	75.8	Confident	67.8	Low	140 Å²	140	128.2 Å²	128.2	61%	0.614	61%	0.613	S	S	*	*	H	α-helix	trans	-62.3	-44.7	174.5	-94.1	-77.2	0	0	0	112.3	M408 L415 T416	M408-F412 HydrophobicContact CG-CD2 4.46Å; M408-F412 WeakPolarHBondContact O-CD2 3.45Å; M408-F412 PolarHBondContact O-N 3.5Å; M408-F412 HydrophobicContact SD-CE2 4.48Å; F412-L415 PolarHBondContact O-N 3.39Å; F412-T416 PolarHBondContact O-N 2.68Å; F412-T416 PolarHBondContact O-OG1 2.98Å
413	C	76.7	Confident	70.2	Confident	73 Å²	73	124.4 Å²	124.4	49%	0.493	60%	0.601	S	S	.	*	H	α-helix	trans	-64.6	-43.3	177.5	-164.1	0	0	0	0	111.7	R409 Y410 L415 T416 V417	R409-C413 WeakPolarHBondContact O-CB 3.39Å; R409-C413 PolarHBondContact O-N 3.4Å; R409-C413 VanDerWaalsContact O-N 3.09Å; Y410-C413 PolarHBondContact O-N 3.46Å; C413-L415 PolarHBondContact O-N 3.42Å; C413-T416 WeakPolarHBondContact CA-OG1 3.28Å; C413-T416 PolarHBondContact O-N 2.73Å; C413-T416 PolarHBondContact O-OG1 3.27Å; C413-V417 WeakPolarHBondContact O-CG2 3.45Å; C413-V417 PolarHBondContact O-N 3.38Å
414	S	78.1	Confident	72.5	Confident	71 Å²	71	121.4 Å²	121.4	50%	0.497	59%	0.588	S	S	.	*	H	α-helix	trans	-60.7	-43.7	175.5	-171.9	0	0	0	0	111.4	Y410 T411 T416 V417 F418	Y410-S414 WeakPolarHBondContact O-CB 3.42Å; Y410-S414 PolarHBondContact O-N 2.89Å; T411-S414 PolarHBondContact O-N 3.31Å; S414-T416 PolarHBondContact O-N 2.87Å; S414-V417 PolarHBondContact O-N 3.49Å; S414-F418 WeakPolarHBondContact O-CB 3.44Å; S414-F418 PolarHBondContact O-N 3.44Å
415	L	84.6	Confident	74.6	Confident	111 Å²	111	118.8 Å²	118.8	58%	0.581	57%	0.565	S	S	*	*	H	α-helix	trans	-59.8	-44	174.7	-82.3	164.7	0	0	0	111.7	T411 F412 C413 V417 F418 L419	T411-L415 WeakPolarHBondContact O-CB 3.15Å; T411-L415 WeakPolarHBondContact O-CG 3.37Å; T411-L415 PolarHBondContact O-N 2.85Å; F412-L415 PolarHBondContact O-N 3.39Å; C413-L415 PolarHBondContact O-N 3.42Å; L415-V417 PolarHBondContact O-N 3.26Å; L415-F418 PolarHBondContact O-N 2.84Å; L415-L419 WeakPolarHBondContact O-CB 3.31Å; L415-L419 PolarHBondContact O-N 3.35Å
416	T	81.4	Confident	76.3	Confident	74 Å²	74	115 Å²	115	45%	0.454	56%	0.561	S	S	.	*	H	α-helix	trans	-64.7	-39	176.9	50.4	0	0	0	0	113	F412 C413 S414 L419 I420	F412-T416 PolarHBondContact O-N 2.68Å; F412-T416 PolarHBondContact O-OG1 2.98Å; C413-T416 WeakPolarHBondContact CA-OG1 3.28Å; C413-T416 PolarHBondContact O-N 2.73Å; C413-T416 PolarHBondContact O-OG1 3.27Å; S414-T416 PolarHBondContact O-N 2.87Å; T416-L419 PolarHBondContact O-N 2.92Å; T416-I420 VanDerWaalsContact O-CG1 3.31Å; T416-I420 WeakPolarHBondContact O-CG1 3.46Å; T416-I420 PolarHBondContact O-N 2.87Å
417	V	85.4	Confident	77.6	Confident	91 Å²	91	117.4 Å²	117.4	55%	0.552	56%	0.563	S	S	*	*	H	α-helix	trans	-67.2	-40.1	175.1	173.6	0	0	0	0	110.9	C413 S414 L415 L419 I420 Y421	C413-V417 WeakPolarHBondContact O-CG2 3.45Å; C413-V417 PolarHBondContact O-N 3.38Å; S414-V417 PolarHBondContact O-N 3.49Å; L415-V417 PolarHBondContact O-N 3.26Å; V417-L419 PolarHBondContact O-N 3.29Å; V417-I420 PolarHBondContact O-N 3.13Å; V417-Y421 WeakPolarHBondContact O-CB 3.33Å; V417-Y421 PolarHBondContact O-N 2.93Å
418	F	83.6	Confident	78.8	Confident	139 Å²	139	113.4 Å²	113.4	61%	0.61	55%	0.553	S	S	*	*	H	α-helix	trans	-63.2	-40.6	175.2	-131.7	-88.6	0	0	0	111.9	S414 L415 Y421 W422	S414-F418 WeakPolarHBondContact O-CB 3.44Å; S414-F418 PolarHBondContact O-N 3.44Å; L415-F418 PolarHBondContact O-N 2.84Å; F418-Y421 PolarHBondContact O-N 2.81Å; F418-W422 VanDerWaalsContact O-CB 3.29Å; F418-W422 WeakPolarHBondContact O-CB 3.34Å; F418-W422 PolarHBondContact O-N 2.9Å
419	L	82.9	Confident	80.2	Confident	101 Å²	101	113 Å²	113	53%	0.529	55%	0.553	S	S	.	*	H	α-helix	trans	-65.3	-43.4	176.6	-122.5	168.1	0	0	0	111.8	L415 T416 V417 W422 L423	L415-L419 WeakPolarHBondContact O-CB 3.31Å; L415-L419 PolarHBondContact O-N 3.35Å; T416-L419 PolarHBondContact O-N 2.92Å; V417-L419 PolarHBondContact O-N 3.29Å; L419-W422 PolarHBondContact O-N 3.49Å; L419-L423 HydrophobicContact CD2-CD1 4.1Å; L419-L423 HydrophobicContact CD2-CG 4.28Å; L419-L423 WeakPolarHBondContact O-CB 3.31Å; L419-L423 VanDerWaalsContact O-CG 3.28Å; L419-L423 WeakPolarHBondContact O-CG 3.49Å; L419-L423 PolarHBondContact O-N 3.24Å
420	I	84.6	Confident	81.3	Confident	113 Å²	113	104.6 Å²	104.6	58%	0.579	54%	0.535	S	S	*	.	H	α-helix	trans	-63.5	-45.6	174.9	-68.5	165	0	0	0	110.4	T416 V417 W422 L423 F424	T416-I420 VanDerWaalsContact O-CG1 3.31Å; T416-I420 WeakPolarHBondContact O-CG1 3.46Å; T416-I420 PolarHBondContact O-N 2.87Å; V417-I420 PolarHBondContact O-N 3.13Å; I420-W422 VanDerWaalsContact C-N 3.34Å; I420-W422 PolarHBondContact O-N 2.87Å; I420-L423 PolarHBondContact O-N 3.44Å; I420-F424 WeakPolarHBondContact O-CB 3.32Å; I420-F424 PolarHBondContact O-N 3.15Å
421	Y	84	Confident	82	Confident	150 Å²	150	100.7 Å²	100.7	59%	0.588	53%	0.526	S	S	*	.	H	α-helix	trans	-61.3	-40.9	176.5	-178.4	-103.1	0	0	0	112	V417 F418 F424 N425	V417-Y421 WeakPolarHBondContact O-CB 3.33Å; V417-Y421 PolarHBondContact O-N 2.93Å; F418-Y421 PolarHBondContact O-N 2.81Å; Y421-F424 PolarHBondContact O-N 3.4Å; Y421-N425 WeakPolarHBondContact CD2-ND2 3.28Å; Y421-N425 WeakPolarHBondContact CE1-ND2 3.41Å; Y421-N425 WeakPolarHBondContact CE2-ND2 3.36Å; Y421-N425 WeakPolarHBondContact O-CB 3.29Å; Y421-N425 PolarHBondContact O-N 3.46Å; Y421-N425 PolarHBondContact O-ND2 3.26Å
422	W	82.9	Confident	82.5	Confident	189 Å²	189	101.7 Å²	101.7	72%	0.716	53%	0.532	S	S	*	.	H	α-helix	trans	-68.3	-40.5	177.8	-160.9	71.2	0	0	0	112.2	F418 L419 I420 G426	F418-W422 VanDerWaalsContact O-CB 3.29Å; F418-W422 WeakPolarHBondContact O-CB 3.34Å; F418-W422 PolarHBondContact O-N 2.9Å; L419-W422 PolarHBondContact O-N 3.49Å; I420-W422 VanDerWaalsContact C-N 3.34Å; I420-W422 PolarHBondContact O-N 2.87Å; W422-G426 PolarHBondContact O-N 2.85Å
423	L	81.9	Confident	83.1	Confident	112 Å²	112	98.1 Å²	98.1	59%	0.586	52%	0.522	S	S	*	.	H	α-helix	trans	-65.6	-40.7	172.9	-72.7	169.7	0	0	0	112.4	L419 I420 G426 F427	L419-L423 HydrophobicContact CD2-CD1 4.1Å; L419-L423 HydrophobicContact CD2-CG 4.28Å; L419-L423 WeakPolarHBondContact O-CB 3.31Å; L419-L423 VanDerWaalsContact O-CG 3.28Å; L419-L423 WeakPolarHBondContact O-CG 3.49Å; L419-L423 PolarHBondContact O-N 3.24Å; I420-L423 PolarHBondContact O-N 3.44Å; L423-G426 PolarHBondContact O-N 2.89Å; L423-F427 WeakPolarHBondContact O-CB 3.5Å; L423-F427 PolarHBondContact O-N 2.95Å
424	F	84.4	Confident	83.6	Confident	124 Å²	124	96.1 Å²	96.1	54%	0.544	51%	0.513	S	S	.	.	H	α-helix	trans	-71.2	-38.7	-179.7	-155.4	-92	0	0	0	112	I420 Y421 F427 L428	I420-F424 WeakPolarHBondContact O-CB 3.32Å; I420-F424 PolarHBondContact O-N 3.15Å; Y421-F424 PolarHBondContact O-N 3.4Å; F424-F427 PolarHBondContact O-N 3.36Å; F424-L428 HydrophobicContact CD1-CD1 3.74Å; F424-L428 HydrophobicContact CD1-CG 4.2Å; F424-L428 HydrophobicContact CE1-CD1 3.89Å; F424-L428 HydrophobicContact CE1-CG 4.22Å; F424-L428 WeakPolarHBondContact O-CB 3.18Å; F424-L428 WeakPolarHBondContact O-CG 3.29Å; F424-L428 PolarHBondContact O-N 2.68Å
425	N	81.6	Confident	84.1	Confident	61 Å²	61	96.1 Å²	96.1	33%	0.326	51%	0.512	S	S	.	.	H	α-helix	trans	-66.1	-40.2	169.2	-79.4	-82.9	0	0	0	111.6	Y421 F427 L428 L429	Y421-N425 WeakPolarHBondContact CD2-ND2 3.28Å; Y421-N425 WeakPolarHBondContact CE1-ND2 3.41Å; Y421-N425 WeakPolarHBondContact CE2-ND2 3.36Å; Y421-N425 WeakPolarHBondContact O-CB 3.29Å; Y421-N425 PolarHBondContact O-N 3.46Å; Y421-N425 PolarHBondContact O-ND2 3.26Å; N425-F427 VanDerWaalsContact C-N 3.3Å; N425-F427 PolarHBondContact O-N 2.87Å; N425-L428 PolarHBondContact O-N 3.43Å; N425-L429 WeakPolarHBondContact O-CB 3.36Å; N425-L429 PolarHBondContact O-N 3.48Å
426	G	82.9	Confident	84.2	Confident	47 Å²	47	95.8 Å²	95.8	49%	0.485	51%	0.51	S	S	.	.	H	α-helix	trans	-59.9	-38.8	173.5	0	0	0	0	0	112.9	W422 L423 G430	W422-G426 PolarHBondContact O-N 2.85Å; L423-G426 PolarHBondContact O-N 2.89Å; G426-G430 PolarHBondContact O-N 3.13Å
427	F	83.2	Confident	84.5	Confident	132 Å²	132	97.5 Å²	97.5	58%	0.579	52%	0.516	S	S	*	.	H	α-helix	trans	-66.4	-49.9	173.1	179.8	-103.6	0	0	0	111.9	L423 F424 N425 L429 G430 L431	L423-F427 WeakPolarHBondContact O-CB 3.5Å; L423-F427 PolarHBondContact O-N 2.95Å; F424-F427 PolarHBondContact O-N 3.36Å; N425-F427 VanDerWaalsContact C-N 3.3Å; N425-F427 PolarHBondContact O-N 2.87Å; F427-L429 VanDerWaalsContact C-N 3.34Å; F427-L429 PolarHBondContact O-N 3.02Å; F427-G430 PolarHBondContact O-N 2.81Å; F427-L431 HydrophobicContact CE1-CD1 3.88Å; F427-L431 HydrophobicContact CZ-CD1 4.11Å; F427-L431 WeakPolarHBondContact O-CB 3.24Å; F427-L431 PolarHBondContact O-N 2.92Å
428	L	82.7	Confident	84.5	Confident	80 Å²	80	97.1 Å²	97.1	42%	0.419	51%	0.514	S	S	.	.	H	α-helix	trans	-58.7	-43.3	176.8	-76.1	168.4	0	0	0	112.3	F424 N425 L431 T432	F424-L428 HydrophobicContact CD1-CD1 3.74Å; F424-L428 HydrophobicContact CD1-CG 4.2Å; F424-L428 HydrophobicContact CE1-CD1 3.89Å; F424-L428 HydrophobicContact CE1-CG 4.22Å; F424-L428 WeakPolarHBondContact O-CB 3.18Å; F424-L428 WeakPolarHBondContact O-CG 3.29Å; F424-L428 PolarHBondContact O-N 2.68Å; N425-L428 PolarHBondContact O-N 3.43Å; L428-L431 WeakPolarHBondContact O-CB 3.37Å; L428-L431 PolarHBondContact O-N 3.38Å; L428-L431 VanDerWaalsContact O-N 3.16Å; L428-T432 PolarHBondContact O-N 2.86Å; L428-T432 PolarHBondContact O-OG1 2.96Å
429	L	80.6	Confident	84.6	Confident	114 Å²	114	98.3 Å²	98.3	60%	0.597	52%	0.516	S	S	*	.	H	α-helix	trans	-70.4	-36.3	-179.5	-153.1	153.8	0	0	0	110.8	N425 F427 L431 T432 V433	N425-L429 WeakPolarHBondContact O-CB 3.36Å; N425-L429 PolarHBondContact O-N 3.48Å; F427-L429 VanDerWaalsContact C-N 3.34Å; F427-L429 PolarHBondContact O-N 3.02Å; L429-L431 VanDerWaalsContact C-N 3.34Å; L429-T432 WeakPolarHBondContact CA-OG1 3.24Å; L429-T432 PolarHBondContact O-N 3.41Å; L429-T432 PolarHBondContact O-OG1 2.97Å; L429-V433 HydrophobicContact CD2-CG2 3.98Å; L429-V433 WeakPolarHBondContact O-CB 3.41Å; L429-V433 VanDerWaalsContact O-CG2 3.26Å; L429-V433 WeakPolarHBondContact O-CG2 3.3Å; L429-V433 PolarHBondContact O-N 2.91Å
430	G	85.6	Confident	84.6	Confident	46 Å²	46	96.4 Å²	96.4	47%	0.474	51%	0.508	S	S	.	.	H	α-helix	trans	-62.3	-37.8	167.5	0	0	0	0	0	113.2	G426 F427 G434	G426-G430 PolarHBondContact O-N 3.13Å; F427-G430 PolarHBondContact O-N 2.81Å; G430-G434 PolarHBondContact O-N 3.32Å
431	L	85.9	Confident	84.6	Confident	89 Å²	89	98.5 Å²	98.5	47%	0.466	51%	0.513	S	S	.	.	H	α-helix	trans	-68.8	-45.8	176.3	-136.9	169.7	0	0	0	111	F427 L428 L429 G434 C435	F427-L431 HydrophobicContact CE1-CD1 3.88Å; F427-L431 HydrophobicContact CZ-CD1 4.11Å; F427-L431 WeakPolarHBondContact O-CB 3.24Å; F427-L431 PolarHBondContact O-N 2.92Å; L428-L431 WeakPolarHBondContact O-CB 3.37Å; L428-L431 PolarHBondContact O-N 3.38Å; L428-L431 VanDerWaalsContact O-N 3.16Å; L429-L431 VanDerWaalsContact C-N 3.34Å; L431-G434 PolarHBondContact O-N 3.49Å; L431-C435 PolarHBondContact O-N 3.18Å; L431-C435 PolarHBondContact O-SG 2.81Å; L431-C435 VanDerWaalsContact O-SG 3.35Å
432	T	84.8	Confident	84.4	Confident	78 Å²	78	96 Å²	96	48%	0.479	51%	0.509	S	S	.	.	H	α-helix	trans	-66.3	-40.8	176.4	53.7	0	0	0	0	112.3	L428 L429 G434 C435 I436	L428-T432 PolarHBondContact O-N 2.86Å; L428-T432 PolarHBondContact O-OG1 2.96Å; L429-T432 WeakPolarHBondContact CA-OG1 3.24Å; L429-T432 PolarHBondContact O-N 3.41Å; L429-T432 PolarHBondContact O-OG1 2.97Å; T432-G434 VanDerWaalsContact C-N 3.32Å; T432-C435 PolarHBondContact O-N 3.29Å; T432-I436 WeakPolarHBondContact O-CB 3.48Å; T432-I436 WeakPolarHBondContact O-CD1 3.35Å; T432-I436 WeakPolarHBondContact O-CG1 3.21Å; T432-I436 PolarHBondContact O-N 2.67Å
433	V	87.8	Confident	84.1	Confident	66 Å²	66	90 Å²	90	40%	0.4	49%	0.493	S	S	.	.	H	α-helix	trans	-65.6	-37.9	174.1	169.5	0	0	0	0	110.5	L429 I436 L437	L429-V433 HydrophobicContact CD2-CG2 3.98Å; L429-V433 WeakPolarHBondContact O-CB 3.41Å; L429-V433 VanDerWaalsContact O-CG2 3.26Å; L429-V433 WeakPolarHBondContact O-CG2 3.3Å; L429-V433 PolarHBondContact O-N 2.91Å; V433-I436 PolarHBondContact O-N 3.29Å; V433-L437 HydrophobicContact CG1-CD1 3.82Å; V433-L437 HydrophobicContact CG1-CG 4.26Å; V433-L437 VanDerWaalsContact O-CB 3.31Å; V433-L437 WeakPolarHBondContact O-CB 3.14Å; V433-L437 VanDerWaalsContact O-CG 3.29Å; V433-L437 WeakPolarHBondContact O-CG 3.38Å; V433-L437 PolarHBondContact O-N 3.1Å
434	G	87.4	Confident	84.1	Confident	31 Å²	31	88.3 Å²	88.3	32%	0.32	49%	0.488	S	S	.	.	H	α-helix	trans	-59.3	-48.8	171.4	0	0	0	0	0	112.6	G430 L431 T432 L437 T438	G430-G434 PolarHBondContact O-N 3.32Å; L431-G434 PolarHBondContact O-N 3.49Å; T432-G434 VanDerWaalsContact C-N 3.32Å; G434-L437 PolarHBondContact O-N 2.81Å; G434-T438 WeakPolarHBondContact O-CG2 3.44Å; G434-T438 PolarHBondContact O-N 3.29Å; G434-T438 PolarHBondContact O-OG1 2.92Å; G434-T438 VanDerWaalsContact O-OG1 3.05Å
435	C	87.8	Confident	83.7	Confident	71 Å²	71	88.3 Å²	88.3	48%	0.48	49%	0.485	S	S	.	.	H	α-helix	trans	-61.7	-43.6	175.8	-69.9	0	0	0	0	112.3	L431 T432 T438 Y439	L431-C435 PolarHBondContact O-N 3.18Å; L431-C435 PolarHBondContact O-SG 2.81Å; L431-C435 VanDerWaalsContact O-SG 3.35Å; T432-C435 PolarHBondContact O-N 3.29Å; C435-T438 WeakPolarHBondContact CA-OG1 3.42Å; C435-T438 PolarHBondContact O-N 3.2Å; C435-T438 PolarHBondContact O-OG1 3.31Å; C435-Y439 VanDerWaalsContact O-CB 3.24Å; C435-Y439 WeakPolarHBondContact O-CB 3.37Å; C435-Y439 PolarHBondContact O-N 3.04Å
436	I	87.7	Confident	83.3	Confident	103 Å²	103	89.8 Å²	89.8	53%	0.528	49%	0.493	S	S	.	.	H	α-helix	trans	-64.9	-42.9	176.8	-68.8	163.4	0	0	0	110.9	T432 V433 Y439 T440	T432-I436 WeakPolarHBondContact O-CB 3.48Å; T432-I436 WeakPolarHBondContact O-CD1 3.35Å; T432-I436 WeakPolarHBondContact O-CG1 3.21Å; T432-I436 PolarHBondContact O-N 2.67Å; V433-I436 PolarHBondContact O-N 3.29Å; I436-Y439 PolarHBondContact O-N 2.85Å; I436-T440 HydrophobicContact CG2-CG2 4.36Å; I436-T440 WeakPolarHBondContact O-CB 3.38Å; I436-T440 VanDerWaalsContact O-CG2 3.32Å; I436-T440 WeakPolarHBondContact O-CG2 3.49Å; I436-T440 PolarHBondContact O-N 3.04Å; I436-T440 PolarHBondContact O-OG1 3.42Å
437	L	87.9	Confident	82.8	Confident	110 Å²	110	93.3 Å²	93.3	58%	0.576	49%	0.492	S	S	*	.	H	α-helix	trans	-64.7	-43.9	175.8	-75.4	171.9	0	0	0	111.6	V433 G434 T440 F441	V433-L437 HydrophobicContact CG1-CD1 3.82Å; V433-L437 HydrophobicContact CG1-CG 4.26Å; V433-L437 VanDerWaalsContact O-CB 3.31Å; V433-L437 WeakPolarHBondContact O-CB 3.14Å; V433-L437 VanDerWaalsContact O-CG 3.29Å; V433-L437 WeakPolarHBondContact O-CG 3.38Å; V433-L437 PolarHBondContact O-N 3.1Å; G434-L437 PolarHBondContact O-N 2.81Å; L437-T440 WeakPolarHBondContact CA-OG1 3.14Å; L437-T440 PolarHBondContact O-OG1 3.06Å; L437-T440 VanDerWaalsContact O-OG1 3.06Å; L437-F441 VanDerWaalsContact O-CB 3.25Å; L437-F441 WeakPolarHBondContact O-CB 3.24Å; L437-F441 PolarHBondContact O-N 2.85Å
438	T	83.9	Confident	82.1	Confident	84 Å²	84	92.1 Å²	92.1	52%	0.515	49%	0.491	S	S	.	.	H	α-helix	trans	-65.5	-40.3	174.7	52.5	0	0	0	0	112.4	G434 C435 F441 I442	G434-T438 WeakPolarHBondContact O-CG2 3.44Å; G434-T438 PolarHBondContact O-N 3.29Å; G434-T438 PolarHBondContact O-OG1 2.92Å; G434-T438 VanDerWaalsContact O-OG1 3.05Å; C435-T438 WeakPolarHBondContact CA-OG1 3.42Å; C435-T438 PolarHBondContact O-N 3.2Å; C435-T438 PolarHBondContact O-OG1 3.31Å; T438-F441 PolarHBondContact O-N 3.5Å; T438-I442 WeakPolarHBondContact O-CB 3.14Å; T438-I442 WeakPolarHBondContact O-CD1 3.26Å; T438-I442 WeakPolarHBondContact O-CG1 3.46Å; T438-I442 PolarHBondContact O-N 3.22Å
439	Y	87	Confident	81.1	Confident	164 Å²	164	93.6 Å²	93.6	64%	0.643	50%	0.496	S	S	*	.	H	α-helix	trans	-65.6	-44.6	177.6	179.2	-95.6	0	0	0	111.9	C435 I436 I442 T443	C435-Y439 VanDerWaalsContact O-CB 3.24Å; C435-Y439 WeakPolarHBondContact O-CB 3.37Å; C435-Y439 PolarHBondContact O-N 3.04Å; I436-Y439 PolarHBondContact O-N 2.85Å; Y439-I442 PolarHBondContact O-N 3.27Å; Y439-T443 VanDerWaalsContact O-CB 3.28Å; Y439-T443 WeakPolarHBondContact O-CB 3.4Å; Y439-T443 PolarHBondContact O-N 3.42Å; Y439-T443 PolarHBondContact O-OG1 3.31Å
440	T	82.9	Confident	79.6	Confident	61 Å²	61	92.3 Å²	92.3	37%	0.374	50%	0.496	S	S	.	.	H	α-helix	trans	-66.7	-38.3	174.6	52.6	0	0	0	0	111.8	I436 L437 T443 V444	I436-T440 HydrophobicContact CG2-CG2 4.36Å; I436-T440 WeakPolarHBondContact O-CB 3.38Å; I436-T440 VanDerWaalsContact O-CG2 3.32Å; I436-T440 WeakPolarHBondContact O-CG2 3.49Å; I436-T440 PolarHBondContact O-N 3.04Å; I436-T440 PolarHBondContact O-OG1 3.42Å; L437-T440 WeakPolarHBondContact CA-OG1 3.14Å; L437-T440 PolarHBondContact O-OG1 3.06Å; L437-T440 VanDerWaalsContact O-OG1 3.06Å; T440-T443 PolarHBondContact O-N 2.84Å; T440-V444 VanDerWaalsContact O-CB 3.3Å; T440-V444 WeakPolarHBondContact O-CB 3.31Å; T440-V444 VanDerWaalsContact O-CG2 3.27Å; T440-V444 WeakPolarHBondContact O-CG2 3.46Å; T440-V444 PolarHBondContact O-N 3.16Å
441	F	83.5	Confident	77.5	Confident	156 Å²	156	98.3 Å²	98.3	68%	0.684	51%	0.505	S	S	*	.	H	α-helix	trans	-66.2	-41.2	175.9	-158.9	-84.9	0	0	0	111.9	L437 T438 V444 Y445	L437-F441 VanDerWaalsContact O-CB 3.25Å; L437-F441 WeakPolarHBondContact O-CB 3.24Å; L437-F441 PolarHBondContact O-N 2.85Å; T438-F441 PolarHBondContact O-N 3.5Å; F441-V444 PolarHBondContact O-N 2.89Å; F441-Y445 WeakPolarHBondContact O-CB 3.31Å; F441-Y445 PolarHBondContact O-N 3.48Å
442	I	80.6	Confident	75.5	Confident	97 Å²	97	98.5 Å²	98.5	50%	0.497	51%	0.51	S	S	.	.	H	α-helix	trans	-63.3	-43.1	172.1	-69.3	163.5	0	0	0	110.6	T438 Y439 Y445 N446	T438-I442 WeakPolarHBondContact O-CB 3.14Å; T438-I442 WeakPolarHBondContact O-CD1 3.26Å; T438-I442 WeakPolarHBondContact O-CG1 3.46Å; T438-I442 PolarHBondContact O-N 3.22Å; Y439-I442 PolarHBondContact O-N 3.27Å; I442-Y445 PolarHBondContact O-N 3.12Å; I442-N446 VanDerWaalsContact O-CB 3.29Å; I442-N446 WeakPolarHBondContact O-CB 3.4Å; I442-N446 PolarHBondContact O-N 3.45Å; I442-N446 PolarHBondContact O-ND2 3.48Å
443	T	77.3	Confident	73.1	Confident	63 Å²	63	100.5 Å²	100.5	39%	0.387	53%	0.527	S	S	.	.	H	α-helix	trans	-66.2	-40	179.4	-57.2	0	0	0	0	111.6	Y439 T440 Y447	Y439-T443 VanDerWaalsContact O-CB 3.28Å; Y439-T443 WeakPolarHBondContact O-CB 3.4Å; Y439-T443 PolarHBondContact O-N 3.42Å; Y439-T443 PolarHBondContact O-OG1 3.31Å; T440-T443 PolarHBondContact O-N 2.84Å; T443-Y447 WeakPolarHBondContact O-CB 3.32Å; T443-Y447 PolarHBondContact O-N 3.28Å
444	V	80.1	Confident	70.7	Confident	77 Å²	77	106.4 Å²	106.4	47%	0.467	54%	0.543	S	S	.	.	H	α-helix	trans	-72.8	-39.8	176.4	168.4	0	0	0	0	111.3	T440 F441 Y447 L448	T440-V444 VanDerWaalsContact O-CB 3.3Å; T440-V444 WeakPolarHBondContact O-CB 3.31Å; T440-V444 VanDerWaalsContact O-CG2 3.27Å; T440-V444 WeakPolarHBondContact O-CG2 3.46Å; T440-V444 PolarHBondContact O-N 3.16Å; F441-V444 PolarHBondContact O-N 2.89Å; V444-Y447 PolarHBondContact O-N 3.42Å; V444-L448 HydrophobicContact CG1-CD1 3.7Å; V444-L448 HydrophobicContact CG1-CG 4.19Å; V444-L448 WeakPolarHBondContact O-CB 3.31Å; V444-L448 VanDerWaalsContact O-CG 3.23Å; V444-L448 WeakPolarHBondContact O-CG 3.5Å; V444-L448 PolarHBondContact O-N 2.82Å
445	Y	77.2	Confident	68.3	Low	125 Å²	125	109.8 Å²	109.8	49%	0.49	56%	0.562	S	S	.	*	H	α-helix	trans	-59.6	-47.4	173.1	177.4	-92.3	0	0	0	111.1	F441 I442 L448 H449	F441-Y445 WeakPolarHBondContact O-CB 3.31Å; F441-Y445 PolarHBondContact O-N 3.48Å; I442-Y445 PolarHBondContact O-N 3.12Å; Y445-L448 PolarHBondContact O-N 2.91Å; Y445-H449 AromaticContact CD2-CE1 3.86Å; Y445-H449 AromaticContact CD2-ND1 3.82Å; Y445-H449 AromaticContact CE1-ND1 3.92Å; Y445-H449 AromaticContact CE2-CE1 3.23Å; Y445-H449 WeakPolarHBondContact CE2-CE1 3.29Å; Y445-H449 AromaticContact CE2-ND1 3.56Å; Y445-H449 AromaticContact CZ-CE1 3.43Å; Y445-H449 VanDerWaalsContact CZ-CE1 3.43Å; Y445-H449 AromaticContact CZ-ND1 3.6Å; Y445-H449 AromaticContact CZ-NE2 4Å; Y445-H449 WeakPolarHBondContact O-CB 3.44Å; Y445-H449 PolarHBondContact O-N 3.09Å; Y445-H449 PolarHBondContact O-ND1 3.32Å
446	N	72.5	Confident	66.1	Low	92 Å²	92	114.4 Å²	114.4	49%	0.492	58%	0.582	S	S	.	*	H	α-helix	trans	-63.6	-41.8	174.5	-69.8	-13.2	0	0	0	111.5	I442 S450	I442-N446 VanDerWaalsContact O-CB 3.29Å; I442-N446 WeakPolarHBondContact O-CB 3.4Å; I442-N446 PolarHBondContact O-N 3.45Å; I442-N446 PolarHBondContact O-ND2 3.48Å; N446-S450 WeakPolarHBondContact O-CB 3.34Å; N446-S450 PolarHBondContact O-N 2.98Å; N446-S450 PolarHBondContact O-OG 2.97Å
447	Y	73.3	Confident	64.2	Low	121 Å²	121	114.2 Å²	114.2	48%	0.475	58%	0.579	S	S	.	*	H	α-helix	trans	-64	-43.2	177.7	-175.4	-102	0	0	0	112.1	T443 V444 S450 R451	T443-Y447 WeakPolarHBondContact O-CB 3.32Å; T443-Y447 PolarHBondContact O-N 3.28Å; V444-Y447 PolarHBondContact O-N 3.42Å; Y447-S450 WeakPolarHBondContact CA-OG 3.1Å; Y447-S450 PolarHBondContact O-N 3.08Å; Y447-S450 PolarHBondContact O-OG 2.89Å; Y447-R451 PolarHBondContact O-N 3.49Å; Y447-R451 VanDerWaalsContact OH-CZ 3.27Å; Y447-R451 PolarHBondContact OH-NH2 2.91Å
448	L	68.7	Low	62.4	Low	106 Å²	106	114.7 Å²	114.7	56%	0.555	58%	0.581	S	S	*	*	H	α-helix	trans	-67.7	-45.4	177.9	-70.5	169.9	0	0	0	111.8	V444 Y445 S450 R451	V444-L448 HydrophobicContact CG1-CD1 3.7Å; V444-L448 HydrophobicContact CG1-CG 4.19Å; V444-L448 WeakPolarHBondContact O-CB 3.31Å; V444-L448 VanDerWaalsContact O-CG 3.23Å; V444-L448 WeakPolarHBondContact O-CG 3.5Å; V444-L448 PolarHBondContact O-N 2.82Å; Y445-L448 PolarHBondContact O-N 2.91Å; L448-S450 VanDerWaalsContact C-N 3.31Å; L448-S450 PolarHBondContact O-N 2.72Å; L448-R451 WeakPolarHBondContact O-CB 3.47Å; L448-R451 PolarHBondContact O-N 3.42Å
449	H	59.8	Low	61.1	Low	111 Å²	111	115.7 Å²	115.7	51%	0.514	58%	0.582	S	S	.	*	H	α-helix	trans	-67.9	-28.5	173.9	-79.6	78.2	0	0	0	112.7	Y445 R451 T452	Y445-H449 AromaticContact CD2-CE1 3.86Å; Y445-H449 AromaticContact CD2-ND1 3.82Å; Y445-H449 AromaticContact CE1-ND1 3.92Å; Y445-H449 AromaticContact CE2-CE1 3.23Å; Y445-H449 WeakPolarHBondContact CE2-CE1 3.29Å; Y445-H449 AromaticContact CE2-ND1 3.56Å; Y445-H449 AromaticContact CZ-CE1 3.43Å; Y445-H449 VanDerWaalsContact CZ-CE1 3.43Å; Y445-H449 AromaticContact CZ-ND1 3.6Å; Y445-H449 AromaticContact CZ-NE2 4Å; Y445-H449 WeakPolarHBondContact O-CB 3.44Å; Y445-H449 PolarHBondContact O-N 3.09Å; Y445-H449 PolarHBondContact O-ND1 3.32Å; H449-R451 PolarHBondContact O-N 3.44Å; H449-T452 PolarHBondContact O-OG1 3.39Å; H449-T452 VanDerWaalsContact O-OG1 3.05Å
450	S	49.6	Very low	59.5	Low	87 Å²	87	108 Å²	108	61%	0.608	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.7	-3.9	171.1	75.2	0	0	0	0	114	N446 Y447 L448	N446-S450 WeakPolarHBondContact O-CB 3.34Å; N446-S450 PolarHBondContact O-N 2.98Å; N446-S450 PolarHBondContact O-OG 2.97Å; Y447-S450 WeakPolarHBondContact CA-OG 3.1Å; Y447-S450 PolarHBondContact O-N 3.08Å; Y447-S450 PolarHBondContact O-OG 2.89Å; L448-S450 VanDerWaalsContact C-N 3.31Å; L448-S450 PolarHBondContact O-N 2.72Å
451	R	42.7	Very low	58	Low	172 Å²	172	110.6 Å²	110.6	65%	0.649	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.2	-3.2	-179	-109.8	-178.6	172.8	-169.2	-1.7	115	Y447 L448 H449 S453	Y447-R451 PolarHBondContact O-N 3.49Å; Y447-R451 VanDerWaalsContact OH-CZ 3.27Å; Y447-R451 PolarHBondContact OH-NH2 2.91Å; L448-R451 WeakPolarHBondContact O-CB 3.47Å; L448-R451 PolarHBondContact O-N 3.42Å; H449-R451 PolarHBondContact O-N 3.44Å; R451-S453 PolarHBondContact O-N 2.84Å
452	T	42.4	Very low	56.2	Low	93 Å²	93	109 Å²	109	57%	0.571	57%	0.568	S	S	*	*	S	Bend	trans	-81.9	85.7	166.1	47.4	0	0	0	0	109.6	H449 Y454	H449-T452 PolarHBondContact O-OG1 3.39Å; H449-T452 VanDerWaalsContact O-OG1 3.05Å; T452-Y454 PolarHBondContact O-N 2.84Å
453	S	35.3	Very low	55.1	Low	120 Å²	120	106.9 Å²	106.9	84%	0.839	56%	0.562	S	S	*	*			trans	-67.9	83.6	-177.8	-61.7	0	0	0	0	113.3	R451	R451-S453 PolarHBondContact O-N 2.84Å
454	Y	37.6	Very low	54.1	Low	190 Å²	190	106.3 Å²	106.3	75%	0.745	57%	0.568	S	S	*	*			trans	-98.1	119.5	157.5	-76.5	-89.3	0	0	0	109.1	T452	T452-Y454 PolarHBondContact O-N 2.84Å
455	S	36.5	Very low	53	Low	103 Å²	103	106.8 Å²	106.8	72%	0.72	57%	0.568	S	S	*	*			trans	-73.9	126.9	-178.7	54.4	0	0	0	0	111.8	Q457	S455-Q457 VanDerWaalsContact C-N 3.28Å; S455-Q457 PolarHBondContact O-N 3.33Å; S455-Q457 VanDerWaalsContact O-N 3.1Å
456	N	40.9	Very low	52	Low	167 Å²	167	102.9 Å²	102.9	89%	0.893	56%	0.558	S	S	*	*	S	Bend	trans	58.4	21.8	161.6	-57.8	-6.5	0	0	0	117.5
457	Q	48.3	Very low	51	Low	99 Å²	99	102.5 Å²	102.5	46%	0.463	56%	0.556	S	S	.	*	P	Polyproline II helix	trans	-89.5	130.6	166	-76	-174.7	-53.8	0	0	111.1	S455	S455-Q457 VanDerWaalsContact C-N 3.28Å; S455-Q457 PolarHBondContact O-N 3.33Å; S455-Q457 VanDerWaalsContact O-N 3.1Å
458	I	51.3	Low	50.1	Low	120 Å²	120	101 Å²	101	62%	0.615	56%	0.556	S	S	*	*	P	Polyproline II helix	trans	-79	136.4	175.5	-55.1	175.2	0	0	0	108.2	L467	I458-L467 HydrophobicContact CB-CD1 4.23Å; I458-L467 HydrophobicContact CB-CD2 4.26Å; I458-L467 HydrophobicContact CG2-CD1 3.98Å; I458-L467 HydrophobicContact CG2-CD2 4.28Å; I458-L467 WeakPolarHBondContact O-CD1 3.42Å; I458-L467 PolarHBondContact O-N 2.82Å; I458-L467 VanDerWaalsContact O-N 3.11Å
459	L	56.1	Low	49.1	Very low	105 Å²	105	103.1 Å²	103.1	55%	0.55	56%	0.563	S	S	.	*	B	Isolated β-bridge	trans	-96.5	143.3	174.9	-84.6	67.9	0	0	0	111.2	P461 G464 L465	L459-P461 VanDerWaalsContact O-CD 3.31Å; L459-P461 WeakPolarHBondContact O-CD 3.27Å; L459-G464 WeakPolarHBondContact CD2-O 3.41Å; L459-L465 WeakPolarHBondContact CA-O 3.25Å
460	C	52.5	Low	48.8	Very low	2 Å²	2	105.4 Å²	105.4	1%	0.014	58%	0.578	C	S	.	*			trans	-69.9	111	-179.9	-162.8	0	0	0	0	110	I462 S463 G464 L465 L467 C471	C460-I462 PolarHBondContact O-N 3.05Å; C460-S463 WeakPolarHBondContact CB-OG 3.22Å; C460-S463 PolarHBondContact O-N 2.86Å; C460-S463 VanDerWaalsContact O-N 3.16Å; C460-S463 PolarHBondContact SG-OG 3.04Å; C460-G464 PolarHBondContact O-N 2.87Å; C460-L465 WeakPolarHBondContact CB-O 3.49Å; C460-L465 PolarHBondContact N-O 3.26Å; C460-L467 HydrophobicContact CB-CD1 4.26Å; C460-C471 HydrophobicContact CB-CB 3.53Å; C460-C471 WeakPolarHBondContact CB-SG 3.08Å; C460-C471 WeakPolarHBondContact SG-CB 3.5Å; C460-C471 CovalentContact SG-SG 2.05Å; C460-C471 PolarHBondContact SG-SG 3.35Å
461	P	52.2	Low	49.1	Very low	116 Å²	116	101.7 Å²	101.7	75%	0.753	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.7	-15.4	-171.2	-25.3	35.4	0	0	0	115.2	L459	L459-P461 VanDerWaalsContact O-CD 3.31Å; L459-P461 WeakPolarHBondContact O-CD 3.27Å
462	I	45.2	Very low	49.6	Very low	122 Å²	122	94.8 Å²	94.8	63%	0.626	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.3	-25	-175.8	-62.7	171.9	0	0	0	112	C460 L474	C460-I462 PolarHBondContact O-N 3.05Å; I462-L474 HydrophobicContact CD1-CD2 4.08Å
463	S	58.3	Low	49.8	Very low	53 Å²	53	95.6 Å²	95.6	37%	0.371	54%	0.539	S	S	.	.	T	Hydrogen-bonded Turn	trans	-133	-8.4	-173	63.3	0	0	0	0	115.7	C460 L465 C471	C460-S463 WeakPolarHBondContact CB-OG 3.22Å; C460-S463 PolarHBondContact O-N 2.86Å; C460-S463 VanDerWaalsContact O-N 3.16Å; C460-S463 PolarHBondContact SG-OG 3.04Å; S463-L465 PolarHBondContact O-N 3.35Å; S463-C471 VanDerWaalsContact CB-O 3.25Å; S463-C471 WeakPolarHBondContact CB-O 3.22Å; S463-C471 PolarHBondContact OG-O 3.03Å
464	G	56.6	Low	50.2	Low	51 Å²	51	93.2 Å²	93.2	53%	0.526	52%	0.516	S	S	.	.	S	Bend	trans	71.4	0.5	-179.6	0	0	0	0	0	115.3	L459 C460	L459-G464 WeakPolarHBondContact CD2-O 3.41Å; C460-G464 PolarHBondContact O-N 2.87Å
465	L	56.8	Low	50.8	Low	87 Å²	87	86.8 Å²	86.8	46%	0.455	49%	0.493	S	S	.	.			trans	-80	157.1	176.4	-69.1	168.5	0	0	0	111.4	L459 C460 S463 C471	L459-L465 WeakPolarHBondContact CA-O 3.25Å; C460-L465 WeakPolarHBondContact CB-O 3.49Å; C460-L465 PolarHBondContact N-O 3.26Å; S463-L465 PolarHBondContact O-N 3.35Å; L465-C471 HydrophobicContact CB-CB 3.95Å
466	P	55.1	Low	51	Low	44 Å²	44	90.5 Å²	90.5	29%	0.286	49%	0.492	S	S	.	.	B	Isolated β-bridge	trans	-60.4	162.7	168.6	27.2	-35.6	0	0	0	112.1	D468 C471	P466-D468 VanDerWaalsContact CG-OD2 3.31Å; P466-D468 WeakPolarHBondContact CG-OD2 3.39Å; P466-D468 PolarHBondContact O-N 3.41Å; P466-C471 VanDerWaalsContact O-CB 3.25Å; P466-C471 WeakPolarHBondContact O-CB 3.46Å
467	L	52.3	Low	50.9	Low	84 Å²	84	92.6 Å²	92.6	44%	0.44	49%	0.488	S	S	.	.	S	Bend	trans	-74.1	46	-179.5	-112.1	74.2	0	0	0	114.6	I458 C460	I458-L467 HydrophobicContact CB-CD1 4.23Å; I458-L467 HydrophobicContact CB-CD2 4.26Å; I458-L467 HydrophobicContact CG2-CD1 3.98Å; I458-L467 HydrophobicContact CG2-CD2 4.28Å; I458-L467 WeakPolarHBondContact O-CD1 3.42Å; I458-L467 PolarHBondContact O-N 2.82Å; I458-L467 VanDerWaalsContact O-N 3.11Å; C460-L467 HydrophobicContact CB-CD1 4.26Å
468	D	53	Low	50.6	Low	90 Å²	90	93 Å²	93	48%	0.481	49%	0.49	S	S	.	.	S	Bend	trans	-95.2	169.1	172.2	-57	-51.2	0	0	0	111.2	P466 L470 C471	P466-D468 VanDerWaalsContact CG-OD2 3.31Å; P466-D468 WeakPolarHBondContact CG-OD2 3.39Å; P466-D468 PolarHBondContact O-N 3.41Å; D468-L470 PolarHBondContact O-N 3.46Å; D468-C471 PolarHBondContact O-N 2.79Å; D468-C471 VanDerWaalsContact O-N 3.16Å
469	H	49	Very low	49.9	Very low	150 Å²	150	95.3 Å²	95.3	69%	0.694	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	2.8	-172.9	-60.2	-69.6	0	0	0	117.3
470	L	54	Low	48.9	Very low	159 Å²	159	99 Å²	99	83%	0.832	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.8	-5.8	-175.2	-74.3	149.1	0	0	0	113.9	D468	D468-L470 PolarHBondContact O-N 3.46Å
471	C	55.7	Low	48.1	Very low	8 Å²	8	108.2 Å²	108.2	5%	0.054	56%	0.555	C	S	.	*	S	Bend	trans	-67.8	-43	-167	101.4	0	0	0	0	114.1	C460 S463 L465 P466 D468 H475	C460-C471 HydrophobicContact CB-CB 3.53Å; C460-C471 WeakPolarHBondContact CB-SG 3.08Å; C460-C471 WeakPolarHBondContact SG-CB 3.5Å; C460-C471 CovalentContact SG-SG 2.05Å; C460-C471 PolarHBondContact SG-SG 3.35Å; S463-C471 VanDerWaalsContact CB-O 3.25Å; S463-C471 WeakPolarHBondContact CB-O 3.22Å; S463-C471 PolarHBondContact OG-O 3.03Å; L465-C471 HydrophobicContact CB-CB 3.95Å; P466-C471 VanDerWaalsContact O-CB 3.25Å; P466-C471 WeakPolarHBondContact O-CB 3.46Å; D468-C471 PolarHBondContact O-N 2.79Å; D468-C471 VanDerWaalsContact O-N 3.16Å; C471-H475 PolarHBondContact SG-ND1 3.39Å
472	C	51.9	Low	47.1	Very low	28 Å²	28	106 Å²	106	19%	0.189	55%	0.553	C	S	.	*			trans	-167.8	163.1	170.8	67.6	0	0	0	0	111.4	L474 H475 Y476	C472-L474 PolarHBondContact O-N 3.49Å; C472-L474 VanDerWaalsContact O-N 3.07Å; C472-L474 VanDerWaalsContact SG-CB 3.56Å; C472-H475 PolarHBondContact O-N 3.45Å; C472-Y476 PolarHBondContact O-N 2.86Å
473	S	47.6	Very low	46.4	Very low	109 Å²	109	107.8 Å²	107.8	76%	0.762	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.7	-5.8	176.1	57.2	0	0	0	0	115
474	L	43.1	Very low	45.1	Very low	70 Å²	70	114.2 Å²	114.2	37%	0.366	58%	0.576	S	S	.	*	T	Hydrogen-bonded Turn	trans	-80	-45.2	175.2	-153.2	77.2	0	0	0	111.1	I462 C472 M497	I462-L474 HydrophobicContact CD1-CD2 4.08Å; C472-L474 PolarHBondContact O-N 3.49Å; C472-L474 VanDerWaalsContact O-N 3.07Å; C472-L474 VanDerWaalsContact SG-CB 3.56Å; L474-M497 HydrophobicContact CD1-CE 4.05Å; L474-M497 HydrophobicContact CD1-SD 4.12Å; L474-M497 HydrophobicContact CD2-SD 4.48Å
475	H	49.8	Very low	43.8	Very low	55 Å²	55	119.7 Å²	119.7	26%	0.255	59%	0.588	S	S	.	*	G	3₁₀ helix	trans	-78.9	-26.6	-178.2	-63.3	173.5	0	0	0	112.7	C471 C472 R477	C471-H475 PolarHBondContact SG-ND1 3.39Å; C472-H475 PolarHBondContact O-N 3.45Å; H475-R477 PolarHBondContact O-N 3.07Å
476	Y	40.5	Very low	42.4	Very low	181 Å²	181	116.6 Å²	116.6	71%	0.71	58%	0.577	S	S	*	*	G	3₁₀ helix	trans	-61.8	-12	173.9	-173.3	-98	0	0	0	114.1	C472	C472-Y476 PolarHBondContact O-N 2.86Å
477	R	40.8	Very low	41.2	Very low	212 Å²	212	120.3 Å²	120.3	80%	0.8	61%	0.605	S	S	*	*	G	3₁₀ helix	trans	-110.7	3.3	-170.8	-153.7	174.3	178.7	-175.2	-4.4	114.8	H475	H475-R477 PolarHBondContact O-N 3.07Å
478	Q	40.7	Very low	40.2	Very low	107 Å²	107	119.7 Å²	119.7	50%	0.5	60%	0.599	S	S	.	*	S	Bend	trans	-96.6	-8.1	-165.1	-162.7	161.8	3.8	0	0	115.6	N499	Q478-N499 PolarHBondContact NE2-OD1 2.83Å
479	E	36.1	Very low	39.4	Very low	168 Å²	168	123.4 Å²	123.4	79%	0.785	61%	0.607	S	S	*	*	S	Bend	trans	-92.8	-9.3	-169.7	-68.6	-172.6	119.9	0	0	116.8
480	Q	35.7	Very low	38.5	Very low	182 Å²	182	124.6 Å²	124.6	85%	0.85	61%	0.605	S	S	*	*	S	Bend	trans	-103.7	-29	-159.9	-70.9	-159.3	-26	0	0	119.4
481	E	35.5	Very low	37.4	Very low	196 Å²	196	121 Å²	121	92%	0.916	59%	0.592	S	S	*	*			trans	-134	140.8	-163	-64.9	-176.3	144.2	0	0	114.8
482	G	31.1	Very low	36.6	Very low	69 Å²	69	122.1 Å²	122.1	71%	0.711	60%	0.597	S	S	*	*			trans	-167.5	153.9	177.1	0	0	0	0	0	115.8
483	Q	30.9	Very low	35.6	Very low	161 Å²	161	122.6 Å²	122.6	75%	0.752	60%	0.595	S	S	*	*			trans	80.3	148.8	177.3	-56.9	-167.2	-27.8	0	0	119.4
484	Y	30.4	Very low	34.8	Very low	187 Å²	187	121.6 Å²	121.6	73%	0.733	59%	0.588	S	S	*	*			trans	97.1	162.2	166.7	-57	-69.4	0	0	0	119.4
485	Q	28.9	Very low	34.3	Very low	166 Å²	166	123.1 Å²	123.1	78%	0.776	60%	0.602	S	S	*	*			trans	-144.3	134.2	-154.5	-68.1	-177.9	-31.2	0	0	113.8	L529	Q485-L529 HydrophobicContact CB-CD1 4.49Å; Q485-L529 HydrophobicContact CB-CD2 4Å; Q485-L529 HydrophobicContact CG-CD1 4.01Å; Q485-L529 HydrophobicContact CG-CD2 4.23Å
486	G	29.4	Very low	33.4	Very low	22 Å²	22	123.7 Å²	123.7	23%	0.227	62%	0.616	C	S	.	*			trans	-164.8	163.6	168.3	0	0	0	0	0	113.5	L529 E530	G486-L529 WeakPolarHBondContact O-CD2 3.43Å; G486-E530 VanDerWaalsContact CA-OE1 3.29Å; G486-E530 WeakPolarHBondContact CA-OE1 3.48Å; G486-E530 WeakPolarHBondContact CA-OE2 3.34Å; G486-E530 PolarHBondContact N-OE2 3.28Å
487	S	29.1	Very low	32.9	Very low	123 Å²	123	121.1 Å²	121.1	86%	0.86	61%	0.612	S	S	*	*			trans	-94.6	111.9	-163.8	61.4	0	0	0	0	114.1
488	Q	31.9	Very low	32.6	Very low	71 Å²	71	113.4 Å²	113.4	33%	0.332	59%	0.589	S	S	.	*			trans	-113.2	166.6	-173.7	-87.4	-168.8	-23.5	0	0	116.7	E530 E531	Q488-E530 HydrophobicContact CG-CG 3.97Å; Q488-E531 PolarHBondContact NE2-O 2.84Å
489	W	35	Very low	32.3	Very low	167 Å²	167	113.3 Å²	113.3	63%	0.633	59%	0.592	S	S	*	*	P	Polyproline II helix	trans	-96.3	136.4	166.1	-72.1	71.2	0	0	0	109.7	K549	W489-K549 HydrophobicContact CD2-CD 4.16Å; W489-K549 HydrophobicContact CE3-CB 4.17Å; W489-K549 HydrophobicContact CE3-CD 3.71Å; W489-K549 HydrophobicContact CE3-CG 4.45Å; W489-K549 HydrophobicContact CH2-CD 3.54Å; W489-K549 HydrophobicContact CZ2-CD 3.99Å; W489-K549 HydrophobicContact CZ3-CB 3.88Å; W489-K549 HydrophobicContact CZ3-CD 3.38Å; W489-K549 HydrophobicContact CZ3-CG 4.17Å
490	W	31	Very low	32.3	Very low	175 Å²	175	110.8 Å²	110.8	66%	0.663	58%	0.584	S	S	*	*	P	Polyproline II helix	trans	-90.5	128.9	-171.3	-55.7	98.2	0	0	0	113.3	M528	W490-M528 WeakPolarHBondContact CH2-O 3.29Å
491	P	31.3	Very low	32.3	Very low	85 Å²	85	106.4 Å²	106.4	55%	0.552	57%	0.57	S	S	*	*	P	Polyproline II helix	trans	-74.3	158.9	164.5	32.4	-33.8	0	0	0	111	Y493	P491-Y493 PolarHBondContact O-N 3.39Å
492	I	37	Very low	32.4	Very low	31 Å²	31	101.3 Å²	101.3	16%	0.159	56%	0.555	C	S	.	*	T	Hydrogen-bonded Turn	trans	-74.1	-8.1	-169.6	-56.5	164.2	0	0	0	113.2
493	Y	32	Very low	32.6	Very low	38 Å²	38	104.1 Å²	104.1	15%	0.149	55%	0.553	C	S	.	*	T	Hydrogen-bonded Turn	trans	-133.5	24.7	-150.4	-61	-68.3	0	0	0	117.7	P491 P495 G540 P541 L542 W989	P491-Y493 PolarHBondContact O-N 3.39Å; Y493-P495 VanDerWaalsContact O-CD 3.3Å; Y493-P495 WeakPolarHBondContact O-CD 3.31Å; Y493-G540 WeakPolarHBondContact CD2-O 3.19Å; Y493-G540 WeakPolarHBondContact CE2-O 3.36Å; Y493-G540 VanDerWaalsContact CG-CA 3.41Å; Y493-P541 HydrophobicContact CD1-CG 4.46Å; Y493-P541 HydrophobicContact CE1-CG 4.26Å; Y493-L542 VanDerWaalsContact OH-CB 3.27Å; Y493-L542 WeakPolarHBondContact OH-CB 3.22Å; Y493-L542 WeakPolarHBondContact OH-CD1 3.47Å; Y493-L542 VanDerWaalsContact OH-CG 3.26Å; Y493-L542 WeakPolarHBondContact OH-CG 3.45Å; Y493-W989 HydrophobicContact CE1-CZ2 4.15Å
494	S	31.5	Very low	32.8	Very low	87 Å²	87	103.4 Å²	103.4	61%	0.608	55%	0.553	S	S	*	*			trans	-95.1	108.9	171.1	42.5	0	0	0	0	111.6	A496	S494-A496 PolarHBondContact O-N 3.2Å
495	P	32.7	Very low	33.1	Very low	102 Å²	102	99.7 Å²	99.7	66%	0.662	55%	0.55	S	S	*	*			trans	-74.6	109.7	169	29.7	-32	0	0	0	109.6	Y493 M497	Y493-P495 VanDerWaalsContact O-CD 3.3Å; Y493-P495 WeakPolarHBondContact O-CD 3.31Å; P495-M497 PolarHBondContact O-N 2.84Å; P495-M497 VanDerWaalsContact O-N 3.14Å
496	A	30.1	Very low	33.4	Very low	68 Å²	68	98.4 Å²	98.4	56%	0.562	55%	0.549	S	S	*	.			trans	-71.1	104.8	177.8	0	0	0	0	0	111.3	S494 P526	S494-A496 PolarHBondContact O-N 3.2Å; A496-P526 HydrophobicContact CB-CG 4.26Å
497	M	30.8	Very low	33.7	Very low	126 Å²	126	104.2 Å²	104.2	62%	0.621	58%	0.575	S	S	*	*			trans	-76.4	126.1	164.3	-75.8	-104.7	-170	0	0	109.3	L474 P495	L474-M497 HydrophobicContact CD1-CE 4.05Å; L474-M497 HydrophobicContact CD1-SD 4.12Å; L474-M497 HydrophobicContact CD2-SD 4.48Å; P495-M497 PolarHBondContact O-N 2.84Å; P495-M497 VanDerWaalsContact O-N 3.14Å
498	P	34.6	Very low	33.9	Very low	50 Å²	50	102.9 Å²	102.9	33%	0.325	57%	0.571	S	S	.	*			trans	-73.3	144.5	175.3	29.9	-34	0	0	0	111.6	L500	P498-L500 PolarHBondContact O-N 3.04Å
499	N	33.8	Very low	33.8	Very low	105 Å²	105	107.4 Å²	107.4	56%	0.561	60%	0.598	S	S	*	*			trans	-76	109.9	177.4	-173.6	-6.7	0	0	0	110.4	Q478 T501	Q478-N499 PolarHBondContact NE2-OD1 2.83Å; N499-T501 VanDerWaalsContact C-N 3.26Å; N499-T501 PolarHBondContact O-N 2.88Å; N499-T501 PolarHBondContact OD1-OG1 3.3Å
500	L	34.7	Very low	33.8	Very low	116 Å²	116	105.2 Å²	105.2	61%	0.607	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.6	1.1	-169.3	-84.9	162.7	0	0	0	115.8	P498	P498-L500 PolarHBondContact O-N 3.04Å
501	T	36.1	Very low	33.8	Very low	90 Å²	90	102.6 Å²	102.6	55%	0.552	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82	-16.9	-166.8	48.2	0	0	0	0	116	N499	N499-T501 VanDerWaalsContact C-N 3.26Å; N499-T501 PolarHBondContact O-N 2.88Å; N499-T501 PolarHBondContact OD1-OG1 3.3Å
502	S	38.1	Very low	33.7	Very low	88 Å²	88	106 Å²	106	62%	0.615	63%	0.625	S	S	*	*	S	Bend	trans	-100.7	-8.3	-166.5	59.2	0	0	0	0	116.9
503	I	35.1	Very low	33.5	Very low	128 Å²	128	114.1 Å²	114.1	66%	0.656	66%	0.659	S	S	*	*	S	Bend	trans	-106.9	-21.2	-173.2	-62.8	178.7	0	0	0	112.8	T505	I503-T505 VanDerWaalsContact C-N 3.31Å; I503-T505 PolarHBondContact O-N 2.82Å
504	L	34.6	Very low	33.3	Very low	146 Å²	146	117.9 Å²	117.9	76%	0.764	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.6	-8.5	-173.9	-82.2	160.1	0	0	0	115.2
505	T	37.2	Very low	33.2	Very low	110 Å²	110	119.4 Å²	119.4	68%	0.675	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.6	-15.3	-175.5	47.1	0	0	0	0	115.1	I503	I503-T505 VanDerWaalsContact C-N 3.31Å; I503-T505 PolarHBondContact O-N 2.82Å
506	N	35.4	Very low	33.1	Very low	139 Å²	139	119.4 Å²	119.4	74%	0.743	68%	0.679	S	S	*	*	S	Bend	trans	-113.1	3.2	-167.4	-85.7	-20.6	0	0	0	116.3
507	N	35.6	Very low	33.1	Very low	144 Å²	144	124 Å²	124	77%	0.77	69%	0.693	S	S	*	*			trans	-136.3	41.5	-176.7	-97	-44.2	0	0	0	114.5	N509	N507-N509 PolarHBondContact O-N 3.39Å
508	A	32.8	Very low	33.3	Very low	94 Å²	94	127.9 Å²	127.9	78%	0.777	70%	0.701	S	S	*	*			trans	-74.1	59.3	172.7	0	0	0	0	0	112.8
509	N	31.5	Very low	33.5	Very low	167 Å²	167	129.2 Å²	129.2	89%	0.893	71%	0.706	S	S	*	*			trans	-165.9	53.9	172.4	-101.2	-34.2	0	0	0	113.7	N507	N507-N509 PolarHBondContact O-N 3.39Å
510	S	33.2	Very low	33.5	Very low	120 Å²	120	128.3 Å²	128.3	84%	0.839	70%	0.701	S	S	*	*			trans	-151.2	124.5	167	-162.1	0	0	0	0	111.8
511	T	32.2	Very low	33.6	Very low	121 Å²	121	126.6 Å²	126.6	74%	0.742	70%	0.696	S	S	*	*			trans	-101.4	144.7	-175.5	47.6	0	0	0	0	113
512	N	29.1	Very low	33.5	Very low	157 Å²	157	127.6 Å²	127.6	84%	0.84	70%	0.698	S	S	*	*			trans	52.7	78.1	152.2	-57.6	-19.3	0	0	0	117.6
513	K	32	Very low	33.1	Very low	201 Å²	201	130.2 Å²	130.2	87%	0.874	70%	0.699	S	S	*	*			trans	-140.9	132.6	155	-108.7	166.2	-172.9	167.4	0	111.8
514	C	29.1	Very low	33	Very low	116 Å²	116	128.7 Å²	128.7	78%	0.784	70%	0.695	S	S	*	*			trans	-61.5	134.7	176.1	-177.2	0	0	0	0	110.5	Q516	C514-Q516 PolarHBondContact O-N 2.96Å
515	M	29.4	Very low	32.6	Very low	120 Å²	120	127.1 Å²	127.1	59%	0.591	69%	0.692	S	S	*	*			trans	-71.9	98.9	-175.7	-171.2	177.1	179.7	0	0	110.5	N519 L520	M515-N519 WeakPolarHBondContact CE-O 3.42Å; M515-N519 HydrophobicContact CG-CB 4.17Å; M515-L520 HydrophobicContact CE-CD1 4.49Å; M515-L520 HydrophobicContact CE-CG 4.23Å
516	Q	31	Very low	32.2	Very low	102 Å²	102	124.3 Å²	124.3	48%	0.477	68%	0.675	S	S	.	*			trans	-73.4	159	173	-65.3	-175.8	-29.5	0	0	110.3	C514 R518 N519	C514-Q516 PolarHBondContact O-N 2.96Å; Q516-R518 HydrophobicContact CB-CG 4.05Å; Q516-R518 PolarHBondContact O-N 3.3Å; Q516-R518 VanDerWaalsContact OE1-CZ 3.32Å; Q516-N519 WeakPolarHBondContact O-CA 3.01Å; Q516-N519 WeakPolarHBondContact O-CB 3.01Å; Q516-N519 PolarHBondContact O-N 2.87Å
517	L	29.9	Very low	31.9	Very low	163 Å²	163	125.3 Å²	125.3	85%	0.853	68%	0.681	S	S	*	*	G	3₁₀ helix	trans	-60.1	-20.1	-176.7	-151.1	76.8	0	0	0	114.1	N519 L520	L517-N519 VanDerWaalsContact C-N 3.31Å; L517-L520 HydrophobicContact CD1-CD1 4.31Å; L517-L520 HydrophobicContact CG-CD1 4.48Å; L517-L520 VanDerWaalsContact O-CD1 3.32Å; L517-L520 WeakPolarHBondContact O-CD1 3.48Å
518	R	33.6	Very low	31.6	Very low	208 Å²	208	125 Å²	125	79%	0.785	68%	0.676	S	S	*	*	G	3₁₀ helix	trans	-83.5	2.9	172.6	60.3	166.1	179.7	150.7	-0.1	114.8	Q516	Q516-R518 HydrophobicContact CB-CG 4.05Å; Q516-R518 PolarHBondContact O-N 3.3Å; Q516-R518 VanDerWaalsContact OE1-CZ 3.32Å
519	N	38.9	Very low	31.4	Very low	79 Å²	79	124.3 Å²	124.3	42%	0.422	66%	0.659	S	S	.	*	G	3₁₀ helix	trans	-113	16	179.3	-61.8	13.1	0	0	0	111.8	M515 Q516 L517	M515-N519 WeakPolarHBondContact CE-O 3.42Å; M515-N519 HydrophobicContact CG-CB 4.17Å; Q516-N519 WeakPolarHBondContact O-CA 3.01Å; Q516-N519 WeakPolarHBondContact O-CB 3.01Å; Q516-N519 PolarHBondContact O-N 2.87Å; L517-N519 VanDerWaalsContact C-N 3.31Å
520	L	34.5	Very low	31.2	Very low	86 Å²	86	121.5 Å²	121.5	45%	0.45	64%	0.641	S	S	.	*	S	Bend	trans	-64.2	138.5	169.1	-89.2	79.7	0	0	0	109.1	M515 L517	M515-L520 HydrophobicContact CE-CD1 4.49Å; M515-L520 HydrophobicContact CE-CG 4.23Å; L517-L520 HydrophobicContact CD1-CD1 4.31Å; L517-L520 HydrophobicContact CG-CD1 4.48Å; L517-L520 VanDerWaalsContact O-CD1 3.32Å; L517-L520 WeakPolarHBondContact O-CD1 3.48Å
521	P	37.1	Very low	31.1	Very low	79 Å²	79	123.1 Å²	123.1	51%	0.513	64%	0.635	S	S	.	*	P	Polyproline II helix	trans	-64.3	140.2	177.2	27.8	-34.5	0	0	0	110.6	F523	P521-F523 PolarHBondContact O-N 2.88Å
522	N	33.6	Very low	30.9	Very low	111 Å²	111	121.2 Å²	121.2	59%	0.594	62%	0.62	S	S	*	*	P	Polyproline II helix	trans	-54.8	130.9	-178.3	-62.2	41.3	0	0	0	110.9	T524 D770	N522-T524 VanDerWaalsContact C-N 3.32Å; N522-T524 PolarHBondContact O-N 3.47Å; N522-D770 PolarHBondContact ND2-OD2 3.46Å
523	F	28.7	Very low	31.2	Very low	143 Å²	143	119.1 Å²	119.1	63%	0.627	61%	0.613	S	S	*	*			trans	-70.5	84	178.1	-76.2	-90.2	0	0	0	111.1	P521 V525	P521-F523 PolarHBondContact O-N 2.88Å; F523-V525 PolarHBondContact O-N 3.47Å
524	T	32.7	Very low	31.1	Very low	96 Å²	96	116.3 Å²	116.3	59%	0.589	61%	0.607	S	S	*	*	P	Polyproline II helix	trans	-70.7	122	169.7	38.5	0	0	0	0	110.3	N522 P526	N522-T524 VanDerWaalsContact C-N 3.32Å; N522-T524 PolarHBondContact O-N 3.47Å; T524-P526 VanDerWaalsContact O-CD 3.26Å; T524-P526 WeakPolarHBondContact O-CD 3.47Å
525	V	27.4	Very low	31.2	Very low	114 Å²	114	118.9 Å²	118.9	69%	0.691	61%	0.605	S	S	*	*	P	Polyproline II helix	trans	-66.5	119.9	-178.2	179.3	0	0	0	0	110.2	F523	F523-V525 PolarHBondContact O-N 3.47Å
526	P	29	Very low	31.1	Very low	50 Å²	50	116.3 Å²	116.3	33%	0.325	60%	0.599	S	S	.	*	P	Polyproline II helix	trans	-74.6	127	173.5	-15.8	32.3	0	0	0	110.8	A496 T524 M528	A496-P526 HydrophobicContact CB-CG 4.26Å; T524-P526 VanDerWaalsContact O-CD 3.26Å; T524-P526 WeakPolarHBondContact O-CD 3.47Å; P526-M528 HydrophobicContact CB-CG 4.32Å; P526-M528 PolarHBondContact O-N 2.9Å
527	N	27.8	Very low	30.8	Very low	160 Å²	160	118.1 Å²	118.1	86%	0.856	62%	0.617	S	S	*	*			trans	-68.4	113	158.1	-84.6	-28.8	0	0	0	108
528	M	29.7	Very low	30.7	Very low	139 Å²	139	116.5 Å²	116.5	69%	0.685	61%	0.608	S	S	*	*			trans	-132.8	140.1	170.1	-75.6	-165.3	68.6	0	0	109.8	W490 P526	W490-M528 WeakPolarHBondContact CH2-O 3.29Å; P526-M528 HydrophobicContact CB-CG 4.32Å; P526-M528 PolarHBondContact O-N 2.9Å
529	L	28	Very low	30.6	Very low	78 Å²	78	109.6 Å²	109.6	41%	0.408	59%	0.592	S	S	.	*			trans	-131.4	142.1	-173.5	-48.7	100	0	0	0	109.1	Q485 G486	Q485-L529 HydrophobicContact CB-CD1 4.49Å; Q485-L529 HydrophobicContact CB-CD2 4Å; Q485-L529 HydrophobicContact CG-CD1 4.01Å; Q485-L529 HydrophobicContact CG-CD2 4.23Å; G486-L529 WeakPolarHBondContact O-CD2 3.43Å
530	E	28.6	Very low	30.4	Very low	109 Å²	109	106 Å²	106	51%	0.509	57%	0.574	S	S	.	*			trans	62.7	68.4	157.8	-57.2	-167.8	140.2	0	0	118.3	G486 Q488	G486-E530 VanDerWaalsContact CA-OE1 3.29Å; G486-E530 WeakPolarHBondContact CA-OE1 3.48Å; G486-E530 WeakPolarHBondContact CA-OE2 3.34Å; G486-E530 PolarHBondContact N-OE2 3.28Å; Q488-E530 HydrophobicContact CG-CG 3.97Å
531	E	30.4	Very low	30.5	Very low	153 Å²	153	102.7 Å²	102.7	72%	0.715	56%	0.557	S	S	*	*			trans	-75.9	144.6	147.2	-80.8	-164.2	157.7	0	0	111	Q488	Q488-E531 PolarHBondContact NE2-O 2.84Å
532	D	27.9	Very low	30.6	Very low	81 Å²	81	99.6 Å²	99.6	43%	0.433	54%	0.536	S	S	.	.			trans	-78.6	129.5	-166.8	-171.9	-4.1	0	0	0	113.3	N534 K535 S536	D532-N534 PolarHBondContact O-N 3.44Å; D532-N534 VanDerWaalsContact O-N 3.16Å; D532-N534 PolarHBondContact OD1-N 3.2Å; D532-N534 PolarHBondContact OD1-ND2 2.86Å; D532-K535 PolarHBondContact O-N 3.32Å; D532-S536 PolarHBondContact O-OG 3.33Å
533	V	35.5	Very low	30.9	Very low	114 Å²	114	95.2 Å²	95.2	69%	0.691	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-20.3	-177.1	178.4	0	0	0	0	112.4
534	N	31	Very low	31.6	Very low	142 Å²	142	93.4 Å²	93.4	76%	0.759	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.7	1.2	-173.7	-57.2	-68.8	0	0	0	114.8	D532	D532-N534 PolarHBondContact O-N 3.44Å; D532-N534 VanDerWaalsContact O-N 3.16Å; D532-N534 PolarHBondContact OD1-N 3.2Å; D532-N534 PolarHBondContact OD1-ND2 2.86Å
535	K	31	Very low	32.3	Very low	169 Å²	169	88.9 Å²	88.9	74%	0.735	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-125.2	-13.4	178.5	-70.6	174	-178.6	164.4	0	114.1	D532 T537	D532-K535 PolarHBondContact O-N 3.32Å; K535-T537 PolarHBondContact O-N 3.11Å
536	S	26.6	Very low	33.5	Very low	66 Å²	66	83.5 Å²	83.5	46%	0.462	45%	0.454	S	S	.	.			trans	-81.3	69.9	-171.1	37.2	0	0	0	0	113.4	D532 I538	D532-S536 PolarHBondContact O-OG 3.33Å; S536-I538 PolarHBondContact O-N 2.91Å
537	T	25.9	Very low	34.8	Very low	140 Å²	140	82.5 Å²	82.5	86%	0.859	45%	0.453	S	S	*	.			trans	-69.8	18.1	169.8	42.1	0	0	0	0	114.1	K535	K535-T537 PolarHBondContact O-N 3.11Å
538	I	26.9	Very low	36.4	Very low	130 Å²	130	77.5 Å²	77.5	67%	0.667	42%	0.424	S	S	*	.			trans	-125.7	63.6	-175.6	-44.9	-179.5	0	0	0	109.7	S536 G540	S536-I538 PolarHBondContact O-N 2.91Å; I538-G540 PolarHBondContact O-N 2.99Å
539	S	30.5	Very low	37.8	Very low	62 Å²	62	75 Å²	75	43%	0.434	41%	0.409	S	S	.	.			trans	-59	124.7	145.5	60.3	0	0	0	0	107.4
540	G	34.6	Very low	39.4	Very low	5 Å²	5	75.5 Å²	75.5	5%	0.052	41%	0.406	C	S	.	.			trans	-63.4	174.3	170.5	0	0	0	0	0	112.6	Y493 I538 L542 G543	Y493-G540 WeakPolarHBondContact CD2-O 3.19Å; Y493-G540 WeakPolarHBondContact CE2-O 3.36Å; Y493-G540 VanDerWaalsContact CG-CA 3.41Å; I538-G540 PolarHBondContact O-N 2.99Å; G540-L542 PolarHBondContact O-N 3.49Å; G540-G543 PolarHBondContact O-N 3.49Å
541	P	36.9	Very low	41.1	Very low	16 Å²	16	71.9 Å²	71.9	10%	0.104	39%	0.39	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.1	-33.4	-138.3	-4.2	-13.8	0	0	0	119.3	Y493 Y982 W989 L1190 L1247	Y493-P541 HydrophobicContact CD1-CG 4.46Å; Y493-P541 HydrophobicContact CE1-CG 4.26Å; P541-Y982 VanDerWaalsContact CG-OH 3.22Å; P541-Y982 WeakPolarHBondContact CG-OH 3.42Å; P541-W989 HydrophobicContact CB-CH2 4.14Å; P541-W989 HydrophobicContact CB-CZ3 4.39Å; P541-W989 HydrophobicContact CG-CH2 4Å; P541-W989 HydrophobicContact CG-CZ2 4.45Å; P541-W989 HydrophobicContact CG-CZ3 4.26Å; P541-L1190 HydrophobicContact CB-CD2 3.33Å; P541-L1190 HydrophobicContact CG-CD2 3.59Å; P541-L1247 HydrophobicContact CB-CD2 3.38Å; P541-L1247 WeakPolarHBondContact O-CD2 3.26Å
542	L	40.3	Very low	42.8	Very low	13 Å²	13	71.6 Å²	71.6	7%	0.068	39%	0.393	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.1	-7.5	-176.9	-55.2	175.2	0	0	0	115.1	Y493 G540 L546 W989 L1247 M1250	Y493-L542 VanDerWaalsContact OH-CB 3.27Å; Y493-L542 WeakPolarHBondContact OH-CB 3.22Å; Y493-L542 WeakPolarHBondContact OH-CD1 3.47Å; Y493-L542 VanDerWaalsContact OH-CG 3.26Å; Y493-L542 WeakPolarHBondContact OH-CG 3.45Å; G540-L542 PolarHBondContact O-N 3.49Å; L542-L546 HydrophobicContact CD1-CD1 4.15Å; L542-W989 HydrophobicContact CD1-CH2 4.3Å; L542-W989 HydrophobicContact CD1-CZ2 4.34Å; L542-W989 HydrophobicContact CD2-CH2 4.1Å; L542-W989 HydrophobicContact CG-CH2 3.96Å; L542-W989 HydrophobicContact CG-CZ2 4.38Å; L542-L1247 HydrophobicContact CD2-CD2 3.98Å; L542-M1250 HydrophobicContact CD2-SD 4.38Å
543	G	40.5	Very low	44.5	Very low	20 Å²	20	72.7 Å²	72.7	21%	0.206	40%	0.4	C	S	.	.	G	3₁₀ helix	trans	65.8	-155.7	-175.9	0	0	0	0	0	114.1	G540 S545	G540-G543 PolarHBondContact O-N 3.49Å; G543-S545 VanDerWaalsContact C-N 3.29Å; G543-S545 PolarHBondContact O-N 2.89Å; G543-S545 VanDerWaalsContact O-N 3.12Å
544	N	42.3	Very low	45.6	Very low	105 Å²	105	69.6 Å²	69.6	56%	0.561	39%	0.39	S	S	*	.	G	3₁₀ helix	trans	-80.5	14.4	-161.6	-63.6	-13.3	0	0	0	116	I609	N544-I609 HydrophobicContact CB-CB 4.24Å; N544-I609 HydrophobicContact CB-CD1 4.26Å
545	S	47.2	Very low	47.2	Very low	0 Å²	0	70 Å²	70	0%	0	38%	0.381	C	S	.	.	G	3₁₀ helix	trans	-91.5	-17.2	-166.8	72.3	0	0	0	0	117.1	G543 G560 E737	G543-S545 VanDerWaalsContact C-N 3.29Å; G543-S545 PolarHBondContact O-N 2.89Å; G543-S545 VanDerWaalsContact O-N 3.12Å; S545-G560 WeakPolarHBondContact O-CA 3.31Å; S545-E737 WeakPolarHBondContact CB-OE1 3.38Å; S545-E737 PolarHBondContact OG-OE1 2.92Å
546	L	53.7	Low	48.9	Very low	2 Å²	2	62.3 Å²	62.3	1%	0.01	35%	0.349	C	S	.	.	S	Bend	trans	-132.3	30.1	-167.2	-79.5	176.8	0	0	0	116.1	L542 K559 E737 T740	L542-L546 HydrophobicContact CD1-CD1 4.15Å; L546-K559 CarbonylContact C-O 3.6Å; L546-E737 HydrophobicContact CD1-CG 3.71Å; L546-E737 HydrophobicContact CD2-CG 4.08Å; L546-E737 HydrophobicContact CG-CG 3.85Å; L546-T740 HydrophobicContact CD1-CG2 4.42Å; L546-T740 HydrophobicContact CD2-CG2 4.17Å
547	G	56.7	Low	51	Low	29 Å²	29	59.7 Å²	59.7	30%	0.299	33%	0.33	S	S	.	.			trans	-55.6	159.1	-176.8	0	0	0	0	0	116.2	K559	G547-K559 PolarHBondContact N-O 2.78Å; G547-K559 PolarHBondContact O-N 3.38Å; G547-K559 VanDerWaalsContact O-O 3.06Å
548	F	59.7	Low	53.6	Low	55 Å²	55	53.7 Å²	53.7	24%	0.241	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	160.3	164.5	76.2	-81.1	0	0	0	110.1	Y550 V557 Y558	F548-Y550 AromaticContact CE2-CE2 3.92Å; F548-Y550 HydrophobicContact CE2-CE2 3.92Å; F548-Y550 AromaticContact CE2-CZ 3.88Å; F548-V557 CarbonylContact C-O 3.55Å; F548-V557 VanDerWaalsContact CA-O 3.25Å; F548-V557 WeakPolarHBondContact CA-O 3.12Å; F548-Y558 HydrophobicContact CB-CD1 3.74Å; F548-Y558 HydrophobicContact CB-CE1 4.1Å
549	K	60	Low	56.1	Low	87 Å²	87	50.5 Å²	50.5	38%	0.378	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	144.2	171.7	159.8	168.1	179.5	171.8	0	108.7	W489 V557	W489-K549 HydrophobicContact CD2-CD 4.16Å; W489-K549 HydrophobicContact CE3-CB 4.17Å; W489-K549 HydrophobicContact CE3-CD 3.71Å; W489-K549 HydrophobicContact CE3-CG 4.45Å; W489-K549 HydrophobicContact CH2-CD 3.54Å; W489-K549 HydrophobicContact CZ2-CD 3.99Å; W489-K549 HydrophobicContact CZ3-CB 3.88Å; W489-K549 HydrophobicContact CZ3-CD 3.38Å; W489-K549 HydrophobicContact CZ3-CG 4.17Å; K549-V557 PolarHBondContact N-O 2.79Å; K549-V557 WeakPolarHBondContact O-CA 3.21Å; K549-V557 WeakPolarHBondContact O-CB 3.26Å; K549-V557 PolarHBondContact O-N 3.18Å
550	Y	60.8	Low	58.5	Low	87 Å²	87	47.7 Å²	47.7	34%	0.341	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	137	166.9	-60	-72.3	0	0	0	111.6	F548 G554 R555 P556 M760	F548-Y550 AromaticContact CE2-CE2 3.92Å; F548-Y550 HydrophobicContact CE2-CE2 3.92Å; F548-Y550 AromaticContact CE2-CZ 3.88Å; Y550-G554 WeakPolarHBondContact CD1-O 3.25Å; Y550-R555 CarbonylContact C-O 3.56Å; Y550-R555 VanDerWaalsContact CA-O 3.3Å; Y550-R555 WeakPolarHBondContact CA-O 3.42Å; Y550-P556 HydrophobicContact CD1-CB 4.38Å; Y550-P556 HydrophobicContact CE1-CB 4.19Å; Y550-M760 HydrophobicContact CE1-SD 4.19Å; Y550-M760 PolarHBondContact OH-SD 3.17Å
551	D	64.6	Low	60.8	Low	33 Å²	33	47.6 Å²	47.6	18%	0.176	25%	0.252	C	S	.	.			trans	-69.8	178.2	165.4	80.4	-13.4	0	0	0	111.1	N553 G554 R555 V557	D551-N553 PolarHBondContact O-N 2.76Å; D551-N553 VanDerWaalsContact O-N 3.08Å; D551-N553 VanDerWaalsContact OD1-CA 3.26Å; D551-N553 WeakPolarHBondContact OD1-CA 3.42Å; D551-N553 WeakPolarHBondContact OD1-CB 3.42Å; D551-N553 PolarHBondContact OD1-N 2.81Å; D551-N553 PolarHBondContact OD2-ND2 3.27Å; D551-G554 PolarHBondContact O-N 2.91Å; D551-G554 PolarHBondContact OD1-N 3.49Å; D551-R555 PolarHBondContact N-O 2.93Å; D551-R555 WeakPolarHBondContact OD1-CB 3.39Å; D551-R555 PolarHBondContact OD1-N 3.14Å; D551-V557 HydrophobicContact CB-CG2 4.04Å
552	N	66.8	Low	63.3	Low	147 Å²	147	46.9 Å²	46.9	79%	0.786	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-6.7	178.2	-62.7	-1.4	0	0	0	113.2
553	N	62.5	Low	65.7	Low	105 Å²	105	46.4 Å²	46.4	56%	0.561	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-107.6	7.6	-178.5	-45.7	-64	0	0	0	112.2	D551 R555	D551-N553 PolarHBondContact O-N 2.76Å; D551-N553 VanDerWaalsContact O-N 3.08Å; D551-N553 VanDerWaalsContact OD1-CA 3.26Å; D551-N553 WeakPolarHBondContact OD1-CA 3.42Å; D551-N553 WeakPolarHBondContact OD1-CB 3.42Å; D551-N553 PolarHBondContact OD1-N 2.81Å; D551-N553 PolarHBondContact OD2-ND2 3.27Å; N553-R555 HydrophobicContact CB-CG 4.34Å
554	G	60	Low	68.1	Low	48 Å²	48	46 Å²	46	50%	0.495	24%	0.237	S	C	.	.	S	Bend	trans	79.6	10.8	-179.4	0	0	0	0	0	115.5	Y550 D551	Y550-G554 WeakPolarHBondContact CD1-O 3.25Å; D551-G554 PolarHBondContact O-N 2.91Å; D551-G554 PolarHBondContact OD1-N 3.49Å
555	R	63.3	Low	70.3	Confident	151 Å²	151	41.4 Å²	41.4	57%	0.57	21%	0.212	S	C	*	.			trans	-92.5	136.1	-176.7	-56.4	174.3	176	-168.7	-3.1	111.2	Y550 D551 N553 V557	Y550-R555 CarbonylContact C-O 3.56Å; Y550-R555 VanDerWaalsContact CA-O 3.3Å; Y550-R555 WeakPolarHBondContact CA-O 3.42Å; D551-R555 PolarHBondContact N-O 2.93Å; D551-R555 WeakPolarHBondContact OD1-CB 3.39Å; D551-R555 PolarHBondContact OD1-N 3.14Å; N553-R555 HydrophobicContact CB-CG 4.34Å; R555-V557 PolarHBondContact O-N 3.46Å
556	P	66.7	Low	72.2	Confident	8 Å²	8	47.5 Å²	47.5	5%	0.052	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	121.4	179.2	29.9	-34.9	0	0	0	112.1	Y550 Y558 L754 I755	Y550-P556 HydrophobicContact CD1-CB 4.38Å; Y550-P556 HydrophobicContact CE1-CB 4.19Å; P556-Y558 HydrophobicContact CB-CE1 4.44Å; P556-Y558 HydrophobicContact CB-CE2 4.39Å; P556-Y558 HydrophobicContact CG-CE2 4.42Å; P556-L754 WeakPolarHBondContact CG-O 3.35Å; P556-I755 WeakPolarHBondContact CG-O 3.29Å
557	V	72	Confident	73.7	Confident	11 Å²	11	54.2 Å²	54.2	7%	0.067	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	115.8	171.6	-176.5	0	0	0	0	108.9	F548 K549 D551 R555 T584 L585 D586	F548-V557 CarbonylContact C-O 3.55Å; F548-V557 VanDerWaalsContact CA-O 3.25Å; F548-V557 WeakPolarHBondContact CA-O 3.12Å; K549-V557 PolarHBondContact N-O 2.79Å; K549-V557 WeakPolarHBondContact O-CA 3.21Å; K549-V557 WeakPolarHBondContact O-CB 3.26Å; K549-V557 PolarHBondContact O-N 3.18Å; D551-V557 HydrophobicContact CB-CG2 4.04Å; R555-V557 PolarHBondContact O-N 3.46Å; V557-T584 HydrophobicContact CG1-CG2 3.59Å; V557-L585 CarbonylContact C-O 3.47Å; V557-L585 WeakPolarHBondContact CA-O 3.48Å; V557-D586 HydrophobicContact CG1-CB 4.09Å; V557-D586 HydrophobicContact CG2-CB 4.37Å
558	Y	79	Confident	75.1	Confident	14 Å²	14	53.7 Å²	53.7	6%	0.055	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	141.2	-177.7	-60.8	-69.9	0	0	0	111.8	F548 P556 T584 L585 R744 L754	F548-Y558 HydrophobicContact CB-CD1 3.74Å; F548-Y558 HydrophobicContact CB-CE1 4.1Å; P556-Y558 HydrophobicContact CB-CE1 4.44Å; P556-Y558 HydrophobicContact CB-CE2 4.39Å; P556-Y558 HydrophobicContact CG-CE2 4.42Å; Y558-T584 CarbonylContact O-C 3.39Å; Y558-T584 WeakPolarHBondContact O-CA 3.14Å; Y558-L585 HydrophobicContact CD2-CD2 4.41Å; Y558-L585 PolarHBondContact N-O 3.18Å; Y558-L585 PolarHBondContact O-N 3.43Å; Y558-R744 HydrophobicContact CD2-CG 4.33Å; Y558-R744 HydrophobicContact CE2-CG 4.4Å; Y558-R744 HydrophobicContact CG-CG 4.49Å; Y558-L754 HydrophobicContact CE2-CB 4.35Å; Y558-L754 PolarHBondContact OH-O 2.8Å
559	K	79.6	Confident	76.3	Confident	63 Å²	63	53.1 Å²	53.1	27%	0.274	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	154.4	-177.6	-62.3	-166.7	176.5	-174.8	0	112.7	L546 G547 F582 L583 T584	L546-K559 CarbonylContact C-O 3.6Å; G547-K559 PolarHBondContact N-O 2.78Å; G547-K559 PolarHBondContact O-N 3.38Å; G547-K559 VanDerWaalsContact O-O 3.06Å; K559-F582 HydrophobicContact CB-CE2 4.35Å; K559-F582 HydrophobicContact CB-CZ 3.79Å; K559-F582 HydrophobicContact CD-CE1 4.17Å; K559-F582 HydrophobicContact CD-CZ 3.94Å; K559-F582 HydrophobicContact CG-CZ 4.27Å; K559-L583 WeakPolarHBondContact CA-O 3.41Å; K559-T584 HydrophobicContact CD-CG2 4.42Å; K559-T584 WeakPolarHBondContact CE-OG1 3.34Å; K559-T584 HydrophobicContact CG-CG2 4.13Å
560	G	80.7	Confident	77.3	Confident	2 Å²	2	51.9 Å²	51.9	2%	0.021	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	164.4	-179.9	178.5	0	0	0	0	0	114.4	S545 F582 L583	S545-G560 WeakPolarHBondContact O-CA 3.31Å; G560-F582 WeakPolarHBondContact O-CD2 3.23Å; G560-L583 PolarHBondContact N-O 2.99Å; G560-L583 VanDerWaalsContact N-O 3.16Å; G560-L583 PolarHBondContact O-N 3.34Å
561	W	84.4	Confident	78.2	Confident	4 Å²	4	55.5 Å²	55.5	2%	0.015	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	131.2	-178.4	-67.3	97.4	0	0	0	111.7	V581 F582 P595 I599 I615 F617	W561-V581 VanDerWaalsContact CE3-C 3.5Å; W561-F582 HydrophobicContact CD2-CB 4.28Å; W561-F582 AromaticContact CD2-CD2 3.91Å; W561-F582 HydrophobicContact CD2-CD2 3.91Å; W561-F582 AromaticContact CE2-CD2 3.62Å; W561-F582 HydrophobicContact CE3-CB 3.94Å; W561-F582 HydrophobicContact CE3-CD2 4.43Å; W561-F582 HydrophobicContact CG-CD2 4.28Å; W561-F582 HydrophobicContact CH2-CB 3.75Å; W561-F582 HydrophobicContact CH2-CD2 4.4Å; W561-F582 HydrophobicContact CH2-CG 4.41Å; W561-F582 HydrophobicContact CZ2-CB 4.1Å; W561-F582 AromaticContact CZ2-CD2 3.88Å; W561-F582 HydrophobicContact CZ2-CD2 3.88Å; W561-F582 HydrophobicContact CZ2-CG 4.29Å; W561-F582 HydrophobicContact CZ3-CB 3.67Å; W561-F582 AromaticContact NE1-CD2 3.85Å; W561-P595 HydrophobicContact CH2-CB 4.38Å; W561-P595 HydrophobicContact CH2-CG 4.44Å; W561-P595 HydrophobicContact CZ3-CG 4.09Å; W561-I599 HydrophobicContact CE3-CD1 4.18Å; W561-I599 HydrophobicContact CH2-CD1 3.3Å; W561-I599 HydrophobicContact CZ2-CD1 3.69Å; W561-I599 HydrophobicContact CZ3-CD1 3.57Å; W561-I615 HydrophobicContact CH2-CD1 3.88Å; W561-I615 HydrophobicContact CZ2-CD1 3.51Å; W561-F617 AromaticContact CH2-CE1 3.95Å; W561-F617 HydrophobicContact CH2-CE1 3.95Å; W561-F617 HydrophobicContact CH2-CZ 4.36Å
562	L	88.5	Confident	78.9	Confident	1 Å²	1	57.9 Å²	57.9	1%	0.005	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	172.2	169.6	-65.8	-173.9	0	0	0	109.4	V581 L583 L730 F731 W741	L562-V581 PolarHBondContact N-O 2.9Å; L562-V581 PolarHBondContact O-N 3.18Å; L562-V581 VanDerWaalsContact O-O 3.09Å; L562-L583 HydrophobicContact CB-CD1 4.08Å; L562-L583 HydrophobicContact CD1-CD2 3.54Å; L562-L583 HydrophobicContact CG-CD1 4.47Å; L562-L583 HydrophobicContact CG-CD2 4.18Å; L562-L730 HydrophobicContact CD1-CB 4.19Å; L562-L730 HydrophobicContact CD1-CD1 4.42Å; L562-F731 WeakPolarHBondContact CB-O 3.44Å; L562-F731 WeakPolarHBondContact CD2-O 3.07Å; L562-W741 HydrophobicContact CD1-CB 4.25Å; L562-W741 HydrophobicContact CD1-CD2 4.18Å; L562-W741 HydrophobicContact CD1-CG 3.94Å; L562-W741 HydrophobicContact CD2-CG 4.19Å; L562-W741 HydrophobicContact CG-CG 4.37Å
563	N	90.2	Very high	79.6	Confident	2 Å²	2	52.2 Å²	52.2	1%	0.011	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	136.5	170.8	-47.2	-54.8	0	0	0	110.9	F579 R601 L730 F731	N563-F579 CarbonylContact C-O 3.55Å; N563-F579 VanDerWaalsContact CA-O 3.3Å; N563-F579 WeakPolarHBondContact CA-O 3.34Å; N563-R601 PolarHBondContact ND2-O 2.8Å; N563-L730 CarbonylContact O-C 3.59Å; N563-L730 WeakPolarHBondContact O-CA 3.13Å; N563-F731 HydrophobicContact CB-CB 4.36Å; N563-F731 PolarHBondContact N-O 3.37Å; N563-F731 PolarHBondContact O-N 2.79Å
564	E	90.9	Very high	80.4	Confident	11 Å²	11	49.7 Å²	49.7	5%	0.051	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	143.2	176.6	-173.5	-173.2	-174.6	0	0	110.5	T578 F579 V581 R594 Y729 L730	E564-T578 WeakPolarHBondContact O-CA 3.32Å; E564-F579 PolarHBondContact N-O 3.29Å; E564-F579 PolarHBondContact O-N 3Å; E564-V581 HydrophobicContact CB-CG2 3.52Å; E564-R594 IonicContact OE1-CZ 2.8Å; E564-R594 IonicContact OE1-NH2 2.8Å; E564-R594 PolarHBondContact OE1-NH2 2.96Å; E564-R594 IonicContact OE2-CZ 2.77Å; E564-R594 IonicContact OE2-NE 2.67Å; E564-R594 PolarHBondContact OE2-NE 2.84Å; E564-R594 IonicContact OE2-NH2 3.53Å; E564-R594 PolarHBondContact OE2-NH2 2.93Å; E564-Y729 WeakPolarHBondContact CA-O 3.41Å; E564-L730 HydrophobicContact CB-CD2 4.22Å; E564-L730 HydrophobicContact CG-CD2 4.43Å
565	I	89.6	Confident	81.4	Confident	9 Å²	9	48.5 Å²	48.5	5%	0.046	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	143.3	164	-159.4	170.2	0	0	0	110.6	H567 K577 T578 Y729 F731	I565-H567 WeakPolarHBondContact CD1-O 3.24Å; I565-H567 WeakPolarHBondContact CG1-O 3.41Å; I565-K577 HydrophobicContact CD1-CB 3.85Å; I565-K577 HydrophobicContact CG1-CB 4.5Å; I565-T578 HydrophobicContact CB-CG2 4.19Å; I565-T578 HydrophobicContact CD1-CG2 4.24Å; I565-T578 HydrophobicContact CG1-CG2 4.49Å; I565-Y729 HydrophobicContact CG2-CD2 4.38Å; I565-Y729 HydrophobicContact CG2-CG 4.27Å; I565-Y729 PolarHBondContact N-O 3.36Å; I565-Y729 VanDerWaalsContact N-O 3.1Å; I565-F731 HydrophobicContact CB-CE2 4.01Å; I565-F731 HydrophobicContact CG2-CE2 3.61Å; I565-F731 HydrophobicContact CG2-CZ 4.2Å
566	I	85.9	Confident	82.2	Confident	128 Å²	128	42.6 Å²	42.6	66%	0.656	22%	0.222	S	C	*	.	S	Bend	trans	-76.1	-38.9	-177.1	-59.5	174.8	0	0	0	111.2
567	H	85.3	Confident	83	Confident	144 Å²	144	47.3 Å²	47.3	67%	0.667	24%	0.241	S	C	*	.	S	Bend	trans	-134.8	124.1	177.9	-175.7	68.6	0	0	0	108.3	I565	I565-H567 WeakPolarHBondContact CD1-O 3.24Å; I565-H567 WeakPolarHBondContact CG1-O 3.41Å
568	Y	87.2	Confident	83.8	Confident	18 Å²	18	46.9 Å²	46.9	7%	0.071	24%	0.239	C	C	.	.			trans	-105.8	132.7	176.2	178.2	-108.6	0	0	0	110.1	P570 H573 L633 P648 Y729 F731	Y568-P570 HydrophobicContact CE1-CB 4.34Å; Y568-H573 HydrophobicContact CD2-CB 3.98Å; Y568-H573 HydrophobicContact CE2-CB 3.82Å; Y568-H573 AromaticContact CE2-CD2 3.89Å; Y568-H573 AromaticContact CE2-CG 3.54Å; Y568-H573 AromaticContact CE2-ND1 3.71Å; Y568-L633 HydrophobicContact CD1-CB 4.31Å; Y568-L633 HydrophobicContact CD1-CD1 4.32Å; Y568-L633 HydrophobicContact CE1-CB 3.96Å; Y568-P648 HydrophobicContact CD1-CG 3.83Å; Y568-P648 HydrophobicContact CD2-CG 3.77Å; Y568-P648 HydrophobicContact CE1-CG 3.79Å; Y568-P648 HydrophobicContact CE2-CG 3.73Å; Y568-P648 HydrophobicContact CG-CG 3.82Å; Y568-P648 VanDerWaalsContact CZ-CD 3.46Å; Y568-Y729 HydrophobicContact CG-CD1 4.45Å; Y568-F731 AromaticContact CD2-CZ 3.91Å; Y568-F731 HydrophobicContact CD2-CZ 3.91Å; Y568-F731 HydrophobicContact CE2-CE1 4.32Å; Y568-F731 HydrophobicContact CE2-CZ 4.05Å
569	D	84.3	Confident	84.1	Confident	43 Å²	43	52 Å²	52	23%	0.23	26%	0.262	C	S	.	.			trans	-136.6	124.2	173	158.7	18.5	0	0	0	106.7	E571 T572 H573	D569-E571 PolarHBondContact O-N 2.7Å; D569-E571 PolarHBondContact OD1-N 2.85Å; D569-T572 WeakPolarHBondContact OD2-CB 3.22Å; D569-T572 WeakPolarHBondContact OD2-CG2 3.41Å; D569-T572 PolarHBondContact OD2-N 3.43Å; D569-T572 VanDerWaalsContact OD2-N 3.09Å; D569-T572 PolarHBondContact OD2-OG1 3.38Å; D569-H573 VanDerWaalsContact O-CB 3.25Å; D569-H573 WeakPolarHBondContact O-CB 3.28Å; D569-H573 PolarHBondContact O-N 2.83Å; D569-H573 PolarHBondContact O-ND1 3.4Å
570	P	81.5	Confident	84.5	Confident	61 Å²	61	49.4 Å²	49.4	40%	0.396	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-20.6	-177.5	28.4	-36.3	0	0	0	114.1	Y568 H573 P634	Y568-P570 HydrophobicContact CE1-CB 4.34Å; P570-H573 PolarHBondContact O-CE1 2.83Å; P570-H573 PolarHBondContact O-ND1 2.84Å; P570-P634 HydrophobicContact CB-CG 3.94Å
571	E	79.5	Confident	84.8	Confident	162 Å²	162	49.3 Å²	49.3	76%	0.757	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.3	-42.9	-179.6	-62.1	-171.9	-179.9	0	0	112.4	D569	D569-E571 PolarHBondContact O-N 2.7Å; D569-E571 PolarHBondContact OD1-N 2.85Å
572	T	78.8	Confident	85	Confident	83 Å²	83	49.8 Å²	49.8	51%	0.509	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.4	4.7	-176.3	78.6	0	0	0	0	116.2	D569 K577	D569-T572 WeakPolarHBondContact OD2-CB 3.22Å; D569-T572 WeakPolarHBondContact OD2-CG2 3.41Å; D569-T572 PolarHBondContact OD2-N 3.43Å; D569-T572 VanDerWaalsContact OD2-N 3.09Å; D569-T572 PolarHBondContact OD2-OG1 3.38Å; T572-K577 PolarHBondContact O-NZ 3.48Å
573	H	82.2	Confident	85	Confident	29 Å²	29	49.7 Å²	49.7	13%	0.134	25%	0.252	C	S	.	.			trans	-62.9	147.4	173	70	-73.4	0	0	0	112.7	Y568 D569 P570	Y568-H573 HydrophobicContact CD2-CB 3.98Å; Y568-H573 HydrophobicContact CE2-CB 3.82Å; Y568-H573 AromaticContact CE2-CD2 3.89Å; Y568-H573 AromaticContact CE2-CG 3.54Å; Y568-H573 AromaticContact CE2-ND1 3.71Å; D569-H573 VanDerWaalsContact O-CB 3.25Å; D569-H573 WeakPolarHBondContact O-CB 3.28Å; D569-H573 PolarHBondContact O-N 2.83Å; D569-H573 PolarHBondContact O-ND1 3.4Å; P570-H573 PolarHBondContact O-CE1 2.83Å; P570-H573 PolarHBondContact O-ND1 2.84Å
574	H	79.9	Confident	84.8	Confident	52 Å²	52	50.1 Å²	50.1	24%	0.241	26%	0.255	C	S	.	.			trans	-151.9	139.8	175.6	-174.4	-109.2	0	0	0	107.9	G576 K577 D1060 S1061	H574-G576 PolarHBondContact ND1-N 2.81Å; H574-G576 PolarHBondContact O-N 2.88Å; H574-G576 VanDerWaalsContact O-N 3.08Å; H574-K577 WeakPolarHBondContact O-CB 3.25Å; H574-K577 PolarHBondContact O-N 3.06Å; H574-D1060 IonicContact CD2-OD2 3.24Å; H574-S1061 PolarHBondContact NE2-OG 3.26Å
575	I	80.8	Confident	84.5	Confident	22 Å²	22	49.8 Å²	49.8	11%	0.113	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-58	-29.1	-176	-158.3	173.2	0	0	0	112.2	K577 T578 R601 R602 D1060	I575-K577 PolarHBondContact O-N 3.47Å; I575-T578 WeakPolarHBondContact O-CB 3.4Å; I575-T578 PolarHBondContact O-N 3.29Å; I575-T578 PolarHBondContact O-OG1 3.15Å; I575-R601 HydrophobicContact CD1-CB 3.87Å; I575-R601 HydrophobicContact CG1-CB 4.03Å; I575-R601 WeakPolarHBondContact O-CD 3.47Å; I575-R601 PolarHBondContact O-NE 3.44Å; I575-R602 HydrophobicContact CD1-CG 3.76Å; I575-D1060 HydrophobicContact CB-CB 4.4Å; I575-D1060 VanDerWaalsContact CB-OD2 3.3Å; I575-D1060 WeakPolarHBondContact CB-OD2 3.37Å; I575-D1060 HydrophobicContact CG2-CB 3.66Å; I575-D1060 WeakPolarHBondContact CG2-OD2 3.41Å; I575-D1060 PolarHBondContact N-OD2 2.77Å
576	G	80.1	Confident	84.3	Confident	28 Å²	28	52.4 Å²	52.4	29%	0.289	27%	0.267	S	S	.	.	G	3₁₀ helix	trans	-55.8	-30.3	173.2	0	0	0	0	0	114.5	H574 T578 R601	H574-G576 PolarHBondContact ND1-N 2.81Å; H574-G576 PolarHBondContact O-N 2.88Å; H574-G576 VanDerWaalsContact O-N 3.08Å; G576-T578 VanDerWaalsContact C-N 3.28Å; G576-T578 PolarHBondContact O-N 3.28Å; G576-R601 PolarHBondContact O-NH2 2.77Å
577	K	83.1	Confident	84.1	Confident	106 Å²	106	47.4 Å²	47.4	46%	0.461	25%	0.247	S	C	.	.	G	3₁₀ helix	trans	-78.5	-6.9	176	-61.8	177.4	176.1	176.4	0	113.3	I565 T572 H574 I575	I565-K577 HydrophobicContact CD1-CB 3.85Å; I565-K577 HydrophobicContact CG1-CB 4.5Å; T572-K577 PolarHBondContact O-NZ 3.48Å; H574-K577 WeakPolarHBondContact O-CB 3.25Å; H574-K577 PolarHBondContact O-N 3.06Å; I575-K577 PolarHBondContact O-N 3.47Å
578	T	87.4	Confident	84.1	Confident	3 Å²	3	42 Å²	42	2%	0.018	22%	0.224	C	C	.	.			trans	-97.3	149.4	-177.5	75.9	0	0	0	0	111.8	E564 I565 I575 G576 R601 F731	E564-T578 WeakPolarHBondContact O-CA 3.32Å; I565-T578 HydrophobicContact CB-CG2 4.19Å; I565-T578 HydrophobicContact CD1-CG2 4.24Å; I565-T578 HydrophobicContact CG1-CG2 4.49Å; I575-T578 WeakPolarHBondContact O-CB 3.4Å; I575-T578 PolarHBondContact O-N 3.29Å; I575-T578 PolarHBondContact O-OG1 3.15Å; G576-T578 VanDerWaalsContact C-N 3.28Å; G576-T578 PolarHBondContact O-N 3.28Å; T578-R601 PolarHBondContact O-NE 2.81Å; T578-R601 WeakPolarHBondContact OG1-CD 3.27Å; T578-F731 HydrophobicContact CG2-CD2 4Å; T578-F731 HydrophobicContact CG2-CE2 3.78Å; T578-F731 HydrophobicContact CG2-CZ 4.48Å
579	F	86.8	Confident	84.1	Confident	122 Å²	122	46 Å²	46	54%	0.535	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	134	-179.5	-59.3	-85.2	0	0	0	110.4	N563 E564 V581	N563-F579 CarbonylContact C-O 3.55Å; N563-F579 VanDerWaalsContact CA-O 3.3Å; N563-F579 WeakPolarHBondContact CA-O 3.34Å; E564-F579 PolarHBondContact N-O 3.29Å; E564-F579 PolarHBondContact O-N 3Å; F579-V581 WeakPolarHBondContact O-CG2 3.38Å
580	S	87.3	Confident	84.4	Confident	7 Å²	7	44 Å²	44	5%	0.049	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	129.2	177.5	-43.2	0	0	0	0	110.6	P595 I599	S580-P595 WeakPolarHBondContact O-CD 3.3Å; S580-I599 PolarHBondContact OG-O 3.22Å
581	V	87.7	Confident	84.7	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	135.9	-175.1	-171.3	0	0	0	0	110	W561 L562 E564 F579 L583 L592 Q593 R594	W561-V581 VanDerWaalsContact CE3-C 3.5Å; L562-V581 PolarHBondContact N-O 2.9Å; L562-V581 PolarHBondContact O-N 3.18Å; L562-V581 VanDerWaalsContact O-O 3.09Å; E564-V581 HydrophobicContact CB-CG2 3.52Å; F579-V581 WeakPolarHBondContact O-CG2 3.38Å; V581-L583 HydrophobicContact CB-CD1 4.11Å; V581-L583 HydrophobicContact CG1-CD1 3.99Å; V581-L592 HydrophobicContact CG1-CB 3.82Å; V581-L592 HydrophobicContact CG1-CD2 4.39Å; V581-L592 HydrophobicContact CG1-CG 3.96Å; V581-Q593 WeakPolarHBondContact CG1-O 3.42Å; V581-R594 HydrophobicContact CG1-CG 4.33Å; V581-R594 HydrophobicContact CG2-CG 4.11Å
582	F	87.3	Confident	85.2	Confident	14 Å²	14	37.6 Å²	37.6	6%	0.061	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	124.9	170.9	-171.1	-112.2	0	0	0	109.7	K559 G560 W561 Q593 T612 F617	K559-F582 HydrophobicContact CB-CE2 4.35Å; K559-F582 HydrophobicContact CB-CZ 3.79Å; K559-F582 HydrophobicContact CD-CE1 4.17Å; K559-F582 HydrophobicContact CD-CZ 3.94Å; K559-F582 HydrophobicContact CG-CZ 4.27Å; G560-F582 WeakPolarHBondContact O-CD2 3.23Å; W561-F582 HydrophobicContact CD2-CB 4.28Å; W561-F582 AromaticContact CD2-CD2 3.91Å; W561-F582 HydrophobicContact CD2-CD2 3.91Å; W561-F582 AromaticContact CE2-CD2 3.62Å; W561-F582 HydrophobicContact CE3-CB 3.94Å; W561-F582 HydrophobicContact CE3-CD2 4.43Å; W561-F582 HydrophobicContact CG-CD2 4.28Å; W561-F582 HydrophobicContact CH2-CB 3.75Å; W561-F582 HydrophobicContact CH2-CD2 4.4Å; W561-F582 HydrophobicContact CH2-CG 4.41Å; W561-F582 HydrophobicContact CZ2-CB 4.1Å; W561-F582 AromaticContact CZ2-CD2 3.88Å; W561-F582 HydrophobicContact CZ2-CD2 3.88Å; W561-F582 HydrophobicContact CZ2-CG 4.29Å; W561-F582 HydrophobicContact CZ3-CB 3.67Å; W561-F582 AromaticContact NE1-CD2 3.85Å; F582-Q593 HydrophobicContact CB-CB 4.4Å; F582-Q593 PolarHBondContact N-O 2.95Å; F582-Q593 PolarHBondContact O-N 2.79Å; F582-T612 HydrophobicContact CD2-CG2 4.17Å; F582-T612 HydrophobicContact CE1-CG2 4.1Å; F582-T612 HydrophobicContact CE2-CG2 3.6Å; F582-T612 HydrophobicContact CZ-CG2 3.55Å; F582-F617 HydrophobicContact CB-CE1 3.76Å; F582-F617 HydrophobicContact CB-CZ 4.17Å; F582-F617 HydrophobicContact CD1-CZ 4.33Å; F582-F617 HydrophobicContact CG-CE1 4.44Å; F582-F617 HydrophobicContact CG-CZ 4.38Å
583	L	88.9	Confident	85.6	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	142.1	176.6	-83.7	66.7	0	0	0	110.2	K559 G560 L562 V581 L590 R591 L592 L730 W741	K559-L583 WeakPolarHBondContact CA-O 3.41Å; G560-L583 PolarHBondContact N-O 2.99Å; G560-L583 VanDerWaalsContact N-O 3.16Å; G560-L583 PolarHBondContact O-N 3.34Å; L562-L583 HydrophobicContact CB-CD1 4.08Å; L562-L583 HydrophobicContact CD1-CD2 3.54Å; L562-L583 HydrophobicContact CG-CD1 4.47Å; L562-L583 HydrophobicContact CG-CD2 4.18Å; V581-L583 HydrophobicContact CB-CD1 4.11Å; V581-L583 HydrophobicContact CG1-CD1 3.99Å; L583-L590 HydrophobicContact CD2-CD1 4.12Å; L583-L590 HydrophobicContact CG-CD1 4.37Å; L583-R591 CarbonylContact C-O 3.59Å; L583-R591 WeakPolarHBondContact CA-O 3.18Å; L583-L592 HydrophobicContact CD1-CD1 4.49Å; L583-L592 HydrophobicContact CD1-CG 4.11Å; L583-L592 HydrophobicContact CG-CD1 4.03Å; L583-L592 HydrophobicContact CG-CG 4.19Å; L583-L730 HydrophobicContact CD2-CD1 4.11Å; L583-W741 HydrophobicContact CB-CH2 3.69Å; L583-W741 HydrophobicContact CB-CZ2 4.09Å; L583-W741 HydrophobicContact CB-CZ3 4.17Å; L583-W741 HydrophobicContact CD2-CE3 4.33Å; L583-W741 HydrophobicContact CD2-CH2 4.44Å; L583-W741 HydrophobicContact CD2-CZ3 4.2Å
584	T	86.4	Confident	85.8	Confident	11 Å²	11	36.4 Å²	36.4	7%	0.067	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	121.8	164.1	-67.3	0	0	0	0	107.9	V557 Y558 K559 R591	V557-T584 HydrophobicContact CG1-CG2 3.59Å; Y558-T584 CarbonylContact O-C 3.39Å; Y558-T584 WeakPolarHBondContact O-CA 3.14Å; K559-T584 HydrophobicContact CD-CG2 4.42Å; K559-T584 WeakPolarHBondContact CE-OG1 3.34Å; K559-T584 HydrophobicContact CG-CG2 4.13Å; T584-R591 PolarHBondContact N-O 3.5Å; T584-R591 PolarHBondContact O-N 3.22Å
585	L	85.5	Confident	85.9	Confident	4 Å²	4	35 Å²	35	2%	0.021	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	117.3	174.8	176.1	65.7	0	0	0	108.5	V557 Y558 Q589 L590 L625 W741 R744 A748	V557-L585 CarbonylContact C-O 3.47Å; V557-L585 WeakPolarHBondContact CA-O 3.48Å; Y558-L585 HydrophobicContact CD2-CD2 4.41Å; Y558-L585 PolarHBondContact N-O 3.18Å; Y558-L585 PolarHBondContact O-N 3.43Å; L585-Q589 WeakPolarHBondContact CA-O 3.34Å; L585-L590 HydrophobicContact CB-CD1 4.14Å; L585-L590 HydrophobicContact CD1-CB 4.28Å; L585-L590 HydrophobicContact CD1-CD1 4.24Å; L585-L625 HydrophobicContact CD1-CD1 3.9Å; L585-W741 HydrophobicContact CB-CZ3 4.1Å; L585-R744 HydrophobicContact CD2-CB 4.02Å; L585-A748 HydrophobicContact CD1-CB 3.95Å; L585-A748 HydrophobicContact CD2-CB 4.2Å
586	D	84.7	Confident	85.6	Confident	63 Å²	63	38.6 Å²	38.6	34%	0.337	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	98.9	-173.7	-168.9	-12.5	0	0	0	108.5	V557 T588 Q589	V557-D586 HydrophobicContact CG1-CB 4.09Å; V557-D586 HydrophobicContact CG2-CB 4.37Å; D586-T588 PolarHBondContact O-N 3.26Å; D586-T588 VanDerWaalsContact O-N 3.13Å; D586-Q589 PolarHBondContact N-O 3Å; D586-Q589 PolarHBondContact O-N 3.23Å
587	G	81.4	Confident	85.2	Confident	23 Å²	23	44.3 Å²	44.3	24%	0.237	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.9	-115.5	-165.2	0	0	0	0	0	111.4
588	T	85.7	Confident	84.4	Confident	30 Å²	30	44.8 Å²	44.8	18%	0.184	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.3	-13.5	174.3	62.3	0	0	0	0	113.4	D586 L590 D624 L625 T626	D586-T588 PolarHBondContact O-N 3.26Å; D586-T588 VanDerWaalsContact O-N 3.13Å; T588-L590 PolarHBondContact O-N 2.75Å; T588-D624 WeakPolarHBondContact CB-OD1 3.43Å; T588-D624 PolarHBondContact OG1-OD1 2.88Å; T588-L625 VanDerWaalsContact O-CB 3.27Å; T588-L625 WeakPolarHBondContact O-CB 3.41Å; T588-L625 WeakPolarHBondContact O-CG 3.44Å; T588-L625 PolarHBondContact O-N 2.95Å; T588-T626 HydrophobicContact CG2-CG2 3.99Å
589	Q	87.2	Confident	83.9	Confident	103 Å²	103	45.3 Å²	45.3	48%	0.481	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	118.6	-174.8	-63	-170.2	13.6	0	0	111.7	L585 D586 Y623	L585-Q589 WeakPolarHBondContact CA-O 3.34Å; D586-Q589 PolarHBondContact N-O 3Å; D586-Q589 PolarHBondContact O-N 3.23Å; Q589-Y623 CarbonylContact C-O 3.55Å; Q589-Y623 WeakPolarHBondContact CA-O 3.27Å
590	L	89.9	Confident	83.3	Confident	0 Å²	0	41 Å²	41	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	112.9	176.6	-176	66.7	0	0	0	111.1	L583 L585 T588 L592 I622 Y623 L625 I651 L745	L583-L590 HydrophobicContact CD2-CD1 4.12Å; L583-L590 HydrophobicContact CG-CD1 4.37Å; L585-L590 HydrophobicContact CB-CD1 4.14Å; L585-L590 HydrophobicContact CD1-CB 4.28Å; L585-L590 HydrophobicContact CD1-CD1 4.24Å; T588-L590 PolarHBondContact O-N 2.75Å; L590-L592 HydrophobicContact CD1-CD1 4.26Å; L590-L592 HydrophobicContact CD2-CD1 3.74Å; L590-L592 HydrophobicContact CG-CD1 3.61Å; L590-I622 WeakPolarHBondContact O-CA 3.42Å; L590-Y623 PolarHBondContact N-O 3.47Å; L590-Y623 PolarHBondContact O-N 2.85Å; L590-L625 HydrophobicContact CB-CD1 3.86Å; L590-L625 HydrophobicContact CB-CD2 4.02Å; L590-L625 HydrophobicContact CB-CG 3.82Å; L590-L625 HydrophobicContact CD2-CD1 4.26Å; L590-L625 HydrophobicContact CD2-CD2 4.07Å; L590-I651 HydrophobicContact CD2-CD1 3.63Å; L590-L745 HydrophobicContact CD1-CD2 3.96Å; L590-L745 HydrophobicContact CD2-CD2 3.82Å; L590-L745 HydrophobicContact CG-CD2 4.46Å
591	R	88.6	Confident	82.9	Confident	90 Å²	90	42.1 Å²	42.1	34%	0.34	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	124.1	175.3	-176.8	-172.4	-60.1	-137.1	6.6	110.4	L583 T584 Q593 Q620 H621 I622	L583-R591 CarbonylContact C-O 3.59Å; L583-R591 WeakPolarHBondContact CA-O 3.18Å; T584-R591 PolarHBondContact N-O 3.5Å; T584-R591 PolarHBondContact O-N 3.22Å; R591-Q593 HydrophobicContact CG-CG 4.13Å; R591-Q620 HydrophobicContact CG-CG 3.83Å; R591-H621 CarbonylContact C-O 3.32Å; R591-H621 WeakPolarHBondContact CA-O 3.29Å; R591-I622 HydrophobicContact CB-CG1 4.34Å; R591-I622 HydrophobicContact CG-CG1 4.12Å
592	L	90.1	Very high	82.4	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	128.6	172.9	-87.5	64.8	0	0	0	109.1	V581 L583 L590 Q620 H621 Y623 L730	V581-L592 HydrophobicContact CG1-CB 3.82Å; V581-L592 HydrophobicContact CG1-CD2 4.39Å; V581-L592 HydrophobicContact CG1-CG 3.96Å; L583-L592 HydrophobicContact CD1-CD1 4.49Å; L583-L592 HydrophobicContact CD1-CG 4.11Å; L583-L592 HydrophobicContact CG-CD1 4.03Å; L583-L592 HydrophobicContact CG-CG 4.19Å; L590-L592 HydrophobicContact CD1-CD1 4.26Å; L590-L592 HydrophobicContact CD2-CD1 3.74Å; L590-L592 HydrophobicContact CG-CD1 3.61Å; L592-Q620 CarbonylContact O-C 3.55Å; L592-Q620 VanDerWaalsContact O-CA 3.3Å; L592-Q620 WeakPolarHBondContact O-CA 3.43Å; L592-H621 PolarHBondContact N-O 3.13Å; L592-H621 PolarHBondContact O-N 2.84Å; L592-Y623 HydrophobicContact CD1-CD2 4.42Å; L592-Y623 HydrophobicContact CD1-CE2 4.41Å; L592-Y623 HydrophobicContact CD2-CE2 4.4Å; L592-L730 HydrophobicContact CD2-CD2 4.34Å
593	Q	86.1	Confident	81.7	Confident	31 Å²	31	42.7 Å²	42.7	15%	0.145	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	121.5	178.2	-63.1	179	-52.5	0	0	110.8	V581 F582 R591 F617 Q619 Q620	V581-Q593 WeakPolarHBondContact CG1-O 3.42Å; F582-Q593 HydrophobicContact CB-CB 4.4Å; F582-Q593 PolarHBondContact N-O 2.95Å; F582-Q593 PolarHBondContact O-N 2.79Å; R591-Q593 HydrophobicContact CG-CG 4.13Å; Q593-F617 HydrophobicContact CB-CB 4.35Å; Q593-F617 HydrophobicContact CB-CD1 3.52Å; Q593-F617 HydrophobicContact CB-CE1 3.9Å; Q593-F617 HydrophobicContact CB-CG 3.95Å; Q593-Q619 WeakPolarHBondContact CA-O 3.16Å; Q593-Q620 HydrophobicContact CG-CB 4.25Å; Q593-Q620 HydrophobicContact CG-CG 3.92Å
594	R	86.5	Confident	80.8	Confident	56 Å²	56	43.7 Å²	43.7	21%	0.211	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	123.2	-179	-61.1	-176.6	-177.5	155.7	-6.8	110.2	E564 V581 F617 K618 Q619	E564-R594 IonicContact OE1-CZ 2.8Å; E564-R594 IonicContact OE1-NH2 2.8Å; E564-R594 PolarHBondContact OE1-NH2 2.96Å; E564-R594 IonicContact OE2-CZ 2.77Å; E564-R594 IonicContact OE2-NE 2.67Å; E564-R594 PolarHBondContact OE2-NE 2.84Å; E564-R594 IonicContact OE2-NH2 3.53Å; E564-R594 PolarHBondContact OE2-NH2 2.93Å; V581-R594 HydrophobicContact CG1-CG 4.33Å; V581-R594 HydrophobicContact CG2-CG 4.11Å; R594-F617 CarbonylContact O-C 3.47Å; R594-F617 VanDerWaalsContact O-CA 3.31Å; R594-F617 WeakPolarHBondContact O-CA 3.24Å; R594-K618 PolarHBondContact O-N 2.71Å; R594-Q619 HydrophobicContact CB-CB 4.42Å; R594-Q619 PolarHBondContact N-O 2.75Å
595	P	83.4	Confident	79.7	Confident	22 Å²	22	48.7 Å²	48.7	14%	0.143	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	160.1	-177.5	32.7	-36.4	0	0	0	112.3	W561 S580 H597 I599 I615 R616 F617	W561-P595 HydrophobicContact CH2-CB 4.38Å; W561-P595 HydrophobicContact CH2-CG 4.44Å; W561-P595 HydrophobicContact CZ3-CG 4.09Å; S580-P595 WeakPolarHBondContact O-CD 3.3Å; P595-H597 VanDerWaalsContact C-N 3.31Å; P595-H597 WeakPolarHBondContact CG-O 3.37Å; P595-I599 HydrophobicContact CB-CD1 4.31Å; P595-I599 HydrophobicContact CG-CD1 4.21Å; P595-I615 HydrophobicContact CB-CG2 3.76Å; P595-R616 CarbonylContact C-O 3.6Å; P595-R616 WeakPolarHBondContact CA-O 3.33Å; P595-F617 HydrophobicContact CB-CD1 4.44Å
596	E	74.3	Confident	78.8	Confident	98 Å²	98	51.8 Å²	51.8	46%	0.458	25%	0.25	S	C	.	.	S	Bend	trans	-75.9	-16.9	171.5	-74.9	-180	-173.1	0	0	113.7	R616 K618	E596-R616 HydrophobicContact CB-CB 4.4Å; E596-R616 HydrophobicContact CG-CB 3.95Å; E596-R616 PolarHBondContact N-O 3.43Å; E596-R616 WeakPolarHBondContact OE1-CB 3.4Å; E596-R616 VanDerWaalsContact OE2-CB 3.32Å; E596-R616 WeakPolarHBondContact OE2-CB 3.39Å; E596-R616 WeakPolarHBondContact OE2-CD 3.44Å; E596-K618 HydrophobicContact CG-CB 4.12Å
597	H	71	Confident	77.9	Confident	147 Å²	147	50.1 Å²	50.1	68%	0.681	24%	0.241	S	C	*	.	S	Bend	trans	-127	149.6	-174.9	-63.8	-17.7	0	0	0	111.4	P595	P595-H597 VanDerWaalsContact C-N 3.31Å; P595-H597 WeakPolarHBondContact CG-O 3.37Å
598	N	67.3	Low	76.8	Confident	117 Å²	117	58 Å²	58	63%	0.626	27%	0.271	S	S	*	.			trans	-69.5	136.8	-179.5	-166.7	20.1	0	0	0	111.1
599	I	76.3	Confident	75.7	Confident	14 Å²	14	57.5 Å²	57.5	7%	0.072	27%	0.268	C	S	.	.			trans	-126.1	140.5	178.6	-67.7	170.6	0	0	0	106.9	W561 S580 P595 R601 P610 I615	W561-I599 HydrophobicContact CE3-CD1 4.18Å; W561-I599 HydrophobicContact CH2-CD1 3.3Å; W561-I599 HydrophobicContact CZ2-CD1 3.69Å; W561-I599 HydrophobicContact CZ3-CD1 3.57Å; S580-I599 PolarHBondContact OG-O 3.22Å; P595-I599 HydrophobicContact CB-CD1 4.31Å; P595-I599 HydrophobicContact CG-CD1 4.21Å; I599-R601 PolarHBondContact O-N 3.25Å; I599-P610 HydrophobicContact CD1-CG 4.28Å; I599-P610 HydrophobicContact CG1-CG 4.38Å; I599-I615 HydrophobicContact CD1-CD1 4.09Å
600	T	74.6	Confident	74.2	Confident	30 Å²	30	55.1 Å²	55.1	18%	0.184	26%	0.261	C	S	.	.			trans	-52.7	123.4	-173.9	47.5	0	0	0	0	111.8	R602 D607 R733 A1052	T600-R602 CarbonylContact C-O 3.57Å; T600-R602 VanDerWaalsContact C-O 3.26Å; T600-R602 WeakPolarHBondContact CB-O 3.45Å; T600-R602 VanDerWaalsContact O-O 3.05Å; T600-R602 PolarHBondContact OG1-O 3.31Å; T600-D607 WeakPolarHBondContact CB-OD2 3.02Å; T600-D607 PolarHBondContact OG1-OD2 2.85Å; T600-R733 VanDerWaalsContact O-CZ 3.3Å; T600-R733 PolarHBondContact O-NE 2.83Å; T600-R733 PolarHBondContact O-NH2 3.05Å; T600-R733 PolarHBondContact OG1-NH2 3.17Å; T600-A1052 HydrophobicContact CG2-CB 4.12Å
601	R	78.5	Confident	72.5	Confident	31 Å²	31	58.6 Å²	58.6	12%	0.117	29%	0.285	C	S	.	.	S	Bend	trans	-71	-37.7	-173.6	-56.7	-172.9	-170.3	97.4	-15.5	111.9	N563 I575 G576 T578 I599 R733 D1057	N563-R601 PolarHBondContact ND2-O 2.8Å; I575-R601 HydrophobicContact CD1-CB 3.87Å; I575-R601 HydrophobicContact CG1-CB 4.03Å; I575-R601 WeakPolarHBondContact O-CD 3.47Å; I575-R601 PolarHBondContact O-NE 3.44Å; G576-R601 PolarHBondContact O-NH2 2.77Å; T578-R601 PolarHBondContact O-NE 2.81Å; T578-R601 WeakPolarHBondContact OG1-CD 3.27Å; I599-R601 PolarHBondContact O-N 3.25Å; R601-R733 WeakPolarHBondContact O-CG 3.44Å; R601-D1057 IonicContact CZ-OD1 2.63Å; R601-D1057 IonicContact NH1-OD1 3.21Å; R601-D1057 PolarHBondContact NH1-OD1 2.91Å; R601-D1057 IonicContact NH1-OD2 2.77Å; R601-D1057 IonicContact NH2-OD1 3.89Å
602	R	77.4	Confident	71	Confident	23 Å²	23	57.4 Å²	57.4	9%	0.087	29%	0.288	C	S	.	.	S	Bend	trans	-86.6	161.1	163.4	-61.3	-179.2	179	-166.2	2.9	108.4	I575 T600 R733 E1059 D1060	I575-R602 HydrophobicContact CD1-CG 3.76Å; T600-R602 CarbonylContact C-O 3.57Å; T600-R602 VanDerWaalsContact C-O 3.26Å; T600-R602 WeakPolarHBondContact CB-O 3.45Å; T600-R602 VanDerWaalsContact O-O 3.05Å; T600-R602 PolarHBondContact OG1-O 3.31Å; R602-R733 PolarHBondContact O-NH2 2.93Å; R602-E1059 IonicContact CZ-OE2 2.67Å; R602-E1059 VanDerWaalsContact NH1-CB 3.27Å; R602-E1059 IonicContact NH1-OE2 3.81Å; R602-E1059 PolarHBondContact NH1-OE2 2.91Å; R602-E1059 PolarHBondContact NH2-O 2.82Å; R602-D1060 IonicContact CZ-OD1 3.85Å; R602-D1060 IonicContact NH2-OD1 2.64Å; R602-D1060 PolarHBondContact NH2-OD1 2.84Å
603	S	72.5	Confident	69.2	Low	4 Å²	4	62.8 Å²	62.8	3%	0.028	32%	0.321	C	S	.	.			trans	-104.7	120.8	169.7	-150.3	0	0	0	0	109.8	D607 R733 N1249	S603-D607 WeakPolarHBondContact CA-OD2 3.36Å; S603-R733 PolarHBondContact OG-NH1 2.98Å; S603-N1249 PolarHBondContact O-ND2 3.21Å
604	L	69.3	Low	67.9	Low	20 Å²	20	66.5 Å²	66.5	11%	0.105	35%	0.346	C	S	.	.			trans	-97.2	163	176.9	-56.7	174.8	0	0	0	111.2	N606 D607 A1052 P1248	L604-N606 WeakPolarHBondContact CB-OD1 3.22Å; L604-N606 PolarHBondContact O-N 3.42Å; L604-D607 HydrophobicContact CB-CB 4.47Å; L604-D607 PolarHBondContact N-OD2 2.83Å; L604-D607 PolarHBondContact O-N 2.78Å; L604-A1052 HydrophobicContact CD1-CB 4.29Å; L604-P1248 WeakPolarHBondContact O-CD 3.3Å
605	W	64.1	Low	66.9	Low	117 Å²	117	65 Å²	65	44%	0.443	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-20.1	179	69.3	-99.7	0	0	0	113.2	V1208 V1246 L1247	W605-V1208 HydrophobicContact CD2-CG2 3.7Å; W605-V1208 HydrophobicContact CE3-CG2 3.87Å; W605-V1208 HydrophobicContact CG-CG2 4.28Å; W605-V1208 HydrophobicContact CH2-CG2 4.07Å; W605-V1208 HydrophobicContact CZ2-CG2 3.9Å; W605-V1208 HydrophobicContact CZ3-CG2 4.05Å; W605-V1246 HydrophobicContact CB-CB 4.48Å; W605-V1246 HydrophobicContact CB-CG1 3.82Å; W605-V1246 HydrophobicContact CG-CG1 4.18Å; W605-L1247 VanDerWaalsContact CA-O 3.24Å; W605-L1247 WeakPolarHBondContact CA-O 3.11Å; W605-L1247 WeakPolarHBondContact CB-O 3.3Å
606	N	65.7	Low	66.4	Low	69 Å²	69	72.4 Å²	72.4	37%	0.369	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.6	17.2	-179.7	64	-46	0	0	0	113.2	L604 E608	L604-N606 WeakPolarHBondContact CB-OD1 3.22Å; L604-N606 PolarHBondContact O-N 3.42Å; N606-E608 PolarHBondContact O-N 2.92Å
607	D	65.4	Low	66.7	Low	28 Å²	28	70.6 Å²	70.6	15%	0.15	36%	0.358	C	S	.	.			trans	-78.2	102.3	176.4	-85.2	-8.6	0	0	0	111.4	T600 S603 L604 I609 R733	T600-D607 WeakPolarHBondContact CB-OD2 3.02Å; T600-D607 PolarHBondContact OG1-OD2 2.85Å; S603-D607 WeakPolarHBondContact CA-OD2 3.36Å; L604-D607 HydrophobicContact CB-CB 4.47Å; L604-D607 PolarHBondContact N-OD2 2.83Å; L604-D607 PolarHBondContact O-N 2.78Å; D607-I609 VanDerWaalsContact C-N 3.33Å; D607-I609 PolarHBondContact O-N 2.75Å; D607-R733 IonicContact OD2-NH2 3.73Å; D607-R733 PolarHBondContact OD2-NH2 3.07Å
608	E	59.3	Low	67.1	Low	187 Å²	187	72 Å²	72	87%	0.874	36%	0.362	S	S	*	.			trans	-66.4	89.4	163.1	-70.5	177.8	-168.1	0	0	109.8	N606 P610	N606-E608 PolarHBondContact O-N 2.92Å; E608-P610 VanDerWaalsContact O-CD 3.26Å; E608-P610 WeakPolarHBondContact O-CD 3.44Å
609	I	61.8	Low	67.7	Low	21 Å²	21	70.3 Å²	70.3	11%	0.108	35%	0.35	C	S	.	.	P	Polyproline II helix	trans	-66.1	117.3	174.6	-59.9	176.6	0	0	0	108.5	N544 D607 S611	N544-I609 HydrophobicContact CB-CB 4.24Å; N544-I609 HydrophobicContact CB-CD1 4.26Å; D607-I609 VanDerWaalsContact C-N 3.33Å; D607-I609 PolarHBondContact O-N 2.75Å; I609-S611 PolarHBondContact O-N 2.83Å
610	P	57	Low	68.2	Low	52 Å²	52	73.6 Å²	73.6	34%	0.338	37%	0.365	S	S	.	.	P	Polyproline II helix	trans	-63.3	136.9	-179.7	20.3	-27.8	0	0	0	111.7	I599 E608 T612 I615	I599-P610 HydrophobicContact CD1-CG 4.28Å; I599-P610 HydrophobicContact CG1-CG 4.38Å; E608-P610 VanDerWaalsContact O-CD 3.26Å; E608-P610 WeakPolarHBondContact O-CD 3.44Å; P610-T612 PolarHBondContact O-N 3Å; P610-I615 HydrophobicContact CB-CD1 4.07Å; P610-I615 HydrophobicContact CB-CG1 4.17Å; P610-I615 HydrophobicContact CG-CD1 3.88Å; P610-I615 HydrophobicContact CG-CG1 4.3Å; P610-I615 WeakPolarHBondContact O-CD1 3.5Å
611	S	53.5	Low	68.8	Low	74 Å²	74	74.2 Å²	74.2	52%	0.517	37%	0.366	S	S	.	.	P	Polyproline II helix	trans	-59.1	134.9	178.3	-54.3	0	0	0	0	111.2	I609 T613 T614	I609-S611 PolarHBondContact O-N 2.83Å; S611-T613 PolarHBondContact O-N 3.16Å; S611-T614 PolarHBondContact O-N 2.95Å; S611-T614 PolarHBondContact O-OG1 3.38Å
612	T	56.6	Low	69.3	Low	64 Å²	64	76.8 Å²	76.8	39%	0.393	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57	-23.3	-175.6	51.6	0	0	0	0	114.3	F582 P610 T614	F582-T612 HydrophobicContact CD2-CG2 4.17Å; F582-T612 HydrophobicContact CE1-CG2 4.1Å; F582-T612 HydrophobicContact CE2-CG2 3.6Å; F582-T612 HydrophobicContact CZ-CG2 3.55Å; P610-T612 PolarHBondContact O-N 3Å; T612-T614 VanDerWaalsContact C-N 3.32Å; T612-T614 PolarHBondContact O-N 2.81Å
613	T	53.5	Low	69.9	Low	114 Å²	114	76.8 Å²	76.8	70%	0.699	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-24.7	176.3	-36.9	0	0	0	0	113.7	S611	S611-T613 PolarHBondContact O-N 3.16Å
614	T	57.8	Low	70.6	Confident	109 Å²	109	79.7 Å²	79.7	67%	0.669	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.5	-9.9	-179.4	64.5	0	0	0	0	113.3	S611 T612	S611-T614 PolarHBondContact O-N 2.95Å; S611-T614 PolarHBondContact O-OG1 3.38Å; T612-T614 VanDerWaalsContact C-N 3.32Å; T612-T614 PolarHBondContact O-N 2.81Å
615	I	65.4	Low	71.5	Confident	25 Å²	25	78.8 Å²	78.8	13%	0.128	39%	0.392	C	S	.	.			trans	-94.4	126.5	-173.9	-58.8	169	0	0	0	110.1	W561 P595 I599 P610 F617	W561-I615 HydrophobicContact CH2-CD1 3.88Å; W561-I615 HydrophobicContact CZ2-CD1 3.51Å; P595-I615 HydrophobicContact CB-CG2 3.76Å; I599-I615 HydrophobicContact CD1-CD1 4.09Å; P610-I615 HydrophobicContact CB-CD1 4.07Å; P610-I615 HydrophobicContact CB-CG1 4.17Å; P610-I615 HydrophobicContact CG-CD1 3.88Å; P610-I615 HydrophobicContact CG-CG1 4.3Å; P610-I615 WeakPolarHBondContact O-CD1 3.5Å; I615-F617 HydrophobicContact CB-CE2 4.37Å; I615-F617 HydrophobicContact CB-CZ 4.25Å; I615-F617 HydrophobicContact CG2-CD1 4.39Å; I615-F617 HydrophobicContact CG2-CE1 4.01Å; I615-F617 HydrophobicContact CG2-CE2 4.27Å; I615-F617 HydrophobicContact CG2-CZ 3.95Å
616	R	73.9	Confident	72.5	Confident	176 Å²	176	75.8 Å²	75.8	66%	0.664	39%	0.387	S	S	*	.			trans	-84.9	139.7	166.2	-67	-178.3	175.8	-168.1	-2.4	110.3	P595 E596	P595-R616 CarbonylContact C-O 3.6Å; P595-R616 WeakPolarHBondContact CA-O 3.33Å; E596-R616 HydrophobicContact CB-CB 4.4Å; E596-R616 HydrophobicContact CG-CB 3.95Å; E596-R616 PolarHBondContact N-O 3.43Å; E596-R616 WeakPolarHBondContact OE1-CB 3.4Å; E596-R616 VanDerWaalsContact OE2-CB 3.32Å; E596-R616 WeakPolarHBondContact OE2-CB 3.39Å; E596-R616 WeakPolarHBondContact OE2-CD 3.44Å
617	F	80.1	Confident	73.4	Confident	60 Å²	60	79.2 Å²	79.2	26%	0.263	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	121.1	179.7	-63.2	-81.2	0	0	0	110.1	W561 F582 Q593 R594 P595 I615	W561-F617 AromaticContact CH2-CE1 3.95Å; W561-F617 HydrophobicContact CH2-CE1 3.95Å; W561-F617 HydrophobicContact CH2-CZ 4.36Å; F582-F617 HydrophobicContact CB-CE1 3.76Å; F582-F617 HydrophobicContact CB-CZ 4.17Å; F582-F617 HydrophobicContact CD1-CZ 4.33Å; F582-F617 HydrophobicContact CG-CE1 4.44Å; F582-F617 HydrophobicContact CG-CZ 4.38Å; Q593-F617 HydrophobicContact CB-CB 4.35Å; Q593-F617 HydrophobicContact CB-CD1 3.52Å; Q593-F617 HydrophobicContact CB-CE1 3.9Å; Q593-F617 HydrophobicContact CB-CG 3.95Å; R594-F617 CarbonylContact O-C 3.47Å; R594-F617 VanDerWaalsContact O-CA 3.31Å; R594-F617 WeakPolarHBondContact O-CA 3.24Å; P595-F617 HydrophobicContact CB-CD1 4.44Å; I615-F617 HydrophobicContact CB-CE2 4.37Å; I615-F617 HydrophobicContact CB-CZ 4.25Å; I615-F617 HydrophobicContact CG2-CD1 4.39Å; I615-F617 HydrophobicContact CG2-CE1 4.01Å; I615-F617 HydrophobicContact CG2-CE2 4.27Å; I615-F617 HydrophobicContact CG2-CZ 3.95Å
618	K	78.3	Confident	74.6	Confident	178 Å²	178	78.1 Å²	78.1	77%	0.774	40%	0.4	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.2	-29.9	-177.7	-177.4	175.7	178.8	179.3	0	112.8	R594 E596	R594-K618 PolarHBondContact O-N 2.71Å; E596-K618 HydrophobicContact CG-CB 4.12Å
619	Q	80	Confident	76.1	Confident	80 Å²	80	73 Å²	73	37%	0.374	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	139.6	-173.2	-171.9	173.8	19.9	0	0	110.8	Q593 R594 H621	Q593-Q619 WeakPolarHBondContact CA-O 3.16Å; R594-Q619 HydrophobicContact CB-CB 4.42Å; R594-Q619 PolarHBondContact N-O 2.75Å; Q619-H621 PolarHBondContact NE2-CE1 3.33Å; Q619-H621 VanDerWaalsContact NE2-CE1 3.26Å; Q619-H621 PolarHBondContact NE2-NE2 3.24Å
620	Q	88.2	Confident	77.5	Confident	83 Å²	83	72.5 Å²	72.5	39%	0.388	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	139	171.4	-178.6	178.1	-73.3	0	0	109.9	R591 L592 Q593	R591-Q620 HydrophobicContact CG-CG 3.83Å; L592-Q620 CarbonylContact O-C 3.55Å; L592-Q620 VanDerWaalsContact O-CA 3.3Å; L592-Q620 WeakPolarHBondContact O-CA 3.43Å; Q593-Q620 HydrophobicContact CG-CB 4.25Å; Q593-Q620 HydrophobicContact CG-CG 3.92Å
621	H	86.2	Confident	79.1	Confident	44 Å²	44	72.5 Å²	72.5	20%	0.204	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	149.4	162.3	-59.6	110	0	0	0	109.1	R591 L592 Q619 Y623	R591-H621 CarbonylContact C-O 3.32Å; R591-H621 WeakPolarHBondContact CA-O 3.29Å; L592-H621 PolarHBondContact N-O 3.13Å; L592-H621 PolarHBondContact O-N 2.84Å; Q619-H621 PolarHBondContact NE2-CE1 3.33Å; Q619-H621 VanDerWaalsContact NE2-CE1 3.26Å; Q619-H621 PolarHBondContact NE2-NE2 3.24Å; H621-Y623 HydrophobicContact CB-CE2 3.69Å
622	I	89.3	Confident	80.9	Confident	84 Å²	84	70 Å²	70	43%	0.431	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	136.1	167.3	-58	171.5	0	0	0	106.5	L590 R591	L590-I622 WeakPolarHBondContact O-CA 3.42Å; R591-I622 HydrophobicContact CB-CG1 4.34Å; R591-I622 HydrophobicContact CG-CG1 4.12Å
623	Y	89.3	Confident	82.4	Confident	23 Å²	23	68.8 Å²	68.8	9%	0.09	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	141	171.5	-53.2	-72.9	0	0	0	107.7	Q589 L590 L592 H621 K726 L728	Q589-Y623 CarbonylContact C-O 3.55Å; Q589-Y623 WeakPolarHBondContact CA-O 3.27Å; L590-Y623 PolarHBondContact N-O 3.47Å; L590-Y623 PolarHBondContact O-N 2.85Å; L592-Y623 HydrophobicContact CD1-CD2 4.42Å; L592-Y623 HydrophobicContact CD1-CE2 4.41Å; L592-Y623 HydrophobicContact CD2-CE2 4.4Å; H621-Y623 HydrophobicContact CB-CE2 3.69Å; Y623-K726 HydrophobicContact CE1-CD 3.8Å; Y623-K726 PolarHBondContact OH-NZ 3.04Å; Y623-L728 HydrophobicContact CD2-CD1 3.59Å; Y623-L728 HydrophobicContact CE2-CD1 3.51Å; Y623-L728 HydrophobicContact CE2-CD2 4.02Å; Y623-L728 HydrophobicContact CE2-CG 4.43Å; Y623-L728 HydrophobicContact CG-CD1 4.13Å
624	D	88.8	Confident	83.9	Confident	66 Å²	66	65.4 Å²	65.4	35%	0.353	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	141.4	156.4	-169.4	21.2	0	0	0	108.4	T588 T626	T588-D624 WeakPolarHBondContact CB-OD1 3.43Å; T588-D624 PolarHBondContact OG1-OD1 2.88Å; D624-T626 WeakPolarHBondContact OD2-CB 3.16Å; D624-T626 VanDerWaalsContact OD2-CG2 3.22Å; D624-T626 WeakPolarHBondContact OD2-CG2 3.49Å; D624-T626 PolarHBondContact OD2-OG1 3.44Å
625	L	88	Confident	85	Confident	0 Å²	0	65 Å²	65	0%	0	33%	0.33	C	S	.	.			trans	-97.4	-2.7	179.2	-64.1	-176	0	0	0	113.1	L585 T588 L590 N627 A628 I651 L745 A748 S749	L585-L625 HydrophobicContact CD1-CD1 3.9Å; T588-L625 VanDerWaalsContact O-CB 3.27Å; T588-L625 WeakPolarHBondContact O-CB 3.41Å; T588-L625 WeakPolarHBondContact O-CG 3.44Å; T588-L625 PolarHBondContact O-N 2.95Å; L590-L625 HydrophobicContact CB-CD1 3.86Å; L590-L625 HydrophobicContact CB-CD2 4.02Å; L590-L625 HydrophobicContact CB-CG 3.82Å; L590-L625 HydrophobicContact CD2-CD1 4.26Å; L590-L625 HydrophobicContact CD2-CD2 4.07Å; L625-N627 PolarHBondContact O-N 2.9Å; L625-A628 HydrophobicContact CD2-CB 4.41Å; L625-A628 VanDerWaalsContact O-CB 3.24Å; L625-A628 WeakPolarHBondContact O-CB 3.23Å; L625-A628 PolarHBondContact O-N 3.1Å; L625-I651 HydrophobicContact CD2-CD1 4.45Å; L625-I651 HydrophobicContact CD2-CG2 3.8Å; L625-L745 HydrophobicContact CD1-CD2 3.7Å; L625-A748 HydrophobicContact CB-CB 4.43Å; L625-A748 HydrophobicContact CD1-CB 3.86Å; L625-S749 WeakPolarHBondContact O-CA 3.23Å
626	T	85.1	Confident	85.6	Confident	55 Å²	55	67.6 Å²	67.6	34%	0.337	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.2	125.9	176.5	55.8	0	0	0	0	110.8	T588 D624 A628	T588-T626 HydrophobicContact CG2-CG2 3.99Å; D624-T626 WeakPolarHBondContact OD2-CB 3.16Å; D624-T626 VanDerWaalsContact OD2-CG2 3.22Å; D624-T626 WeakPolarHBondContact OD2-CG2 3.49Å; D624-T626 PolarHBondContact OD2-OG1 3.44Å; T626-A628 PolarHBondContact O-N 3.1Å; T626-A628 VanDerWaalsContact O-N 3.07Å
627	N	85	Confident	86	Confident	140 Å²	140	60.6 Å²	60.6	75%	0.749	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.9	13.9	-177.2	-52.3	-41.5	0	0	0	116.1	L625 S749	L625-N627 PolarHBondContact O-N 2.9Å; N627-S749 PolarHBondContact N-O 2.76Å
628	A	88.8	Confident	86.1	Confident	6 Å²	6	62 Å²	62	5%	0.05	35%	0.353	C	S	.	.			trans	-74.1	143.2	172.3	0	0	0	0	0	111.3	L625 T626 I651 T652 V653 S749	L625-A628 HydrophobicContact CD2-CB 4.41Å; L625-A628 VanDerWaalsContact O-CB 3.24Å; L625-A628 WeakPolarHBondContact O-CB 3.23Å; L625-A628 PolarHBondContact O-N 3.1Å; T626-A628 PolarHBondContact O-N 3.1Å; T626-A628 VanDerWaalsContact O-N 3.07Å; A628-I651 HydrophobicContact CB-CG2 4.06Å; A628-T652 CarbonylContact C-O 3.59Å; A628-T652 VanDerWaalsContact CA-O 3.26Å; A628-T652 WeakPolarHBondContact CA-O 3.33Å; A628-T652 WeakPolarHBondContact CB-O 3.2Å; A628-V653 HydrophobicContact CB-CG2 4.37Å; A628-S749 WeakPolarHBondContact O-CB 3.25Å
629	T	90.8	Very high	86.1	Confident	79 Å²	79	55.1 Å²	55.1	49%	0.485	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	121.3	177.2	69.6	0	0	0	0	111	I651 T652	T629-I651 WeakPolarHBondContact O-CA 3.47Å; T629-T652 PolarHBondContact N-O 3.04Å; T629-T652 PolarHBondContact O-N 2.8Å; T629-T652 WeakPolarHBondContact OG1-CB 3.43Å
630	V	91.8	Very high	86	Confident	11 Å²	11	59.5 Å²	59.5	7%	0.067	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	103.6	-178.8	-175.2	0	0	0	0	110.9	I649 C650 I651 Y742 L745	V630-I649 HydrophobicContact CG1-CG2 3.9Å; V630-C650 WeakPolarHBondContact CA-O 3.23Å; V630-I651 HydrophobicContact CG2-CG1 4.49Å; V630-I651 HydrophobicContact CG2-CG2 4.39Å; V630-Y742 HydrophobicContact CG1-CD2 3.95Å; V630-Y742 HydrophobicContact CG1-CE2 3.79Å; V630-Y742 WeakPolarHBondContact O-CE2 3.33Å; V630-Y742 PolarHBondContact O-OH 3.11Å; V630-Y742 VanDerWaalsContact O-OH 3.06Å; V630-L745 HydrophobicContact CG1-CB 4.01Å; V630-L745 HydrophobicContact CG2-CB 4.4Å
631	T	91.6	Very high	85.8	Confident	52 Å²	52	61 Å²	61	32%	0.319	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	170.4	-174.9	59.7	0	0	0	0	111.9	C650	T631-C650 PolarHBondContact N-O 3.09Å; T631-C650 PolarHBondContact O-N 2.88Å
632	L	90.4	Very high	85.7	Confident	21 Å²	21	61.1 Å²	61.1	11%	0.11	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	138.6	168.9	-64.2	174.6	0	0	0	107.7	L642 W643 I649 Y742	L632-L642 HydrophobicContact CD1-CD1 3.53Å; L632-L642 HydrophobicContact CD1-CG 3.81Å; L632-W643 HydrophobicContact CD1-CE3 4.28Å; L632-W643 HydrophobicContact CD1-CH2 4.4Å; L632-W643 HydrophobicContact CD1-CZ3 3.81Å; L632-I649 HydrophobicContact CD2-CB 4.47Å; L632-I649 HydrophobicContact CD2-CG1 3.86Å; L632-Y742 HydrophobicContact CD2-CD2 3.67Å; L632-Y742 HydrophobicContact CD2-CE2 4.06Å; L632-Y742 HydrophobicContact CD2-CG 4.34Å; L632-Y742 HydrophobicContact CG-CD2 3.96Å; L632-Y742 HydrophobicContact CG-CE2 3.86Å
633	L	87.9	Confident	85.5	Confident	38 Å²	38	58.1 Å²	58.1	20%	0.199	34%	0.337	C	S	.	.	S	Bend	trans	-119.5	140.7	179.2	-64.4	-179.9	0	0	0	111.4	Y568 Y647 P648 C650 Y729	Y568-L633 HydrophobicContact CD1-CB 4.31Å; Y568-L633 HydrophobicContact CD1-CD1 4.32Å; Y568-L633 HydrophobicContact CE1-CB 3.96Å; L633-Y647 WeakPolarHBondContact O-CB 3.33Å; L633-P648 HydrophobicContact CB-CG 4.35Å; L633-P648 PolarHBondContact N-O 3.1Å; L633-P648 WeakPolarHBondContact O-CD 3.22Å; L633-C650 HydrophobicContact CD1-CB 3.62Å; L633-C650 HydrophobicContact CG-CB 3.84Å; L633-Y729 HydrophobicContact CD1-CD1 4.18Å; L633-Y729 HydrophobicContact CD1-CE1 3.74Å
634	P	85.1	Confident	85.3	Confident	43 Å²	43	59 Å²	59	28%	0.279	35%	0.347	S	S	.	.	S	Bend	cis	-58.7	157	-9	-25	35.6	0	0	0	114	P570 L637 Y647	P570-P634 HydrophobicContact CB-CG 3.94Å; P634-L637 WeakPolarHBondContact O-CD1 3.29Å; P634-L637 WeakPolarHBondContact O-CG 3.47Å; P634-Y647 VanDerWaalsContact CD-CD1 3.45Å
635	C	81.5	Confident	85.2	Confident	100 Å²	100	58.4 Å²	58.4	68%	0.676	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	153.9	167	-59.7	0	0	0	0	109.7	L637	C635-L637 PolarHBondContact O-N 3.45Å
636	G	78.4	Confident	85	Confident	81 Å²	81	60.5 Å²	60.5	84%	0.835	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.9	15	178.9	0	0	0	0	0	115.7	V638	G636-V638 PolarHBondContact O-N 3.07Å; G636-V638 VanDerWaalsContact O-N 3.1Å
637	L	82.3	Confident	85.2	Confident	29 Å²	29	59.4 Å²	59.4	15%	0.152	34%	0.338	C	S	.	.			trans	-55.7	115.9	174.3	-80.6	167.2	0	0	0	111.9	P634 C635 G639 R641 L642 Y647	P634-L637 WeakPolarHBondContact O-CD1 3.29Å; P634-L637 WeakPolarHBondContact O-CG 3.47Å; C635-L637 PolarHBondContact O-N 3.45Å; L637-G639 PolarHBondContact O-N 2.8Å; L637-R641 HydrophobicContact CD2-CB 4.13Å; L637-L642 HydrophobicContact CB-CD1 4.47Å; L637-Y647 HydrophobicContact CD1-CD1 4.3Å; L637-Y647 HydrophobicContact CD1-CD2 3.88Å; L637-Y647 HydrophobicContact CD1-CG 3.73Å; L637-Y647 HydrophobicContact CD2-CD1 4.16Å; L637-Y647 HydrophobicContact CD2-CD2 3.68Å; L637-Y647 HydrophobicContact CD2-CE1 4.01Å; L637-Y647 HydrophobicContact CD2-CE2 3.54Å; L637-Y647 HydrophobicContact CD2-CG 4.01Å; L637-Y647 HydrophobicContact CG-CD2 4.47Å
638	V	82.2	Confident	85.6	Confident	90 Å²	90	52.7 Å²	52.7	55%	0.545	30%	0.303	S	S	.	.			trans	-43.4	136.1	170.5	178.1	0	0	0	0	110.2	G636 K640 R641 L642	G636-V638 PolarHBondContact O-N 3.07Å; G636-V638 VanDerWaalsContact O-N 3.1Å; V638-K640 PolarHBondContact O-N 3.31Å; V638-R641 WeakPolarHBondContact O-CA 3.37Å; V638-R641 PolarHBondContact O-N 3.35Å; V638-L642 PolarHBondContact O-N 3.31Å
639	G	76.7	Confident	85.8	Confident	32 Å²	32	52.4 Å²	52.4	33%	0.33	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.4	-35.7	-171.2	0	0	0	0	0	115.2	L637 R641 L642 R1200	L637-G639 PolarHBondContact O-N 2.8Å; G639-R641 VanDerWaalsContact C-N 3.29Å; G639-R641 PolarHBondContact O-N 3.48Å; G639-L642 WeakPolarHBondContact O-CB 3.41Å; G639-L642 PolarHBondContact O-N 2.89Å; G639-R1200 VanDerWaalsContact O-CZ 3.31Å; G639-R1200 PolarHBondContact O-NH1 2.72Å; G639-R1200 PolarHBondContact O-NH2 3.07Å
640	K	77.9	Confident	85.9	Confident	172 Å²	172	48.9 Å²	48.9	75%	0.748	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-29.3	174.8	-61.8	165.5	-173	155.1	0	113.5	V638	V638-K640 PolarHBondContact O-N 3.31Å
641	R	84.4	Confident	86	Confident	115 Å²	115	48.3 Å²	48.3	43%	0.434	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.4	-15.9	-178.3	-68.7	-180	170.5	154	5.4	113.3	L637 V638 G639 W643 S644 Y647 D1067	L637-R641 HydrophobicContact CD2-CB 4.13Å; V638-R641 WeakPolarHBondContact O-CA 3.37Å; V638-R641 PolarHBondContact O-N 3.35Å; G639-R641 VanDerWaalsContact C-N 3.29Å; G639-R641 PolarHBondContact O-N 3.48Å; R641-W643 PolarHBondContact O-N 3.26Å; R641-S644 VanDerWaalsContact O-CB 3.26Å; R641-S644 WeakPolarHBondContact O-CB 3.43Å; R641-S644 PolarHBondContact O-N 2.83Å; R641-Y647 HydrophobicContact CB-CE2 4.14Å; R641-D1067 IonicContact CZ-OD2 3.65Å; R641-D1067 IonicContact NH1-OD2 2.65Å; R641-D1067 PolarHBondContact NH1-OD2 3.38Å; R641-D1067 IonicContact NH2-OD2 3.65Å; R641-D1067 PolarHBondContact NH2-OD2 3.4Å
642	L	84	Confident	86	Confident	47 Å²	47	47.5 Å²	47.5	25%	0.246	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-47.2	-53.2	-172.8	-167.5	72.1	0	0	0	114.3	L632 L637 V638 G639 K738	L632-L642 HydrophobicContact CD1-CD1 3.53Å; L632-L642 HydrophobicContact CD1-CG 3.81Å; L637-L642 HydrophobicContact CB-CD1 4.47Å; V638-L642 PolarHBondContact O-N 3.31Å; G639-L642 WeakPolarHBondContact O-CB 3.41Å; G639-L642 PolarHBondContact O-N 2.89Å; L642-K738 PolarHBondContact O-NZ 3.01Å
643	W	86.4	Confident	86	Confident	21 Å²	21	47.2 Å²	47.2	8%	0.08	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.4	5.3	-177.9	-58.2	136	0	0	0	114.8	L632 R641 R645 C735 E739 Y742 W1202	L632-W643 HydrophobicContact CD1-CE3 4.28Å; L632-W643 HydrophobicContact CD1-CH2 4.4Å; L632-W643 HydrophobicContact CD1-CZ3 3.81Å; R641-W643 PolarHBondContact O-N 3.26Å; W643-R645 PolarHBondContact O-N 3.19Å; W643-C735 WeakPolarHBondContact O-CA 3.22Å; W643-C735 VanDerWaalsContact O-CB 3.23Å; W643-C735 WeakPolarHBondContact O-CB 3.45Å; W643-E739 HydrophobicContact CD2-CB 3.7Å; W643-E739 HydrophobicContact CD2-CG 4.07Å; W643-E739 VanDerWaalsContact CE2-OE1 3.31Å; W643-E739 HydrophobicContact CE3-CB 3.92Å; W643-E739 HydrophobicContact CE3-CG 4.48Å; W643-E739 HydrophobicContact CG-CB 4.01Å; W643-E739 HydrophobicContact CH2-CG 4.37Å; W643-E739 HydrophobicContact CZ2-CB 4.37Å; W643-E739 HydrophobicContact CZ2-CG 3.89Å; W643-E739 HydrophobicContact CZ3-CB 4.38Å; W643-E739 PolarHBondContact NE1-OE1 3.44Å; W643-Y742 AromaticContact CH2-CD1 3.54Å; W643-Y742 HydrophobicContact CH2-CD1 3.54Å; W643-Y742 HydrophobicContact CH2-CE1 4.2Å; W643-Y742 HydrophobicContact CH2-CG 4.07Å; W643-Y742 AromaticContact CZ3-CD1 3.81Å; W643-Y742 HydrophobicContact CZ3-CD1 3.81Å; W643-Y742 AromaticContact CZ3-CG 3.83Å; W643-Y742 HydrophobicContact CZ3-CG 3.83Å; W643-W1202 HydrophobicContact CB-CH2 4.2Å; W643-W1202 HydrophobicContact CB-CZ2 4.4Å
644	S	84.5	Confident	85.7	Confident	41 Å²	41	48.9 Å²	48.9	29%	0.287	28%	0.282	S	S	.	.			trans	-58.6	134.3	177.1	175.4	0	0	0	0	111.4	R641 K646 Y647 K738	R641-S644 VanDerWaalsContact O-CB 3.26Å; R641-S644 WeakPolarHBondContact O-CB 3.43Å; R641-S644 PolarHBondContact O-N 2.83Å; S644-K646 PolarHBondContact O-N 2.82Å; S644-K646 VanDerWaalsContact O-N 3.16Å; S644-K646 PolarHBondContact OG-N 3.45Å; S644-Y647 PolarHBondContact O-N 3.39Å; S644-K738 WeakPolarHBondContact O-CD 3.45Å; S644-K738 PolarHBondContact O-NZ 3.36Å
645	R	85.7	Confident	84.9	Confident	54 Å²	54	50.5 Å²	50.5	20%	0.204	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-15.2	174.7	65.7	-177.5	-178.1	-158.4	-1.7	114.1	W643 Y647 C735 N1249	W643-R645 PolarHBondContact O-N 3.19Å; R645-Y647 VanDerWaalsContact C-N 3.28Å; R645-Y647 PolarHBondContact O-N 2.76Å; R645-C735 PolarHBondContact N-SG 2.94Å; R645-N1249 PolarHBondContact NH1-OD1 2.86Å
646	K	84.8	Confident	83.8	Confident	43 Å²	43	53.4 Å²	53.4	19%	0.187	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-29.6	173.7	-165.7	-166.9	176.2	-158.1	0	112.9	S644 F731 D1063	S644-K646 PolarHBondContact O-N 2.82Å; S644-K646 VanDerWaalsContact O-N 3.16Å; S644-K646 PolarHBondContact OG-N 3.45Å; K646-F731 WeakPolarHBondContact O-CE1 3.28Å; K646-D1063 HydrophobicContact CD-CB 3.84Å; K646-D1063 PolarHBondContact NZ-O 2.82Å
647	Y	89.6	Confident	81.9	Confident	32 Å²	32	53.9 Å²	53.9	13%	0.125	29%	0.286	C	S	.	.	S	Bend	trans	-106.8	131.2	-170.1	-62.3	-61	0	0	0	111.4	L633 P634 L637 R641 S644 R645 K738	L633-Y647 WeakPolarHBondContact O-CB 3.33Å; P634-Y647 VanDerWaalsContact CD-CD1 3.45Å; L637-Y647 HydrophobicContact CD1-CD1 4.3Å; L637-Y647 HydrophobicContact CD1-CD2 3.88Å; L637-Y647 HydrophobicContact CD1-CG 3.73Å; L637-Y647 HydrophobicContact CD2-CD1 4.16Å; L637-Y647 HydrophobicContact CD2-CD2 3.68Å; L637-Y647 HydrophobicContact CD2-CE1 4.01Å; L637-Y647 HydrophobicContact CD2-CE2 3.54Å; L637-Y647 HydrophobicContact CD2-CG 4.01Å; L637-Y647 HydrophobicContact CG-CD2 4.47Å; R641-Y647 HydrophobicContact CB-CE2 4.14Å; S644-Y647 PolarHBondContact O-N 3.39Å; R645-Y647 VanDerWaalsContact C-N 3.28Å; R645-Y647 PolarHBondContact O-N 2.76Å; Y647-K738 WeakPolarHBondContact O-CE 3.45Å; Y647-K738 PolarHBondContact O-NZ 3.18Å
648	P	92.5	Very high	79.4	Confident	0 Å²	0	63.7 Å²	63.7	0%	0	32%	0.321	C	S	.	.	P	Polyproline II helix	trans	-76.8	157.4	-177.8	31.4	-35.4	0	0	0	113.2	Y568 L633 L730 F731	Y568-P648 HydrophobicContact CD1-CG 3.83Å; Y568-P648 HydrophobicContact CD2-CG 3.77Å; Y568-P648 HydrophobicContact CE1-CG 3.79Å; Y568-P648 HydrophobicContact CE2-CG 3.73Å; Y568-P648 HydrophobicContact CG-CG 3.82Å; Y568-P648 VanDerWaalsContact CZ-CD 3.46Å; L633-P648 HydrophobicContact CB-CG 4.35Å; L633-P648 PolarHBondContact N-O 3.1Å; L633-P648 WeakPolarHBondContact O-CD 3.22Å; P648-L730 CarbonylContact C-O 3.56Å; P648-L730 WeakPolarHBondContact CA-O 3.33Å; P648-F731 HydrophobicContact CB-CD1 4.08Å; P648-F731 HydrophobicContact CB-CD2 4.39Å; P648-F731 HydrophobicContact CB-CE1 3.83Å; P648-F731 HydrophobicContact CB-CE2 4.14Å; P648-F731 HydrophobicContact CB-CG 4.36Å; P648-F731 HydrophobicContact CB-CZ 3.86Å; P648-F731 HydrophobicContact CG-CE1 4.06Å; P648-F731 HydrophobicContact CG-CZ 4.08Å
649	I	93.4	Very high	77.2	Confident	0 Å²	0	67.8 Å²	67.8	0%	0	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	128.4	153.9	-57.4	166.7	0	0	0	106.7	V630 L632 I651 L730 K738 W741 Y742 L745	V630-I649 HydrophobicContact CG1-CG2 3.9Å; L632-I649 HydrophobicContact CD2-CB 4.47Å; L632-I649 HydrophobicContact CD2-CG1 3.86Å; I649-I651 HydrophobicContact CG2-CG1 4.41Å; I649-L730 HydrophobicContact CB-CB 4.5Å; I649-L730 PolarHBondContact N-O 3.12Å; I649-L730 PolarHBondContact O-N 2.91Å; I649-K738 HydrophobicContact CD1-CG 4.1Å; I649-K738 HydrophobicContact CG1-CG 4.09Å; I649-W741 HydrophobicContact CD1-CB 4.27Å; I649-Y742 HydrophobicContact CG1-CD2 4.28Å; I649-Y742 HydrophobicContact CG2-CD2 4.08Å; I649-L745 HydrophobicContact CD1-CD1 4.31Å; I649-L745 HydrophobicContact CG2-CD1 4.22Å
650	C	93.2	Very high	75.1	Confident	4 Å²	4	75.7 Å²	75.7	3%	0.027	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	131.1	169.5	-171.8	0	0	0	0	109.6	V630 T631 L633 L728 Y729	V630-C650 WeakPolarHBondContact CA-O 3.23Å; T631-C650 PolarHBondContact N-O 3.09Å; T631-C650 PolarHBondContact O-N 2.88Å; L633-C650 HydrophobicContact CD1-CB 3.62Å; L633-C650 HydrophobicContact CG-CB 3.84Å; C650-L728 WeakPolarHBondContact CA-O 3.26Å; C650-Y729 HydrophobicContact CB-CD1 4.17Å; C650-Y729 HydrophobicContact CB-CE1 4.3Å; C650-Y729 VanDerWaalsContact SG-CE1 3.53Å
651	I	93.6	Very high	72.9	Confident	0 Å²	0	78.8 Å²	78.8	0%	0	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	117.8	168.8	-50.1	174.8	0	0	0	106.8	L590 L625 A628 T629 V630 I649 V653 N727 L728 L730 L745	L590-I651 HydrophobicContact CD2-CD1 3.63Å; L625-I651 HydrophobicContact CD2-CD1 4.45Å; L625-I651 HydrophobicContact CD2-CG2 3.8Å; A628-I651 HydrophobicContact CB-CG2 4.06Å; T629-I651 WeakPolarHBondContact O-CA 3.47Å; V630-I651 HydrophobicContact CG2-CG1 4.49Å; V630-I651 HydrophobicContact CG2-CG2 4.39Å; I649-I651 HydrophobicContact CG2-CG1 4.41Å; I651-V653 HydrophobicContact CG2-CG2 3.89Å; I651-N727 CarbonylContact O-C 3.57Å; I651-N727 WeakPolarHBondContact O-CA 3.5Å; I651-L728 HydrophobicContact CB-CB 4.28Å; I651-L728 PolarHBondContact N-O 2.92Å; I651-L728 PolarHBondContact O-N 2.77Å; I651-L730 HydrophobicContact CD1-CD1 3.79Å; I651-L745 HydrophobicContact CD1-CD1 4.02Å; I651-L745 HydrophobicContact CD1-CD2 3.91Å; I651-L745 HydrophobicContact CD1-CG 4.49Å
652	T	92.2	Very high	70.3	Confident	35 Å²	35	81.2 Å²	81.2	22%	0.215	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	108.6	170.9	-55.6	0	0	0	0	108.7	A628 T629 A725	A628-T652 CarbonylContact C-O 3.59Å; A628-T652 VanDerWaalsContact CA-O 3.26Å; A628-T652 WeakPolarHBondContact CA-O 3.33Å; A628-T652 WeakPolarHBondContact CB-O 3.2Å; T629-T652 PolarHBondContact N-O 3.04Å; T629-T652 PolarHBondContact O-N 2.8Å; T629-T652 WeakPolarHBondContact OG1-CB 3.43Å; T652-A725 HydrophobicContact CG2-CB 3.85Å
653	V	88.9	Confident	67.6	Low	14 Å²	14	86.5 Å²	86.5	9%	0.085	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	126.3	179.6	-175.3	0	0	0	0	109.4	A628 I651 T655 K726 L728	A628-V653 HydrophobicContact CB-CG2 4.37Å; I651-V653 HydrophobicContact CG2-CG2 3.89Å; V653-T655 PolarHBondContact O-N 3.46Å; V653-K726 PolarHBondContact N-O 3.21Å; V653-K726 PolarHBondContact O-N 2.82Å; V653-L728 HydrophobicContact CG2-CD1 4.31Å
654	P	81.9	Confident	65.1	Low	73 Å²	73	92.2 Å²	92.2	47%	0.474	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	129.2	172.5	28.6	-33.4	0	0	0	110
655	T	69.7	Low	62.3	Low	78 Å²	78	101.9 Å²	101.9	48%	0.479	46%	0.464	S	S	.	.			trans	-98.7	113.3	175.6	-43.7	0	0	0	0	109.1	V653 S657 N724	V653-T655 PolarHBondContact O-N 3.46Å; T655-S657 PolarHBondContact O-N 3.08Å; T655-N724 WeakPolarHBondContact CA-O 3.41Å; T655-N724 WeakPolarHBondContact CB-O 3.48Å; T655-N724 PolarHBondContact N-O 3.38Å; T655-N724 PolarHBondContact OG1-O 2.83Å; T655-N724 VanDerWaalsContact OG1-O 3.09Å
656	E	57.7	Low	59.7	Low	161 Å²	161	107.2 Å²	107.2	75%	0.752	50%	0.495	S	S	*	.			trans	-58.1	121.8	-179.4	-71.7	-160	155.8	0	0	112.4	R658	E656-R658 PolarHBondContact O-N 2.77Å
657	S	39.1	Very low	57	Low	91 Å²	91	111.9 Å²	111.9	64%	0.636	52%	0.523	S	S	*	.			trans	-91.6	99.1	179.9	59.3	0	0	0	0	112	T655	T655-S657 PolarHBondContact O-N 3.08Å
658	R	29.5	Very low	54.1	Low	235 Å²	235	116 Å²	116	89%	0.887	56%	0.556	S	S	*	*			trans	70.1	73.7	162.4	-48.4	178.2	-177.4	-172.5	1.1	117.3	E656 K660	E656-R658 PolarHBondContact O-N 2.77Å; R658-K660 PolarHBondContact O-N 2.85Å
659	F	35.1	Very low	51.2	Low	175 Å²	175	123.9 Å²	123.9	77%	0.768	60%	0.597	S	S	*	*	P	Polyproline II helix	trans	-65.6	117	145.4	-95.7	-80.1	0	0	0	109.7	R661	F659-R661 PolarHBondContact O-N 3.32Å
660	K	34	Very low	48.2	Very low	199 Å²	199	129.6 Å²	129.6	87%	0.865	63%	0.634	S	S	*	*	P	Polyproline II helix	trans	-66.1	123.1	169	-76.6	-179.2	176.1	177.9	0	108.2	R658 K662	R658-K660 PolarHBondContact O-N 2.85Å; K660-K662 PolarHBondContact O-N 2.76Å
661	R	31.1	Very low	45	Very low	236 Å²	236	135 Å²	135	89%	0.891	67%	0.672	S	S	*	*	P	Polyproline II helix	trans	-60.2	120.6	170.9	-65.5	-177.6	-170.7	150.2	1.8	109.5	F659	F659-R661 PolarHBondContact O-N 3.32Å
662	K	29.4	Very low	42	Very low	167 Å²	167	140.2 Å²	140.2	73%	0.726	71%	0.708	S	S	*	*			trans	-111	117.1	158.3	-151.8	-171.3	179.4	-138.7	0	105.9	K660 E664	K660-K662 PolarHBondContact O-N 2.76Å; K662-E664 VanDerWaalsContact CE-OE1 3.26Å; K662-E664 WeakPolarHBondContact CE-OE1 3.18Å; K662-E664 IonicContact NZ-OE1 2.64Å; K662-E664 PolarHBondContact NZ-OE1 3.39Å; K662-E664 PolarHBondContact O-N 2.77Å; K662-E664 VanDerWaalsContact O-N 3.16Å
663	N	27.5	Very low	39	Very low	157 Å²	157	144.1 Å²	144.1	84%	0.84	73%	0.732	S	S	*	*			trans	-81.1	93.6	-176.2	-79	-2.1	0	0	0	110
664	E	32.9	Very low	36.3	Very low	142 Å²	142	148.9 Å²	148.9	66%	0.664	77%	0.766	S	S	*	*			trans	-121.2	119.4	166.6	-78.7	163.5	-148.5	0	0	108.3	K662	K662-E664 VanDerWaalsContact CE-OE1 3.26Å; K662-E664 WeakPolarHBondContact CE-OE1 3.18Å; K662-E664 IonicContact NZ-OE1 2.64Å; K662-E664 PolarHBondContact NZ-OE1 3.39Å; K662-E664 PolarHBondContact O-N 2.77Å; K662-E664 VanDerWaalsContact O-N 3.16Å
665	R	27.1	Very low	33.9	Very low	244 Å²	244	153.9 Å²	153.9	92%	0.921	78%	0.781	S	S	*	*			trans	-76.5	132.1	170.9	-75.5	178	166.2	118.7	-9.5	108
666	L	30.6	Very low	32.1	Very low	165 Å²	165	155.4 Å²	155.4	86%	0.864	79%	0.792	S	S	*	*			trans	-163.8	152.8	142.1	-107.2	155.8	0	0	0	110
667	D	28.4	Very low	30.7	Very low	142 Å²	142	154.9 Å²	154.9	76%	0.759	80%	0.795	S	S	*	*			trans	-85.4	-175.4	-159.6	-53.5	-85.4	0	0	0	114.3
668	S	28.6	Very low	30.3	Very low	117 Å²	117	157.3 Å²	157.3	82%	0.818	80%	0.799	S	S	*	*			trans	84.6	79.4	173	74.6	0	0	0	0	119.1
669	L	30.8	Very low	30.2	Very low	166 Å²	166	153.9 Å²	153.9	87%	0.869	80%	0.797	S	S	*	*			trans	-132.3	125.2	145.9	-88	170.9	0	0	0	109.6	S671	L669-S671 PolarHBondContact O-N 2.61Å
670	P	30.9	Very low	29.9	Very low	120 Å²	120	152.4 Å²	152.4	78%	0.779	80%	0.796	S	S	*	*			trans	-76.8	110.6	-170	28.8	-34.1	0	0	0	112.9	S672	P670-S672 PolarHBondContact O-N 3.49Å
671	S	26.2	Very low	29.7	Very low	117 Å²	117	148.5 Å²	148.5	82%	0.818	79%	0.794	S	S	*	*			trans	-75.1	101.4	169.4	55.8	0	0	0	0	111.3	L669	L669-S671 PolarHBondContact O-N 2.61Å
672	S	30.2	Very low	29.5	Very low	110 Å²	110	143.9 Å²	143.9	77%	0.769	79%	0.792	S	S	*	*			trans	-126.8	66.5	175.7	-73.7	0	0	0	0	112.6	P670	P670-S672 PolarHBondContact O-N 3.49Å
673	T	28.2	Very low	29.5	Very low	117 Å²	117	141.5 Å²	141.5	72%	0.718	80%	0.796	S	S	*	*			trans	-89.4	135.6	158.3	52.2	0	0	0	0	110.2	F675	T673-F675 HydrophobicContact CG2-CE2 4.4Å
674	S	32.2	Very low	29.7	Very low	114 Å²	114	139.5 Å²	139.5	80%	0.797	80%	0.795	S	S	*	*			trans	-134.2	123.6	155.1	53.2	0	0	0	0	110.5
675	F	32.8	Very low	29.6	Very low	178 Å²	178	140.2 Å²	140.2	78%	0.781	80%	0.803	S	S	*	*			trans	-102.6	164.7	169.3	-63.6	-93.5	0	0	0	108.6	T673	T673-F675 HydrophobicContact CG2-CE2 4.4Å
676	P	32.5	Very low	29.9	Very low	110 Å²	110	135.1 Å²	135.1	71%	0.714	80%	0.799	S	S	*	*				-137.6	164.8	108.6	16	5.5	0	0	0	111.9
677	N	27.9	Very low	29.8	Very low	150 Å²	150	132.6 Å²	132.6	80%	0.802	79%	0.792	S	S	*	*			cis	-153.4	130.1	-9.2	-102.9	-23.6	0	0	0	107.4
678	I	31.1	Very low	29.9	Very low	143 Å²	143	132.4 Å²	132.4	73%	0.733	80%	0.796	S	S	*	*			trans	-135.6	121.8	157.3	-64.3	-175.5	0	0	0	107.8	L680	I678-L680 PolarHBondContact O-N 2.88Å
679	I	26.6	Very low	29.9	Very low	162 Å²	162	133.7 Å²	133.7	83%	0.831	79%	0.792	S	S	*	*			trans	-75.2	120.4	176.3	-59.6	169.6	0	0	0	108.2
680	L	29.8	Very low	29.9	Very low	145 Å²	145	135 Å²	135	76%	0.759	79%	0.794	S	S	*	*			trans	-118.6	114.8	168.6	-161.9	74.8	0	0	0	108.6	I678	I678-L680 PolarHBondContact O-N 2.88Å
681	S	29.3	Very low	29.9	Very low	116 Å²	116	135.1 Å²	135.1	81%	0.811	79%	0.793	S	S	*	*			trans	-70.7	132.9	-179	31.5	0	0	0	0	111.5
682	T	26	Very low	30.2	Very low	139 Å²	139	134.2 Å²	134.2	85%	0.853	79%	0.786	S	S	*	*			trans	-102.7	117.4	-169.5	42.9	0	0	0	0	113.7
683	S	30.3	Very low	30.3	Very low	118 Å²	118	136.8 Å²	136.8	83%	0.825	79%	0.791	S	S	*	*			trans	-164.6	139.3	153	55.7	0	0	0	0	109.3
684	S	32.2	Very low	30.6	Very low	115 Å²	115	138.8 Å²	138.8	80%	0.804	80%	0.797	S	S	*	*			cis	-153.8	152.4	-10.1	45.7	0	0	0	0	109.7
685	N	30.4	Very low	30.8	Very low	157 Å²	157	138.6 Å²	138.6	84%	0.84	80%	0.795	S	S	*	*			trans	-87.1	143.1	-177.7	-66.2	-31.8	0	0	0	112.3
686	V	33.1	Very low	30.9	Very low	136 Å²	136	135.8 Å²	135.8	82%	0.824	79%	0.793	S	S	*	*			trans	-143.1	113.8	143.5	-175.2	0	0	0	0	109.5	V688	V686-V688 HydrophobicContact CG1-CG2 4.36Å
687	P	27.5	Very low	30.8	Very low	113 Å²	113	137.5 Å²	137.5	73%	0.734	80%	0.796	S	S	*	*			trans	-106.4	138	163.6	35.3	-26.2	0	0	0	111.1
688	V	31.9	Very low	31	Very low	137 Å²	137	135.3 Å²	135.3	83%	0.83	79%	0.788	S	S	*	*			trans	-134.3	139.9	164.8	-178.5	0	0	0	0	108.5	V686	V686-V688 HydrophobicContact CG1-CG2 4.36Å
689	I	28.3	Very low	31.3	Very low	145 Å²	145	134 Å²	134	74%	0.744	79%	0.792	S	S	*	*			trans	-113.8	134.6	177	-61.4	165.4	0	0	0	106.5
690	E	30.8	Very low	31.6	Very low	192 Å²	192	133.7 Å²	133.7	90%	0.897	79%	0.79	S	S	*	*			trans	-164.3	173.9	139.8	-113.2	158.7	-150.6	0	0	111.5
691	T	31	Very low	32	Very low	124 Å²	124	132.3 Å²	132.3	76%	0.761	79%	0.79	S	S	*	*			trans	-108.9	165.7	-151.7	43.7	0	0	0	0	115.5
692	S	32	Very low	32.3	Very low	98 Å²	98	132.6 Å²	132.6	69%	0.685	79%	0.792	S	S	*	*			trans	-29.5	146.8	169.9	52.4	0	0	0	0	117.9
693	D	33.3	Very low	32.7	Very low	163 Å²	163	130.5 Å²	130.5	87%	0.872	79%	0.788	S	S	*	*				-153.1	-177.6	111.3	-102.7	-18.6	0	0	0	112.8
694	L	34.4	Very low	32.9	Very low	159 Å²	159	127.9 Å²	127.9	83%	0.832	78%	0.78	S	S	*	*			trans	-112.7	-170.3	-154.4	-144	79.9	0	0	0	114.4
695	S	35.3	Very low	33.1	Very low	110 Å²	110	130.7 Å²	130.7	77%	0.769	79%	0.786	S	S	*	*			trans	76.4	125.3	-177.8	68.9	0	0	0	0	115.3
696	V	34.3	Very low	33.3	Very low	120 Å²	120	130.4 Å²	130.4	73%	0.727	78%	0.781	S	S	*	*			cis	97.4	100.4	30.1	173.4	0	0	0	0	112.6
697	D	32.1	Very low	33.3	Very low	145 Å²	145	133 Å²	133	78%	0.775	79%	0.785	S	S	*	*				174.3	169.7	122.7	-95.6	-32.9	0	0	0	111
698	T	31.6	Very low	33.6	Very low	105 Å²	105	136.3 Å²	136.3	64%	0.644	79%	0.788	S	S	*	*			cis	-176.4	108.9	-48.9	-86	0	0	0	0	107.7
699	S	37.2	Very low	33.8	Very low	116 Å²	116	134.8 Å²	134.8	81%	0.811	78%	0.781	S	S	*	*			trans	165.8	147.6	160.6	54.7	0	0	0	0	110.7
700	I	33.6	Very low	34.1	Very low	155 Å²	155	135.6 Å²	135.6	80%	0.795	79%	0.787	S	S	*	*			cis	173.3	150.4	-30.7	-102.4	165.1	0	0	0	104.7
701	P	38.2	Very low	34.1	Very low	115 Å²	115	133.4 Å²	133.4	75%	0.747	78%	0.781	S	S	*	*			trans	-122	178.7	-149.6	42.1	-30.8	0	0	0	116.7
702	S	34.9	Very low	34.1	Very low	122 Å²	122	133.5 Å²	133.5	85%	0.853	78%	0.782	S	S	*	*			trans	-169.5	159	162.2	-81.6	0	0	0	0	110.8
703	A	34	Very low	34.3	Very low	95 Å²	95	135.5 Å²	135.5	79%	0.785	79%	0.79	S	S	*	*			cis	-171.5	157.8	-25	0	0	0	0	0	109
704	G	34.6	Very low	34.3	Very low	63 Å²	63	135.6 Å²	135.6	65%	0.649	79%	0.789	S	S	*	*			trans	86.2	141.4	172.3	0	0	0	0	0	115.5
705	D	37.8	Very low	34	Very low	174 Å²	174	135.7 Å²	135.7	93%	0.93	79%	0.79	S	S	*	*			cis	-141.3	169.6	-4.6	-76.8	-45.7	0	0	0	111.1
706	M	32.7	Very low	34	Very low	151 Å²	151	136.6 Å²	136.6	74%	0.744	79%	0.791	S	S	*	*			trans	-150.9	125.7	-161.3	171	-174.9	70.7	0	0	113	F708	M706-F708 HydrophobicContact CG-CD2 4.08Å; M706-F708 HydrophobicContact CG-CE2 4.14Å; M706-F708 HydrophobicContact SD-CE2 4.17Å
707	E	34.1	Very low	33.8	Very low	191 Å²	191	138.7 Å²	138.7	89%	0.893	80%	0.797	S	S	*	*			trans	-176	112.7	157.8	-103.7	155.1	-163.6	0	0	106.5
708	F	33.1	Very low	33.8	Very low	182 Å²	182	140.7 Å²	140.7	80%	0.798	80%	0.802	S	S	*	*				85.2	142.3	64.6	-88.5	-94.7	0	0	0	115.1	M706	M706-F708 HydrophobicContact CG-CD2 4.08Å; M706-F708 HydrophobicContact CG-CE2 4.14Å; M706-F708 HydrophobicContact SD-CE2 4.17Å
709	P	37.1	Very low	33.7	Very low	105 Å²	105	139.5 Å²	139.5	68%	0.682	80%	0.803	S	S	*	*			trans	-122.9	170.8	-154.3	43	-30.2	0	0	0	116.1
710	D	34.3	Very low	33.3	Very low	162 Å²	162	139.6 Å²	139.6	87%	0.866	80%	0.803	S	S	*	*			trans	-131.1	112.2	168	-81.5	-46.4	0	0	0	113.3
711	D	29.9	Very low	33.4	Very low	147 Å²	147	136.7 Å²	136.7	79%	0.786	80%	0.797	S	S	*	*			trans	46.6	140.6	134.5	-92.9	-0.6	0	0	0	127.3
712	T	32.3	Very low	33.2	Very low	125 Å²	125	141.2 Å²	141.2	77%	0.767	80%	0.804	S	S	*	*			trans	78.5	72.8	147.1	57.6	0	0	0	0	123.1
713	T	34.7	Very low	33.6	Very low	141 Å²	141	139.9 Å²	139.9	87%	0.865	80%	0.795	S	S	*	*			trans	-141.6	107.3	143.5	35.8	0	0	0	0	114.4
714	I	33.8	Very low	34.8	Very low	164 Å²	164	140.7 Å²	140.7	84%	0.841	79%	0.786	S	S	*	*			trans	18.1	120.9	152.9	-55.7	175.4	0	0	0	119
715	N	29.1	Very low	36.6	Very low	161 Å²	161	139.7 Å²	139.7	86%	0.861	77%	0.772	S	S	*	*			trans	-76.2	127.6	178.5	-68.4	-66.7	0	0	0	114.9
716	V	34.6	Very low	38.8	Very low	130 Å²	130	135.5 Å²	135.5	79%	0.788	75%	0.746	S	S	*	*			trans	-132.6	88.4	152.3	-175.1	0	0	0	0	110.9	Q718	V716-Q718 PolarHBondContact O-N 3.29Å
717	L	30.8	Very low	41.4	Very low	163 Å²	163	131.6 Å²	131.6	85%	0.853	73%	0.728	S	S	*	*			trans	51.5	47	157	-62	177.4	0	0	0	119.2	A719	L717-A719 PolarHBondContact O-N 2.96Å; L717-A719 VanDerWaalsContact O-N 3.08Å
718	Q	30.6	Very low	44.2	Very low	187 Å²	187	122.7 Å²	122.7	87%	0.874	69%	0.687	S	S	*	*			trans	-82.2	66.7	160.2	-160.7	176.5	23.4	0	0	111.7	V716 S720	V716-Q718 PolarHBondContact O-N 3.29Å; Q718-S720 PolarHBondContact O-N 3.41Å
719	A	30.4	Very low	47	Very low	81 Å²	81	115.5 Å²	115.5	67%	0.669	65%	0.654	S	S	*	*			trans	-74	79.1	-179.4	0	0	0	0	0	112.6	L717 S721	L717-A719 PolarHBondContact O-N 2.96Å; L717-A719 VanDerWaalsContact O-N 3.08Å; A719-S721 VanDerWaalsContact C-N 3.27Å; A719-S721 PolarHBondContact O-N 2.89Å
720	S	29.8	Very low	49.7	Very low	118 Å²	118	110.5 Å²	110.5	83%	0.825	62%	0.622	S	S	*	*			trans	-77	61.3	-176.8	56.4	0	0	0	0	114.2	Q718	Q718-S720 PolarHBondContact O-N 3.41Å
721	S	34.1	Very low	52.4	Low	93 Å²	93	103.5 Å²	103.5	65%	0.65	58%	0.584	S	S	*	*	S	Bend	trans	-124.5	69.2	-176.9	64.1	0	0	0	0	114.5	A719 S723	A719-S721 VanDerWaalsContact C-N 3.27Å; A719-S721 PolarHBondContact O-N 2.89Å; S721-S723 PolarHBondContact O-N 2.96Å
722	K	34.5	Very low	55.1	Low	210 Å²	210	96.6 Å²	96.6	91%	0.913	55%	0.548	S	S	*	.			trans	38.2	51	160.4	-66.9	-178.4	177.5	172.8	0	117.2
723	S	44.4	Very low	57.5	Low	95 Å²	95	90.7 Å²	90.7	66%	0.664	51%	0.511	S	S	*	.			trans	-86	131.1	167.3	54.8	0	0	0	0	111.4	S721 A725	S721-S723 PolarHBondContact O-N 2.96Å; S723-A725 PolarHBondContact O-N 2.96Å
724	N	57.9	Low	59.9	Low	111 Å²	111	84.2 Å²	84.2	59%	0.594	47%	0.471	S	S	*	.			trans	-78.8	61.8	175.5	-61.4	-48.2	0	0	0	111.4	T655	T655-N724 WeakPolarHBondContact CA-O 3.41Å; T655-N724 WeakPolarHBondContact CB-O 3.48Å; T655-N724 PolarHBondContact N-O 3.38Å; T655-N724 PolarHBondContact OG1-O 2.83Å; T655-N724 VanDerWaalsContact OG1-O 3.09Å
725	A	72	Confident	62.4	Low	43 Å²	43	77.8 Å²	77.8	36%	0.355	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	139.8	177.7	0	0	0	0	0	109.8	T652 S723	T652-A725 HydrophobicContact CG2-CB 3.85Å; S723-A725 PolarHBondContact O-N 2.96Å
726	K	84.1	Confident	65	Low	85 Å²	85	70.5 Å²	70.5	37%	0.37	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	112.4	177.4	-167.3	-179.4	-172.4	179.9	0	110.5	Y623 V653 L728	Y623-K726 HydrophobicContact CE1-CD 3.8Å; Y623-K726 PolarHBondContact OH-NZ 3.04Å; V653-K726 PolarHBondContact N-O 3.21Å; V653-K726 PolarHBondContact O-N 2.82Å; K726-L728 HydrophobicContact CD-CD2 4.49Å
727	N	88.9	Confident	67.3	Low	69 Å²	69	64.5 Å²	64.5	37%	0.369	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	133.5	177	-59.7	16.3	0	0	0	109.7	I651 Y729	I651-N727 CarbonylContact O-C 3.57Å; I651-N727 WeakPolarHBondContact O-CA 3.5Å; N727-Y729 HydrophobicContact CB-CE1 4.38Å; N727-Y729 HydrophobicContact CB-CE2 4.07Å; N727-Y729 PolarHBondContact ND2-OH 2.81Å; N727-Y729 VanDerWaalsContact ND2-OH 3.16Å
728	L	91.1	Very high	70	Confident	5 Å²	5	56.7 Å²	56.7	3%	0.026	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	133.4	171.3	-52.8	172.5	0	0	0	108.2	Y623 C650 I651 V653 K726	Y623-L728 HydrophobicContact CD2-CD1 3.59Å; Y623-L728 HydrophobicContact CE2-CD1 3.51Å; Y623-L728 HydrophobicContact CE2-CD2 4.02Å; Y623-L728 HydrophobicContact CE2-CG 4.43Å; Y623-L728 HydrophobicContact CG-CD1 4.13Å; C650-L728 WeakPolarHBondContact CA-O 3.26Å; I651-L728 HydrophobicContact CB-CB 4.28Å; I651-L728 PolarHBondContact N-O 2.92Å; I651-L728 PolarHBondContact O-N 2.77Å; V653-L728 HydrophobicContact CG2-CD1 4.31Å; K726-L728 HydrophobicContact CD-CD2 4.49Å
729	Y	93.2	Very high	72.7	Confident	31 Å²	31	48 Å²	48	12%	0.122	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	117.3	-178.5	-56.1	-71.8	0	0	0	109.7	E564 I565 Y568 L633 C650 N727	E564-Y729 WeakPolarHBondContact CA-O 3.41Å; I565-Y729 HydrophobicContact CG2-CD2 4.38Å; I565-Y729 HydrophobicContact CG2-CG 4.27Å; I565-Y729 PolarHBondContact N-O 3.36Å; I565-Y729 VanDerWaalsContact N-O 3.1Å; Y568-Y729 HydrophobicContact CG-CD1 4.45Å; L633-Y729 HydrophobicContact CD1-CD1 4.18Å; L633-Y729 HydrophobicContact CD1-CE1 3.74Å; C650-Y729 HydrophobicContact CB-CD1 4.17Å; C650-Y729 HydrophobicContact CB-CE1 4.3Å; C650-Y729 VanDerWaalsContact SG-CE1 3.53Å; N727-Y729 HydrophobicContact CB-CE1 4.38Å; N727-Y729 HydrophobicContact CB-CE2 4.07Å; N727-Y729 PolarHBondContact ND2-OH 2.81Å; N727-Y729 VanDerWaalsContact ND2-OH 3.16Å
730	L	92.5	Very high	75.1	Confident	0 Å²	0	45 Å²	45	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	129	-169.7	-64.6	170.7	0	0	0	112.2	L562 N563 E564 L583 L592 P648 I649 I651	L562-L730 HydrophobicContact CD1-CB 4.19Å; L562-L730 HydrophobicContact CD1-CD1 4.42Å; N563-L730 CarbonylContact O-C 3.59Å; N563-L730 WeakPolarHBondContact O-CA 3.13Å; E564-L730 HydrophobicContact CB-CD2 4.22Å; E564-L730 HydrophobicContact CG-CD2 4.43Å; L583-L730 HydrophobicContact CD2-CD1 4.11Å; L592-L730 HydrophobicContact CD2-CD2 4.34Å; P648-L730 CarbonylContact C-O 3.56Å; P648-L730 WeakPolarHBondContact CA-O 3.33Å; I649-L730 HydrophobicContact CB-CB 4.5Å; I649-L730 PolarHBondContact N-O 3.12Å; I649-L730 PolarHBondContact O-N 2.91Å; I651-L730 HydrophobicContact CD1-CD1 3.79Å
731	F	91.5	Very high	77.8	Confident	14 Å²	14	39.3 Å²	39.3	6%	0.061	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	140	177.4	-56.3	-99.3	0	0	0	111.5	L562 N563 I565 Y568 T578 K646 P648	L562-F731 WeakPolarHBondContact CB-O 3.44Å; L562-F731 WeakPolarHBondContact CD2-O 3.07Å; N563-F731 HydrophobicContact CB-CB 4.36Å; N563-F731 PolarHBondContact N-O 3.37Å; N563-F731 PolarHBondContact O-N 2.79Å; I565-F731 HydrophobicContact CB-CE2 4.01Å; I565-F731 HydrophobicContact CG2-CE2 3.61Å; I565-F731 HydrophobicContact CG2-CZ 4.2Å; Y568-F731 AromaticContact CD2-CZ 3.91Å; Y568-F731 HydrophobicContact CD2-CZ 3.91Å; Y568-F731 HydrophobicContact CE2-CE1 4.32Å; Y568-F731 HydrophobicContact CE2-CZ 4.05Å; T578-F731 HydrophobicContact CG2-CD2 4Å; T578-F731 HydrophobicContact CG2-CE2 3.78Å; T578-F731 HydrophobicContact CG2-CZ 4.48Å; K646-F731 WeakPolarHBondContact O-CE1 3.28Å; P648-F731 HydrophobicContact CB-CD1 4.08Å; P648-F731 HydrophobicContact CB-CD2 4.39Å; P648-F731 HydrophobicContact CB-CE1 3.83Å; P648-F731 HydrophobicContact CB-CE2 4.14Å; P648-F731 HydrophobicContact CB-CG 4.36Å; P648-F731 HydrophobicContact CB-CZ 3.86Å; P648-F731 HydrophobicContact CG-CE1 4.06Å; P648-F731 HydrophobicContact CG-CZ 4.08Å
732	G	87.5	Confident	80.5	Confident	3 Å²	3	36.3 Å²	36.3	3%	0.031	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	144.3	168.4	0	0	0	0	0	112.2	T734	G732-T734 VanDerWaalsContact C-N 3.3Å
733	R	82.3	Confident	82.8	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	16%	0.158	C	C	.	.	S	Bend	trans	-75.3	-29.6	170.5	-50.5	177.1	60.3	-121.1	-0.4	109.5	T600 R601 R602 S603 D607 E737	T600-R733 VanDerWaalsContact O-CZ 3.3Å; T600-R733 PolarHBondContact O-NE 2.83Å; T600-R733 PolarHBondContact O-NH2 3.05Å; T600-R733 PolarHBondContact OG1-NH2 3.17Å; R601-R733 WeakPolarHBondContact O-CG 3.44Å; R602-R733 PolarHBondContact O-NH2 2.93Å; S603-R733 PolarHBondContact OG-NH1 2.98Å; D607-R733 IonicContact OD2-NH2 3.73Å; D607-R733 PolarHBondContact OD2-NH2 3.07Å; R733-E737 WeakPolarHBondContact CA-OE2 3.3Å; R733-E737 VanDerWaalsContact CB-OE2 3.25Å; R733-E737 WeakPolarHBondContact CB-OE2 3.31Å; R733-E737 PolarHBondContact N-OE2 2.87Å; R733-E737 VanDerWaalsContact N-OE2 3.07Å
734	T	84.3	Confident	84.7	Confident	5 Å²	5	25.3 Å²	25.3	3%	0.031	13%	0.13	C	C	.	.	S	Bend	trans	-122.3	163.7	163.8	77.1	0	0	0	0	112.6	G732 E737 K738 P1248	G732-T734 VanDerWaalsContact C-N 3.3Å; T734-E737 PolarHBondContact N-OE2 2.82Å; T734-E737 WeakPolarHBondContact OG1-CB 3.46Å; T734-E737 VanDerWaalsContact OG1-CD 3.31Å; T734-E737 VanDerWaalsContact OG1-CG 3.22Å; T734-E737 WeakPolarHBondContact OG1-CG 3.23Å; T734-E737 PolarHBondContact OG1-N 2.8Å; T734-K738 PolarHBondContact O-N 2.82Å; T734-P1248 HydrophobicContact CG2-CB 4.15Å; T734-P1248 HydrophobicContact CG2-CG 4.28Å
735	C	86.5	Confident	86.2	Confident	30 Å²	30	20 Å²	20	20%	0.203	10%	0.101	C	C	.	.	H	α-helix	trans	-68.2	-36.9	179.1	-58.6	0	0	0	0	112.6	W643 R645 K738 E739 W1202	W643-C735 WeakPolarHBondContact O-CA 3.22Å; W643-C735 VanDerWaalsContact O-CB 3.23Å; W643-C735 WeakPolarHBondContact O-CB 3.45Å; R645-C735 PolarHBondContact N-SG 2.94Å; C735-K738 WeakPolarHBondContact O-CB 3.4Å; C735-K738 PolarHBondContact O-N 2.83Å; C735-E739 PolarHBondContact O-N 2.87Å; C735-E739 VanDerWaalsContact O-N 3.16Å; C735-W1202 HydrophobicContact CB-CH2 3.62Å; C735-W1202 HydrophobicContact CB-CZ3 3.74Å
736	R	83.5	Confident	86.9	Confident	8 Å²	8	22.7 Å²	22.7	3%	0.03	11%	0.105	C	C	.	.	H	α-helix	trans	-75.9	-29	179	-173.5	168.2	166.2	-130.3	-1.7	113.1	T740 H986 W989 N1192 W1202 M1250	R736-T740 WeakPolarHBondContact O-CB 3.46Å; R736-T740 PolarHBondContact O-N 2.75Å; R736-T740 PolarHBondContact O-OG1 2.8Å; R736-H986 PolarHBondContact NH2-O 3.49Å; R736-W989 VanDerWaalsContact NH1-CZ2 3.34Å; R736-N1192 VanDerWaalsContact CZ-CG 3.48Å; R736-N1192 PolarHBondContact NE-ND2 3.45Å; R736-N1192 PolarHBondContact NH2-ND2 3.38Å; R736-N1192 PolarHBondContact NH2-OD1 2.87Å; R736-W1202 HydrophobicContact CB-CD2 4.05Å; R736-W1202 HydrophobicContact CB-CE3 4.02Å; R736-W1202 HydrophobicContact CB-CH2 3.94Å; R736-W1202 HydrophobicContact CB-CZ2 3.93Å; R736-W1202 HydrophobicContact CB-CZ3 3.97Å; R736-W1202 HydrophobicContact CG-CD2 4.16Å; R736-W1202 HydrophobicContact CG-CZ2 4.27Å; R736-M1250 PolarHBondContact NH1-SD 3.48Å
737	E	83.5	Confident	86.9	Confident	3 Å²	3	19.2 Å²	19.2	1%	0.014	9%	0.092	C	C	.	.	H	α-helix	trans	-60.8	-45.3	165.6	-78.8	165.2	-173.3	0	0	111.4	S545 L546 R733 T734 E739 T740 W741	S545-E737 WeakPolarHBondContact CB-OE1 3.38Å; S545-E737 PolarHBondContact OG-OE1 2.92Å; L546-E737 HydrophobicContact CD1-CG 3.71Å; L546-E737 HydrophobicContact CD2-CG 4.08Å; L546-E737 HydrophobicContact CG-CG 3.85Å; R733-E737 WeakPolarHBondContact CA-OE2 3.3Å; R733-E737 VanDerWaalsContact CB-OE2 3.25Å; R733-E737 WeakPolarHBondContact CB-OE2 3.31Å; R733-E737 PolarHBondContact N-OE2 2.87Å; R733-E737 VanDerWaalsContact N-OE2 3.07Å; T734-E737 PolarHBondContact N-OE2 2.82Å; T734-E737 WeakPolarHBondContact OG1-CB 3.46Å; T734-E737 VanDerWaalsContact OG1-CD 3.31Å; T734-E737 VanDerWaalsContact OG1-CG 3.22Å; T734-E737 WeakPolarHBondContact OG1-CG 3.23Å; T734-E737 PolarHBondContact OG1-N 2.8Å; E737-E739 PolarHBondContact O-N 2.81Å; E737-T740 PolarHBondContact O-N 3.32Å; E737-W741 WeakPolarHBondContact O-CB 3.48Å; E737-W741 PolarHBondContact O-N 3.38Å
738	K	88.7	Confident	86.7	Confident	0 Å²	0	16 Å²	16	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-59	-47	177.9	-176.5	-169.2	172.3	-171.7	0	111.6	L642 S644 Y647 I649 T734 C735 W741 Y742	L642-K738 PolarHBondContact O-NZ 3.01Å; S644-K738 WeakPolarHBondContact O-CD 3.45Å; S644-K738 PolarHBondContact O-NZ 3.36Å; Y647-K738 WeakPolarHBondContact O-CE 3.45Å; Y647-K738 PolarHBondContact O-NZ 3.18Å; I649-K738 HydrophobicContact CD1-CG 4.1Å; I649-K738 HydrophobicContact CG1-CG 4.09Å; T734-K738 PolarHBondContact O-N 2.82Å; C735-K738 WeakPolarHBondContact O-CB 3.4Å; C735-K738 PolarHBondContact O-N 2.83Å; K738-W741 PolarHBondContact O-N 3.24Å; K738-Y742 VanDerWaalsContact O-CB 3.27Å; K738-Y742 WeakPolarHBondContact O-CB 3.37Å; K738-Y742 PolarHBondContact O-N 2.86Å
739	E	86.4	Confident	86.6	Confident	5 Å²	5	16.3 Å²	16.3	2%	0.023	8%	0.078	C	C	.	.	H	α-helix	trans	-57.6	-49.4	174.1	175	166.4	-129.9	0	0	111.6	W643 C735 E737 W741 Y742 R743 W1202	W643-E739 HydrophobicContact CD2-CB 3.7Å; W643-E739 HydrophobicContact CD2-CG 4.07Å; W643-E739 VanDerWaalsContact CE2-OE1 3.31Å; W643-E739 HydrophobicContact CE3-CB 3.92Å; W643-E739 HydrophobicContact CE3-CG 4.48Å; W643-E739 HydrophobicContact CG-CB 4.01Å; W643-E739 HydrophobicContact CH2-CG 4.37Å; W643-E739 HydrophobicContact CZ2-CB 4.37Å; W643-E739 HydrophobicContact CZ2-CG 3.89Å; W643-E739 HydrophobicContact CZ3-CB 4.38Å; W643-E739 PolarHBondContact NE1-OE1 3.44Å; C735-E739 PolarHBondContact O-N 2.87Å; C735-E739 VanDerWaalsContact O-N 3.16Å; E737-E739 PolarHBondContact O-N 2.81Å; E739-W741 PolarHBondContact O-N 3.25Å; E739-Y742 PolarHBondContact O-N 3.07Å; E739-R743 VanDerWaalsContact CD-NH2 3.31Å; E739-R743 WeakPolarHBondContact O-CG 3.48Å; E739-R743 PolarHBondContact O-N 3.2Å; E739-R743 IonicContact OE1-CZ 3.59Å; E739-R743 IonicContact OE1-NE 2.66Å; E739-R743 IonicContact OE1-NH2 3.69Å; E739-R743 PolarHBondContact OE1-NH2 3.05Å; E739-R743 IonicContact OE2-NH2 3.94Å; E739-W1202 HydrophobicContact CB-CZ2 4.44Å; E739-W1202 WeakPolarHBondContact OE2-CZ2 3.42Å; E739-W1202 PolarHBondContact OE2-NE1 2.98Å
740	T	81.1	Confident	86.2	Confident	16 Å²	16	20.8 Å²	20.8	10%	0.098	10%	0.103	C	C	.	.	H	α-helix	trans	-59	-48.6	180	-61.9	0	0	0	0	111.9	L546 R736 E737 R743 R744	L546-T740 HydrophobicContact CD1-CG2 4.42Å; L546-T740 HydrophobicContact CD2-CG2 4.17Å; R736-T740 WeakPolarHBondContact O-CB 3.46Å; R736-T740 PolarHBondContact O-N 2.75Å; R736-T740 PolarHBondContact O-OG1 2.8Å; E737-T740 PolarHBondContact O-N 3.32Å; T740-R743 PolarHBondContact O-N 2.82Å; T740-R744 WeakPolarHBondContact O-CG 3.4Å; T740-R744 PolarHBondContact O-N 2.98Å; T740-R744 VanDerWaalsContact O-N 3.12Å
741	W	86.8	Confident	85.3	Confident	0 Å²	0	22.8 Å²	22.8	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-68.2	-40.9	179.2	-84.3	105.7	0	0	0	112.3	L562 L583 L585 I649 E737 K738 E739 R743 R744 L745	L562-W741 HydrophobicContact CD1-CB 4.25Å; L562-W741 HydrophobicContact CD1-CD2 4.18Å; L562-W741 HydrophobicContact CD1-CG 3.94Å; L562-W741 HydrophobicContact CD2-CG 4.19Å; L562-W741 HydrophobicContact CG-CG 4.37Å; L583-W741 HydrophobicContact CB-CH2 3.69Å; L583-W741 HydrophobicContact CB-CZ2 4.09Å; L583-W741 HydrophobicContact CB-CZ3 4.17Å; L583-W741 HydrophobicContact CD2-CE3 4.33Å; L583-W741 HydrophobicContact CD2-CH2 4.44Å; L583-W741 HydrophobicContact CD2-CZ3 4.2Å; L585-W741 HydrophobicContact CB-CZ3 4.1Å; I649-W741 HydrophobicContact CD1-CB 4.27Å; E737-W741 WeakPolarHBondContact O-CB 3.48Å; E737-W741 PolarHBondContact O-N 3.38Å; K738-W741 PolarHBondContact O-N 3.24Å; E739-W741 PolarHBondContact O-N 3.25Å; W741-R743 VanDerWaalsContact C-N 3.34Å; W741-R743 PolarHBondContact O-N 3.45Å; W741-R744 PolarHBondContact O-N 3.1Å; W741-L745 HydrophobicContact CB-CD1 4.48Å; W741-L745 HydrophobicContact CE3-CG 4.45Å; W741-L745 VanDerWaalsContact O-CB 3.31Å; W741-L745 WeakPolarHBondContact O-CB 3.38Å; W741-L745 WeakPolarHBondContact O-CD1 3.17Å; W741-L745 WeakPolarHBondContact O-CG 3.4Å; W741-L745 PolarHBondContact O-N 2.97Å
742	Y	89.3	Confident	84.4	Confident	30 Å²	30	26.5 Å²	26.5	12%	0.118	15%	0.148	C	C	.	.	H	α-helix	trans	-58.2	-45.6	175.8	179.9	-92.7	0	0	0	111.5	V630 L632 W643 I649 K738 E739 L745 K746	V630-Y742 HydrophobicContact CG1-CD2 3.95Å; V630-Y742 HydrophobicContact CG1-CE2 3.79Å; V630-Y742 WeakPolarHBondContact O-CE2 3.33Å; V630-Y742 PolarHBondContact O-OH 3.11Å; V630-Y742 VanDerWaalsContact O-OH 3.06Å; L632-Y742 HydrophobicContact CD2-CD2 3.67Å; L632-Y742 HydrophobicContact CD2-CE2 4.06Å; L632-Y742 HydrophobicContact CD2-CG 4.34Å; L632-Y742 HydrophobicContact CG-CD2 3.96Å; L632-Y742 HydrophobicContact CG-CE2 3.86Å; W643-Y742 AromaticContact CH2-CD1 3.54Å; W643-Y742 HydrophobicContact CH2-CD1 3.54Å; W643-Y742 HydrophobicContact CH2-CE1 4.2Å; W643-Y742 HydrophobicContact CH2-CG 4.07Å; W643-Y742 AromaticContact CZ3-CD1 3.81Å; W643-Y742 HydrophobicContact CZ3-CD1 3.81Å; W643-Y742 AromaticContact CZ3-CG 3.83Å; W643-Y742 HydrophobicContact CZ3-CG 3.83Å; I649-Y742 HydrophobicContact CG1-CD2 4.28Å; I649-Y742 HydrophobicContact CG2-CD2 4.08Å; K738-Y742 VanDerWaalsContact O-CB 3.27Å; K738-Y742 WeakPolarHBondContact O-CB 3.37Å; K738-Y742 PolarHBondContact O-N 2.86Å; E739-Y742 PolarHBondContact O-N 3.07Å; Y742-L745 PolarHBondContact O-N 3.46Å; Y742-K746 HydrophobicContact CE1-CD 3.83Å; Y742-K746 VanDerWaalsContact O-CB 3.24Å; Y742-K746 WeakPolarHBondContact O-CB 3.49Å; Y742-K746 PolarHBondContact O-N 3.28Å
743	R	84.1	Confident	83.5	Confident	58 Å²	58	28.1 Å²	28.1	22%	0.219	16%	0.158	C	C	.	.	H	α-helix	trans	-60.8	-46.8	176.2	-67.8	178.5	-170.7	-153.5	9.5	111.9	E739 T740 W741 A747 P1195 S1198	E739-R743 VanDerWaalsContact CD-NH2 3.31Å; E739-R743 WeakPolarHBondContact O-CG 3.48Å; E739-R743 PolarHBondContact O-N 3.2Å; E739-R743 IonicContact OE1-CZ 3.59Å; E739-R743 IonicContact OE1-NE 2.66Å; E739-R743 IonicContact OE1-NH2 3.69Å; E739-R743 PolarHBondContact OE1-NH2 3.05Å; E739-R743 IonicContact OE2-NH2 3.94Å; T740-R743 PolarHBondContact O-N 2.82Å; W741-R743 VanDerWaalsContact C-N 3.34Å; W741-R743 PolarHBondContact O-N 3.45Å; R743-A747 PolarHBondContact O-N 3.41Å; R743-A747 VanDerWaalsContact O-N 3.09Å; R743-P1195 PolarHBondContact NH1-O 2.77Å; R743-S1198 PolarHBondContact NH2-OG 2.79Å
744	R	83.6	Confident	82.6	Confident	15 Å²	15	31.4 Å²	31.4	6%	0.057	18%	0.175	C	C	.	.	H	α-helix	trans	-61.3	-47.1	177.7	-71.8	171.7	-179.5	178.2	-1.4	112.4	Y558 L585 T740 W741 A747 A748 L754 H986	Y558-R744 HydrophobicContact CD2-CG 4.33Å; Y558-R744 HydrophobicContact CE2-CG 4.4Å; Y558-R744 HydrophobicContact CG-CG 4.49Å; L585-R744 HydrophobicContact CD2-CB 4.02Å; T740-R744 WeakPolarHBondContact O-CG 3.4Å; T740-R744 PolarHBondContact O-N 2.98Å; T740-R744 VanDerWaalsContact O-N 3.12Å; W741-R744 PolarHBondContact O-N 3.1Å; R744-A747 PolarHBondContact O-N 3.25Å; R744-A748 PolarHBondContact O-N 3.48Å; R744-L754 HydrophobicContact CG-CD1 4.22Å; R744-H986 PolarHBondContact NH2-CE1 3.41Å
745	L	89.9	Confident	81.2	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-66	-42	179.5	-69.6	166.5	0	0	0	111.9	L590 L625 V630 I649 I651 W741 Y742 A748 S749	L590-L745 HydrophobicContact CD1-CD2 3.96Å; L590-L745 HydrophobicContact CD2-CD2 3.82Å; L590-L745 HydrophobicContact CG-CD2 4.46Å; L625-L745 HydrophobicContact CD1-CD2 3.7Å; V630-L745 HydrophobicContact CG1-CB 4.01Å; V630-L745 HydrophobicContact CG2-CB 4.4Å; I649-L745 HydrophobicContact CD1-CD1 4.31Å; I649-L745 HydrophobicContact CG2-CD1 4.22Å; I651-L745 HydrophobicContact CD1-CD1 4.02Å; I651-L745 HydrophobicContact CD1-CD2 3.91Å; I651-L745 HydrophobicContact CD1-CG 4.49Å; W741-L745 HydrophobicContact CB-CD1 4.48Å; W741-L745 HydrophobicContact CE3-CG 4.45Å; W741-L745 VanDerWaalsContact O-CB 3.31Å; W741-L745 WeakPolarHBondContact O-CB 3.38Å; W741-L745 WeakPolarHBondContact O-CD1 3.17Å; W741-L745 WeakPolarHBondContact O-CG 3.4Å; W741-L745 PolarHBondContact O-N 2.97Å; Y742-L745 PolarHBondContact O-N 3.46Å; L745-A748 PolarHBondContact O-N 2.83Å; L745-S749 PolarHBondContact O-N 3.34Å; L745-S749 PolarHBondContact O-OG 3.15Å
746	K	87.1	Confident	79.5	Confident	99 Å²	99	38.7 Å²	38.7	43%	0.43	20%	0.203	S	C	.	.	H	α-helix	trans	-63.8	-41.2	177.5	-171.3	172.8	-171.4	168.3	0	112	Y742 S749 L750	Y742-K746 HydrophobicContact CE1-CD 3.83Å; Y742-K746 VanDerWaalsContact O-CB 3.24Å; Y742-K746 WeakPolarHBondContact O-CB 3.49Å; Y742-K746 PolarHBondContact O-N 3.28Å; K746-S749 WeakPolarHBondContact CA-OG 3.42Å; K746-S749 PolarHBondContact O-N 3.01Å; K746-S749 PolarHBondContact O-OG 3.1Å; K746-L750 WeakPolarHBondContact O-CG 3.19Å; K746-L750 PolarHBondContact O-N 2.81Å
747	A	82.3	Confident	78.2	Confident	13 Å²	13	38.6 Å²	38.6	11%	0.107	20%	0.203	C	C	.	.	H	α-helix	trans	-62.3	-48.1	174	0	0	0	0	0	111.7	R743 R744 S749 L750 T752 L754	R743-A747 PolarHBondContact O-N 3.41Å; R743-A747 VanDerWaalsContact O-N 3.09Å; R744-A747 PolarHBondContact O-N 3.25Å; A747-S749 VanDerWaalsContact C-N 3.26Å; A747-S749 PolarHBondContact O-N 3.25Å; A747-L750 PolarHBondContact O-N 2.99Å; A747-L750 VanDerWaalsContact O-N 3.11Å; A747-T752 CarbonylContact C-O 3.58Å; A747-T752 CarbonylContact O-C 3.59Å; A747-T752 VanDerWaalsContact O-C 3.29Å; A747-L754 HydrophobicContact CB-CD1 4.37Å; A747-L754 HydrophobicContact CB-CD2 3.85Å; A747-L754 HydrophobicContact CB-CG 3.62Å
748	A	86.4	Confident	76.5	Confident	1 Å²	1	40.1 Å²	40.1	1%	0.008	21%	0.213	C	C	.	.	H	α-helix	trans	-57.6	-36.9	175	0	0	0	0	0	113	L585 L625 R744 L745 L750 G751	L585-A748 HydrophobicContact CD1-CB 3.95Å; L585-A748 HydrophobicContact CD2-CB 4.2Å; L625-A748 HydrophobicContact CB-CB 4.43Å; L625-A748 HydrophobicContact CD1-CB 3.86Å; R744-A748 PolarHBondContact O-N 3.48Å; L745-A748 PolarHBondContact O-N 2.83Å; A748-L750 VanDerWaalsContact C-N 3.31Å; A748-L750 PolarHBondContact O-N 3Å; A748-G751 PolarHBondContact O-N 2.88Å
749	S	87.6	Confident	74.4	Confident	12 Å²	12	42.9 Å²	42.9	8%	0.084	23%	0.226	C	C	.	.	H	α-helix	trans	-69	-24.2	177.4	58.4	0	0	0	0	115.4	L625 N627 A628 L745 K746 A747 G751	L625-S749 WeakPolarHBondContact O-CA 3.23Å; N627-S749 PolarHBondContact N-O 2.76Å; A628-S749 WeakPolarHBondContact O-CB 3.25Å; L745-S749 PolarHBondContact O-N 3.34Å; L745-S749 PolarHBondContact O-OG 3.15Å; K746-S749 WeakPolarHBondContact CA-OG 3.42Å; K746-S749 PolarHBondContact O-N 3.01Å; K746-S749 PolarHBondContact O-OG 3.1Å; A747-S749 VanDerWaalsContact C-N 3.26Å; A747-S749 PolarHBondContact O-N 3.25Å; S749-G751 PolarHBondContact O-N 3.18Å
750	L	84.8	Confident	72.6	Confident	124 Å²	124	44.6 Å²	44.6	65%	0.649	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82	5.2	175.8	-66.3	169.2	0	0	0	112.6	K746 A747 A748 T752	K746-L750 WeakPolarHBondContact O-CG 3.19Å; K746-L750 PolarHBondContact O-N 2.81Å; A747-L750 PolarHBondContact O-N 2.99Å; A747-L750 VanDerWaalsContact O-N 3.11Å; A748-L750 VanDerWaalsContact C-N 3.31Å; A748-L750 PolarHBondContact O-N 3Å; L750-T752 PolarHBondContact O-N 3.15Å; L750-T752 VanDerWaalsContact O-N 3.08Å
751	G	74.8	Confident	71.1	Confident	43 Å²	43	46.1 Å²	46.1	44%	0.443	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	72.8	-9.7	-173.3	0	0	0	0	0	114.2	A748 S749 P753	A748-G751 PolarHBondContact O-N 2.88Å; S749-G751 PolarHBondContact O-N 3.18Å; G751-P753 VanDerWaalsContact C-CD 3.46Å; G751-P753 WeakPolarHBondContact O-CD 3.3Å
752	T	73	Confident	69.2	Low	92 Å²	92	49.2 Å²	49.2	56%	0.564	27%	0.268	S	S	*	.			trans	-104.2	78.6	176.4	58.7	0	0	0	0	110.2	A747 L750	A747-T752 CarbonylContact C-O 3.58Å; A747-T752 CarbonylContact O-C 3.59Å; A747-T752 VanDerWaalsContact O-C 3.29Å; L750-T752 PolarHBondContact O-N 3.15Å; L750-T752 VanDerWaalsContact O-N 3.08Å
753	P	67.3	Low	67.3	Low	37 Å²	37	52 Å²	52	24%	0.24	28%	0.281	C	S	.	.			trans	-58.7	155.5	174.8	28.1	-36	0	0	0	110.4	G751 I755	G751-P753 VanDerWaalsContact C-CD 3.46Å; G751-P753 WeakPolarHBondContact O-CD 3.3Å; P753-I755 VanDerWaalsContact C-N 3.26Å; P753-I755 PolarHBondContact O-N 2.72Å
754	L	63.6	Low	65.4	Low	68 Å²	68	53.4 Å²	53.4	36%	0.356	29%	0.291	S	S	.	.			trans	-69.7	84.7	175.1	-64	177.1	0	0	0	109.8	P556 Y558 R744 A747 W756	P556-L754 WeakPolarHBondContact CG-O 3.35Å; Y558-L754 HydrophobicContact CE2-CB 4.35Å; Y558-L754 PolarHBondContact OH-O 2.8Å; R744-L754 HydrophobicContact CG-CD1 4.22Å; A747-L754 HydrophobicContact CB-CD1 4.37Å; A747-L754 HydrophobicContact CB-CD2 3.85Å; A747-L754 HydrophobicContact CB-CG 3.62Å; L754-W756 PolarHBondContact O-N 2.83Å
755	I	55.5	Low	63.7	Low	78 Å²	78	60.8 Å²	60.8	40%	0.4	32%	0.32	S	S	.	.			trans	-63.6	-34.8	170.6	-62.6	164.5	0	0	0	109.9	P556 P753	P556-I755 WeakPolarHBondContact CG-O 3.29Å; P753-I755 VanDerWaalsContact C-N 3.26Å; P753-I755 PolarHBondContact O-N 2.72Å
756	W	51.3	Low	61.8	Low	111 Å²	111	64.8 Å²	64.8	42%	0.42	34%	0.341	S	S	.	.			trans	-98.6	121.7	-176.6	-58.7	92.3	0	0	0	110.4	L754 M760 A761 H764	L754-W756 PolarHBondContact O-N 2.83Å; W756-M760 HydrophobicContact CE3-CB 3.57Å; W756-M760 HydrophobicContact CE3-CE 4.24Å; W756-M760 HydrophobicContact CZ3-CB 4.07Å; W756-M760 HydrophobicContact CZ3-CE 4.32Å; W756-A761 HydrophobicContact CB-CB 4.32Å; W756-H764 HydrophobicContact CE3-CB 4.28Å; W756-H764 HydrophobicContact CH2-CB 3.99Å; W756-H764 AromaticContact CH2-CD2 3.46Å; W756-H764 VanDerWaalsContact CH2-CD2 3.46Å; W756-H764 WeakPolarHBondContact CH2-CD2 3.5Å; W756-H764 AromaticContact CH2-CG 3.78Å; W756-H764 HydrophobicContact CZ3-CB 3.57Å; W756-H764 AromaticContact CZ3-CD2 3.98Å; W756-H764 AromaticContact CZ3-CG 3.91Å
757	T	55	Low	59.9	Low	6 Å²	6	64.4 Å²	64.4	4%	0.037	34%	0.343	C	S	.	.			trans	-70.7	153.4	154.3	69.4	0	0	0	0	109.4	Q759 M760 A761 A985	T757-Q759 PolarHBondContact O-N 2.64Å; T757-Q759 VanDerWaalsContact O-N 3.16Å; T757-Q759 PolarHBondContact OG1-OE1 3.02Å; T757-M760 HydrophobicContact CG2-SD 4.38Å; T757-M760 PolarHBondContact O-N 3.48Å; T757-M760 WeakPolarHBondContact OG1-CG 3.5Å; T757-M760 PolarHBondContact OG1-N 3.43Å; T757-A761 PolarHBondContact O-N 2.9Å; T757-A985 HydrophobicContact CG2-CB 3.94Å
758	P	49	Very low	58.1	Low	35 Å²	35	65.4 Å²	65.4	23%	0.227	35%	0.351	C	S	.	.	H	α-helix	trans	-46.1	-39.7	171.1	-33.2	32.1	0	0	0	115.1	A761 V762 A985 P1195	P758-A761 PolarHBondContact O-N 3.49Å; P758-V762 WeakPolarHBondContact O-CG2 3.44Å; P758-V762 PolarHBondContact O-N 3.07Å; P758-A985 HydrophobicContact CG-CB 4.48Å; P758-P1195 HydrophobicContact CB-CB 4.39Å; P758-P1195 HydrophobicContact CG-CB 4.02Å; P758-P1195 HydrophobicContact CG-CG 3.77Å
759	Q	43.6	Very low	56.2	Low	58 Å²	58	67.9 Å²	67.9	27%	0.271	37%	0.368	S	S	.	.	H	α-helix	trans	-69.9	-39.5	176.2	-37.9	95.1	-53.4	0	0	112.1	T757 A761 V762 Q763 L983	T757-Q759 PolarHBondContact O-N 2.64Å; T757-Q759 VanDerWaalsContact O-N 3.16Å; T757-Q759 PolarHBondContact OG1-OE1 3.02Å; Q759-A761 VanDerWaalsContact C-N 3.3Å; Q759-A761 PolarHBondContact O-N 3.07Å; Q759-V762 PolarHBondContact O-N 3.14Å; Q759-Q763 WeakPolarHBondContact O-CB 3.35Å; Q759-Q763 PolarHBondContact O-N 2.95Å; Q759-L983 WeakPolarHBondContact CG-O 3.42Å
760	M	49.4	Very low	54	Low	41 Å²	41	70.8 Å²	70.8	20%	0.202	38%	0.383	C	S	.	.	H	α-helix	trans	-63.4	-38.1	173.7	-66.9	170.5	75	0	0	111.2	Y550 W756 T757 Q763 H764	Y550-M760 HydrophobicContact CE1-SD 4.19Å; Y550-M760 PolarHBondContact OH-SD 3.17Å; W756-M760 HydrophobicContact CE3-CB 3.57Å; W756-M760 HydrophobicContact CE3-CE 4.24Å; W756-M760 HydrophobicContact CZ3-CB 4.07Å; W756-M760 HydrophobicContact CZ3-CE 4.32Å; T757-M760 HydrophobicContact CG2-SD 4.38Å; T757-M760 PolarHBondContact O-N 3.48Å; T757-M760 WeakPolarHBondContact OG1-CG 3.5Å; T757-M760 PolarHBondContact OG1-N 3.43Å; M760-Q763 PolarHBondContact O-N 3.44Å; M760-H764 WeakPolarHBondContact O-CB 3.29Å; M760-H764 PolarHBondContact O-N 2.74Å
761	A	49.6	Very low	52	Low	47 Å²	47	69.3 Å²	69.3	39%	0.388	38%	0.375	S	S	.	.	H	α-helix	trans	-65.3	-42.5	176.9	0	0	0	0	0	111.8	W756 T757 P758 Q759 Y765	W756-A761 HydrophobicContact CB-CB 4.32Å; T757-A761 PolarHBondContact O-N 2.9Å; P758-A761 PolarHBondContact O-N 3.49Å; Q759-A761 VanDerWaalsContact C-N 3.3Å; Q759-A761 PolarHBondContact O-N 3.07Å; A761-Y765 VanDerWaalsContact O-CB 3.32Å; A761-Y765 WeakPolarHBondContact O-CB 3.33Å; A761-Y765 PolarHBondContact O-N 3.02Å
762	V	47	Very low	50.3	Low	66 Å²	66	73.8 Å²	73.8	40%	0.4	39%	0.388	S	S	.	.	H	α-helix	trans	-66.7	-43	173.8	169.1	0	0	0	0	111.4	P758 Q759 Y765 L766 L983	P758-V762 WeakPolarHBondContact O-CG2 3.44Å; P758-V762 PolarHBondContact O-N 3.07Å; Q759-V762 PolarHBondContact O-N 3.14Å; V762-Y765 PolarHBondContact O-N 3.42Å; V762-L766 HydrophobicContact CG1-CD1 3.97Å; V762-L766 HydrophobicContact CG1-CG 4.49Å; V762-L766 VanDerWaalsContact O-CG 3.27Å; V762-L766 WeakPolarHBondContact O-CG 3.5Å; V762-L766 PolarHBondContact O-N 2.88Å; V762-L983 HydrophobicContact CG1-CD2 4.47Å; V762-L983 HydrophobicContact CG2-CD2 4.18Å
763	Q	48.4	Very low	48.8	Very low	87 Å²	87	75.2 Å²	75.2	41%	0.407	40%	0.397	S	S	.	.	H	α-helix	trans	-63.4	-43.5	177.3	-174.3	178.2	9.3	0	0	111.3	Q759 M760 L766 L767	Q759-Q763 WeakPolarHBondContact O-CB 3.35Å; Q759-Q763 PolarHBondContact O-N 2.95Å; M760-Q763 PolarHBondContact O-N 3.44Å; Q763-L766 PolarHBondContact O-N 3.35Å; Q763-L767 HydrophobicContact CG-CD1 4.01Å; Q763-L767 WeakPolarHBondContact O-CB 3.28Å; Q763-L767 WeakPolarHBondContact O-CG 3.46Å; Q763-L767 PolarHBondContact O-N 3.27Å
764	H	44.4	Very low	47.2	Very low	89 Å²	89	77.5 Å²	77.5	41%	0.412	41%	0.414	S	S	.	.	H	α-helix	trans	-66.3	-38.3	174.4	-176.2	-85.9	0	0	0	112	W756 M760 A768	W756-H764 HydrophobicContact CE3-CB 4.28Å; W756-H764 HydrophobicContact CH2-CB 3.99Å; W756-H764 AromaticContact CH2-CD2 3.46Å; W756-H764 VanDerWaalsContact CH2-CD2 3.46Å; W756-H764 WeakPolarHBondContact CH2-CD2 3.5Å; W756-H764 AromaticContact CH2-CG 3.78Å; W756-H764 HydrophobicContact CZ3-CB 3.57Å; W756-H764 AromaticContact CZ3-CD2 3.98Å; W756-H764 AromaticContact CZ3-CG 3.91Å; M760-H764 WeakPolarHBondContact O-CB 3.29Å; M760-H764 PolarHBondContact O-N 2.74Å; H764-A768 WeakPolarHBondContact O-CB 3.3Å; H764-A768 PolarHBondContact O-N 2.97Å
765	Y	48.6	Very low	45.6	Very low	169 Å²	169	81 Å²	81	66%	0.663	43%	0.433	S	S	*	.	H	α-helix	trans	-61.5	-45.8	173.4	-179.7	-90.9	0	0	0	111.8	A761 V762 A768 S769	A761-Y765 VanDerWaalsContact O-CB 3.32Å; A761-Y765 WeakPolarHBondContact O-CB 3.33Å; A761-Y765 PolarHBondContact O-N 3.02Å; V762-Y765 PolarHBondContact O-N 3.42Å; Y765-A768 PolarHBondContact O-N 2.86Å; Y765-S769 PolarHBondContact O-N 3.18Å; Y765-S769 PolarHBondContact O-OG 3.22Å
766	L	48.7	Very low	44.3	Very low	85 Å²	85	84 Å²	84	45%	0.445	45%	0.45	S	S	.	.	H	α-helix	trans	-61.7	-50.6	176.4	-69.6	167.7	0	0	0	111.4	V762 Q763 A768 S769 D770	V762-L766 HydrophobicContact CG1-CD1 3.97Å; V762-L766 HydrophobicContact CG1-CG 4.49Å; V762-L766 VanDerWaalsContact O-CG 3.27Å; V762-L766 WeakPolarHBondContact O-CG 3.5Å; V762-L766 PolarHBondContact O-N 2.88Å; Q763-L766 PolarHBondContact O-N 3.35Å; L766-A768 VanDerWaalsContact C-N 3.31Å; L766-A768 PolarHBondContact O-N 2.93Å; L766-S769 WeakPolarHBondContact CA-OG 3.42Å; L766-S769 PolarHBondContact O-N 3.46Å; L766-S769 VanDerWaalsContact O-N 3.08Å; L766-S769 PolarHBondContact O-OG 3.47Å; L766-D770 PolarHBondContact O-N 3.21Å; L766-D770 VanDerWaalsContact O-N 3.11Å
767	L	47.9	Very low	43.2	Very low	91 Å²	91	86.1 Å²	86.1	48%	0.476	47%	0.47	S	S	.	.	H	α-helix	trans	-60.9	-37.4	176.9	-69.6	168.3	0	0	0	112.6	Q763 D770 I771	Q763-L767 HydrophobicContact CG-CD1 4.01Å; Q763-L767 WeakPolarHBondContact O-CB 3.28Å; Q763-L767 WeakPolarHBondContact O-CG 3.46Å; Q763-L767 PolarHBondContact O-N 3.27Å; L767-D770 PolarHBondContact O-N 3.11Å; L767-I771 WeakPolarHBondContact O-CG1 3.3Å; L767-I771 PolarHBondContact O-N 3.48Å
768	A	45.2	Very low	42.2	Very low	33 Å²	33	92.8 Å²	92.8	27%	0.273	51%	0.51	S	S	.	.	H	α-helix	trans	-71.1	-29.7	175.5	0	0	0	0	0	112.6	H764 Y765 L766 N772	H764-A768 WeakPolarHBondContact O-CB 3.3Å; H764-A768 PolarHBondContact O-N 2.97Å; Y765-A768 PolarHBondContact O-N 2.86Å; L766-A768 VanDerWaalsContact C-N 3.31Å; L766-A768 PolarHBondContact O-N 2.93Å; A768-N772 PolarHBondContact O-ND2 3.09Å
769	S	45.2	Very low	41.1	Very low	53 Å²	53	94.4 Å²	94.4	37%	0.371	53%	0.533	S	S	.	.	H	α-helix	trans	-70.3	-33.5	172.2	56.9	0	0	0	0	112.9	Y765 L766 T773	Y765-S769 PolarHBondContact O-N 3.18Å; Y765-S769 PolarHBondContact O-OG 3.22Å; L766-S769 WeakPolarHBondContact CA-OG 3.42Å; L766-S769 PolarHBondContact O-N 3.46Å; L766-S769 VanDerWaalsContact O-N 3.08Å; L766-S769 PolarHBondContact O-OG 3.47Å; S769-T773 PolarHBondContact O-OG1 2.79Å
770	D	42.7	Very low	40.3	Very low	73 Å²	73	98.4 Å²	98.4	39%	0.39	56%	0.555	S	S	.	*	H	α-helix	trans	-63.3	-49.5	176.5	-68.6	-24.5	0	0	0	111.7	N522 L766 L767 N772 T773	N522-D770 PolarHBondContact ND2-OD2 3.46Å; L766-D770 PolarHBondContact O-N 3.21Å; L766-D770 VanDerWaalsContact O-N 3.11Å; L767-D770 PolarHBondContact O-N 3.11Å; D770-N772 VanDerWaalsContact C-N 3.26Å; D770-N772 PolarHBondContact O-N 3.4Å; D770-T773 PolarHBondContact O-N 3.14Å; D770-T773 PolarHBondContact O-OG1 3.06Å
771	I	41.5	Very low	39.3	Very low	94 Å²	94	100.9 Å²	100.9	48%	0.482	58%	0.576	S	S	.	*	H	α-helix	trans	-56.8	-37.6	-176.2	-66.9	165.8	0	0	0	112.1	L767 T773 S774 L780	L767-I771 WeakPolarHBondContact O-CG1 3.3Å; L767-I771 PolarHBondContact O-N 3.48Å; I771-T773 PolarHBondContact O-N 3.43Å; I771-T773 VanDerWaalsContact O-N 3.14Å; I771-S774 PolarHBondContact O-N 3.09Å; I771-S774 PolarHBondContact O-OG 3.43Å; I771-S774 VanDerWaalsContact O-OG 3.09Å; I771-L780 HydrophobicContact CD1-CD1 4.31Å
772	N	39.1	Very low	38.3	Very low	137 Å²	137	105.1 Å²	105.1	73%	0.733	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.3	-1.9	-179.1	-74.1	-60.2	0	0	0	114.3	A768 D770	A768-N772 PolarHBondContact O-ND2 3.09Å; D770-N772 VanDerWaalsContact C-N 3.26Å; D770-N772 PolarHBondContact O-N 3.4Å
773	T	41.8	Very low	37.5	Very low	121 Å²	121	112.2 Å²	112.2	74%	0.742	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.2	-10.2	172.7	10.8	0	0	0	0	114.1	S769 D770 I771	S769-T773 PolarHBondContact O-OG1 2.79Å; D770-T773 PolarHBondContact O-N 3.14Å; D770-T773 PolarHBondContact O-OG1 3.06Å; I771-T773 PolarHBondContact O-N 3.43Å; I771-T773 VanDerWaalsContact O-N 3.14Å
774	S	33.7	Very low	36.7	Very low	86 Å²	86	114.7 Å²	114.7	60%	0.601	63%	0.629	S	S	*	*	S	Bend	trans	-101.9	92.4	175.3	54.3	0	0	0	0	110.8	I771	I771-S774 PolarHBondContact O-N 3.09Å; I771-S774 PolarHBondContact O-OG 3.43Å; I771-S774 VanDerWaalsContact O-OG 3.09Å
775	N	30	Very low	36.1	Very low	141 Å²	141	117.3 Å²	117.3	75%	0.754	65%	0.645	S	S	*	*			trans	-61.7	138.6	-179.9	-84.4	-27.4	0	0	0	113.3
776	N	29	Very low	35.2	Very low	140 Å²	140	113 Å²	113	75%	0.749	65%	0.651	S	S	*	*	S	Bend	trans	76	127.9	159.2	-51.7	-25.8	0	0	0	118.4
777	N	27.2	Very low	34.3	Very low	157 Å²	157	115.1 Å²	115.1	84%	0.84	67%	0.668	S	S	*	*			trans	68.5	80.6	157.3	-55	-10.8	0	0	0	118.5
778	V	33.8	Very low	33.3	Very low	146 Å²	146	115 Å²	115	89%	0.885	68%	0.68	S	S	*	*				-165.2	144	126.8	139.6	0	0	0	0	108
779	G	25.7	Very low	32.5	Very low	68 Å²	68	119.8 Å²	119.8	70%	0.701	71%	0.707	S	S	*	*			trans	-76.7	147.9	-174.4	0	0	0	0	0	113.9
780	L	27.9	Very low	31.6	Very low	143 Å²	143	122 Å²	122	75%	0.749	73%	0.727	S	S	*	*			trans	-128.1	51.4	178.1	-137.3	173.1	0	0	0	111.8	I771	I771-L780 HydrophobicContact CD1-CD1 4.31Å
781	S	27	Very low	30.9	Very low	92 Å²	92	125 Å²	125	64%	0.643	75%	0.749	S	S	*	*			trans	-87.9	153.7	156.5	69.9	0	0	0	0	108.2
782	D	29.6	Very low	30.4	Very low	137 Å²	137	125.3 Å²	125.3	73%	0.733	76%	0.76	S	S	*	*	S	Bend	cis	-132.1	9.7	21.4	-65.9	-71.6	0	0	0	114.1	L784	D782-L784 PolarHBondContact O-N 2.83Å
783	Y	30.6	Very low	30	Very low	214 Å²	214	126.1 Å²	126.1	84%	0.839	76%	0.764	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.8	-1.3	-158.9	-137.3	-94	0	0	0	117.2
784	L	31.8	Very low	29.4	Very low	140 Å²	140	126.7 Å²	126.7	73%	0.733	77%	0.767	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116	4.2	-167.9	-79	170	0	0	0	116.2	D782	D782-L784 PolarHBondContact O-N 2.83Å
785	I	31.4	Very low	29.3	Very low	143 Å²	143	130.9 Å²	130.9	73%	0.733	78%	0.781	S	S	*	*	S	Bend	trans	-104.7	-11.6	-175.5	-60.2	179	0	0	0	112.7	T787	I785-T787 PolarHBondContact O-N 3.41Å; I785-T787 VanDerWaalsContact O-N 3.16Å
786	G	29.7	Very low	29.3	Very low	78 Å²	78	128.4 Å²	128.4	80%	0.804	78%	0.775	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.6	5.8	-164	0	0	0	0	0	119.4
787	T	30.3	Very low	29.5	Very low	130 Å²	130	128.4 Å²	128.4	80%	0.798	78%	0.775	S	S	*	*	T	Hydrogen-bonded Turn	trans	-138	10.1	-169.4	52.2	0	0	0	0	116.4	I785	I785-T787 PolarHBondContact O-N 3.41Å; I785-T787 VanDerWaalsContact O-N 3.16Å
788	A	27.1	Very low	29.9	Very low	89 Å²	89	128.9 Å²	128.9	74%	0.736	77%	0.772	S	S	*	*	S	Bend	trans	-123.8	10.2	-166.2	0	0	0	0	0	117.1
789	T	27.5	Very low	30	Very low	134 Å²	134	128.4 Å²	128.4	82%	0.822	76%	0.764	S	S	*	*			trans	-143.8	96	-180	36.1	0	0	0	0	112.8
790	A	25.4	Very low	30.4	Very low	98 Å²	98	131.9 Å²	131.9	81%	0.81	77%	0.767	S	S	*	*			trans	-150.5	58.2	176.3	0	0	0	0	0	112.7
791	T	28.9	Very low	30.7	Very low	136 Å²	136	129.3 Å²	129.3	83%	0.834	76%	0.761	S	S	*	*			trans	-158.8	146.9	167.1	-6.1	0	0	0	0	111.7
792	S	30.1	Very low	31.2	Very low	102 Å²	102	130.8 Å²	130.8	71%	0.713	77%	0.766	S	S	*	*			trans	80.6	118.9	166.1	-51.2	0	0	0	0	119.2
793	N	31.9	Very low	31.4	Very low	154 Å²	154	132 Å²	132	82%	0.824	77%	0.772	S	S	*	*			trans	86.4	84.7	143.8	-56.1	-8.6	0	0	0	120.2
794	T	28	Very low	31.6	Very low	133 Å²	133	125.5 Å²	125.5	82%	0.816	76%	0.758	S	S	*	*			trans	-46	143	140.7	42.2	0	0	0	0	114
795	I	33.2	Very low	31.8	Very low	173 Å²	173	125.4 Å²	125.4	89%	0.887	76%	0.758	S	S	*	*				-162.9	155	126.6	-100.4	154.7	0	0	0	108.4
796	S	28.7	Very low	32.1	Very low	89 Å²	89	125.9 Å²	125.9	62%	0.622	76%	0.762	S	S	*	*			trans	-99.2	158.6	-168.2	58.8	0	0	0	0	114.6
797	N	34.8	Very low	32.2	Very low	141 Å²	141	131.8 Å²	131.8	75%	0.754	77%	0.768	S	S	*	*				158.4	111.6	126.5	-73.7	-10.9	0	0	0	108.9
798	H	34.3	Very low	32.1	Very low	166 Å²	166	131 Å²	131	77%	0.769	77%	0.769	S	S	*	*				80.7	129	75.8	-114.3	-73.6	0	0	0	115.8
799	N	36.7	Very low	32.3	Very low	137 Å²	137	135.4 Å²	135.4	73%	0.733	77%	0.774	S	S	*	*			trans	77.5	150.9	164.4	-52	-12.1	0	0	0	119
800	D	34.1	Very low	32.6	Very low	141 Å²	141	133.7 Å²	133.7	75%	0.754	77%	0.765	S	S	*	*			cis	-163.6	147.8	-42.6	-149.4	-16	0	0	0	111.7
801	S	34.7	Very low	32.9	Very low	89 Å²	89	135 Å²	135	62%	0.622	76%	0.758	S	S	*	*			trans	65.1	148	149.6	76.1	0	0	0	0	124.3
802	T	36.3	Very low	32.9	Very low	123 Å²	123	138.1 Å²	138.1	76%	0.755	76%	0.755	S	S	*	*			trans	78.7	114.5	156.1	54.8	0	0	0	0	123.3
803	L	33.6	Very low	32.7	Very low	162 Å²	162	139.9 Å²	139.9	85%	0.848	76%	0.756	S	S	*	*				21.1	149.5	129.7	-77.3	80.1	0	0	0	121.7
804	S	34.6	Very low	32.6	Very low	78 Å²	78	138.2 Å²	138.2	55%	0.545	75%	0.752	S	S	.	*			cis	-170.6	173.6	-11.6	52.9	0	0	0	0	112.6
805	D	37.2	Very low	32.7	Very low	137 Å²	137	137 Å²	137	73%	0.733	75%	0.749	S	S	*	*			trans	73.3	107.6	153.4	-46	-40.5	0	0	0	121.6
806	D	36.2	Very low	32.4	Very low	153 Å²	153	133.2 Å²	133.2	82%	0.818	74%	0.738	S	S	*	*			trans	42.9	106.6	133.7	-59.5	-11.3	0	0	0	122.6
807	E	32.3	Very low	32.7	Very low	202 Å²	202	135.5 Å²	135.5	94%	0.944	74%	0.743	S	S	*	*				-173.8	153.2	97	-93.8	-159.4	98.6	0	0	109.9
808	S	28.1	Very low	32.4	Very low	115 Å²	115	136 Å²	136	80%	0.804	75%	0.745	S	S	*	*			trans	-144.4	115.6	-176.4	61.5	0	0	0	0	116.5
809	Q	32.2	Very low	32.4	Very low	180 Å²	180	133.8 Å²	133.8	84%	0.841	74%	0.743	S	S	*	*			trans	-156.9	164.4	172.8	-100.6	-64.5	-77.9	0	0	107.2
810	P	34.6	Very low	32	Very low	98 Å²	98	132.7 Å²	132.7	64%	0.636	74%	0.741	S	S	*	*				-112.1	-156.5	-106.1	43.8	-39.6	0	0	0	114.9
811	D	30.3	Very low	31.8	Very low	126 Å²	126	131.7 Å²	131.7	67%	0.674	74%	0.744	S	S	*	*			trans	88.8	115.3	161.2	-84.8	-38	0	0	0	121.3
812	R	28.4	Very low	31.6	Very low	201 Å²	201	132.2 Å²	132.2	76%	0.758	75%	0.747	S	S	*	*				64.9	116.2	128.3	-70.6	170.5	178.2	-159.8	-5.6	122.1
813	N	27.8	Very low	31.4	Very low	140 Å²	140	133.2 Å²	133.2	75%	0.749	75%	0.747	S	S	*	*			trans	68.7	129.2	130.6	-51.2	-9.3	0	0	0	119.2
814	T	29.6	Very low	31.5	Very low	119 Å²	119	130.3 Å²	130.3	73%	0.73	74%	0.74	S	S	*	*				164.7	142.6	95.5	-62.7	0	0	0	0	111.4
815	S	28.6	Very low	31.5	Very low	108 Å²	108	132.7 Å²	132.7	76%	0.755	75%	0.752	S	S	*	*			trans	64.1	150	161.6	55.4	0	0	0	0	119.2
816	S	28.2	Very low	31.3	Very low	93 Å²	93	129.9 Å²	129.9	65%	0.65	75%	0.747	S	S	*	*			cis	-169.5	179.5	-14.2	49.3	0	0	0	0	111.6
817	N	34.2	Very low	31.2	Very low	136 Å²	136	127.9 Å²	127.9	73%	0.727	75%	0.746	S	S	*	*			trans	101.5	108.6	166.5	-53.2	-28.3	0	0	0	115.3
818	L	29	Very low	31.1	Very low	152 Å²	152	124.4 Å²	124.4	80%	0.796	74%	0.738	S	S	*	*				79.6	134.3	83.1	-103.5	73.4	0	0	0	112.9
819	V	33.9	Very low	31.4	Very low	120 Å²	120	122.7 Å²	122.7	73%	0.727	73%	0.731	S	S	*	*			cis	-141.8	145.6	4.6	-179.4	0	0	0	0	107.9
820	T	29	Very low	31.3	Very low	114 Å²	114	120.9 Å²	120.9	70%	0.699	73%	0.727	S	S	*	*			cis	101.7	70.6	5.3	-41.7	0	0	0	0	118.1
821	C	29.8	Very low	31.3	Very low	119 Å²	119	121.3 Å²	121.3	80%	0.804	73%	0.728	S	S	*	*			trans	-153.8	122.2	152	-85.6	0	0	0	0	108.7
822	C	30.7	Very low	31.3	Very low	101 Å²	101	122.1 Å²	122.1	68%	0.682	73%	0.732	S	S	*	*			cis	75.5	146.1	27.4	102	0	0	0	0	114.7
823	D	32.3	Very low	31.4	Very low	143 Å²	143	118.9 Å²	118.9	77%	0.765	74%	0.735	S	S	*	*			cis	-148	-165.5	5.2	-151.6	-89.7	0	0	0	111.6
824	S	35.1	Very low	31.4	Very low	101 Å²	101	116.3 Å²	116.3	71%	0.706	73%	0.733	S	S	*	*			trans	92.1	142.5	-179	-47.8	0	0	0	0	115.8
825	T	33.6	Very low	31.3	Very low	129 Å²	129	117 Å²	117	79%	0.791	74%	0.738	S	S	*	*			cis	-168.9	152.2	-19.8	31.2	0	0	0	0	108.2
826	A	33.8	Very low	31.4	Very low	77 Å²	77	118.6 Å²	118.6	64%	0.636	74%	0.743	S	S	*	*			cis	-169.9	139.2	-20.8	0	0	0	0	0	111.5
827	S	33.6	Very low	31.5	Very low	112 Å²	112	119.1 Å²	119.1	78%	0.783	75%	0.746	S	S	*	*			trans	69.5	152.2	150.6	73.3	0	0	0	0	122.4
828	T	31	Very low	31.5	Very low	129 Å²	129	120.8 Å²	120.8	79%	0.791	75%	0.753	S	S	*	*			cis	-172.3	163	-25.9	-84.3	0	0	0	0	108
829	A	33.4	Very low	31.4	Very low	79 Å²	79	120.5 Å²	120.5	65%	0.653	75%	0.753	S	S	*	*			trans	91.6	113.8	169.4	0	0	0	0	0	115.1
830	N	30.2	Very low	31.3	Very low	142 Å²	142	119.4 Å²	119.4	76%	0.759	75%	0.75	S	S	*	*				82.9	135.4	57.4	-67.6	19.4	0	0	0	111.3
831	T	34.2	Very low	31.2	Very low	106 Å²	106	120.6 Å²	120.6	65%	0.65	75%	0.752	S	S	*	*			cis	-163.7	157.2	6.8	6.4	0	0	0	0	110
832	D	31.2	Very low	31.3	Very low	143 Å²	143	122.2 Å²	122.2	77%	0.765	75%	0.753	S	S	*	*			trans	55.4	155.7	140.2	-61	-10.1	0	0	0	122.2
833	V	29.6	Very low	31.4	Very low	133 Å²	133	123.3 Å²	123.3	81%	0.806	76%	0.762	S	S	*	*			cis	-166.2	179.5	-35.1	107.9	0	0	0	0	107.5
834	A	29.2	Very low	31.3	Very low	87 Å²	87	123.7 Å²	123.7	72%	0.719	76%	0.764	S	S	*	*			trans	80.2	93.2	162.9	0	0	0	0	0	119.8
835	T	27.5	Very low	31.2	Very low	134 Å²	134	124.3 Å²	124.3	82%	0.822	77%	0.768	S	S	*	*			trans	-23.1	133.5	139	-36.7	0	0	0	0	116.5
836	T	30.4	Very low	31.2	Very low	141 Å²	141	125.2 Å²	125.2	87%	0.865	77%	0.767	S	S	*	*				-172.4	154.7	123.7	17.5	0	0	0	0	113
837	S	30.5	Very low	31.4	Very low	103 Å²	103	126.5 Å²	126.5	72%	0.72	77%	0.769	S	S	*	*			trans	-88.2	153.8	173.5	54.6	0	0	0	0	112.5
838	I	32.6	Very low	31.2	Very low	171 Å²	171	128 Å²	128	88%	0.877	77%	0.773	S	S	*	*			trans	-167.2	152.4	136.1	-103.6	151.8	0	0	0	112.4
839	N	28.7	Very low	31.3	Very low	146 Å²	146	124.8 Å²	124.8	78%	0.781	77%	0.766	S	S	*	*			trans	-68.1	169.3	-179.1	-69.5	-35.5	0	0	0	115.1
840	S	30	Very low	31.3	Very low	97 Å²	97	128.9 Å²	128.9	68%	0.678	78%	0.776	S	S	*	*			trans	122.8	100.6	132.1	-60.7	0	0	0	0	117.8
841	N	28.4	Very low	31.3	Very low	139 Å²	139	126.2 Å²	126.2	74%	0.743	77%	0.768	S	S	*	*				54.5	120.4	120.6	-56	-11.9	0	0	0	121.7
842	N	30.4	Very low	31	Very low	154 Å²	154	126.3 Å²	126.3	82%	0.824	77%	0.773	S	S	*	*			trans	51.6	120.3	131.2	-60.4	-7.6	0	0	0	121.1
843	S	33.8	Very low	30.8	Very low	123 Å²	123	125 Å²	125	86%	0.86	77%	0.771	S	S	*	*				-153.8	149.6	127.8	34.9	0	0	0	0	111.2
844	N	30.5	Very low	30.7	Very low	152 Å²	152	124.8 Å²	124.8	81%	0.813	77%	0.77	S	S	*	*			trans	-108.2	135.1	-174.9	-69.8	-41.8	0	0	0	111.8
845	S	33.3	Very low	30.8	Very low	114 Å²	114	127.2 Å²	127.2	80%	0.797	77%	0.771	S	S	*	*			trans	-169.1	135.6	149.5	34.2	0	0	0	0	109.2
846	I	32.6	Very low	30.8	Very low	148 Å²	148	127.4 Å²	127.4	76%	0.759	77%	0.772	S	S	*	*			cis	80.8	123.3	26.1	-56	173.3	0	0	0	112.7
847	P	38.3	Very low	30.6	Very low	104 Å²	104	127.9 Å²	127.9	68%	0.675	77%	0.769	S	S	*	*			cis	-143.6	-144.3	-25.2	40.5	-18.3	0	0	0	112.5
848	T	29.4	Very low	30.5	Very low	142 Å²	142	127.2 Å²	127.2	87%	0.871	76%	0.764	S	S	*	*			trans	74.5	146.4	171.3	75.2	0	0	0	0	116.9
849	G	32.8	Very low	30.1	Very low	62 Å²	62	124.4 Å²	124.4	64%	0.639	76%	0.755	S	S	*	*			cis	178.1	147.4	-12.8	0	0	0	0	0	112.2
850	L	34.4	Very low	30.1	Very low	165 Å²	165	125.1 Å²	125.1	86%	0.864	75%	0.753	S	S	*	*				176.3	130.6	117.2	-110.6	65.8	0	0	0	112.3
851	S	29.1	Very low	29.8	Very low	86 Å²	86	124.8 Å²	124.8	60%	0.601	75%	0.751	S	S	*	*			trans	5	132	136.3	51.6	0	0	0	0	119.2
852	S	28.1	Very low	29.8	Very low	108 Å²	108	123 Å²	123	76%	0.755	75%	0.749	S	S	*	*				68.3	150.2	60.7	86.2	0	0	0	0	113.6
853	T	27.3	Very low	29.7	Very low	116 Å²	116	120.7 Å²	120.7	71%	0.712	75%	0.745	S	S	*	*			cis	-144.4	161.9	11	43.2	0	0	0	0	111.5
854	T	28.5	Very low	29.5	Very low	128 Å²	128	121.3 Å²	121.3	79%	0.785	74%	0.738	S	S	*	*				-172.2	110.4	120.8	29.9	0	0	0	0	113
855	N	29.3	Very low	29.6	Very low	139 Å²	139	121.1 Å²	121.1	74%	0.743	74%	0.737	S	S	*	*			trans	42.5	97.3	141.6	-56.8	0.2	0	0	0	120.5
856	T	28	Very low	29.3	Very low	137 Å²	137	123.4 Å²	123.4	84%	0.84	74%	0.739	S	S	*	*			trans	-79.7	117.9	139.4	48.9	0	0	0	0	110.1
857	N	27.6	Very low	29.3	Very low	152 Å²	152	122.1 Å²	122.1	81%	0.813	74%	0.744	S	S	*	*			trans	-167.8	144	163.7	-92.7	-27.1	0	0	0	106.3
858	S	26.5	Very low	28.9	Very low	88 Å²	88	125.1 Å²	125.1	62%	0.615	75%	0.754	S	S	*	*			cis	-167.5	149.1	-4.2	50.2	0	0	0	0	109.7
859	T	25.5	Very low	29.1	Very low	112 Å²	112	124.1 Å²	124.1	69%	0.687	75%	0.752	S	S	*	*			trans	54.5	158.9	149.4	54.8	0	0	0	0	121.8
860	H	27.6	Very low	28.9	Very low	161 Å²	161	124.2 Å²	124.2	75%	0.745	75%	0.754	S	S	*	*			trans	70.8	129.2	174.2	-53.3	-68.2	0	0	0	116.3
861	S	25.2	Very low	29	Very low	91 Å²	91	122.6 Å²	122.6	64%	0.636	75%	0.75	S	S	*	*			cis	82.4	141	29.4	87.1	0	0	0	0	114.5
862	S	28	Very low	29.2	Very low	100 Å²	100	124.4 Å²	124.4	70%	0.699	76%	0.76	S	S	*	*			trans	64.2	129	-151.4	66.2	0	0	0	0	112.2
863	S	28.2	Very low	29.5	Very low	106 Å²	106	126.6 Å²	126.6	74%	0.741	76%	0.762	S	S	*	*			cis	75.2	163.1	35.8	89	0	0	0	0	114
864	I	29.7	Very low	29.9	Very low	136 Å²	136	127.3 Å²	127.3	70%	0.697	77%	0.769	S	S	*	*			trans	96	113.3	176.4	-56.2	169.8	0	0	0	116.5
865	N	31.4	Very low	30.2	Very low	149 Å²	149	124.8 Å²	124.8	80%	0.797	77%	0.768	S	S	*	*			trans	75.9	123.7	150	-64.8	-4.2	0	0	0	124.3
866	L	28.3	Very low	30.7	Very low	161 Å²	161	126.3 Å²	126.3	84%	0.843	77%	0.77	S	S	*	*			trans	-51.2	148.9	150.4	-70.1	57.3	0	0	0	111.9
867	S	32.1	Very low	31.5	Very low	122 Å²	122	131.3 Å²	131.3	85%	0.853	77%	0.774	S	S	*	*				-177	162.9	110.6	41.2	0	0	0	0	112.4
868	N	30.8	Very low	32.3	Very low	166 Å²	166	128 Å²	128	89%	0.888	75%	0.753	S	S	*	*			trans	-59.4	137.1	-177.6	-63.7	-28.9	0	0	0	113.4
869	S	31.9	Very low	33.4	Very low	121 Å²	121	127.8 Å²	127.8	85%	0.846	75%	0.75	S	S	*	*				-177.4	127.4	122.3	-172.9	0	0	0	0	113.5
870	G	30.5	Very low	34.6	Very low	65 Å²	65	128 Å²	128	67%	0.67	75%	0.751	S	S	*	*			trans	94.7	144.2	138.7	0	0	0	0	0	120
871	V	36.4	Very low	36	Very low	130 Å²	130	128.6 Å²	128.6	79%	0.788	75%	0.748	S	S	*	*			trans	74.5	106.2	167.1	-168.7	0	0	0	0	117
872	P	32.1	Very low	37.6	Very low	124 Å²	124	126.7 Å²	126.7	81%	0.805	73%	0.732	S	S	*	*			trans	-78.9	121.7	171.4	31.7	-32.1	0	0	0	111.5
873	I	35.8	Very low	38.7	Very low	155 Å²	155	124.7 Å²	124.7	80%	0.795	72%	0.718	S	S	*	*			trans	-90.8	121.3	175.8	-58.6	178	0	0	0	109.5	G875	I873-G875 PolarHBondContact O-N 2.93Å
874	P	34.2	Very low	40	Very low	131 Å²	131	125.2 Å²	125.2	85%	0.851	71%	0.705	S	S	*	*			trans	-81	101.4	-178.1	31.2	-33.4	0	0	0	111.3
875	G	35.1	Very low	41.2	Very low	75 Å²	75	121.8 Å²	121.8	77%	0.773	69%	0.69	S	S	*	*			trans	-167.9	71.6	-175.6	0	0	0	0	0	116.9	I873	I873-G875 PolarHBondContact O-N 2.93Å
876	H	40.7	Very low	42.6	Very low	170 Å²	170	121.3 Å²	121.3	79%	0.787	68%	0.677	S	S	*	*			trans	-136.8	94.2	159	-156	-49.6	0	0	0	110.5	E878	H876-E878 PolarHBondContact O-N 2.87Å
877	R	43.6	Very low	44.2	Very low	242 Å²	242	119.6 Å²	119.6	91%	0.913	66%	0.66	S	S	*	*	P	Polyproline II helix	trans	-67	123.5	167.2	-84.2	179.3	166.5	164.7	-4.7	108.1
878	E	44.6	Very low	45.3	Very low	82 Å²	82	115 Å²	115	38%	0.383	63%	0.625	S	S	.	*	P	Polyproline II helix	trans	-68.2	143.7	164.1	-72.9	-174.8	121.2	0	0	109.5	H876 R886	H876-E878 PolarHBondContact O-N 2.87Å; E878-R886 IonicContact OE1-CZ 3.55Å; E878-R886 IonicContact OE1-NH1 3.46Å; E878-R886 PolarHBondContact OE1-NH1 2.88Å; E878-R886 IonicContact OE1-NH2 2.73Å; E878-R886 PolarHBondContact OE1-NH2 2.86Å; E878-R886 IonicContact OE2-CZ 3.54Å; E878-R886 IonicContact OE2-NH1 2.68Å; E878-R886 PolarHBondContact OE2-NH1 3.07Å; E878-R886 IonicContact OE2-NH2 3.5Å
879	P	49.8	Very low	46.7	Very low	85 Å²	85	109 Å²	109	55%	0.552	60%	0.599	S	S	*	*	P	Polyproline II helix	trans	-63.5	139.4	174.3	26.8	-33.3	0	0	0	110	Y881 V882	P879-Y881 PolarHBondContact O-N 2.6Å; P879-V882 HydrophobicContact CG-CB 4.38Å; P879-V882 HydrophobicContact CG-CG2 3.88Å; P879-V882 PolarHBondContact O-N 2.88Å
880	V	50.1	Low	48.2	Very low	117 Å²	117	111.6 Å²	111.6	71%	0.709	60%	0.595	S	S	*	*	H	α-helix	trans	-52.5	-36.1	-170.5	-178.8	0	0	0	0	112.5	V882 S883 Y884	V880-V882 VanDerWaalsContact C-N 3.35Å; V880-V882 PolarHBondContact O-N 3.16Å; V880-S883 PolarHBondContact O-N 2.97Å; V880-S883 VanDerWaalsContact O-N 3.13Å; V880-S883 PolarHBondContact O-OG 3.01Å; V880-Y884 PolarHBondContact O-N 2.8Å
881	Y	57	Low	49.6	Very low	172 Å²	172	113.2 Å²	113.2	68%	0.675	58%	0.584	S	S	*	*	H	α-helix	trans	-54.3	-43.7	174.5	-178.9	-104.7	0	0	0	113.7	P879 S883 Y884 V885	P879-Y881 PolarHBondContact O-N 2.6Å; Y881-S883 VanDerWaalsContact C-N 3.35Å; Y881-S883 PolarHBondContact O-N 3.3Å; Y881-Y884 PolarHBondContact O-N 3.28Å; Y881-V885 HydrophobicContact CD1-CG2 4.25Å; Y881-V885 HydrophobicContact CD2-CG2 4.29Å; Y881-V885 HydrophobicContact CE1-CG2 3.82Å; Y881-V885 HydrophobicContact CE2-CG2 3.87Å; Y881-V885 HydrophobicContact CG-CG2 4.47Å; Y881-V885 WeakPolarHBondContact O-CG2 3.49Å; Y881-V885 PolarHBondContact O-N 3.08Å
882	V	59.3	Low	50.5	Low	51 Å²	51	108.7 Å²	108.7	31%	0.309	56%	0.555	S	S	.	*	H	α-helix	trans	-66.3	-38.9	178.1	172.6	0	0	0	0	110.8	P879 V880 R886	P879-V882 HydrophobicContact CG-CB 4.38Å; P879-V882 HydrophobicContact CG-CG2 3.88Å; P879-V882 PolarHBondContact O-N 2.88Å; V880-V882 VanDerWaalsContact C-N 3.35Å; V880-V882 PolarHBondContact O-N 3.16Å; V882-R886 WeakPolarHBondContact O-CB 3.45Å; V882-R886 PolarHBondContact O-N 2.93Å
883	S	50.3	Low	51.8	Low	58 Å²	58	105.8 Å²	105.8	41%	0.406	54%	0.536	S	S	.	.	H	α-helix	trans	-65.6	-37.8	174.4	75.5	0	0	0	0	112.3	V880 Y881 Y887	V880-S883 PolarHBondContact O-N 2.97Å; V880-S883 VanDerWaalsContact O-N 3.13Å; V880-S883 PolarHBondContact O-OG 3.01Å; Y881-S883 VanDerWaalsContact C-N 3.35Å; Y881-S883 PolarHBondContact O-N 3.3Å; S883-Y887 VanDerWaalsContact O-CB 3.24Å; S883-Y887 WeakPolarHBondContact O-CB 3.31Å; S883-Y887 PolarHBondContact O-N 3.17Å
884	Y	56.2	Low	52.7	Low	117 Å²	117	102 Å²	102	46%	0.459	53%	0.528	S	S	.	.	H	α-helix	trans	-68.7	-45	176.1	174.6	-101	0	0	0	112.3	V880 Y881 Y887 M888	V880-Y884 PolarHBondContact O-N 2.8Å; Y881-Y884 PolarHBondContact O-N 3.28Å; Y884-Y887 WeakPolarHBondContact O-CB 3.39Å; Y884-Y887 PolarHBondContact O-N 2.87Å; Y884-M888 HydrophobicContact CD1-CG 4.24Å; Y884-M888 HydrophobicContact CD2-CG 4.29Å; Y884-M888 HydrophobicContact CE1-CG 3.78Å; Y884-M888 HydrophobicContact CE2-CE 4.17Å; Y884-M888 HydrophobicContact CE2-CG 3.84Å; Y884-M888 HydrophobicContact CE2-SD 4.22Å; Y884-M888 HydrophobicContact CG-CG 4.48Å; Y884-M888 WeakPolarHBondContact O-CB 2.85Å; Y884-M888 WeakPolarHBondContact O-CG 3.29Å; Y884-M888 PolarHBondContact O-N 2.85Å
885	V	56	Low	53.9	Low	64 Å²	64	100.1 Å²	100.1	39%	0.388	51%	0.511	S	S	.	.	H	α-helix	trans	-64	-42.1	176.4	172.3	0	0	0	0	110.8	Y881 Y887 M888 A889	Y881-V885 HydrophobicContact CD1-CG2 4.25Å; Y881-V885 HydrophobicContact CD2-CG2 4.29Å; Y881-V885 HydrophobicContact CE1-CG2 3.82Å; Y881-V885 HydrophobicContact CE2-CG2 3.87Å; Y881-V885 HydrophobicContact CG-CG2 4.47Å; Y881-V885 WeakPolarHBondContact O-CG2 3.49Å; Y881-V885 PolarHBondContact O-N 3.08Å; V885-Y887 VanDerWaalsContact C-N 3.35Å; V885-Y887 PolarHBondContact O-N 3.18Å; V885-M888 PolarHBondContact O-N 2.7Å; V885-A889 VanDerWaalsContact O-CB 3.3Å; V885-A889 WeakPolarHBondContact O-CB 3.46Å; V885-A889 PolarHBondContact O-N 3.07Å
886	R	60.1	Low	54.8	Low	140 Å²	140	99.2 Å²	99.2	53%	0.528	48%	0.484	S	S	.	.	H	α-helix	trans	-65.7	-36.2	174.8	-166.9	-176.8	-64.3	131.4	2.3	112.4	E878 V882 K890	E878-R886 IonicContact OE1-CZ 3.55Å; E878-R886 IonicContact OE1-NH1 3.46Å; E878-R886 PolarHBondContact OE1-NH1 2.88Å; E878-R886 IonicContact OE1-NH2 2.73Å; E878-R886 PolarHBondContact OE1-NH2 2.86Å; E878-R886 IonicContact OE2-CZ 3.54Å; E878-R886 IonicContact OE2-NH1 2.68Å; E878-R886 PolarHBondContact OE2-NH1 3.07Å; E878-R886 IonicContact OE2-NH2 3.5Å; V882-R886 WeakPolarHBondContact O-CB 3.45Å; V882-R886 PolarHBondContact O-N 2.93Å; R886-K890 PolarHBondContact O-N 3.23Å
887	Y	62.6	Low	55.5	Low	124 Å²	124	94.8 Å²	94.8	49%	0.486	47%	0.466	S	S	.	.	H	α-helix	trans	-65.2	-49.9	173	176.3	-95.4	0	0	0	111.4	S883 Y884 V885 A889 K890 F891	S883-Y887 VanDerWaalsContact O-CB 3.24Å; S883-Y887 WeakPolarHBondContact O-CB 3.31Å; S883-Y887 PolarHBondContact O-N 3.17Å; Y884-Y887 WeakPolarHBondContact O-CB 3.39Å; Y884-Y887 PolarHBondContact O-N 2.87Å; V885-Y887 VanDerWaalsContact C-N 3.35Å; V885-Y887 PolarHBondContact O-N 3.18Å; Y887-A889 PolarHBondContact O-N 2.96Å; Y887-K890 VanDerWaalsContact O-CB 3.28Å; Y887-K890 WeakPolarHBondContact O-CB 3.42Å; Y887-K890 PolarHBondContact O-N 3.33Å; Y887-K890 VanDerWaalsContact O-N 3.15Å; Y887-F891 HydrophobicContact CD1-CE2 4.23Å; Y887-F891 HydrophobicContact CD2-CE2 4.04Å; Y887-F891 HydrophobicContact CE1-CD2 4.35Å; Y887-F891 AromaticContact CE1-CE2 3.85Å; Y887-F891 HydrophobicContact CE1-CE2 3.85Å; Y887-F891 AromaticContact CE2-CE2 3.65Å; Y887-F891 HydrophobicContact CE2-CE2 3.65Å; Y887-F891 HydrophobicContact CE2-CZ 4.15Å; Y887-F891 HydrophobicContact CG-CE2 4.31Å; Y887-F891 AromaticContact CZ-CE2 3.54Å; Y887-F891 WeakPolarHBondContact O-CD2 3.39Å; Y887-F891 WeakPolarHBondContact O-CE2 3.5Å
888	M	53.5	Low	56.2	Low	25 Å²	25	87.3 Å²	87.3	12%	0.123	45%	0.446	C	S	.	.	H	α-helix	trans	-58.8	-45	176.6	-76	-70.9	103.3	0	0	112.3	Y884 V885 K890 F891 M892	Y884-M888 HydrophobicContact CD1-CG 4.24Å; Y884-M888 HydrophobicContact CD2-CG 4.29Å; Y884-M888 HydrophobicContact CE1-CG 3.78Å; Y884-M888 HydrophobicContact CE2-CE 4.17Å; Y884-M888 HydrophobicContact CE2-CG 3.84Å; Y884-M888 HydrophobicContact CE2-SD 4.22Å; Y884-M888 HydrophobicContact CG-CG 4.48Å; Y884-M888 WeakPolarHBondContact O-CB 2.85Å; Y884-M888 WeakPolarHBondContact O-CG 3.29Å; Y884-M888 PolarHBondContact O-N 2.85Å; V885-M888 PolarHBondContact O-N 2.7Å; M888-K890 PolarHBondContact O-N 3.44Å; M888-K890 VanDerWaalsContact O-N 3.13Å; M888-F891 PolarHBondContact O-N 3.31Å; M888-M892 HydrophobicContact CB-CE 3.87Å; M888-M892 HydrophobicContact CB-SD 4Å; M888-M892 HydrophobicContact CG-CE 4.48Å; M888-M892 VanDerWaalsContact O-CG 3.29Å; M888-M892 WeakPolarHBondContact O-CG 3.3Å; M888-M892 PolarHBondContact O-N 3.07Å; M888-M892 HydrophobicContact SD-CE 4.39Å
889	A	60.3	Low	56.6	Low	40 Å²	40	89.3 Å²	89.3	33%	0.331	45%	0.451	S	S	.	.	H	α-helix	trans	-56	-30.5	177.4	0	0	0	0	0	112.9	V885 Y887 F891 M892	V885-A889 VanDerWaalsContact O-CB 3.3Å; V885-A889 WeakPolarHBondContact O-CB 3.46Å; V885-A889 PolarHBondContact O-N 3.07Å; Y887-A889 PolarHBondContact O-N 2.96Å; A889-F891 PolarHBondContact O-N 3.13Å; A889-M892 PolarHBondContact O-N 3.11Å
890	K	64.1	Low	56.4	Low	176 Å²	176	86 Å²	86	77%	0.765	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-20	176.3	-161.3	-178.7	178	-174.9	0	113.8	R886 Y887 M888	R886-K890 PolarHBondContact O-N 3.23Å; Y887-K890 VanDerWaalsContact O-CB 3.28Å; Y887-K890 WeakPolarHBondContact O-CB 3.42Å; Y887-K890 PolarHBondContact O-N 3.33Å; Y887-K890 VanDerWaalsContact O-N 3.15Å; M888-K890 PolarHBondContact O-N 3.44Å; M888-K890 VanDerWaalsContact O-N 3.13Å
891	F	59	Low	56.4	Low	100 Å²	100	83.2 Å²	83.2	44%	0.439	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.8	6.7	177.8	-54.3	-83.2	0	0	0	112.9	Y887 M888 A889 R933	Y887-F891 HydrophobicContact CD1-CE2 4.23Å; Y887-F891 HydrophobicContact CD2-CE2 4.04Å; Y887-F891 HydrophobicContact CE1-CD2 4.35Å; Y887-F891 AromaticContact CE1-CE2 3.85Å; Y887-F891 HydrophobicContact CE1-CE2 3.85Å; Y887-F891 AromaticContact CE2-CE2 3.65Å; Y887-F891 HydrophobicContact CE2-CE2 3.65Å; Y887-F891 HydrophobicContact CE2-CZ 4.15Å; Y887-F891 HydrophobicContact CG-CE2 4.31Å; Y887-F891 AromaticContact CZ-CE2 3.54Å; Y887-F891 WeakPolarHBondContact O-CD2 3.39Å; Y887-F891 WeakPolarHBondContact O-CE2 3.5Å; M888-F891 PolarHBondContact O-N 3.31Å; A889-F891 PolarHBondContact O-N 3.13Å; F891-R933 PolarHBondContact O-NH1 3.01Å
892	M	55.5	Low	56.2	Low	35 Å²	35	79.9 Å²	79.9	17%	0.172	41%	0.409	C	S	.	.	S	Bend	trans	-104	106.9	179.2	-73.4	164.8	168.4	0	0	108.9	M888 A889 W896 L897 W929	M888-M892 HydrophobicContact CB-CE 3.87Å; M888-M892 HydrophobicContact CB-SD 4Å; M888-M892 HydrophobicContact CG-CE 4.48Å; M888-M892 VanDerWaalsContact O-CG 3.29Å; M888-M892 WeakPolarHBondContact O-CG 3.3Å; M888-M892 PolarHBondContact O-N 3.07Å; M888-M892 HydrophobicContact SD-CE 4.39Å; A889-M892 PolarHBondContact O-N 3.11Å; M892-W896 HydrophobicContact CB-CE3 3.87Å; M892-W896 HydrophobicContact CB-CZ3 4.37Å; M892-W896 HydrophobicContact CE-CE3 4.28Å; M892-W896 HydrophobicContact CE-CH2 3.76Å; M892-W896 HydrophobicContact CE-CZ3 3.53Å; M892-W896 HydrophobicContact CG-CE3 3.67Å; M892-W896 HydrophobicContact CG-CZ3 3.81Å; M892-W896 HydrophobicContact SD-CE3 3.88Å; M892-W896 HydrophobicContact SD-CH2 4.22Å; M892-W896 HydrophobicContact SD-CZ3 3.38Å; M892-W896 WeakPolarHBondContact SD-CZ3 3.29Å; M892-L897 HydrophobicContact CB-CD1 4.36Å; M892-L897 HydrophobicContact CB-CG 4.13Å; M892-L897 HydrophobicContact SD-CD2 4.34Å; M892-W929 HydrophobicContact CE-CH2 3.83Å; M892-W929 HydrophobicContact CE-CZ2 4.14Å; M892-W929 HydrophobicContact CG-CH2 4.07Å; M892-W929 HydrophobicContact CG-CZ2 4.09Å
893	P	60.2	Low	55.6	Low	62 Å²	62	77.9 Å²	77.9	40%	0.403	40%	0.398	S	S	.	.			trans	-61.6	147.7	175.7	28	-34.9	0	0	0	109.4	N895 W896 L897	P893-N895 VanDerWaalsContact CB-OD1 3.31Å; P893-N895 WeakPolarHBondContact CB-OD1 3.48Å; P893-N895 WeakPolarHBondContact CG-OD1 3.44Å; P893-N895 PolarHBondContact O-N 3.18Å; P893-W896 HydrophobicContact CG-CB 4.11Å; P893-W896 WeakPolarHBondContact O-CA 3.38Å; P893-W896 WeakPolarHBondContact O-CB 3.37Å; P893-W896 PolarHBondContact O-N 3.37Å; P893-L897 PolarHBondContact O-N 2.89Å
894	A	54	Low	55.5	Low	77 Å²	77	80.5 Å²	80.5	64%	0.636	41%	0.407	S	S	*	.	H	α-helix	trans	-59.4	-34.5	-169.8	0	0	0	0	0	113.3	W896 L897 V898	A894-W896 PolarHBondContact O-N 2.71Å; A894-L897 PolarHBondContact O-N 3.29Å; A894-V898 PolarHBondContact O-N 2.86Å; A894-V898 VanDerWaalsContact O-N 3.1Å
895	N	59	Low	54.9	Low	91 Å²	91	81.8 Å²	81.8	49%	0.487	42%	0.415	S	S	.	.	H	α-helix	trans	-58.8	-32.7	172.3	66.3	-15	0	0	0	112.4	P893 R899	P893-N895 VanDerWaalsContact CB-OD1 3.31Å; P893-N895 WeakPolarHBondContact CB-OD1 3.48Å; P893-N895 WeakPolarHBondContact CG-OD1 3.44Å; P893-N895 PolarHBondContact O-N 3.18Å; N895-R899 WeakPolarHBondContact O-CB 3.34Å; N895-R899 WeakPolarHBondContact O-CG 3.29Å; N895-R899 PolarHBondContact O-N 3Å
896	W	55.3	Low	54.5	Low	55 Å²	55	83.4 Å²	83.4	21%	0.208	42%	0.421	C	S	.	.	H	α-helix	trans	-75.5	-39.9	174.5	-175.1	86.5	0	0	0	112.3	M892 P893 A894 V898 R899 S900 W929 R933	M892-W896 HydrophobicContact CB-CE3 3.87Å; M892-W896 HydrophobicContact CB-CZ3 4.37Å; M892-W896 HydrophobicContact CE-CE3 4.28Å; M892-W896 HydrophobicContact CE-CH2 3.76Å; M892-W896 HydrophobicContact CE-CZ3 3.53Å; M892-W896 HydrophobicContact CG-CE3 3.67Å; M892-W896 HydrophobicContact CG-CZ3 3.81Å; M892-W896 HydrophobicContact SD-CE3 3.88Å; M892-W896 HydrophobicContact SD-CH2 4.22Å; M892-W896 HydrophobicContact SD-CZ3 3.38Å; M892-W896 WeakPolarHBondContact SD-CZ3 3.29Å; P893-W896 HydrophobicContact CG-CB 4.11Å; P893-W896 WeakPolarHBondContact O-CA 3.38Å; P893-W896 WeakPolarHBondContact O-CB 3.37Å; P893-W896 PolarHBondContact O-N 3.37Å; A894-W896 PolarHBondContact O-N 2.71Å; W896-V898 VanDerWaalsContact C-N 3.31Å; W896-V898 PolarHBondContact O-N 2.71Å; W896-R899 CarbonylContact O-C 3.54Å; W896-R899 PolarHBondContact O-N 2.96Å; W896-S900 VanDerWaalsContact CE2-CB 3.44Å; W896-S900 VanDerWaalsContact CH2-CB 3.41Å; W896-S900 WeakPolarHBondContact CH2-OG 3.38Å; W896-S900 VanDerWaalsContact CZ3-OG 3.24Å; W896-S900 WeakPolarHBondContact CZ3-OG 3.47Å; W896-S900 WeakPolarHBondContact O-CA 2.99Å; W896-S900 WeakPolarHBondContact O-CB 3.35Å; W896-S900 PolarHBondContact O-N 3.12Å; W896-S900 PolarHBondContact O-OG 3.39Å; W896-W929 AromaticContact CD2-CH2 3.62Å; W896-W929 HydrophobicContact CD2-CH2 3.62Å; W896-W929 HydrophobicContact CD2-CZ3 4.05Å; W896-W929 AromaticContact CE2-CH2 3.39Å; W896-W929 AromaticContact CE2-CZ3 3.31Å; W896-W929 AromaticContact CE3-CH2 3.99Å; W896-W929 HydrophobicContact CE3-CH2 3.99Å; W896-W929 HydrophobicContact CG-CH2 4.21Å; W896-W929 AromaticContact CH2-CH2 3.99Å; W896-W929 HydrophobicContact CH2-CH2 3.99Å; W896-W929 HydrophobicContact CH2-CZ3 4.04Å; W896-W929 AromaticContact CZ2-CH2 3.62Å; W896-W929 HydrophobicContact CZ2-CH2 3.62Å; W896-W929 AromaticContact CZ2-CZ3 3.32Å; W896-W929 HydrophobicContact CZ2-CZ3 3.32Å; W896-W929 HydrophobicContact CZ3-CH2 4.17Å; W896-W929 AromaticContact NE1-CH2 3.8Å; W896-W929 AromaticContact NE1-CZ3 3.5Å; W896-R933 VanDerWaalsContact CD1-NH2 3.33Å
897	L	55.5	Low	53.9	Low	78 Å²	78	77.9 Å²	77.9	41%	0.408	40%	0.402	S	S	.	.	H	α-helix	trans	-63.3	-39.3	177.4	-85	167.3	0	0	0	111.9	M892 P893 A894 S900 A901	M892-L897 HydrophobicContact CB-CD1 4.36Å; M892-L897 HydrophobicContact CB-CG 4.13Å; M892-L897 HydrophobicContact SD-CD2 4.34Å; P893-L897 PolarHBondContact O-N 2.89Å; A894-L897 PolarHBondContact O-N 3.29Å; L897-S900 PolarHBondContact O-OG 2.83Å; L897-A901 VanDerWaalsContact O-CB 3.31Å; L897-A901 WeakPolarHBondContact O-CB 3.24Å; L897-A901 PolarHBondContact O-N 2.88Å
898	V	57.5	Low	53.2	Low	84 Å²	84	77.3 Å²	77.3	51%	0.509	41%	0.411	S	S	.	.	H	α-helix	trans	-67.6	-48.7	172.7	177.6	0	0	0	0	110.8	A894 W896 S900 A901 Q902	A894-V898 PolarHBondContact O-N 2.86Å; A894-V898 VanDerWaalsContact O-N 3.1Å; W896-V898 VanDerWaalsContact C-N 3.31Å; W896-V898 PolarHBondContact O-N 2.71Å; V898-S900 VanDerWaalsContact C-N 3.32Å; V898-S900 PolarHBondContact O-N 2.67Å; V898-A901 PolarHBondContact O-N 3.38Å; V898-Q902 WeakPolarHBondContact O-CB 3.48Å; V898-Q902 VanDerWaalsContact O-CG 3.25Å; V898-Q902 WeakPolarHBondContact O-CG 3.44Å; V898-Q902 PolarHBondContact O-N 3.48Å
899	R	52.4	Low	52.8	Low	124 Å²	124	82 Å²	82	47%	0.468	44%	0.437	S	S	.	.	H	α-helix	trans	-67.4	-26.1	178.8	-74.6	175.1	-177.2	-175.4	-0.8	113.7	N895 W896 A903	N895-R899 WeakPolarHBondContact O-CB 3.34Å; N895-R899 WeakPolarHBondContact O-CG 3.29Å; N895-R899 PolarHBondContact O-N 3Å; W896-R899 CarbonylContact O-C 3.54Å; W896-R899 PolarHBondContact O-N 2.96Å; R899-A903 WeakPolarHBondContact O-CA 3.23Å; R899-A903 WeakPolarHBondContact O-CB 3.21Å; R899-A903 PolarHBondContact O-N 3.1Å
900	S	46.1	Very low	52.6	Low	17 Å²	17	86.9 Å²	86.9	12%	0.119	45%	0.453	C	S	.	.	H	α-helix	trans	-82.8	-35.7	177.5	71.7	0	0	0	0	111.4	W896 L897 V898 Q902 A903 L904	W896-S900 VanDerWaalsContact CE2-CB 3.44Å; W896-S900 VanDerWaalsContact CH2-CB 3.41Å; W896-S900 WeakPolarHBondContact CH2-OG 3.38Å; W896-S900 VanDerWaalsContact CZ3-OG 3.24Å; W896-S900 WeakPolarHBondContact CZ3-OG 3.47Å; W896-S900 WeakPolarHBondContact O-CA 2.99Å; W896-S900 WeakPolarHBondContact O-CB 3.35Å; W896-S900 PolarHBondContact O-N 3.12Å; W896-S900 PolarHBondContact O-OG 3.39Å; L897-S900 PolarHBondContact O-OG 2.83Å; V898-S900 VanDerWaalsContact C-N 3.32Å; V898-S900 PolarHBondContact O-N 2.67Å; S900-Q902 VanDerWaalsContact C-N 3.3Å; S900-A903 PolarHBondContact O-N 3.49Å; S900-L904 VanDerWaalsContact O-CB 3.27Å; S900-L904 WeakPolarHBondContact O-CB 3.35Å; S900-L904 WeakPolarHBondContact O-CD1 3.16Å; S900-L904 WeakPolarHBondContact O-CG 3.49Å; S900-L904 PolarHBondContact O-N 2.66Å
901	A	51	Low	52.3	Low	57 Å²	57	79.3 Å²	79.3	47%	0.471	42%	0.42	S	S	.	.	H	α-helix	trans	-61.9	-41.5	166.4	0	0	0	0	0	110.5	L897 V898 K905	L897-A901 VanDerWaalsContact O-CB 3.31Å; L897-A901 WeakPolarHBondContact O-CB 3.24Å; L897-A901 PolarHBondContact O-N 2.88Å; V898-A901 PolarHBondContact O-N 3.38Å; A901-K905 WeakPolarHBondContact O-CB 3.26Å; A901-K905 PolarHBondContact O-N 3.32Å
902	Q	52.1	Low	52.6	Low	102 Å²	102	79.6 Å²	79.6	48%	0.477	44%	0.435	S	S	.	.	H	α-helix	trans	-66.7	-46.7	173.3	-72.3	168.5	-17.1	0	0	112.3	V898 S900 L904 K905 L906	V898-Q902 WeakPolarHBondContact O-CB 3.48Å; V898-Q902 VanDerWaalsContact O-CG 3.25Å; V898-Q902 WeakPolarHBondContact O-CG 3.44Å; V898-Q902 PolarHBondContact O-N 3.48Å; S900-Q902 VanDerWaalsContact C-N 3.3Å; Q902-L904 PolarHBondContact O-N 2.82Å; Q902-K905 CarbonylContact O-C 3.44Å; Q902-K905 PolarHBondContact O-N 3.04Å; Q902-K905 VanDerWaalsContact O-N 3.14Å; Q902-L906 WeakPolarHBondContact O-CB 3.1Å; Q902-L906 VanDerWaalsContact O-CG 3.26Å; Q902-L906 WeakPolarHBondContact O-CG 3.36Å; Q902-L906 PolarHBondContact O-N 2.66Å
903	A	47.9	Very low	53.4	Low	10 Å²	10	80.1 Å²	80.1	8%	0.083	44%	0.442	C	S	.	.	H	α-helix	trans	-59.9	-44.9	177.5	0	0	0	0	0	111.3	R899 S900 L906 N907 E971	R899-A903 WeakPolarHBondContact O-CA 3.23Å; R899-A903 WeakPolarHBondContact O-CB 3.21Å; R899-A903 PolarHBondContact O-N 3.1Å; S900-A903 PolarHBondContact O-N 3.49Å; A903-L906 PolarHBondContact O-N 3.16Å; A903-N907 VanDerWaalsContact O-CB 3.23Å; A903-N907 WeakPolarHBondContact O-CB 3.4Å; A903-N907 PolarHBondContact O-N 3.02Å; A903-N907 PolarHBondContact O-ND2 2.92Å; A903-E971 WeakPolarHBondContact CB-OE1 3.49Å; A903-E971 WeakPolarHBondContact CB-OE2 3.38Å
904	L	47.4	Very low	54.1	Low	113 Å²	113	80.8 Å²	80.8	59%	0.592	44%	0.442	S	S	*	.	H	α-helix	trans	-63.1	-47.9	172.6	-71.6	167	0	0	0	110.4	S900 Q902 L906 V908	S900-L904 VanDerWaalsContact O-CB 3.27Å; S900-L904 WeakPolarHBondContact O-CB 3.35Å; S900-L904 WeakPolarHBondContact O-CD1 3.16Å; S900-L904 WeakPolarHBondContact O-CG 3.49Å; S900-L904 PolarHBondContact O-N 2.66Å; Q902-L904 PolarHBondContact O-N 2.82Å; L904-L906 PolarHBondContact O-N 3.5Å; L904-V908 WeakPolarHBondContact O-CB 3.32Å; L904-V908 WeakPolarHBondContact O-CG2 3.41Å; L904-V908 PolarHBondContact O-N 3.41Å
905	K	44.4	Very low	55.1	Low	143 Å²	143	82.6 Å²	82.6	62%	0.622	45%	0.445	S	S	*	.	H	α-helix	trans	-66.4	-15.9	179.6	-165.3	168.2	-175	174.6	0	114.1	A901 Q902 N909	A901-K905 WeakPolarHBondContact O-CB 3.26Å; A901-K905 PolarHBondContact O-N 3.32Å; Q902-K905 CarbonylContact O-C 3.44Å; Q902-K905 PolarHBondContact O-N 3.04Å; Q902-K905 VanDerWaalsContact O-N 3.14Å; K905-N909 PolarHBondContact O-ND2 3.29Å
906	L	46.5	Very low	55.9	Low	98 Å²	98	84.2 Å²	84.2	51%	0.513	45%	0.454	S	S	.	.	H	α-helix	trans	-96.9	-50.9	173.5	-70.7	169.2	0	0	0	111.9	Q902 A903 L904 N909 Q910	Q902-L906 WeakPolarHBondContact O-CB 3.1Å; Q902-L906 VanDerWaalsContact O-CG 3.26Å; Q902-L906 WeakPolarHBondContact O-CG 3.36Å; Q902-L906 PolarHBondContact O-N 2.66Å; A903-L906 PolarHBondContact O-N 3.16Å; L904-L906 PolarHBondContact O-N 3.5Å; L906-N909 CarbonylContact O-C 3.48Å; L906-N909 PolarHBondContact O-N 3.37Å; L906-N909 VanDerWaalsContact O-N 3.1Å; L906-Q910 WeakPolarHBondContact O-CB 3.44Å; L906-Q910 PolarHBondContact O-N 2.87Å; L906-Q910 VanDerWaalsContact O-N 3.09Å
907	N	46.9	Very low	57.2	Low	24 Å²	24	82.8 Å²	82.8	13%	0.128	45%	0.45	C	S	.	.	H	α-helix	trans	-63.8	-42.4	-179.9	-73.7	-67.2	0	0	0	112.1	A903 N909 Q910 I911 E971 A997	A903-N907 VanDerWaalsContact O-CB 3.23Å; A903-N907 WeakPolarHBondContact O-CB 3.4Å; A903-N907 PolarHBondContact O-N 3.02Å; A903-N907 PolarHBondContact O-ND2 2.92Å; N907-N909 PolarHBondContact O-N 2.63Å; N907-N909 VanDerWaalsContact O-N 3.1Å; N907-Q910 PolarHBondContact O-N 3.18Å; N907-Q910 VanDerWaalsContact O-N 3.1Å; N907-I911 PolarHBondContact O-N 3.43Å; N907-E971 PolarHBondContact ND2-OE2 3.29Å; N907-A997 VanDerWaalsContact OD1-CB 3.29Å; N907-A997 WeakPolarHBondContact OD1-CB 3.33Å
908	V	48.5	Very low	58.2	Low	113 Å²	113	83.7 Å²	83.7	69%	0.685	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-22.1	175.8	173	0	0	0	0	112.1	L904	L904-V908 WeakPolarHBondContact O-CB 3.32Å; L904-V908 WeakPolarHBondContact O-CG2 3.41Å; L904-V908 PolarHBondContact O-N 3.41Å
909	N	45.5	Very low	59.3	Low	124 Å²	124	87.7 Å²	87.7	66%	0.663	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.3	0.5	179.2	-71	-53.7	0	0	0	114.5	K905 L906 N907	K905-N909 PolarHBondContact O-ND2 3.29Å; L906-N909 CarbonylContact O-C 3.48Å; L906-N909 PolarHBondContact O-N 3.37Å; L906-N909 VanDerWaalsContact O-N 3.1Å; N907-N909 PolarHBondContact O-N 2.63Å; N907-N909 VanDerWaalsContact O-N 3.1Å
910	Q	55.3	Low	60.8	Low	142 Å²	142	83.7 Å²	83.7	66%	0.664	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-135.4	-19	-176.6	-66.1	-168.9	12.8	0	0	115.3	L906 N907	L906-Q910 WeakPolarHBondContact O-CB 3.44Å; L906-Q910 PolarHBondContact O-N 2.87Å; L906-Q910 VanDerWaalsContact O-N 3.09Å; N907-Q910 PolarHBondContact O-N 3.18Å; N907-Q910 VanDerWaalsContact O-N 3.1Å
911	I	59.3	Low	62.7	Low	16 Å²	16	84 Å²	84	8%	0.082	45%	0.448	C	S	.	.			trans	-133.9	99.9	176	-59.9	-178.9	0	0	0	109.8	N907 V974 R976 A997	N907-I911 PolarHBondContact O-N 3.43Å; I911-V974 HydrophobicContact CG2-CB 4.16Å; I911-V974 HydrophobicContact CG2-CG1 4.06Å; I911-R976 HydrophobicContact CG2-CG 3.96Å; I911-A997 HydrophobicContact CD1-CB 4.09Å
912	S	65.3	Low	64	Low	106 Å²	106	84.4 Å²	84.4	74%	0.741	45%	0.451	S	S	*	.			trans	-67.7	144	165.8	48	0	0	0	0	111	R976	S912-R976 WeakPolarHBondContact O-CG 3.36Å
913	C	71.4	Confident	65.4	Low	47 Å²	47	83.5 Å²	83.5	32%	0.318	45%	0.449	S	S	.	.			trans	-136.6	152.3	169.7	60.3	0	0	0	0	109.3	V974 L975 R976	C913-V974 HydrophobicContact CB-CG1 4.08Å; C913-L975 WeakPolarHBondContact CB-O 3.29Å; C913-R976 CarbonylContact C-O 3.33Å; C913-R976 WeakPolarHBondContact CA-O 3.26Å
914	D	75.7	Confident	67.2	Low	76 Å²	76	84.6 Å²	84.6	41%	0.406	45%	0.454	S	S	.	.			trans	-64.5	141.5	177.7	-59.7	-28.9	0	0	0	109.7	N916 M917 R976 R977	D914-N916 PolarHBondContact O-N 3.11Å; D914-M917 HydrophobicContact CB-CG 4.21Å; D914-M917 WeakPolarHBondContact O-CB 3.33Å; D914-M917 PolarHBondContact O-N 3.36Å; D914-R976 PolarHBondContact N-O 3.45Å; D914-R977 VanDerWaalsContact OD2-CB 3.29Å; D914-R977 WeakPolarHBondContact OD2-CB 3.23Å; D914-R977 WeakPolarHBondContact OD2-CG 3.4Å
915	T	73.3	Confident	68.9	Low	115 Å²	115	79.8 Å²	79.8	71%	0.706	43%	0.431	S	S	*	.	G	3₁₀ helix	trans	-51.5	-34.9	-178.6	-47	0	0	0	0	112.7	M917 I918	T915-M917 PolarHBondContact O-N 3.24Å; T915-I918 HydrophobicContact CG2-CD1 4.1Å; T915-I918 WeakPolarHBondContact O-CG1 3.3Å; T915-I918 PolarHBondContact O-N 3.2Å
916	N	77.4	Confident	70.7	Confident	124 Å²	124	78.4 Å²	78.4	66%	0.663	42%	0.422	S	S	*	.	G	3₁₀ helix	trans	-65.7	-18	178.4	-63.7	-19.4	0	0	0	113.9	D914 W919	D914-N916 PolarHBondContact O-N 3.11Å; N916-W919 PolarHBondContact O-NE1 2.79Å
917	M	81.1	Confident	72.4	Confident	25 Å²	25	78.9 Å²	78.9	12%	0.123	42%	0.424	C	S	.	.	G	3₁₀ helix	trans	-91.9	-12.7	-179.5	-60.8	-64.3	105.4	0	0	113.3	D914 T915 W919 L920 N921 V978	D914-M917 HydrophobicContact CB-CG 4.21Å; D914-M917 WeakPolarHBondContact O-CB 3.33Å; D914-M917 PolarHBondContact O-N 3.36Å; T915-M917 PolarHBondContact O-N 3.24Å; M917-W919 PolarHBondContact O-N 2.97Å; M917-L920 PolarHBondContact O-N 2.94Å; M917-L920 HydrophobicContact SD-CD2 4.39Å; M917-N921 PolarHBondContact O-N 3.23Å; M917-N921 PolarHBondContact O-ND2 3.41Å; M917-V978 HydrophobicContact CE-CB 4.23Å; M917-V978 HydrophobicContact CE-CG2 4.28Å; M917-V978 HydrophobicContact SD-CB 4.04Å; M917-V978 HydrophobicContact SD-CG2 3.58Å; M917-V978 VanDerWaalsContact SD-CG2 3.58Å
918	I	76.7	Confident	74.1	Confident	98 Å²	98	79.8 Å²	79.8	50%	0.503	43%	0.429	S	S	.	.	H	α-helix	trans	-58.7	-43.8	-172.9	-63.8	173.1	0	0	0	111.9	T915 L920 N921 A922	T915-I918 HydrophobicContact CG2-CD1 4.1Å; T915-I918 WeakPolarHBondContact O-CG1 3.3Å; T915-I918 PolarHBondContact O-N 3.2Å; I918-L920 VanDerWaalsContact C-N 3.32Å; I918-L920 PolarHBondContact O-N 2.77Å; I918-N921 PolarHBondContact O-N 3.34Å; I918-A922 WeakPolarHBondContact O-CB 3.48Å; I918-A922 PolarHBondContact O-N 3.47Å
919	W	82.2	Confident	75.4	Confident	168 Å²	168	76.2 Å²	76.2	64%	0.636	40%	0.403	S	S	*	.	H	α-helix	trans	-65.8	-35.4	178.2	73.2	-88.7	0	0	0	112.3	N916 M917 A922 L923	N916-W919 PolarHBondContact O-NE1 2.79Å; M917-W919 PolarHBondContact O-N 2.97Å; W919-A922 PolarHBondContact O-N 3.27Å; W919-L923 HydrophobicContact CZ3-CD2 4.04Å; W919-L923 WeakPolarHBondContact O-CB 3.45Å; W919-L923 PolarHBondContact O-N 3.44Å
920	L	82.9	Confident	77	Confident	40 Å²	40	74.6 Å²	74.6	21%	0.209	40%	0.395	C	S	.	.	H	α-helix	trans	-73.5	-40.7	-179.7	-178.4	57.5	0	0	0	110.6	M917 I918 A922 L923 I924 L975 V978	M917-L920 PolarHBondContact O-N 2.94Å; M917-L920 HydrophobicContact SD-CD2 4.39Å; I918-L920 VanDerWaalsContact C-N 3.32Å; I918-L920 PolarHBondContact O-N 2.77Å; L920-A922 VanDerWaalsContact C-N 3.34Å; L920-L923 PolarHBondContact O-N 3Å; L920-I924 HydrophobicContact CD1-CD1 4.21Å; L920-I924 HydrophobicContact CD1-CG1 4.48Å; L920-I924 HydrophobicContact CG-CD1 4.03Å; L920-I924 WeakPolarHBondContact O-CB 3.36Å; L920-I924 VanDerWaalsContact O-CG1 3.27Å; L920-I924 WeakPolarHBondContact O-CG1 3.34Å; L920-I924 PolarHBondContact O-N 2.91Å; L920-L975 HydrophobicContact CD2-CD1 3.75Å; L920-L975 HydrophobicContact CG-CD1 4.06Å; L920-V978 HydrophobicContact CD2-CG2 4.48Å
921	N	85.6	Confident	78.1	Confident	23 Å²	23	70.9 Å²	70.9	12%	0.123	38%	0.377	C	S	.	.	H	α-helix	trans	-62.2	-40	171.3	-71.6	-31.6	0	0	0	111.8	M917 I918 G925 L975	M917-N921 PolarHBondContact O-N 3.23Å; M917-N921 PolarHBondContact O-ND2 3.41Å; I918-N921 PolarHBondContact O-N 3.34Å; N921-G925 PolarHBondContact O-N 3.03Å; N921-L975 PolarHBondContact ND2-O 2.88Å; N921-L975 WeakPolarHBondContact OD1-CA 3.4Å; N921-L975 WeakPolarHBondContact OD1-CB 3.46Å; N921-L975 PolarHBondContact OD1-N 2.83Å; N921-L975 PolarHBondContact OD1-O 2.69Å
922	A	79	Confident	79	Confident	66 Å²	66	72.1 Å²	72.1	55%	0.545	38%	0.383	S	S	.	.	H	α-helix	trans	-65.7	-39.5	173.6	0	0	0	0	0	112.6	I918 W919 L920 G925 R926	I918-A922 WeakPolarHBondContact O-CB 3.48Å; I918-A922 PolarHBondContact O-N 3.47Å; W919-A922 PolarHBondContact O-N 3.27Å; L920-A922 VanDerWaalsContact C-N 3.34Å; A922-G925 PolarHBondContact O-N 3.1Å; A922-R926 PolarHBondContact O-N 3.39Å
923	L	81.5	Confident	79.4	Confident	82 Å²	82	71.6 Å²	71.6	43%	0.429	37%	0.365	S	S	.	.	H	α-helix	trans	-64.8	-46.7	174.7	178	61.2	0	0	0	111.7	W919 L920 G925 R926 L927	W919-L923 HydrophobicContact CZ3-CD2 4.04Å; W919-L923 WeakPolarHBondContact O-CB 3.45Å; W919-L923 PolarHBondContact O-N 3.44Å; L920-L923 PolarHBondContact O-N 3Å; L923-G925 VanDerWaalsContact C-N 3.35Å; L923-G925 PolarHBondContact O-N 3Å; L923-R926 PolarHBondContact O-N 2.67Å; L923-R926 VanDerWaalsContact O-N 3.11Å; L923-L927 HydrophobicContact CD1-CD1 4.29Å; L923-L927 HydrophobicContact CD1-CG 4.39Å; L923-L927 HydrophobicContact CG-CD1 4.14Å; L923-L927 WeakPolarHBondContact O-CG 3.41Å; L923-L927 PolarHBondContact O-N 2.94Å
924	I	84.8	Confident	79.9	Confident	34 Å²	34	74.4 Å²	74.4	17%	0.174	37%	0.373	C	S	.	.	H	α-helix	trans	-60.5	-44.9	175.9	-71.9	165	0	0	0	110.5	L920 R926 L927 L928 I972 L975	L920-I924 HydrophobicContact CD1-CD1 4.21Å; L920-I924 HydrophobicContact CD1-CG1 4.48Å; L920-I924 HydrophobicContact CG-CD1 4.03Å; L920-I924 WeakPolarHBondContact O-CB 3.36Å; L920-I924 VanDerWaalsContact O-CG1 3.27Å; L920-I924 WeakPolarHBondContact O-CG1 3.34Å; L920-I924 PolarHBondContact O-N 2.91Å; I924-R926 VanDerWaalsContact C-N 3.25Å; I924-R926 PolarHBondContact O-N 2.83Å; I924-L927 PolarHBondContact O-N 2.98Å; I924-L928 HydrophobicContact CG2-CD1 3.72Å; I924-L928 HydrophobicContact CG2-CG 4.3Å; I924-L928 WeakPolarHBondContact O-CB 3.44Å; I924-L928 WeakPolarHBondContact O-CG 3.14Å; I924-L928 PolarHBondContact O-N 3.32Å; I924-I972 HydrophobicContact CG2-CG2 4.14Å; I924-L975 HydrophobicContact CD1-CD1 3.43Å; I924-L975 VanDerWaalsContact CD1-CD1 3.43Å; I924-L975 HydrophobicContact CD1-CD2 4.38Å; I924-L975 HydrophobicContact CD1-CG 3.73Å
925	G	83	Confident	80.2	Confident	12 Å²	12	74.3 Å²	74.3	12%	0.124	38%	0.377	C	S	.	.	H	α-helix	trans	-61.7	-30.8	174.5	0	0	0	0	0	113.7	N921 A922 L923 W929	N921-G925 PolarHBondContact O-N 3.03Å; A922-G925 PolarHBondContact O-N 3.1Å; L923-G925 VanDerWaalsContact C-N 3.35Å; L923-G925 PolarHBondContact O-N 3Å; G925-W929 PolarHBondContact O-N 2.77Å
926	R	82.8	Confident	80.8	Confident	114 Å²	114	74 Å²	74	43%	0.43	36%	0.363	S	S	.	.	H	α-helix	trans	-76.4	-35.8	173.8	-173.4	62.4	-167.6	147.5	10.7	112.9	A922 L923 I924 W929	A922-R926 PolarHBondContact O-N 3.39Å; L923-R926 PolarHBondContact O-N 2.67Å; L923-R926 VanDerWaalsContact O-N 3.11Å; I924-R926 VanDerWaalsContact C-N 3.25Å; I924-R926 PolarHBondContact O-N 2.83Å; R926-W929 VanDerWaalsContact O-CB 3.29Å; R926-W929 WeakPolarHBondContact O-CB 3.44Å
927	L	82.8	Confident	81.1	Confident	107 Å²	107	71.3 Å²	71.3	56%	0.56	34%	0.344	S	S	*	.	H	α-helix	trans	-72.8	-38.7	176.8	-69.8	169.8	0	0	0	112.4	L923 I924 W929	L923-L927 HydrophobicContact CD1-CD1 4.29Å; L923-L927 HydrophobicContact CD1-CG 4.39Å; L923-L927 HydrophobicContact CG-CD1 4.14Å; L923-L927 WeakPolarHBondContact O-CG 3.41Å; L923-L927 PolarHBondContact O-N 2.94Å; I924-L927 PolarHBondContact O-N 2.98Å; L927-W929 VanDerWaalsContact C-N 3.26Å; L927-W929 PolarHBondContact O-N 2.96Å
928	L	82.6	Confident	81.4	Confident	43 Å²	43	72.9 Å²	72.9	23%	0.225	35%	0.353	C	S	.	.	H	α-helix	trans	-77.7	-9	176.9	-67.4	176.9	0	0	0	113.3	I924 D930 F931 L932 I972 P973	I924-L928 HydrophobicContact CG2-CD1 3.72Å; I924-L928 HydrophobicContact CG2-CG 4.3Å; I924-L928 WeakPolarHBondContact O-CB 3.44Å; I924-L928 WeakPolarHBondContact O-CG 3.14Å; I924-L928 PolarHBondContact O-N 3.32Å; L928-D930 PolarHBondContact O-N 3.02Å; L928-F931 HydrophobicContact CD2-CB 4.37Å; L928-F931 HydrophobicContact CD2-CD1 4.01Å; L928-F931 HydrophobicContact CD2-CG 4.3Å; L928-F931 PolarHBondContact O-N 2.84Å; L928-L932 HydrophobicContact CB-CD1 4.13Å; L928-L932 HydrophobicContact CB-CG 4.34Å; L928-L932 WeakPolarHBondContact O-CB 3.2Å; L928-L932 VanDerWaalsContact O-CG 3.31Å; L928-L932 WeakPolarHBondContact O-CG 3.31Å; L928-L932 PolarHBondContact O-N 2.87Å; L928-I972 HydrophobicContact CD1-CG2 4.35Å; L928-P973 HydrophobicContact CD1-CG 4.02Å
929	W	75.6	Confident	81.9	Confident	38 Å²	38	74.1 Å²	74.1	14%	0.144	36%	0.356	C	S	.	.	H	α-helix	trans	-54.6	-52.6	-177.9	-177.3	-100.5	0	0	0	113.7	M892 W896 G925 R926 L927 R933	M892-W929 HydrophobicContact CE-CH2 3.83Å; M892-W929 HydrophobicContact CE-CZ2 4.14Å; M892-W929 HydrophobicContact CG-CH2 4.07Å; M892-W929 HydrophobicContact CG-CZ2 4.09Å; W896-W929 AromaticContact CD2-CH2 3.62Å; W896-W929 HydrophobicContact CD2-CH2 3.62Å; W896-W929 HydrophobicContact CD2-CZ3 4.05Å; W896-W929 AromaticContact CE2-CH2 3.39Å; W896-W929 AromaticContact CE2-CZ3 3.31Å; W896-W929 AromaticContact CE3-CH2 3.99Å; W896-W929 HydrophobicContact CE3-CH2 3.99Å; W896-W929 HydrophobicContact CG-CH2 4.21Å; W896-W929 AromaticContact CH2-CH2 3.99Å; W896-W929 HydrophobicContact CH2-CH2 3.99Å; W896-W929 HydrophobicContact CH2-CZ3 4.04Å; W896-W929 AromaticContact CZ2-CH2 3.62Å; W896-W929 HydrophobicContact CZ2-CH2 3.62Å; W896-W929 AromaticContact CZ2-CZ3 3.32Å; W896-W929 HydrophobicContact CZ2-CZ3 3.32Å; W896-W929 HydrophobicContact CZ3-CH2 4.17Å; W896-W929 AromaticContact NE1-CH2 3.8Å; W896-W929 AromaticContact NE1-CZ3 3.5Å; G925-W929 PolarHBondContact O-N 2.77Å; R926-W929 VanDerWaalsContact O-CB 3.29Å; R926-W929 WeakPolarHBondContact O-CB 3.44Å; L927-W929 VanDerWaalsContact C-N 3.26Å; L927-W929 PolarHBondContact O-N 2.96Å; W929-R933 VanDerWaalsContact CZ2-NH2 3.28Å; W929-R933 WeakPolarHBondContact O-CG 3.32Å
930	D	78.4	Confident	82	Confident	90 Å²	90	69.4 Å²	69.4	48%	0.481	34%	0.34	S	S	.	.	H	α-helix	trans	-77.6	-33.2	-179.6	-58.6	-46.7	0	0	0	110.4	L928 L932 R933 E934	L928-D930 PolarHBondContact O-N 3.02Å; D930-L932 PolarHBondContact O-N 3.02Å; D930-R933 PolarHBondContact O-N 3.25Å; D930-E934 VanDerWaalsContact O-CB 3.31Å; D930-E934 WeakPolarHBondContact O-CB 3.27Å; D930-E934 PolarHBondContact O-N 2.87Å
931	F	78.5	Confident	82.2	Confident	65 Å²	65	68.8 Å²	68.8	29%	0.285	34%	0.337	S	S	.	.	H	α-helix	trans	-62.2	-40.7	177.5	-178.5	-91.1	0	0	0	113.6	L928 R933 W937 I941	L928-F931 HydrophobicContact CD2-CB 4.37Å; L928-F931 HydrophobicContact CD2-CD1 4.01Å; L928-F931 HydrophobicContact CD2-CG 4.3Å; L928-F931 PolarHBondContact O-N 2.84Å; F931-R933 VanDerWaalsContact C-N 3.26Å; F931-R933 PolarHBondContact O-N 2.77Å; F931-W937 HydrophobicContact CD2-CB 4.22Å; F931-W937 AromaticContact CD2-CD1 3.97Å; F931-W937 AromaticContact CD2-CD2 3.52Å; F931-W937 HydrophobicContact CD2-CD2 3.52Å; F931-W937 AromaticContact CD2-CE2 3.81Å; F931-W937 AromaticContact CD2-CE3 3.87Å; F931-W937 HydrophobicContact CD2-CE3 3.87Å; F931-W937 AromaticContact CD2-CG 3.67Å; F931-W937 HydrophobicContact CD2-CG 3.67Å; F931-W937 HydrophobicContact CD2-CZ2 4.39Å; F931-W937 HydrophobicContact CD2-CZ3 4.42Å; F931-W937 HydrophobicContact CE2-CB 4.34Å; F931-W937 AromaticContact CE2-CD2 3.65Å; F931-W937 HydrophobicContact CE2-CD2 3.65Å; F931-W937 AromaticContact CE2-CE3 3.48Å; F931-W937 HydrophobicContact CE2-CE3 3.48Å; F931-W937 VanDerWaalsContact CE2-CE3 3.48Å; F931-W937 HydrophobicContact CE2-CG 4.03Å; F931-W937 AromaticContact CE2-CZ3 3.97Å; F931-W937 HydrophobicContact CE2-CZ3 3.97Å; F931-W937 HydrophobicContact CG-CG 4.34Å; F931-W937 WeakPolarHBondContact O-CB 3.47Å; F931-I941 HydrophobicContact CE1-CD1 3.97Å; F931-I941 HydrophobicContact CZ-CD1 3.8Å
932	L	78.7	Confident	82.4	Confident	42 Å²	42	71.2 Å²	71.2	22%	0.22	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-6	-179.7	-68	171.6	0	0	0	113.6	L928 D930 L968 I972	L928-L932 HydrophobicContact CB-CD1 4.13Å; L928-L932 HydrophobicContact CB-CG 4.34Å; L928-L932 WeakPolarHBondContact O-CB 3.2Å; L928-L932 VanDerWaalsContact O-CG 3.31Å; L928-L932 WeakPolarHBondContact O-CG 3.31Å; L928-L932 PolarHBondContact O-N 2.87Å; D930-L932 PolarHBondContact O-N 3.02Å; L932-L968 HydrophobicContact CD2-CB 3.82Å; L932-L968 HydrophobicContact CD2-CD1 4.44Å; L932-I972 HydrophobicContact CD1-CG1 4.12Å
933	R	74	Confident	82.8	Confident	95 Å²	95	73.2 Å²	73.2	36%	0.358	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120.1	-32.8	-172.9	-72.2	-179.1	168.3	-146.6	0.8	114.8	F891 W896 W929 D930 F931	F891-R933 PolarHBondContact O-NH1 3.01Å; W896-R933 VanDerWaalsContact CD1-NH2 3.33Å; W929-R933 VanDerWaalsContact CZ2-NH2 3.28Å; W929-R933 WeakPolarHBondContact O-CG 3.32Å; D930-R933 PolarHBondContact O-N 3.25Å; F931-R933 VanDerWaalsContact C-N 3.26Å; F931-R933 PolarHBondContact O-N 2.77Å
934	E	80.3	Confident	82.9	Confident	105 Å²	105	76 Å²	76	49%	0.491	36%	0.357	S	S	.	.			trans	-74.9	123.6	-174.4	-173.3	64.2	-141.8	0	0	111	D930 Y936 W937 L938	D930-E934 VanDerWaalsContact O-CB 3.31Å; D930-E934 WeakPolarHBondContact O-CB 3.27Å; D930-E934 PolarHBondContact O-N 2.87Å; E934-Y936 PolarHBondContact O-N 2.9Å; E934-Y936 VanDerWaalsContact O-N 3.12Å; E934-W937 PolarHBondContact O-N 3.21Å; E934-L938 PolarHBondContact O-N 2.85Å
935	P	82.9	Confident	83	Confident	74 Å²	74	76.2 Å²	76.2	48%	0.481	36%	0.358	S	S	.	.	H	α-helix	trans	-59.8	-27.9	-176.2	22.5	-34.1	0	0	0	113.5	W937 L938 E939	P935-W937 VanDerWaalsContact C-N 3.29Å; P935-W937 PolarHBondContact O-N 2.9Å; P935-L938 WeakPolarHBondContact O-CA 3.37Å; P935-L938 VanDerWaalsContact O-CB 3.31Å; P935-L938 WeakPolarHBondContact O-CB 3.09Å; P935-L938 PolarHBondContact O-N 2.91Å; P935-L938 VanDerWaalsContact O-N 3.09Å; P935-E939 PolarHBondContact O-N 2.88Å
936	Y	86.6	Confident	83.2	Confident	108 Å²	108	77.1 Å²	77.1	42%	0.424	36%	0.359	S	S	.	.	H	α-helix	trans	-54.2	-41.9	171.9	171.8	-98	0	0	0	113	E934 K940	E934-Y936 PolarHBondContact O-N 2.9Å; E934-Y936 VanDerWaalsContact O-N 3.12Å; Y936-K940 HydrophobicContact CE1-CD 3.83Å; Y936-K940 VanDerWaalsContact O-CB 3.22Å; Y936-K940 WeakPolarHBondContact O-CB 3.47Å; Y936-K940 PolarHBondContact O-N 2.93Å; Y936-K940 VanDerWaalsContact O-N 3.07Å; Y936-K940 PolarHBondContact OH-NZ 2.8Å
937	W	83.1	Confident	83.3	Confident	68 Å²	68	74.7 Å²	74.7	26%	0.258	36%	0.363	S	S	.	.	H	α-helix	trans	-73.7	-34.2	177.5	-71.3	116.7	0	0	0	111.5	F931 E934 P935 K940 I941	F931-W937 HydrophobicContact CD2-CB 4.22Å; F931-W937 AromaticContact CD2-CD1 3.97Å; F931-W937 AromaticContact CD2-CD2 3.52Å; F931-W937 HydrophobicContact CD2-CD2 3.52Å; F931-W937 AromaticContact CD2-CE2 3.81Å; F931-W937 AromaticContact CD2-CE3 3.87Å; F931-W937 HydrophobicContact CD2-CE3 3.87Å; F931-W937 AromaticContact CD2-CG 3.67Å; F931-W937 HydrophobicContact CD2-CG 3.67Å; F931-W937 HydrophobicContact CD2-CZ2 4.39Å; F931-W937 HydrophobicContact CD2-CZ3 4.42Å; F931-W937 HydrophobicContact CE2-CB 4.34Å; F931-W937 AromaticContact CE2-CD2 3.65Å; F931-W937 HydrophobicContact CE2-CD2 3.65Å; F931-W937 AromaticContact CE2-CE3 3.48Å; F931-W937 HydrophobicContact CE2-CE3 3.48Å; F931-W937 VanDerWaalsContact CE2-CE3 3.48Å; F931-W937 HydrophobicContact CE2-CG 4.03Å; F931-W937 AromaticContact CE2-CZ3 3.97Å; F931-W937 HydrophobicContact CE2-CZ3 3.97Å; F931-W937 HydrophobicContact CG-CG 4.34Å; F931-W937 WeakPolarHBondContact O-CB 3.47Å; E934-W937 PolarHBondContact O-N 3.21Å; P935-W937 VanDerWaalsContact C-N 3.29Å; P935-W937 PolarHBondContact O-N 2.9Å; W937-K940 HydrophobicContact CE3-CD 3.86Å; W937-K940 HydrophobicContact CZ3-CD 3.8Å; W937-K940 PolarHBondContact O-N 3.01Å; W937-I941 WeakPolarHBondContact O-CB 3.5Å; W937-I941 WeakPolarHBondContact O-CD1 3.47Å; W937-I941 WeakPolarHBondContact O-CG1 3.43Å; W937-I941 PolarHBondContact O-N 3.02Å
938	L	86.6	Confident	83.2	Confident	59 Å²	59	75.1 Å²	75.1	31%	0.309	36%	0.36	S	S	.	.	H	α-helix	trans	-60	-49.8	174	-167.6	72.2	0	0	0	111.7	E934 P935 I941 K942 I966 L968	E934-L938 PolarHBondContact O-N 2.85Å; P935-L938 WeakPolarHBondContact O-CA 3.37Å; P935-L938 VanDerWaalsContact O-CB 3.31Å; P935-L938 WeakPolarHBondContact O-CB 3.09Å; P935-L938 PolarHBondContact O-N 2.91Å; P935-L938 VanDerWaalsContact O-N 3.09Å; L938-I941 PolarHBondContact O-N 3.1Å; L938-K942 WeakPolarHBondContact O-CB 3.38Å; L938-K942 PolarHBondContact O-N 3.16Å; L938-I966 HydrophobicContact CD1-CB 3.8Å; L938-I966 HydrophobicContact CD1-CG2 3.64Å; L938-I966 HydrophobicContact CG-CB 4.44Å; L938-L968 HydrophobicContact CD1-CD1 4.08Å; L938-L968 HydrophobicContact CD1-CD2 4.04Å; L938-L968 HydrophobicContact CD1-CG 3.67Å
939	E	87.1	Confident	83.2	Confident	124 Å²	124	73.4 Å²	73.4	58%	0.579	35%	0.351	S	S	*	.	H	α-helix	trans	-62.6	-42.8	176.4	-70.4	176.9	173.7	0	0	111.8	P935 I941 K942 N943	P935-E939 PolarHBondContact O-N 2.88Å; E939-I941 VanDerWaalsContact C-N 3.3Å; E939-I941 PolarHBondContact O-N 2.79Å; E939-K942 WeakPolarHBondContact O-CB 3.44Å; E939-K942 PolarHBondContact O-N 2.65Å; E939-N943 WeakPolarHBondContact O-CB 3.43Å; E939-N943 VanDerWaalsContact O-CG 3.28Å; E939-N943 PolarHBondContact O-N 2.71Å; E939-N943 PolarHBondContact O-OD1 2.87Å
940	K	84.3	Confident	83.4	Confident	69 Å²	69	77.9 Å²	77.9	30%	0.3	37%	0.372	S	S	.	.	H	α-helix	trans	-65.5	-32.2	177.9	-164.2	168.2	-173.9	176.1	0	112.6	Y936 W937 K944	Y936-K940 HydrophobicContact CE1-CD 3.83Å; Y936-K940 VanDerWaalsContact O-CB 3.22Å; Y936-K940 WeakPolarHBondContact O-CB 3.47Å; Y936-K940 PolarHBondContact O-N 2.93Å; Y936-K940 VanDerWaalsContact O-N 3.07Å; Y936-K940 PolarHBondContact OH-NZ 2.8Å; W937-K940 HydrophobicContact CE3-CD 3.86Å; W937-K940 HydrophobicContact CZ3-CD 3.8Å; W937-K940 PolarHBondContact O-N 3.01Å; K940-K944 WeakPolarHBondContact O-CB 3.37Å; K940-K944 WeakPolarHBondContact O-CG 3.45Å; K940-K944 PolarHBondContact O-N 2.77Å
941	I	87.7	Confident	83.1	Confident	27 Å²	27	78.8 Å²	78.8	14%	0.138	37%	0.371	C	S	.	.	H	α-helix	trans	-74.3	-43.1	171.6	-70.5	164.8	0	0	0	110.5	F931 W937 L938 E939 N943 K944 I945 I966 L968	F931-I941 HydrophobicContact CE1-CD1 3.97Å; F931-I941 HydrophobicContact CZ-CD1 3.8Å; W937-I941 WeakPolarHBondContact O-CB 3.5Å; W937-I941 WeakPolarHBondContact O-CD1 3.47Å; W937-I941 WeakPolarHBondContact O-CG1 3.43Å; W937-I941 PolarHBondContact O-N 3.02Å; L938-I941 PolarHBondContact O-N 3.1Å; E939-I941 VanDerWaalsContact C-N 3.3Å; E939-I941 PolarHBondContact O-N 2.79Å; I941-N943 PolarHBondContact O-N 2.78Å; I941-K944 PolarHBondContact O-N 3.31Å; I941-I945 HydrophobicContact CG2-CD1 3.61Å; I941-I945 HydrophobicContact CG2-CG1 4.28Å; I941-I945 WeakPolarHBondContact O-CB 3.37Å; I941-I945 WeakPolarHBondContact O-CG1 3.03Å; I941-I945 PolarHBondContact O-N 2.82Å; I941-I966 HydrophobicContact CG2-CD1 4.16Å; I941-L968 HydrophobicContact CD1-CD1 3.91Å; I941-L968 HydrophobicContact CD1-CD2 3.64Å; I941-L968 HydrophobicContact CD1-CG 4.46Å; I941-L968 HydrophobicContact CG2-CD2 4.2Å
942	K	89.1	Confident	83	Confident	73 Å²	73	76.5 Å²	76.5	32%	0.317	36%	0.362	S	S	.	.	H	α-helix	trans	-56.3	-47.9	174.7	177.9	168.7	170.8	163.4	0	111.7	L938 E939 I945 Q946 V963 V964 I966	L938-K942 WeakPolarHBondContact O-CB 3.38Å; L938-K942 PolarHBondContact O-N 3.16Å; E939-K942 WeakPolarHBondContact O-CB 3.44Å; E939-K942 PolarHBondContact O-N 2.65Å; K942-I945 PolarHBondContact O-N 2.96Å; K942-Q946 VanDerWaalsContact O-CB 3.24Å; K942-Q946 WeakPolarHBondContact O-CB 3.5Å; K942-Q946 PolarHBondContact O-N 2.66Å; K942-V963 HydrophobicContact CD-CG1 4.47Å; K942-V963 WeakPolarHBondContact CE-O 3.29Å; K942-V963 HydrophobicContact CG-CB 4.28Å; K942-V963 HydrophobicContact CG-CG1 4.09Å; K942-V963 PolarHBondContact NZ-O 3.25Å; K942-V964 PolarHBondContact NZ-O 2.05Å; K942-I966 HydrophobicContact CB-CD1 3.78Å; K942-I966 HydrophobicContact CB-CG1 4.45Å; K942-I966 HydrophobicContact CG-CD1 4.41Å
943	N	88.2	Confident	82.4	Confident	108 Å²	108	81.3 Å²	81.3	58%	0.578	38%	0.383	S	S	*	.	H	α-helix	trans	-66.2	-40.6	178.7	-65.9	-7.1	0	0	0	111.7	E939 I941 A947	E939-N943 WeakPolarHBondContact O-CB 3.43Å; E939-N943 VanDerWaalsContact O-CG 3.28Å; E939-N943 PolarHBondContact O-N 2.71Å; E939-N943 PolarHBondContact O-OD1 2.87Å; I941-N943 PolarHBondContact O-N 2.78Å; N943-A947 VanDerWaalsContact O-CB 3.31Å; N943-A947 WeakPolarHBondContact O-CB 3.42Å; N943-A947 PolarHBondContact O-N 3.12Å
944	K	84.7	Confident	82.5	Confident	142 Å²	142	78.5 Å²	78.5	62%	0.617	38%	0.375	S	S	*	.	H	α-helix	trans	-61.1	-44.1	172.7	-83.8	-177.4	170.6	-168	0	113	K940 I941 K948	K940-K944 WeakPolarHBondContact O-CB 3.37Å; K940-K944 WeakPolarHBondContact O-CG 3.45Å; K940-K944 PolarHBondContact O-N 2.77Å; I941-K944 PolarHBondContact O-N 3.31Å; K944-K948 PolarHBondContact O-N 3.32Å
945	I	86.5	Confident	82.2	Confident	38 Å²	38	74.4 Å²	74.4	20%	0.195	36%	0.358	C	S	.	.	H	α-helix	trans	-71.9	-42.5	-178.9	-70	175.8	0	0	0	110.1	I941 K942 A947 K948 L949 V963 I966 F1000	I941-I945 HydrophobicContact CG2-CD1 3.61Å; I941-I945 HydrophobicContact CG2-CG1 4.28Å; I941-I945 WeakPolarHBondContact O-CB 3.37Å; I941-I945 WeakPolarHBondContact O-CG1 3.03Å; I941-I945 PolarHBondContact O-N 2.82Å; K942-I945 PolarHBondContact O-N 2.96Å; I945-A947 VanDerWaalsContact C-N 3.33Å; I945-A947 PolarHBondContact O-N 2.85Å; I945-K948 PolarHBondContact O-N 3.04Å; I945-L949 HydrophobicContact CG2-CD1 3.62Å; I945-L949 HydrophobicContact CG2-CG 4.19Å; I945-L949 WeakPolarHBondContact O-CB 3.37Å; I945-L949 WeakPolarHBondContact O-CD1 3.42Å; I945-L949 VanDerWaalsContact O-CG 3.23Å; I945-L949 WeakPolarHBondContact O-CG 3.25Å; I945-L949 PolarHBondContact O-N 2.88Å; I945-V963 HydrophobicContact CG2-CG2 4.02Å; I945-I966 HydrophobicContact CD1-CD1 4.15Å; I945-F1000 HydrophobicContact CD1-CZ 3.78Å
946	Q	87.4	Confident	81.6	Confident	31 Å²	31	76.3 Å²	76.3	15%	0.145	36%	0.364	C	S	.	.	H	α-helix	trans	-58.7	-42.9	173.8	-174.8	62.2	72.3	0	0	112.1	K942 L949 K950 L961 V963	K942-Q946 VanDerWaalsContact O-CB 3.24Å; K942-Q946 WeakPolarHBondContact O-CB 3.5Å; K942-Q946 PolarHBondContact O-N 2.66Å; Q946-L949 PolarHBondContact O-N 3.22Å; Q946-K950 WeakPolarHBondContact O-CG 3.32Å; Q946-K950 PolarHBondContact O-N 3.35Å; Q946-L961 PolarHBondContact NE2-O 3.22Å; Q946-V963 HydrophobicContact CB-CG2 4.33Å
947	A	83.7	Confident	80.9	Confident	62 Å²	62	71.8 Å²	71.8	51%	0.512	35%	0.346	S	S	.	.	H	α-helix	trans	-64.5	-43.1	175.4	0	0	0	0	0	112.2	N943 I945 K951	N943-A947 VanDerWaalsContact O-CB 3.31Å; N943-A947 WeakPolarHBondContact O-CB 3.42Å; N943-A947 PolarHBondContact O-N 3.12Å; I945-A947 VanDerWaalsContact C-N 3.33Å; I945-A947 PolarHBondContact O-N 2.85Å; A947-K951 PolarHBondContact O-N 3.05Å
948	K	80.8	Confident	80.7	Confident	116 Å²	116	69 Å²	69	50%	0.504	34%	0.336	S	S	.	.	H	α-helix	trans	-66.4	-35.2	174.6	-75.4	-164.8	174.8	-170.4	0	112.6	K944 I945 K951	K944-K948 PolarHBondContact O-N 3.32Å; I945-K948 PolarHBondContact O-N 3.04Å; K948-K951 PolarHBondContact O-N 2.96Å
949	L	82.9	Confident	80.3	Confident	7 Å²	7	69.2 Å²	69.2	4%	0.037	34%	0.338	C	S	.	.	H	α-helix	trans	-69.9	-42.6	177.1	-72.8	162.8	0	0	0	112.8	I945 Q946 K951 I952 L961 V963 L1004 M1237	I945-L949 HydrophobicContact CG2-CD1 3.62Å; I945-L949 HydrophobicContact CG2-CG 4.19Å; I945-L949 WeakPolarHBondContact O-CB 3.37Å; I945-L949 WeakPolarHBondContact O-CD1 3.42Å; I945-L949 VanDerWaalsContact O-CG 3.23Å; I945-L949 WeakPolarHBondContact O-CG 3.25Å; I945-L949 PolarHBondContact O-N 2.88Å; Q946-L949 PolarHBondContact O-N 3.22Å; L949-K951 PolarHBondContact O-N 3.5Å; L949-K951 VanDerWaalsContact O-N 3.17Å; L949-I952 HydrophobicContact CD2-CD1 4.19Å; L949-I952 WeakPolarHBondContact O-CB 3.35Å; L949-I952 PolarHBondContact O-N 3.23Å; L949-L961 HydrophobicContact CD2-CD1 4.02Å; L949-V963 HydrophobicContact CD1-CG2 3.42Å; L949-V963 VanDerWaalsContact CD1-CG2 3.42Å; L949-L1004 HydrophobicContact CD1-CD2 3.49Å; L949-L1004 VanDerWaalsContact CD1-CD2 3.49Å; L949-L1004 HydrophobicContact CD2-CD2 4.37Å; L949-M1237 HydrophobicContact CD2-SD 4.45Å
950	K	80.9	Confident	80	Confident	132 Å²	132	67.8 Å²	67.8	57%	0.574	33%	0.331	S	S	*	.	H	α-helix	trans	-58.5	-25.8	175.3	-77.9	174.8	-177.9	-84.6	0	112.8	Q946 E960	Q946-K950 WeakPolarHBondContact O-CG 3.32Å; Q946-K950 PolarHBondContact O-N 3.35Å; K950-E960 WeakPolarHBondContact CE-OE1 3.25Å; K950-E960 IonicContact NZ-OE1 2.94Å; K950-E960 PolarHBondContact NZ-OE1 2.71Å
951	K	71.2	Confident	80	Confident	110 Å²	110	64.9 Å²	64.9	48%	0.478	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.5	-19.2	176.3	-176	163.9	-176.1	161.7	0	114.1	A947 K948 L949 H953 D1063	A947-K951 PolarHBondContact O-N 3.05Å; K948-K951 PolarHBondContact O-N 2.96Å; L949-K951 PolarHBondContact O-N 3.5Å; L949-K951 VanDerWaalsContact O-N 3.17Å; K951-H953 PolarHBondContact O-N 3.04Å; K951-D1063 WeakPolarHBondContact CE-OD1 3.39Å; K951-D1063 IonicContact NZ-OD1 3.91Å; K951-D1063 PolarHBondContact NZ-OD1 3.08Å; K951-D1063 IonicContact NZ-OD2 2.69Å; K951-D1063 PolarHBondContact NZ-OD2 3.36Å
952	I	76.2	Confident	80	Confident	17 Å²	17	65.8 Å²	65.8	9%	0.087	33%	0.325	C	S	.	.	S	Bend	trans	-74.3	119.3	-179.6	-62.1	176.4	0	0	0	108.8	L949 L954 K1236 E1240	L949-I952 HydrophobicContact CD2-CD1 4.19Å; L949-I952 WeakPolarHBondContact O-CB 3.35Å; L949-I952 PolarHBondContact O-N 3.23Å; I952-L954 PolarHBondContact O-N 2.68Å; I952-K1236 HydrophobicContact CG2-CD 4.49Å; I952-K1236 HydrophobicContact CG2-CG 3.89Å; I952-E1240 HydrophobicContact CD1-CG 3.86Å; I952-E1240 HydrophobicContact CG1-CG 4.01Å
953	H	65.8	Low	80	Confident	142 Å²	142	62.6 Å²	62.6	66%	0.657	31%	0.312	S	S	*	.			trans	-61.6	108.1	176.5	-176	-72	0	0	0	111	K951	K951-H953 PolarHBondContact O-N 3.04Å
954	L	76.1	Confident	80	Confident	36 Å²	36	60.2 Å²	60.2	19%	0.188	30%	0.301	C	S	.	.			trans	-79.4	129.8	-179.1	-77.6	154.2	0	0	0	110.5	I952 I958 L961 W1232	I952-L954 PolarHBondContact O-N 2.68Å; L954-I958 HydrophobicContact CD2-CB 4.06Å; L954-I958 HydrophobicContact CD2-CD1 4.47Å; L954-I958 HydrophobicContact CD2-CG2 3.96Å; L954-L961 HydrophobicContact CD1-CG 4.2Å; L954-L961 HydrophobicContact CD2-CD1 3.85Å; L954-L961 HydrophobicContact CD2-CD2 4.3Å; L954-L961 HydrophobicContact CD2-CG 3.69Å; L954-W1232 HydrophobicContact CD2-CH2 4.42Å; L954-W1232 HydrophobicContact CD2-CZ3 4.47Å
955	P	75.4	Confident	80.1	Confident	20 Å²	20	56.8 Å²	56.8	13%	0.13	29%	0.29	C	S	.	.			trans	-59.1	144.8	173.3	-23	32.9	0	0	0	110.8	F957 I958 W1232	P955-F957 HydrophobicContact CB-CD1 3.77Å; P955-F957 HydrophobicContact CB-CE1 3.28Å; P955-F957 HydrophobicContact CB-CE2 4.25Å; P955-F957 HydrophobicContact CB-CG 4.42Å; P955-F957 HydrophobicContact CB-CZ 3.54Å; P955-F957 HydrophobicContact CG-CE1 4.1Å; P955-F957 HydrophobicContact CG-CZ 3.9Å; P955-F957 PolarHBondContact O-N 2.85Å; P955-I958 HydrophobicContact CG-CD1 4.45Å; P955-I958 PolarHBondContact O-N 3.36Å; P955-W1232 HydrophobicContact CG-CD2 4.31Å; P955-W1232 HydrophobicContact CG-CH2 3.85Å; P955-W1232 HydrophobicContact CG-CZ2 3.4Å; P955-W1232 HydrophobicContact CG-CZ3 4.43Å
956	N	69.2	Low	80.3	Confident	114 Å²	114	55.5 Å²	55.5	61%	0.61	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-3.1	-172.9	-53.5	6.2	0	0	0	116.3	R1012	N956-R1012 WeakPolarHBondContact O-CD 3.42Å; N956-R1012 PolarHBondContact O-NH1 2.79Å
957	F	73.3	Confident	80.4	Confident	13 Å²	13	57.9 Å²	57.9	6%	0.057	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.1	-2.1	173.9	63	-100.8	0	0	0	114.1	P955 V1008 N1009 R1012 W1013 K1016	P955-F957 HydrophobicContact CB-CD1 3.77Å; P955-F957 HydrophobicContact CB-CE1 3.28Å; P955-F957 HydrophobicContact CB-CE2 4.25Å; P955-F957 HydrophobicContact CB-CG 4.42Å; P955-F957 HydrophobicContact CB-CZ 3.54Å; P955-F957 HydrophobicContact CG-CE1 4.1Å; P955-F957 HydrophobicContact CG-CZ 3.9Å; P955-F957 PolarHBondContact O-N 2.85Å; F957-V1008 CarbonylContact O-C 3.29Å; F957-V1008 VanDerWaalsContact O-CA 3.3Å; F957-V1008 WeakPolarHBondContact O-CA 3.26Å; F957-N1009 PolarHBondContact O-N 3.11Å; F957-R1012 HydrophobicContact CB-CB 4.11Å; F957-W1013 HydrophobicContact CB-CB 4.24Å; F957-W1013 HydrophobicContact CD1-CE3 4.1Å; F957-W1013 AromaticContact CD2-CE3 3.5Å; F957-W1013 HydrophobicContact CD2-CE3 3.5Å; F957-W1013 HydrophobicContact CD2-CZ3 4.01Å; F957-W1013 HydrophobicContact CE1-CE3 4.02Å; F957-W1013 HydrophobicContact CE1-CZ3 4.13Å; F957-W1013 AromaticContact CE2-CE3 3.43Å; F957-W1013 HydrophobicContact CE2-CE3 3.43Å; F957-W1013 VanDerWaalsContact CE2-CE3 3.43Å; F957-W1013 AromaticContact CE2-CZ3 3.42Å; F957-W1013 HydrophobicContact CE2-CZ3 3.42Å; F957-W1013 VanDerWaalsContact CE2-CZ3 3.42Å; F957-W1013 AromaticContact CG-CE3 3.86Å; F957-W1013 HydrophobicContact CG-CE3 3.86Å; F957-W1013 AromaticContact CZ-CE3 3.72Å; F957-W1013 HydrophobicContact CZ-CE3 3.72Å; F957-W1013 AromaticContact CZ-CZ3 3.51Å; F957-W1013 HydrophobicContact CZ-CZ3 3.51Å; F957-K1016 HydrophobicContact CE1-CD 4.19Å
958	I	77.8	Confident	80.4	Confident	9 Å²	9	55.4 Å²	55.4	5%	0.046	28%	0.275	C	S	.	.	B	Isolated β-bridge	trans	-116.3	133	172.7	-41.8	-174.6	0	0	0	107.4	L954 P955 L961 T1006 I1229 W1232	L954-I958 HydrophobicContact CD2-CB 4.06Å; L954-I958 HydrophobicContact CD2-CD1 4.47Å; L954-I958 HydrophobicContact CD2-CG2 3.96Å; P955-I958 HydrophobicContact CG-CD1 4.45Å; P955-I958 PolarHBondContact O-N 3.36Å; I958-L961 HydrophobicContact CG2-CD2 4.33Å; I958-T1006 WeakPolarHBondContact CG2-OG1 3.32Å; I958-I1229 HydrophobicContact CD1-CG2 4.16Å; I958-W1232 HydrophobicContact CD1-CD2 4.46Å; I958-W1232 HydrophobicContact CD1-CE3 3.56Å; I958-W1232 HydrophobicContact CD1-CH2 4.33Å; I958-W1232 HydrophobicContact CD1-CZ3 3.49Å; I958-W1232 VanDerWaalsContact CD1-CZ3 3.49Å
959	N	77.6	Confident	80.4	Confident	64 Å²	64	50.5 Å²	50.5	34%	0.342	26%	0.257	S	S	.	.			trans	-83.4	-170.1	171.6	-60.2	-18.9	0	0	0	109.8	L961 S1007	N959-L961 PolarHBondContact O-N 2.94Å; N959-S1007 WeakPolarHBondContact CB-O 3.49Å; N959-S1007 WeakPolarHBondContact CB-OG 3.33Å; N959-S1007 PolarHBondContact N-O 3.09Å; N959-S1007 WeakPolarHBondContact ND2-CB 3.38Å; N959-S1007 PolarHBondContact ND2-OG 3.16Å
960	E	82.4	Confident	79.9	Confident	94 Å²	94	51.9 Å²	51.9	44%	0.439	27%	0.268	S	S	.	.			trans	-54.5	138.5	-179.3	-174.2	172.4	-172.9	0	0	113.2	K950 T962	K950-E960 WeakPolarHBondContact CE-OE1 3.25Å; K950-E960 IonicContact NZ-OE1 2.94Å; K950-E960 PolarHBondContact NZ-OE1 2.71Å; E960-T962 HydrophobicContact CG-CG2 4.08Å
961	L	83.4	Confident	79.7	Confident	7 Å²	7	47 Å²	47	4%	0.037	25%	0.247	C	C	.	.			trans	-87.7	117.3	168.5	-64	-178.7	0	0	0	109.8	Q946 L949 L954 I958 N959 T1006	Q946-L961 PolarHBondContact NE2-O 3.22Å; L949-L961 HydrophobicContact CD2-CD1 4.02Å; L954-L961 HydrophobicContact CD1-CG 4.2Å; L954-L961 HydrophobicContact CD2-CD1 3.85Å; L954-L961 HydrophobicContact CD2-CD2 4.3Å; L954-L961 HydrophobicContact CD2-CG 3.69Å; I958-L961 HydrophobicContact CG2-CD2 4.33Å; N959-L961 PolarHBondContact O-N 2.94Å; L961-T1006 HydrophobicContact CD2-CG2 4.45Å
962	T	86.9	Confident	80.3	Confident	46 Å²	46	44.1 Å²	44.1	28%	0.282	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	137.8	177.9	55.1	0	0	0	0	110.8	E960 V964 L1004 E1005	E960-T962 HydrophobicContact CG-CG2 4.08Å; T962-V964 PolarHBondContact O-N 3.19Å; T962-L1004 CarbonylContact O-C 3.53Å; T962-L1004 WeakPolarHBondContact O-CA 3.11Å; T962-E1005 PolarHBondContact N-O 2.9Å; T962-E1005 PolarHBondContact O-N 2.81Å; T962-E1005 WeakPolarHBondContact OG1-CB 3.25Å; T962-E1005 PolarHBondContact OG1-O 2.81Å
963	V	89.2	Confident	80.8	Confident	6 Å²	6	45.3 Å²	45.3	4%	0.036	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	106.4	177.7	-174.3	0	0	0	0	108.6	K942 I945 Q946 L949 I966 L1004	K942-V963 HydrophobicContact CD-CG1 4.47Å; K942-V963 WeakPolarHBondContact CE-O 3.29Å; K942-V963 HydrophobicContact CG-CB 4.28Å; K942-V963 HydrophobicContact CG-CG1 4.09Å; K942-V963 PolarHBondContact NZ-O 3.25Å; I945-V963 HydrophobicContact CG2-CG2 4.02Å; Q946-V963 HydrophobicContact CB-CG2 4.33Å; L949-V963 HydrophobicContact CD1-CG2 3.42Å; L949-V963 VanDerWaalsContact CD1-CG2 3.42Å; V963-I966 HydrophobicContact CG1-CD1 3.97Å; V963-I966 HydrophobicContact CG1-CG1 3.69Å; V963-L1004 HydrophobicContact CG2-CD2 4.08Å
964	V	88.3	Confident	81.7	Confident	58 Å²	58	39.6 Å²	39.6	35%	0.352	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	-51.9	174.8	-173.7	0	0	0	0	109.4	K942 T962 A1003 E1005	K942-V964 PolarHBondContact NZ-O 2.05Å; T962-V964 PolarHBondContact O-N 3.19Å; V964-A1003 HydrophobicContact CB-CB 4.32Å; V964-A1003 PolarHBondContact N-O 3.44Å; V964-E1005 HydrophobicContact CG2-CB 3.41Å; V964-E1005 VanDerWaalsContact CG2-CB 3.41Å
965	D	88.4	Confident	82.3	Confident	71 Å²	71	39 Å²	39	38%	0.38	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	147.9	-155.9	-161.6	-0.1	0	0	0	110	F1002 A1003 R1218	D965-F1002 CarbonylContact O-C 3.55Å; D965-F1002 WeakPolarHBondContact O-CA 3.47Å; D965-F1002 WeakPolarHBondContact O-CB 3Å; D965-A1003 HydrophobicContact CB-CB 3.72Å; D965-A1003 PolarHBondContact O-N 3.16Å; D965-R1218 IonicContact OD2-CZ 3.87Å; D965-R1218 IonicContact OD2-NH1 3.96Å; D965-R1218 PolarHBondContact OD2-NH1 3.28Å; D965-R1218 IonicContact OD2-NH2 3.65Å; D965-R1218 PolarHBondContact OD2-NH2 3.41Å
966	I	90.4	Very high	82.8	Confident	11 Å²	11	41 Å²	41	6%	0.056	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	136.9	174.9	-60.9	-165.9	0	0	0	109.2	L938 I941 K942 I945 V963 L968 F1000 F1002	L938-I966 HydrophobicContact CD1-CB 3.8Å; L938-I966 HydrophobicContact CD1-CG2 3.64Å; L938-I966 HydrophobicContact CG-CB 4.44Å; I941-I966 HydrophobicContact CG2-CD1 4.16Å; K942-I966 HydrophobicContact CB-CD1 3.78Å; K942-I966 HydrophobicContact CB-CG1 4.45Å; K942-I966 HydrophobicContact CG-CD1 4.41Å; I945-I966 HydrophobicContact CD1-CD1 4.15Å; V963-I966 HydrophobicContact CG1-CD1 3.97Å; V963-I966 HydrophobicContact CG1-CG1 3.69Å; I966-L968 HydrophobicContact CG2-CD2 3.8Å; I966-F1000 HydrophobicContact CG2-CE2 4.32Å; I966-F1002 HydrophobicContact CB-CB 4.48Å; I966-F1002 HydrophobicContact CG1-CB 3.89Å
967	D	88.1	Confident	83.5	Confident	80 Å²	80	41.9 Å²	41.9	43%	0.428	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	120.2	163.4	-173.9	-4.7	0	0	0	108.4	G969 F1000 S1001	D967-G969 PolarHBondContact O-N 2.65Å; D967-G969 PolarHBondContact OD1-N 3.06Å; D967-F1000 WeakPolarHBondContact O-CA 3.12Å; D967-S1001 PolarHBondContact N-O 3.48Å; D967-S1001 PolarHBondContact O-N 3.36Å
968	L	83.7	Confident	84.1	Confident	10 Å²	10	43.7 Å²	43.7	5%	0.052	23%	0.228	C	C	.	.			trans	-75.7	-15.7	177.7	-57.1	179.2	0	0	0	112.4	L932 L938 I941 I966 F1000	L932-L968 HydrophobicContact CD2-CB 3.82Å; L932-L968 HydrophobicContact CD2-CD1 4.44Å; L938-L968 HydrophobicContact CD1-CD1 4.08Å; L938-L968 HydrophobicContact CD1-CD2 4.04Å; L938-L968 HydrophobicContact CD1-CG 3.67Å; I941-L968 HydrophobicContact CD1-CD1 3.91Å; I941-L968 HydrophobicContact CD1-CD2 3.64Å; I941-L968 HydrophobicContact CD1-CG 4.46Å; I941-L968 HydrophobicContact CG2-CD2 4.2Å; I966-L968 HydrophobicContact CG2-CD2 3.8Å; L968-F1000 HydrophobicContact CD2-CD2 4.01Å; L968-F1000 HydrophobicContact CD2-CE2 3.74Å
969	G	80.5	Confident	84.1	Confident	13 Å²	13	44.4 Å²	44.4	13%	0.134	24%	0.239	C	C	.	.			trans	77.3	168.8	-174	0	0	0	0	0	113.6	D967	D967-G969 PolarHBondContact O-N 2.65Å; D967-G969 PolarHBondContact OD1-N 3.06Å
970	S	73.4	Confident	84.1	Confident	36 Å²	36	46.2 Å²	46.2	25%	0.252	26%	0.255	S	S	.	.	S	Bend	trans	-94.6	-4.4	172.7	48.8	0	0	0	0	113.9
971	E	77	Confident	84.1	Confident	31 Å²	31	45.3 Å²	45.3	15%	0.145	26%	0.257	C	S	.	.			trans	-83.8	144.3	-176.4	-57.7	-51.7	134.1	0	0	111.8	A903 N907 Y996 G998	A903-E971 WeakPolarHBondContact CB-OE1 3.49Å; A903-E971 WeakPolarHBondContact CB-OE2 3.38Å; N907-E971 PolarHBondContact ND2-OE2 3.29Å; E971-Y996 HydrophobicContact CB-CE2 3.99Å; E971-G998 WeakPolarHBondContact CB-O 3.46Å; E971-G998 VanDerWaalsContact CG-O 3.25Å; E971-G998 WeakPolarHBondContact CG-O 3.31Å
972	I	84.1	Confident	83.6	Confident	49 Å²	49	47.3 Å²	47.3	25%	0.251	27%	0.265	S	S	.	.			trans	-113.3	138.2	-177.5	-72.7	147.4	0	0	0	108.8	I924 L928 L932 V974	I924-I972 HydrophobicContact CG2-CG2 4.14Å; L928-I972 HydrophobicContact CD1-CG2 4.35Å; L932-I972 HydrophobicContact CD1-CG1 4.12Å; I972-V974 PolarHBondContact O-N 3.16Å
973	P	85.9	Confident	82.7	Confident	41 Å²	41	49.3 Å²	49.3	27%	0.266	27%	0.273	S	S	.	.	P	Polyproline II helix	trans	-62.7	120.9	172	26.1	-34.2	0	0	0	110.5	L928 V994 Y996	L928-P973 HydrophobicContact CD1-CG 4.02Å; P973-V994 HydrophobicContact CB-CG1 4.1Å; P973-Y996 HydrophobicContact CB-CD2 4.29Å
974	V	85.7	Confident	81.4	Confident	22 Å²	22	49.2 Å²	49.2	13%	0.133	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	124.1	179.9	-178.6	0	0	0	0	109	I911 C913 I972 R976 G995	I911-V974 HydrophobicContact CG2-CB 4.16Å; I911-V974 HydrophobicContact CG2-CG1 4.06Å; C913-V974 HydrophobicContact CB-CG1 4.08Å; I972-V974 PolarHBondContact O-N 3.16Å; V974-R976 PolarHBondContact O-N 3.49Å; V974-G995 PolarHBondContact N-O 3.3Å; V974-G995 PolarHBondContact O-N 3.46Å
975	L	88.1	Confident	79.9	Confident	23 Å²	23	47.4 Å²	47.4	12%	0.12	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	118	167.5	-49.6	-167	0	0	0	108	C913 L920 N921 I924 V992 V994	C913-L975 WeakPolarHBondContact CB-O 3.29Å; L920-L975 HydrophobicContact CD2-CD1 3.75Å; L920-L975 HydrophobicContact CG-CD1 4.06Å; N921-L975 PolarHBondContact ND2-O 2.88Å; N921-L975 WeakPolarHBondContact OD1-CA 3.4Å; N921-L975 WeakPolarHBondContact OD1-CB 3.46Å; N921-L975 PolarHBondContact OD1-N 2.83Å; N921-L975 PolarHBondContact OD1-O 2.69Å; I924-L975 HydrophobicContact CD1-CD1 3.43Å; I924-L975 VanDerWaalsContact CD1-CD1 3.43Å; I924-L975 HydrophobicContact CD1-CD2 4.38Å; I924-L975 HydrophobicContact CD1-CG 3.73Å; L975-V992 HydrophobicContact CB-CG1 4.26Å; L975-V992 HydrophobicContact CD1-CG1 3.85Å; L975-V992 HydrophobicContact CD2-CG1 3.72Å; L975-V992 HydrophobicContact CG-CG1 4.15Å; L975-V994 HydrophobicContact CD2-CG1 4.48Å; L975-V994 HydrophobicContact CD2-CG2 3.98Å
976	R	84.6	Confident	78.7	Confident	64 Å²	64	44.4 Å²	44.4	24%	0.242	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	-45.1	-179.9	-61.2	-176	174.1	165.9	-3.7	110.9	I911 S912 C913 D914 V974 D993 S1186	I911-R976 HydrophobicContact CG2-CG 3.96Å; S912-R976 WeakPolarHBondContact O-CG 3.36Å; C913-R976 CarbonylContact C-O 3.33Å; C913-R976 WeakPolarHBondContact CA-O 3.26Å; D914-R976 PolarHBondContact N-O 3.45Å; V974-R976 PolarHBondContact O-N 3.49Å; R976-D993 HydrophobicContact CB-CB 4.18Å; R976-D993 WeakPolarHBondContact CB-O 3.39Å; R976-D993 PolarHBondContact N-O 3.07Å; R976-S1186 PolarHBondContact NH1-OG 2.96Å
977	R	85.6	Confident	77.8	Confident	131 Å²	131	44 Å²	44	49%	0.494	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.6	150.5	-173.8	175.2	171.1	56.9	-149.5	-2	109.6	D914 D993	D914-R977 VanDerWaalsContact OD2-CB 3.29Å; D914-R977 WeakPolarHBondContact OD2-CB 3.23Å; D914-R977 WeakPolarHBondContact OD2-CG 3.4Å; R977-D993 HydrophobicContact CB-CB 4.34Å; R977-D993 IonicContact CZ-OD2 3.73Å; R977-D993 VanDerWaalsContact CZ-OD2 3.23Å; R977-D993 IonicContact NE-OD2 3.78Å; R977-D993 PolarHBondContact NE-OD2 2.84Å; R977-D993 IonicContact NH2-OD2 3.74Å; R977-D993 PolarHBondContact NH2-OD2 2.81Å; R977-D993 PolarHBondContact O-N 2.79Å
978	V	84.8	Confident	77.4	Confident	51 Å²	51	43.4 Å²	43.4	31%	0.309	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	128.5	165	171.4	0	0	0	0	107.6	M917 L920 I990 E991 V992	M917-V978 HydrophobicContact CE-CB 4.23Å; M917-V978 HydrophobicContact CE-CG2 4.28Å; M917-V978 HydrophobicContact SD-CB 4.04Å; M917-V978 HydrophobicContact SD-CG2 3.58Å; M917-V978 VanDerWaalsContact SD-CG2 3.58Å; L920-V978 HydrophobicContact CD2-CG2 4.48Å; V978-I990 HydrophobicContact CG1-CG2 3.92Å; V978-E991 CarbonylContact C-O 3.34Å; V978-E991 WeakPolarHBondContact CA-O 3.5Å; V978-V992 HydrophobicContact CG2-CG1 4.18Å; V978-V992 HydrophobicContact CG2-CG2 4.28Å
979	G	78.8	Confident	77.4	Confident	25 Å²	25	42.9 Å²	42.9	26%	0.258	24%	0.239	S	C	.	.	P	Polyproline II helix	trans	-75.3	171	175.5	0	0	0	0	0	112.1	P981 E991	G979-P981 WeakPolarHBondContact O-CD 3.46Å; G979-E991 PolarHBondContact N-O 3.24Å
980	C	77.5	Confident	77.8	Confident	101 Å²	101	44.6 Å²	44.6	68%	0.682	25%	0.245	S	C	*	.	P	Polyproline II helix	trans	-64.7	120.5	178.6	-166.6	0	0	0	0	110.2
981	P	82.3	Confident	78.5	Confident	76 Å²	76	44.7 Å²	44.7	49%	0.494	24%	0.241	S	C	.	.	P	Polyproline II helix	trans	-71.1	141.6	177.3	30.5	-34.7	0	0	0	110.4	G979 L988 W989 I990	G979-P981 WeakPolarHBondContact O-CD 3.46Å; P981-L988 HydrophobicContact CB-CD1 4.25Å; P981-W989 VanDerWaalsContact CA-O 3.25Å; P981-W989 WeakPolarHBondContact CA-O 3.43Å; P981-I990 HydrophobicContact CB-CG1 4.32Å
982	Y	72.4	Confident	79.1	Confident	48 Å²	48	43.9 Å²	43.9	19%	0.188	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	152.4	-179.2	65.6	-88.4	0	0	0	111.9	P541 D984 W989	P541-Y982 VanDerWaalsContact CG-OH 3.22Å; P541-Y982 WeakPolarHBondContact CG-OH 3.42Å; Y982-D984 HydrophobicContact CD2-CB 4.34Å; Y982-D984 HydrophobicContact CE2-CB 4.44Å; Y982-W989 HydrophobicContact CD1-CB 4.01Å; Y982-W989 HydrophobicContact CD2-CB 4.11Å; Y982-W989 AromaticContact CD2-CD1 3.84Å; Y982-W989 HydrophobicContact CD2-CG 4.21Å; Y982-W989 HydrophobicContact CE1-CB 3.63Å; Y982-W989 HydrophobicContact CE1-CG 4.25Å; Y982-W989 HydrophobicContact CE2-CB 3.74Å; Y982-W989 AromaticContact CE2-CD1 3.32Å; Y982-W989 HydrophobicContact CE2-CD2 4.28Å; Y982-W989 AromaticContact CE2-CG 3.55Å; Y982-W989 HydrophobicContact CE2-CG 3.55Å; Y982-W989 AromaticContact CE2-NE1 3.83Å; Y982-W989 HydrophobicContact CG-CB 4.23Å; Y982-W989 VanDerWaalsContact CZ-CB 3.48Å; Y982-W989 AromaticContact CZ-CD1 3.85Å; Y982-W989 AromaticContact CZ-CG 3.57Å; Y982-W989 PolarHBondContact N-O 3.01Å; Y982-W989 VanDerWaalsContact N-O 3.1Å; Y982-W989 PolarHBondContact O-N 3.46Å
983	L	68	Low	79.4	Confident	88 Å²	88	43 Å²	43	46%	0.461	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	123.5	-175.5	-177.3	66.7	0	0	0	109.5	Q759 V762 L988	Q759-L983 WeakPolarHBondContact CG-O 3.42Å; V762-L983 HydrophobicContact CG1-CD2 4.47Å; V762-L983 HydrophobicContact CG2-CD2 4.18Å; L983-L988 HydrophobicContact CD1-CB 4.22Å
984	D	61.1	Low	79.6	Confident	5 Å²	5	41.6 Å²	41.6	3%	0.027	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	-163.4	-170.4	91.4	-24.7	0	0	0	115	Y982 H986 G987 W989	Y982-D984 HydrophobicContact CD2-CB 4.34Å; Y982-D984 HydrophobicContact CE2-CB 4.44Å; D984-H986 PolarHBondContact O-N 2.83Å; D984-H986 WeakPolarHBondContact OD1-CA 3.39Å; D984-H986 PolarHBondContact OD1-N 3.05Å; D984-H986 IonicContact OD2-CD2 3.92Å; D984-G987 PolarHBondContact N-O 3.41Å; D984-G987 PolarHBondContact OD1-N 2.85Å; D984-G987 VanDerWaalsContact OD1-N 3.08Å; D984-W989 PolarHBondContact OD1-NE1 3Å; D984-W989 PolarHBondContact OD2-NE1 3.08Å
985	A	56.5	Low	79.8	Confident	19 Å²	19	40.6 Å²	40.6	16%	0.157	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-41.3	-31.6	170.3	0	0	0	0	0	116.3	T757 P758	T757-A985 HydrophobicContact CG2-CB 3.94Å; P758-A985 HydrophobicContact CG-CB 4.48Å
986	H	63.4	Low	79.8	Confident	9 Å²	9	40.7 Å²	40.7	4%	0.042	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-140.1	0.8	-153	-54.9	-91.3	0	0	0	113.7	R736 R744 D984 N1192 P1194	R736-H986 PolarHBondContact NH2-O 3.49Å; R744-H986 PolarHBondContact NH2-CE1 3.41Å; D984-H986 PolarHBondContact O-N 2.83Å; D984-H986 WeakPolarHBondContact OD1-CA 3.39Å; D984-H986 PolarHBondContact OD1-N 3.05Å; D984-H986 IonicContact OD2-CD2 3.92Å; H986-N1192 PolarHBondContact O-ND2 3.49Å; H986-N1192 PolarHBondContact O-OD1 3.2Å; H986-P1194 VanDerWaalsContact O-CA 3.32Å; H986-P1194 WeakPolarHBondContact O-CA 3.31Å; H986-P1194 WeakPolarHBondContact O-CB 3.25Å
987	G	72.7	Confident	79.7	Confident	1 Å²	1	39.4 Å²	39.4	1%	0.01	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	152	-178.3	171.6	0	0	0	0	0	115.6	D984 N1192 I1193	D984-G987 PolarHBondContact N-O 3.41Å; D984-G987 PolarHBondContact OD1-N 2.85Å; D984-G987 VanDerWaalsContact OD1-N 3.08Å; G987-N1192 WeakPolarHBondContact CA-OD1 3.33Å; G987-I1193 CarbonylContact C-O 3.57Å; G987-I1193 WeakPolarHBondContact CA-O 3.19Å
988	L	80.2	Confident	79.6	Confident	68 Å²	68	33.2 Å²	33.2	36%	0.356	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79	120.2	158.2	174.2	64.5	0	0	0	108	P981 L983 I990 N1192 I1193	P981-L988 HydrophobicContact CB-CD1 4.25Å; L983-L988 HydrophobicContact CD1-CB 4.22Å; L988-I990 HydrophobicContact CG-CG1 4.43Å; L988-N1192 WeakPolarHBondContact O-CA 3Å; L988-I1193 PolarHBondContact N-O 2.82Å; L988-I1193 PolarHBondContact O-N 2.9Å
989	W	83.9	Confident	79.3	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	142.3	175.4	-63.9	88.4	0	0	0	111.4	Y493 P541 L542 R736 P981 Y982 D984 L1190 V1191 N1192 M1250	Y493-W989 HydrophobicContact CE1-CZ2 4.15Å; P541-W989 HydrophobicContact CB-CH2 4.14Å; P541-W989 HydrophobicContact CB-CZ3 4.39Å; P541-W989 HydrophobicContact CG-CH2 4Å; P541-W989 HydrophobicContact CG-CZ2 4.45Å; P541-W989 HydrophobicContact CG-CZ3 4.26Å; L542-W989 HydrophobicContact CD1-CH2 4.3Å; L542-W989 HydrophobicContact CD1-CZ2 4.34Å; L542-W989 HydrophobicContact CD2-CH2 4.1Å; L542-W989 HydrophobicContact CG-CH2 3.96Å; L542-W989 HydrophobicContact CG-CZ2 4.38Å; R736-W989 VanDerWaalsContact NH1-CZ2 3.34Å; P981-W989 VanDerWaalsContact CA-O 3.25Å; P981-W989 WeakPolarHBondContact CA-O 3.43Å; Y982-W989 HydrophobicContact CD1-CB 4.01Å; Y982-W989 HydrophobicContact CD2-CB 4.11Å; Y982-W989 AromaticContact CD2-CD1 3.84Å; Y982-W989 HydrophobicContact CD2-CG 4.21Å; Y982-W989 HydrophobicContact CE1-CB 3.63Å; Y982-W989 HydrophobicContact CE1-CG 4.25Å; Y982-W989 HydrophobicContact CE2-CB 3.74Å; Y982-W989 AromaticContact CE2-CD1 3.32Å; Y982-W989 HydrophobicContact CE2-CD2 4.28Å; Y982-W989 AromaticContact CE2-CG 3.55Å; Y982-W989 HydrophobicContact CE2-CG 3.55Å; Y982-W989 AromaticContact CE2-NE1 3.83Å; Y982-W989 HydrophobicContact CG-CB 4.23Å; Y982-W989 VanDerWaalsContact CZ-CB 3.48Å; Y982-W989 AromaticContact CZ-CD1 3.85Å; Y982-W989 AromaticContact CZ-CG 3.57Å; Y982-W989 PolarHBondContact N-O 3.01Å; Y982-W989 VanDerWaalsContact N-O 3.1Å; Y982-W989 PolarHBondContact O-N 3.46Å; D984-W989 PolarHBondContact OD1-NE1 3Å; D984-W989 PolarHBondContact OD2-NE1 3.08Å; W989-L1190 HydrophobicContact CB-CD1 4.4Å; W989-L1190 HydrophobicContact CD2-CD1 4.39Å; W989-L1190 HydrophobicContact CE3-CD1 3.54Å; W989-L1190 HydrophobicContact CE3-CD2 3.72Å; W989-L1190 HydrophobicContact CE3-CG 3.54Å; W989-L1190 HydrophobicContact CH2-CD2 4.19Å; W989-L1190 HydrophobicContact CZ3-CD1 4.08Å; W989-L1190 HydrophobicContact CZ3-CD2 3.33Å; W989-L1190 HydrophobicContact CZ3-CG 3.6Å; W989-V1191 CarbonylContact C-O 3.16Å; W989-V1191 VanDerWaalsContact CA-O 3.29Å; W989-V1191 WeakPolarHBondContact CA-O 3.47Å; W989-N1192 HydrophobicContact CD2-CB 3.98Å; W989-N1192 HydrophobicContact CE3-CB 3.62Å; W989-N1192 HydrophobicContact CZ3-CB 4.06Å; W989-N1192 PolarHBondContact NE1-OD1 2.95Å; W989-M1250 HydrophobicContact CZ3-CE 4.16Å; W989-M1250 HydrophobicContact CZ3-SD 4.24Å
990	I	88	Confident	79.8	Confident	49 Å²	49	33 Å²	33	25%	0.251	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	121.9	176.3	-48.8	178	0	0	0	108.1	V978 P981 L988 V992 V1191	V978-I990 HydrophobicContact CG1-CG2 3.92Å; P981-I990 HydrophobicContact CB-CG1 4.32Å; L988-I990 HydrophobicContact CG-CG1 4.43Å; I990-V992 HydrophobicContact CG2-CG2 3.95Å; I990-V1191 HydrophobicContact CB-CB 4.46Å; I990-V1191 PolarHBondContact N-O 3.41Å; I990-V1191 PolarHBondContact O-N 2.9Å
991	E	88.7	Confident	80.4	Confident	38 Å²	38	29 Å²	29	18%	0.178	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	135.4	172.4	-74.3	-173.8	160.4	0	0	110.3	V978 G979 T1188 L1190 R1206	V978-E991 CarbonylContact C-O 3.34Å; V978-E991 WeakPolarHBondContact CA-O 3.5Å; G979-E991 PolarHBondContact N-O 3.24Å; E991-T1188 HydrophobicContact CB-CG2 4.34Å; E991-L1190 HydrophobicContact CG-CD1 3.42Å; E991-L1190 VanDerWaalsContact CG-CD1 3.42Å; E991-R1206 VanDerWaalsContact OE1-CD 3.23Å; E991-R1206 WeakPolarHBondContact OE1-CD 3.27Å; E991-R1206 IonicContact OE1-CZ 2.69Å; E991-R1206 IonicContact OE1-NE 2.66Å; E991-R1206 IonicContact OE1-NH1 3.29Å; E991-R1206 PolarHBondContact OE1-NH1 3.45Å; E991-R1206 IonicContact OE2-NH1 3.75Å
992	V	89.3	Confident	80.9	Confident	14 Å²	14	26 Å²	26	9%	0.085	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	116.7	-173.8	-171.3	0	0	0	0	109.4	L975 V978 I990 V994 L1189	L975-V992 HydrophobicContact CB-CG1 4.26Å; L975-V992 HydrophobicContact CD1-CG1 3.85Å; L975-V992 HydrophobicContact CD2-CG1 3.72Å; L975-V992 HydrophobicContact CG-CG1 4.15Å; V978-V992 HydrophobicContact CG2-CG1 4.18Å; V978-V992 HydrophobicContact CG2-CG2 4.28Å; I990-V992 HydrophobicContact CG2-CG2 3.95Å; V992-V994 HydrophobicContact CG1-CG2 4.14Å; V992-V994 PolarHBondContact O-N 2.69Å; V992-L1189 PolarHBondContact N-O 3.04Å; V992-L1189 PolarHBondContact O-N 3Å
993	D	90.6	Very high	81.7	Confident	29 Å²	29	23.8 Å²	23.8	16%	0.155	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	107	175.1	-73.3	-44.3	0	0	0	109.8	R976 R977 T1188	R976-D993 HydrophobicContact CB-CB 4.18Å; R976-D993 WeakPolarHBondContact CB-O 3.39Å; R976-D993 PolarHBondContact N-O 3.07Å; R977-D993 HydrophobicContact CB-CB 4.34Å; R977-D993 IonicContact CZ-OD2 3.73Å; R977-D993 VanDerWaalsContact CZ-OD2 3.23Å; R977-D993 IonicContact NE-OD2 3.78Å; R977-D993 PolarHBondContact NE-OD2 2.84Å; R977-D993 IonicContact NH2-OD2 3.74Å; R977-D993 PolarHBondContact NH2-OD2 2.81Å; R977-D993 PolarHBondContact O-N 2.79Å; D993-T1188 WeakPolarHBondContact OD1-CB 3.15Å; D993-T1188 WeakPolarHBondContact OD1-CG2 3.32Å; D993-T1188 PolarHBondContact OD1-OG1 3.13Å
994	V	90.1	Very high	82.7	Confident	13 Å²	13	19.6 Å²	19.6	8%	0.079	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	134.5	-177.2	-172.7	0	0	0	0	110.2	P973 L975 V992 S1186 G1187 L1189	P973-V994 HydrophobicContact CB-CG1 4.1Å; L975-V994 HydrophobicContact CD2-CG1 4.48Å; L975-V994 HydrophobicContact CD2-CG2 3.98Å; V992-V994 HydrophobicContact CG1-CG2 4.14Å; V992-V994 PolarHBondContact O-N 2.69Å; V994-S1186 WeakPolarHBondContact O-CA 3.36Å; V994-G1187 PolarHBondContact N-O 3.23Å; V994-G1187 PolarHBondContact O-N 2.79Å; V994-G1187 VanDerWaalsContact O-N 3.08Å; V994-L1189 HydrophobicContact CG2-CB 3.72Å; V994-L1189 HydrophobicContact CG2-CD2 4.04Å
995	G	89.1	Confident	84	Confident	0 Å²	0	22.6 Å²	22.6	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	128.2	169	0	0	0	0	0	111.5	V974	V974-G995 PolarHBondContact N-O 3.3Å; V974-G995 PolarHBondContact O-N 3.46Å
996	Y	89.2	Confident	85.2	Confident	26 Å²	26	21.8 Å²	21.8	10%	0.102	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	126	177	177.2	-111.7	0	0	0	109.4	E971 P973 G998 F1000 I1182 M1184 L1185	E971-Y996 HydrophobicContact CB-CE2 3.99Å; P973-Y996 HydrophobicContact CB-CD2 4.29Å; Y996-G998 VanDerWaalsContact CE1-CA 3.49Å; Y996-G998 WeakPolarHBondContact CE2-O 3.23Å; Y996-G998 PolarHBondContact O-N 3.38Å; Y996-G998 PolarHBondContact OH-O 2.93Å; Y996-G998 VanDerWaalsContact OH-O 3.13Å; Y996-F1000 HydrophobicContact CE1-CB 4.28Å; Y996-F1000 VanDerWaalsContact OH-CB 3.3Å; Y996-F1000 WeakPolarHBondContact OH-CB 3.41Å; Y996-F1000 PolarHBondContact OH-N 3.02Å; Y996-I1182 HydrophobicContact CD1-CG2 4.32Å; Y996-I1182 HydrophobicContact CE1-CG2 4.24Å; Y996-M1184 WeakPolarHBondContact O-CA 3.49Å; Y996-L1185 HydrophobicContact CD1-CB 4.44Å; Y996-L1185 PolarHBondContact N-O 2.69Å; Y996-L1185 PolarHBondContact O-N 3.46Å
997	A	82.2	Confident	86	Confident	36 Å²	36	22.7 Å²	22.7	30%	0.298	13%	0.132	S	C	.	.			trans	-83.9	10.5	-173.1	0	0	0	0	0	114.5	N907 I911 Q1183	N907-A997 VanDerWaalsContact OD1-CB 3.29Å; N907-A997 WeakPolarHBondContact OD1-CB 3.33Å; I911-A997 HydrophobicContact CD1-CB 4.09Å; A997-Q1183 CarbonylContact C-O 3.55Å
998	G	82.2	Confident	86.1	Confident	2 Å²	2	22.9 Å²	22.9	2%	0.021	13%	0.133	C	C	.	.			trans	88.4	-165.6	-175.1	0	0	0	0	0	112.9	E971 Y996 I1182	E971-G998 WeakPolarHBondContact CB-O 3.46Å; E971-G998 VanDerWaalsContact CG-O 3.25Å; E971-G998 WeakPolarHBondContact CG-O 3.31Å; Y996-G998 VanDerWaalsContact CE1-CA 3.49Å; Y996-G998 WeakPolarHBondContact CE2-O 3.23Å; Y996-G998 PolarHBondContact O-N 3.38Å; Y996-G998 PolarHBondContact OH-O 2.93Å; Y996-G998 VanDerWaalsContact OH-O 3.13Å; G998-I1182 WeakPolarHBondContact CA-O 3.38Å
999	G	79.7	Confident	85.8	Confident	36 Å²	36	21.4 Å²	21.4	37%	0.371	13%	0.126	S	C	.	.			trans	114.8	-33.9	-179.4	0	0	0	0	0	113.5	S1001 I1182	G999-S1001 PolarHBondContact O-N 3.14Å; G999-I1182 PolarHBondContact N-O 2.74Å
1000	F	88.8	Confident	85	Confident	35 Å²	35	22.1 Å²	22.1	15%	0.154	13%	0.129	C	C	.	.			trans	-66.7	126.4	170.5	178.9	-87.6	0	0	0	111.2	I945 I966 D967 L968 Y996 F1002 I1182	I945-F1000 HydrophobicContact CD1-CZ 3.78Å; I966-F1000 HydrophobicContact CG2-CE2 4.32Å; D967-F1000 WeakPolarHBondContact O-CA 3.12Å; L968-F1000 HydrophobicContact CD2-CD2 4.01Å; L968-F1000 HydrophobicContact CD2-CE2 3.74Å; Y996-F1000 HydrophobicContact CE1-CB 4.28Å; Y996-F1000 VanDerWaalsContact OH-CB 3.3Å; Y996-F1000 WeakPolarHBondContact OH-CB 3.41Å; Y996-F1000 PolarHBondContact OH-N 3.02Å; F1000-F1002 HydrophobicContact CD1-CD1 4.28Å; F1000-F1002 AromaticContact CE1-CD1 3.5Å; F1000-F1002 HydrophobicContact CE1-CD1 3.5Å; F1000-F1002 VanDerWaalsContact CE1-CD1 3.5Å; F1000-F1002 AromaticContact CE1-CE1 3.8Å; F1000-F1002 HydrophobicContact CE1-CE1 3.8Å; F1000-F1002 HydrophobicContact CZ-CD1 4.15Å; F1000-I1182 HydrophobicContact CD1-CB 4.47Å; F1000-I1182 HydrophobicContact CD1-CD1 3.57Å; F1000-I1182 HydrophobicContact CD1-CG1 3.94Å; F1000-I1182 HydrophobicContact CE1-CD1 4.04Å; F1000-I1182 HydrophobicContact CG-CD1 4.44Å; F1000-I1182 PolarHBondContact O-N 3.42Å
1001	S	91	Very high	83.9	Confident	16 Å²	16	24.5 Å²	24.5	11%	0.112	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	157	172.9	79.7	0	0	0	0	112.7	D967 G999 Q1179 V1180	D967-S1001 PolarHBondContact N-O 3.48Å; D967-S1001 PolarHBondContact O-N 3.36Å; G999-S1001 PolarHBondContact O-N 3.14Å; S1001-Q1179 PolarHBondContact OG-NE2 2.92Å; S1001-V1180 CarbonylContact C-O 3.49Å; S1001-V1180 WeakPolarHBondContact CA-O 3.37Å; S1001-V1180 VanDerWaalsContact CB-O 3.22Å; S1001-V1180 WeakPolarHBondContact CB-O 3.36Å
1002	F	91.9	Very high	83	Confident	13 Å²	13	29 Å²	29	6%	0.057	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	150.1	177.7	58.8	-76.2	0	0	0	111.2	D965 I966 F1000 L1004 Q1179 V1180 M1237	D965-F1002 CarbonylContact O-C 3.55Å; D965-F1002 WeakPolarHBondContact O-CA 3.47Å; D965-F1002 WeakPolarHBondContact O-CB 3Å; I966-F1002 HydrophobicContact CB-CB 4.48Å; I966-F1002 HydrophobicContact CG1-CB 3.89Å; F1000-F1002 HydrophobicContact CD1-CD1 4.28Å; F1000-F1002 AromaticContact CE1-CD1 3.5Å; F1000-F1002 HydrophobicContact CE1-CD1 3.5Å; F1000-F1002 VanDerWaalsContact CE1-CD1 3.5Å; F1000-F1002 AromaticContact CE1-CE1 3.8Å; F1000-F1002 HydrophobicContact CE1-CE1 3.8Å; F1000-F1002 HydrophobicContact CZ-CD1 4.15Å; F1002-L1004 HydrophobicContact CD2-CD2 3.89Å; F1002-L1004 HydrophobicContact CD2-CG 3.92Å; F1002-L1004 HydrophobicContact CE2-CD1 3.95Å; F1002-L1004 HydrophobicContact CE2-CD2 3.8Å; F1002-L1004 HydrophobicContact CE2-CG 3.77Å; F1002-Q1179 CarbonylContact O-C 3.54Å; F1002-Q1179 WeakPolarHBondContact O-CA 3.44Å; F1002-V1180 HydrophobicContact CD1-CB 4.01Å; F1002-V1180 HydrophobicContact CD1-CG1 4.21Å; F1002-V1180 HydrophobicContact CD2-CB 4.35Å; F1002-V1180 HydrophobicContact CE1-CB 3.68Å; F1002-V1180 HydrophobicContact CE1-CG1 3.46Å; F1002-V1180 VanDerWaalsContact CE1-CG1 3.46Å; F1002-V1180 HydrophobicContact CE2-CB 4.05Å; F1002-V1180 HydrophobicContact CE2-CG1 4.39Å; F1002-V1180 HydrophobicContact CE2-CG2 4.15Å; F1002-V1180 HydrophobicContact CG-CB 4.34Å; F1002-V1180 HydrophobicContact CZ-CB 3.71Å; F1002-V1180 HydrophobicContact CZ-CG1 3.58Å; F1002-V1180 HydrophobicContact CZ-CG2 4.12Å; F1002-V1180 PolarHBondContact N-O 2.95Å; F1002-V1180 PolarHBondContact O-N 3.07Å; F1002-M1237 HydrophobicContact CZ-CE 4.38Å; F1002-M1237 HydrophobicContact CZ-SD 4.03Å
1003	A	90.1	Very high	81.8	Confident	2 Å²	2	29.8 Å²	29.8	2%	0.017	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	117.5	178.3	0	0	0	0	0	110.8	V964 D965 I1177 L1178	V964-A1003 HydrophobicContact CB-CB 4.32Å; V964-A1003 PolarHBondContact N-O 3.44Å; D965-A1003 HydrophobicContact CB-CB 3.72Å; D965-A1003 PolarHBondContact O-N 3.16Å; A1003-I1177 HydrophobicContact CB-CG2 3.85Å; A1003-L1178 WeakPolarHBondContact CA-O 3.3Å
1004	L	88.6	Confident	80.6	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	122.1	171.4	-66.1	178.2	0	0	0	110.3	L949 T962 V963 F1002 I1177 L1178 V1180	L949-L1004 HydrophobicContact CD1-CD2 3.49Å; L949-L1004 VanDerWaalsContact CD1-CD2 3.49Å; L949-L1004 HydrophobicContact CD2-CD2 4.37Å; T962-L1004 CarbonylContact O-C 3.53Å; T962-L1004 WeakPolarHBondContact O-CA 3.11Å; V963-L1004 HydrophobicContact CG2-CD2 4.08Å; F1002-L1004 HydrophobicContact CD2-CD2 3.89Å; F1002-L1004 HydrophobicContact CD2-CG 3.92Å; F1002-L1004 HydrophobicContact CE2-CD1 3.95Å; F1002-L1004 HydrophobicContact CE2-CD2 3.8Å; F1002-L1004 HydrophobicContact CE2-CG 3.77Å; L1004-I1177 CarbonylContact O-C 3.51Å; L1004-I1177 WeakPolarHBondContact O-CA 3.42Å; L1004-L1178 HydrophobicContact CB-CB 4.42Å; L1004-L1178 PolarHBondContact N-O 3.04Å; L1004-L1178 PolarHBondContact O-N 3.32Å; L1004-V1180 HydrophobicContact CD1-CG2 3.87Å; L1004-V1180 HydrophobicContact CG-CG2 4.28Å
1005	E	87.4	Confident	79.6	Confident	68 Å²	68	35 Å²	35	32%	0.318	18%	0.181	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	132.5	163.3	168.6	169.8	-174.1	0	0	109.8	T962 V964 P1175 I1177	T962-E1005 PolarHBondContact N-O 2.9Å; T962-E1005 PolarHBondContact O-N 2.81Å; T962-E1005 WeakPolarHBondContact OG1-CB 3.25Å; T962-E1005 PolarHBondContact OG1-O 2.81Å; V964-E1005 HydrophobicContact CG2-CB 3.41Å; V964-E1005 VanDerWaalsContact CG2-CB 3.41Å; E1005-P1175 HydrophobicContact CG-CB 3.83Å; E1005-P1175 WeakPolarHBondContact OE1-CB 3.5Å; E1005-I1177 HydrophobicContact CB-CG1 4.39Å
1006	T	82.5	Confident	78.5	Confident	2 Å²	2	39.9 Å²	39.9	1%	0.012	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	144.7	-179.4	-174.9	0	0	0	0	110.4	I958 L961 I1176 L1178	I958-T1006 WeakPolarHBondContact CG2-OG1 3.32Å; L961-T1006 HydrophobicContact CD2-CG2 4.45Å; T1006-I1176 HydrophobicContact CG2-CB 4.35Å; T1006-I1176 PolarHBondContact N-O 3.47Å; T1006-I1176 PolarHBondContact O-N 2.79Å; T1006-L1178 HydrophobicContact CG2-CD1 3.77Å; T1006-L1178 HydrophobicContact CG2-CG 4.2Å
1007	S	80.4	Confident	77.3	Confident	29 Å²	29	40.7 Å²	40.7	20%	0.203	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	150	166.3	39.1	0	0	0	0	110.4	N959	N959-S1007 WeakPolarHBondContact CB-O 3.49Å; N959-S1007 WeakPolarHBondContact CB-OG 3.33Å; N959-S1007 PolarHBondContact N-O 3.09Å; N959-S1007 WeakPolarHBondContact ND2-CB 3.38Å; N959-S1007 PolarHBondContact ND2-OG 3.16Å
1008	V	74.5	Confident	76.4	Confident	4 Å²	4	44.7 Å²	44.7	2%	0.024	22%	0.216	C	C	.	.	B	Isolated β-bridge	trans	-131.5	110.9	-163.9	174.3	0	0	0	0	110.8	F957 L1010 S1172 I1176 I1229	F957-V1008 CarbonylContact O-C 3.29Å; F957-V1008 VanDerWaalsContact O-CA 3.3Å; F957-V1008 WeakPolarHBondContact O-CA 3.26Å; V1008-L1010 VanDerWaalsContact C-N 3.3Å; V1008-L1010 HydrophobicContact CG1-CD2 4.01Å; V1008-L1010 HydrophobicContact CG1-CG 4.5Å; V1008-L1010 PolarHBondContact O-N 2.72Å; V1008-S1172 CarbonylContact C-O 3.51Å; V1008-S1172 PolarHBondContact N-O 3.47Å; V1008-S1172 CarbonylContact O-C 3.26Å; V1008-S1172 WeakPolarHBondContact O-CA 3.4Å; V1008-S1172 WeakPolarHBondContact O-CB 3.49Å; V1008-I1176 HydrophobicContact CB-CD1 4.42Å; V1008-I1176 HydrophobicContact CG2-CD1 4.08Å; V1008-I1229 HydrophobicContact CB-CD1 4.44Å; V1008-I1229 HydrophobicContact CG1-CD1 3.48Å; V1008-I1229 VanDerWaalsContact CG1-CD1 3.48Å; V1008-I1229 HydrophobicContact CG2-CD1 4.1Å
1009	N	73.6	Confident	75.6	Confident	38 Å²	38	48.9 Å²	48.9	20%	0.203	24%	0.235	C	C	.	.			trans	-68.8	83.9	175.6	-166.4	-46.7	0	0	0	111.9	F957 M1011 R1012 W1013	F957-N1009 PolarHBondContact O-N 3.11Å; N1009-M1011 PolarHBondContact O-N 3.09Å; N1009-M1011 VanDerWaalsContact O-N 3.15Å; N1009-M1011 PolarHBondContact OD1-N 3.1Å; N1009-R1012 HydrophobicContact CB-CB 4.36Å; N1009-R1012 PolarHBondContact O-N 2.72Å; N1009-R1012 PolarHBondContact OD1-N 2.91Å; N1009-W1013 PolarHBondContact O-N 2.87Å
1010	L	67.5	Low	74.6	Confident	14 Å²	14	50.6 Å²	50.6	7%	0.073	23%	0.233	C	C	.	.	H	α-helix	trans	-58.4	-24.1	-179.9	-64.3	171.4	0	0	0	113.4	V1008 N1014 M1168 L1171 M1226	V1008-L1010 VanDerWaalsContact C-N 3.3Å; V1008-L1010 HydrophobicContact CG1-CD2 4.01Å; V1008-L1010 HydrophobicContact CG1-CG 4.5Å; V1008-L1010 PolarHBondContact O-N 2.72Å; L1010-N1014 PolarHBondContact O-N 3.08Å; L1010-N1014 VanDerWaalsContact O-N 3.1Å; L1010-N1014 PolarHBondContact O-ND2 2.55Å; L1010-M1168 HydrophobicContact CB-CG 3.82Å; L1010-M1168 HydrophobicContact CB-SD 3.57Å; L1010-M1168 VanDerWaalsContact CB-SD 3.57Å; L1010-M1168 HydrophobicContact CD1-SD 3.72Å; L1010-M1168 HydrophobicContact CG-SD 4.23Å; L1010-L1171 HydrophobicContact CD1-CB 3.64Å; L1010-M1226 HydrophobicContact CD2-SD 3.93Å
1011	M	65.3	Low	73.1	Confident	100 Å²	100	53.3 Å²	53.3	49%	0.493	25%	0.245	S	C	.	.	H	α-helix	trans	-72.7	-46.3	177.4	-163	170.3	-176.9	0	0	110.9	N1009 N1014 Q1015 Q1165	N1009-M1011 PolarHBondContact O-N 3.09Å; N1009-M1011 VanDerWaalsContact O-N 3.15Å; N1009-M1011 PolarHBondContact OD1-N 3.1Å; M1011-N1014 PolarHBondContact O-N 3.03Å; M1011-Q1015 PolarHBondContact O-N 3.19Å; M1011-Q1165 HydrophobicContact CE-CG 4.27Å
1012	R	68.1	Low	71.5	Confident	131 Å²	131	57.1 Å²	57.1	49%	0.494	26%	0.264	S	S	.	.	H	α-helix	trans	-65.4	-36.3	171.7	-71.5	179.4	173.9	175.7	-2	112.6	N956 F957 N1009 N1014 Q1015 K1016	N956-R1012 WeakPolarHBondContact O-CD 3.42Å; N956-R1012 PolarHBondContact O-NH1 2.79Å; F957-R1012 HydrophobicContact CB-CB 4.11Å; N1009-R1012 HydrophobicContact CB-CB 4.36Å; N1009-R1012 PolarHBondContact O-N 2.72Å; N1009-R1012 PolarHBondContact OD1-N 2.91Å; R1012-N1014 VanDerWaalsContact C-N 3.33Å; R1012-N1014 PolarHBondContact O-N 3.35Å; R1012-Q1015 WeakPolarHBondContact O-CB 3.32Å; R1012-Q1015 PolarHBondContact O-N 3.44Å; R1012-Q1015 VanDerWaalsContact O-N 3.07Å; R1012-K1016 PolarHBondContact O-N 2.93Å; R1012-K1016 VanDerWaalsContact O-N 3.13Å
1013	W	64.4	Low	69.9	Low	31 Å²	31	62.4 Å²	62.4	12%	0.117	29%	0.292	C	S	.	.	H	α-helix	trans	-57.9	-44.5	172.7	176.3	-101.1	0	0	0	112.2	F957 N1009 Q1015 K1016 L1017 R1228 I1229	F957-W1013 HydrophobicContact CB-CB 4.24Å; F957-W1013 HydrophobicContact CD1-CE3 4.1Å; F957-W1013 AromaticContact CD2-CE3 3.5Å; F957-W1013 HydrophobicContact CD2-CE3 3.5Å; F957-W1013 HydrophobicContact CD2-CZ3 4.01Å; F957-W1013 HydrophobicContact CE1-CE3 4.02Å; F957-W1013 HydrophobicContact CE1-CZ3 4.13Å; F957-W1013 AromaticContact CE2-CE3 3.43Å; F957-W1013 HydrophobicContact CE2-CE3 3.43Å; F957-W1013 VanDerWaalsContact CE2-CE3 3.43Å; F957-W1013 AromaticContact CE2-CZ3 3.42Å; F957-W1013 HydrophobicContact CE2-CZ3 3.42Å; F957-W1013 VanDerWaalsContact CE2-CZ3 3.42Å; F957-W1013 AromaticContact CG-CE3 3.86Å; F957-W1013 HydrophobicContact CG-CE3 3.86Å; F957-W1013 AromaticContact CZ-CE3 3.72Å; F957-W1013 HydrophobicContact CZ-CE3 3.72Å; F957-W1013 AromaticContact CZ-CZ3 3.51Å; F957-W1013 HydrophobicContact CZ-CZ3 3.51Å; N1009-W1013 PolarHBondContact O-N 2.87Å; W1013-Q1015 PolarHBondContact O-N 3.32Å; W1013-K1016 PolarHBondContact O-N 3.26Å; W1013-L1017 WeakPolarHBondContact O-CG 3.23Å; W1013-L1017 PolarHBondContact O-N 3.18Å; W1013-L1017 VanDerWaalsContact O-N 3.12Å; W1013-R1228 HydrophobicContact CH2-CB 3.76Å; W1013-R1228 HydrophobicContact CH2-CG 3.77Å; W1013-R1228 HydrophobicContact CZ2-CB 3.87Å; W1013-R1228 HydrophobicContact CZ2-CG 4.21Å; W1013-I1229 HydrophobicContact CE3-CD1 4.44Å; W1013-I1229 HydrophobicContact CE3-CG1 4.35Å; W1013-I1229 HydrophobicContact CH2-CG1 3.76Å; W1013-I1229 HydrophobicContact CZ2-CG1 4.21Å; W1013-I1229 HydrophobicContact CZ3-CD1 4.42Å; W1013-I1229 HydrophobicContact CZ3-CG1 3.85Å
1014	N	65.1	Low	67.9	Low	43 Å²	43	66.7 Å²	66.7	23%	0.23	31%	0.314	C	S	.	.	H	α-helix	trans	-70.8	-12.9	175.4	-79	-62.7	0	0	0	114.2	L1010 M1011 R1012 R1018	L1010-N1014 PolarHBondContact O-N 3.08Å; L1010-N1014 VanDerWaalsContact O-N 3.1Å; L1010-N1014 PolarHBondContact O-ND2 2.55Å; M1011-N1014 PolarHBondContact O-N 3.03Å; R1012-N1014 VanDerWaalsContact C-N 3.33Å; R1012-N1014 PolarHBondContact O-N 3.35Å; N1014-R1018 WeakPolarHBondContact O-CG 3.34Å; N1014-R1018 PolarHBondContact O-NE 3.41Å; N1014-R1018 VanDerWaalsContact O-NE 3.07Å
1015	Q	69.3	Low	66.1	Low	109 Å²	109	73.1 Å²	73.1	51%	0.509	34%	0.34	S	S	.	.	H	α-helix	trans	-79	-50	169.1	-174.8	-173.8	-30.7	0	0	110.4	M1011 R1012 W1013 L1017 R1018 E1019	M1011-Q1015 PolarHBondContact O-N 3.19Å; R1012-Q1015 WeakPolarHBondContact O-CB 3.32Å; R1012-Q1015 PolarHBondContact O-N 3.44Å; R1012-Q1015 VanDerWaalsContact O-N 3.07Å; W1013-Q1015 PolarHBondContact O-N 3.32Å; Q1015-L1017 PolarHBondContact O-N 3.36Å; Q1015-R1018 WeakPolarHBondContact O-CA 3.45Å; Q1015-R1018 WeakPolarHBondContact O-CB 3.29Å; Q1015-R1018 PolarHBondContact O-N 2.75Å; Q1015-E1019 WeakPolarHBondContact CG-OE1 3.25Å; Q1015-E1019 PolarHBondContact NE2-OE1 3.13Å; Q1015-E1019 PolarHBondContact O-N 2.85Å; Q1015-E1019 VanDerWaalsContact O-N 3.12Å
1016	K	65.8	Low	64.1	Low	102 Å²	102	74.3 Å²	74.3	44%	0.443	36%	0.355	S	S	.	.	H	α-helix	trans	-59.5	-33.1	177.2	-171.5	166.6	-175.2	166.3	0	112.9	F957 R1012 W1013 R1018 E1019 E1020	F957-K1016 HydrophobicContact CE1-CD 4.19Å; R1012-K1016 PolarHBondContact O-N 2.93Å; R1012-K1016 VanDerWaalsContact O-N 3.13Å; W1013-K1016 PolarHBondContact O-N 3.26Å; K1016-R1018 PolarHBondContact O-N 3.12Å; K1016-E1019 WeakPolarHBondContact CA-OE2 3.36Å; K1016-E1020 VanDerWaalsContact O-CB 3.29Å; K1016-E1020 WeakPolarHBondContact O-CB 3.48Å; K1016-E1020 PolarHBondContact O-N 2.77Å
1017	L	64.8	Low	62.4	Low	44 Å²	44	77.5 Å²	77.5	23%	0.23	38%	0.377	C	S	.	.	H	α-helix	trans	-69.5	-8.8	172.3	-75	177.3	0	0	0	115.3	W1013 Q1015 K1021	W1013-L1017 WeakPolarHBondContact O-CG 3.23Å; W1013-L1017 PolarHBondContact O-N 3.18Å; W1013-L1017 VanDerWaalsContact O-N 3.12Å; Q1015-L1017 PolarHBondContact O-N 3.36Å; L1017-K1021 VanDerWaalsContact O-CD 3.23Å; L1017-K1021 WeakPolarHBondContact O-CD 3.44Å; L1017-K1021 WeakPolarHBondContact O-CE 3.18Å; L1017-K1021 WeakPolarHBondContact O-CG 3.31Å
1018	R	63.1	Low	60.5	Low	120 Å²	120	81.3 Å²	81.3	45%	0.453	40%	0.396	S	S	.	.	H	α-helix	trans	-95.8	-53	170.1	-62	173.1	-150.5	-133.1	10.6	109.4	N1014 Q1015 K1016 E1020 K1021 D1022 D1160	N1014-R1018 WeakPolarHBondContact O-CG 3.34Å; N1014-R1018 PolarHBondContact O-NE 3.41Å; N1014-R1018 VanDerWaalsContact O-NE 3.07Å; Q1015-R1018 WeakPolarHBondContact O-CA 3.45Å; Q1015-R1018 WeakPolarHBondContact O-CB 3.29Å; Q1015-R1018 PolarHBondContact O-N 2.75Å; K1016-R1018 PolarHBondContact O-N 3.12Å; R1018-E1020 VanDerWaalsContact C-N 3.28Å; R1018-E1020 PolarHBondContact O-N 3.44Å; R1018-K1021 CarbonylContact O-C 3.6Å; R1018-K1021 WeakPolarHBondContact O-CA 3.17Å; R1018-K1021 WeakPolarHBondContact O-CB 3.36Å; R1018-K1021 PolarHBondContact O-N 3.31Å; R1018-D1022 VanDerWaalsContact O-CG 3.26Å; R1018-D1022 PolarHBondContact O-N 3.09Å; R1018-D1022 VanDerWaalsContact O-OD2 3.12Å; R1018-D1160 IonicContact NH1-OD1 3.57Å; R1018-D1160 IonicContact NH2-OD1 3.75Å
1019	E	64.8	Low	58.8	Low	90 Å²	90	87.1 Å²	87.1	42%	0.421	43%	0.427	S	S	.	.	H	α-helix	trans	-49.5	-46.3	176.8	-65.1	164.1	175.4	0	0	112.6	Q1015 K1016 K1021 D1022 I1023	Q1015-E1019 WeakPolarHBondContact CG-OE1 3.25Å; Q1015-E1019 PolarHBondContact NE2-OE1 3.13Å; Q1015-E1019 PolarHBondContact O-N 2.85Å; Q1015-E1019 VanDerWaalsContact O-N 3.12Å; K1016-E1019 WeakPolarHBondContact CA-OE2 3.36Å; E1019-K1021 VanDerWaalsContact C-N 3.28Å; E1019-K1021 PolarHBondContact O-N 3.36Å; E1019-D1022 PolarHBondContact O-N 2.78Å; E1019-I1023 WeakPolarHBondContact O-CG1 3.37Å; E1019-I1023 PolarHBondContact O-N 2.89Å
1020	E	60.5	Low	57.1	Low	71 Å²	71	94.9 Å²	94.9	33%	0.332	46%	0.459	S	S	.	.	H	α-helix	trans	-69.1	-22.4	177.9	-170.6	177.5	-131.9	0	0	113.5	K1016 R1018 N1024 R1228	K1016-E1020 VanDerWaalsContact O-CB 3.29Å; K1016-E1020 WeakPolarHBondContact O-CB 3.48Å; K1016-E1020 PolarHBondContact O-N 2.77Å; R1018-E1020 VanDerWaalsContact C-N 3.28Å; R1018-E1020 PolarHBondContact O-N 3.44Å; E1020-N1024 PolarHBondContact O-ND2 2.9Å; E1020-R1228 IonicContact OE1-CZ 2.84Å; E1020-R1228 IonicContact OE1-NH1 2.61Å; E1020-R1228 IonicContact OE1-NH2 3.72Å; E1020-R1228 PolarHBondContact OE1-NH2 2.94Å; E1020-R1228 IonicContact OE2-CZ 3.52Å; E1020-R1228 VanDerWaalsContact OE2-CZ 3.24Å; E1020-R1228 IonicContact OE2-NH1 3.22Å; E1020-R1228 PolarHBondContact OE2-NH1 2.78Å; E1020-R1228 IonicContact OE2-NH2 3.96Å; E1020-R1228 PolarHBondContact OE2-NH2 3.2Å
1021	K	56.8	Low	55.6	Low	92 Å²	92	98 Å²	98	40%	0.4	49%	0.486	S	S	.	.	H	α-helix	trans	-82.4	-38.7	172.3	-69.8	176	-174.7	167.5	0	111.6	L1017 R1018 E1019 I1023 N1024 Y1025	L1017-K1021 VanDerWaalsContact O-CD 3.23Å; L1017-K1021 WeakPolarHBondContact O-CD 3.44Å; L1017-K1021 WeakPolarHBondContact O-CE 3.18Å; L1017-K1021 WeakPolarHBondContact O-CG 3.31Å; R1018-K1021 CarbonylContact O-C 3.6Å; R1018-K1021 WeakPolarHBondContact O-CA 3.17Å; R1018-K1021 WeakPolarHBondContact O-CB 3.36Å; R1018-K1021 PolarHBondContact O-N 3.31Å; E1019-K1021 VanDerWaalsContact C-N 3.28Å; E1019-K1021 PolarHBondContact O-N 3.36Å; K1021-I1023 VanDerWaalsContact C-N 3.31Å; K1021-I1023 PolarHBondContact O-N 3.25Å; K1021-N1024 PolarHBondContact O-N 2.91Å; K1021-N1024 VanDerWaalsContact O-N 3.13Å; K1021-Y1025 WeakPolarHBondContact O-CD2 3.47Å; K1021-Y1025 PolarHBondContact O-N 2.87Å
1022	D	57.2	Low	54.2	Low	96 Å²	96	101.3 Å²	101.3	51%	0.513	50%	0.501	S	S	.	.	H	α-helix	trans	-66.3	-35.6	-177.9	-57.8	-34.8	0	0	0	111.5	R1018 E1019 Y1025 S1026	R1018-D1022 VanDerWaalsContact O-CG 3.26Å; R1018-D1022 PolarHBondContact O-N 3.09Å; R1018-D1022 VanDerWaalsContact O-OD2 3.12Å; E1019-D1022 PolarHBondContact O-N 2.78Å; D1022-Y1025 PolarHBondContact O-N 3.11Å; D1022-S1026 WeakPolarHBondContact O-CB 3.3Å; D1022-S1026 PolarHBondContact O-N 3.5Å; D1022-S1026 VanDerWaalsContact O-N 3.11Å; D1022-S1026 PolarHBondContact O-OG 3.12Å
1023	I	57.5	Low	52.5	Low	125 Å²	125	103 Å²	103	64%	0.641	52%	0.52	S	S	*	.	H	α-helix	trans	-60.1	-44.8	170.7	-67.6	165.9	0	0	0	111.4	E1019 K1021 S1026 S1027	E1019-I1023 WeakPolarHBondContact O-CG1 3.37Å; E1019-I1023 PolarHBondContact O-N 2.89Å; K1021-I1023 VanDerWaalsContact C-N 3.31Å; K1021-I1023 PolarHBondContact O-N 3.25Å; I1023-S1026 PolarHBondContact O-N 2.85Å; I1023-S1027 PolarHBondContact O-N 3.07Å
1024	N	48.9	Very low	51.1	Low	91 Å²	91	107.1 Å²	107.1	49%	0.487	55%	0.553	S	S	.	*	H	α-helix	trans	-74.7	-34.7	179.8	-75.1	-71.8	0	0	0	112.9	E1020 K1021 S1026 S1027 D1028	E1020-N1024 PolarHBondContact O-ND2 2.9Å; K1021-N1024 PolarHBondContact O-N 2.91Å; K1021-N1024 VanDerWaalsContact O-N 3.13Å; N1024-S1026 PolarHBondContact O-N 3.48Å; N1024-S1027 PolarHBondContact O-N 3.26Å; N1024-S1027 PolarHBondContact O-OG 3.5Å; N1024-D1028 PolarHBondContact O-N 2.89Å
1025	Y	49.9	Very low	49.6	Very low	136 Å²	136	113.4 Å²	113.4	53%	0.533	59%	0.586	S	S	.	*	H	α-helix	trans	-69.3	-22.4	174.5	-93.5	-82.6	0	0	0	112.8	K1021 D1022 N1029 K1151	K1021-Y1025 WeakPolarHBondContact O-CD2 3.47Å; K1021-Y1025 PolarHBondContact O-N 2.87Å; D1022-Y1025 PolarHBondContact O-N 3.11Å; Y1025-N1029 PolarHBondContact O-ND2 3.09Å; Y1025-K1151 PolarHBondContact OH-NZ 2.9Å
1026	S	46	Very low	47.8	Very low	93 Å²	93	113.2 Å²	113.2	65%	0.65	60%	0.596	S	S	*	*	H	α-helix	trans	-79.7	-29.5	176.1	-58.3	0	0	0	0	113.1	D1022 I1023 N1024	D1022-S1026 WeakPolarHBondContact O-CB 3.3Å; D1022-S1026 PolarHBondContact O-N 3.5Å; D1022-S1026 VanDerWaalsContact O-N 3.11Å; D1022-S1026 PolarHBondContact O-OG 3.12Å; I1023-S1026 PolarHBondContact O-N 2.85Å; N1024-S1026 PolarHBondContact O-N 3.48Å
1027	S	46.4	Very low	46.3	Very low	68 Å²	68	116.1 Å²	116.1	48%	0.476	62%	0.617	S	S	.	*	H	α-helix	trans	-75.8	-38.3	176.8	49.2	0	0	0	0	113.4	I1023 N1024 N1029	I1023-S1027 PolarHBondContact O-N 3.07Å; N1024-S1027 PolarHBondContact O-N 3.26Å; N1024-S1027 PolarHBondContact O-OG 3.5Å; S1027-N1029 VanDerWaalsContact C-N 3.33Å; S1027-N1029 PolarHBondContact O-N 3.05Å
1028	D	41.6	Very low	44.5	Very low	109 Å²	109	123 Å²	123	58%	0.583	65%	0.648	S	S	*	*	H	α-helix	trans	-74.4	-22.7	-170	-69.5	4.3	0	0	0	113.3	N1024 F1030	N1024-D1028 PolarHBondContact O-N 2.89Å; D1028-F1030 PolarHBondContact O-N 3.42Å
1029	N	39	Very low	43	Very low	127 Å²	127	122.8 Å²	122.8	68%	0.679	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.9	-0.9	-175.8	-77.8	-69	0	0	0	115.1	Y1025 S1027	Y1025-N1029 PolarHBondContact O-ND2 3.09Å; S1027-N1029 VanDerWaalsContact C-N 3.33Å; S1027-N1029 PolarHBondContact O-N 3.05Å
1030	F	37.5	Very low	41.4	Very low	200 Å²	200	126.4 Å²	126.4	88%	0.877	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.9	-0.8	172.9	-148.6	-96.8	0	0	0	113.3	D1028	D1028-F1030 PolarHBondContact O-N 3.42Å
1031	A	35.6	Very low	40.1	Very low	79 Å²	79	128.9 Å²	128.9	65%	0.653	71%	0.709	S	S	*	*	S	Bend	trans	-91.4	-2	-173.7	0	0	0	0	0	115
1032	Q	36.8	Very low	38.7	Very low	171 Å²	171	133.4 Å²	133.4	80%	0.799	73%	0.728	S	S	*	*	S	Bend	trans	-104	55.6	-175.2	-66.4	-168.8	-12.5	0	0	113.5
1033	N	32.5	Very low	37.6	Very low	167 Å²	167	135.8 Å²	135.8	89%	0.893	75%	0.746	S	S	*	*	S	Bend	trans	-162.4	43.7	164.9	-109.4	-23.7	0	0	0	116.3
1034	S	34.4	Very low	36.3	Very low	116 Å²	116	135.8 Å²	135.8	81%	0.811	75%	0.747	S	S	*	*			trans	-160.1	112.2	161.6	56.4	0	0	0	0	111.5
1035	L	32.5	Very low	35.6	Very low	176 Å²	176	135.6 Å²	135.6	92%	0.921	75%	0.753	S	S	*	*			trans	-109.7	103	-177	-167.4	84.9	0	0	0	110.9
1036	S	31.6	Very low	34.8	Very low	104 Å²	104	139.4 Å²	139.4	73%	0.727	77%	0.766	S	S	*	*			trans	175.4	140.3	148.6	36	0	0	0	0	114.1
1037	N	34	Very low	34.2	Very low	164 Å²	164	138.5 Å²	138.5	88%	0.877	76%	0.76	S	S	*	*			trans	72.4	151.4	152.2	-56.4	-4.1	0	0	0	120
1038	E	27.9	Very low	33.7	Very low	188 Å²	188	140 Å²	140	88%	0.879	76%	0.762	S	S	*	*			trans	-88.5	148.8	-155.5	-57.2	164	90.7	0	0	115.2
1039	S	32.2	Very low	33.4	Very low	116 Å²	116	139.4 Å²	139.4	81%	0.811	76%	0.762	S	S	*	*				178.3	159.3	122.2	40	0	0	0	0	112.2
1040	L	31.2	Very low	33.1	Very low	165 Å²	165	141.1 Å²	141.1	86%	0.864	76%	0.763	S	S	*	*			trans	-66.1	130.6	-177.7	-97.4	66.6	0	0	0	112.7	K1042	L1040-K1042 PolarHBondContact O-N 3.39Å
1041	P	31.9	Very low	32.7	Very low	124 Å²	124	136.7 Å²	136.7	81%	0.805	75%	0.747	S	S	*	*			trans	-74.7	109.8	168.9	30.1	-32.5	0	0	0	110.8	V1043	P1041-V1043 PolarHBondContact O-N 3.48Å
1042	K	28.9	Very low	33	Very low	186 Å²	186	133.3 Å²	133.3	81%	0.809	72%	0.719	S	S	*	*			trans	-59.6	130.5	164.2	-75.5	178.9	176.1	177.2	0	109.2	L1040 N1044	L1040-K1042 PolarHBondContact O-N 3.39Å; K1042-N1044 PolarHBondContact O-N 2.83Å
1043	V	32.9	Very low	33.1	Very low	146 Å²	146	126.9 Å²	126.9	89%	0.885	70%	0.695	S	S	*	*			trans	-67.7	106	176.7	179	0	0	0	0	109	P1041 S1045	P1041-V1043 PolarHBondContact O-N 3.48Å; V1043-S1045 PolarHBondContact O-N 3.23Å
1044	N	29.8	Very low	33.3	Very low	125 Å²	125	127 Å²	127	67%	0.668	68%	0.684	S	S	*	*			trans	-68.3	124.6	-175.3	-81	-49.6	0	0	0	112.2	K1042 R1046 S1047	K1042-N1044 PolarHBondContact O-N 2.83Å; N1044-R1046 PolarHBondContact O-N 3.48Å; N1044-S1047 PolarHBondContact O-N 2.83Å
1045	S	34.9	Very low	33.7	Very low	87 Å²	87	124.8 Å²	124.8	61%	0.608	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55	-24.3	179.1	49.9	0	0	0	0	114.5	V1043 S1047 I1048	V1043-S1045 PolarHBondContact O-N 3.23Å; S1045-S1047 PolarHBondContact O-N 3.01Å; S1045-I1048 PolarHBondContact O-N 3.33Å; S1045-I1048 VanDerWaalsContact O-N 3.11Å
1046	R	33.8	Very low	34.2	Very low	217 Å²	217	116.7 Å²	116.7	82%	0.819	62%	0.621	S	S	*	*	H	α-helix	trans	-56.2	-17.1	176.2	-78.9	-178.2	167.5	172.7	-3.6	115.7	N1044	N1044-R1046 PolarHBondContact O-N 3.48Å
1047	S	31.9	Very low	34.8	Very low	73 Å²	73	115.1 Å²	115.1	51%	0.51	60%	0.604	S	S	.	*	H	α-helix	trans	-74.7	-38.8	175.6	-164.1	0	0	0	0	112.4	N1044 S1045 T1049 K1050 M1051	N1044-S1047 PolarHBondContact O-N 2.83Å; S1045-S1047 PolarHBondContact O-N 3.01Å; S1047-T1049 PolarHBondContact O-N 2.65Å; S1047-K1050 PolarHBondContact O-N 3.21Å; S1047-M1051 PolarHBondContact O-N 3.45Å
1048	I	36.5	Very low	35.6	Very low	100 Å²	100	114 Å²	114	51%	0.513	59%	0.594	S	S	.	*	H	α-helix	trans	-67.7	-40.1	-174	-59.3	175	0	0	0	110.7	S1045 K1050 M1051 A1052	S1045-I1048 PolarHBondContact O-N 3.33Å; S1045-I1048 VanDerWaalsContact O-N 3.11Å; I1048-K1050 VanDerWaalsContact C-N 3.28Å; I1048-K1050 PolarHBondContact O-N 3.29Å; I1048-M1051 WeakPolarHBondContact O-CA 3.42Å; I1048-M1051 WeakPolarHBondContact O-CB 3.41Å; I1048-M1051 PolarHBondContact O-N 2.9Å; I1048-A1052 PolarHBondContact O-N 2.75Å
1049	T	35.8	Very low	36.7	Very low	97 Å²	97	107.3 Å²	107.3	60%	0.595	56%	0.562	S	S	*	*	H	α-helix	trans	-61.9	-32.7	179.9	-26.6	0	0	0	0	112.9	S1047 A1053	S1047-T1049 PolarHBondContact O-N 2.65Å; T1049-A1053 PolarHBondContact O-N 3.05Å
1050	K	32.7	Very low	37.5	Very low	162 Å²	162	103.6 Å²	103.6	70%	0.704	53%	0.534	S	S	*	.	H	α-helix	trans	-69.8	-37.6	173.3	-80.3	-170	172.5	-173.5	0	112.1	S1047 I1048 A1053 Y1054	S1047-K1050 PolarHBondContact O-N 3.21Å; I1048-K1050 VanDerWaalsContact C-N 3.28Å; I1048-K1050 PolarHBondContact O-N 3.29Å; K1050-A1053 PolarHBondContact O-N 3.36Å; K1050-Y1054 PolarHBondContact O-N 3.37Å; K1050-Y1054 VanDerWaalsContact O-N 3.11Å
1051	M	29.9	Very low	38.1	Very low	107 Å²	107	100.6 Å²	100.6	53%	0.527	53%	0.526	S	S	.	.	H	α-helix	trans	-65.1	-44.5	175	-114.9	170.9	-75.7	0	0	111.5	S1047 I1048 A1053 Y1054 L1055	S1047-M1051 PolarHBondContact O-N 3.45Å; I1048-M1051 WeakPolarHBondContact O-CA 3.42Å; I1048-M1051 WeakPolarHBondContact O-CB 3.41Å; I1048-M1051 PolarHBondContact O-N 2.9Å; M1051-A1053 VanDerWaalsContact C-N 3.27Å; M1051-A1053 PolarHBondContact O-N 2.95Å; M1051-Y1054 PolarHBondContact O-N 2.9Å; M1051-L1055 WeakPolarHBondContact O-CB 3.26Å; M1051-L1055 VanDerWaalsContact O-CG 3.26Å; M1051-L1055 WeakPolarHBondContact O-CG 3.48Å; M1051-L1055 PolarHBondContact O-N 3.23Å
1052	A	40.3	Very low	38.5	Very low	9 Å²	9	98 Å²	98	7%	0.074	52%	0.516	C	S	.	.	H	α-helix	trans	-60.7	-34.6	176.8	0	0	0	0	0	113	T600 L604 I1048 S1056	T600-A1052 HydrophobicContact CG2-CB 4.12Å; L604-A1052 HydrophobicContact CD1-CB 4.29Å; I1048-A1052 PolarHBondContact O-N 2.75Å; A1052-S1056 WeakPolarHBondContact O-CB 3.27Å; A1052-S1056 PolarHBondContact O-N 3.16Å; A1052-S1056 VanDerWaalsContact O-N 3.11Å; A1052-S1056 PolarHBondContact O-OG 2.83Å
1053	A	40.6	Very low	38.9	Very low	35 Å²	35	92.7 Å²	92.7	29%	0.289	50%	0.496	S	S	.	.	H	α-helix	trans	-67.6	-52.6	173.1	0	0	0	0	0	112.1	T1049 K1050 M1051 L1055 S1056 D1057	T1049-A1053 PolarHBondContact O-N 3.05Å; K1050-A1053 PolarHBondContact O-N 3.36Å; M1051-A1053 VanDerWaalsContact C-N 3.27Å; M1051-A1053 PolarHBondContact O-N 2.95Å; A1053-L1055 PolarHBondContact O-N 2.79Å; A1053-S1056 WeakPolarHBondContact O-CB 3.35Å; A1053-S1056 PolarHBondContact O-N 3.46Å; A1053-S1056 VanDerWaalsContact O-N 3.11Å; A1053-D1057 PolarHBondContact O-N 3.39Å
1054	Y	35.6	Very low	38.8	Very low	171 Å²	171	89.3 Å²	89.3	67%	0.671	48%	0.479	S	S	*	.	H	α-helix	trans	-57.2	-46.5	177.9	-98.2	-100.1	0	0	0	112.4	K1050 M1051 S1056 D1057 E1058	K1050-Y1054 PolarHBondContact O-N 3.37Å; K1050-Y1054 VanDerWaalsContact O-N 3.11Å; M1051-Y1054 PolarHBondContact O-N 2.9Å; Y1054-S1056 VanDerWaalsContact C-N 3.28Å; Y1054-S1056 PolarHBondContact O-N 2.98Å; Y1054-D1057 PolarHBondContact O-N 2.9Å; Y1054-D1057 VanDerWaalsContact O-N 3.09Å; Y1054-E1058 PolarHBondContact O-N 2.81Å; Y1054-E1058 VanDerWaalsContact O-N 3.12Å
1055	L	42.4	Very low	39.1	Very low	69 Å²	69	89.6 Å²	89.6	36%	0.361	49%	0.485	S	S	.	.	H	α-helix	trans	-66.6	-28.4	178.5	-66.1	168.5	0	0	0	112.5	M1051 A1053 D1057 E1059	M1051-L1055 WeakPolarHBondContact O-CB 3.26Å; M1051-L1055 VanDerWaalsContact O-CG 3.26Å; M1051-L1055 WeakPolarHBondContact O-CG 3.48Å; M1051-L1055 PolarHBondContact O-N 3.23Å; A1053-L1055 PolarHBondContact O-N 2.79Å; L1055-D1057 VanDerWaalsContact C-N 3.27Å; L1055-D1057 PolarHBondContact O-N 3.28Å; L1055-E1059 WeakPolarHBondContact O-CG 3.38Å
1056	S	44	Very low	39	Very low	6 Å²	6	91.1 Å²	91.1	4%	0.042	49%	0.491	C	S	.	.	H	α-helix	trans	-69.6	-22.9	173.3	-64.9	0	0	0	0	113.4	A1052 A1053 Y1054	A1052-S1056 WeakPolarHBondContact O-CB 3.27Å; A1052-S1056 PolarHBondContact O-N 3.16Å; A1052-S1056 VanDerWaalsContact O-N 3.11Å; A1052-S1056 PolarHBondContact O-OG 2.83Å; A1053-S1056 WeakPolarHBondContact O-CB 3.35Å; A1053-S1056 PolarHBondContact O-N 3.46Å; A1053-S1056 VanDerWaalsContact O-N 3.11Å; Y1054-S1056 VanDerWaalsContact C-N 3.28Å; Y1054-S1056 PolarHBondContact O-N 2.98Å
1057	D	44.3	Very low	39	Very low	71 Å²	71	86.2 Å²	86.2	38%	0.38	48%	0.481	S	S	.	.	H	α-helix	trans	-97.7	-21.3	-179	-70.3	-37.4	0	0	0	112.9	R601 A1053 Y1054 L1055	R601-D1057 IonicContact CZ-OD1 2.63Å; R601-D1057 IonicContact NH1-OD1 3.21Å; R601-D1057 PolarHBondContact NH1-OD1 2.91Å; R601-D1057 IonicContact NH1-OD2 2.77Å; R601-D1057 IonicContact NH2-OD1 3.89Å; A1053-D1057 PolarHBondContact O-N 3.39Å; Y1054-D1057 PolarHBondContact O-N 2.9Å; Y1054-D1057 VanDerWaalsContact O-N 3.09Å; L1055-D1057 VanDerWaalsContact C-N 3.27Å; L1055-D1057 PolarHBondContact O-N 3.28Å
1058	E	50.6	Low	39.3	Very low	139 Å²	139	87.8 Å²	87.8	65%	0.65	49%	0.492	S	S	*	.	H	α-helix	trans	-83	-24.2	176.5	-72.7	-170	158.8	0	0	114.8	Y1054 D1060	Y1054-E1058 PolarHBondContact O-N 2.81Å; Y1054-E1058 VanDerWaalsContact O-N 3.12Å; E1058-D1060 PolarHBondContact O-N 3.43Å
1059	E	50.2	Low	39.1	Very low	48 Å²	48	92.6 Å²	92.6	22%	0.224	51%	0.513	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.8	15.9	-169.2	-71.9	-170.5	161.6	0	0	116.7	R602 L1055	R602-E1059 IonicContact CZ-OE2 2.67Å; R602-E1059 VanDerWaalsContact NH1-CB 3.27Å; R602-E1059 IonicContact NH1-OE2 3.81Å; R602-E1059 PolarHBondContact NH1-OE2 2.91Å; R602-E1059 PolarHBondContact NH2-O 2.82Å; L1055-E1059 WeakPolarHBondContact O-CG 3.38Å
1060	D	48.4	Very low	39.2	Very low	39 Å²	39	96.1 Å²	96.1	21%	0.209	53%	0.527	C	S	.	.	T	Hydrogen-bonded Turn	trans	-125.6	0.9	-163.2	-142.5	73.5	0	0	0	115.7	H574 I575 R602 E1058	H574-D1060 IonicContact CD2-OD2 3.24Å; I575-D1060 HydrophobicContact CB-CB 4.4Å; I575-D1060 VanDerWaalsContact CB-OD2 3.3Å; I575-D1060 WeakPolarHBondContact CB-OD2 3.37Å; I575-D1060 HydrophobicContact CG2-CB 3.66Å; I575-D1060 WeakPolarHBondContact CG2-OD2 3.41Å; I575-D1060 PolarHBondContact N-OD2 2.77Å; R602-D1060 IonicContact CZ-OD1 3.85Å; R602-D1060 IonicContact NH2-OD1 2.64Å; R602-D1060 PolarHBondContact NH2-OD1 2.84Å; E1058-D1060 PolarHBondContact O-N 3.43Å
1061	S	44.2	Very low	38.9	Very low	101 Å²	101	96.2 Å²	96.2	71%	0.706	54%	0.535	S	S	*	.	S	Bend	trans	-95.4	17.6	-169.8	-64.8	0	0	0	0	116.9	H574	H574-S1061 PolarHBondContact NE2-OG 3.26Å
1062	A	41.5	Very low	39.1	Very low	71 Å²	71	100.2 Å²	100.2	59%	0.587	55%	0.552	S	S	*	*			trans	-142.8	19.3	-164.6	0	0	0	0	0	117.7
1063	D	36.7	Very low	38.6	Very low	73 Å²	73	105.9 Å²	105.9	39%	0.39	59%	0.586	S	S	.	*			trans	-108.8	22.9	-176.6	-85.8	-27.9	0	0	0	114.7	K646 K951	K646-D1063 HydrophobicContact CD-CB 3.84Å; K646-D1063 PolarHBondContact NZ-O 2.82Å; K951-D1063 WeakPolarHBondContact CE-OD1 3.39Å; K951-D1063 IonicContact NZ-OD1 3.91Å; K951-D1063 PolarHBondContact NZ-OD1 3.08Å; K951-D1063 IonicContact NZ-OD2 2.69Å; K951-D1063 PolarHBondContact NZ-OD2 3.36Å
1064	S	30.5	Very low	38.1	Very low	76 Å²	76	110.8 Å²	110.8	53%	0.531	61%	0.613	S	S	.	*			trans	-125	139.9	175.4	-156.4	0	0	0	0	111
1065	T	36.3	Very low	37.7	Very low	131 Å²	131	110.1 Å²	110.1	80%	0.804	62%	0.621	S	S	*	*			trans	61.4	142.5	-155.5	78.7	0	0	0	0	111.9
1066	T	33.9	Very low	37.2	Very low	118 Å²	118	114.9 Å²	114.9	72%	0.724	65%	0.645	S	S	*	*			cis	-141.3	133.2	6.1	-46.1	0	0	0	0	109
1067	D	33.4	Very low	36.5	Very low	115 Å²	115	119.1 Å²	119.1	62%	0.615	67%	0.674	S	S	*	*			trans	-150.4	85.4	164	-84.6	-41.6	0	0	0	105.9	R641	R641-D1067 IonicContact CZ-OD2 3.65Å; R641-D1067 IonicContact NH1-OD2 2.65Å; R641-D1067 PolarHBondContact NH1-OD2 3.38Å; R641-D1067 IonicContact NH2-OD2 3.65Å; R641-D1067 PolarHBondContact NH2-OD2 3.4Å
1068	S	37.3	Very low	36.1	Very low	106 Å²	106	124.5 Å²	124.5	74%	0.741	70%	0.697	S	S	*	*			trans	-156	65.4	-176.3	-59.8	0	0	0	0	109.6	L1070	S1068-L1070 PolarHBondContact O-N 3.11Å
1069	E	33.5	Very low	35.1	Very low	201 Å²	201	124.9 Å²	124.9	94%	0.939	70%	0.704	S	S	*	*			trans	-75.8	108.5	169.2	-66.5	-176.1	141.9	0	0	108.6
1070	L	36.4	Very low	34.2	Very low	170 Å²	170	128.8 Å²	128.8	89%	0.89	74%	0.736	S	S	*	*			trans	-134.1	114.1	163.1	-84.4	174.5	0	0	0	107.6	S1068 E1072	S1068-L1070 PolarHBondContact O-N 3.11Å; L1070-E1072 PolarHBondContact O-N 3.14Å
1071	D	28.1	Very low	33.3	Very low	164 Å²	164	132 Å²	132	88%	0.877	76%	0.762	S	S	*	*			trans	-72	119.8	173.2	-80.2	-51.7	0	0	0	110.4
1072	E	33.6	Very low	32.8	Very low	191 Å²	191	133.1 Å²	133.1	89%	0.893	77%	0.767	S	S	*	*			trans	-143.8	124.4	148.8	-147	170	-144.3	0	0	111.1	L1070	L1070-E1072 PolarHBondContact O-N 3.14Å
1073	T	28.5	Very low	32.1	Very low	128 Å²	128	136.8 Å²	136.8	79%	0.785	78%	0.775	S	S	*	*			trans	-108.7	111.9	-172.2	45.6	0	0	0	0	111.5
1074	T	30.5	Very low	31.6	Very low	139 Å²	139	139.6 Å²	139.6	85%	0.853	79%	0.79	S	S	*	*			trans	-144.2	137.6	159.5	27.4	0	0	0	0	111.5
1075	N	27.9	Very low	31.4	Very low	157 Å²	157	140.3 Å²	140.3	84%	0.84	80%	0.795	S	S	*	*			trans	-97.9	129.7	-178.7	-64	-79.7	0	0	0	111.1
1076	I	32.5	Very low	31	Very low	169 Å²	169	140.7 Å²	140.7	87%	0.867	79%	0.792	S	S	*	*			trans	-135.6	125.9	141.4	-61.2	-174.4	0	0	0	108.2
1077	S	29	Very low	30.6	Very low	94 Å²	94	145.2 Å²	145.2	66%	0.657	80%	0.795	S	S	*	*			trans	-118.6	126.3	-178.4	50.8	0	0	0	0	112.1
1078	Q	35.6	Very low	30.4	Very low	185 Å²	185	145.9 Å²	145.9	86%	0.864	80%	0.804	S	S	*	*			trans	-141.3	99	158.7	-63.5	-169.1	8	0	0	107.4
1079	N	28.5	Very low	30.1	Very low	147 Å²	147	144.3 Å²	144.3	79%	0.786	80%	0.804	S	S	*	*				56.3	92.8	79	-72.3	-18.7	0	0	0	114.6
1080	S	32.6	Very low	29.8	Very low	129 Å²	129	145.7 Å²	145.7	90%	0.902	80%	0.8	S	S	*	*				-170.3	150.3	117.7	36.4	0	0	0	0	111.5
1081	S	28.2	Very low	29.6	Very low	107 Å²	107	144.2 Å²	144.2	75%	0.748	79%	0.793	S	S	*	*			trans	-105.6	155.9	-173.6	46.2	0	0	0	0	112.4
1082	P	35.1	Very low	29.7	Very low	125 Å²	125	144.2 Å²	144.2	81%	0.812	79%	0.793	S	S	*	*			trans	-79.7	140.1	-174.4	32.1	-35.8	0	0	0	112.5
1083	I	25.5	Very low	29.8	Very low	148 Å²	148	140.2 Å²	140.2	76%	0.759	78%	0.783	S	S	*	*			trans	-158.2	145.2	172.9	-121.8	161.1	0	0	0	112.8
1084	N	27.1	Very low	30.1	Very low	132 Å²	132	139.1 Å²	139.1	71%	0.706	78%	0.781	S	S	*	*			trans	49.5	116.2	165.6	-65.6	-30.8	0	0	0	119.5
1085	S	26.2	Very low	29.9	Very low	91 Å²	91	139 Å²	139	64%	0.636	78%	0.78	S	S	*	*				74.1	123.5	54.1	88.5	0	0	0	0	114.8
1086	L	27.1	Very low	30.1	Very low	139 Å²	139	134.5 Å²	134.5	73%	0.728	77%	0.77	S	S	*	*			trans	-174.9	136.2	138	-119.1	64.7	0	0	0	110.7
1087	R	27.2	Very low	29.9	Very low	213 Å²	213	134.6 Å²	134.6	80%	0.804	77%	0.772	S	S	*	*				42.5	147.2	125	-67.5	-175.7	179.5	173.3	-2.3	121.1
1088	T	27.9	Very low	30	Very low	129 Å²	129	137.3 Å²	137.3	79%	0.791	78%	0.777	S	S	*	*			cis	-166.9	144	1	11.5	0	0	0	0	113.8
1089	G	30.9	Very low	29.7	Very low	72 Å²	72	136.7 Å²	136.7	74%	0.742	78%	0.779	S	S	*	*			trans	78.6	172.7	143.8	0	0	0	0	0	118.3
1090	R	27.9	Very low	29.7	Very low	230 Å²	230	133.6 Å²	133.6	87%	0.868	78%	0.782	S	S	*	*			cis	-165.2	153.7	-13.9	-134.6	-171.7	167.1	156	-3.1	111.9
1091	N	31.8	Very low	29.6	Very low	139 Å²	139	130.7 Å²	130.7	74%	0.743	77%	0.772	S	S	*	*			trans	84.5	136.9	152.6	-59.9	-16.1	0	0	0	122.8
1092	L	30.8	Very low	29.7	Very low	165 Å²	165	133.2 Å²	133.2	86%	0.864	78%	0.776	S	S	*	*			trans	-80.7	-170.9	158.2	-114.7	70.4	0	0	0	110.5
1093	P	34.4	Very low	29.6	Very low	107 Å²	107	136.8 Å²	136.8	70%	0.695	78%	0.779	S	S	*	*			cis	-119.3	-151.9	16.5	27.6	-1.2	0	0	0	112.1
1094	S	34.6	Very low	29.8	Very low	105 Å²	105	135.6 Å²	135.6	73%	0.734	78%	0.783	S	S	*	*			cis	-149.1	158.4	16.5	-75.4	0	0	0	0	109.5
1095	T	27.7	Very low	30	Very low	137 Å²	137	132 Å²	132	84%	0.84	78%	0.778	S	S	*	*			cis	101.9	113.6	36	-48.7	0	0	0	0	113.7
1096	G	32.6	Very low	30.5	Very low	61 Å²	61	135 Å²	135	63%	0.629	79%	0.786	S	S	*	*			trans	146.2	112.9	174.3	0	0	0	0	0	111
1097	L	27.4	Very low	30.6	Very low	171 Å²	171	134.8 Å²	134.8	90%	0.895	79%	0.786	S	S	*	*				64.8	129.4	69.9	-61.4	172.7	0	0	0	111.5
1098	I	32	Very low	31	Very low	151 Å²	151	133.4 Å²	133.4	77%	0.774	79%	0.789	S	S	*	*			cis	-149.3	124.7	32.9	-70.5	-179.1	0	0	0	108.4
1099	L	27.4	Very low	30.9	Very low	173 Å²	173	138.9 Å²	138.9	91%	0.906	80%	0.795	S	S	*	*				71.2	122.6	88.6	-160.4	77.5	0	0	0	118.3
1100	G	28.3	Very low	31	Very low	81 Å²	81	139 Å²	139	84%	0.835	80%	0.796	S	S	*	*			trans	91.8	143.5	159.4	0	0	0	0	0	117.1
1101	G	31.4	Very low	31.1	Very low	69 Å²	69	135.8 Å²	135.8	71%	0.711	80%	0.796	S	S	*	*			cis	-174.3	139.5	-8.9	0	0	0	0	0	114.9
1102	I	30.3	Very low	31.4	Very low	159 Å²	159	133.6 Å²	133.6	82%	0.815	79%	0.79	S	S	*	*				41.5	113	128.3	-49.3	171	0	0	0	120.3
1103	K	33.5	Very low	31.2	Very low	201 Å²	201	134.3 Å²	134.3	87%	0.874	79%	0.789	S	S	*	*			trans	171.8	128.5	132.2	-94.8	164.4	-176	-177.1	0	108.3
1104	S	29.2	Very low	30.9	Very low	123 Å²	123	135.3 Å²	135.3	86%	0.86	79%	0.788	S	S	*	*			cis	87.9	128	19	-157.2	0	0	0	0	115.8
1105	G	32	Very low	30.6	Very low	57 Å²	57	134.7 Å²	134.7	59%	0.588	78%	0.777	S	S	*	*			trans	104.7	140.4	-180	0	0	0	0	0	113.4
1106	D	35.5	Very low	30.6	Very low	152 Å²	152	138 Å²	138	81%	0.813	77%	0.773	S	S	*	*			cis	-158.4	-171.6	-6.1	-113	-57.8	0	0	0	113.1
1107	N	30	Very low	30.5	Very low	136 Å²	136	138.8 Å²	138.8	73%	0.727	77%	0.77	S	S	*	*			trans	-68.5	176.6	-177.1	-60.1	-88.6	0	0	0	112.8
1108	E	34.8	Very low	30.6	Very low	184 Å²	184	139.1 Å²	139.1	86%	0.86	76%	0.764	S	S	*	*			cis	-146.2	165.6	37.5	-55.5	179.2	108.3	0	0	110.5
1109	R	26.7	Very low	30.6	Very low	244 Å²	244	137.4 Å²	137.4	92%	0.921	76%	0.756	S	S	*	*			cis	76.2	116.3	34.2	-93	-168.3	-174.8	-117.9	2.3	116.8
1110	G	32.9	Very low	30.7	Very low	75 Å²	75	139.3 Å²	139.3	77%	0.773	75%	0.752	S	S	*	*			trans	143.5	77.6	179	0	0	0	0	0	111.2
1111	N	30.1	Very low	30.8	Very low	162 Å²	162	142 Å²	142	87%	0.866	75%	0.746	S	S	*	*				82.4	139.1	79.4	-151	70	0	0	0	113
1112	P	37.2	Very low	30.8	Very low	93 Å²	93	143.4 Å²	143.4	60%	0.604	75%	0.745	S	S	*	*			trans	-109.2	-173.2	-155.5	43.7	-37.2	0	0	0	114.9
1113	E	27.1	Very low	30.9	Very low	180 Å²	180	142 Å²	142	84%	0.841	75%	0.746	S	S	*	*			trans	70.9	148.9	171.2	-63.1	167.3	-175.3	0	0	112.9
1114	D	28.3	Very low	30.7	Very low	128 Å²	128	138.8 Å²	138.8	68%	0.684	74%	0.743	S	S	*	*			cis	-163.4	164.6	35.1	-167.7	11.4	0	0	0	113.6
1115	N	28	Very low	30.8	Very low	92 Å²	92	136.8 Å²	136.8	49%	0.492	73%	0.729	S	S	.	*			trans	57	132.3	146.1	-93.8	-50.5	0	0	0	124.3
1116	R	28.8	Very low	30.9	Very low	205 Å²	205	136.5 Å²	136.5	77%	0.774	72%	0.717	S	S	*	*			trans	79.9	149.3	132.4	-76.9	165.4	-149.3	-166.2	11.2	121.4
1117	S	29.7	Very low	30.7	Very low	78 Å²	78	135.5 Å²	135.5	55%	0.545	71%	0.712	S	S	.	*			cis	-178.2	178.2	-22.3	45	0	0	0	0	111.7
1118	F	28.7	Very low	30.8	Very low	178 Å²	178	135.6 Å²	135.6	78%	0.781	70%	0.702	S	S	*	*			trans	70.6	145.8	172.9	-63	-94.1	0	0	0	116.3
1119	N	32.1	Very low	30.7	Very low	115 Å²	115	132.9 Å²	132.9	62%	0.615	70%	0.7	S	S	*	*			cis	-162.6	151.5	-24.4	-114.4	13.5	0	0	0	105.5
1120	R	30.1	Very low	30.7	Very low	213 Å²	213	127 Å²	127	80%	0.804	69%	0.691	S	S	*	*				176	121.1	68	-177	175.1	-70.7	-107.2	3.3	109.5
1121	L	30.1	Very low	30.4	Very low	139 Å²	139	130 Å²	130	73%	0.728	69%	0.689	S	S	*	*				27.9	138.4	125.7	-60	144.1	0	0	0	118.9
1122	S	31	Very low	30.3	Very low	98 Å²	98	129.7 Å²	129.7	69%	0.685	69%	0.687	S	S	*	*			cis	-174.6	-178.2	0.7	-70.9	0	0	0	0	108.6
1123	P	33.5	Very low	29.9	Very low	128 Å²	128	132.4 Å²	132.4	83%	0.831	69%	0.692	S	S	*	*			cis	-122.2	-150.6	-13.1	39.6	-20.2	0	0	0	113
1124	V	28.9	Very low	30	Very low	134 Å²	134	129.4 Å²	129.4	81%	0.812	69%	0.688	S	S	*	*			trans	-145.8	143.3	-160	178.5	0	0	0	0	115
1125	S	32.2	Very low	30.1	Very low	81 Å²	81	129.6 Å²	129.6	57%	0.566	69%	0.693	S	S	*	*			trans	140.3	151.9	142.1	-64.4	0	0	0	0	114.4
1126	P	32.4	Very low	30.2	Very low	51 Å²	51	130.8 Å²	130.8	33%	0.331	70%	0.699	S	S	.	*			cis	-139.3	133.6	-40.8	37.8	-19.9	0	0	0	114.7	L199 D201	L199-P1126 HydrophobicContact CB-CG 4.15Å; L199-P1126 VanDerWaalsContact O-CG 3.29Å; L199-P1126 WeakPolarHBondContact O-CG 3.42Å; D201-P1126 WeakPolarHBondContact CB-O 3.42Å; D201-P1126 PolarHBondContact N-O 2.78Å
1127	N	31.5	Very low	30.4	Very low	132 Å²	132	126.4 Å²	126.4	71%	0.706	70%	0.697	S	S	*	*			trans	-74.6	135.3	-168.3	-87.4	-104.9	0	0	0	117.7	D201	D201-N1127 CarbonylContact O-C 3.55Å
1128	R	32.8	Very low	31	Very low	138 Å²	138	126 Å²	126	52%	0.521	69%	0.694	S	S	.	*				43.6	130	121.1	-152.5	172.5	-171.7	151.6	11	119.6	D201 N203 L204 V1130	D201-R1128 PolarHBondContact O-N 3.31Å; N203-R1128 VanDerWaalsContact O-CZ 3.22Å; N203-R1128 PolarHBondContact O-NH1 3.22Å; N203-R1128 PolarHBondContact O-NH2 3.09Å; L204-R1128 PolarHBondContact O-NH2 3.22Å; R1128-V1130 PolarHBondContact O-N 3.48Å
1129	P	32.1	Very low	31.7	Very low	127 Å²	127	127.3 Å²	127.3	83%	0.825	69%	0.694	S	S	*	*			trans	-65.2	132.3	-173.7	26.2	-35.5	0	0	0	114.2
1130	V	26.8	Very low	32.5	Very low	120 Å²	120	129.8 Å²	129.8	73%	0.727	69%	0.694	S	S	*	*			trans	-71	133.2	177.8	178.2	0	0	0	0	110.7	R1128 L1132	R1128-V1130 PolarHBondContact O-N 3.48Å; V1130-L1132 WeakPolarHBondContact O-CD1 3.24Å; V1130-L1132 PolarHBondContact O-N 3.35Å
1131	N	27.2	Very low	33.2	Very low	138 Å²	138	128.4 Å²	128.4	74%	0.738	69%	0.689	S	S	*	*			trans	-75.3	106.2	174.7	-169	-33.1	0	0	0	110	Q1133	N1131-Q1133 VanDerWaalsContact C-N 3.29Å; N1131-Q1133 PolarHBondContact O-N 2.85Å
1132	L	28.6	Very low	34.3	Very low	155 Å²	155	126.5 Å²	126.5	81%	0.812	68%	0.679	S	S	*	*			trans	-70.7	78.9	-178	-92	79.3	0	0	0	112.4	V1130	V1130-L1132 WeakPolarHBondContact O-CD1 3.24Å; V1130-L1132 PolarHBondContact O-N 3.35Å
1133	Q	27.8	Very low	35.7	Very low	151 Å²	151	126.7 Å²	126.7	71%	0.706	67%	0.671	S	S	*	*			trans	-67.7	130.5	154.9	-62.2	-174.5	12.1	0	0	109	N1131 V1135	N1131-Q1133 VanDerWaalsContact C-N 3.29Å; N1131-Q1133 PolarHBondContact O-N 2.85Å; Q1133-V1135 VanDerWaalsContact C-N 3.32Å; Q1133-V1135 PolarHBondContact O-N 3.29Å
1134	P	30.2	Very low	36.9	Very low	117 Å²	117	128.5 Å²	128.5	76%	0.76	66%	0.662	S	S	*	*			trans	-71.3	88.7	173	28.6	-33.5	0	0	0	110	L1136	P1134-L1136 PolarHBondContact O-N 3.05Å
1135	V	29.3	Very low	38.6	Very low	131 Å²	131	126.5 Å²	126.5	79%	0.794	65%	0.645	S	S	*	*			trans	-57.5	119.9	175.4	177.9	0	0	0	0	109	Q1133 P1137	Q1133-V1135 VanDerWaalsContact C-N 3.32Å; Q1133-V1135 PolarHBondContact O-N 3.29Å; V1135-P1137 VanDerWaalsContact O-CD 3.3Å; V1135-P1137 WeakPolarHBondContact O-CD 3.37Å
1136	L	31.3	Very low	39.8	Very low	117 Å²	117	126.4 Å²	126.4	61%	0.613	64%	0.641	S	S	*	*			trans	-88.5	124.4	-178.8	-75	117.7	0	0	0	113	P1134	P1134-L1136 PolarHBondContact O-N 3.05Å
1137	P	31.8	Very low	40.9	Very low	114 Å²	114	127.7 Å²	127.7	74%	0.74	65%	0.645	S	S	*	*			trans	-130.3	82.5	162.5	37.3	-19.4	0	0	0	112.4	V1135	V1135-P1137 VanDerWaalsContact O-CD 3.3Å; V1135-P1137 WeakPolarHBondContact O-CD 3.37Å
1138	S	41.9	Very low	42.8	Very low	69 Å²	69	130.6 Å²	130.6	48%	0.483	65%	0.646	S	S	.	*	S	Bend	trans	-172	-59.5	147.8	-179.3	0	0	0	0	112.8	R1140 R1141 I1142	S1138-R1140 VanDerWaalsContact C-N 3.26Å; S1138-R1140 PolarHBondContact O-N 3.32Å; S1138-R1141 WeakPolarHBondContact O-CA 3.35Å; S1138-R1141 WeakPolarHBondContact O-CB 3.38Å; S1138-R1141 PolarHBondContact O-N 2.91Å; S1138-I1142 PolarHBondContact O-N 3.16Å
1139	R	45.2	Very low	44.2	Very low	206 Å²	206	128.2 Å²	128.2	78%	0.777	64%	0.643	S	S	*	*	H	α-helix	trans	-54	-36.4	-171.5	-78.5	-169.6	173.7	-157.4	-1.2	114.3	R1141 I1142 I1143	R1139-R1141 VanDerWaalsContact C-N 3.34Å; R1139-R1141 PolarHBondContact O-N 2.8Å; R1139-I1142 PolarHBondContact O-N 3.08Å; R1139-I1143 WeakPolarHBondContact O-CG1 3.46Å; R1139-I1143 PolarHBondContact O-N 3.05Å
1140	R	48.9	Very low	45.5	Very low	166 Å²	166	124.2 Å²	124.2	63%	0.626	62%	0.616	S	S	*	*	H	α-helix	trans	-67.7	-24.1	175	-68.8	-175.1	-179.8	175.8	0.7	114.1	S1138 R1144	S1138-R1140 VanDerWaalsContact C-N 3.26Å; S1138-R1140 PolarHBondContact O-N 3.32Å; R1140-R1144 WeakPolarHBondContact O-CD 3.22Å; R1140-R1144 VanDerWaalsContact O-CG 3.26Å; R1140-R1144 WeakPolarHBondContact O-CG 3.17Å; R1140-R1144 PolarHBondContact O-N 3.46Å
1141	R	44.7	Very low	46.9	Very low	185 Å²	185	124 Å²	124	70%	0.698	61%	0.605	S	S	*	*	H	α-helix	trans	-73.6	-44.4	172.4	-73.9	-172.6	179.4	177.3	1	111.2	S1138 R1139 I1143 R1144 I1145	S1138-R1141 WeakPolarHBondContact O-CA 3.35Å; S1138-R1141 WeakPolarHBondContact O-CB 3.38Å; S1138-R1141 PolarHBondContact O-N 2.91Å; R1139-R1141 VanDerWaalsContact C-N 3.34Å; R1139-R1141 PolarHBondContact O-N 2.8Å; R1141-I1143 PolarHBondContact O-N 3.48Å; R1141-R1144 PolarHBondContact O-N 3.11Å; R1141-I1145 WeakPolarHBondContact O-CG1 3.33Å; R1141-I1145 PolarHBondContact O-N 3.5Å
1142	I	53.5	Low	49	Very low	98 Å²	98	119.4 Å²	119.4	50%	0.503	58%	0.584	S	S	.	*	H	α-helix	trans	-62.1	-44.6	-179.6	-57.4	175.4	0	0	0	110.6	S1138 R1139 R1144 I1145 V1146	S1138-I1142 PolarHBondContact O-N 3.16Å; R1139-I1142 PolarHBondContact O-N 3.08Å; I1142-R1144 PolarHBondContact O-N 2.9Å; I1142-I1145 WeakPolarHBondContact O-CB 3.43Å; I1142-I1145 PolarHBondContact O-N 3.2Å; I1142-I1145 VanDerWaalsContact O-N 3.09Å; I1142-V1146 WeakPolarHBondContact O-CG2 3.24Å; I1142-V1146 PolarHBondContact O-N 3.37Å
1143	I	58.3	Low	50.6	Low	103 Å²	103	115.3 Å²	115.3	53%	0.528	57%	0.568	S	S	.	*	H	α-helix	trans	-58.1	-48.8	175	-64.9	166.6	0	0	0	110.8	R1139 R1141 I1145 V1146 D1147	R1139-I1143 WeakPolarHBondContact O-CG1 3.46Å; R1139-I1143 PolarHBondContact O-N 3.05Å; R1141-I1143 PolarHBondContact O-N 3.48Å; I1143-I1145 PolarHBondContact O-N 3.46Å; I1143-V1146 PolarHBondContact O-N 2.8Å; I1143-V1146 VanDerWaalsContact O-N 3.14Å; I1143-D1147 PolarHBondContact O-N 2.91Å
1144	R	59.7	Low	52.2	Low	166 Å²	166	117.3 Å²	117.3	63%	0.626	57%	0.571	S	S	*	*	H	α-helix	trans	-60	-28.4	175.6	-72.6	173	-174.4	174.1	1.1	113.9	R1140 R1141 I1142 R1148	R1140-R1144 WeakPolarHBondContact O-CD 3.22Å; R1140-R1144 VanDerWaalsContact O-CG 3.26Å; R1140-R1144 WeakPolarHBondContact O-CG 3.17Å; R1140-R1144 PolarHBondContact O-N 3.46Å; R1141-R1144 PolarHBondContact O-N 3.11Å; I1142-R1144 PolarHBondContact O-N 2.9Å; R1144-R1148 VanDerWaalsContact O-CB 3.24Å; R1144-R1148 WeakPolarHBondContact O-CB 3.26Å; R1144-R1148 PolarHBondContact O-N 2.71Å
1145	I	64.8	Low	53.5	Low	92 Å²	92	116.1 Å²	116.1	47%	0.472	55%	0.554	S	S	.	*	H	α-helix	trans	-75.7	-44.1	175.9	-69.9	163.2	0	0	0	110	R1141 I1142 I1143 D1147 R1148 I1149	R1141-I1145 WeakPolarHBondContact O-CG1 3.33Å; R1141-I1145 PolarHBondContact O-N 3.5Å; I1142-I1145 WeakPolarHBondContact O-CB 3.43Å; I1142-I1145 PolarHBondContact O-N 3.2Å; I1142-I1145 VanDerWaalsContact O-N 3.09Å; I1143-I1145 PolarHBondContact O-N 3.46Å; I1145-D1147 PolarHBondContact O-N 3.1Å; I1145-R1148 PolarHBondContact O-N 2.93Å; I1145-R1148 VanDerWaalsContact O-N 3.16Å; I1145-I1149 HydrophobicContact CG2-CD1 3.8Å; I1145-I1149 VanDerWaalsContact O-CG1 3.29Å; I1145-I1149 WeakPolarHBondContact O-CG1 3.27Å; I1145-I1149 PolarHBondContact O-N 3Å
1146	V	58.1	Low	55	Low	79 Å²	79	114.4 Å²	114.4	48%	0.479	54%	0.537	S	S	.	.	H	α-helix	trans	-62.6	-41.2	173.7	175.3	0	0	0	0	111.3	I1142 I1143 R1148 I1149 T1150	I1142-V1146 WeakPolarHBondContact O-CG2 3.24Å; I1142-V1146 PolarHBondContact O-N 3.37Å; I1143-V1146 PolarHBondContact O-N 2.8Å; I1143-V1146 VanDerWaalsContact O-N 3.14Å; V1146-R1148 PolarHBondContact O-N 3.28Å; V1146-I1149 PolarHBondContact O-N 2.69Å; V1146-T1150 HydrophobicContact CG1-CG2 4.39Å; V1146-T1150 WeakPolarHBondContact O-CB 3.41Å; V1146-T1150 WeakPolarHBondContact O-CG2 3.22Å; V1146-T1150 PolarHBondContact O-N 3.28Å; V1146-T1150 PolarHBondContact O-OG1 3.11Å
1147	D	54.8	Low	56.4	Low	77 Å²	77	117.1 Å²	117.1	41%	0.412	54%	0.539	S	S	.	.	H	α-helix	trans	-61.5	-41.3	171.8	-74.8	-37.1	0	0	0	111.8	I1143 I1145 T1150 K1151	I1143-D1147 PolarHBondContact O-N 2.91Å; I1145-D1147 PolarHBondContact O-N 3.1Å; D1147-T1150 WeakPolarHBondContact CA-OG1 3.2Å; D1147-T1150 PolarHBondContact O-OG1 3.11Å; D1147-K1151 WeakPolarHBondContact O-CB 3.04Å; D1147-K1151 VanDerWaalsContact O-CG 3.23Å; D1147-K1151 WeakPolarHBondContact O-CG 3.37Å; D1147-K1151 PolarHBondContact O-N 2.88Å
1148	R	70.7	Confident	57.8	Low	193 Å²	193	113.7 Å²	113.7	73%	0.728	52%	0.521	S	S	*	.	H	α-helix	trans	-68.4	-36.8	178.4	-170.4	-179.2	-64.6	-177.3	-4	112.3	R1144 I1145 V1146 S1152	R1144-R1148 VanDerWaalsContact O-CB 3.24Å; R1144-R1148 WeakPolarHBondContact O-CB 3.26Å; R1144-R1148 PolarHBondContact O-N 2.71Å; I1145-R1148 PolarHBondContact O-N 2.93Å; I1145-R1148 VanDerWaalsContact O-N 3.16Å; V1146-R1148 PolarHBondContact O-N 3.28Å; R1148-S1152 PolarHBondContact O-N 2.99Å
1149	I	61.7	Low	58.7	Low	89 Å²	89	112 Å²	112	46%	0.456	51%	0.507	S	S	.	.	H	α-helix	trans	-68.8	-49.2	175.4	-69.2	165	0	0	0	110.1	I1145 V1146 K1151 S1152 F1155	I1145-I1149 HydrophobicContact CG2-CD1 3.8Å; I1145-I1149 VanDerWaalsContact O-CG1 3.29Å; I1145-I1149 WeakPolarHBondContact O-CG1 3.27Å; I1145-I1149 PolarHBondContact O-N 3Å; V1146-I1149 PolarHBondContact O-N 2.69Å; I1149-K1151 VanDerWaalsContact C-N 3.31Å; I1149-K1151 PolarHBondContact O-N 3.41Å; I1149-S1152 VanDerWaalsContact O-CB 3.29Å; I1149-S1152 WeakPolarHBondContact O-CB 3.42Å; I1149-S1152 PolarHBondContact O-N 2.96Å; I1149-S1152 PolarHBondContact O-OG 2.82Å; I1149-F1155 HydrophobicContact CG2-CD2 3.85Å; I1149-F1155 HydrophobicContact CG2-CE2 4.3Å; I1149-F1155 HydrophobicContact CG2-CG 4.47Å; I1149-F1155 WeakPolarHBondContact O-CB 3.42Å
1150	T	59.4	Low	59.4	Low	42 Å²	42	106.6 Å²	106.6	26%	0.258	49%	0.493	S	S	.	.	H	α-helix	trans	-71.2	-21.2	-179.8	56.5	0	0	0	0	114	V1146 D1147 S1152 F1155	V1146-T1150 HydrophobicContact CG1-CG2 4.39Å; V1146-T1150 WeakPolarHBondContact O-CB 3.41Å; V1146-T1150 WeakPolarHBondContact O-CG2 3.22Å; V1146-T1150 PolarHBondContact O-N 3.28Å; V1146-T1150 PolarHBondContact O-OG1 3.11Å; D1147-T1150 WeakPolarHBondContact CA-OG1 3.2Å; D1147-T1150 PolarHBondContact O-OG1 3.11Å; T1150-S1152 VanDerWaalsContact C-N 3.35Å; T1150-F1155 HydrophobicContact CG2-CD1 4.23Å; T1150-F1155 HydrophobicContact CG2-CE1 3.92Å; T1150-F1155 HydrophobicContact CG2-CZ 4.25Å
1151	K	57.6	Low	60.6	Low	116 Å²	116	101.8 Å²	101.8	50%	0.504	48%	0.483	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-7.3	167.1	-74.6	-173.8	179.6	-158.1	0	114	Y1025 D1147 I1149	Y1025-K1151 PolarHBondContact OH-NZ 2.9Å; D1147-K1151 WeakPolarHBondContact O-CB 3.04Å; D1147-K1151 VanDerWaalsContact O-CG 3.23Å; D1147-K1151 WeakPolarHBondContact O-CG 3.37Å; D1147-K1151 PolarHBondContact O-N 2.88Å; I1149-K1151 VanDerWaalsContact C-N 3.31Å; I1149-K1151 PolarHBondContact O-N 3.41Å
1152	S	71	Confident	61.8	Low	42 Å²	42	100.7 Å²	100.7	29%	0.294	48%	0.483	S	S	.	.	S	Bend	trans	-72.9	135.7	178.8	75.3	0	0	0	0	111.4	R1148 I1149 T1150 Y1154 F1155 Q1156	R1148-S1152 PolarHBondContact O-N 2.99Å; I1149-S1152 VanDerWaalsContact O-CB 3.29Å; I1149-S1152 WeakPolarHBondContact O-CB 3.42Å; I1149-S1152 PolarHBondContact O-N 2.96Å; I1149-S1152 PolarHBondContact O-OG 2.82Å; T1150-S1152 VanDerWaalsContact C-N 3.35Å; S1152-Y1154 PolarHBondContact O-N 2.89Å; S1152-F1155 PolarHBondContact O-N 2.79Å; S1152-F1155 VanDerWaalsContact OG-CB 3.3Å; S1152-F1155 WeakPolarHBondContact OG-CB 3.3Å; S1152-F1155 PolarHBondContact OG-N 3.22Å; S1152-F1155 VanDerWaalsContact OG-N 3.15Å; S1152-Q1156 PolarHBondContact O-N 2.72Å; S1152-Q1156 VanDerWaalsContact O-N 3.11Å
1153	S	61.4	Low	62.6	Low	68 Å²	68	102.3 Å²	102.3	48%	0.476	49%	0.492	S	S	.	.	H	α-helix	trans	-60.6	-26.5	177.2	-174.4	0	0	0	0	112.3	R1157	S1153-R1157 WeakPolarHBondContact O-CB 3.13Å; S1153-R1157 WeakPolarHBondContact O-CG 3.22Å; S1153-R1157 PolarHBondContact O-N 3.32Å
1154	Y	61.2	Low	63	Low	194 Å²	194	100.3 Å²	100.3	76%	0.761	48%	0.484	S	S	*	.	H	α-helix	trans	-66.7	-42.8	170.7	-77.6	-77.3	0	0	0	113	S1152 R1157 A1158	S1152-Y1154 PolarHBondContact O-N 2.89Å; Y1154-R1157 PolarHBondContact O-N 2.96Å; Y1154-A1158 VanDerWaalsContact O-CB 3.25Å; Y1154-A1158 WeakPolarHBondContact O-CB 3.22Å; Y1154-A1158 PolarHBondContact O-N 3.25Å
1155	F	57.5	Low	63.3	Low	92 Å²	92	95.7 Å²	95.7	40%	0.404	47%	0.47	S	S	.	.	H	α-helix	trans	-67.7	-37.1	176.7	-166.6	-87.7	0	0	0	111.7	I1149 T1150 S1152 A1158 V1159	I1149-F1155 HydrophobicContact CG2-CD2 3.85Å; I1149-F1155 HydrophobicContact CG2-CE2 4.3Å; I1149-F1155 HydrophobicContact CG2-CG 4.47Å; I1149-F1155 WeakPolarHBondContact O-CB 3.42Å; T1150-F1155 HydrophobicContact CG2-CD1 4.23Å; T1150-F1155 HydrophobicContact CG2-CE1 3.92Å; T1150-F1155 HydrophobicContact CG2-CZ 4.25Å; S1152-F1155 PolarHBondContact O-N 2.79Å; S1152-F1155 VanDerWaalsContact OG-CB 3.3Å; S1152-F1155 WeakPolarHBondContact OG-CB 3.3Å; S1152-F1155 PolarHBondContact OG-N 3.22Å; S1152-F1155 VanDerWaalsContact OG-N 3.15Å; F1155-A1158 PolarHBondContact O-N 3.44Å; F1155-V1159 HydrophobicContact CD1-CG2 4.11Å; F1155-V1159 HydrophobicContact CE1-CG2 3.85Å; F1155-V1159 WeakPolarHBondContact O-CG2 3.39Å; F1155-V1159 PolarHBondContact O-N 3.44Å
1156	Q	61.7	Low	63.5	Low	95 Å²	95	98.3 Å²	98.3	44%	0.444	47%	0.474	S	S	.	.	H	α-helix	trans	-62	-53.1	173.4	-66.8	174.1	-14.6	0	0	111.1	S1152 A1158 V1159 D1160	S1152-Q1156 PolarHBondContact O-N 2.72Å; S1152-Q1156 VanDerWaalsContact O-N 3.11Å; Q1156-A1158 PolarHBondContact O-N 2.96Å; Q1156-V1159 PolarHBondContact O-N 3.03Å; Q1156-V1159 VanDerWaalsContact O-N 3.1Å; Q1156-D1160 VanDerWaalsContact O-CG 3.25Å; Q1156-D1160 PolarHBondContact O-N 3.35Å
1157	R	61.2	Low	63.9	Low	174 Å²	174	95.9 Å²	95.9	66%	0.657	47%	0.465	S	S	*	.	H	α-helix	trans	-60.4	-30.3	174.6	-75.8	175	164.8	172.8	-3.9	113.7	S1153 Y1154 T1161	S1153-R1157 WeakPolarHBondContact O-CB 3.13Å; S1153-R1157 WeakPolarHBondContact O-CG 3.22Å; S1153-R1157 PolarHBondContact O-N 3.32Å; Y1154-R1157 PolarHBondContact O-N 2.96Å; R1157-T1161 PolarHBondContact O-N 2.71Å; R1157-T1161 PolarHBondContact O-OG1 2.92Å
1158	A	60.5	Low	64.3	Low	42 Å²	42	94.3 Å²	94.3	35%	0.347	46%	0.456	S	S	.	.	H	α-helix	trans	-68	-46.2	173.2	0	0	0	0	0	111.2	Y1154 F1155 Q1156 D1160 T1161 V1164	Y1154-A1158 VanDerWaalsContact O-CB 3.25Å; Y1154-A1158 WeakPolarHBondContact O-CB 3.22Å; Y1154-A1158 PolarHBondContact O-N 3.25Å; F1155-A1158 PolarHBondContact O-N 3.44Å; Q1156-A1158 PolarHBondContact O-N 2.96Å; A1158-D1160 VanDerWaalsContact C-N 3.29Å; A1158-D1160 PolarHBondContact O-N 3.47Å; A1158-T1161 VanDerWaalsContact O-CB 3.23Å; A1158-T1161 WeakPolarHBondContact O-CB 3.27Å; A1158-T1161 PolarHBondContact O-N 3.36Å; A1158-T1161 VanDerWaalsContact O-N 3.11Å; A1158-T1161 PolarHBondContact O-OG1 2.88Å; A1158-V1164 WeakPolarHBondContact O-CB 3.41Å; A1158-V1164 WeakPolarHBondContact O-CG2 3.34Å
1159	V	61.1	Low	64.1	Low	32 Å²	32	88.6 Å²	88.6	19%	0.194	44%	0.437	C	S	.	.	H	α-helix	trans	-59.6	-40.6	174.2	170.5	0	0	0	0	111.6	F1155 Q1156 T1161	F1155-V1159 HydrophobicContact CD1-CG2 4.11Å; F1155-V1159 HydrophobicContact CE1-CG2 3.85Å; F1155-V1159 WeakPolarHBondContact O-CG2 3.39Å; F1155-V1159 PolarHBondContact O-N 3.44Å; Q1156-V1159 PolarHBondContact O-N 3.03Å; Q1156-V1159 VanDerWaalsContact O-N 3.1Å; V1159-T1161 PolarHBondContact O-N 3.36Å
1160	D	60.5	Low	64.1	Low	93 Å²	93	93.7 Å²	93.7	50%	0.497	45%	0.451	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-1.2	179.4	-55	-28.9	0	0	0	113.2	R1018 Q1156 A1158	R1018-D1160 IonicContact NH1-OD1 3.57Å; R1018-D1160 IonicContact NH2-OD1 3.75Å; Q1156-D1160 VanDerWaalsContact O-CG 3.25Å; Q1156-D1160 PolarHBondContact O-N 3.35Å; A1158-D1160 VanDerWaalsContact C-N 3.29Å; A1158-D1160 PolarHBondContact O-N 3.47Å
1161	T	72.4	Confident	64.3	Low	66 Å²	66	95.2 Å²	95.2	41%	0.405	46%	0.457	S	S	.	.	S	Bend	trans	-75.2	129.1	175.9	-65.1	0	0	0	0	110.5	R1157 A1158 V1159 L1163 V1164 Q1165	R1157-T1161 PolarHBondContact O-N 2.71Å; R1157-T1161 PolarHBondContact O-OG1 2.92Å; A1158-T1161 VanDerWaalsContact O-CB 3.23Å; A1158-T1161 WeakPolarHBondContact O-CB 3.27Å; A1158-T1161 PolarHBondContact O-N 3.36Å; A1158-T1161 VanDerWaalsContact O-N 3.11Å; A1158-T1161 PolarHBondContact O-OG1 2.88Å; V1159-T1161 PolarHBondContact O-N 3.36Å; T1161-L1163 HydrophobicContact CG2-CB 4.4Å; T1161-L1163 PolarHBondContact O-N 3.29Å; T1161-V1164 CarbonylContact O-C 3.4Å; T1161-V1164 WeakPolarHBondContact O-CA 3.16Å; T1161-V1164 PolarHBondContact O-N 3.39Å; T1161-Q1165 PolarHBondContact O-N 3.34Å
1162	K	70.9	Confident	64.6	Low	161 Å²	161	89.9 Å²	89.9	70%	0.7	43%	0.434	S	S	*	.	H	α-helix	trans	-51.6	-25.6	-176.2	-67	-176.1	179	179.8	0	115.7	R1166	K1162-R1166 WeakPolarHBondContact O-CB 3.4Å; K1162-R1166 WeakPolarHBondContact O-CD 3.38Å; K1162-R1166 WeakPolarHBondContact O-CG 3.33Å; K1162-R1166 PolarHBondContact O-N 2.99Å; K1162-R1166 VanDerWaalsContact O-N 3.12Å
1163	L	70.3	Confident	64.5	Low	133 Å²	133	93.2 Å²	93.2	70%	0.696	45%	0.449	S	S	*	.	H	α-helix	trans	-75.1	-40.2	173.6	-65.8	176.2	0	0	0	112.5	T1161 G1167	T1161-L1163 HydrophobicContact CG2-CB 4.4Å; T1161-L1163 PolarHBondContact O-N 3.29Å; L1163-G1167 PolarHBondContact O-N 2.9Å
1164	V	66.4	Low	65.2	Low	60 Å²	60	91.5 Å²	91.5	36%	0.364	44%	0.435	S	S	.	.	H	α-helix	trans	-74.9	-35.9	175.4	-178	0	0	0	0	110.6	A1158 T1161 G1167 M1168	A1158-V1164 WeakPolarHBondContact O-CB 3.41Å; A1158-V1164 WeakPolarHBondContact O-CG2 3.34Å; T1161-V1164 CarbonylContact O-C 3.4Å; T1161-V1164 WeakPolarHBondContact O-CA 3.16Å; T1161-V1164 PolarHBondContact O-N 3.39Å; V1164-G1167 CarbonylContact O-C 3.51Å; V1164-G1167 PolarHBondContact O-N 2.94Å; V1164-M1168 WeakPolarHBondContact O-CB 3.37Å; V1164-M1168 PolarHBondContact O-N 3.42Å
1165	Q	67.1	Low	66	Low	69 Å²	69	86 Å²	86	32%	0.322	42%	0.424	S	S	.	.	H	α-helix	trans	-57.2	-52.1	168.8	-170.1	-169.6	-24.4	0	0	110.8	M1011 T1161 G1167 M1168 E1169	M1011-Q1165 HydrophobicContact CE-CG 4.27Å; T1161-Q1165 PolarHBondContact O-N 3.34Å; Q1165-G1167 VanDerWaalsContact C-N 3.26Å; Q1165-G1167 PolarHBondContact O-N 2.91Å; Q1165-M1168 CarbonylContact O-C 3.53Å; Q1165-M1168 WeakPolarHBondContact O-CB 3.36Å; Q1165-M1168 PolarHBondContact O-N 3.11Å; Q1165-M1168 VanDerWaalsContact O-N 3.08Å; Q1165-E1169 HydrophobicContact CG-CG 4.47Å; Q1165-E1169 WeakPolarHBondContact CG-OE1 3.4Å; Q1165-E1169 PolarHBondContact NE2-OE1 3.23Å; Q1165-E1169 WeakPolarHBondContact O-CB 3.42Å; Q1165-E1169 VanDerWaalsContact O-CG 3.28Å; Q1165-E1169 WeakPolarHBondContact O-CG 3.5Å; Q1165-E1169 PolarHBondContact O-N 3.08Å
1166	R	67.9	Low	67.1	Low	147 Å²	147	83.5 Å²	83.5	56%	0.555	41%	0.414	S	S	*	.	H	α-helix	trans	-60.7	-31.8	174.4	-75.6	170.5	175.2	178.8	-3	113.6	K1162 E1169 R1170	K1162-R1166 WeakPolarHBondContact O-CB 3.4Å; K1162-R1166 WeakPolarHBondContact O-CD 3.38Å; K1162-R1166 WeakPolarHBondContact O-CG 3.33Å; K1162-R1166 PolarHBondContact O-N 2.99Å; K1162-R1166 VanDerWaalsContact O-N 3.12Å; R1166-E1169 WeakPolarHBondContact CA-OE2 3.35Å; R1166-R1170 WeakPolarHBondContact O-CB 3.16Å; R1166-R1170 WeakPolarHBondContact O-CD 3.26Å; R1166-R1170 WeakPolarHBondContact O-CG 3.4Å; R1166-R1170 PolarHBondContact O-N 3.11Å; R1166-R1170 VanDerWaalsContact O-N 3.15Å
1167	G	67	Low	68.3	Low	28 Å²	28	81.8 Å²	81.8	29%	0.289	41%	0.407	S	S	.	.	H	α-helix	trans	-67.1	-45.1	172	0	0	0	0	0	112	L1163 V1164 Q1165 R1170 L1171	L1163-G1167 PolarHBondContact O-N 2.9Å; V1164-G1167 CarbonylContact O-C 3.51Å; V1164-G1167 PolarHBondContact O-N 2.94Å; Q1165-G1167 VanDerWaalsContact C-N 3.26Å; Q1165-G1167 PolarHBondContact O-N 2.91Å; G1167-R1170 PolarHBondContact O-N 3.3Å; G1167-L1171 WeakPolarHBondContact O-CG 3.46Å; G1167-L1171 PolarHBondContact O-N 2.66Å
1168	M	64	Low	69.5	Low	45 Å²	45	73.9 Å²	73.9	22%	0.222	38%	0.378	C	S	.	.	H	α-helix	trans	-65.1	-42.3	177.8	-163.7	70	71.6	0	0	111.6	L1010 V1164 Q1165 R1170 L1171 S1172	L1010-M1168 HydrophobicContact CB-CG 3.82Å; L1010-M1168 HydrophobicContact CB-SD 3.57Å; L1010-M1168 VanDerWaalsContact CB-SD 3.57Å; L1010-M1168 HydrophobicContact CD1-SD 3.72Å; L1010-M1168 HydrophobicContact CG-SD 4.23Å; V1164-M1168 WeakPolarHBondContact O-CB 3.37Å; V1164-M1168 PolarHBondContact O-N 3.42Å; Q1165-M1168 CarbonylContact O-C 3.53Å; Q1165-M1168 WeakPolarHBondContact O-CB 3.36Å; Q1165-M1168 PolarHBondContact O-N 3.11Å; Q1165-M1168 VanDerWaalsContact O-N 3.08Å; M1168-R1170 VanDerWaalsContact C-N 3.33Å; M1168-R1170 PolarHBondContact O-N 3.41Å; M1168-L1171 CarbonylContact O-C 3.52Å; M1168-L1171 PolarHBondContact O-N 3.29Å; M1168-S1172 VanDerWaalsContact O-CB 3.26Å; M1168-S1172 WeakPolarHBondContact O-CB 3.34Å; M1168-S1172 PolarHBondContact O-N 3.07Å; M1168-S1172 PolarHBondContact O-OG 2.84Å
1169	E	65.2	Low	70.8	Confident	72 Å²	72	75.8 Å²	75.8	34%	0.336	38%	0.38	S	S	.	.	H	α-helix	trans	-62.2	-36.8	174	-71.4	164	172.5	0	0	112.1	Q1165 R1166 S1172	Q1165-E1169 HydrophobicContact CG-CG 4.47Å; Q1165-E1169 WeakPolarHBondContact CG-OE1 3.4Å; Q1165-E1169 PolarHBondContact NE2-OE1 3.23Å; Q1165-E1169 WeakPolarHBondContact O-CB 3.42Å; Q1165-E1169 VanDerWaalsContact O-CG 3.28Å; Q1165-E1169 WeakPolarHBondContact O-CG 3.5Å; Q1165-E1169 PolarHBondContact O-N 3.08Å; R1166-E1169 WeakPolarHBondContact CA-OE2 3.35Å; E1169-S1172 WeakPolarHBondContact CA-OG 3.49Å; E1169-S1172 PolarHBondContact O-OG 2.92Å; E1169-S1172 VanDerWaalsContact O-OG 3.04Å
1170	R	62.4	Low	72.2	Confident	196 Å²	196	74.3 Å²	74.3	74%	0.74	37%	0.371	S	S	*	.	H	α-helix	trans	-73.1	-27.3	174.2	-75.1	168.3	178.3	176.6	-4.1	113.2	R1166 G1167 M1168 T1174	R1166-R1170 WeakPolarHBondContact O-CB 3.16Å; R1166-R1170 WeakPolarHBondContact O-CD 3.26Å; R1166-R1170 WeakPolarHBondContact O-CG 3.4Å; R1166-R1170 PolarHBondContact O-N 3.11Å; R1166-R1170 VanDerWaalsContact O-N 3.15Å; G1167-R1170 PolarHBondContact O-N 3.3Å; M1168-R1170 VanDerWaalsContact C-N 3.33Å; M1168-R1170 PolarHBondContact O-N 3.41Å; R1170-T1174 WeakPolarHBondContact O-CG2 3.44Å
1171	L	63.2	Low	73.7	Confident	74 Å²	74	72.3 Å²	72.3	39%	0.387	36%	0.358	S	S	.	.	H	α-helix	trans	-86.2	-25	174.2	-69.1	170.7	0	0	0	112.5	L1010 G1167 M1168 N1173 T1174	L1010-L1171 HydrophobicContact CD1-CB 3.64Å; G1167-L1171 WeakPolarHBondContact O-CG 3.46Å; G1167-L1171 PolarHBondContact O-N 2.66Å; M1168-L1171 CarbonylContact O-C 3.52Å; M1168-L1171 PolarHBondContact O-N 3.29Å; L1171-N1173 VanDerWaalsContact C-N 3.29Å; L1171-N1173 PolarHBondContact O-N 3.32Å; L1171-T1174 PolarHBondContact O-OG1 3.26Å
1172	S	64.8	Low	74.6	Confident	5 Å²	5	70.9 Å²	70.9	4%	0.035	35%	0.348	C	S	.	.	H	α-helix	trans	-75.4	-21.3	-175.1	70.2	0	0	0	0	113.7	V1008 M1168 E1169	V1008-S1172 CarbonylContact C-O 3.51Å; V1008-S1172 PolarHBondContact N-O 3.47Å; V1008-S1172 CarbonylContact O-C 3.26Å; V1008-S1172 WeakPolarHBondContact O-CA 3.4Å; V1008-S1172 WeakPolarHBondContact O-CB 3.49Å; M1168-S1172 VanDerWaalsContact O-CB 3.26Å; M1168-S1172 WeakPolarHBondContact O-CB 3.34Å; M1168-S1172 PolarHBondContact O-N 3.07Å; M1168-S1172 PolarHBondContact O-OG 2.84Å; E1169-S1172 WeakPolarHBondContact CA-OG 3.49Å; E1169-S1172 PolarHBondContact O-OG 2.92Å; E1169-S1172 VanDerWaalsContact O-OG 3.04Å
1173	N	68.7	Low	75.3	Confident	112 Å²	112	65.6 Å²	65.6	60%	0.599	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.4	6.3	-176	-59.1	-1.1	0	0	0	112.2	L1171	L1171-N1173 VanDerWaalsContact C-N 3.29Å; L1171-N1173 PolarHBondContact O-N 3.32Å
1174	T	75.9	Confident	76.2	Confident	31 Å²	31	61.6 Å²	61.6	19%	0.19	30%	0.304	C	S	.	.	S	Bend	trans	-78.2	136	170.6	50	0	0	0	0	110.7	R1170 L1171	R1170-T1174 WeakPolarHBondContact O-CG2 3.44Å; L1171-T1174 PolarHBondContact O-OG1 3.26Å
1175	P	78.5	Confident	77.3	Confident	79 Å²	79	60.4 Å²	60.4	51%	0.513	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	140	168.2	28	-33.1	0	0	0	110.7	E1005	E1005-P1175 HydrophobicContact CG-CB 3.83Å; E1005-P1175 WeakPolarHBondContact OE1-CB 3.5Å
1176	I	80.1	Confident	78.4	Confident	40 Å²	40	58.1 Å²	58.1	21%	0.205	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	120.4	178.4	-54.6	177.5	0	0	0	106.1	T1006 V1008 L1178	T1006-I1176 HydrophobicContact CG2-CB 4.35Å; T1006-I1176 PolarHBondContact N-O 3.47Å; T1006-I1176 PolarHBondContact O-N 2.79Å; V1008-I1176 HydrophobicContact CB-CD1 4.42Å; V1008-I1176 HydrophobicContact CG2-CD1 4.08Å; I1176-L1178 HydrophobicContact CG2-CD2 3.7Å; I1176-L1178 HydrophobicContact CG2-CG 4.28Å
1177	I	86.2	Confident	79.5	Confident	58 Å²	58	51.7 Å²	51.7	30%	0.297	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	124.4	176.2	-56.2	175.3	0	0	0	108.9	A1003 L1004 E1005 R1218	A1003-I1177 HydrophobicContact CB-CG2 3.85Å; L1004-I1177 CarbonylContact O-C 3.51Å; L1004-I1177 WeakPolarHBondContact O-CA 3.42Å; E1005-I1177 HydrophobicContact CB-CG1 4.39Å; I1177-R1218 HydrophobicContact CB-CB 4.04Å; I1177-R1218 HydrophobicContact CG2-CB 3.87Å; I1177-R1218 HydrophobicContact CG2-CG 4.42Å; I1177-R1218 PolarHBondContact O-N 3.12Å
1178	L	86	Confident	80.6	Confident	8 Å²	8	52 Å²	52	4%	0.042	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	110.8	-177.7	-57.6	-177.9	0	0	0	109.2	A1003 L1004 T1006 I1176 V1180 R1216 P1217 L1230 I1233	A1003-L1178 WeakPolarHBondContact CA-O 3.3Å; L1004-L1178 HydrophobicContact CB-CB 4.42Å; L1004-L1178 PolarHBondContact N-O 3.04Å; L1004-L1178 PolarHBondContact O-N 3.32Å; T1006-L1178 HydrophobicContact CG2-CD1 3.77Å; T1006-L1178 HydrophobicContact CG2-CG 4.2Å; I1176-L1178 HydrophobicContact CG2-CD2 3.7Å; I1176-L1178 HydrophobicContact CG2-CG 4.28Å; L1178-V1180 PolarHBondContact O-N 3.5Å; L1178-R1216 CarbonylContact C-O 3.59Å; L1178-R1216 WeakPolarHBondContact CA-O 3.35Å; L1178-P1217 HydrophobicContact CD2-CB 4.26Å; L1178-L1230 HydrophobicContact CD1-CD2 4.28Å; L1178-L1230 HydrophobicContact CD2-CD2 3.76Å; L1178-I1233 HydrophobicContact CD1-CD1 3.49Å; L1178-I1233 VanDerWaalsContact CD1-CD1 3.49Å
1179	Q	89.3	Confident	81.9	Confident	83 Å²	83	51.4 Å²	51.4	39%	0.388	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	115.3	170.5	-170.9	176.8	13.2	0	0	109.5	S1001 F1002 R1216	S1001-Q1179 PolarHBondContact OG-NE2 2.92Å; F1002-Q1179 CarbonylContact O-C 3.54Å; F1002-Q1179 WeakPolarHBondContact O-CA 3.44Å; Q1179-R1216 PolarHBondContact N-O 3.47Å; Q1179-R1216 PolarHBondContact O-N 3.16Å
1180	V	90	Very high	83.1	Confident	0 Å²	0	48 Å²	48	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	125.6	172.9	179.1	0	0	0	0	108.7	S1001 F1002 L1004 L1178 L1213 A1215 M1237	S1001-V1180 CarbonylContact C-O 3.49Å; S1001-V1180 WeakPolarHBondContact CA-O 3.37Å; S1001-V1180 VanDerWaalsContact CB-O 3.22Å; S1001-V1180 WeakPolarHBondContact CB-O 3.36Å; F1002-V1180 HydrophobicContact CD1-CB 4.01Å; F1002-V1180 HydrophobicContact CD1-CG1 4.21Å; F1002-V1180 HydrophobicContact CD2-CB 4.35Å; F1002-V1180 HydrophobicContact CE1-CB 3.68Å; F1002-V1180 HydrophobicContact CE1-CG1 3.46Å; F1002-V1180 VanDerWaalsContact CE1-CG1 3.46Å; F1002-V1180 HydrophobicContact CE2-CB 4.05Å; F1002-V1180 HydrophobicContact CE2-CG1 4.39Å; F1002-V1180 HydrophobicContact CE2-CG2 4.15Å; F1002-V1180 HydrophobicContact CG-CB 4.34Å; F1002-V1180 HydrophobicContact CZ-CB 3.71Å; F1002-V1180 HydrophobicContact CZ-CG1 3.58Å; F1002-V1180 HydrophobicContact CZ-CG2 4.12Å; F1002-V1180 PolarHBondContact N-O 2.95Å; F1002-V1180 PolarHBondContact O-N 3.07Å; L1004-V1180 HydrophobicContact CD1-CG2 3.87Å; L1004-V1180 HydrophobicContact CG-CG2 4.28Å; L1178-V1180 PolarHBondContact O-N 3.5Å; V1180-L1213 HydrophobicContact CG1-CD1 3.93Å; V1180-L1213 HydrophobicContact CG1-CD2 3.66Å; V1180-L1213 HydrophobicContact CG1-CG 3.78Å; V1180-A1215 HydrophobicContact CG2-CB 4.42Å; V1180-M1237 HydrophobicContact CG1-CE 3.83Å; V1180-M1237 HydrophobicContact CG2-CE 4.11Å
1181	E	91.1	Very high	84.4	Confident	52 Å²	52	39.7 Å²	39.7	24%	0.243	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	123.6	-176.3	173.8	-165.8	-137.8	0	0	109.1	Q1183 L1213 K1214 R1216	E1181-Q1183 HydrophobicContact CG-CG 4Å; E1181-Q1183 PolarHBondContact OE2-NE2 2.71Å; E1181-L1213 WeakPolarHBondContact O-CA 3.32Å; E1181-K1214 PolarHBondContact N-O 3.32Å; E1181-K1214 PolarHBondContact O-N 3.27Å; E1181-R1216 IonicContact OE1-CZ 2.93Å; E1181-R1216 IonicContact OE1-NH2 2.68Å; E1181-R1216 PolarHBondContact OE1-NH2 3.18Å; E1181-R1216 IonicContact OE2-CZ 3.23Å; E1181-R1216 IonicContact OE2-NE 3.48Å; E1181-R1216 PolarHBondContact OE2-NE 3.4Å; E1181-R1216 VanDerWaalsContact OE2-NE 3.16Å; E1181-R1216 IonicContact OE2-NH2 2.71Å; E1181-R1216 PolarHBondContact OE2-NH2 3.27Å
1182	I	90.8	Very high	85.6	Confident	36 Å²	36	36.1 Å²	36.1	19%	0.185	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	113.2	165.2	-61.4	-178.2	0	0	0	107.1	Y996 G998 G999 F1000 L1213	Y996-I1182 HydrophobicContact CD1-CG2 4.32Å; Y996-I1182 HydrophobicContact CE1-CG2 4.24Å; G998-I1182 WeakPolarHBondContact CA-O 3.38Å; G999-I1182 PolarHBondContact N-O 2.74Å; F1000-I1182 HydrophobicContact CD1-CB 4.47Å; F1000-I1182 HydrophobicContact CD1-CD1 3.57Å; F1000-I1182 HydrophobicContact CD1-CG1 3.94Å; F1000-I1182 HydrophobicContact CE1-CD1 4.04Å; F1000-I1182 HydrophobicContact CG-CD1 4.44Å; F1000-I1182 PolarHBondContact O-N 3.42Å; I1182-L1213 HydrophobicContact CG1-CD1 4.38Å
1183	Q	86.7	Confident	86.6	Confident	50 Å²	50	38.4 Å²	38.4	23%	0.234	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	-29.7	-179.4	-54.5	-160.1	-31.5	0	0	113	A997 E1181 R1212 K1214	A997-Q1183 CarbonylContact C-O 3.55Å; E1181-Q1183 HydrophobicContact CG-CG 4Å; E1181-Q1183 PolarHBondContact OE2-NE2 2.71Å; Q1183-R1212 HydrophobicContact CB-CB 4.08Å; Q1183-R1212 WeakPolarHBondContact CB-O 3.33Å; Q1183-R1212 PolarHBondContact N-O 3.13Å; Q1183-K1214 HydrophobicContact CG-CB 4.31Å
1184	M	89	Confident	87.3	Confident	48 Å²	48	33.5 Å²	33.5	24%	0.236	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.7	141.6	-179.5	-163.9	-178.7	-174.3	0	0	110.1	Y996 R1212	Y996-M1184 WeakPolarHBondContact O-CA 3.49Å; M1184-R1212 HydrophobicContact CB-CB 3.99Å; M1184-R1212 HydrophobicContact CB-CG 4.29Å; M1184-R1212 PolarHBondContact N-O 2.85Å; M1184-R1212 PolarHBondContact O-N 3.04Å
1185	L	89.7	Confident	87.1	Confident	35 Å²	35	33.9 Å²	33.9	18%	0.183	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	125.4	163.5	162.5	66.8	0	0	0	107.7	Y996 F1205 P1209 N1210 I1211	Y996-L1185 HydrophobicContact CD1-CB 4.44Å; Y996-L1185 PolarHBondContact N-O 2.69Å; Y996-L1185 PolarHBondContact O-N 3.46Å; L1185-F1205 HydrophobicContact CD1-CZ 4.19Å; L1185-F1205 HydrophobicContact CD2-CZ 4.43Å; L1185-P1209 HydrophobicContact CD1-CB 3.96Å; L1185-P1209 HydrophobicContact CD1-CG 4.31Å; L1185-N1210 WeakPolarHBondContact CA-O 3.46Å; L1185-I1211 HydrophobicContact CD1-CD1 4.24Å; L1185-I1211 HydrophobicContact CD1-CG1 3.81Å
1186	S	90.1	Very high	86.8	Confident	21 Å²	21	35.9 Å²	35.9	15%	0.147	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144	127.4	178.9	-175.2	0	0	0	0	111.2	R976 V994 N1210	R976-S1186 PolarHBondContact NH1-OG 2.96Å; V994-S1186 WeakPolarHBondContact O-CA 3.36Å; S1186-N1210 PolarHBondContact N-O 3.03Å; S1186-N1210 PolarHBondContact O-N 3.03Å
1187	G	90.1	Very high	86.2	Confident	13 Å²	13	39.3 Å²	39.3	13%	0.134	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	172.9	166.5	175.8	0	0	0	0	0	113.9	V994 L1189	V994-G1187 PolarHBondContact N-O 3.23Å; V994-G1187 PolarHBondContact O-N 2.79Å; V994-G1187 VanDerWaalsContact O-N 3.08Å; G1187-L1189 PolarHBondContact O-N 3.21Å
1188	T	90.4	Very high	85.7	Confident	34 Å²	34	36.8 Å²	36.8	21%	0.209	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	105	177.3	-45.9	0	0	0	0	109.9	E991 D993 F1205 R1206	E991-T1188 HydrophobicContact CB-CG2 4.34Å; D993-T1188 WeakPolarHBondContact OD1-CB 3.15Å; D993-T1188 WeakPolarHBondContact OD1-CG2 3.32Å; D993-T1188 PolarHBondContact OD1-OG1 3.13Å; T1188-F1205 WeakPolarHBondContact O-CA 3.45Å; T1188-R1206 PolarHBondContact O-N 3.22Å
1189	L	91.4	Very high	85.4	Confident	32 Å²	32	37.6 Å²	37.6	17%	0.168	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79	137.9	169.9	-177.9	67.4	0	0	0	109	V992 V994 G1187 V1191 Y1203 F1205	V992-L1189 PolarHBondContact N-O 3.04Å; V992-L1189 PolarHBondContact O-N 3Å; V994-L1189 HydrophobicContact CG2-CB 3.72Å; V994-L1189 HydrophobicContact CG2-CD2 4.04Å; G1187-L1189 PolarHBondContact O-N 3.21Å; L1189-V1191 HydrophobicContact CD2-CG2 4.47Å; L1189-V1191 HydrophobicContact CG-CG2 4.45Å; L1189-Y1203 HydrophobicContact CD1-CD2 4.26Å; L1189-F1205 HydrophobicContact CB-CD1 4.37Å; L1189-F1205 HydrophobicContact CB-CE1 4.09Å; L1189-F1205 HydrophobicContact CD1-CD2 4.28Å; L1189-F1205 HydrophobicContact CD1-CE1 4.38Å; L1189-F1205 HydrophobicContact CD1-CE2 4.07Å; L1189-F1205 HydrophobicContact CD1-CZ 4.13Å
1190	L	90.6	Very high	85.2	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	123.1	-179.9	176.8	66.8	0	0	0	108.5	P541 W989 E991 Y1203 G1204 R1206 L1247 M1250	P541-L1190 HydrophobicContact CB-CD2 3.33Å; P541-L1190 HydrophobicContact CG-CD2 3.59Å; W989-L1190 HydrophobicContact CB-CD1 4.4Å; W989-L1190 HydrophobicContact CD2-CD1 4.39Å; W989-L1190 HydrophobicContact CE3-CD1 3.54Å; W989-L1190 HydrophobicContact CE3-CD2 3.72Å; W989-L1190 HydrophobicContact CE3-CG 3.54Å; W989-L1190 HydrophobicContact CH2-CD2 4.19Å; W989-L1190 HydrophobicContact CZ3-CD1 4.08Å; W989-L1190 HydrophobicContact CZ3-CD2 3.33Å; W989-L1190 HydrophobicContact CZ3-CG 3.6Å; E991-L1190 HydrophobicContact CG-CD1 3.42Å; E991-L1190 VanDerWaalsContact CG-CD1 3.42Å; L1190-Y1203 WeakPolarHBondContact O-CA 3.24Å; L1190-G1204 WeakPolarHBondContact CA-O 3.4Å; L1190-G1204 WeakPolarHBondContact CB-O 3.08Å; L1190-G1204 PolarHBondContact N-O 3.04Å; L1190-G1204 PolarHBondContact O-N 2.83Å; L1190-R1206 HydrophobicContact CD2-CB 4.47Å; L1190-L1247 HydrophobicContact CD2-CD1 4.39Å; L1190-L1247 HydrophobicContact CD2-CD2 3.65Å; L1190-M1250 WeakPolarHBondContact O-CE 3.42Å
1191	V	90.4	Very high	85.2	Confident	22 Å²	22	35.8 Å²	35.8	13%	0.133	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	136.9	-178.3	174.9	0	0	0	0	108.8	W989 I990 L1189 L1201 W1202	W989-V1191 CarbonylContact C-O 3.16Å; W989-V1191 VanDerWaalsContact CA-O 3.29Å; W989-V1191 WeakPolarHBondContact CA-O 3.47Å; I990-V1191 HydrophobicContact CB-CB 4.46Å; I990-V1191 PolarHBondContact N-O 3.41Å; I990-V1191 PolarHBondContact O-N 2.9Å; L1189-V1191 HydrophobicContact CD2-CG2 4.47Å; L1189-V1191 HydrophobicContact CG-CG2 4.45Å; V1191-L1201 HydrophobicContact CG1-CD1 3.72Å; V1191-L1201 HydrophobicContact CG1-CD2 3.87Å; V1191-L1201 HydrophobicContact CG1-CG 3.71Å; V1191-W1202 WeakPolarHBondContact CA-O 3.26Å
1192	N	87.5	Confident	85.1	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	125	176.4	177.1	89.1	0	0	0	112	R736 H986 G987 L988 W989 P1194 W1202 M1250	R736-N1192 VanDerWaalsContact CZ-CG 3.48Å; R736-N1192 PolarHBondContact NE-ND2 3.45Å; R736-N1192 PolarHBondContact NH2-ND2 3.38Å; R736-N1192 PolarHBondContact NH2-OD1 2.87Å; H986-N1192 PolarHBondContact O-ND2 3.49Å; H986-N1192 PolarHBondContact O-OD1 3.2Å; G987-N1192 WeakPolarHBondContact CA-OD1 3.33Å; L988-N1192 WeakPolarHBondContact O-CA 3Å; W989-N1192 HydrophobicContact CD2-CB 3.98Å; W989-N1192 HydrophobicContact CE3-CB 3.62Å; W989-N1192 HydrophobicContact CZ3-CB 4.06Å; W989-N1192 PolarHBondContact NE1-OD1 2.95Å; N1192-P1194 WeakPolarHBondContact ND2-CG 3.44Å; N1192-W1202 HydrophobicContact CB-CB 4.35Å; N1192-W1202 PolarHBondContact N-O 3.2Å; N1192-W1202 PolarHBondContact O-N 2.95Å; N1192-M1250 HydrophobicContact CB-CE 4.36Å
1193	I	86.8	Confident	85.1	Confident	53 Å²	53	34.7 Å²	34.7	27%	0.272	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	104	171.3	-55.8	174.6	0	0	0	107.5	G987 L988 L1201 L1258	G987-I1193 CarbonylContact C-O 3.57Å; G987-I1193 WeakPolarHBondContact CA-O 3.19Å; L988-I1193 PolarHBondContact N-O 2.82Å; L988-I1193 PolarHBondContact O-N 2.9Å; I1193-L1201 HydrophobicContact CD1-CD1 4.44Å; I1193-L1201 HydrophobicContact CG1-CD1 4.19Å; I1193-L1201 HydrophobicContact CG1-CG 4.36Å; I1193-L1258 HydrophobicContact CG2-CD1 4.24Å; I1193-L1258 HydrophobicContact CG2-CD2 4.49Å
1194	P	82.2	Confident	85.3	Confident	9 Å²	9	32.3 Å²	32.3	6%	0.058	19%	0.188	C	C	.	.	P	Polyproline II helix	trans	-67	158	-177.3	-11.1	25.8	0	0	0	112.2	H986 N1192 S1198 R1200 W1202	H986-P1194 VanDerWaalsContact O-CA 3.32Å; H986-P1194 WeakPolarHBondContact O-CA 3.31Å; H986-P1194 WeakPolarHBondContact O-CB 3.25Å; N1192-P1194 WeakPolarHBondContact ND2-CG 3.44Å; P1194-S1198 WeakPolarHBondContact CB-OG 3.48Å; P1194-S1198 WeakPolarHBondContact CG-OG 3.14Å; P1194-S1198 WeakPolarHBondContact O-CB 3.4Å; P1194-R1200 WeakPolarHBondContact CD-O 3.37Å; P1194-W1202 VanDerWaalsContact CG-CD1 3.43Å
1195	P	71.9	Confident	85.3	Confident	38 Å²	38	30.6 Å²	30.6	25%	0.247	18%	0.18	C	C	.	.	S	Bend	trans	-59.7	151.4	179.2	27.8	-38	0	0	0	112	R743 P758 S1198	R743-P1195 PolarHBondContact NH1-O 2.77Å; P758-P1195 HydrophobicContact CB-CB 4.39Å; P758-P1195 HydrophobicContact CG-CB 4.02Å; P758-P1195 HydrophobicContact CG-CG 3.77Å; P1195-S1198 VanDerWaalsContact O-CB 3.27Å; P1195-S1198 WeakPolarHBondContact O-CB 3.07Å; P1195-S1198 PolarHBondContact O-N 2.93Å
1196	P	71.7	Confident	85	Confident	121 Å²	121	33.2 Å²	33.2	79%	0.786	19%	0.187	S	C	*	.	T	Hydrogen-bonded Turn	trans	-46.8	145.2	170.6	-29.9	36.8	0	0	0	112.8	S1198	P1196-S1198 VanDerWaalsContact CA-N 3.34Å
1197	P	68.4	Low	84.7	Confident	112 Å²	112	35.3 Å²	35.3	73%	0.727	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	cis	-91.1	50.2	4.4	38.1	-36.8	0	0	0	113
1198	S	75.7	Confident	84.6	Confident	6 Å²	6	37 Å²	37	4%	0.042	21%	0.208	C	C	.	.			trans	-74.2	125.5	176.5	-152.7	0	0	0	0	112.7	R743 P1194 P1195 P1196 R1200	R743-S1198 PolarHBondContact NH2-OG 2.79Å; P1194-S1198 WeakPolarHBondContact CB-OG 3.48Å; P1194-S1198 WeakPolarHBondContact CG-OG 3.14Å; P1194-S1198 WeakPolarHBondContact O-CB 3.4Å; P1195-S1198 VanDerWaalsContact O-CB 3.27Å; P1195-S1198 WeakPolarHBondContact O-CB 3.07Å; P1195-S1198 PolarHBondContact O-N 2.93Å; P1196-S1198 VanDerWaalsContact CA-N 3.34Å; S1198-R1200 VanDerWaalsContact C-N 3.34Å
1199	D	80.7	Confident	84.6	Confident	24 Å²	24	35.9 Å²	35.9	13%	0.128	20%	0.201	C	C	.	.			trans	-94.9	21.9	175.4	70.8	-29.9	0	0	0	113.2	K1254 V1255 L1259	D1199-K1254 CarbonylContact O-C 3.59Å; D1199-K1254 WeakPolarHBondContact O-CA 3.46Å; D1199-K1254 WeakPolarHBondContact OD2-CE 3.45Å; D1199-K1254 VanDerWaalsContact OD2-CG 3.29Å; D1199-K1254 WeakPolarHBondContact OD2-CG 3.32Å; D1199-V1255 PolarHBondContact O-N 2.81Å; D1199-L1259 HydrophobicContact CB-CD1 3.9Å; D1199-L1259 HydrophobicContact CB-CD2 4.33Å; D1199-L1259 HydrophobicContact CB-CG 3.9Å
1200	R	85	Confident	84.5	Confident	3 Å²	3	38.9 Å²	38.9	1%	0.011	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	149.5	-162.5	-46.4	-167.1	-177.6	-141	-3.5	115.3	G639 P1194 S1198 D1252 L1253	G639-R1200 VanDerWaalsContact O-CZ 3.31Å; G639-R1200 PolarHBondContact O-NH1 2.72Å; G639-R1200 PolarHBondContact O-NH2 3.07Å; P1194-R1200 WeakPolarHBondContact CD-O 3.37Å; S1198-R1200 VanDerWaalsContact C-N 3.34Å; R1200-D1252 WeakPolarHBondContact CD-OD2 3.29Å; R1200-D1252 IonicContact CZ-OD2 2.88Å; R1200-D1252 IonicContact NE-OD2 3.62Å; R1200-D1252 IonicContact NH1-OD2 3.94Å; R1200-D1252 PolarHBondContact NH1-OD2 3.29Å; R1200-L1253 VanDerWaalsContact CA-O 3.31Å; R1200-L1253 WeakPolarHBondContact CA-O 3.4Å
1201	L	88.6	Confident	84.5	Confident	42 Å²	42	40.2 Å²	40.2	22%	0.22	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	124.8	164.7	179.8	151.8	0	0	0	108.4	V1191 I1193 L1253 V1255	V1191-L1201 HydrophobicContact CG1-CD1 3.72Å; V1191-L1201 HydrophobicContact CG1-CD2 3.87Å; V1191-L1201 HydrophobicContact CG1-CG 3.71Å; I1193-L1201 HydrophobicContact CD1-CD1 4.44Å; I1193-L1201 HydrophobicContact CG1-CD1 4.19Å; I1193-L1201 HydrophobicContact CG1-CG 4.36Å; L1201-L1253 HydrophobicContact CD2-CD1 4.27Å; L1201-L1253 PolarHBondContact N-O 3.37Å; L1201-L1253 PolarHBondContact O-N 2.74Å; L1201-V1255 HydrophobicContact CB-CG2 4.27Å
1202	W	88.7	Confident	84.5	Confident	1 Å²	1	45.1 Å²	45.1	0%	0.004	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	141.6	173.9	-65.8	87.6	0	0	0	109.5	W643 C735 R736 E739 V1191 N1192 P1194 M1250 D1251 D1252	W643-W1202 HydrophobicContact CB-CH2 4.2Å; W643-W1202 HydrophobicContact CB-CZ2 4.4Å; C735-W1202 HydrophobicContact CB-CH2 3.62Å; C735-W1202 HydrophobicContact CB-CZ3 3.74Å; R736-W1202 HydrophobicContact CB-CD2 4.05Å; R736-W1202 HydrophobicContact CB-CE3 4.02Å; R736-W1202 HydrophobicContact CB-CH2 3.94Å; R736-W1202 HydrophobicContact CB-CZ2 3.93Å; R736-W1202 HydrophobicContact CB-CZ3 3.97Å; R736-W1202 HydrophobicContact CG-CD2 4.16Å; R736-W1202 HydrophobicContact CG-CZ2 4.27Å; E739-W1202 HydrophobicContact CB-CZ2 4.44Å; E739-W1202 WeakPolarHBondContact OE2-CZ2 3.42Å; E739-W1202 PolarHBondContact OE2-NE1 2.98Å; V1191-W1202 WeakPolarHBondContact CA-O 3.26Å; N1192-W1202 HydrophobicContact CB-CB 4.35Å; N1192-W1202 PolarHBondContact N-O 3.2Å; N1192-W1202 PolarHBondContact O-N 2.95Å; P1194-W1202 VanDerWaalsContact CG-CD1 3.43Å; W1202-M1250 HydrophobicContact CB-CB 4.46Å; W1202-M1250 HydrophobicContact CB-CE 4.09Å; W1202-M1250 HydrophobicContact CB-SD 4.47Å; W1202-M1250 HydrophobicContact CE3-CB 4.13Å; W1202-D1251 WeakPolarHBondContact CA-O 3.31Å; W1202-D1252 HydrophobicContact CD2-CB 4Å; W1202-D1252 HydrophobicContact CE3-CB 3.76Å; W1202-D1252 HydrophobicContact CH2-CB 4.1Å; W1202-D1252 HydrophobicContact CZ2-CB 4.35Å; W1202-D1252 HydrophobicContact CZ3-CB 3.8Å
1203	Y	91.6	Very high	84.6	Confident	64 Å²	64	46.4 Å²	46.4	25%	0.251	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	144.8	177.6	72.2	-72.5	0	0	0	112.8	L1189 L1190 V1245 M1250 D1251 L1253	L1189-Y1203 HydrophobicContact CD1-CD2 4.26Å; L1190-Y1203 WeakPolarHBondContact O-CA 3.24Å; Y1203-V1245 HydrophobicContact CD2-CG1 4.48Å; Y1203-V1245 HydrophobicContact CE2-CG1 4.31Å; Y1203-M1250 CarbonylContact O-C 3.39Å; Y1203-M1250 VanDerWaalsContact O-CA 3.31Å; Y1203-M1250 WeakPolarHBondContact O-CA 3.35Å; Y1203-M1250 WeakPolarHBondContact O-CB 3.3Å; Y1203-D1251 HydrophobicContact CD1-CB 4.23Å; Y1203-D1251 WeakPolarHBondContact CD1-O 3.4Å; Y1203-D1251 HydrophobicContact CE1-CB 3.55Å; Y1203-D1251 WeakPolarHBondContact CE1-OD2 3.42Å; Y1203-D1251 VanDerWaalsContact CZ-OD2 3.31Å; Y1203-D1251 PolarHBondContact N-O 2.88Å; Y1203-D1251 PolarHBondContact O-N 2.87Å; Y1203-D1251 PolarHBondContact OH-OD2 3.48Å; Y1203-L1253 HydrophobicContact CD1-CD1 4.08Å; Y1203-L1253 HydrophobicContact CD1-CG 4.08Å; Y1203-L1253 HydrophobicContact CE1-CD1 4Å; Y1203-L1253 HydrophobicContact CE1-CD2 4.19Å; Y1203-L1253 HydrophobicContact CE1-CG 3.8Å
1204	G	90.3	Very high	84.7	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-170.4	160.1	177.4	0	0	0	0	0	112.7	L1190 V1245 L1247	L1190-G1204 WeakPolarHBondContact CA-O 3.4Å; L1190-G1204 WeakPolarHBondContact CB-O 3.08Å; L1190-G1204 PolarHBondContact N-O 3.04Å; L1190-G1204 PolarHBondContact O-N 2.83Å; G1204-V1245 CarbonylContact C-O 3.6Å; G1204-V1245 WeakPolarHBondContact CA-O 3.47Å; G1204-L1247 VanDerWaalsContact C-CD1 3.49Å
1205	F	89.6	Confident	85	Confident	13 Å²	13	47.7 Å²	47.7	6%	0.057	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	132	177.5	-72	-88.3	0	0	0	111	L1185 T1188 L1189 P1207 P1209 F1241 V1245 V1246 L1247	L1185-F1205 HydrophobicContact CD1-CZ 4.19Å; L1185-F1205 HydrophobicContact CD2-CZ 4.43Å; T1188-F1205 WeakPolarHBondContact O-CA 3.45Å; L1189-F1205 HydrophobicContact CB-CD1 4.37Å; L1189-F1205 HydrophobicContact CB-CE1 4.09Å; L1189-F1205 HydrophobicContact CD1-CD2 4.28Å; L1189-F1205 HydrophobicContact CD1-CE1 4.38Å; L1189-F1205 HydrophobicContact CD1-CE2 4.07Å; L1189-F1205 HydrophobicContact CD1-CZ 4.13Å; F1205-P1207 WeakPolarHBondContact CB-O 3.35Å; F1205-P1209 HydrophobicContact CB-CG 4.2Å; F1205-P1209 HydrophobicContact CD1-CB 3.86Å; F1205-P1209 HydrophobicContact CD1-CG 4.11Å; F1205-P1209 HydrophobicContact CD2-CG 4.11Å; F1205-P1209 HydrophobicContact CE1-CB 4.18Å; F1205-P1209 HydrophobicContact CG-CB 4.13Å; F1205-P1209 HydrophobicContact CG-CG 3.86Å; F1205-F1241 AromaticContact CD2-CE1 3.91Å; F1205-F1241 HydrophobicContact CD2-CE1 3.91Å; F1205-F1241 HydrophobicContact CD2-CZ 4.21Å; F1205-F1241 AromaticContact CE2-CE1 3.92Å; F1205-F1241 HydrophobicContact CE2-CE1 3.92Å; F1205-F1241 AromaticContact CE2-CZ 3.75Å; F1205-F1241 HydrophobicContact CE2-CZ 3.75Å; F1205-V1245 HydrophobicContact CD2-CG1 4.05Å; F1205-V1245 HydrophobicContact CE2-CG1 4.36Å; F1205-V1245 PolarHBondContact N-O 3.2Å; F1205-V1246 HydrophobicContact CB-CG2 4.37Å; F1205-L1247 VanDerWaalsContact O-CD1 3.26Å; F1205-L1247 WeakPolarHBondContact O-CD1 3.37Å; F1205-L1247 PolarHBondContact O-N 2.91Å
1206	R	82.9	Confident	85.7	Confident	89 Å²	89	50.7 Å²	50.7	34%	0.336	26%	0.257	S	S	.	.	S	Bend	trans	-71.6	-55.6	-177.2	-179.5	173.5	177.5	-177.8	-3.1	111.9	E991 T1188 L1190	E991-R1206 VanDerWaalsContact OE1-CD 3.23Å; E991-R1206 WeakPolarHBondContact OE1-CD 3.27Å; E991-R1206 IonicContact OE1-CZ 2.69Å; E991-R1206 IonicContact OE1-NE 2.66Å; E991-R1206 IonicContact OE1-NH1 3.29Å; E991-R1206 PolarHBondContact OE1-NH1 3.45Å; E991-R1206 IonicContact OE2-NH1 3.75Å; T1188-R1206 PolarHBondContact O-N 3.22Å; L1190-R1206 HydrophobicContact CD2-CB 4.47Å
1207	P	84.1	Confident	86.3	Confident	65 Å²	65	47.9 Å²	47.9	42%	0.422	24%	0.239	S	C	.	.	S	Bend	trans	-86.3	167	161.2	36.3	-34.8	0	0	0	111	F1205 P1209	F1205-P1207 WeakPolarHBondContact CB-O 3.35Å; P1207-P1209 WeakPolarHBondContact O-CD 3.38Å
1208	V	87	Confident	86.7	Confident	50 Å²	50	48.8 Å²	48.8	30%	0.303	23%	0.228	S	C	.	.	P	Polyproline II helix	trans	-60.1	120.8	163.4	173.7	0	0	0	0	108.9	W605 Q1242 V1246	W605-V1208 HydrophobicContact CD2-CG2 3.7Å; W605-V1208 HydrophobicContact CE3-CG2 3.87Å; W605-V1208 HydrophobicContact CG-CG2 4.28Å; W605-V1208 HydrophobicContact CH2-CG2 4.07Å; W605-V1208 HydrophobicContact CZ2-CG2 3.9Å; W605-V1208 HydrophobicContact CZ3-CG2 4.05Å; V1208-Q1242 HydrophobicContact CG1-CG 4.06Å; V1208-V1246 HydrophobicContact CG2-CG1 4.04Å
1209	P	90.9	Very high	86	Confident	10 Å²	10	54.8 Å²	54.8	7%	0.065	26%	0.264	C	S	.	.	P	Polyproline II helix	trans	-74.5	152.6	-178.2	29.6	-34.3	0	0	0	111.9	L1185 F1205 P1207 I1211 F1241	L1185-P1209 HydrophobicContact CD1-CB 3.96Å; L1185-P1209 HydrophobicContact CD1-CG 4.31Å; F1205-P1209 HydrophobicContact CB-CG 4.2Å; F1205-P1209 HydrophobicContact CD1-CB 3.86Å; F1205-P1209 HydrophobicContact CD1-CG 4.11Å; F1205-P1209 HydrophobicContact CD2-CG 4.11Å; F1205-P1209 HydrophobicContact CE1-CB 4.18Å; F1205-P1209 HydrophobicContact CG-CB 4.13Å; F1205-P1209 HydrophobicContact CG-CG 3.86Å; P1207-P1209 WeakPolarHBondContact O-CD 3.38Å; P1209-I1211 HydrophobicContact CB-CG1 4.42Å; P1209-I1211 HydrophobicContact CG-CD1 4.1Å; P1209-I1211 HydrophobicContact CG-CG1 4.08Å; P1209-I1211 PolarHBondContact O-N 3.26Å; P1209-I1211 VanDerWaalsContact O-N 3.16Å; P1209-F1241 HydrophobicContact CG-CD1 4.47Å; P1209-F1241 HydrophobicContact CG-CE1 3.92Å
1210	N	90.2	Very high	84.9	Confident	94 Å²	94	57 Å²	57	50%	0.503	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	101.8	171.9	-176.5	-5.2	0	0	0	109.1	L1185 S1186	L1185-N1210 WeakPolarHBondContact CA-O 3.46Å; S1186-N1210 PolarHBondContact N-O 3.03Å; S1186-N1210 PolarHBondContact O-N 3.03Å
1211	I	90.4	Very high	83.3	Confident	28 Å²	28	65.5 Å²	65.5	14%	0.144	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	118.7	176.7	-51.6	-173.9	0	0	0	109	L1185 P1209 L1213 F1241	L1185-I1211 HydrophobicContact CD1-CD1 4.24Å; L1185-I1211 HydrophobicContact CD1-CG1 3.81Å; P1209-I1211 HydrophobicContact CB-CG1 4.42Å; P1209-I1211 HydrophobicContact CG-CD1 4.1Å; P1209-I1211 HydrophobicContact CG-CG1 4.08Å; P1209-I1211 PolarHBondContact O-N 3.26Å; P1209-I1211 VanDerWaalsContact O-N 3.16Å; I1211-L1213 HydrophobicContact CG2-CB 4.34Å; I1211-F1241 HydrophobicContact CD1-CB 4.29Å; I1211-F1241 HydrophobicContact CD1-CD1 3.44Å; I1211-F1241 VanDerWaalsContact CD1-CD1 3.44Å; I1211-F1241 HydrophobicContact CD1-CD2 4.03Å; I1211-F1241 HydrophobicContact CD1-CE1 3.66Å; I1211-F1241 HydrophobicContact CD1-CE2 4.21Å; I1211-F1241 HydrophobicContact CD1-CG 3.65Å; I1211-F1241 HydrophobicContact CD1-CZ 4.03Å
1212	R	89.8	Confident	81.6	Confident	126 Å²	126	69.6 Å²	69.6	48%	0.475	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	98.4	169.4	-69.9	176.3	50.3	-165.8	-10	108.9	Q1183 M1184	Q1183-R1212 HydrophobicContact CB-CB 4.08Å; Q1183-R1212 WeakPolarHBondContact CB-O 3.33Å; Q1183-R1212 PolarHBondContact N-O 3.13Å; M1184-R1212 HydrophobicContact CB-CB 3.99Å; M1184-R1212 HydrophobicContact CB-CG 4.29Å; M1184-R1212 PolarHBondContact N-O 2.85Å; M1184-R1212 PolarHBondContact O-N 3.04Å
1213	L	90	Very high	79.8	Confident	26 Å²	26	75.9 Å²	75.9	14%	0.136	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	139.5	174.7	-176.1	154.7	0	0	0	108.8	V1180 E1181 I1182 I1211 E1234 M1237	V1180-L1213 HydrophobicContact CG1-CD1 3.93Å; V1180-L1213 HydrophobicContact CG1-CD2 3.66Å; V1180-L1213 HydrophobicContact CG1-CG 3.78Å; E1181-L1213 WeakPolarHBondContact O-CA 3.32Å; I1182-L1213 HydrophobicContact CG1-CD1 4.38Å; I1211-L1213 HydrophobicContact CG2-CB 4.34Å; L1213-E1234 HydrophobicContact CD2-CB 4.28Å; L1213-E1234 HydrophobicContact CD2-CG 3.85Å; L1213-M1237 HydrophobicContact CD1-CB 4.5Å; L1213-M1237 HydrophobicContact CD1-CE 3.93Å; L1213-M1237 HydrophobicContact CD2-CE 3.75Å; L1213-M1237 HydrophobicContact CG-CE 4.49Å
1214	K	89.7	Confident	78.1	Confident	84 Å²	84	75.6 Å²	75.6	37%	0.365	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	124.7	-178.6	-174.8	176.6	-179.8	179.7	0	111.3	E1181 Q1183 R1216 E1234	E1181-K1214 PolarHBondContact N-O 3.32Å; E1181-K1214 PolarHBondContact O-N 3.27Å; Q1183-K1214 HydrophobicContact CG-CB 4.31Å; K1214-R1216 HydrophobicContact CD-CG 4.43Å; K1214-R1216 HydrophobicContact CG-CG 4.2Å; K1214-E1234 WeakPolarHBondContact CA-OE1 3.44Å
1215	A	88	Confident	76.5	Confident	5 Å²	5	80.5 Å²	80.5	4%	0.041	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	133.1	172.6	0	0	0	0	0	110.3	V1180 L1230 E1234	V1180-A1215 HydrophobicContact CG2-CB 4.42Å; A1215-L1230 HydrophobicContact CB-CB 4.18Å; A1215-L1230 HydrophobicContact CB-CD2 3.77Å; A1215-E1234 HydrophobicContact CB-CG 4.03Å; A1215-E1234 PolarHBondContact N-OE1 2.78Å
1216	R	86.7	Confident	75.5	Confident	101 Å²	101	81.9 Å²	81.9	38%	0.381	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	137	177.6	-47.8	-175.5	-166.6	-165.4	9.9	109.2	L1178 Q1179 E1181 K1214	L1178-R1216 CarbonylContact C-O 3.59Å; L1178-R1216 WeakPolarHBondContact CA-O 3.35Å; Q1179-R1216 PolarHBondContact N-O 3.47Å; Q1179-R1216 PolarHBondContact O-N 3.16Å; E1181-R1216 IonicContact OE1-CZ 2.93Å; E1181-R1216 IonicContact OE1-NH2 2.68Å; E1181-R1216 PolarHBondContact OE1-NH2 3.18Å; E1181-R1216 IonicContact OE2-CZ 3.23Å; E1181-R1216 IonicContact OE2-NE 3.48Å; E1181-R1216 PolarHBondContact OE2-NE 3.4Å; E1181-R1216 VanDerWaalsContact OE2-NE 3.16Å; E1181-R1216 IonicContact OE2-NH2 2.71Å; E1181-R1216 PolarHBondContact OE2-NH2 3.27Å; K1214-R1216 HydrophobicContact CD-CG 4.43Å; K1214-R1216 HydrophobicContact CG-CG 4.2Å
1217	P	83.5	Confident	75	Confident	62 Å²	62	81 Å²	81	40%	0.403	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	137.5	170.3	28.7	-33.5	0	0	0	110.2	L1178 V1219	L1178-P1217 HydrophobicContact CD2-CB 4.26Å; P1217-V1219 PolarHBondContact O-N 3.24Å
1218	R	77.6	Confident	74.5	Confident	131 Å²	131	82.9 Å²	82.9	49%	0.494	44%	0.435	S	S	.	.			trans	-73.4	94.1	171.6	-164.3	172.4	-175.9	151.5	-0.3	107	D965 I1177 G1220	D965-R1218 IonicContact OD2-CZ 3.87Å; D965-R1218 IonicContact OD2-NH1 3.96Å; D965-R1218 PolarHBondContact OD2-NH1 3.28Å; D965-R1218 IonicContact OD2-NH2 3.65Å; D965-R1218 PolarHBondContact OD2-NH2 3.41Å; I1177-R1218 HydrophobicContact CB-CB 4.04Å; I1177-R1218 HydrophobicContact CG2-CB 3.87Å; I1177-R1218 HydrophobicContact CG2-CG 4.42Å; I1177-R1218 PolarHBondContact O-N 3.12Å; R1218-G1220 PolarHBondContact O-N 2.9Å
1219	V	61.5	Low	74	Confident	133 Å²	133	80.7 Å²	80.7	81%	0.806	42%	0.421	S	S	*	.			trans	-62.9	133	-171.3	-177.1	0	0	0	0	110.5	P1217	P1217-V1219 PolarHBondContact O-N 3.24Å
1220	G	56.8	Low	73.6	Confident	71 Å²	71	81.4 Å²	81.4	73%	0.732	43%	0.425	S	S	*	.	S	Bend	trans	-150	-59.7	179.4	0	0	0	0	0	112.7	R1218	R1218-G1220 PolarHBondContact O-N 2.9Å
1221	E	51.3	Low	73.3	Confident	180 Å²	180	81 Å²	81	84%	0.841	42%	0.42	S	S	*	.	S	Bend	trans	-142.1	-21.1	-174.2	-99.2	174.2	-160.6	0	0	116.3
1222	K	53.2	Low	72.9	Confident	128 Å²	128	82.9 Å²	82.9	56%	0.557	43%	0.425	S	S	*	.			trans	-129.1	103.7	-168.4	-66.9	171.7	-172	162.7	0	111.6	V1224	K1222-V1224 HydrophobicContact CB-CG2 4.31Å; K1222-V1224 PolarHBondContact O-N 3.21Å
1223	V	51.7	Low	72.6	Confident	133 Å²	133	77.1 Å²	77.1	81%	0.806	40%	0.404	S	S	*	.			trans	-79.7	69.5	178	-168.5	0	0	0	0	110.8
1224	V	54.7	Low	72.5	Confident	58 Å²	58	77.9 Å²	77.9	35%	0.352	41%	0.407	S	S	.	.			trans	-96.1	94.9	173.5	-170.6	0	0	0	0	108.3	K1222 M1226	K1222-V1224 HydrophobicContact CB-CG2 4.31Å; K1222-V1224 PolarHBondContact O-N 3.21Å; V1224-M1226 VanDerWaalsContact C-N 3.31Å; V1224-M1226 HydrophobicContact CG1-CE 3.76Å; V1224-M1226 HydrophobicContact CG1-CG 3.92Å; V1224-M1226 HydrophobicContact CG1-SD 3.93Å; V1224-M1226 PolarHBondContact O-N 2.95Å
1225	T	56.8	Low	72.4	Confident	104 Å²	104	81.1 Å²	81.1	64%	0.638	42%	0.417	S	S	*	.			trans	-73.9	75.7	-171	-46.8	0	0	0	0	112.5	S1227	T1225-S1227 PolarHBondContact O-N 2.85Å
1226	M	67.8	Low	72.3	Confident	42 Å²	42	83.2 Å²	83.2	21%	0.207	43%	0.425	C	S	.	.			trans	-79.5	46	-175.7	-62.7	-71.2	79.3	0	0	114.3	L1010 V1224 R1228 I1229 L1230	L1010-M1226 HydrophobicContact CD2-SD 3.93Å; V1224-M1226 VanDerWaalsContact C-N 3.31Å; V1224-M1226 HydrophobicContact CG1-CE 3.76Å; V1224-M1226 HydrophobicContact CG1-CG 3.92Å; V1224-M1226 HydrophobicContact CG1-SD 3.93Å; V1224-M1226 PolarHBondContact O-N 2.95Å; M1226-R1228 PolarHBondContact O-N 3.16Å; M1226-R1228 VanDerWaalsContact O-N 3.07Å; M1226-I1229 HydrophobicContact CB-CB 4.18Å; M1226-I1229 HydrophobicContact CB-CD1 4.2Å; M1226-I1229 HydrophobicContact CB-CG1 4.3Å; M1226-I1229 HydrophobicContact CG-CD1 4.29Å; M1226-I1229 PolarHBondContact O-N 2.79Å; M1226-I1229 HydrophobicContact SD-CD1 3.86Å; M1226-L1230 PolarHBondContact O-N 3.39Å
1227	S	73.6	Confident	72.2	Confident	71 Å²	71	79.8 Å²	79.8	50%	0.497	41%	0.413	S	S	.	.	H	α-helix	trans	-49.2	-41.5	-173.9	-52.2	0	0	0	0	114.1	T1225 I1229 L1230 E1231	T1225-S1227 PolarHBondContact O-N 2.85Å; S1227-I1229 VanDerWaalsContact C-N 3.34Å; S1227-I1229 PolarHBondContact O-N 2.97Å; S1227-L1230 PolarHBondContact O-N 3.49Å; S1227-E1231 VanDerWaalsContact O-CB 3.29Å; S1227-E1231 WeakPolarHBondContact O-CB 3.25Å; S1227-E1231 PolarHBondContact O-N 3.34Å
1228	R	73.9	Confident	72.4	Confident	103 Å²	103	79 Å²	79	39%	0.389	41%	0.405	S	S	.	.	H	α-helix	trans	-75.2	-20.8	-178.5	-165.7	-178.1	179.8	-171.2	2.3	113.6	W1013 E1020 M1226 W1232	W1013-R1228 HydrophobicContact CH2-CB 3.76Å; W1013-R1228 HydrophobicContact CH2-CG 3.77Å; W1013-R1228 HydrophobicContact CZ2-CB 3.87Å; W1013-R1228 HydrophobicContact CZ2-CG 4.21Å; E1020-R1228 IonicContact OE1-CZ 2.84Å; E1020-R1228 IonicContact OE1-NH1 2.61Å; E1020-R1228 IonicContact OE1-NH2 3.72Å; E1020-R1228 PolarHBondContact OE1-NH2 2.94Å; E1020-R1228 IonicContact OE2-CZ 3.52Å; E1020-R1228 VanDerWaalsContact OE2-CZ 3.24Å; E1020-R1228 IonicContact OE2-NH1 3.22Å; E1020-R1228 PolarHBondContact OE2-NH1 2.78Å; E1020-R1228 IonicContact OE2-NH2 3.96Å; E1020-R1228 PolarHBondContact OE2-NH2 3.2Å; M1226-R1228 PolarHBondContact O-N 3.16Å; M1226-R1228 VanDerWaalsContact O-N 3.07Å; R1228-W1232 VanDerWaalsContact O-CB 3.3Å; R1228-W1232 WeakPolarHBondContact O-CB 3.26Å; R1228-W1232 PolarHBondContact O-N 3.09Å; R1228-W1232 VanDerWaalsContact O-N 3.11Å
1229	I	76.1	Confident	72.8	Confident	4 Å²	4	76.2 Å²	76.2	2%	0.021	40%	0.4	C	S	.	.	H	α-helix	trans	-81.5	-42	172.5	-55.6	-177	0	0	0	109.6	I958 V1008 W1013 M1226 S1227 E1231 W1232 I1233	I958-I1229 HydrophobicContact CD1-CG2 4.16Å; V1008-I1229 HydrophobicContact CB-CD1 4.44Å; V1008-I1229 HydrophobicContact CG1-CD1 3.48Å; V1008-I1229 VanDerWaalsContact CG1-CD1 3.48Å; V1008-I1229 HydrophobicContact CG2-CD1 4.1Å; W1013-I1229 HydrophobicContact CE3-CD1 4.44Å; W1013-I1229 HydrophobicContact CE3-CG1 4.35Å; W1013-I1229 HydrophobicContact CH2-CG1 3.76Å; W1013-I1229 HydrophobicContact CZ2-CG1 4.21Å; W1013-I1229 HydrophobicContact CZ3-CD1 4.42Å; W1013-I1229 HydrophobicContact CZ3-CG1 3.85Å; M1226-I1229 HydrophobicContact CB-CB 4.18Å; M1226-I1229 HydrophobicContact CB-CD1 4.2Å; M1226-I1229 HydrophobicContact CB-CG1 4.3Å; M1226-I1229 HydrophobicContact CG-CD1 4.29Å; M1226-I1229 PolarHBondContact O-N 2.79Å; M1226-I1229 HydrophobicContact SD-CD1 3.86Å; S1227-I1229 VanDerWaalsContact C-N 3.34Å; S1227-I1229 PolarHBondContact O-N 2.97Å; I1229-E1231 VanDerWaalsContact C-N 3.35Å; I1229-E1231 PolarHBondContact O-N 3.27Å; I1229-W1232 PolarHBondContact O-N 2.98Å; I1229-I1233 HydrophobicContact CG2-CD1 4.06Å; I1229-I1233 HydrophobicContact CG2-CG1 4.47Å; I1229-I1233 WeakPolarHBondContact O-CG1 3.36Å; I1229-I1233 PolarHBondContact O-N 2.8Å
1230	L	82.1	Confident	73.7	Confident	26 Å²	26	71.9 Å²	71.9	14%	0.136	37%	0.371	C	S	.	.	H	α-helix	trans	-54.6	-52.4	171.1	-60	172.8	0	0	0	110.4	L1178 A1215 M1226 S1227 W1232 I1233 E1234	L1178-L1230 HydrophobicContact CD1-CD2 4.28Å; L1178-L1230 HydrophobicContact CD2-CD2 3.76Å; A1215-L1230 HydrophobicContact CB-CB 4.18Å; A1215-L1230 HydrophobicContact CB-CD2 3.77Å; M1226-L1230 PolarHBondContact O-N 3.39Å; S1227-L1230 PolarHBondContact O-N 3.49Å; L1230-W1232 VanDerWaalsContact C-N 3.3Å; L1230-W1232 PolarHBondContact O-N 2.83Å; L1230-I1233 PolarHBondContact O-N 2.8Å; L1230-E1234 WeakPolarHBondContact O-CB 3.03Å; L1230-E1234 VanDerWaalsContact O-CG 3.28Å; L1230-E1234 WeakPolarHBondContact O-CG 3.45Å; L1230-E1234 PolarHBondContact O-N 2.63Å
1231	E	83.8	Confident	75.1	Confident	85 Å²	85	71.6 Å²	71.6	40%	0.397	35%	0.349	S	S	.	.	H	α-helix	trans	-65.2	-29.8	179.2	-174.5	175.9	-148.7	0	0	113	S1227 I1229 R1235	S1227-E1231 VanDerWaalsContact O-CB 3.29Å; S1227-E1231 WeakPolarHBondContact O-CB 3.25Å; S1227-E1231 PolarHBondContact O-N 3.34Å; I1229-E1231 VanDerWaalsContact C-N 3.35Å; I1229-E1231 PolarHBondContact O-N 3.27Å; E1231-R1235 VanDerWaalsContact CD-NH2 3.27Å; E1231-R1235 WeakPolarHBondContact O-CB 3.41Å; E1231-R1235 WeakPolarHBondContact O-CD 3.48Å; E1231-R1235 WeakPolarHBondContact O-CG 3.11Å; E1231-R1235 PolarHBondContact O-N 3.21Å; E1231-R1235 VanDerWaalsContact O-N 3.11Å; E1231-R1235 IonicContact OE1-CZ 2.72Å; E1231-R1235 IonicContact OE1-NE 2.83Å; E1231-R1235 IonicContact OE1-NH2 3.2Å; E1231-R1235 PolarHBondContact OE1-NH2 2.88Å; E1231-R1235 IonicContact OE2-NH2 2.69Å
1232	W	83	Confident	76.7	Confident	68 Å²	68	64.5 Å²	64.5	26%	0.258	32%	0.316	S	S	.	.	H	α-helix	trans	-70.3	-44.9	171.6	178.5	84.5	0	0	0	111.9	L954 P955 I958 R1228 I1229 L1230 R1235 K1236	L954-W1232 HydrophobicContact CD2-CH2 4.42Å; L954-W1232 HydrophobicContact CD2-CZ3 4.47Å; P955-W1232 HydrophobicContact CG-CD2 4.31Å; P955-W1232 HydrophobicContact CG-CH2 3.85Å; P955-W1232 HydrophobicContact CG-CZ2 3.4Å; P955-W1232 HydrophobicContact CG-CZ3 4.43Å; I958-W1232 HydrophobicContact CD1-CD2 4.46Å; I958-W1232 HydrophobicContact CD1-CE3 3.56Å; I958-W1232 HydrophobicContact CD1-CH2 4.33Å; I958-W1232 HydrophobicContact CD1-CZ3 3.49Å; I958-W1232 VanDerWaalsContact CD1-CZ3 3.49Å; R1228-W1232 VanDerWaalsContact O-CB 3.3Å; R1228-W1232 WeakPolarHBondContact O-CB 3.26Å; R1228-W1232 PolarHBondContact O-N 3.09Å; R1228-W1232 VanDerWaalsContact O-N 3.11Å; I1229-W1232 PolarHBondContact O-N 2.98Å; L1230-W1232 VanDerWaalsContact C-N 3.3Å; L1230-W1232 PolarHBondContact O-N 2.83Å; W1232-R1235 PolarHBondContact O-N 3.26Å; W1232-K1236 HydrophobicContact CH2-CB 4.27Å; W1232-K1236 HydrophobicContact CH2-CG 4.06Å; W1232-K1236 HydrophobicContact CZ2-CB 4.06Å; W1232-K1236 HydrophobicContact CZ2-CG 3.88Å; W1232-K1236 WeakPolarHBondContact O-CB 3.22Å; W1232-K1236 PolarHBondContact O-N 3.48Å
1233	I	83.7	Confident	78	Confident	4 Å²	4	59.6 Å²	59.6	2%	0.021	30%	0.295	C	S	.	.	H	α-helix	trans	-61.3	-46.6	176.6	-71.5	172.9	0	0	0	110.3	L1178 I1229 L1230 K1236 M1237	L1178-I1233 HydrophobicContact CD1-CD1 3.49Å; L1178-I1233 VanDerWaalsContact CD1-CD1 3.49Å; I1229-I1233 HydrophobicContact CG2-CD1 4.06Å; I1229-I1233 HydrophobicContact CG2-CG1 4.47Å; I1229-I1233 WeakPolarHBondContact O-CG1 3.36Å; I1229-I1233 PolarHBondContact O-N 2.8Å; L1230-I1233 PolarHBondContact O-N 2.8Å; I1233-K1236 PolarHBondContact O-N 2.88Å; I1233-M1237 HydrophobicContact CG2-CE 3.51Å; I1233-M1237 HydrophobicContact CG2-SD 4.36Å; I1233-M1237 PolarHBondContact O-N 2.89Å
1234	E	87.2	Confident	79.4	Confident	43 Å²	43	56.4 Å²	56.4	20%	0.201	27%	0.274	C	S	.	.	H	α-helix	trans	-55.9	-54.1	176.2	-74.2	168.6	174.6	0	0	111.4	L1213 K1214 A1215 L1230 I1238	L1213-E1234 HydrophobicContact CD2-CB 4.28Å; L1213-E1234 HydrophobicContact CD2-CG 3.85Å; K1214-E1234 WeakPolarHBondContact CA-OE1 3.44Å; A1215-E1234 HydrophobicContact CB-CG 4.03Å; A1215-E1234 PolarHBondContact N-OE1 2.78Å; L1230-E1234 WeakPolarHBondContact O-CB 3.03Å; L1230-E1234 VanDerWaalsContact O-CG 3.28Å; L1230-E1234 WeakPolarHBondContact O-CG 3.45Å; L1230-E1234 PolarHBondContact O-N 2.63Å; E1234-I1238 VanDerWaalsContact O-CG1 3.3Å; E1234-I1238 WeakPolarHBondContact O-CG1 3.46Å; E1234-I1238 PolarHBondContact O-N 2.64Å; E1234-I1238 VanDerWaalsContact O-N 3.14Å
1235	R	87.4	Confident	80.8	Confident	152 Å²	152	54.3 Å²	54.3	57%	0.574	26%	0.261	S	S	*	.	H	α-helix	trans	-64	-42.5	180	-69.6	171.6	-172.8	-157.5	8.1	112.3	E1231 W1232 I1238 L1239	E1231-R1235 VanDerWaalsContact CD-NH2 3.27Å; E1231-R1235 WeakPolarHBondContact O-CB 3.41Å; E1231-R1235 WeakPolarHBondContact O-CD 3.48Å; E1231-R1235 WeakPolarHBondContact O-CG 3.11Å; E1231-R1235 PolarHBondContact O-N 3.21Å; E1231-R1235 VanDerWaalsContact O-N 3.11Å; E1231-R1235 IonicContact OE1-CZ 2.72Å; E1231-R1235 IonicContact OE1-NE 2.83Å; E1231-R1235 IonicContact OE1-NH2 3.2Å; E1231-R1235 PolarHBondContact OE1-NH2 2.88Å; E1231-R1235 IonicContact OE2-NH2 2.69Å; W1232-R1235 PolarHBondContact O-N 3.26Å; R1235-I1238 PolarHBondContact O-N 2.9Å; R1235-L1239 WeakPolarHBondContact O-CG 3.48Å; R1235-L1239 PolarHBondContact O-N 3.49Å
1236	K	85	Confident	82.2	Confident	48 Å²	48	49.4 Å²	49.4	21%	0.209	23%	0.231	C	C	.	.	H	α-helix	trans	-65.8	-44.7	-178.4	-173.3	51.2	162.8	157.9	0	111.2	I952 W1232 I1233 I1238 L1239 E1240	I952-K1236 HydrophobicContact CG2-CD 4.49Å; I952-K1236 HydrophobicContact CG2-CG 3.89Å; W1232-K1236 HydrophobicContact CH2-CB 4.27Å; W1232-K1236 HydrophobicContact CH2-CG 4.06Å; W1232-K1236 HydrophobicContact CZ2-CB 4.06Å; W1232-K1236 HydrophobicContact CZ2-CG 3.88Å; W1232-K1236 WeakPolarHBondContact O-CB 3.22Å; W1232-K1236 PolarHBondContact O-N 3.48Å; I1233-K1236 PolarHBondContact O-N 2.88Å; K1236-I1238 VanDerWaalsContact C-N 3.34Å; K1236-I1238 PolarHBondContact O-N 2.9Å; K1236-L1239 PolarHBondContact O-N 2.8Å; K1236-E1240 HydrophobicContact CD-CG 4.49Å; K1236-E1240 WeakPolarHBondContact CE-OE1 3.47Å; K1236-E1240 IonicContact NZ-OE1 3.62Å; K1236-E1240 PolarHBondContact NZ-OE1 2.85Å; K1236-E1240 WeakPolarHBondContact O-CG 3.47Å; K1236-E1240 PolarHBondContact O-N 2.83Å
1237	M	84.9	Confident	82.7	Confident	29 Å²	29	47.9 Å²	47.9	14%	0.143	22%	0.223	C	C	.	.	H	α-helix	trans	-66.8	-32.8	177.2	-69	-172.4	-57	0	0	113.3	L949 F1002 V1180 L1213 I1233 F1241	L949-M1237 HydrophobicContact CD2-SD 4.45Å; F1002-M1237 HydrophobicContact CZ-CE 4.38Å; F1002-M1237 HydrophobicContact CZ-SD 4.03Å; V1180-M1237 HydrophobicContact CG1-CE 3.83Å; V1180-M1237 HydrophobicContact CG2-CE 4.11Å; L1213-M1237 HydrophobicContact CD1-CB 4.5Å; L1213-M1237 HydrophobicContact CD1-CE 3.93Å; L1213-M1237 HydrophobicContact CD2-CE 3.75Å; L1213-M1237 HydrophobicContact CG-CE 4.49Å; I1233-M1237 HydrophobicContact CG2-CE 3.51Å; I1233-M1237 HydrophobicContact CG2-SD 4.36Å; I1233-M1237 PolarHBondContact O-N 2.89Å; M1237-F1241 PolarHBondContact O-N 2.88Å; M1237-F1241 VanDerWaalsContact O-N 3.09Å
1238	I	87.8	Confident	82.7	Confident	45 Å²	45	45 Å²	45	23%	0.231	20%	0.203	C	C	.	.	H	α-helix	trans	-65.6	-40.4	172.1	-69.7	167.8	0	0	0	110.9	E1234 R1235 K1236 F1241 Q1242	E1234-I1238 VanDerWaalsContact O-CG1 3.3Å; E1234-I1238 WeakPolarHBondContact O-CG1 3.46Å; E1234-I1238 PolarHBondContact O-N 2.64Å; E1234-I1238 VanDerWaalsContact O-N 3.14Å; R1235-I1238 PolarHBondContact O-N 2.9Å; K1236-I1238 VanDerWaalsContact C-N 3.34Å; K1236-I1238 PolarHBondContact O-N 2.9Å; I1238-F1241 PolarHBondContact O-N 3Å; I1238-Q1242 WeakPolarHBondContact O-CG 3.14Å; I1238-Q1242 PolarHBondContact O-N 2.9Å; I1238-Q1242 VanDerWaalsContact O-N 3.1Å
1239	L	86	Confident	83.1	Confident	74 Å²	74	40.6 Å²	40.6	39%	0.387	19%	0.187	S	C	.	.	H	α-helix	trans	-65	-47.8	174.9	-71.3	167.3	0	0	0	112	R1235 K1236 F1241 Q1242 H1243	R1235-L1239 WeakPolarHBondContact O-CG 3.48Å; R1235-L1239 PolarHBondContact O-N 3.49Å; K1236-L1239 PolarHBondContact O-N 2.8Å; L1239-F1241 PolarHBondContact O-N 2.9Å; L1239-Q1242 WeakPolarHBondContact O-CB 3.33Å; L1239-Q1242 PolarHBondContact O-N 2.93Å; L1239-H1243 PolarHBondContact O-CD2 2.98Å; L1239-H1243 PolarHBondContact O-N 2.94Å
1240	E	81.4	Confident	83.5	Confident	42 Å²	42	41.1 Å²	41.1	20%	0.196	19%	0.19	C	C	.	.	H	α-helix	trans	-55.7	-40.1	175.6	-66.2	-55.4	140.3	0	0	112.1	I952 K1236 H1243 L1244	I952-E1240 HydrophobicContact CD1-CG 3.86Å; I952-E1240 HydrophobicContact CG1-CG 4.01Å; K1236-E1240 HydrophobicContact CD-CG 4.49Å; K1236-E1240 WeakPolarHBondContact CE-OE1 3.47Å; K1236-E1240 IonicContact NZ-OE1 3.62Å; K1236-E1240 PolarHBondContact NZ-OE1 2.85Å; K1236-E1240 WeakPolarHBondContact O-CG 3.47Å; K1236-E1240 PolarHBondContact O-N 2.83Å; E1240-H1243 PolarHBondContact O-N 2.78Å; E1240-L1244 WeakPolarHBondContact O-CB 3.44Å; E1240-L1244 VanDerWaalsContact O-CG 3.3Å; E1240-L1244 WeakPolarHBondContact O-CG 3.38Å; E1240-L1244 PolarHBondContact O-N 3.23Å
1241	F	85	Confident	83.6	Confident	64 Å²	64	42.4 Å²	42.4	28%	0.281	20%	0.197	S	C	.	.	H	α-helix	trans	-62.4	-45	175.1	-168.5	-75.4	0	0	0	111.7	F1205 P1209 I1211 M1237 I1238 L1239 L1244 V1245	F1205-F1241 AromaticContact CD2-CE1 3.91Å; F1205-F1241 HydrophobicContact CD2-CE1 3.91Å; F1205-F1241 HydrophobicContact CD2-CZ 4.21Å; F1205-F1241 AromaticContact CE2-CE1 3.92Å; F1205-F1241 HydrophobicContact CE2-CE1 3.92Å; F1205-F1241 AromaticContact CE2-CZ 3.75Å; F1205-F1241 HydrophobicContact CE2-CZ 3.75Å; P1209-F1241 HydrophobicContact CG-CD1 4.47Å; P1209-F1241 HydrophobicContact CG-CE1 3.92Å; I1211-F1241 HydrophobicContact CD1-CB 4.29Å; I1211-F1241 HydrophobicContact CD1-CD1 3.44Å; I1211-F1241 VanDerWaalsContact CD1-CD1 3.44Å; I1211-F1241 HydrophobicContact CD1-CD2 4.03Å; I1211-F1241 HydrophobicContact CD1-CE1 3.66Å; I1211-F1241 HydrophobicContact CD1-CE2 4.21Å; I1211-F1241 HydrophobicContact CD1-CG 3.65Å; I1211-F1241 HydrophobicContact CD1-CZ 4.03Å; M1237-F1241 PolarHBondContact O-N 2.88Å; M1237-F1241 VanDerWaalsContact O-N 3.09Å; I1238-F1241 PolarHBondContact O-N 3Å; L1239-F1241 PolarHBondContact O-N 2.9Å; F1241-L1244 PolarHBondContact O-N 3.08Å; F1241-V1245 HydrophobicContact CE1-CB 4.23Å; F1241-V1245 PolarHBondContact O-N 3.16Å
1242	Q	86.1	Confident	83.8	Confident	31 Å²	31	40.3 Å²	40.3	15%	0.145	19%	0.188	C	C	.	.	H	α-helix	trans	-62.7	-43.5	177.7	-70.7	173.1	14.4	0	0	112.3	V1208 I1238 L1239 L1244 V1246	V1208-Q1242 HydrophobicContact CG1-CG 4.06Å; I1238-Q1242 WeakPolarHBondContact O-CG 3.14Å; I1238-Q1242 PolarHBondContact O-N 2.9Å; I1238-Q1242 VanDerWaalsContact O-N 3.1Å; L1239-Q1242 WeakPolarHBondContact O-CB 3.33Å; L1239-Q1242 PolarHBondContact O-N 2.93Å; Q1242-L1244 VanDerWaalsContact C-N 3.27Å; Q1242-L1244 PolarHBondContact O-N 3.41Å; Q1242-V1246 HydrophobicContact CB-CG2 4.37Å; Q1242-V1246 HydrophobicContact CG-CG2 4.33Å; Q1242-V1246 WeakPolarHBondContact O-CB 3.4Å; Q1242-V1246 PolarHBondContact O-N 3.33Å
1243	H	80.2	Confident	83.9	Confident	25 Å²	25	41 Å²	41	12%	0.116	20%	0.196	C	C	.	.	H	α-helix	trans	-69.5	-21.3	-178.8	-65.2	-55.8	0	0	0	114	L1239 E1240	L1239-H1243 PolarHBondContact O-CD2 2.98Å; L1239-H1243 PolarHBondContact O-N 2.94Å; E1240-H1243 PolarHBondContact O-N 2.78Å
1244	L	80.8	Confident	83.8	Confident	67 Å²	67	46.7 Å²	46.7	35%	0.351	22%	0.221	S	C	.	.	H	α-helix	trans	-98.8	-40	-178.5	-67.7	175.8	0	0	0	114.2	E1240 F1241 Q1242	E1240-L1244 WeakPolarHBondContact O-CB 3.44Å; E1240-L1244 VanDerWaalsContact O-CG 3.3Å; E1240-L1244 WeakPolarHBondContact O-CG 3.38Å; E1240-L1244 PolarHBondContact O-N 3.23Å; F1241-L1244 PolarHBondContact O-N 3.08Å; Q1242-L1244 VanDerWaalsContact C-N 3.27Å; Q1242-L1244 PolarHBondContact O-N 3.41Å
1245	V	85	Confident	83.5	Confident	13 Å²	13	47 Å²	47	8%	0.079	23%	0.226	C	C	.	.	H	α-helix	trans	-123	-4.1	-164.5	-159.8	0	0	0	0	113.5	Y1203 G1204 F1205 F1241	Y1203-V1245 HydrophobicContact CD2-CG1 4.48Å; Y1203-V1245 HydrophobicContact CE2-CG1 4.31Å; G1204-V1245 CarbonylContact C-O 3.6Å; G1204-V1245 WeakPolarHBondContact CA-O 3.47Å; F1205-V1245 HydrophobicContact CD2-CG1 4.05Å; F1205-V1245 HydrophobicContact CE2-CG1 4.36Å; F1205-V1245 PolarHBondContact N-O 3.2Å; F1241-V1245 HydrophobicContact CE1-CB 4.23Å; F1241-V1245 PolarHBondContact O-N 3.16Å
1246	V	84.6	Confident	82.6	Confident	2 Å²	2	42 Å²	42	1%	0.012	22%	0.221	C	C	.	.	B	Isolated β-bridge	trans	-94.5	136	172.5	-178.3	0	0	0	0	110	W605 F1205 V1208 Q1242 N1249	W605-V1246 HydrophobicContact CB-CB 4.48Å; W605-V1246 HydrophobicContact CB-CG1 3.82Å; W605-V1246 HydrophobicContact CG-CG1 4.18Å; F1205-V1246 HydrophobicContact CB-CG2 4.37Å; V1208-V1246 HydrophobicContact CG2-CG1 4.04Å; Q1242-V1246 HydrophobicContact CB-CG2 4.37Å; Q1242-V1246 HydrophobicContact CG-CG2 4.33Å; Q1242-V1246 WeakPolarHBondContact O-CB 3.4Å; Q1242-V1246 PolarHBondContact O-N 3.33Å; V1246-N1249 CarbonylContact C-O 3.38Å; V1246-N1249 VanDerWaalsContact C-O 3.32Å; V1246-N1249 PolarHBondContact O-N 3.27Å
1247	L	78.6	Confident	81.8	Confident	9 Å²	9	47.7 Å²	47.7	5%	0.047	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	142.5	-177	-89.6	79.9	0	0	0	111.7	P541 L542 W605 L1190 G1204 F1205 N1249 M1250	P541-L1247 HydrophobicContact CB-CD2 3.38Å; P541-L1247 WeakPolarHBondContact O-CD2 3.26Å; L542-L1247 HydrophobicContact CD2-CD2 3.98Å; W605-L1247 VanDerWaalsContact CA-O 3.24Å; W605-L1247 WeakPolarHBondContact CA-O 3.11Å; W605-L1247 WeakPolarHBondContact CB-O 3.3Å; L1190-L1247 HydrophobicContact CD2-CD1 4.39Å; L1190-L1247 HydrophobicContact CD2-CD2 3.65Å; G1204-L1247 VanDerWaalsContact C-CD1 3.49Å; F1205-L1247 VanDerWaalsContact O-CD1 3.26Å; F1205-L1247 WeakPolarHBondContact O-CD1 3.37Å; F1205-L1247 PolarHBondContact O-N 2.91Å; L1247-N1249 PolarHBondContact N-O 3.39Å; L1247-M1250 HydrophobicContact CD1-CE 4.49Å; L1247-M1250 HydrophobicContact CD1-CG 3.89Å; L1247-M1250 HydrophobicContact CD1-SD 4.34Å; L1247-M1250 HydrophobicContact CD2-SD 4.34Å; L1247-M1250 HydrophobicContact CG-CG 4Å; L1247-M1250 HydrophobicContact CG-SD 4.32Å
1248	P	74.4	Confident	80.9	Confident	12 Å²	12	50 Å²	50	8%	0.078	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	cis	-81.9	-0.1	14.7	34.5	-37.9	0	0	0	115.2	L604 T734	L604-P1248 WeakPolarHBondContact O-CD 3.3Å; T734-P1248 HydrophobicContact CG2-CB 4.15Å; T734-P1248 HydrophobicContact CG2-CG 4.28Å
1249	N	81.4	Confident	79.6	Confident	10 Å²	10	51.3 Å²	51.3	5%	0.053	27%	0.273	C	S	.	.			trans	-78.9	140.3	173.5	-60.3	-77.8	0	0	0	110.8	S603 R645 V1246 L1247	S603-N1249 PolarHBondContact O-ND2 3.21Å; R645-N1249 PolarHBondContact NH1-OD1 2.86Å; V1246-N1249 CarbonylContact C-O 3.38Å; V1246-N1249 VanDerWaalsContact C-O 3.32Å; V1246-N1249 PolarHBondContact O-N 3.27Å; L1247-N1249 PolarHBondContact N-O 3.39Å
1250	M	84	Confident	77.9	Confident	14 Å²	14	52.6 Å²	52.6	7%	0.069	29%	0.288	C	S	.	.			trans	-144.4	143.6	178.1	-60.9	-178.3	79.8	0	0	107.8	L542 R736 W989 L1190 N1192 W1202 Y1203 L1247	L542-M1250 HydrophobicContact CD2-SD 4.38Å; R736-M1250 PolarHBondContact NH1-SD 3.48Å; W989-M1250 HydrophobicContact CZ3-CE 4.16Å; W989-M1250 HydrophobicContact CZ3-SD 4.24Å; L1190-M1250 WeakPolarHBondContact O-CE 3.42Å; N1192-M1250 HydrophobicContact CB-CE 4.36Å; W1202-M1250 HydrophobicContact CB-CB 4.46Å; W1202-M1250 HydrophobicContact CB-CE 4.09Å; W1202-M1250 HydrophobicContact CB-SD 4.47Å; W1202-M1250 HydrophobicContact CE3-CB 4.13Å; Y1203-M1250 CarbonylContact O-C 3.39Å; Y1203-M1250 VanDerWaalsContact O-CA 3.31Å; Y1203-M1250 WeakPolarHBondContact O-CA 3.35Å; Y1203-M1250 WeakPolarHBondContact O-CB 3.3Å; L1247-M1250 HydrophobicContact CD1-CE 4.49Å; L1247-M1250 HydrophobicContact CD1-CG 3.89Å; L1247-M1250 HydrophobicContact CD1-SD 4.34Å; L1247-M1250 HydrophobicContact CD2-SD 4.34Å; L1247-M1250 HydrophobicContact CG-CG 4Å; L1247-M1250 HydrophobicContact CG-SD 4.32Å
1251	D	85.7	Confident	76.3	Confident	54 Å²	54	56.3 Å²	56.3	29%	0.289	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	150.4	177.8	-167.6	55.8	0	0	0	109.4	W1202 Y1203	W1202-D1251 WeakPolarHBondContact CA-O 3.31Å; Y1203-D1251 HydrophobicContact CD1-CB 4.23Å; Y1203-D1251 WeakPolarHBondContact CD1-O 3.4Å; Y1203-D1251 HydrophobicContact CE1-CB 3.55Å; Y1203-D1251 WeakPolarHBondContact CE1-OD2 3.42Å; Y1203-D1251 VanDerWaalsContact CZ-OD2 3.31Å; Y1203-D1251 PolarHBondContact N-O 2.88Å; Y1203-D1251 PolarHBondContact O-N 2.87Å; Y1203-D1251 PolarHBondContact OH-OD2 3.48Å
1252	D	87.1	Confident	74.3	Confident	40 Å²	40	58.7 Å²	58.7	21%	0.214	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	138.6	-173.8	79.8	-67	0	0	0	114.4	R1200 W1202	R1200-D1252 WeakPolarHBondContact CD-OD2 3.29Å; R1200-D1252 IonicContact CZ-OD2 2.88Å; R1200-D1252 IonicContact NE-OD2 3.62Å; R1200-D1252 IonicContact NH1-OD2 3.94Å; R1200-D1252 PolarHBondContact NH1-OD2 3.29Å; W1202-D1252 HydrophobicContact CD2-CB 4Å; W1202-D1252 HydrophobicContact CE3-CB 3.76Å; W1202-D1252 HydrophobicContact CH2-CB 4.1Å; W1202-D1252 HydrophobicContact CZ2-CB 4.35Å; W1202-D1252 HydrophobicContact CZ3-CB 3.8Å
1253	L	85	Confident	72.2	Confident	82 Å²	82	63.4 Å²	63.4	43%	0.429	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	114.8	175.6	-61.9	177.3	0	0	0	109.1	R1200 L1201 Y1203 V1255	R1200-L1253 VanDerWaalsContact CA-O 3.31Å; R1200-L1253 WeakPolarHBondContact CA-O 3.4Å; L1201-L1253 HydrophobicContact CD2-CD1 4.27Å; L1201-L1253 PolarHBondContact N-O 3.37Å; L1201-L1253 PolarHBondContact O-N 2.74Å; Y1203-L1253 HydrophobicContact CD1-CD1 4.08Å; Y1203-L1253 HydrophobicContact CD1-CG 4.08Å; Y1203-L1253 HydrophobicContact CE1-CD1 4Å; Y1203-L1253 HydrophobicContact CE1-CD2 4.19Å; Y1203-L1253 HydrophobicContact CE1-CG 3.8Å; L1253-V1255 PolarHBondContact O-N 3.37Å
1254	K	82.1	Confident	70	Confident	124 Å²	124	67 Å²	67	54%	0.539	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	123	169.1	-162.9	-160.7	-176.5	-160.9	0	109	D1199	D1199-K1254 CarbonylContact O-C 3.59Å; D1199-K1254 WeakPolarHBondContact O-CA 3.46Å; D1199-K1254 WeakPolarHBondContact OD2-CE 3.45Å; D1199-K1254 VanDerWaalsContact OD2-CG 3.29Å; D1199-K1254 WeakPolarHBondContact OD2-CG 3.32Å
1255	V	80	Confident	67.5	Low	51 Å²	51	69.7 Å²	69.7	31%	0.309	41%	0.408	S	S	.	.			trans	-119.6	101	178.4	-179.7	0	0	0	0	107.9	D1199 L1201 L1253 L1257 L1258	D1199-V1255 PolarHBondContact O-N 2.81Å; L1201-V1255 HydrophobicContact CB-CG2 4.27Å; L1253-V1255 PolarHBondContact O-N 3.37Å; V1255-L1257 HydrophobicContact CG1-CB 4.35Å; V1255-L1257 PolarHBondContact O-N 3.16Å; V1255-L1258 HydrophobicContact CB-CD1 3.98Å; V1255-L1258 HydrophobicContact CB-CG 4.07Å; V1255-L1258 HydrophobicContact CG1-CD1 4.46Å; V1255-L1258 HydrophobicContact CG1-CG 4.09Å; V1255-L1258 WeakPolarHBondContact O-CB 3.26Å; V1255-L1258 PolarHBondContact O-N 3.45Å
1256	G	68.7	Low	64.8	Low	45 Å²	45	79.6 Å²	79.6	46%	0.464	47%	0.468	S	S	.	.	G	3₁₀ helix	trans	-53.9	-38.5	-175.3	0	0	0	0	0	113.6	L1258 L1259	G1256-L1258 PolarHBondContact O-N 3.25Å; G1256-L1259 PolarHBondContact O-N 3.19Å
1257	L	68.9	Low	63.8	Low	169 Å²	169	83.5 Å²	83.5	89%	0.885	49%	0.491	S	S	*	.	G	3₁₀ helix	trans	-61.8	-6.6	178.5	-59	175.6	0	0	0	115.5	V1255	V1255-L1257 HydrophobicContact CG1-CB 4.35Å; V1255-L1257 PolarHBondContact O-N 3.16Å
1258	L	66.9	Low	63	Low	76 Å²	76	87.4 Å²	87.4	40%	0.398	51%	0.514	S	S	.	.	G	3₁₀ helix	trans	-84.6	-14.4	171.5	-65.1	178	0	0	0	112.8	I1193 V1255 G1256	I1193-L1258 HydrophobicContact CG2-CD1 4.24Å; I1193-L1258 HydrophobicContact CG2-CD2 4.49Å; V1255-L1258 HydrophobicContact CB-CD1 3.98Å; V1255-L1258 HydrophobicContact CB-CG 4.07Å; V1255-L1258 HydrophobicContact CG1-CD1 4.46Å; V1255-L1258 HydrophobicContact CG1-CG 4.09Å; V1255-L1258 WeakPolarHBondContact O-CB 3.26Å; V1255-L1258 PolarHBondContact O-N 3.45Å; G1256-L1258 PolarHBondContact O-N 3.25Å
1259	L	60	Low	62.4	Low	73 Å²	73	91.6 Å²	91.6	38%	0.382	54%	0.539	S	S	.	.	S	Bend	trans	-92	138.2	165.5	-65.6	168.5	0	0	0	108.5	D1199 G1256	D1199-L1259 HydrophobicContact CB-CD1 3.9Å; D1199-L1259 HydrophobicContact CB-CD2 4.33Å; D1199-L1259 HydrophobicContact CB-CG 3.9Å; G1256-L1259 PolarHBondContact O-N 3.19Å
1260	S	49.6	Very low	61.3	Low	102 Å²	102	96.4 Å²	96.4	71%	0.713	57%	0.567	S	S	*	*			trans	-91.6	112.7	167	42.7	0	0	0	0	107.8	T1262	S1260-T1262 VanDerWaalsContact C-N 3.27Å; S1260-T1262 PolarHBondContact O-N 3.25Å
1261	D	47.7	Very low	59.9	Low	120 Å²	120	101.5 Å²	101.5	64%	0.642	60%	0.598	S	S	*	*			trans	-72.9	77.3	-176.2	-66.6	-46.1	0	0	0	112	T1263	D1261-T1263 PolarHBondContact O-N 3.36Å
1262	T	43.8	Very low	58.2	Low	113 Å²	113	104.7 Å²	104.7	69%	0.693	62%	0.619	S	S	*	*			trans	-77	5.1	167.8	44.9	0	0	0	0	113	S1260 S1264	S1260-T1262 VanDerWaalsContact C-N 3.27Å; S1260-T1262 PolarHBondContact O-N 3.25Å; T1262-S1264 PolarHBondContact O-N 2.64Å
1263	T	40.8	Very low	56.1	Low	131 Å²	131	109.3 Å²	109.3	80%	0.804	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.6	30.5	175.1	43	0	0	0	0	113.9	D1261	D1261-T1263 PolarHBondContact O-N 3.36Å
1264	S	34.8	Very low	53.9	Low	100 Å²	100	111.4 Å²	111.4	70%	0.699	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-125.1	-0.5	-179	52.2	0	0	0	0	115.6	T1262	T1262-S1264 PolarHBondContact O-N 2.64Å
1265	T	28	Very low	51.5	Low	124 Å²	124	110.3 Å²	110.3	76%	0.761	68%	0.675	S	S	*	*			trans	-157	94.9	162.6	49.4	0	0	0	0	113.8
1266	T	28.9	Very low	48.9	Very low	220 Å²	220	115.7 Å²	115.7	100%	1.35	71%	0.708	S	S	*	*			trans	-173	0	143.3	30.8	0	0	0	0	107.8

Retrieved 1,266 of 1,266 residues in 221.5 ms (Link to these results)

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