A0A3Q0KI86_SCHMA Loading...

Putative lim homeobox protein

AlphaFold DB , UniProt , Accession A0A3Q0KI86, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 967 aa.

						>A0A3Q0KI86_SCHMA|A0A3Q0KI86
MSTEYTVLDSSISSHPYSSNKQFVDDNQNNLMNNFISDIYSTSLFEQFPFSMKNFPSTGTSLPTNSPNLSSSLPLSSITVRKLSNMEIIQENDIHNINFQLYPNKYKLPLLSTHQLTDNHIHSISTIETNTPSTSTTTMDPLIKTQSNESNKSIIKRTKTYQKLIKDCTGCNQPIYEKIYLGLSDGQLWHMNCLNCNTCGKCLDKETSCFNRYGQIYCRKDYEQIFGSFKSRPVCTYCKQLISSNELIVRSINQLIFHSDCFCCNICHRIMKCGDRYELDNVSHQPICWEHYQQSHHHQLDSFLSCTDLCEGIKCLRESDHRDPGKLKELSGQIYSADGNTNLNFVHASDVLSIRDTDPDIEDLPTESSSRTDFLEHGNKLNLIDYGVNKQQPKSSVSSVIDKHKDEKYSRFNSYSIPLIGKDSSAIELLPNCLSHKPIHYLPPLSHHLLQDNSSYSPCNLFNQPLRKLESDSSSERLSSLHETSCSSCPLSSSSHSPSVLPLCTSLKSISSYPSSACCSIPFTSACTPTFSNISAPLLSLPPHNPSSLSSSSPPSSGTRFMHKHLDVSPLNYSSLLSNNNPSTLVDFIDTKNPSELNKSIDSNVLIQHVQQQKRNRKRRSGIHQVFENDCFNSGTNFYLGITTRQKRMRTSFKHHQLRTMKAYFNINHNPDVKDLKVLTEKTGLSKRVLQVWFQNARAKYRRNLVRQENTSTSVNNHINNSLTSGLITSSNCGSSEMIGNSISECDSQSSQINPDDFTISQTTPSSTSPQKNDLIQDDDDDDDNVDDDDEERVNDMNDIDNELEHNQIMGVLNKNDCQTNQNIQAKQCENSNLIDFEDNLNCSHYHDHHLTNELHKLTSHSEHEQQMQQPSINLTSCITSINSFTLNSAYNTDNMLISQNNNNNNNDSNSNNSKNNNYNLLHTNKIYLENEHQLTTNMINYTDKLNNLVLSNKCHPVNCFTLTRIH
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.4	Very low	34.8	Very low	236 Å²	236	138.5 Å²	138.5	100%	1.163	76%	0.757	S	S	*	*				0	121.6	0	-51.7	-166.9	89.6	0	0	106.7
2	S	33.8	Very low	34.7	Very low	107 Å²	107	139.9 Å²	139.9	75%	0.748	76%	0.76	S	S	*	*			cis	-141.1	147.4	-8.9	-68.5	0	0	0	0	110.6
3	T	32.8	Very low	34.5	Very low	113 Å²	113	136.1 Å²	136.1	69%	0.693	75%	0.75	S	S	*	*			trans	-53.2	159.1	159.4	41.5	0	0	0	0	110.2
4	E	36.6	Very low	34.3	Very low	147 Å²	147	132.4 Å²	132.4	69%	0.687	74%	0.739	S	S	*	*				-174.7	158.8	59.3	-125.5	125.5	-106.8	0	0	110.2
5	Y	30.4	Very low	34.2	Very low	238 Å²	238	134.7 Å²	134.7	93%	0.933	74%	0.741	S	S	*	*			trans	-142.4	115.2	141	-130.3	-76.9	0	0	0	108.2
6	T	39.3	Very low	34.2	Very low	106 Å²	106	133.2 Å²	133.2	65%	0.65	74%	0.74	S	S	*	*			trans	-92.2	128	-171.8	-27.8	0	0	0	0	110.6
7	V	37	Very low	34.2	Very low	109 Å²	109	139.1 Å²	139.1	66%	0.661	75%	0.75	S	S	*	*			trans	-2.5	137.4	153.1	-163	0	0	0	0	117.4
8	L	35.8	Very low	34	Very low	160 Å²	160	137.2 Å²	137.2	84%	0.838	75%	0.749	S	S	*	*				150.3	154.5	128.9	-78	167.3	0	0	0	110.8
9	D	34.2	Very low	33.9	Very low	118 Å²	118	134.8 Å²	134.8	63%	0.631	74%	0.744	S	S	*	*			cis	-165.3	152	-49.1	-150.8	-54.6	0	0	0	107.7
10	S	35	Very low	33.6	Very low	103 Å²	103	135.5 Å²	135.5	72%	0.72	75%	0.746	S	S	*	*			trans	61.3	161.1	155.8	-72.5	0	0	0	0	118.7
11	S	33.1	Very low	33.6	Very low	86 Å²	86	137.4 Å²	137.4	60%	0.601	75%	0.747	S	S	*	*			cis	-168.6	172.5	-25.5	58.4	0	0	0	0	108.4
12	I	34.2	Very low	33.4	Very low	156 Å²	156	132.3 Å²	132.3	80%	0.8	72%	0.72	S	S	*	*			trans	69.7	144.5	161	-59.5	161.5	0	0	0	115.9
13	S	32.1	Very low	33.2	Very low	90 Å²	90	134.2 Å²	134.2	63%	0.629	72%	0.716	S	S	*	*			cis	-163.1	166.8	-34.2	66.1	0	0	0	0	110.4
14	S	31.2	Very low	33.5	Very low	85 Å²	85	135.8 Å²	135.8	59%	0.594	72%	0.724	S	S	*	*			trans	31.5	112.7	146.6	61.5	0	0	0	0	121.2
15	H	33.7	Very low	33.3	Very low	166 Å²	166	134.1 Å²	134.1	77%	0.769	72%	0.72	S	S	*	*				174.9	143	101.6	-98.8	-74.4	0	0	0	112.9
16	P	34.4	Very low	33.6	Very low	111 Å²	111	129.5 Å²	129.5	72%	0.721	71%	0.712	S	S	*	*			trans	-96.1	148.1	167.9	36.5	-31.3	0	0	0	112
17	Y	34	Very low	33.5	Very low	234 Å²	234	131.3 Å²	131.3	92%	0.918	72%	0.718	S	S	*	*			trans	-146.1	154.5	163.1	-107.6	-82.1	0	0	0	111.8
18	S	30.2	Very low	33.4	Very low	105 Å²	105	134.1 Å²	134.1	73%	0.734	72%	0.724	S	S	*	*			trans	-121.8	166.7	-174.7	-176.5	0	0	0	0	111.3
19	S	32.6	Very low	33.4	Very low	92 Å²	92	132.3 Å²	132.3	64%	0.643	72%	0.715	S	S	*	*			trans	112.5	116.3	154.4	-48.2	0	0	0	0	118.1
20	N	28	Very low	33.4	Very low	147 Å²	147	133 Å²	133	79%	0.786	72%	0.718	S	S	*	*				50.5	115.7	127.3	-51.1	-26	0	0	0	120.3
21	K	33.8	Very low	33.4	Very low	177 Å²	177	134.8 Å²	134.8	77%	0.77	72%	0.719	S	S	*	*				-177.6	143.9	94.3	-91.7	-163.2	173.9	-167.4	0	110.8
22	Q	30.2	Very low	33.3	Very low	129 Å²	129	138.6 Å²	138.6	60%	0.603	73%	0.729	S	S	*	*				57.9	127.9	80	-109.7	178.2	-12.2	0	0	111.4
23	F	29.5	Very low	33.2	Very low	147 Å²	147	136.7 Å²	136.7	65%	0.645	72%	0.721	S	S	*	*			cis	-149.6	161	18.2	-100.5	-87.9	0	0	0	110.6	D25	F23-D25 VanDerWaalsContact CD1-OD2 3.25Å; F23-D25 WeakPolarHBondContact CD1-OD2 2.85Å; F23-D25 VanDerWaalsContact CE1-OD2 3.27Å; F23-D25 WeakPolarHBondContact CE1-OD2 3.25Å
24	V	39.4	Very low	33.2	Very low	145 Å²	145	138.1 Å²	138.1	88%	0.879	72%	0.721	S	S	*	*				-162.9	126.1	124.1	168.6	0	0	0	0	106.9
25	D	32.3	Very low	33.4	Very low	112 Å²	112	142.4 Å²	142.4	60%	0.599	73%	0.729	S	S	*	*			trans	-98.6	162.7	171	-66.4	-76	0	0	0	110.9	F23	F23-D25 VanDerWaalsContact CD1-OD2 3.25Å; F23-D25 WeakPolarHBondContact CD1-OD2 2.85Å; F23-D25 VanDerWaalsContact CE1-OD2 3.27Å; F23-D25 WeakPolarHBondContact CE1-OD2 3.25Å
26	D	36.7	Very low	33.5	Very low	142 Å²	142	141.3 Å²	141.3	76%	0.759	73%	0.728	S	S	*	*				180	154.9	123.8	-97.2	-26.2	0	0	0	113
27	N	36.7	Very low	33.5	Very low	144 Å²	144	139.8 Å²	139.8	77%	0.77	72%	0.72	S	S	*	*			trans	58.6	87.8	179.5	-54.4	-62.4	0	0	0	114.6
28	Q	35.1	Very low	33.5	Very low	168 Å²	168	135 Å²	135	79%	0.785	71%	0.71	S	S	*	*			cis	70	140.6	29.4	-142.1	-173.8	70.6	0	0	114.8
29	N	34.8	Very low	33.8	Very low	122 Å²	122	136.6 Å²	136.6	65%	0.652	71%	0.709	S	S	*	*			trans	78.3	127.6	-174.5	-49.6	-62.8	0	0	0	114.8
30	N	35.5	Very low	33.8	Very low	132 Å²	132	141.8 Å²	141.8	71%	0.706	72%	0.716	S	S	*	*			cis	-155.1	150.7	7	-122.1	-28	0	0	0	113.8
31	L	35.3	Very low	34	Very low	140 Å²	140	139.3 Å²	139.3	73%	0.733	71%	0.71	S	S	*	*			trans	51.1	107.8	156.1	-62.1	165.2	0	0	0	118.4
32	M	29.6	Very low	34	Very low	166 Å²	166	137.3 Å²	137.3	82%	0.818	71%	0.713	S	S	*	*			cis	81.4	142.9	20.2	-150.1	63.9	142.7	0	0	116.6
33	N	32.7	Very low	34.2	Very low	116 Å²	116	136.8 Å²	136.8	62%	0.62	72%	0.723	S	S	*	*			trans	82.2	143.8	178.8	-49.1	-60.4	0	0	0	116.6
34	N	32.7	Very low	34.3	Very low	120 Å²	120	136.1 Å²	136.1	64%	0.642	73%	0.726	S	S	*	*			cis	-158.7	154.3	-25.8	-89.8	-32.5	0	0	0	105.7
35	F	35.1	Very low	33.9	Very low	175 Å²	175	136.9 Å²	136.9	77%	0.768	72%	0.718	S	S	*	*				-172.4	135.9	68.1	-99.2	-91.8	0	0	0	111.4
36	I	35.8	Very low	33.8	Very low	143 Å²	143	138.5 Å²	138.5	73%	0.733	72%	0.722	S	S	*	*				48.9	133.4	125.2	-64.4	-165.8	0	0	0	120.2
37	S	33.6	Very low	33.6	Very low	80 Å²	80	138.4 Å²	138.4	56%	0.559	72%	0.717	S	S	*	*			cis	-170	170.2	-12.8	62.6	0	0	0	0	112.2
38	D	33.6	Very low	33.3	Very low	132 Å²	132	140.5 Å²	140.5	71%	0.706	72%	0.719	S	S	*	*			trans	66.6	152.1	148.2	-59.5	-29	0	0	0	120.6
39	I	36.3	Very low	33.7	Very low	139 Å²	139	137 Å²	137	71%	0.713	71%	0.711	S	S	*	*			cis	-147.4	131.7	1	-123.2	153.4	0	0	0	111.3
40	Y	33.2	Very low	33.5	Very low	201 Å²	201	140.4 Å²	140.4	79%	0.788	72%	0.721	S	S	*	*			trans	37.6	140.8	148	-74.5	-96.2	0	0	0	127.5
41	S	32.3	Very low	33.2	Very low	95 Å²	95	138.6 Å²	138.6	66%	0.664	72%	0.718	S	S	*	*			trans	66.3	126.7	143.5	-56.9	0	0	0	0	120.7
42	T	33.1	Very low	33.1	Very low	135 Å²	135	139.3 Å²	139.3	83%	0.828	72%	0.72	S	S	*	*			cis	79.1	96.2	33.6	76.2	0	0	0	0	117.5
43	S	34.9	Very low	33.4	Very low	118 Å²	118	139.1 Å²	139.1	83%	0.825	71%	0.714	S	S	*	*			trans	-176.1	159	156.3	-168.4	0	0	0	0	110.2
44	L	31.1	Very low	33.4	Very low	134 Å²	134	139.8 Å²	139.8	70%	0.702	72%	0.718	S	S	*	*				-167.8	149.9	-67.8	-105.9	179.2	0	0	0	109.5
45	F	31	Very low	33.4	Very low	161 Å²	161	143 Å²	143	71%	0.706	73%	0.727	S	S	*	*			trans	57.1	123.4	165.1	-68.3	-66.8	0	0	0	118.9
46	E	30.7	Very low	33.6	Very low	146 Å²	146	139.4 Å²	139.4	68%	0.682	72%	0.721	S	S	*	*				72.3	152.1	85.7	-75.9	-175	-131.5	0	0	115.9
47	Q	33.2	Very low	33.5	Very low	139 Å²	139	137.5 Å²	137.5	65%	0.65	72%	0.72	S	S	*	*			cis	-160.3	144.9	15.6	-143.2	-178.5	76.6	0	0	115.5
48	F	29.2	Very low	33.5	Very low	188 Å²	188	140.5 Å²	140.5	83%	0.825	74%	0.735	S	S	*	*			trans	51.9	171	153.9	-73.7	-44.9	0	0	0	123.7
49	P	44.1	Very low	33.5	Very low	95 Å²	95	137.4 Å²	137.4	62%	0.617	74%	0.735	S	S	*	*			trans	-129.6	179.2	-165.2	43.9	-28.6	0	0	0	116.7
50	F	30.3	Very low	33.4	Very low	193 Å²	193	137.6 Å²	137.6	85%	0.846	74%	0.743	S	S	*	*			trans	147	121.9	139	-90.7	-70.8	0	0	0	117.9
51	S	30.5	Very low	33.5	Very low	94 Å²	94	133.4 Å²	133.4	66%	0.657	74%	0.743	S	S	*	*				80.7	146.4	127.5	-144.7	0	0	0	0	125.2
52	M	32.9	Very low	33.6	Very low	155 Å²	155	135.8 Å²	135.8	76%	0.764	75%	0.747	S	S	*	*			trans	75.7	145	155.9	-60.3	-125.5	-146.2	0	0	119.7
53	K	34.1	Very low	33.8	Very low	163 Å²	163	135.2 Å²	135.2	71%	0.709	75%	0.746	S	S	*	*			cis	-176.2	167.3	-23.1	-126	-174.5	-163.8	175.7	0	111.6
54	N	33.4	Very low	33.6	Very low	129 Å²	129	134.4 Å²	134.4	69%	0.69	74%	0.736	S	S	*	*			trans	76.2	158.1	156.8	-56.5	-15.6	0	0	0	119.9
55	F	32	Very low	33.7	Very low	189 Å²	189	135.5 Å²	135.5	83%	0.829	74%	0.742	S	S	*	*			cis	-161.2	-178.2	-38.6	-117.8	-89.9	0	0	0	105.3
56	P	40	Very low	33.8	Very low	99 Å²	99	133 Å²	133	64%	0.643	75%	0.745	S	S	*	*			trans	-139.6	-141.2	-130.2	39.9	-13.2	0	0	0	114.6
57	S	33.9	Very low	34.3	Very low	102 Å²	102	130.6 Å²	130.6	71%	0.713	74%	0.742	S	S	*	*			trans	80.4	148.6	158.7	79.6	0	0	0	0	117.7
58	T	33.3	Very low	34.4	Very low	143 Å²	143	130.5 Å²	130.5	88%	0.877	75%	0.746	S	S	*	*			cis	-166.3	158	-8.6	11.2	0	0	0	0	110.3
59	G	34.6	Very low	34.7	Very low	68 Å²	68	128.4 Å²	128.4	70%	0.701	74%	0.743	S	S	*	*			trans	168.2	96.7	163.6	0	0	0	0	0	119.5
60	T	33.8	Very low	34.1	Very low	143 Å²	143	129.2 Å²	129.2	88%	0.877	75%	0.751	S	S	*	*			trans	-6.2	155.8	142.5	38.4	0	0	0	0	121.4
61	S	35.6	Very low	34.4	Very low	113 Å²	113	125.3 Å²	125.3	79%	0.79	75%	0.747	S	S	*	*			cis	-165.6	163.8	6.6	38.5	0	0	0	0	114.8
62	L	33.6	Very low	34.5	Very low	144 Å²	144	125.7 Å²	125.7	75%	0.754	75%	0.75	S	S	*	*			trans	-77.2	176.3	173.1	-130.7	74.5	0	0	0	113.1	T64	L62-T64 HydrophobicContact CD2-CG2 4.1Å
63	P	37.2	Very low	34.7	Very low	123 Å²	123	126 Å²	126	80%	0.799	75%	0.753	S	S	*	*				-151.4	177.5	63.9	41.4	-19.2	0	0	0	120
64	T	32.2	Very low	34.6	Very low	101 Å²	101	123.7 Å²	123.7	62%	0.62	76%	0.755	S	S	*	*			trans	-74.8	164.2	-172.5	51.8	0	0	0	0	118.4	L62	L62-T64 HydrophobicContact CD2-CG2 4.1Å
65	N	32.6	Very low	34.4	Very low	157 Å²	157	125.3 Å²	125.3	84%	0.84	76%	0.763	S	S	*	*				-176.4	167.3	113.8	-88.9	-11.4	0	0	0	115.8
66	S	32.9	Very low	34.5	Very low	108 Å²	108	122 Å²	122	76%	0.755	76%	0.763	S	S	*	*			trans	-167.1	-167.1	-173.6	60.6	0	0	0	0	108.5
67	P	41.9	Very low	34	Very low	97 Å²	97	122.2 Å²	122.2	63%	0.63	77%	0.768	S	S	*	*			cis	-144	-152.1	4.7	40	-15.3	0	0	0	115.4
68	N	34.7	Very low	33.8	Very low	136 Å²	136	124.9 Å²	124.9	73%	0.727	77%	0.772	S	S	*	*			trans	81.1	149.3	152.1	-77.4	-6.7	0	0	0	120.4
69	L	34.8	Very low	33.8	Very low	145 Å²	145	123.1 Å²	123.1	76%	0.759	76%	0.761	S	S	*	*			cis	-166.1	155.1	-12.7	-170.5	69.9	0	0	0	113
70	S	33	Very low	33.6	Very low	112 Å²	112	126.5 Å²	126.5	78%	0.783	77%	0.768	S	S	*	*			trans	81.9	154.3	159.5	86.2	0	0	0	0	118.2
71	S	35.1	Very low	33.6	Very low	111 Å²	111	130.1 Å²	130.1	78%	0.776	77%	0.766	S	S	*	*			cis	-144.5	169.1	12	68.2	0	0	0	0	116.2
72	S	34	Very low	33.5	Very low	102 Å²	102	134 Å²	134	71%	0.713	77%	0.768	S	S	*	*			trans	-27.9	142.2	-178.3	53.4	0	0	0	0	122.7
73	L	35.6	Very low	33.3	Very low	160 Å²	160	135.5 Å²	135.5	84%	0.838	78%	0.776	S	S	*	*				-172.7	164.3	108.3	-92.4	169.2	0	0	0	110.7
74	P	32.4	Very low	32.9	Very low	115 Å²	115	134 Å²	134	75%	0.747	77%	0.769	S	S	*	*			trans	-96.7	138.4	-148.2	35.2	-37.4	0	0	0	118
75	L	30.5	Very low	32.8	Very low	164 Å²	164	137.2 Å²	137.2	86%	0.859	78%	0.782	S	S	*	*			trans	-89	134	166.5	-94.7	70.1	0	0	0	112.6
76	S	33.7	Very low	32.7	Very low	119 Å²	119	137.6 Å²	137.6	83%	0.832	78%	0.781	S	S	*	*			trans	-98.5	84	174.1	46.2	0	0	0	0	113.3
77	S	29.5	Very low	32.5	Very low	104 Å²	104	141 Å²	141	73%	0.727	79%	0.785	S	S	*	*			trans	49.5	67.7	151	-55.1	0	0	0	0	119	T79	S77-T79 PolarHBondContact O-N 3.26Å; S77-T79 VanDerWaalsContact O-N 3.17Å
78	I	29.9	Very low	31.9	Very low	157 Å²	157	143.3 Å²	143.3	81%	0.805	79%	0.79	S	S	*	*			trans	-64.7	113	155.2	-63	176.2	0	0	0	108.4
79	T	32.2	Very low	31.6	Very low	106 Å²	106	143.2 Å²	143.2	65%	0.65	79%	0.788	S	S	*	*			trans	-114.6	102.1	174.6	35.2	0	0	0	0	111.3	S77 R81	S77-T79 PolarHBondContact O-N 3.26Å; S77-T79 VanDerWaalsContact O-N 3.17Å; T79-R81 PolarHBondContact O-N 3.01Å; T79-R81 VanDerWaalsContact O-N 3.07Å
80	V	30.7	Very low	31.4	Very low	140 Å²	140	143.1 Å²	143.1	85%	0.848	78%	0.784	S	S	*	*			trans	-62.1	108.1	177.1	179.4	0	0	0	0	110
81	R	32.9	Very low	31.5	Very low	219 Å²	219	146.4 Å²	146.4	83%	0.826	79%	0.787	S	S	*	*			trans	-96.1	106.3	175.4	-79.3	-171.9	174.1	161.8	4.1	111.4	T79 L83	T79-R81 PolarHBondContact O-N 3.01Å; T79-R81 VanDerWaalsContact O-N 3.07Å; R81-L83 PolarHBondContact O-N 2.82Å
82	K	33.3	Very low	31.5	Very low	194 Å²	194	146.6 Å²	146.6	84%	0.843	78%	0.779	S	S	*	*			trans	-45.6	99.2	176.5	-155.1	163.5	-168.2	162	0	112.7	S84	K82-S84 PolarHBondContact O-N 3.01Å
83	L	30.5	Very low	31.3	Very low	175 Å²	175	148.7 Å²	148.7	92%	0.916	78%	0.782	S	S	*	*			trans	-87.8	75.9	173.4	-78.2	171.2	0	0	0	110.4	R81	R81-L83 PolarHBondContact O-N 2.82Å
84	S	28.6	Very low	31.2	Very low	92 Å²	92	149.2 Å²	149.2	64%	0.643	78%	0.784	S	S	*	*			trans	-97.9	83.4	170.7	61.3	0	0	0	0	110.1	K82	K82-S84 PolarHBondContact O-N 3.01Å
85	N	30	Very low	31.2	Very low	168 Å²	168	152.8 Å²	152.8	90%	0.898	79%	0.791	S	S	*	*			trans	-171.1	63.6	163	-106	18.2	0	0	0	108.9
86	M	29.7	Very low	31.2	Very low	166 Å²	166	150.9 Å²	150.9	82%	0.818	78%	0.781	S	S	*	*			trans	-111.6	116.1	158.1	-84.2	-178.2	58.7	0	0	107	I88	M86-I88 PolarHBondContact O-N 2.9Å
87	E	30.1	Very low	31.2	Very low	180 Å²	180	152.9 Å²	152.9	84%	0.841	78%	0.781	S	S	*	*			trans	-69.9	115	154.7	-79.5	170.7	129.6	0	0	106.6	I89	E87-I89 VanDerWaalsContact C-N 3.26Å; E87-I89 HydrophobicContact CB-CG1 4.47Å; E87-I89 PolarHBondContact O-N 3.44Å
88	I	29.1	Very low	31.2	Very low	144 Å²	144	153.6 Å²	153.6	74%	0.738	78%	0.777	S	S	*	*			trans	-76.5	89.3	167	-59.6	175.3	0	0	0	105.2	M86 Q90	M86-I88 PolarHBondContact O-N 2.9Å; I88-Q90 VanDerWaalsContact C-N 3.33Å; I88-Q90 PolarHBondContact O-N 2.83Å
89	I	29	Very low	31.3	Very low	134 Å²	134	156.4 Å²	156.4	69%	0.687	78%	0.783	S	S	*	*			trans	-71.4	100	166	-57.6	-179.3	0	0	0	105.7	E87 E91	E87-I89 VanDerWaalsContact C-N 3.26Å; E87-I89 HydrophobicContact CB-CG1 4.47Å; E87-I89 PolarHBondContact O-N 3.44Å; I89-E91 HydrophobicContact CG2-CG 3.92Å; I89-E91 PolarHBondContact O-N 3.38Å
90	Q	29.1	Very low	31.2	Very low	144 Å²	144	159.2 Å²	159.2	67%	0.673	79%	0.789	S	S	*	*			trans	-81.6	89.5	175	-169.1	177.3	-9.5	0	0	107.6	I88 N92	I88-Q90 VanDerWaalsContact C-N 3.33Å; I88-Q90 PolarHBondContact O-N 2.83Å; Q90-N92 VanDerWaalsContact C-N 3.27Å; Q90-N92 WeakPolarHBondContact CG-OD1 3.27Å; Q90-N92 PolarHBondContact NE2-OD1 2.77Å; Q90-N92 PolarHBondContact O-N 3.22Å
91	E	35.3	Very low	31.2	Very low	180 Å²	180	160 Å²	160	84%	0.841	79%	0.788	S	S	*	*			trans	-70.3	83.9	175.6	-67.7	-174.3	144.3	0	0	109.6	I89	I89-E91 HydrophobicContact CG2-CG 3.92Å; I89-E91 PolarHBondContact O-N 3.38Å
92	N	34.5	Very low	31.2	Very low	116 Å²	116	160 Å²	160	62%	0.62	79%	0.789	S	S	*	*			trans	-74.7	128.5	172.5	-74.4	-12.5	0	0	0	110.5	Q90	Q90-N92 VanDerWaalsContact C-N 3.27Å; Q90-N92 WeakPolarHBondContact CG-OD1 3.27Å; Q90-N92 PolarHBondContact NE2-OD1 2.77Å; Q90-N92 PolarHBondContact O-N 3.22Å
93	D	30.5	Very low	31.1	Very low	145 Å²	145	156 Å²	156	78%	0.775	78%	0.783	S	S	*	*			trans	-18.6	117.2	174.8	-59.2	-71.2	0	0	0	118.9
94	I	33.4	Very low	31.3	Very low	172 Å²	172	155 Å²	155	88%	0.882	78%	0.779	S	S	*	*			trans	-130.7	67.7	139.4	-50.1	-178.4	0	0	0	108.8
95	H	32.5	Very low	31.7	Very low	189 Å²	189	158.2 Å²	158.2	88%	0.875	78%	0.782	S	S	*	*			trans	-96.5	83.9	169.1	-128.9	-41	0	0	0	109.7
96	N	30.2	Very low	31.7	Very low	125 Å²	125	159.9 Å²	159.9	67%	0.668	78%	0.777	S	S	*	*			trans	-151.8	108.3	166.8	-158.3	-8.2	0	0	0	112.7
97	I	33.4	Very low	31.9	Very low	160 Å²	160	161.8 Å²	161.8	82%	0.821	78%	0.78	S	S	*	*				-163.1	124	129.1	-95.6	151	0	0	0	107.5
98	N	29.2	Very low	31.7	Very low	120 Å²	120	161 Å²	161	64%	0.642	78%	0.781	S	S	*	*			trans	-21	128.7	177.1	-60.5	-57.6	0	0	0	118.5
99	F	32.4	Very low	32	Very low	215 Å²	215	158.9 Å²	158.9	94%	0.943	78%	0.777	S	S	*	*				-130.2	134.9	118.8	-98.4	-82.5	0	0	0	109.4
100	Q	29.8	Very low	32	Very low	166 Å²	166	159.8 Å²	159.8	78%	0.776	78%	0.782	S	S	*	*			trans	-82.1	142.6	-179	-64.5	170.2	-36	0	0	110.7
101	L	32.2	Very low	32.1	Very low	157 Å²	157	159.9 Å²	159.9	82%	0.822	79%	0.786	S	S	*	*				179.8	156.8	117.5	-91.3	163.9	0	0	0	111.2
102	Y	31.5	Very low	31.9	Very low	217 Å²	217	155.5 Å²	155.5	85%	0.851	78%	0.776	S	S	*	*			trans	-74.5	150.5	-155.6	-66.7	-95.3	0	0	0	117
103	P	32.7	Very low	31.8	Very low	111 Å²	111	155.2 Å²	155.2	72%	0.721	78%	0.778	S	S	*	*			trans	-98.7	142.9	166.6	36.9	-31.5	0	0	0	113.8
104	N	34.7	Very low	32.1	Very low	155 Å²	155	155.6 Å²	155.6	83%	0.829	78%	0.775	S	S	*	*			trans	-162.2	117.6	152.6	-91.7	-43.1	0	0	0	107.4
105	K	36	Very low	32.1	Very low	159 Å²	159	154.8 Å²	154.8	69%	0.691	77%	0.768	S	S	*	*				80.9	93	65.3	-85.1	-166.9	165.3	-176.8	0	115.7
106	Y	29.8	Very low	32.2	Very low	202 Å²	202	152.9 Å²	152.9	79%	0.792	76%	0.763	S	S	*	*			trans	79.9	144.1	147.6	-55.9	-63.2	0	0	0	122.5
107	K	33.9	Very low	32.4	Very low	206 Å²	206	152.2 Å²	152.2	90%	0.896	76%	0.764	S	S	*	*			trans	70.1	100.7	159.6	-71.9	-175.8	177.3	-176.5	0	120.5
108	L	27.2	Very low	32.5	Very low	164 Å²	164	150.9 Å²	150.9	86%	0.859	76%	0.758	S	S	*	*			trans	-43.1	169.4	138.2	-77.6	163.1	0	0	0	114.2
109	P	34.9	Very low	32.8	Very low	100 Å²	100	151.7 Å²	151.7	65%	0.649	76%	0.763	S	S	*	*			cis	-137.7	-172.3	-6.7	24.8	0.8	0	0	0	115.5
110	L	29.5	Very low	33.1	Very low	152 Å²	152	149.9 Å²	149.9	80%	0.796	76%	0.757	S	S	*	*			trans	108.1	141.6	146.3	-64.1	178.6	0	0	0	121.3
111	L	30.8	Very low	33.3	Very low	146 Å²	146	149.1 Å²	149.1	76%	0.764	76%	0.757	S	S	*	*			trans	70	107.7	159.4	-94.3	68	0	0	0	121.2
112	S	30.3	Very low	33.4	Very low	88 Å²	88	149.8 Å²	149.8	62%	0.615	76%	0.755	S	S	*	*				38.2	144	116.8	66.9	0	0	0	0	121.7
113	T	33.3	Very low	33.4	Very low	111 Å²	111	145.6 Å²	145.6	68%	0.681	76%	0.758	S	S	*	*			cis	-172.6	174.5	0.3	23.1	0	0	0	0	109
114	H	35.8	Very low	33.4	Very low	153 Å²	153	147.6 Å²	147.6	71%	0.708	76%	0.76	S	S	*	*			trans	68.9	153.7	167.4	-63.2	-81	0	0	0	116.6
115	Q	34.2	Very low	33.1	Very low	155 Å²	155	144.7 Å²	144.7	72%	0.724	75%	0.753	S	S	*	*			cis	-168.9	-178.3	-36.4	-122.9	171.2	-7.9	0	0	107.7
116	L	35.1	Very low	32.8	Very low	148 Å²	148	143.1 Å²	143.1	78%	0.775	76%	0.756	S	S	*	*			trans	76.5	112.5	171.3	-50.4	-175.3	0	0	0	114.7
117	T	34.1	Very low	33	Very low	111 Å²	111	139.9 Å²	139.9	68%	0.681	75%	0.751	S	S	*	*				64.5	130.9	75.9	63.5	0	0	0	0	113.4
118	D	35.6	Very low	32.9	Very low	132 Å²	132	137.8 Å²	137.8	71%	0.706	75%	0.745	S	S	*	*			cis	-165.1	174	15.5	-115	-8.7	0	0	0	114.4
119	N	36.1	Very low	33.2	Very low	138 Å²	138	135.6 Å²	135.6	74%	0.738	74%	0.738	S	S	*	*			trans	65.6	80	151.5	-64.1	-32	0	0	0	123.2
120	H	37.5	Very low	33.1	Very low	176 Å²	176	138 Å²	138	82%	0.815	75%	0.746	S	S	*	*				42	142.5	104.5	-139.4	-46.1	0	0	0	123.3
121	I	35.1	Very low	33.4	Very low	151 Å²	151	137.2 Å²	137.2	77%	0.774	75%	0.747	S	S	*	*			trans	114.7	135.3	152.3	-60.2	-179.6	0	0	0	117
122	H	33.6	Very low	33.6	Very low	171 Å²	171	136.1 Å²	136.1	79%	0.792	75%	0.749	S	S	*	*			trans	-86.5	162.2	-178.8	-63.2	-53.3	0	0	0	114.2
123	S	31.3	Very low	33.7	Very low	129 Å²	129	136.9 Å²	136.9	90%	0.902	75%	0.754	S	S	*	*			trans	-139.5	154.3	146.7	-79.2	0	0	0	0	109.7
124	I	32.1	Very low	33.7	Very low	152 Å²	152	137.5 Å²	137.5	78%	0.779	76%	0.758	S	S	*	*			trans	-125.7	153	-167.9	-55.6	171.2	0	0	0	110.3
125	S	29.4	Very low	33.5	Very low	95 Å²	95	134.8 Å²	134.8	66%	0.664	76%	0.756	S	S	*	*			trans	119.5	146.9	142	77.7	0	0	0	0	119
126	T	29.4	Very low	33.5	Very low	126 Å²	126	133.3 Å²	133.3	77%	0.773	76%	0.758	S	S	*	*			trans	61.2	161.2	166.1	66.1	0	0	0	0	116.7
127	I	35.1	Very low	33.3	Very low	133 Å²	133	131.7 Å²	131.7	68%	0.682	76%	0.755	S	S	*	*			cis	-139.3	120.2	18.8	-72.3	174.6	0	0	0	108.9
128	E	30.8	Very low	33.3	Very low	163 Å²	163	133.4 Å²	133.4	76%	0.762	77%	0.765	S	S	*	*				70.7	165.1	105.9	-50.3	-172.9	141.7	0	0	119.7
129	T	33	Very low	33.3	Very low	117 Å²	117	135.5 Å²	135.5	72%	0.718	77%	0.772	S	S	*	*			trans	73.8	138.6	171.2	71.5	0	0	0	0	117.3
130	N	33.8	Very low	33.2	Very low	152 Å²	152	136.3 Å²	136.3	81%	0.813	78%	0.777	S	S	*	*			cis	-148.3	162.5	-6.2	-98.5	-21.8	0	0	0	111
131	T	34.6	Very low	33.2	Very low	134 Å²	134	133.5 Å²	133.5	82%	0.822	78%	0.775	S	S	*	*			trans	-110.9	171.5	168.8	61.2	0	0	0	0	111
132	P	36.5	Very low	33.2	Very low	123 Å²	123	133.6 Å²	133.6	80%	0.799	78%	0.776	S	S	*	*				-146.4	178.2	92.2	37.9	-20	0	0	0	116.1
133	S	31.3	Very low	33.4	Very low	104 Å²	104	131.8 Å²	131.8	73%	0.727	77%	0.771	S	S	*	*			trans	-71.5	170.5	-178.5	58.9	0	0	0	0	114.4
134	T	33.8	Very low	33.6	Very low	124 Å²	124	135.3 Å²	135.3	76%	0.761	77%	0.77	S	S	*	*				-170.4	165.4	79.8	-59.7	0	0	0	0	112.3
135	S	31.6	Very low	33.6	Very low	96 Å²	96	133.5 Å²	133.5	67%	0.671	77%	0.766	S	S	*	*			trans	-70.1	179.2	-176.9	60.7	0	0	0	0	114.1
136	T	33.4	Very low	33.8	Very low	124 Å²	124	135.9 Å²	135.9	76%	0.761	77%	0.766	S	S	*	*			cis	-162.6	168.1	36.2	-30.6	0	0	0	0	113.8
137	T	31.7	Very low	33.9	Very low	115 Å²	115	132.7 Å²	132.7	71%	0.706	75%	0.749	S	S	*	*			trans	-57.3	148.9	-173.8	52.1	0	0	0	0	119.4
138	T	34	Very low	34.2	Very low	147 Å²	147	133.2 Å²	133.2	90%	0.902	75%	0.753	S	S	*	*			trans	-138.3	152.2	132.3	44.1	0	0	0	0	110.2
139	M	34.7	Very low	35.1	Very low	175 Å²	175	132.3 Å²	132.3	86%	0.862	75%	0.749	S	S	*	*			trans	-124	144.9	-176.9	-74.8	-85.1	-163.5	0	0	110.4
140	D	34	Very low	36.3	Very low	155 Å²	155	131.4 Å²	131.4	83%	0.829	75%	0.748	S	S	*	*			trans	-154.2	157	161.1	-115.1	-12.4	0	0	0	110
141	P	38	Very low	38	Very low	118 Å²	118	126.2 Å²	126.2	77%	0.766	72%	0.72	S	S	*	*			trans	-107.7	155.9	-132.5	-2.7	25.9	0	0	0	116.8
142	L	35.2	Very low	40.2	Very low	152 Å²	152	124.7 Å²	124.7	80%	0.796	70%	0.702	S	S	*	*			trans	-71.1	135.2	-178	-103.8	68.6	0	0	0	115.5
143	I	38.6	Very low	42.3	Very low	134 Å²	134	119.3 Å²	119.3	69%	0.687	67%	0.667	S	S	*	*			trans	48.1	113.8	130.5	-58.7	172.9	0	0	0	118.6	T145	I143-T145 PolarHBondContact O-N 3.2Å
144	K	34.3	Very low	44.7	Very low	203 Å²	203	118.7 Å²	118.7	88%	0.883	65%	0.654	S	S	*	*			trans	-73.4	113.6	163	-73.2	165.1	179.3	159.2	0	110.9	Q146	K144-Q146 PolarHBondContact O-N 3.5Å
145	T	31.8	Very low	47	Very low	113 Å²	113	113.5 Å²	113.5	69%	0.693	62%	0.622	S	S	*	*			trans	-65.4	112.6	-171.2	57.6	0	0	0	0	114.8	I143 S147	I143-T145 PolarHBondContact O-N 3.2Å; T145-S147 VanDerWaalsContact C-N 3.28Å; T145-S147 PolarHBondContact O-N 2.85Å
146	Q	34.1	Very low	49.3	Very low	146 Å²	146	115.5 Å²	115.5	68%	0.682	62%	0.619	S	S	*	*			trans	-87.2	59.1	168.6	-63	-169	13	0	0	112.2	K144 N148	K144-Q146 PolarHBondContact O-N 3.5Å; Q146-N148 PolarHBondContact O-N 3.34Å
147	S	30.9	Very low	51.3	Low	58 Å²	58	116.3 Å²	116.3	41%	0.406	61%	0.608	S	S	.	*	T	Hydrogen-bonded Turn	trans	-61.4	88.8	178.8	48.2	0	0	0	0	114.2	T145 R645	T145-S147 VanDerWaalsContact C-N 3.28Å; T145-S147 PolarHBondContact O-N 2.85Å; S147-R645 VanDerWaalsContact C-NH2 3.31Å; S147-R645 PolarHBondContact O-NH2 2.92Å; S147-R645 PolarHBondContact OG-NH2 3.38Å
148	N	41.3	Very low	53	Low	145 Å²	145	112.9 Å²	112.9	78%	0.775	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	175.8	-19.4	151.4	-97.9	2.6	0	0	0	112.7	Q146	Q146-N148 PolarHBondContact O-N 3.34Å
149	E	51.1	Low	54.1	Low	143 Å²	143	114.3 Å²	114.3	67%	0.668	58%	0.58	S	S	*	*	S	Bend	trans	-90.6	-15.5	-175.7	-70.1	176.9	127.2	0	0	113.5	N151 K152	E149-N151 PolarHBondContact O-N 3.01Å; E149-K152 PolarHBondContact O-N 3.02Å
150	S	58	Low	55.1	Low	99 Å²	99	109.3 Å²	109.3	69%	0.692	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53.9	-24.3	179.4	53.1	0	0	0	0	115.9
151	N	69.6	Low	55.8	Low	43 Å²	43	112.4 Å²	112.4	23%	0.23	56%	0.561	C	S	.	*	T	Hydrogen-bonded Turn	trans	-98.8	3.4	-171.4	-58	10.3	0	0	0	112.8	E149 F210 N211 Y222	E149-N151 PolarHBondContact O-N 3.01Å; N151-F210 CarbonylContact O-C 3.48Å; N151-F210 WeakPolarHBondContact O-CA 3.35Å; N151-F210 WeakPolarHBondContact O-CB 3.36Å; N151-N211 PolarHBondContact O-N 3.2Å; N151-Y222 HydrophobicContact CB-CE2 4.45Å; N151-Y222 WeakPolarHBondContact CB-OH 3.33Å; N151-Y222 PolarHBondContact ND2-OH 3.02Å
152	K	80	Confident	56.6	Low	102 Å²	102	113.5 Å²	113.5	44%	0.443	56%	0.556	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-108.3	95.7	-172.2	-174	-159.8	169.5	-152.6	0	110.8	E149 S208 F210	E149-K152 PolarHBondContact O-N 3.02Å; K152-S208 VanDerWaalsContact CE-CB 3.48Å; K152-S208 VanDerWaalsContact CE-OG 3.22Å; K152-S208 WeakPolarHBondContact CE-OG 3.34Å; K152-F210 HydrophobicContact CB-CD1 3.91Å; K152-F210 HydrophobicContact CB-CE1 3.74Å; K152-F210 HydrophobicContact CD-CE1 4.44Å; K152-F210 HydrophobicContact CG-CD1 4.15Å; K152-F210 HydrophobicContact CG-CE1 3.73Å; K152-F210 HydrophobicContact CG-CZ 4.04Å
153	S	80.8	Confident	57.6	Low	9 Å²	9	116.4 Å²	116.4	6%	0.063	56%	0.562	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-76.6	132.6	176.3	-55.4	0	0	0	0	111.1	S184 D185 S208 C209	S153-S184 VanDerWaalsContact CA-OG 3.3Å; S153-S184 WeakPolarHBondContact CA-OG 3.39Å; S153-D185 PolarHBondContact OG-OD2 2.91Å; S153-S208 WeakPolarHBondContact O-CA 3.43Å; S153-S208 VanDerWaalsContact O-CB 3.24Å; S153-S208 WeakPolarHBondContact O-CB 3.43Å; S153-C209 PolarHBondContact N-O 3.49Å; S153-C209 VanDerWaalsContact N-O 3.12Å; S153-C209 PolarHBondContact O-N 3.4Å
154	I	81.3	Confident	58.5	Low	91 Å²	91	115.4 Å²	115.4	47%	0.467	56%	0.558	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-84.6	132.5	174	-61.6	177.4	0	0	0	108.5	S184	I154-S184 PolarHBondContact N-OG 3.2Å; I154-S184 PolarHBondContact O-N 3.02Å
155	I	82.3	Confident	60.2	Low	16 Å²	16	111.3 Å²	111.3	8%	0.082	55%	0.545	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	110.8	177.8	-62	166.2	0	0	0	108.4	L181 L183 L194 L203 E206 T207 C209	I155-L181 HydrophobicContact CG2-CB 4.41Å; I155-L181 HydrophobicContact CG2-CD2 3.86Å; I155-L183 HydrophobicContact CG1-CD2 3.76Å; I155-L194 HydrophobicContact CD1-CD2 3.74Å; I155-L194 HydrophobicContact CG1-CD2 4Å; I155-L203 HydrophobicContact CD1-CB 4.34Å; I155-E206 WeakPolarHBondContact CD1-O 3.46Å; I155-T207 PolarHBondContact N-O 3.19Å; I155-T207 VanDerWaalsContact N-O 3.12Å; I155-C209 HydrophobicContact CD1-CB 4.08Å
156	K	79.9	Confident	62.5	Low	138 Å²	138	110.9 Å²	110.9	60%	0.6	53%	0.533	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.7	129.8	169.7	-65.2	-178.3	178.9	179.9	0	108.9	G182	K156-G182 PolarHBondContact N-O 3.32Å; K156-G182 PolarHBondContact O-N 3.14Å
157	R	75.4	Confident	65.1	Low	141 Å²	141	108.5 Å²	108.5	53%	0.532	53%	0.525	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	124.1	164.2	-55.5	-162.8	-164.3	99	5.5	108.1	L181 D204	R157-L181 HydrophobicContact CG-CD2 3.98Å; R157-D204 VanDerWaalsContact CZ-O 3.29Å; R157-D204 PolarHBondContact NE-O 3.05Å; R157-D204 PolarHBondContact NH2-O 3.08Å
158	T	68	Low	68.1	Low	43 Å²	43	105.7 Å²	105.7	26%	0.264	51%	0.506	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	135.5	-178.6	34.3	0	0	0	0	110.4	Y180	T158-Y180 PolarHBondContact N-O 3.41Å; T158-Y180 WeakPolarHBondContact OG1-CE2 3.44Å
159	K	57.7	Low	70.3	Confident	176 Å²	176	101.7 Å²	101.7	77%	0.765	49%	0.486	S	S	*	.			trans	-117.6	72.1	177.3	-71.6	-173.7	176.3	-175.4	0	108.1	I179	K159-I179 HydrophobicContact CG-CG1 4.41Å
160	T	55.5	Low	72	Confident	70 Å²	70	96.8 Å²	96.8	43%	0.429	47%	0.474	S	S	.	.			trans	-141.9	113.4	-176	-35.8	0	0	0	0	110.2	Q162	T160-Q162 HydrophobicContact CG2-CG 4.04Å; T160-Q162 PolarHBondContact O-N 3.4Å
161	Y	47.4	Very low	73.6	Confident	221 Å²	221	94.4 Å²	94.4	87%	0.867	46%	0.457	S	S	*	.			trans	-83.2	64.8	178.9	-163.9	-97.9	0	0	0	110.5
162	Q	54.5	Low	74.5	Confident	141 Å²	141	98.2 Å²	98.2	66%	0.659	48%	0.477	S	S	*	.			trans	-86.7	140.7	169.9	-79.3	179.6	-9.6	0	0	109.9	T160 L164	T160-Q162 HydrophobicContact CG2-CG 4.04Å; T160-Q162 PolarHBondContact O-N 3.4Å; Q162-L164 PolarHBondContact O-N 3.48Å
163	K	57.8	Low	74.9	Confident	212 Å²	212	98.9 Å²	98.9	92%	0.922	48%	0.482	S	S	*	.	S	Bend	trans	-77.1	41.9	-169.4	-158.8	-178.4	179.2	-177.6	0	113.4
164	L	56.8	Low	75.2	Confident	114 Å²	114	99.8 Å²	99.8	60%	0.597	49%	0.488	S	S	*	.			trans	-109.6	88.3	177.6	-84	159.3	0	0	0	108.3	Q162 K166	Q162-L164 PolarHBondContact O-N 3.48Å; L164-K166 PolarHBondContact O-N 3.31Å
165	I	69.9	Low	75.6	Confident	117 Å²	117	96.5 Å²	96.5	60%	0.6	47%	0.471	S	S	*	.			trans	-64.8	105.9	170.3	-57.9	176.7	0	0	0	106.8	P174 Y176	I165-P174 HydrophobicContact CG2-CB 3.34Å; I165-Y176 HydrophobicContact CD1-CE1 4.48Å
166	K	80	Confident	75.7	Confident	104 Å²	104	104 Å²	104	45%	0.452	50%	0.499	S	S	.	.			trans	-119.7	139.7	177.9	-76.2	-178.5	172.9	-175.2	0	108.7	L164 I175 L188	L164-K166 PolarHBondContact O-N 3.31Å; K166-I175 WeakPolarHBondContact O-CG1 3.23Å; K166-I175 PolarHBondContact O-N 3.34Å; K166-L188 HydrophobicContact CB-CD1 3.93Å; K166-L188 HydrophobicContact CD-CD1 3.65Å; K166-L188 HydrophobicContact CG-CD1 4.42Å
167	D	89.5	Confident	75.8	Confident	95 Å²	95	100.8 Å²	100.8	51%	0.508	49%	0.486	S	S	.	.	B	Isolated β-bridge	trans	-80.6	141.3	-175.6	-54.3	-56	0	0	0	112.1	T169 Q173 P174	D167-T169 PolarHBondContact O-N 3.04Å; D167-Q173 WeakPolarHBondContact CA-O 3.34Å; D167-P174 WeakPolarHBondContact OD1-CA 3.5Å
168	C	92.4	Very high	76.1	Confident	0 Å²	0	102.7 Å²	102.7	0%	0	50%	0.499	C	S	.	.			trans	-69.9	117.9	175.9	168.3	0	0	0	0	110.5	G170 C171 N172 Q173 I175 L188 H190 C193	C168-G170 PolarHBondContact O-N 3.2Å; C168-C171 PolarHBondContact O-N 3.18Å; C168-N172 WeakPolarHBondContact O-CA 2.98Å; C168-N172 PolarHBondContact O-N 3.18Å; C168-Q173 WeakPolarHBondContact CB-O 3.44Å; C168-Q173 PolarHBondContact N-O 3.39Å; C168-I175 HydrophobicContact CB-CD1 4.01Å; C168-I175 HydrophobicContact CB-CG1 3.75Å; C168-L188 WeakPolarHBondContact CA-O 3.49Å; C168-H190 VanDerWaalsContact CB-CE1 3.48Å; C168-H190 WeakPolarHBondContact CB-CE1 3.49Å; C168-H190 VanDerWaalsContact CB-ND1 3.25Å; C168-H190 WeakPolarHBondContact CB-ND1 3.34Å; C168-H190 PolarHBondContact SG-N 3.18Å; C168-H190 VanDerWaalsContact SG-N 3.39Å; C168-H190 PolarHBondContact SG-ND1 3.18Å; C168-H190 VanDerWaalsContact SG-ND1 3.41Å; C168-C193 WeakPolarHBondContact SG-CB 3.5Å; C168-C193 VanDerWaalsContact SG-SG 3.7Å
169	T	89.1	Confident	76.9	Confident	60 Å²	60	103.9 Å²	103.9	37%	0.368	50%	0.503	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-19.6	-177.3	-45.7	0	0	0	0	113.4	D167 Q187 L188 W189	D167-T169 PolarHBondContact O-N 3.04Å; T169-Q187 HydrophobicContact CG2-CG 4.28Å; T169-L188 PolarHBondContact N-O 2.93Å; T169-L188 PolarHBondContact OG1-O 3.37Å; T169-W189 HydrophobicContact CG2-CZ2 4.09Å
170	G	86.3	Confident	78.3	Confident	40 Å²	40	97.5 Å²	97.5	41%	0.412	47%	0.474	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.3	-16.7	176.4	0	0	0	0	0	116.5	C168	C168-G170 PolarHBondContact O-N 3.2Å
171	C	91.5	Very high	79.9	Confident	50 Å²	50	94.2 Å²	94.2	34%	0.338	45%	0.454	S	S	.	.	T	Hydrogen-bonded Turn	trans	-143.1	-1.4	-177.2	66.3	0	0	0	0	115.2	C168 Q173 H190 C193	C168-C171 PolarHBondContact O-N 3.18Å; C171-Q173 PolarHBondContact O-N 2.99Å; C171-H190 PolarHBondContact SG-ND1 3.42Å; C171-H190 VanDerWaalsContact SG-ND1 3.39Å; C171-C193 VanDerWaalsContact SG-SG 3.68Å
172	N	88.2	Confident	81.8	Confident	122 Å²	122	84 Å²	84	65%	0.652	42%	0.416	S	S	*	.			trans	52.3	36.2	-178.4	-54.7	-29.3	0	0	0	113.4	C168	C168-N172 WeakPolarHBondContact O-CA 2.98Å; C168-N172 PolarHBondContact O-N 3.18Å
173	Q	87.9	Confident	83.4	Confident	116 Å²	116	77.8 Å²	77.8	54%	0.542	39%	0.387	S	S	.	.			trans	-115.6	144.2	173	-64.7	-59.1	-63	0	0	110.5	D167 C168 C171 I175	D167-Q173 WeakPolarHBondContact CA-O 3.34Å; C168-Q173 WeakPolarHBondContact CB-O 3.44Å; C168-Q173 PolarHBondContact N-O 3.39Å; C171-Q173 PolarHBondContact O-N 2.99Å; Q173-I175 PolarHBondContact O-N 3.02Å
174	P	88.6	Confident	84.5	Confident	28 Å²	28	71.1 Å²	71.1	18%	0.182	37%	0.367	C	S	.	.	B	Isolated β-bridge	trans	-60.5	132.8	179.5	22.2	-34	0	0	0	112.5	I165 D167 Y176	I165-P174 HydrophobicContact CG2-CB 3.34Å; D167-P174 WeakPolarHBondContact OD1-CA 3.5Å; P174-Y176 HydrophobicContact CB-CE1 4.3Å; P174-Y176 HydrophobicContact CB-CE2 4.11Å; P174-Y176 HydrophobicContact CG-CE2 3.63Å; P174-Y176 WeakPolarHBondContact CG-OH 3.25Å; P174-Y176 WeakPolarHBondContact O-CD2 3.48Å; P174-Y176 PolarHBondContact O-N 3.42Å
175	I	88.4	Confident	85.5	Confident	23 Å²	23	68.9 Å²	68.9	12%	0.118	36%	0.356	C	S	.	.			trans	-78.4	104.5	-179.1	-62	171.6	0	0	0	110.6	K166 C168 Q173 E177 Y180 L188 H190	K166-I175 WeakPolarHBondContact O-CG1 3.23Å; K166-I175 PolarHBondContact O-N 3.34Å; C168-I175 HydrophobicContact CB-CD1 4.01Å; C168-I175 HydrophobicContact CB-CG1 3.75Å; Q173-I175 PolarHBondContact O-N 3.02Å; I175-E177 HydrophobicContact CG2-CB 4.41Å; I175-Y180 HydrophobicContact CG2-CD1 4.15Å; I175-Y180 HydrophobicContact CG2-CG 4.12Å; I175-L188 HydrophobicContact CD1-CB 3.53Å; I175-H190 WeakPolarHBondContact CA-NE2 3.4Å
176	Y	84	Confident	86.1	Confident	172 Å²	172	66.1 Å²	66.1	68%	0.675	36%	0.356	S	S	*	.			trans	-97.4	-5.7	170.7	-56	-61.5	0	0	0	113.6	I165 P174 K178	I165-Y176 HydrophobicContact CD1-CE1 4.48Å; P174-Y176 HydrophobicContact CB-CE1 4.3Å; P174-Y176 HydrophobicContact CB-CE2 4.11Å; P174-Y176 HydrophobicContact CG-CE2 3.63Å; P174-Y176 WeakPolarHBondContact CG-OH 3.25Å; P174-Y176 WeakPolarHBondContact O-CD2 3.48Å; P174-Y176 PolarHBondContact O-N 3.42Å; Y176-K178 PolarHBondContact O-N 3.4Å
177	E	82.9	Confident	86.4	Confident	71 Å²	71	64.1 Å²	64.1	33%	0.332	35%	0.348	S	S	.	.			trans	-65.7	130.7	-179.5	-68.1	-177.8	160.1	0	0	111.7	I175 I179 H190 M191	I175-E177 HydrophobicContact CG2-CB 4.41Å; E177-I179 WeakPolarHBondContact CB-O 3.39Å; E177-I179 PolarHBondContact O-N 2.96Å; E177-H190 IonicContact OE1-CD2 3.96Å; E177-H190 VanDerWaalsContact OE2-CA 3.23Å; E177-H190 WeakPolarHBondContact OE2-CA 3.5Å; E177-H190 WeakPolarHBondContact OE2-CB 3.3Å; E177-H190 IonicContact OE2-CD2 3.54Å; E177-H190 IonicContact OE2-CG 3.88Å; E177-M191 PolarHBondContact OE2-N 3.39Å
178	K	82.4	Confident	86.4	Confident	181 Å²	181	61.1 Å²	61.1	79%	0.787	33%	0.332	S	S	*	.	S	Bend	trans	-60.3	-14.2	175.8	-70.7	-174.3	177.6	-178.8	0	114.2	Y176	Y176-K178 PolarHBondContact O-N 3.4Å
179	I	83.4	Confident	86.3	Confident	68 Å²	68	62.4 Å²	62.4	35%	0.349	34%	0.337	S	S	.	.	S	Bend	trans	-137.1	127.2	176.9	-43.6	-180	0	0	0	106.3	K159 E177 M191	K159-I179 HydrophobicContact CG-CG1 4.41Å; E177-I179 WeakPolarHBondContact CB-O 3.39Å; E177-I179 PolarHBondContact O-N 2.96Å; I179-M191 HydrophobicContact CB-CE 4.23Å; I179-M191 HydrophobicContact CG2-CE 3.8Å; I179-M191 WeakPolarHBondContact O-CE 3.08Å
180	Y	88.2	Confident	86.4	Confident	43 Å²	43	60.7 Å²	60.7	17%	0.169	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	163.8	176.6	54.4	-90.1	0	0	0	111.1	T158 I175 L188 M191	T158-Y180 PolarHBondContact N-O 3.41Å; T158-Y180 WeakPolarHBondContact OG1-CE2 3.44Å; I175-Y180 HydrophobicContact CG2-CD1 4.15Å; I175-Y180 HydrophobicContact CG2-CG 4.12Å; Y180-L188 HydrophobicContact CD2-CD1 4.33Å; Y180-L188 HydrophobicContact CD2-CD2 4.09Å; Y180-L188 HydrophobicContact CE2-CD1 4.08Å; Y180-L188 HydrophobicContact CE2-CD2 3.99Å; Y180-M191 VanDerWaalsContact CA-CE 3.42Å
181	L	88	Confident	86.4	Confident	0 Å²	0	60.6 Å²	60.6	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	120.3	177.6	-55.8	174.6	0	0	0	108.9	I155 R157 L188 W189 M191 L194	I155-L181 HydrophobicContact CG2-CB 4.41Å; I155-L181 HydrophobicContact CG2-CD2 3.86Å; R157-L181 HydrophobicContact CG-CD2 3.98Å; L181-L188 WeakPolarHBondContact O-CA 3.37Å; L181-W189 HydrophobicContact CB-CB 4.29Å; L181-W189 PolarHBondContact N-O 3.37Å; L181-W189 PolarHBondContact O-N 3.45Å; L181-M191 HydrophobicContact CD2-CE 3.52Å; L181-M191 HydrophobicContact CD2-SD 4.13Å; L181-M191 HydrophobicContact CG-CE 3.6Å; L181-M191 HydrophobicContact CG-SD 4.38Å; L181-L194 HydrophobicContact CD1-CB 3.63Å; L181-L194 HydrophobicContact CD1-CD2 3.78Å; L181-L194 HydrophobicContact CD1-CG 4.36Å
182	G	88.5	Confident	86.2	Confident	8 Å²	8	63.8 Å²	63.8	8%	0.082	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	124.2	168.4	0	0	0	0	0	110.4	K156	K156-G182 PolarHBondContact N-O 3.32Å; K156-G182 PolarHBondContact O-N 3.14Å
183	L	86.9	Confident	86.3	Confident	9 Å²	9	59.4 Å²	59.4	5%	0.047	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	156.7	170	-65.1	-171.4	0	0	0	110.8	I155 D185 G186 Q187 L194 I216	I155-L183 HydrophobicContact CG1-CD2 3.76Å; L183-D185 WeakPolarHBondContact CB-OD1 3.39Å; L183-D185 PolarHBondContact O-N 3.2Å; L183-G186 PolarHBondContact O-N 2.89Å; L183-Q187 HydrophobicContact CB-CB 4.44Å; L183-Q187 HydrophobicContact CD1-CB 4.48Å; L183-Q187 PolarHBondContact N-O 2.86Å; L183-L194 HydrophobicContact CD1-CD1 4Å; L183-L194 HydrophobicContact CD2-CD1 4.18Å; L183-L194 HydrophobicContact CD2-CD2 3.94Å; L183-L194 HydrophobicContact CG-CD1 4.37Å; L183-I216 HydrophobicContact CD1-CD1 4.21Å
184	S	80.8	Confident	86.4	Confident	72 Å²	72	53.9 Å²	53.9	50%	0.503	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-6.5	178.1	54.2	0	0	0	0	115	S153 I154 G186	S153-S184 VanDerWaalsContact CA-OG 3.3Å; S153-S184 WeakPolarHBondContact CA-OG 3.39Å; I154-S184 PolarHBondContact N-OG 3.2Å; I154-S184 PolarHBondContact O-N 3.02Å; S184-G186 VanDerWaalsContact C-N 3.33Å
185	D	79.2	Confident	86.6	Confident	68 Å²	68	55.6 Å²	55.6	36%	0.364	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.9	5.9	169.6	47.6	37.2	0	0	0	112.4	S153 L183 Q187 N211	S153-D185 PolarHBondContact OG-OD2 2.91Å; L183-D185 WeakPolarHBondContact CB-OD1 3.39Å; L183-D185 PolarHBondContact O-N 3.2Å; D185-Q187 VanDerWaalsContact C-N 3.32Å; D185-Q187 WeakPolarHBondContact OD1-CB 3.38Å; D185-Q187 WeakPolarHBondContact OD1-CG 3.41Å; D185-Q187 PolarHBondContact OD1-N 2.87Å; D185-N211 PolarHBondContact OD2-ND2 3.04Å
186	G	81.6	Confident	86.8	Confident	58 Å²	58	54.7 Å²	54.7	60%	0.598	28%	0.284	S	S	*	.	S	Bend	trans	86.9	-5.6	177.1	0	0	0	0	0	114.6	L183 S184	L183-G186 PolarHBondContact O-N 2.89Å; S184-G186 VanDerWaalsContact C-N 3.33Å
187	Q	85.7	Confident	87.1	Confident	62 Å²	62	51.1 Å²	51.1	29%	0.29	28%	0.276	S	S	.	.			trans	-71.2	138.3	178.5	-62.1	-178.8	-1.7	0	0	111.4	T169 L183 D185	T169-Q187 HydrophobicContact CG2-CG 4.28Å; L183-Q187 HydrophobicContact CB-CB 4.44Å; L183-Q187 HydrophobicContact CD1-CB 4.48Å; L183-Q187 PolarHBondContact N-O 2.86Å; D185-Q187 VanDerWaalsContact C-N 3.32Å; D185-Q187 WeakPolarHBondContact OD1-CB 3.38Å; D185-Q187 WeakPolarHBondContact OD1-CG 3.41Å; D185-Q187 PolarHBondContact OD1-N 2.87Å
188	L	90.4	Very high	87.3	Confident	33 Å²	33	51.1 Å²	51.1	17%	0.173	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	141.9	177.3	-57.5	-172.5	0	0	0	110.6	K166 C168 T169 I175 Y180 L181	K166-L188 HydrophobicContact CB-CD1 3.93Å; K166-L188 HydrophobicContact CD-CD1 3.65Å; K166-L188 HydrophobicContact CG-CD1 4.42Å; C168-L188 WeakPolarHBondContact CA-O 3.49Å; T169-L188 PolarHBondContact N-O 2.93Å; T169-L188 PolarHBondContact OG1-O 3.37Å; I175-L188 HydrophobicContact CD1-CB 3.53Å; Y180-L188 HydrophobicContact CD2-CD1 4.33Å; Y180-L188 HydrophobicContact CD2-CD2 4.09Å; Y180-L188 HydrophobicContact CE2-CD1 4.08Å; Y180-L188 HydrophobicContact CE2-CD2 3.99Å; L181-L188 WeakPolarHBondContact O-CA 3.37Å
189	W	90.7	Very high	87.7	Confident	26 Å²	26	45.7 Å²	45.7	10%	0.098	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	139.3	-174.7	-58.3	71.5	0	0	0	110.6	T169 L181 C193 L194 I216	T169-W189 HydrophobicContact CG2-CZ2 4.09Å; L181-W189 HydrophobicContact CB-CB 4.29Å; L181-W189 PolarHBondContact N-O 3.37Å; L181-W189 PolarHBondContact O-N 3.45Å; W189-C193 HydrophobicContact CE3-CB 4.17Å; W189-C193 WeakPolarHBondContact CZ3-O 3.31Å; W189-L194 HydrophobicContact CB-CB 4.13Å; W189-L194 HydrophobicContact CD2-CB 4.31Å; W189-L194 HydrophobicContact CD2-CD1 3.62Å; W189-L194 HydrophobicContact CE3-CB 4.22Å; W189-L194 HydrophobicContact CE3-CD1 3.94Å; W189-L194 HydrophobicContact CG-CB 4.29Å; W189-L194 HydrophobicContact CG-CD1 3.92Å; W189-L194 HydrophobicContact CZ2-CD1 4.24Å; W189-L194 HydrophobicContact CZ3-CD1 4.36Å; W189-I216 HydrophobicContact CH2-CG1 4.21Å; W189-I216 HydrophobicContact CZ2-CG1 4.25Å
190	H	91.9	Very high	87.9	Confident	24 Å²	24	45 Å²	45	11%	0.111	28%	0.275	C	S	.	.			trans	-57.6	155.1	163.9	-64.5	118.2	0	0	0	110.9	C168 C171 I175 E177 N192 C193	C168-H190 VanDerWaalsContact CB-CE1 3.48Å; C168-H190 WeakPolarHBondContact CB-CE1 3.49Å; C168-H190 VanDerWaalsContact CB-ND1 3.25Å; C168-H190 WeakPolarHBondContact CB-ND1 3.34Å; C168-H190 PolarHBondContact SG-N 3.18Å; C168-H190 VanDerWaalsContact SG-N 3.39Å; C168-H190 PolarHBondContact SG-ND1 3.18Å; C168-H190 VanDerWaalsContact SG-ND1 3.41Å; C171-H190 PolarHBondContact SG-ND1 3.42Å; C171-H190 VanDerWaalsContact SG-ND1 3.39Å; I175-H190 WeakPolarHBondContact CA-NE2 3.4Å; E177-H190 IonicContact OE1-CD2 3.96Å; E177-H190 VanDerWaalsContact OE2-CA 3.23Å; E177-H190 WeakPolarHBondContact OE2-CA 3.5Å; E177-H190 WeakPolarHBondContact OE2-CB 3.3Å; E177-H190 IonicContact OE2-CD2 3.54Å; E177-H190 IonicContact OE2-CG 3.88Å; H190-N192 PolarHBondContact O-N 2.85Å; H190-N192 VanDerWaalsContact O-N 3.09Å; H190-C193 HydrophobicContact CB-CB 4.04Å; H190-C193 PolarHBondContact O-N 3.35Å; H190-C193 VanDerWaalsContact O-N 3.08Å
191	M	85.7	Confident	87.9	Confident	39 Å²	39	47.4 Å²	47.4	19%	0.192	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-47.7	-43	177	-75.3	-62.8	112	0	0	112.5	E177 I179 Y180 L181 C202	E177-M191 PolarHBondContact OE2-N 3.39Å; I179-M191 HydrophobicContact CB-CE 4.23Å; I179-M191 HydrophobicContact CG2-CE 3.8Å; I179-M191 WeakPolarHBondContact O-CE 3.08Å; Y180-M191 VanDerWaalsContact CA-CE 3.42Å; L181-M191 HydrophobicContact CD2-CE 3.52Å; L181-M191 HydrophobicContact CD2-SD 4.13Å; L181-M191 HydrophobicContact CG-CE 3.6Å; L181-M191 HydrophobicContact CG-SD 4.38Å; M191-C202 PolarHBondContact O-SG 3.07Å
192	N	86.7	Confident	88	Confident	116 Å²	116	48.8 Å²	48.8	62%	0.62	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.2	2.1	-173.6	-63.4	-23	0	0	0	114.6	H190 N195	H190-N192 PolarHBondContact O-N 2.85Å; H190-N192 VanDerWaalsContact O-N 3.09Å; N192-N195 PolarHBondContact O-ND2 3.42Å; N192-N195 PolarHBondContact O-OD1 2.87Å
193	C	91	Very high	88.1	Confident	31 Å²	31	48.4 Å²	48.4	21%	0.209	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.4	-25	-178.8	-74.4	0	0	0	0	113.7	C168 C171 W189 H190 N195	C168-C193 WeakPolarHBondContact SG-CB 3.5Å; C168-C193 VanDerWaalsContact SG-SG 3.7Å; C171-C193 VanDerWaalsContact SG-SG 3.68Å; W189-C193 HydrophobicContact CE3-CB 4.17Å; W189-C193 WeakPolarHBondContact CZ3-O 3.31Å; H190-C193 HydrophobicContact CB-CB 4.04Å; H190-C193 PolarHBondContact O-N 3.35Å; H190-C193 VanDerWaalsContact O-N 3.08Å; C193-N195 VanDerWaalsContact C-N 3.29Å; C193-N195 PolarHBondContact O-N 3.06Å
194	L	90.6	Very high	88.1	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	30%	0.297	C	S	.	.			trans	-79.8	77.9	178.9	-170.3	73.8	0	0	0	110.6	I155 L181 L183 W189 L203 I216	I155-L194 HydrophobicContact CD1-CD2 3.74Å; I155-L194 HydrophobicContact CG1-CD2 4Å; L181-L194 HydrophobicContact CD1-CB 3.63Å; L181-L194 HydrophobicContact CD1-CD2 3.78Å; L181-L194 HydrophobicContact CD1-CG 4.36Å; L183-L194 HydrophobicContact CD1-CD1 4Å; L183-L194 HydrophobicContact CD2-CD1 4.18Å; L183-L194 HydrophobicContact CD2-CD2 3.94Å; L183-L194 HydrophobicContact CG-CD1 4.37Å; W189-L194 HydrophobicContact CB-CB 4.13Å; W189-L194 HydrophobicContact CD2-CB 4.31Å; W189-L194 HydrophobicContact CD2-CD1 3.62Å; W189-L194 HydrophobicContact CE3-CB 4.22Å; W189-L194 HydrophobicContact CE3-CD1 3.94Å; W189-L194 HydrophobicContact CG-CB 4.29Å; W189-L194 HydrophobicContact CG-CD1 3.92Å; W189-L194 HydrophobicContact CZ2-CD1 4.24Å; W189-L194 HydrophobicContact CZ3-CD1 4.36Å; L194-L203 HydrophobicContact CD2-CB 4.09Å; L194-L203 HydrophobicContact CG-CB 4.21Å; L194-L203 WeakPolarHBondContact O-CB 3.24Å; L194-L203 WeakPolarHBondContact O-CG 3.19Å; L194-L203 PolarHBondContact O-N 3.35Å; L194-I216 HydrophobicContact CD1-CG1 4.35Å; L194-I216 HydrophobicContact CD1-CG2 4.06Å
195	N	92.6	Very high	88.2	Confident	64 Å²	64	53.2 Å²	53.2	34%	0.342	31%	0.305	S	S	.	.	B	Isolated β-bridge	trans	-105.1	149	-176.1	-61.3	-38	0	0	0	111.7	N192 C193 N197 C202	N192-N195 PolarHBondContact O-ND2 3.42Å; N192-N195 PolarHBondContact O-OD1 2.87Å; C193-N195 VanDerWaalsContact C-N 3.29Å; C193-N195 PolarHBondContact O-N 3.06Å; N195-N197 PolarHBondContact O-N 3.09Å; N195-C202 WeakPolarHBondContact OD1-CA 3.39Å; N195-C202 WeakPolarHBondContact OD1-CB 3.48Å
196	C	92.8	Very high	88.5	Confident	3 Å²	3	51.6 Å²	51.6	2%	0.02	30%	0.295	C	S	.	.			trans	-71	126.5	172.7	-179.1	0	0	0	0	111.4	T198 G200 K201 L203 C218 D221	C196-T198 PolarHBondContact O-N 3.21Å; C196-T198 VanDerWaalsContact O-N 3.14Å; C196-T198 PolarHBondContact SG-N 3.28Å; C196-T198 VanDerWaalsContact SG-N 3.39Å; C196-G200 VanDerWaalsContact O-CA 3.27Å; C196-G200 WeakPolarHBondContact O-CA 3.35Å; C196-G200 PolarHBondContact O-N 3.23Å; C196-K201 PolarHBondContact N-O 3.22Å; C196-L203 HydrophobicContact CB-CD2 4.32Å; C196-C218 HydrophobicContact CB-CB 4.01Å; C196-C218 PolarHBondContact SG-N 3.48Å; C196-D221 PolarHBondContact SG-OD2 3.11Å
197	N	89.9	Confident	88.7	Confident	97 Å²	97	54.2 Å²	54.2	52%	0.519	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-22.2	177.4	-168.2	94.4	0	0	0	113.8	N195 Q215 I216	N195-N197 PolarHBondContact O-N 3.09Å; N197-Q215 HydrophobicContact CB-CB 4.24Å; N197-Q215 PolarHBondContact ND2-OE1 2.9Å; N197-I216 WeakPolarHBondContact CB-O 3.46Å; N197-I216 PolarHBondContact N-O 2.87Å
198	T	86.8	Confident	88.9	Confident	72 Å²	72	51.8 Å²	51.8	44%	0.442	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.3	-49.1	-178.6	-56.4	0	0	0	0	113.3	C196 Y217 D221 I225	C196-T198 PolarHBondContact O-N 3.21Å; C196-T198 VanDerWaalsContact O-N 3.14Å; C196-T198 PolarHBondContact SG-N 3.28Å; C196-T198 VanDerWaalsContact SG-N 3.39Å; T198-Y217 WeakPolarHBondContact OG1-CD1 3.42Å; T198-D221 HydrophobicContact CG2-CB 4.14Å; T198-I225 HydrophobicContact CG2-CD1 4.04Å; T198-I225 WeakPolarHBondContact OG1-CD1 3.41Å
199	C	90.1	Very high	88.9	Confident	67 Å²	67	50.2 Å²	50.2	45%	0.453	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.5	3.7	-174	68.1	0	0	0	0	114.4	K201 D221	C199-K201 PolarHBondContact O-N 3.45Å; C199-K201 WeakPolarHBondContact SG-CB 3.45Å; C199-D221 PolarHBondContact SG-OD2 3.03Å
200	G	88	Confident	88.8	Confident	53 Å²	53	50.1 Å²	50.1	55%	0.546	28%	0.281	S	S	.	.			trans	67.2	-9.9	-177	0	0	0	0	0	115.2	C196 C202	C196-G200 VanDerWaalsContact O-CA 3.27Å; C196-G200 WeakPolarHBondContact O-CA 3.35Å; C196-G200 PolarHBondContact O-N 3.23Å; G200-C202 PolarHBondContact O-N 3.28Å
201	K	88.8	Confident	88.7	Confident	94 Å²	94	50.6 Å²	50.6	41%	0.409	29%	0.285	S	S	.	.			trans	-61.5	128.2	-174.4	-171.2	-147.5	162.5	-174.1	0	111.6	C196 C199 L203 E206	C196-K201 PolarHBondContact N-O 3.22Å; C199-K201 PolarHBondContact O-N 3.45Å; C199-K201 WeakPolarHBondContact SG-CB 3.45Å; K201-L203 WeakPolarHBondContact O-CD2 3.33Å; K201-E206 IonicContact NZ-OE1 2.76Å; K201-E206 PolarHBondContact NZ-OE1 3.09Å
202	C	90.4	Very high	88.5	Confident	28 Å²	28	52 Å²	52	19%	0.189	29%	0.288	C	S	.	.	B	Isolated β-bridge	trans	-59.7	138.5	168	-175.2	0	0	0	0	112.2	M191 N195 G200	M191-C202 PolarHBondContact O-SG 3.07Å; N195-C202 WeakPolarHBondContact OD1-CA 3.39Å; N195-C202 WeakPolarHBondContact OD1-CB 3.48Å; G200-C202 PolarHBondContact O-N 3.28Å
203	L	89.8	Confident	88.2	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	29%	0.294	C	S	.	.			trans	-104.5	9.6	-175.9	-52.4	-176.9	0	0	0	112.9	I155 L194 C196 K201 K205 E206 C209 I216 C218	I155-L203 HydrophobicContact CD1-CB 4.34Å; L194-L203 HydrophobicContact CD2-CB 4.09Å; L194-L203 HydrophobicContact CG-CB 4.21Å; L194-L203 WeakPolarHBondContact O-CB 3.24Å; L194-L203 WeakPolarHBondContact O-CG 3.19Å; L194-L203 PolarHBondContact O-N 3.35Å; C196-L203 HydrophobicContact CB-CD2 4.32Å; K201-L203 WeakPolarHBondContact O-CD2 3.33Å; L203-K205 PolarHBondContact O-N 3.37Å; L203-E206 PolarHBondContact O-N 2.94Å; L203-C209 HydrophobicContact CD1-CB 3.62Å; L203-I216 HydrophobicContact CD1-CG2 3.71Å; L203-C218 HydrophobicContact CD2-CB 3.45Å; L203-C218 VanDerWaalsContact CD2-CB 3.45Å
204	D	86.1	Confident	87.7	Confident	29 Å²	29	57 Å²	57	16%	0.155	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-41.9	-39.1	173.5	71.2	-36.2	0	0	0	114.1	R157	R157-D204 VanDerWaalsContact CZ-O 3.29Å; R157-D204 PolarHBondContact NE-O 3.05Å; R157-D204 PolarHBondContact NH2-O 3.08Å
205	K	84	Confident	87.4	Confident	153 Å²	153	60.9 Å²	60.9	67%	0.665	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.5	-13.1	-176	-74.5	156.4	-174.6	104	0	114.2	L203	L203-K205 PolarHBondContact O-N 3.37Å
206	E	85.6	Confident	87.3	Confident	35 Å²	35	58.2 Å²	58.2	16%	0.164	32%	0.319	C	S	.	.			trans	-86.2	146.8	177	-65.4	-169.2	-161.7	0	0	110.9	I155 K201 L203 R219	I155-E206 WeakPolarHBondContact CD1-O 3.46Å; K201-E206 IonicContact NZ-OE1 2.76Å; K201-E206 PolarHBondContact NZ-OE1 3.09Å; L203-E206 PolarHBondContact O-N 2.94Å; E206-R219 PolarHBondContact OE2-N 3Å
207	T	85.9	Confident	87.2	Confident	112 Å²	112	58.7 Å²	58.7	69%	0.687	32%	0.32	S	S	*	.	S	Bend	trans	-90.6	-9	-178.4	52.2	0	0	0	0	113.6	I155	I155-T207 PolarHBondContact N-O 3.19Å; I155-T207 VanDerWaalsContact N-O 3.12Å
208	S	89.1	Confident	87.2	Confident	12 Å²	12	54.2 Å²	54.2	8%	0.084	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.2	129.9	173	59.3	0	0	0	0	110.1	K152 S153	K152-S208 VanDerWaalsContact CE-CB 3.48Å; K152-S208 VanDerWaalsContact CE-OG 3.22Å; K152-S208 WeakPolarHBondContact CE-OG 3.34Å; S153-S208 WeakPolarHBondContact O-CA 3.43Å; S153-S208 VanDerWaalsContact O-CB 3.24Å; S153-S208 WeakPolarHBondContact O-CB 3.43Å
209	C	90.2	Very high	87.3	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	178	163.4	62	0	0	0	0	109.9	S153 I155 L203 I216	S153-C209 PolarHBondContact N-O 3.49Å; S153-C209 VanDerWaalsContact N-O 3.12Å; S153-C209 PolarHBondContact O-N 3.4Å; I155-C209 HydrophobicContact CD1-CB 4.08Å; L203-C209 HydrophobicContact CD1-CB 3.62Å; C209-I216 HydrophobicContact CB-CG2 3.69Å
210	F	90	Very high	87.1	Confident	23 Å²	23	61.9 Å²	61.9	10%	0.101	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	123.7	170	-66.1	-96.5	0	0	0	109.8	N151 K152 I216 Y217 R219 Y222	N151-F210 CarbonylContact O-C 3.48Å; N151-F210 WeakPolarHBondContact O-CA 3.35Å; N151-F210 WeakPolarHBondContact O-CB 3.36Å; K152-F210 HydrophobicContact CB-CD1 3.91Å; K152-F210 HydrophobicContact CB-CE1 3.74Å; K152-F210 HydrophobicContact CD-CE1 4.44Å; K152-F210 HydrophobicContact CG-CD1 4.15Å; K152-F210 HydrophobicContact CG-CE1 3.73Å; K152-F210 HydrophobicContact CG-CZ 4.04Å; F210-I216 WeakPolarHBondContact O-CA 3.14Å; F210-Y217 PolarHBondContact N-O 2.68Å; F210-Y217 PolarHBondContact O-N 3.15Å; F210-R219 HydrophobicContact CE2-CB 4.11Å; F210-R219 HydrophobicContact CE2-CG 4.08Å; F210-Y222 HydrophobicContact CB-CD1 4.09Å; F210-Y222 HydrophobicContact CB-CD2 3.23Å; F210-Y222 HydrophobicContact CB-CE1 4.5Å; F210-Y222 HydrophobicContact CB-CE2 3.73Å; F210-Y222 HydrophobicContact CB-CG 3.44Å; F210-Y222 VanDerWaalsContact CB-CG 3.44Å; F210-Y222 AromaticContact CD1-CD1 3.42Å; F210-Y222 HydrophobicContact CD1-CD1 3.42Å; F210-Y222 VanDerWaalsContact CD1-CD1 3.42Å; F210-Y222 HydrophobicContact CD1-CD2 4.06Å; F210-Y222 AromaticContact CD1-CE1 3.48Å; F210-Y222 HydrophobicContact CD1-CE1 3.48Å; F210-Y222 VanDerWaalsContact CD1-CE1 3.48Å; F210-Y222 HydrophobicContact CD1-CE2 4.12Å; F210-Y222 AromaticContact CD1-CG 3.73Å; F210-Y222 HydrophobicContact CD1-CG 3.73Å; F210-Y222 AromaticContact CD1-CZ 3.84Å; F210-Y222 AromaticContact CD2-CD1 3.95Å; F210-Y222 HydrophobicContact CD2-CD1 3.95Å; F210-Y222 HydrophobicContact CD2-CD2 4.44Å; F210-Y222 AromaticContact CD2-CG 3.75Å; F210-Y222 HydrophobicContact CD2-CG 3.75Å; F210-Y222 AromaticContact CE1-CD1 3.71Å; F210-Y222 HydrophobicContact CE1-CD1 3.71Å; F210-Y222 AromaticContact CE1-CE1 3.8Å; F210-Y222 HydrophobicContact CE1-CE1 3.8Å; F210-Y222 HydrophobicContact CE1-CG 4.39Å; F210-Y222 HydrophobicContact CE2-CD1 4.23Å; F210-Y222 HydrophobicContact CE2-CG 4.43Å; F210-Y222 AromaticContact CG-CD1 3.54Å; F210-Y222 HydrophobicContact CG-CD1 3.54Å; F210-Y222 AromaticContact CG-CD2 3.69Å; F210-Y222 HydrophobicContact CG-CD2 3.69Å; F210-Y222 HydrophobicContact CG-CE1 4.04Å; F210-Y222 HydrophobicContact CG-CE2 4.17Å; F210-Y222 AromaticContact CG-CG 3.35Å; F210-Y222 HydrophobicContact CG-CG 3.35Å; F210-Y222 HydrophobicContact CZ-CD1 4.11Å
211	N	88	Confident	87.1	Confident	35 Å²	35	60.1 Å²	60.1	19%	0.187	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	123.1	173.8	-173.6	-15.4	0	0	0	108.1	N151 D185 G214 I216	N151-N211 PolarHBondContact O-N 3.2Å; D185-N211 PolarHBondContact OD2-ND2 3.04Å; N211-G214 PolarHBondContact OD1-N 3Å; N211-I216 HydrophobicContact CB-CD1 3.8Å
212	R	81.7	Confident	86.9	Confident	68 Å²	68	57 Å²	57	26%	0.257	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	124.6	173.5	-171.5	-177.4	173.8	167.3	-2.7	109.8	G214 Q215 Y217 Y222	R212-G214 PolarHBondContact O-N 3.12Å; R212-Q215 PolarHBondContact N-O 3.12Å; R212-Q215 PolarHBondContact O-N 3.01Å; R212-Q215 VanDerWaalsContact O-N 3.07Å; R212-Y217 HydrophobicContact CB-CE2 4.04Å; R212-Y222 HydrophobicContact CB-CE2 4.28Å
213	Y	81	Confident	86.6	Confident	189 Å²	189	59.6 Å²	59.6	74%	0.741	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.7	33.1	-174.5	-46.9	-58.4	0	0	0	113.5	Q215	Y213-Q215 PolarHBondContact O-N 3.25Å
214	G	80.3	Confident	86	Confident	64 Å²	64	66.2 Å²	66.2	66%	0.66	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	78	-7	-176.9	0	0	0	0	0	114.9	N211 R212	N211-G214 PolarHBondContact OD1-N 3Å; R212-G214 PolarHBondContact O-N 3.12Å
215	Q	84.9	Confident	85.5	Confident	80 Å²	80	68.1 Å²	68.1	37%	0.374	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	134	173.4	-68.4	-176.8	0.2	0	0	110.5	N197 R212 Y213 Y217	N197-Q215 HydrophobicContact CB-CB 4.24Å; N197-Q215 PolarHBondContact ND2-OE1 2.9Å; R212-Q215 PolarHBondContact N-O 3.12Å; R212-Q215 PolarHBondContact O-N 3.01Å; R212-Q215 VanDerWaalsContact O-N 3.07Å; Y213-Q215 PolarHBondContact O-N 3.25Å; Q215-Y217 HydrophobicContact CB-CE1 4.39Å; Q215-Y217 HydrophobicContact CB-CE2 3.69Å; Q215-Y217 WeakPolarHBondContact CB-OH 3.49Å; Q215-Y217 WeakPolarHBondContact O-CD2 3.33Å; Q215-Y217 WeakPolarHBondContact O-CE2 3.49Å; Q215-Y217 PolarHBondContact OE1-OH 3.25Å
216	I	89.7	Confident	85.3	Confident	9 Å²	9	62.9 Å²	62.9	5%	0.046	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	129.5	176.1	-55.5	-57.9	0	0	0	109.6	L183 W189 L194 N197 L203 C209 F210 N211	L183-I216 HydrophobicContact CD1-CD1 4.21Å; W189-I216 HydrophobicContact CH2-CG1 4.21Å; W189-I216 HydrophobicContact CZ2-CG1 4.25Å; L194-I216 HydrophobicContact CD1-CG1 4.35Å; L194-I216 HydrophobicContact CD1-CG2 4.06Å; N197-I216 WeakPolarHBondContact CB-O 3.46Å; N197-I216 PolarHBondContact N-O 2.87Å; L203-I216 HydrophobicContact CD1-CG2 3.71Å; C209-I216 HydrophobicContact CB-CG2 3.69Å; F210-I216 WeakPolarHBondContact O-CA 3.14Å; N211-I216 HydrophobicContact CB-CD1 3.8Å
217	Y	90.6	Very high	84.2	Confident	12 Å²	12	63.3 Å²	63.3	5%	0.047	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	142.8	178.7	-54.4	-86.6	0	0	0	111.4	T198 F210 R212 Q215 Y222 I225 F226	T198-Y217 WeakPolarHBondContact OG1-CD1 3.42Å; F210-Y217 PolarHBondContact N-O 2.68Å; F210-Y217 PolarHBondContact O-N 3.15Å; R212-Y217 HydrophobicContact CB-CE2 4.04Å; Q215-Y217 HydrophobicContact CB-CE1 4.39Å; Q215-Y217 HydrophobicContact CB-CE2 3.69Å; Q215-Y217 WeakPolarHBondContact CB-OH 3.49Å; Q215-Y217 WeakPolarHBondContact O-CD2 3.33Å; Q215-Y217 WeakPolarHBondContact O-CE2 3.49Å; Q215-Y217 PolarHBondContact OE1-OH 3.25Å; Y217-Y222 HydrophobicContact CD2-CD2 4.23Å; Y217-I225 HydrophobicContact CD1-CD1 4.29Å; Y217-I225 HydrophobicContact CE1-CD1 4.23Å; Y217-F226 HydrophobicContact CD1-CE2 4.41Å; Y217-F226 HydrophobicContact CD2-CE2 4.04Å; Y217-F226 HydrophobicContact CE1-CE2 4.11Å; Y217-F226 HydrophobicContact CE1-CZ 4.49Å; Y217-F226 AromaticContact CE2-CE2 3.69Å; Y217-F226 HydrophobicContact CE2-CE2 3.69Å; Y217-F226 HydrophobicContact CE2-CZ 4.18Å; Y217-F226 HydrophobicContact CG-CE2 4.37Å; Y217-F226 AromaticContact CZ-CE2 3.72Å; Y217-F226 AromaticContact CZ-CZ 3.93Å
218	C	91.4	Very high	82.7	Confident	4 Å²	4	62.4 Å²	62.4	3%	0.027	32%	0.315	C	S	.	.			trans	-67.1	163.1	165.5	92.4	0	0	0	0	110	C196 L203 K220 D221 Y222	C196-C218 HydrophobicContact CB-CB 4.01Å; C196-C218 PolarHBondContact SG-N 3.48Å; L203-C218 HydrophobicContact CD2-CB 3.45Å; L203-C218 VanDerWaalsContact CD2-CB 3.45Å; C218-K220 VanDerWaalsContact C-N 3.29Å; C218-K220 PolarHBondContact O-N 2.86Å; C218-K220 PolarHBondContact SG-N 2.91Å; C218-D221 PolarHBondContact O-N 2.9Å; C218-D221 VanDerWaalsContact SG-CG 3.58Å; C218-D221 PolarHBondContact SG-N 2.97Å; C218-D221 VanDerWaalsContact SG-N 3.44Å; C218-D221 PolarHBondContact SG-OD2 3.24Å; C218-Y222 WeakPolarHBondContact O-CB 3.18Å; C218-Y222 PolarHBondContact O-N 2.97Å
219	R	87.3	Confident	80.8	Confident	137 Å²	137	66.5 Å²	66.5	52%	0.517	33%	0.332	S	S	.	.	H	α-helix	trans	-57.3	-40.1	-179.7	-179.8	172.1	-176.2	153	14.3	113.7	E206 F210 E223	E206-R219 PolarHBondContact OE2-N 3Å; F210-R219 HydrophobicContact CE2-CB 4.11Å; F210-R219 HydrophobicContact CE2-CG 4.08Å; R219-E223 HydrophobicContact CG-CG 4.42Å; R219-E223 IonicContact CZ-OE1 2.96Å; R219-E223 IonicContact NE-OE1 3.53Å; R219-E223 PolarHBondContact NE-OE1 2.84Å; R219-E223 IonicContact NE-OE2 3.8Å; R219-E223 IonicContact NH2-OE1 3.87Å; R219-E223 PolarHBondContact NH2-OE1 2.84Å; R219-E223 WeakPolarHBondContact O-CB 3.22Å; R219-E223 WeakPolarHBondContact O-CG 3.33Å; R219-E223 PolarHBondContact O-N 3.18Å
220	K	86.1	Confident	79.1	Confident	162 Å²	162	73.6 Å²	73.6	70%	0.704	36%	0.362	S	S	*	.	H	α-helix	trans	-65.3	-49.3	-178.2	-63.6	-176.8	-180	-178.9	0	111.3	C218 E223 Q224	C218-K220 VanDerWaalsContact C-N 3.29Å; C218-K220 PolarHBondContact O-N 2.86Å; C218-K220 PolarHBondContact SG-N 2.91Å; K220-E223 CarbonylContact O-C 3.55Å; K220-E223 PolarHBondContact O-N 2.85Å; K220-Q224 VanDerWaalsContact O-CB 3.25Å; K220-Q224 WeakPolarHBondContact O-CB 3.47Å; K220-Q224 PolarHBondContact O-N 2.72Å
221	D	87.5	Confident	77.5	Confident	17 Å²	17	76.5 Å²	76.5	9%	0.091	39%	0.386	C	S	.	.	H	α-helix	trans	-70.1	-37	-177	-53.7	-40.4	0	0	0	111	C196 T198 C199 C218 E223 Q224 I225	C196-D221 PolarHBondContact SG-OD2 3.11Å; T198-D221 HydrophobicContact CG2-CB 4.14Å; C199-D221 PolarHBondContact SG-OD2 3.03Å; C218-D221 PolarHBondContact O-N 2.9Å; C218-D221 VanDerWaalsContact SG-CG 3.58Å; C218-D221 PolarHBondContact SG-N 2.97Å; C218-D221 VanDerWaalsContact SG-N 3.44Å; C218-D221 PolarHBondContact SG-OD2 3.24Å; D221-E223 PolarHBondContact O-N 2.88Å; D221-Q224 PolarHBondContact O-N 3.28Å; D221-I225 HydrophobicContact CB-CD1 4.32Å; D221-I225 WeakPolarHBondContact O-CB 3.4Å; D221-I225 VanDerWaalsContact O-CG1 3.23Å; D221-I225 WeakPolarHBondContact O-CG1 3.41Å; D221-I225 PolarHBondContact O-N 3Å
222	Y	86.3	Confident	76.6	Confident	28 Å²	28	79.5 Å²	79.5	11%	0.11	40%	0.395	C	S	.	.	H	α-helix	trans	-62.5	-43	171.1	-169.4	-93.2	0	0	0	111.7	N151 F210 R212 Y217 C218 Q224 F226 G227	N151-Y222 HydrophobicContact CB-CE2 4.45Å; N151-Y222 WeakPolarHBondContact CB-OH 3.33Å; N151-Y222 PolarHBondContact ND2-OH 3.02Å; F210-Y222 HydrophobicContact CB-CD1 4.09Å; F210-Y222 HydrophobicContact CB-CD2 3.23Å; F210-Y222 HydrophobicContact CB-CE1 4.5Å; F210-Y222 HydrophobicContact CB-CE2 3.73Å; F210-Y222 HydrophobicContact CB-CG 3.44Å; F210-Y222 VanDerWaalsContact CB-CG 3.44Å; F210-Y222 AromaticContact CD1-CD1 3.42Å; F210-Y222 HydrophobicContact CD1-CD1 3.42Å; F210-Y222 VanDerWaalsContact CD1-CD1 3.42Å; F210-Y222 HydrophobicContact CD1-CD2 4.06Å; F210-Y222 AromaticContact CD1-CE1 3.48Å; F210-Y222 HydrophobicContact CD1-CE1 3.48Å; F210-Y222 VanDerWaalsContact CD1-CE1 3.48Å; F210-Y222 HydrophobicContact CD1-CE2 4.12Å; F210-Y222 AromaticContact CD1-CG 3.73Å; F210-Y222 HydrophobicContact CD1-CG 3.73Å; F210-Y222 AromaticContact CD1-CZ 3.84Å; F210-Y222 AromaticContact CD2-CD1 3.95Å; F210-Y222 HydrophobicContact CD2-CD1 3.95Å; F210-Y222 HydrophobicContact CD2-CD2 4.44Å; F210-Y222 AromaticContact CD2-CG 3.75Å; F210-Y222 HydrophobicContact CD2-CG 3.75Å; F210-Y222 AromaticContact CE1-CD1 3.71Å; F210-Y222 HydrophobicContact CE1-CD1 3.71Å; F210-Y222 AromaticContact CE1-CE1 3.8Å; F210-Y222 HydrophobicContact CE1-CE1 3.8Å; F210-Y222 HydrophobicContact CE1-CG 4.39Å; F210-Y222 HydrophobicContact CE2-CD1 4.23Å; F210-Y222 HydrophobicContact CE2-CG 4.43Å; F210-Y222 AromaticContact CG-CD1 3.54Å; F210-Y222 HydrophobicContact CG-CD1 3.54Å; F210-Y222 AromaticContact CG-CD2 3.69Å; F210-Y222 HydrophobicContact CG-CD2 3.69Å; F210-Y222 HydrophobicContact CG-CE1 4.04Å; F210-Y222 HydrophobicContact CG-CE2 4.17Å; F210-Y222 AromaticContact CG-CG 3.35Å; F210-Y222 HydrophobicContact CG-CG 3.35Å; F210-Y222 HydrophobicContact CZ-CD1 4.11Å; R212-Y222 HydrophobicContact CB-CE2 4.28Å; Y217-Y222 HydrophobicContact CD2-CD2 4.23Å; C218-Y222 WeakPolarHBondContact O-CB 3.18Å; C218-Y222 PolarHBondContact O-N 2.97Å; Y222-Q224 VanDerWaalsContact C-N 3.34Å; Y222-F226 AromaticContact CD2-CD2 3.41Å; Y222-F226 HydrophobicContact CD2-CD2 3.41Å; Y222-F226 VanDerWaalsContact CD2-CD2 3.41Å; Y222-F226 HydrophobicContact CD2-CE2 4.02Å; Y222-F226 HydrophobicContact CD2-CG 4.37Å; Y222-F226 HydrophobicContact CE1-CB 4.41Å; Y222-F226 HydrophobicContact CE2-CB 4.25Å; Y222-F226 AromaticContact CE2-CD2 3.56Å; Y222-F226 HydrophobicContact CE2-CD2 3.56Å; Y222-F226 HydrophobicContact CE2-CE2 4.24Å; Y222-F226 HydrophobicContact CE2-CG 4.21Å; Y222-F226 HydrophobicContact CG-CD2 4.09Å; Y222-F226 CarbonylContact O-C 3.53Å; Y222-F226 WeakPolarHBondContact O-CA 3.5Å; Y222-F226 WeakPolarHBondContact O-CB 3.46Å; Y222-F226 PolarHBondContact O-N 3.2Å; Y222-G227 PolarHBondContact O-N 2.94Å
223	E	83.4	Confident	76.3	Confident	83 Å²	83	78.6 Å²	78.6	39%	0.388	40%	0.397	S	S	.	.	H	α-helix	trans	-67.7	-32.5	176.4	-74.5	179.6	-176.5	0	0	112.7	R219 K220 D221 G227 S228	R219-E223 HydrophobicContact CG-CG 4.42Å; R219-E223 IonicContact CZ-OE1 2.96Å; R219-E223 IonicContact NE-OE1 3.53Å; R219-E223 PolarHBondContact NE-OE1 2.84Å; R219-E223 IonicContact NE-OE2 3.8Å; R219-E223 IonicContact NH2-OE1 3.87Å; R219-E223 PolarHBondContact NH2-OE1 2.84Å; R219-E223 WeakPolarHBondContact O-CB 3.22Å; R219-E223 WeakPolarHBondContact O-CG 3.33Å; R219-E223 PolarHBondContact O-N 3.18Å; K220-E223 CarbonylContact O-C 3.55Å; K220-E223 PolarHBondContact O-N 2.85Å; D221-E223 PolarHBondContact O-N 2.88Å; E223-G227 CarbonylContact O-C 3.45Å; E223-G227 PolarHBondContact O-N 3.14Å; E223-S228 PolarHBondContact O-N 2.95Å
224	Q	78.1	Confident	76.4	Confident	139 Å²	139	72.9 Å²	72.9	65%	0.65	38%	0.382	S	S	*	.	H	α-helix	trans	-78.6	-39.8	179.1	179	168.4	-36.6	0	0	113.8	K220 D221 Y222 F229	K220-Q224 VanDerWaalsContact O-CB 3.25Å; K220-Q224 WeakPolarHBondContact O-CB 3.47Å; K220-Q224 PolarHBondContact O-N 2.72Å; D221-Q224 PolarHBondContact O-N 3.28Å; Y222-Q224 VanDerWaalsContact C-N 3.34Å; Q224-F229 VanDerWaalsContact O-CD2 3.26Å; Q224-F229 WeakPolarHBondContact O-CD2 3.5Å; Q224-F229 WeakPolarHBondContact O-CE2 3.27Å
225	I	75.4	Confident	76.9	Confident	68 Å²	68	69.9 Å²	69.9	35%	0.349	35%	0.351	S	S	.	.	H	α-helix	trans	-86.6	-35.2	-179.4	-57	166.2	0	0	0	110.6	T198 Y217 D221	T198-I225 HydrophobicContact CG2-CD1 4.04Å; T198-I225 WeakPolarHBondContact OG1-CD1 3.41Å; Y217-I225 HydrophobicContact CD1-CD1 4.29Å; Y217-I225 HydrophobicContact CE1-CD1 4.23Å; D221-I225 HydrophobicContact CB-CD1 4.32Å; D221-I225 WeakPolarHBondContact O-CB 3.4Å; D221-I225 VanDerWaalsContact O-CG1 3.23Å; D221-I225 WeakPolarHBondContact O-CG1 3.41Å; D221-I225 PolarHBondContact O-N 3Å
226	F	78.6	Confident	77.2	Confident	44 Å²	44	67.5 Å²	67.5	19%	0.193	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	-127.7	-43.2	-171.2	-48	-65.5	0	0	0	114.3	Y217 Y222 S228 F229	Y217-F226 HydrophobicContact CD1-CE2 4.41Å; Y217-F226 HydrophobicContact CD2-CE2 4.04Å; Y217-F226 HydrophobicContact CE1-CE2 4.11Å; Y217-F226 HydrophobicContact CE1-CZ 4.49Å; Y217-F226 AromaticContact CE2-CE2 3.69Å; Y217-F226 HydrophobicContact CE2-CE2 3.69Å; Y217-F226 HydrophobicContact CE2-CZ 4.18Å; Y217-F226 HydrophobicContact CG-CE2 4.37Å; Y217-F226 AromaticContact CZ-CE2 3.72Å; Y217-F226 AromaticContact CZ-CZ 3.93Å; Y222-F226 AromaticContact CD2-CD2 3.41Å; Y222-F226 HydrophobicContact CD2-CD2 3.41Å; Y222-F226 VanDerWaalsContact CD2-CD2 3.41Å; Y222-F226 HydrophobicContact CD2-CE2 4.02Å; Y222-F226 HydrophobicContact CD2-CG 4.37Å; Y222-F226 HydrophobicContact CE1-CB 4.41Å; Y222-F226 HydrophobicContact CE2-CB 4.25Å; Y222-F226 AromaticContact CE2-CD2 3.56Å; Y222-F226 HydrophobicContact CE2-CD2 3.56Å; Y222-F226 HydrophobicContact CE2-CE2 4.24Å; Y222-F226 HydrophobicContact CE2-CG 4.21Å; Y222-F226 HydrophobicContact CG-CD2 4.09Å; Y222-F226 CarbonylContact O-C 3.53Å; Y222-F226 WeakPolarHBondContact O-CA 3.5Å; Y222-F226 WeakPolarHBondContact O-CB 3.46Å; Y222-F226 PolarHBondContact O-N 3.2Å; F226-S228 PolarHBondContact O-N 3.48Å; F226-S228 VanDerWaalsContact O-N 3.09Å; F226-F229 PolarHBondContact O-N 3.39Å
227	G	62.7	Low	77.1	Confident	43 Å²	43	71 Å²	71	44%	0.443	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.3	3	-166.7	0	0	0	0	0	116.9	Y222 E223	Y222-G227 PolarHBondContact O-N 2.94Å; E223-G227 CarbonylContact O-C 3.45Å; E223-G227 PolarHBondContact O-N 3.14Å
228	S	54.6	Low	77.1	Confident	93 Å²	93	72.6 Å²	72.6	65%	0.65	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-136.2	16.8	157.5	-74.9	0	0	0	0	113.3	E223 F226	E223-S228 PolarHBondContact O-N 2.95Å; F226-S228 PolarHBondContact O-N 3.48Å; F226-S228 VanDerWaalsContact O-N 3.09Å
229	F	49.9	Very low	76.9	Confident	99 Å²	99	79.3 Å²	79.3	43%	0.434	40%	0.396	S	S	.	.			trans	-107	53.5	179.7	-80.8	-97.3	0	0	0	112.5	Q224 F226 S231 R232	Q224-F229 VanDerWaalsContact O-CD2 3.26Å; Q224-F229 WeakPolarHBondContact O-CD2 3.5Å; Q224-F229 WeakPolarHBondContact O-CE2 3.27Å; F226-F229 PolarHBondContact O-N 3.39Å; F229-S231 PolarHBondContact O-N 2.89Å; F229-R232 HydrophobicContact CD1-CB 4.14Å; F229-R232 HydrophobicContact CD1-CG 4.03Å; F229-R232 HydrophobicContact CD2-CG 4.28Å; F229-R232 HydrophobicContact CE1-CB 3.78Å; F229-R232 HydrophobicContact CE1-CG 3.71Å; F229-R232 HydrophobicContact CE2-CG 3.96Å; F229-R232 HydrophobicContact CG-CG 4.32Å; F229-R232 HydrophobicContact CZ-CB 4.21Å; F229-R232 HydrophobicContact CZ-CG 3.7Å
230	K	52.9	Low	76.8	Confident	148 Å²	148	79.1 Å²	79.1	64%	0.643	40%	0.401	S	S	*	.	S	Bend	trans	-71.2	75.1	135.1	-90.4	-157.7	170.8	-166.1	0	106.6
231	S	58	Low	76.7	Confident	84 Å²	84	75.3 Å²	75.3	59%	0.587	39%	0.388	S	S	*	.			trans	37.4	92.3	-177.1	57	0	0	0	0	113.5	F229 P233	F229-S231 PolarHBondContact O-N 2.89Å; S231-P233 WeakPolarHBondContact O-CD 3.46Å
232	R	67.5	Low	76.6	Confident	99 Å²	99	74.8 Å²	74.8	37%	0.374	39%	0.385	S	S	.	.			trans	-49.7	119.8	167.1	-82.4	-169.2	67.9	170.5	-4.9	107.1	F229 V234 L241	F229-R232 HydrophobicContact CD1-CB 4.14Å; F229-R232 HydrophobicContact CD1-CG 4.03Å; F229-R232 HydrophobicContact CD2-CG 4.28Å; F229-R232 HydrophobicContact CE1-CB 3.78Å; F229-R232 HydrophobicContact CE1-CG 3.71Å; F229-R232 HydrophobicContact CE2-CG 3.96Å; F229-R232 HydrophobicContact CG-CG 4.32Å; F229-R232 HydrophobicContact CZ-CB 4.21Å; F229-R232 HydrophobicContact CZ-CG 3.7Å; R232-V234 PolarHBondContact O-N 3.37Å; R232-L241 HydrophobicContact CB-CD1 3.62Å; R232-L241 HydrophobicContact CB-CG 4.48Å
233	P	75.4	Confident	76.3	Confident	49 Å²	49	76.4 Å²	76.4	32%	0.318	40%	0.401	S	S	.	.			trans	-63.5	134.7	-165.9	19.4	-28.3	0	0	0	109.7	S231 I242 I256	S231-P233 WeakPolarHBondContact O-CD 3.46Å; P233-I242 HydrophobicContact CB-CB 4.27Å; P233-I242 HydrophobicContact CB-CD1 3.83Å; P233-I242 HydrophobicContact CG-CB 4.04Å; P233-I242 HydrophobicContact CG-CD1 4.47Å; P233-I242 HydrophobicContact CG-CG2 4.17Å; P233-I242 VanDerWaalsContact O-CB 3.29Å; P233-I242 WeakPolarHBondContact O-CB 3.47Å; P233-I242 PolarHBondContact O-N 3.21Å; P233-I256 HydrophobicContact CB-CD1 3.99Å
234	V	84.8	Confident	76.2	Confident	69 Å²	69	76.6 Å²	76.6	42%	0.418	41%	0.411	S	S	.	.	B	Isolated β-bridge	trans	-108.8	134.3	178.4	174.1	0	0	0	0	107.3	R232 T236 K239 Q240 L241	R232-V234 PolarHBondContact O-N 3.37Å; V234-T236 PolarHBondContact O-N 2.8Å; V234-K239 VanDerWaalsContact CG1-C 3.5Å; V234-K239 HydrophobicContact CG1-CB 4.46Å; V234-K239 VanDerWaalsContact CG1-O 3.31Å; V234-K239 WeakPolarHBondContact CG1-O 3.24Å; V234-Q240 CarbonylContact C-O 3.59Å; V234-Q240 WeakPolarHBondContact CA-O 3.22Å; V234-L241 HydrophobicContact CG2-CD1 4.12Å
235	C	90.8	Very high	76.2	Confident	0 Å²	0	74.7 Å²	74.7	0%	0	41%	0.405	C	S	.	.			trans	-65.6	124.5	176.3	176.4	0	0	0	0	110	Y237 C238 K239 Q240 I242 H258 C261	C235-Y237 PolarHBondContact O-N 2.92Å; C235-C238 VanDerWaalsContact SG-SG 3.66Å; C235-K239 WeakPolarHBondContact O-CA 3.31Å; C235-K239 PolarHBondContact O-N 2.79Å; C235-Q240 PolarHBondContact N-O 3.35Å; C235-I242 HydrophobicContact CB-CD1 4.37Å; C235-I242 HydrophobicContact CB-CG1 4.34Å; C235-H258 WeakPolarHBondContact CB-CE1 3.4Å; C235-H258 PolarHBondContact SG-N 3.39Å; C235-C261 WeakPolarHBondContact SG-CB 3.34Å
236	T	89.6	Confident	76.8	Confident	31 Å²	31	74.6 Å²	74.6	19%	0.19	40%	0.403	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-28.9	-174.9	-51.2	0	0	0	0	111.8	V234 K239 L255 I256 F257	V234-T236 PolarHBondContact O-N 2.8Å; T236-K239 WeakPolarHBondContact O-CE 3.43Å; T236-K239 PolarHBondContact O-NZ 2.99Å; T236-L255 HydrophobicContact CG2-CB 4.3Å; T236-L255 HydrophobicContact CG2-CD1 4.29Å; T236-L255 HydrophobicContact CG2-CD2 4.26Å; T236-I256 WeakPolarHBondContact CB-O 3.48Å; T236-I256 PolarHBondContact N-O 2.92Å; T236-I256 PolarHBondContact OG1-N 3.49Å; T236-I256 PolarHBondContact OG1-O 3.02Å; T236-F257 HydrophobicContact CG2-CE1 4.28Å; T236-F257 HydrophobicContact CG2-CZ 4.05Å
237	Y	89.2	Confident	77.2	Confident	83 Å²	83	78 Å²	78	33%	0.325	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-78.2	174.8	-175.7	-104.7	0	0	0	111.6	C235 K239 C261 Q285	C235-Y237 PolarHBondContact O-N 2.92Å; Y237-K239 VanDerWaalsContact C-N 3.29Å; Y237-K239 PolarHBondContact O-N 2.97Å; Y237-C261 HydrophobicContact CD1-CB 4.09Å; Y237-C261 HydrophobicContact CG-CB 4.49Å; Y237-Q285 HydrophobicContact CD2-CG 4.33Å
238	C	90.4	Very high	78.5	Confident	44 Å²	44	79.5 Å²	79.5	30%	0.297	42%	0.42	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.5	-0.2	-171.2	69.1	0	0	0	0	115.8	C235 Q240 H258 C261	C235-C238 VanDerWaalsContact SG-SG 3.66Å; C238-Q240 PolarHBondContact O-N 3.44Å; C238-H258 PolarHBondContact SG-CE1 3.03Å; C238-H258 PolarHBondContact SG-ND1 3.07Å; C238-H258 VanDerWaalsContact SG-ND1 3.42Å; C238-C261 VanDerWaalsContact SG-SG 3.69Å
239	K	86.6	Confident	80.2	Confident	146 Å²	146	76.2 Å²	76.2	64%	0.635	40%	0.396	S	S	*	.			trans	58	12.8	-179.6	-42.5	-56	-177.5	-175.4	0	115.8	V234 C235 T236 Y237	V234-K239 VanDerWaalsContact CG1-C 3.5Å; V234-K239 HydrophobicContact CG1-CB 4.46Å; V234-K239 VanDerWaalsContact CG1-O 3.31Å; V234-K239 WeakPolarHBondContact CG1-O 3.24Å; C235-K239 WeakPolarHBondContact O-CA 3.31Å; C235-K239 PolarHBondContact O-N 2.79Å; T236-K239 WeakPolarHBondContact O-CE 3.43Å; T236-K239 PolarHBondContact O-NZ 2.99Å; Y237-K239 VanDerWaalsContact C-N 3.29Å; Y237-K239 PolarHBondContact O-N 2.97Å
240	Q	84.5	Confident	82.2	Confident	132 Å²	132	77.8 Å²	77.8	62%	0.617	40%	0.399	S	S	*	.			trans	-86.1	167.9	175.7	-64.8	-179.1	7	0	0	112.8	V234 C235 C238	V234-Q240 CarbonylContact C-O 3.59Å; V234-Q240 WeakPolarHBondContact CA-O 3.22Å; C235-Q240 PolarHBondContact N-O 3.35Å; C238-Q240 PolarHBondContact O-N 3.44Å
241	L	83.8	Confident	83.8	Confident	83 Å²	83	71 Å²	71	44%	0.435	37%	0.37	S	S	.	.	B	Isolated β-bridge	trans	-97.3	100.1	-163.2	-168.4	67.4	0	0	0	112.3	R232 V234	R232-L241 HydrophobicContact CB-CD1 3.62Å; R232-L241 HydrophobicContact CB-CG 4.48Å; V234-L241 HydrophobicContact CG2-CD1 4.12Å
242	I	85.3	Confident	84.9	Confident	5 Å²	5	71.1 Å²	71.1	3%	0.026	36%	0.363	C	S	.	.			trans	-54.7	136.1	-176.4	-64.8	155.2	0	0	0	111.3	P233 C235 E246 I248 I256 H258	P233-I242 HydrophobicContact CB-CB 4.27Å; P233-I242 HydrophobicContact CB-CD1 3.83Å; P233-I242 HydrophobicContact CG-CB 4.04Å; P233-I242 HydrophobicContact CG-CD1 4.47Å; P233-I242 HydrophobicContact CG-CG2 4.17Å; P233-I242 VanDerWaalsContact O-CB 3.29Å; P233-I242 WeakPolarHBondContact O-CB 3.47Å; P233-I242 PolarHBondContact O-N 3.21Å; C235-I242 HydrophobicContact CB-CD1 4.37Å; C235-I242 HydrophobicContact CB-CG1 4.34Å; I242-E246 HydrophobicContact CG2-CB 4.27Å; I242-I248 HydrophobicContact CD1-CG2 4.05Å; I242-I248 HydrophobicContact CG1-CG2 4.36Å; I242-I248 HydrophobicContact CG2-CG2 3.58Å; I242-I256 HydrophobicContact CD1-CB 4.27Å; I242-I256 HydrophobicContact CD1-CG2 3.58Å; I242-H258 WeakPolarHBondContact CG1-CD2 3.37Å; I242-H258 VanDerWaalsContact CG1-NE2 3.34Å; I242-H258 WeakPolarHBondContact CG1-NE2 3.23Å
243	S	81.3	Confident	85.6	Confident	63 Å²	63	71.2 Å²	71.2	44%	0.441	37%	0.371	S	S	.	.			trans	-80.7	149.7	178.4	-178.3	0	0	0	0	112.7	N245 E246	S243-N245 PolarHBondContact O-N 3.11Å; S243-N245 VanDerWaalsContact O-N 3.08Å; S243-E246 PolarHBondContact N-OE2 3.26Å; S243-E246 WeakPolarHBondContact O-CB 3.41Å; S243-E246 PolarHBondContact O-N 3.22Å
244	S	80.2	Confident	86	Confident	87 Å²	87	74.6 Å²	74.6	61%	0.608	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-13.5	-176.7	-65.4	0	0	0	0	114.8
245	N	79.5	Confident	86.2	Confident	99 Å²	99	73.4 Å²	73.4	53%	0.529	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.5	-0.9	-177.7	-60.2	-16.3	0	0	0	112.2	S243 Q613	S243-N245 PolarHBondContact O-N 3.11Å; S243-N245 VanDerWaalsContact O-N 3.08Å; N245-Q613 PolarHBondContact ND2-NE2 3.21Å
246	E	87.4	Confident	86.1	Confident	66 Å²	66	74.8 Å²	74.8	31%	0.308	38%	0.381	S	S	.	.			trans	-79.3	159.7	-172.8	-152.6	175	157.4	0	0	112.2	I242 S243 H258	I242-E246 HydrophobicContact CG2-CB 4.27Å; S243-E246 PolarHBondContact N-OE2 3.26Å; S243-E246 WeakPolarHBondContact O-CB 3.41Å; S243-E246 PolarHBondContact O-N 3.22Å; E246-H258 IonicContact OE1-CD2 3.89Å; E246-H258 PolarHBondContact OE1-CD2 3.47Å; E246-H258 IonicContact OE1-CG 2.79Å; E246-H258 IonicContact OE1-NE2 2.91Å; E246-H258 IonicContact OE2-CD2 3.22Å
247	L	87.7	Confident	86.2	Confident	115 Å²	115	73.4 Å²	73.4	60%	0.602	37%	0.372	S	S	*	.			trans	-90.5	137.3	167.6	-63.9	-178.8	0	0	0	109.3	S259	L247-S259 PolarHBondContact O-OG 2.91Å
248	I	90	Very high	86.3	Confident	74 Å²	74	70.2 Å²	70.2	38%	0.379	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	145.5	179.6	51.6	167.9	0	0	0	109.5	I242 I256 F257	I242-I248 HydrophobicContact CD1-CG2 4.05Å; I242-I248 HydrophobicContact CG1-CG2 4.36Å; I242-I248 HydrophobicContact CG2-CG2 3.58Å; I248-I256 HydrophobicContact CB-CG2 3.79Å; I248-I256 HydrophobicContact CD1-CG2 3.71Å; I248-I256 HydrophobicContact CG1-CG2 4.33Å; I248-I256 HydrophobicContact CG2-CG2 3.77Å; I248-F257 CarbonylContact C-O 3.59Å; I248-F257 VanDerWaalsContact CA-O 3.24Å; I248-F257 WeakPolarHBondContact CA-O 3.02Å; I248-F257 WeakPolarHBondContact CB-O 3.49Å
249	V	90.4	Very high	86.3	Confident	24 Å²	24	70.1 Å²	70.1	15%	0.145	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	139.8	157.8	-176.1	0	0	0	0	107.9	F257 F262	V249-F257 PolarHBondContact N-O 3.44Å; V249-F257 PolarHBondContact O-N 3.35Å; V249-F262 HydrophobicContact CB-CB 3.93Å; V249-F262 HydrophobicContact CB-CD1 4.11Å; V249-F262 HydrophobicContact CB-CD2 4.38Å; V249-F262 HydrophobicContact CB-CG 3.89Å; V249-F262 HydrophobicContact CG1-CB 4.27Å; V249-F262 HydrophobicContact CG1-CD1 3.48Å; V249-F262 VanDerWaalsContact CG1-CD1 3.48Å; V249-F262 HydrophobicContact CG1-CD2 4.13Å; V249-F262 HydrophobicContact CG1-CE1 3.69Å; V249-F262 HydrophobicContact CG1-CE2 4.36Å; V249-F262 HydrophobicContact CG1-CG 3.69Å; V249-F262 HydrophobicContact CG1-CZ 4.15Å; V249-F262 HydrophobicContact CG2-CB 3.92Å; V249-F262 HydrophobicContact CG2-CD1 4.31Å; V249-F262 HydrophobicContact CG2-CG 4.25Å
250	R	90.3	Very high	86.5	Confident	132 Å²	132	68.8 Å²	68.8	50%	0.498	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	121.3	172.9	-166.5	174.2	-138.9	165.6	-0.1	108.5	Q254 L255 I256	R250-Q254 VanDerWaalsContact CZ-OE1 3.29Å; R250-Q254 PolarHBondContact NE-O 3.07Å; R250-Q254 VanDerWaalsContact NE-OE1 3.09Å; R250-L255 WeakPolarHBondContact CA-O 3.26Å; R250-I256 HydrophobicContact CG-CG1 4.5Å
251	S	87	Confident	86.9	Confident	5 Å²	5	63.4 Å²	63.4	4%	0.035	34%	0.337	C	S	.	.			trans	-76.2	169.2	176.7	73.2	0	0	0	0	111	N253 Q254 L255 Y277	S251-N253 PolarHBondContact O-N 2.95Å; S251-Q254 PolarHBondContact O-N 3.49Å; S251-L255 PolarHBondContact N-O 2.86Å; S251-L255 WeakPolarHBondContact OG-CB 3.33Å; S251-Y277 WeakPolarHBondContact CA-OH 3.31Å
252	I	81.7	Confident	87.4	Confident	88 Å²	88	59.5 Å²	59.5	45%	0.451	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-34.4	179.1	-168.1	170.8	0	0	0	112.5	Q254 Y277 Y415	I252-Q254 PolarHBondContact O-N 3.26Å; I252-Y277 PolarHBondContact N-OH 2.64Å; I252-Y415 HydrophobicContact CD1-CD1 3.46Å; I252-Y415 VanDerWaalsContact CD1-CD1 3.46Å; I252-Y415 HydrophobicContact CD1-CE1 3.37Å; I252-Y415 HydrophobicContact CD1-CG 4.29Å; I252-Y415 HydrophobicContact CG2-CD1 4.17Å; I252-Y415 HydrophobicContact CG2-CD2 3.93Å; I252-Y415 HydrophobicContact CG2-CE1 4.33Å; I252-Y415 HydrophobicContact CG2-CE2 4.08Å; I252-Y415 HydrophobicContact CG2-CG 3.95Å
253	N	81.8	Confident	87.8	Confident	101 Å²	101	59.8 Å²	59.8	54%	0.54	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76	21.7	175.6	-65.4	-2.4	0	0	0	113.4	S251 L255 L279	S251-N253 PolarHBondContact O-N 2.95Å; N253-L255 HydrophobicContact CB-CD1 4.38Å; N253-L255 HydrophobicContact CB-CG 4.31Å; N253-L255 PolarHBondContact O-N 3.23Å; N253-L279 HydrophobicContact CB-CD1 4.13Å
254	Q	83.3	Confident	88.4	Confident	119 Å²	119	56.8 Å²	56.8	56%	0.556	30%	0.298	S	S	*	.	S	Bend	trans	61.6	-4.3	-179.2	-60.1	-69	-20.6	0	0	116.6	R250 S251 I252 I256	R250-Q254 VanDerWaalsContact CZ-OE1 3.29Å; R250-Q254 PolarHBondContact NE-O 3.07Å; R250-Q254 VanDerWaalsContact NE-OE1 3.09Å; S251-Q254 PolarHBondContact O-N 3.49Å; I252-Q254 PolarHBondContact O-N 3.26Å; Q254-I256 WeakPolarHBondContact O-CG1 3.32Å
255	L	88.7	Confident	89	Confident	44 Å²	44	55 Å²	55	23%	0.23	28%	0.281	C	S	.	.			trans	-58.9	141.9	176.1	-56.3	172.3	0	0	0	110.5	T236 R250 S251 N253 F257 L279 H284	T236-L255 HydrophobicContact CG2-CB 4.3Å; T236-L255 HydrophobicContact CG2-CD1 4.29Å; T236-L255 HydrophobicContact CG2-CD2 4.26Å; R250-L255 WeakPolarHBondContact CA-O 3.26Å; S251-L255 PolarHBondContact N-O 2.86Å; S251-L255 WeakPolarHBondContact OG-CB 3.33Å; N253-L255 HydrophobicContact CB-CD1 4.38Å; N253-L255 HydrophobicContact CB-CG 4.31Å; N253-L255 PolarHBondContact O-N 3.23Å; L255-F257 HydrophobicContact CB-CE2 3.82Å; L255-F257 HydrophobicContact CB-CZ 4.38Å; L255-L279 HydrophobicContact CD1-CD1 4.34Å; L255-H284 HydrophobicContact CD1-CB 3.86Å
256	I	89.7	Confident	89.5	Confident	30 Å²	30	54.5 Å²	54.5	15%	0.154	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	137.9	-171.3	-48.4	177.8	0	0	0	109.8	P233 T236 I242 I248 R250 Q254	P233-I256 HydrophobicContact CB-CD1 3.99Å; T236-I256 WeakPolarHBondContact CB-O 3.48Å; T236-I256 PolarHBondContact N-O 2.92Å; T236-I256 PolarHBondContact OG1-N 3.49Å; T236-I256 PolarHBondContact OG1-O 3.02Å; I242-I256 HydrophobicContact CD1-CB 4.27Å; I242-I256 HydrophobicContact CD1-CG2 3.58Å; I248-I256 HydrophobicContact CB-CG2 3.79Å; I248-I256 HydrophobicContact CD1-CG2 3.71Å; I248-I256 HydrophobicContact CG1-CG2 4.33Å; I248-I256 HydrophobicContact CG2-CG2 3.77Å; R250-I256 HydrophobicContact CG-CG1 4.5Å; Q254-I256 WeakPolarHBondContact O-CG1 3.32Å
257	F	91.1	Very high	89.8	Confident	1 Å²	1	53.9 Å²	53.9	0%	0.004	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	150.3	179.3	-58.1	-103.7	0	0	0	109.4	T236 I248 V249 L255 F262	T236-F257 HydrophobicContact CG2-CE1 4.28Å; T236-F257 HydrophobicContact CG2-CZ 4.05Å; I248-F257 CarbonylContact C-O 3.59Å; I248-F257 VanDerWaalsContact CA-O 3.24Å; I248-F257 WeakPolarHBondContact CA-O 3.02Å; I248-F257 WeakPolarHBondContact CB-O 3.49Å; V249-F257 PolarHBondContact N-O 3.44Å; V249-F257 PolarHBondContact O-N 3.35Å; L255-F257 HydrophobicContact CB-CE2 3.82Å; L255-F257 HydrophobicContact CB-CZ 4.38Å; F257-F262 HydrophobicContact CB-CB 4.22Å; F257-F262 HydrophobicContact CB-CD2 3.98Å; F257-F262 AromaticContact CD1-CD2 3.94Å; F257-F262 HydrophobicContact CD1-CD2 3.94Å; F257-F262 AromaticContact CD2-CD2 3.54Å; F257-F262 HydrophobicContact CD2-CD2 3.54Å; F257-F262 AromaticContact CD2-CE2 3.73Å; F257-F262 HydrophobicContact CD2-CE2 3.73Å; F257-F262 HydrophobicContact CE1-CD2 4.29Å; F257-F262 AromaticContact CE2-CD2 3.93Å; F257-F262 HydrophobicContact CE2-CD2 3.93Å; F257-F262 AromaticContact CE2-CE2 3.7Å; F257-F262 HydrophobicContact CE2-CE2 3.7Å; F257-F262 AromaticContact CG-CD2 3.57Å; F257-F262 HydrophobicContact CG-CD2 3.57Å; F257-F262 HydrophobicContact CG-CE2 4.21Å; F257-F262 HydrophobicContact CZ-CD2 4.29Å; F257-F262 HydrophobicContact CZ-CE2 4.13Å
258	H	91.7	Very high	90	Very high	17 Å²	17	54.1 Å²	54.1	8%	0.079	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.1	154.2	160.2	-49.3	130	0	0	0	109.1	C235 C238 I242 E246 D260 C261 F262	C235-H258 WeakPolarHBondContact CB-CE1 3.4Å; C235-H258 PolarHBondContact SG-N 3.39Å; C238-H258 PolarHBondContact SG-CE1 3.03Å; C238-H258 PolarHBondContact SG-ND1 3.07Å; C238-H258 VanDerWaalsContact SG-ND1 3.42Å; I242-H258 WeakPolarHBondContact CG1-CD2 3.37Å; I242-H258 VanDerWaalsContact CG1-NE2 3.34Å; I242-H258 WeakPolarHBondContact CG1-NE2 3.23Å; E246-H258 IonicContact OE1-CD2 3.89Å; E246-H258 PolarHBondContact OE1-CD2 3.47Å; E246-H258 IonicContact OE1-CG 2.79Å; E246-H258 IonicContact OE1-NE2 2.91Å; E246-H258 IonicContact OE2-CD2 3.22Å; H258-D260 VanDerWaalsContact C-N 3.28Å; H258-D260 PolarHBondContact O-N 3.47Å; H258-C261 HydrophobicContact CB-CB 3.95Å; H258-C261 PolarHBondContact ND1-SG 2.89Å; H258-C261 VanDerWaalsContact ND1-SG 3.37Å; H258-C261 PolarHBondContact O-N 3.04Å; H258-F262 PolarHBondContact O-N 2.66Å
259	S	91	Very high	90.1	Very high	42 Å²	42	55.1 Å²	55.1	29%	0.294	28%	0.277	S	S	.	.	G	3₁₀ helix	trans	-51.8	-44.9	176.5	-70.5	0	0	0	0	113.2	L247 C261 F262	L247-S259 PolarHBondContact O-OG 2.91Å; S259-C261 VanDerWaalsContact C-N 3.3Å; S259-C261 PolarHBondContact O-N 3.03Å; S259-F262 PolarHBondContact O-N 2.96Å
260	D	91.2	Very high	90.2	Very high	117 Å²	117	57.8 Å²	57.8	63%	0.626	29%	0.29	S	S	*	.	G	3₁₀ helix	trans	-80.6	-12.9	-177.8	-42.9	-60.7	0	0	0	113.2	H258 I270	H258-D260 VanDerWaalsContact C-N 3.28Å; H258-D260 PolarHBondContact O-N 3.47Å; D260-I270 HydrophobicContact CB-CD1 4.3Å
261	C	92.6	Very high	90.2	Very high	20 Å²	20	52 Å²	52	14%	0.135	27%	0.269	C	S	.	.	G	3₁₀ helix	trans	-91.7	2.8	176.8	-69.8	0	0	0	0	113.3	C235 Y237 C238 H258 S259	C235-C261 WeakPolarHBondContact SG-CB 3.34Å; Y237-C261 HydrophobicContact CD1-CB 4.09Å; Y237-C261 HydrophobicContact CG-CB 4.49Å; C238-C261 VanDerWaalsContact SG-SG 3.69Å; H258-C261 HydrophobicContact CB-CB 3.95Å; H258-C261 PolarHBondContact ND1-SG 2.89Å; H258-C261 VanDerWaalsContact ND1-SG 3.37Å; H258-C261 PolarHBondContact O-N 3.04Å; S259-C261 VanDerWaalsContact C-N 3.3Å; S259-C261 PolarHBondContact O-N 3.03Å
262	F	93.4	Very high	90.2	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	30%	0.3	C	S	.	.			trans	-100.7	68.4	174	-154.8	-114	0	0	0	110.2	V249 F257 H258 S259 M271 Y277 P286 I417	V249-F262 HydrophobicContact CB-CB 3.93Å; V249-F262 HydrophobicContact CB-CD1 4.11Å; V249-F262 HydrophobicContact CB-CD2 4.38Å; V249-F262 HydrophobicContact CB-CG 3.89Å; V249-F262 HydrophobicContact CG1-CB 4.27Å; V249-F262 HydrophobicContact CG1-CD1 3.48Å; V249-F262 VanDerWaalsContact CG1-CD1 3.48Å; V249-F262 HydrophobicContact CG1-CD2 4.13Å; V249-F262 HydrophobicContact CG1-CE1 3.69Å; V249-F262 HydrophobicContact CG1-CE2 4.36Å; V249-F262 HydrophobicContact CG1-CG 3.69Å; V249-F262 HydrophobicContact CG1-CZ 4.15Å; V249-F262 HydrophobicContact CG2-CB 3.92Å; V249-F262 HydrophobicContact CG2-CD1 4.31Å; V249-F262 HydrophobicContact CG2-CG 4.25Å; F257-F262 HydrophobicContact CB-CB 4.22Å; F257-F262 HydrophobicContact CB-CD2 3.98Å; F257-F262 AromaticContact CD1-CD2 3.94Å; F257-F262 HydrophobicContact CD1-CD2 3.94Å; F257-F262 AromaticContact CD2-CD2 3.54Å; F257-F262 HydrophobicContact CD2-CD2 3.54Å; F257-F262 AromaticContact CD2-CE2 3.73Å; F257-F262 HydrophobicContact CD2-CE2 3.73Å; F257-F262 HydrophobicContact CE1-CD2 4.29Å; F257-F262 AromaticContact CE2-CD2 3.93Å; F257-F262 HydrophobicContact CE2-CD2 3.93Å; F257-F262 AromaticContact CE2-CE2 3.7Å; F257-F262 HydrophobicContact CE2-CE2 3.7Å; F257-F262 AromaticContact CG-CD2 3.57Å; F257-F262 HydrophobicContact CG-CD2 3.57Å; F257-F262 HydrophobicContact CG-CE2 4.21Å; F257-F262 HydrophobicContact CZ-CD2 4.29Å; F257-F262 HydrophobicContact CZ-CE2 4.13Å; H258-F262 PolarHBondContact O-N 2.66Å; S259-F262 PolarHBondContact O-N 2.96Å; F262-M271 HydrophobicContact CD1-CB 4.24Å; F262-M271 HydrophobicContact CD1-CE 3.78Å; F262-M271 HydrophobicContact CD1-SD 4.49Å; F262-M271 HydrophobicContact CE1-CE 3.33Å; F262-M271 HydrophobicContact CE1-SD 4.48Å; F262-M271 HydrophobicContact CZ-CE 4.05Å; F262-M271 PolarHBondContact O-N 2.85Å; F262-Y277 HydrophobicContact CE1-CD1 4.47Å; F262-Y277 HydrophobicContact CE1-CE1 4.34Å; F262-Y277 HydrophobicContact CZ-CD2 4.11Å; F262-Y277 HydrophobicContact CZ-CE1 4.32Å; F262-Y277 AromaticContact CZ-CE2 3.78Å; F262-Y277 HydrophobicContact CZ-CE2 3.78Å; F262-Y277 AromaticContact CZ-CZ 3.91Å; F262-P286 HydrophobicContact CD2-CB 4.35Å; F262-P286 HydrophobicContact CD2-CG 3.84Å; F262-P286 HydrophobicContact CE2-CB 3.84Å; F262-P286 HydrophobicContact CE2-CG 3.8Å; F262-P286 HydrophobicContact CG-CG 4.43Å; F262-P286 HydrophobicContact CZ-CB 4Å; F262-P286 HydrophobicContact CZ-CG 4.38Å; F262-I417 HydrophobicContact CD1-CD1 3.91Å; F262-I417 HydrophobicContact CE1-CD1 3.76Å; F262-I417 HydrophobicContact CE1-CG1 3.93Å
263	C	93.8	Very high	90.5	Very high	12 Å²	12	58.5 Å²	58.5	8%	0.081	30%	0.301	C	S	.	.	B	Isolated β-bridge	trans	-121.6	147.4	-177.4	59.9	0	0	0	0	111.4	N265 H268 R269 I270 P286	C263-N265 PolarHBondContact O-N 2.91Å; C263-H268 WeakPolarHBondContact CB-O 3.36Å; C263-R269 CarbonylContact C-O 3.6Å; C263-R269 VanDerWaalsContact CA-O 3.24Å; C263-R269 WeakPolarHBondContact CA-O 3.26Å; C263-I270 HydrophobicContact CB-CG1 4.05Å; C263-P286 WeakPolarHBondContact O-CG 3.43Å
264	C	94.2	Very high	90.7	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	30%	0.295	C	S	.	.			trans	-58.1	130.6	-179.6	176.4	0	0	0	0	111.3	I266 C267 H268 R269 P286 C288	C264-I266 PolarHBondContact O-N 3Å; C264-I266 VanDerWaalsContact O-N 3.11Å; C264-I266 PolarHBondContact SG-N 3.48Å; C264-C267 VanDerWaalsContact CB-SG 3.6Å; C264-C267 VanDerWaalsContact SG-SG 3.7Å; C264-H268 WeakPolarHBondContact O-CA 3.25Å; C264-H268 PolarHBondContact O-N 2.94Å; C264-H268 PolarHBondContact O-ND1 3.01Å; C264-R269 PolarHBondContact N-O 3.24Å; C264-P286 CarbonylContact C-O 3.59Å; C264-P286 WeakPolarHBondContact CA-O 3.47Å; C264-C288 HydrophobicContact CB-CB 4.05Å; C264-C288 PolarHBondContact SG-N 3.28Å
265	N	91.4	Very high	91.1	Very high	48 Å²	48	52 Å²	52	26%	0.257	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-21.3	-178.5	-154.2	34.6	0	0	0	114.2	C263 H268 Q285 P286 I287	C263-N265 PolarHBondContact O-N 2.91Å; N265-H268 PolarHBondContact O-CE1 3.09Å; N265-H268 VanDerWaalsContact O-CE1 3.25Å; N265-Q285 HydrophobicContact CB-CB 4.09Å; N265-Q285 PolarHBondContact ND2-OE1 2.88Å; N265-Q285 VanDerWaalsContact OD1-CD 3.24Å; N265-Q285 PolarHBondContact OD1-NE2 2.89Å; N265-Q285 VanDerWaalsContact OD1-NE2 3.14Å; N265-Q285 PolarHBondContact OD1-OE1 2.81Å; N265-P286 PolarHBondContact N-O 3.24Å; N265-I287 HydrophobicContact CB-CG1 4.31Å
266	I	91.2	Very high	91.3	Very high	90 Å²	90	55.1 Å²	55.1	46%	0.462	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.2	-43.2	-174	-65.5	168.7	0	0	0	112.4	C264 I287 H291	C264-I266 PolarHBondContact O-N 3Å; C264-I266 VanDerWaalsContact O-N 3.11Å; C264-I266 PolarHBondContact SG-N 3.48Å; I266-I287 HydrophobicContact CD1-CD1 4.45Å; I266-I287 HydrophobicContact CD1-CG2 4.06Å; I266-H291 HydrophobicContact CB-CB 4.26Å; I266-H291 HydrophobicContact CD1-CB 3.82Å; I266-H291 HydrophobicContact CG2-CB 4.32Å; I266-H291 VanDerWaalsContact CG2-CD2 3.45Å; I266-H291 WeakPolarHBondContact CG2-CD2 3.04Å
267	C	93.9	Very high	91.4	Very high	53 Å²	53	54 Å²	54	36%	0.358	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.9	1.5	-178.8	67.5	0	0	0	0	114.7	C264 R269 H291	C264-C267 VanDerWaalsContact CB-SG 3.6Å; C264-C267 VanDerWaalsContact SG-SG 3.7Å; C267-R269 PolarHBondContact O-N 3.15Å; C267-H291 VanDerWaalsContact CB-CE1 3.43Å; C267-H291 WeakPolarHBondContact CB-CE1 3.18Å; C267-H291 PolarHBondContact SG-CE1 3.3Å
268	H	91.6	Very high	91.4	Very high	120 Å²	120	55.3 Å²	55.3	56%	0.556	29%	0.288	S	S	*	.			trans	54.2	14	-179.2	-51.8	-39.1	0	0	0	115.9	C263 C264 N265 I270	C263-H268 WeakPolarHBondContact CB-O 3.36Å; C264-H268 WeakPolarHBondContact O-CA 3.25Å; C264-H268 PolarHBondContact O-N 2.94Å; C264-H268 PolarHBondContact O-ND1 3.01Å; N265-H268 PolarHBondContact O-CE1 3.09Å; N265-H268 VanDerWaalsContact O-CE1 3.25Å; H268-I270 PolarHBondContact O-N 3.09Å
269	R	92.8	Very high	91.4	Very high	94 Å²	94	55 Å²	55	36%	0.355	29%	0.287	S	S	.	.	P	Polyproline II helix	trans	-63	116.3	172.4	-171.5	171.4	88.1	-148.2	7.2	109.9	C263 C264 C267 M271 E290	C263-R269 CarbonylContact C-O 3.6Å; C263-R269 VanDerWaalsContact CA-O 3.24Å; C263-R269 WeakPolarHBondContact CA-O 3.26Å; C264-R269 PolarHBondContact N-O 3.24Å; C267-R269 PolarHBondContact O-N 3.15Å; R269-M271 PolarHBondContact O-N 2.95Å; R269-E290 IonicContact CZ-OE1 3.34Å; R269-E290 IonicContact CZ-OE2 3.66Å; R269-E290 VanDerWaalsContact NH1-CD 3.3Å; R269-E290 IonicContact NH1-OE1 3.07Å; R269-E290 PolarHBondContact NH1-OE1 3.06Å; R269-E290 IonicContact NH1-OE2 2.71Å; R269-E290 PolarHBondContact NH1-OE2 2.96Å; R269-E290 IonicContact NH2-OE1 2.7Å; R269-E290 PolarHBondContact NH2-OE1 3.03Å; R269-E290 IonicContact NH2-OE2 3.76Å
270	I	92.6	Very high	91.1	Very high	81 Å²	81	55.4 Å²	55.4	42%	0.415	29%	0.286	S	S	.	.	B	Isolated β-bridge	trans	-61.4	127.6	168.8	-58.9	170.3	0	0	0	108.2	D260 C263 H268	D260-I270 HydrophobicContact CB-CD1 4.3Å; C263-I270 HydrophobicContact CB-CG1 4.05Å; H268-I270 PolarHBondContact O-N 3.09Å
271	M	89.6	Confident	90.5	Very high	11 Å²	11	56.7 Å²	56.7	5%	0.054	29%	0.293	C	S	.	.	P	Polyproline II helix	trans	-90.4	136	-171.6	-68.1	160.4	36.9	0	0	111.6	F262 R269 D275 Y277 P286 I417	F262-M271 HydrophobicContact CD1-CB 4.24Å; F262-M271 HydrophobicContact CD1-CE 3.78Å; F262-M271 HydrophobicContact CD1-SD 4.49Å; F262-M271 HydrophobicContact CE1-CE 3.33Å; F262-M271 HydrophobicContact CE1-SD 4.48Å; F262-M271 HydrophobicContact CZ-CE 4.05Å; F262-M271 PolarHBondContact O-N 2.85Å; R269-M271 PolarHBondContact O-N 2.95Å; M271-D275 VanDerWaalsContact CA-OD2 3.32Å; M271-D275 WeakPolarHBondContact CA-OD2 3.4Å; M271-D275 HydrophobicContact CB-CB 4.28Å; M271-Y277 HydrophobicContact CE-CD1 3.7Å; M271-Y277 HydrophobicContact CE-CD2 4.22Å; M271-Y277 HydrophobicContact CE-CG 3.48Å; M271-Y277 VanDerWaalsContact CE-CG 3.48Å; M271-P286 HydrophobicContact CE-CB 4.34Å; M271-P286 HydrophobicContact SD-CB 4.11Å; M271-I417 HydrophobicContact CB-CD1 3.69Å; M271-I417 HydrophobicContact CE-CD1 3.96Å
272	K	87.7	Confident	90	Very high	158 Å²	158	62 Å²	62	69%	0.687	32%	0.324	S	S	*	.	P	Polyproline II helix	trans	-97.6	158.8	-175	-64.8	176.6	-177.8	175	0	111.6	G274 D275 I417	K272-G274 PolarHBondContact O-N 3.23Å; K272-D275 PolarHBondContact N-OD2 3.3Å; K272-D275 VanDerWaalsContact O-CB 3.3Å; K272-D275 WeakPolarHBondContact O-CB 3.35Å; K272-D275 PolarHBondContact O-N 2.8Å; K272-I417 VanDerWaalsContact O-CD1 3.27Å; K272-I417 WeakPolarHBondContact O-CD1 3.42Å
273	C	87.6	Confident	89.5	Confident	71 Å²	71	64.1 Å²	64.1	48%	0.48	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.2	126.3	171.8	-58.6	0	0	0	0	110.2	I417 L419	C273-I417 HydrophobicContact CB-CG2 4.41Å; C273-L419 HydrophobicContact CB-CD2 4.14Å
274	G	86.7	Confident	89	Confident	41 Å²	41	67.8 Å²	67.8	42%	0.423	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	100	-24.4	-170.2	0	0	0	0	0	115.5	K272 I417	K272-G274 PolarHBondContact O-N 3.23Å; G274-I417 PolarHBondContact N-O 2.94Å
275	D	91.2	Very high	88.7	Confident	41 Å²	41	70.3 Å²	70.3	22%	0.219	37%	0.367	C	S	.	.			trans	-62.2	138.7	-180	-74	-4.2	0	0	0	111.4	M271 K272 S416 I417	M271-D275 VanDerWaalsContact CA-OD2 3.32Å; M271-D275 WeakPolarHBondContact CA-OD2 3.4Å; M271-D275 HydrophobicContact CB-CB 4.28Å; K272-D275 PolarHBondContact N-OD2 3.3Å; K272-D275 VanDerWaalsContact O-CB 3.3Å; K272-D275 WeakPolarHBondContact O-CB 3.35Å; K272-D275 PolarHBondContact O-N 2.8Å; D275-S416 WeakPolarHBondContact O-CA 3.38Å; D275-I417 HydrophobicContact CB-CD1 4.41Å; D275-I417 PolarHBondContact O-N 3.33Å; D275-I417 VanDerWaalsContact O-N 3.11Å
276	R	92.6	Very high	88.7	Confident	110 Å²	110	68 Å²	68	42%	0.415	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	138.5	174.3	-68.1	174.1	78.3	-165.3	7.2	110.9	W289 S414 Y415	R276-W289 HydrophobicContact CB-CB 3.69Å; R276-W289 HydrophobicContact CB-CD2 4.42Å; R276-W289 HydrophobicContact CB-CG 4.03Å; R276-W289 WeakPolarHBondContact O-CB 3.16Å; R276-W289 PolarHBondContact O-N 3.44Å; R276-S414 PolarHBondContact NE-OG 2.92Å; R276-S414 PolarHBondContact NH2-OG 2.9Å; R276-Y415 CarbonylContact C-O 3.57Å; R276-Y415 WeakPolarHBondContact CA-O 3.36Å
277	Y	92.3	Very high	88.8	Confident	6 Å²	6	64.9 Å²	64.9	2%	0.024	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	165.9	179.8	71.6	-80.5	0	0	0	112.8	S251 I252 F262 M271 L279 P286 I287 Y415 I417	S251-Y277 WeakPolarHBondContact CA-OH 3.31Å; I252-Y277 PolarHBondContact N-OH 2.64Å; F262-Y277 HydrophobicContact CE1-CD1 4.47Å; F262-Y277 HydrophobicContact CE1-CE1 4.34Å; F262-Y277 HydrophobicContact CZ-CD2 4.11Å; F262-Y277 HydrophobicContact CZ-CE1 4.32Å; F262-Y277 AromaticContact CZ-CE2 3.78Å; F262-Y277 HydrophobicContact CZ-CE2 3.78Å; F262-Y277 AromaticContact CZ-CZ 3.91Å; M271-Y277 HydrophobicContact CE-CD1 3.7Å; M271-Y277 HydrophobicContact CE-CD2 4.22Å; M271-Y277 HydrophobicContact CE-CG 3.48Å; M271-Y277 VanDerWaalsContact CE-CG 3.48Å; Y277-L279 HydrophobicContact CD2-CD2 4.37Å; Y277-L279 HydrophobicContact CD2-CG 4.44Å; Y277-L279 HydrophobicContact CE2-CD2 4.1Å; Y277-L279 HydrophobicContact CE2-CG 4.07Å; Y277-P286 HydrophobicContact CD2-CB 4.4Å; Y277-I287 VanDerWaalsContact CA-O 3.3Å; Y277-I287 WeakPolarHBondContact CA-O 3.5Å; Y277-I287 WeakPolarHBondContact CB-O 3.39Å; Y277-Y415 WeakPolarHBondContact CD1-O 3.27Å; Y277-Y415 WeakPolarHBondContact CE1-O 3.33Å; Y277-Y415 PolarHBondContact N-O 3.02Å; Y277-Y415 PolarHBondContact O-N 3.25Å; Y277-I417 HydrophobicContact CD1-CG1 4.1Å; Y277-I417 HydrophobicContact CE1-CG1 3.88Å
278	E	90.8	Very high	88.8	Confident	30 Å²	30	62.4 Å²	62.4	14%	0.14	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	161.9	161.5	-160	52.8	-136.6	0	0	109.3	P286 I287 Y292 Y415	E278-P286 WeakPolarHBondContact O-CA 3.44Å; E278-I287 PolarHBondContact N-O 2.81Å; E278-I287 PolarHBondContact O-N 3.21Å; E278-Y292 HydrophobicContact CB-CD1 4.36Å; E278-Y292 HydrophobicContact CB-CD2 3.65Å; E278-Y292 HydrophobicContact CB-CE1 4.46Å; E278-Y292 HydrophobicContact CB-CE2 3.77Å; E278-Y292 HydrophobicContact CB-CG 3.97Å; E278-Y292 HydrophobicContact CG-CD2 4.08Å; E278-Y292 HydrophobicContact CG-CE2 3.66Å; E278-Y415 WeakPolarHBondContact OE1-CE2 3.42Å; E278-Y415 WeakPolarHBondContact OE2-CD2 3.43Å; E278-Y415 WeakPolarHBondContact OE2-CE2 3.39Å
279	L	90.8	Very high	88.8	Confident	10 Å²	10	58.1 Å²	58.1	5%	0.052	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	135	170.2	-64.8	170.6	0	0	0	108.6	N253 L255 Y277 N281 P286	N253-L279 HydrophobicContact CB-CD1 4.13Å; L255-L279 HydrophobicContact CD1-CD1 4.34Å; Y277-L279 HydrophobicContact CD2-CD2 4.37Å; Y277-L279 HydrophobicContact CD2-CG 4.44Å; Y277-L279 HydrophobicContact CE2-CD2 4.1Å; Y277-L279 HydrophobicContact CE2-CG 4.07Å; L279-N281 PolarHBondContact O-N 3.5Å; L279-P286 HydrophobicContact CD2-CB 4.05Å
280	D	85.3	Confident	88.7	Confident	50 Å²	50	57.8 Å²	57.8	27%	0.267	30%	0.303	S	S	.	.			trans	-61.6	130.4	169.8	168.5	33.8	0	0	0	110.6	V282 S283 H284 Q285 I287	D280-V282 PolarHBondContact O-N 3.36Å; D280-V282 PolarHBondContact OD1-N 3.21Å; D280-S283 WeakPolarHBondContact CB-OG 3.4Å; D280-S283 WeakPolarHBondContact OD2-CB 3.49Å; D280-S283 PolarHBondContact OD2-N 2.97Å; D280-S283 PolarHBondContact OD2-OG 2.76Å; D280-H284 WeakPolarHBondContact O-CA 3.45Å; D280-H284 PolarHBondContact O-N 3.28Å; D280-H284 PolarHBondContact O-ND1 2.81Å; D280-Q285 PolarHBondContact N-O 3.48Å; D280-I287 HydrophobicContact CB-CD1 4.22Å
281	N	79.5	Confident	88.7	Confident	145 Å²	145	55.7 Å²	55.7	78%	0.775	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-27	-180	-70.1	-48.5	0	0	0	112.8	L279 H284	L279-N281 PolarHBondContact O-N 3.5Å; N281-H284 PolarHBondContact O-CE1 2.92Å
282	V	81.7	Confident	88.8	Confident	131 Å²	131	57.5 Å²	57.5	79%	0.794	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.3	-51.8	-176.1	-174.4	0	0	0	0	112.4	D280	D280-V282 PolarHBondContact O-N 3.36Å; D280-V282 PolarHBondContact OD1-N 3.21Å
283	S	81.9	Confident	88.8	Confident	45 Å²	45	54.2 Å²	54.2	32%	0.315	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.1	-17.5	-175.8	67.4	0	0	0	0	114.6	D280 Q285	D280-S283 WeakPolarHBondContact CB-OG 3.4Å; D280-S283 WeakPolarHBondContact OD2-CB 3.49Å; D280-S283 PolarHBondContact OD2-N 2.97Å; D280-S283 PolarHBondContact OD2-OG 2.76Å; S283-Q285 PolarHBondContact O-N 2.79Å; S283-Q285 WeakPolarHBondContact OG-CB 3.36Å; S283-Q285 WeakPolarHBondContact OG-CG 3.45Å; S283-Q285 PolarHBondContact OG-N 3.45Å; S283-Q285 PolarHBondContact OG-OE1 3.17Å
284	H	83.3	Confident	88.8	Confident	88 Å²	88	55.9 Å²	55.9	41%	0.407	29%	0.286	S	S	.	.			trans	56.6	22.5	-168.4	-53.6	-26.1	0	0	0	114.5	L255 D280 N281	L255-H284 HydrophobicContact CD1-CB 3.86Å; D280-H284 WeakPolarHBondContact O-CA 3.45Å; D280-H284 PolarHBondContact O-N 3.28Å; D280-H284 PolarHBondContact O-ND1 2.81Å; N281-H284 PolarHBondContact O-CE1 2.92Å
285	Q	88.7	Confident	88.2	Confident	54 Å²	54	56.2 Å²	56.2	25%	0.252	28%	0.282	S	S	.	.			trans	-82.7	140.1	172.2	-61.5	175.6	-66.9	0	0	109.9	Y237 N265 D280 S283	Y237-Q285 HydrophobicContact CD2-CG 4.33Å; N265-Q285 HydrophobicContact CB-CB 4.09Å; N265-Q285 PolarHBondContact ND2-OE1 2.88Å; N265-Q285 VanDerWaalsContact OD1-CD 3.24Å; N265-Q285 PolarHBondContact OD1-NE2 2.89Å; N265-Q285 VanDerWaalsContact OD1-NE2 3.14Å; N265-Q285 PolarHBondContact OD1-OE1 2.81Å; D280-Q285 PolarHBondContact N-O 3.48Å; S283-Q285 PolarHBondContact O-N 2.79Å; S283-Q285 WeakPolarHBondContact OG-CB 3.36Å; S283-Q285 WeakPolarHBondContact OG-CG 3.45Å; S283-Q285 PolarHBondContact OG-N 3.45Å; S283-Q285 PolarHBondContact OG-OE1 3.17Å
286	P	91.4	Very high	86.9	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	143.9	179.3	30.2	-33.5	0	0	0	111.7	F262 C263 C264 N265 M271 Y277 E278 L279	F262-P286 HydrophobicContact CD2-CB 4.35Å; F262-P286 HydrophobicContact CD2-CG 3.84Å; F262-P286 HydrophobicContact CE2-CB 3.84Å; F262-P286 HydrophobicContact CE2-CG 3.8Å; F262-P286 HydrophobicContact CG-CG 4.43Å; F262-P286 HydrophobicContact CZ-CB 4Å; F262-P286 HydrophobicContact CZ-CG 4.38Å; C263-P286 WeakPolarHBondContact O-CG 3.43Å; C264-P286 CarbonylContact C-O 3.59Å; C264-P286 WeakPolarHBondContact CA-O 3.47Å; N265-P286 PolarHBondContact N-O 3.24Å; M271-P286 HydrophobicContact CE-CB 4.34Å; M271-P286 HydrophobicContact SD-CB 4.11Å; Y277-P286 HydrophobicContact CD2-CB 4.4Å; E278-P286 WeakPolarHBondContact O-CA 3.44Å; L279-P286 HydrophobicContact CD2-CB 4.05Å
287	I	92.5	Very high	85.4	Confident	24 Å²	24	57.8 Å²	57.8	12%	0.123	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	128.3	174.6	-59.4	176.8	0	0	0	107.3	N265 I266 Y277 E278 D280 H291	N265-I287 HydrophobicContact CB-CG1 4.31Å; I266-I287 HydrophobicContact CD1-CD1 4.45Å; I266-I287 HydrophobicContact CD1-CG2 4.06Å; Y277-I287 VanDerWaalsContact CA-O 3.3Å; Y277-I287 WeakPolarHBondContact CA-O 3.5Å; Y277-I287 WeakPolarHBondContact CB-O 3.39Å; E278-I287 PolarHBondContact N-O 2.81Å; E278-I287 PolarHBondContact O-N 3.21Å; D280-I287 HydrophobicContact CB-CD1 4.22Å; I287-H291 HydrophobicContact CG2-CB 3.94Å
288	C	94.3	Very high	83.7	Confident	0 Å²	0	63.8 Å²	63.8	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	150.5	177.2	69.8	0	0	0	0	111	C264 E290 H291 Y292	C264-C288 HydrophobicContact CB-CB 4.05Å; C264-C288 PolarHBondContact SG-N 3.28Å; C288-E290 PolarHBondContact O-N 3.15Å; C288-E290 VanDerWaalsContact O-N 3.1Å; C288-H291 PolarHBondContact O-N 3.37Å; C288-H291 PolarHBondContact SG-ND1 3.02Å; C288-Y292 PolarHBondContact O-N 3.34Å; C288-Y292 VanDerWaalsContact O-N 3.07Å
289	W	91.7	Very high	81.9	Confident	31 Å²	31	68 Å²	68	12%	0.117	34%	0.34	C	S	.	.	H	α-helix	trans	-51.6	-38	-173.2	-173.9	-101.7	0	0	0	114.3	R276 H291 Y292 Q293 F412	R276-W289 HydrophobicContact CB-CB 3.69Å; R276-W289 HydrophobicContact CB-CD2 4.42Å; R276-W289 HydrophobicContact CB-CG 4.03Å; R276-W289 WeakPolarHBondContact O-CB 3.16Å; R276-W289 PolarHBondContact O-N 3.44Å; W289-H291 PolarHBondContact O-N 3.49Å; W289-Y292 AromaticContact CE3-CD1 3.79Å; W289-Y292 HydrophobicContact CE3-CD1 3.79Å; W289-Y292 HydrophobicContact CE3-CE1 4.38Å; W289-Y292 HydrophobicContact CH2-CD1 4.27Å; W289-Y292 HydrophobicContact CH2-CE1 4.25Å; W289-Y292 AromaticContact CZ3-CD1 3.59Å; W289-Y292 HydrophobicContact CZ3-CD1 3.59Å; W289-Y292 AromaticContact CZ3-CE1 3.73Å; W289-Y292 HydrophobicContact CZ3-CE1 3.73Å; W289-Y292 PolarHBondContact O-N 2.88Å; W289-Q293 HydrophobicContact CD2-CG 4.4Å; W289-Q293 HydrophobicContact CZ2-CG 4.13Å; W289-Q293 WeakPolarHBondContact O-CG 3.43Å; W289-Q293 PolarHBondContact O-N 2.74Å; W289-F412 HydrophobicContact CH2-CD1 4.21Å
290	E	91	Very high	79.9	Confident	87 Å²	87	72.6 Å²	72.6	41%	0.407	36%	0.364	S	S	.	.	H	α-helix	trans	-55.3	-50.3	176.5	-67.3	140.6	-125.6	0	0	112.9	R269 C288 Q294	R269-E290 IonicContact CZ-OE1 3.34Å; R269-E290 IonicContact CZ-OE2 3.66Å; R269-E290 VanDerWaalsContact NH1-CD 3.3Å; R269-E290 IonicContact NH1-OE1 3.07Å; R269-E290 PolarHBondContact NH1-OE1 3.06Å; R269-E290 IonicContact NH1-OE2 2.71Å; R269-E290 PolarHBondContact NH1-OE2 2.96Å; R269-E290 IonicContact NH2-OE1 2.7Å; R269-E290 PolarHBondContact NH2-OE1 3.03Å; R269-E290 IonicContact NH2-OE2 3.76Å; C288-E290 PolarHBondContact O-N 3.15Å; C288-E290 VanDerWaalsContact O-N 3.1Å; E290-Q294 VanDerWaalsContact O-CG 3.29Å; E290-Q294 WeakPolarHBondContact O-CG 3.46Å; E290-Q294 PolarHBondContact O-N 3.29Å
291	H	93.3	Very high	78.2	Confident	36 Å²	36	74.1 Å²	74.1	17%	0.167	37%	0.372	C	S	.	.	H	α-helix	trans	-78.2	-28	-179.5	-64.5	93.8	0	0	0	112.2	I266 C267 I287 C288 W289 Q294 S295	I266-H291 HydrophobicContact CB-CB 4.26Å; I266-H291 HydrophobicContact CD1-CB 3.82Å; I266-H291 HydrophobicContact CG2-CB 4.32Å; I266-H291 VanDerWaalsContact CG2-CD2 3.45Å; I266-H291 WeakPolarHBondContact CG2-CD2 3.04Å; C267-H291 VanDerWaalsContact CB-CE1 3.43Å; C267-H291 WeakPolarHBondContact CB-CE1 3.18Å; C267-H291 PolarHBondContact SG-CE1 3.3Å; I287-H291 HydrophobicContact CG2-CB 3.94Å; C288-H291 PolarHBondContact O-N 3.37Å; C288-H291 PolarHBondContact SG-ND1 3.02Å; W289-H291 PolarHBondContact O-N 3.49Å; H291-Q294 PolarHBondContact CD2-OE1 2.94Å; H291-Q294 VanDerWaalsContact CD2-OE1 3.24Å; H291-Q294 PolarHBondContact O-N 3.04Å; H291-S295 PolarHBondContact O-N 2.95Å; H291-S295 PolarHBondContact O-OG 2.99Å
292	Y	90	Very high	76.7	Confident	50 Å²	50	70.9 Å²	70.9	20%	0.196	36%	0.361	C	S	.	.	H	α-helix	trans	-64.4	-40	172.8	178.8	-105.4	0	0	0	111.8	E278 C288 W289 S295 H296	E278-Y292 HydrophobicContact CB-CD1 4.36Å; E278-Y292 HydrophobicContact CB-CD2 3.65Å; E278-Y292 HydrophobicContact CB-CE1 4.46Å; E278-Y292 HydrophobicContact CB-CE2 3.77Å; E278-Y292 HydrophobicContact CB-CG 3.97Å; E278-Y292 HydrophobicContact CG-CD2 4.08Å; E278-Y292 HydrophobicContact CG-CE2 3.66Å; C288-Y292 PolarHBondContact O-N 3.34Å; C288-Y292 VanDerWaalsContact O-N 3.07Å; W289-Y292 AromaticContact CE3-CD1 3.79Å; W289-Y292 HydrophobicContact CE3-CD1 3.79Å; W289-Y292 HydrophobicContact CE3-CE1 4.38Å; W289-Y292 HydrophobicContact CH2-CD1 4.27Å; W289-Y292 HydrophobicContact CH2-CE1 4.25Å; W289-Y292 AromaticContact CZ3-CD1 3.59Å; W289-Y292 HydrophobicContact CZ3-CD1 3.59Å; W289-Y292 AromaticContact CZ3-CE1 3.73Å; W289-Y292 HydrophobicContact CZ3-CE1 3.73Å; W289-Y292 PolarHBondContact O-N 2.88Å; Y292-S295 PolarHBondContact O-OG 2.63Å; Y292-H296 AromaticContact CD2-CD2 3.75Å; Y292-H296 AromaticContact CE1-CD2 3.93Å; Y292-H296 AromaticContact CE2-CD2 3.21Å; Y292-H296 WeakPolarHBondContact CE2-CD2 3.3Å; Y292-H296 AromaticContact CE2-NE2 3.18Å; Y292-H296 WeakPolarHBondContact CE2-NE2 3.34Å; Y292-H296 AromaticContact CZ-CD2 3.3Å; Y292-H296 AromaticContact CZ-NE2 3.39Å; Y292-H296 PolarHBondContact O-CD2 3.23Å; Y292-H296 PolarHBondContact O-N 3.13Å; Y292-H296 VanDerWaalsContact O-N 3.16Å; Y292-H296 PolarHBondContact OH-NE2 3.28Å
293	Q	89.1	Confident	75.2	Confident	89 Å²	89	72.1 Å²	72.1	42%	0.416	36%	0.356	S	S	.	.	H	α-helix	trans	-64.5	-45.3	171.9	-70.2	-174.9	-78.5	0	0	111.4	W289 S295 H296 H297	W289-Q293 HydrophobicContact CD2-CG 4.4Å; W289-Q293 HydrophobicContact CZ2-CG 4.13Å; W289-Q293 WeakPolarHBondContact O-CG 3.43Å; W289-Q293 PolarHBondContact O-N 2.74Å; Q293-S295 PolarHBondContact O-N 3.44Å; Q293-H296 PolarHBondContact O-N 2.82Å; Q293-H297 PolarHBondContact O-CD2 3.3Å; Q293-H297 VanDerWaalsContact O-CD2 3.32Å; Q293-H297 PolarHBondContact O-N 3.43Å
294	Q	86.2	Confident	73.6	Confident	105 Å²	105	74.5 Å²	74.5	49%	0.491	36%	0.364	S	S	.	.	H	α-helix	trans	-61.7	-42.4	179.6	-69	163.6	7	0	0	112.7	E290 H291 H297 H298	E290-Q294 VanDerWaalsContact O-CG 3.29Å; E290-Q294 WeakPolarHBondContact O-CG 3.46Å; E290-Q294 PolarHBondContact O-N 3.29Å; H291-Q294 PolarHBondContact CD2-OE1 2.94Å; H291-Q294 VanDerWaalsContact CD2-OE1 3.24Å; H291-Q294 PolarHBondContact O-N 3.04Å; Q294-H297 PolarHBondContact O-N 2.89Å; Q294-H298 PolarHBondContact O-CD2 3.45Å; Q294-H298 PolarHBondContact O-N 3.25Å; Q294-H298 VanDerWaalsContact O-N 3.11Å
295	S	73.8	Confident	71.8	Confident	48 Å²	48	73.4 Å²	73.4	34%	0.336	37%	0.366	S	S	.	.	H	α-helix	trans	-70	-34	178.1	62.9	0	0	0	0	112.9	H291 Y292 Q293 H298 Q299	H291-S295 PolarHBondContact O-N 2.95Å; H291-S295 PolarHBondContact O-OG 2.99Å; Y292-S295 PolarHBondContact O-OG 2.63Å; Q293-S295 PolarHBondContact O-N 3.44Å; S295-H298 PolarHBondContact O-N 2.93Å; S295-Q299 PolarHBondContact O-N 3Å
296	H	65.7	Low	69.6	Low	70 Å²	70	74.2 Å²	74.2	32%	0.324	38%	0.377	S	S	.	.	H	α-helix	trans	-73.8	-33.1	174.4	-89.9	-69.2	0	0	0	113.7	Y292 Q293 Q299 L300	Y292-H296 AromaticContact CD2-CD2 3.75Å; Y292-H296 AromaticContact CE1-CD2 3.93Å; Y292-H296 AromaticContact CE2-CD2 3.21Å; Y292-H296 WeakPolarHBondContact CE2-CD2 3.3Å; Y292-H296 AromaticContact CE2-NE2 3.18Å; Y292-H296 WeakPolarHBondContact CE2-NE2 3.34Å; Y292-H296 AromaticContact CZ-CD2 3.3Å; Y292-H296 AromaticContact CZ-NE2 3.39Å; Y292-H296 PolarHBondContact O-CD2 3.23Å; Y292-H296 PolarHBondContact O-N 3.13Å; Y292-H296 VanDerWaalsContact O-N 3.16Å; Y292-H296 PolarHBondContact OH-NE2 3.28Å; Q293-H296 PolarHBondContact O-N 2.82Å; H296-Q299 PolarHBondContact O-N 3.28Å; H296-L300 PolarHBondContact O-N 3.18Å
297	H	60.9	Low	67.6	Low	114 Å²	114	78.4 Å²	78.4	53%	0.528	40%	0.403	S	S	.	.	H	α-helix	trans	-59.3	-49.9	167.5	-89.1	-76.7	0	0	0	110.5	Q293 Q294 Q299 L300 D301	Q293-H297 PolarHBondContact O-CD2 3.3Å; Q293-H297 VanDerWaalsContact O-CD2 3.32Å; Q293-H297 PolarHBondContact O-N 3.43Å; Q294-H297 PolarHBondContact O-N 2.89Å; H297-Q299 VanDerWaalsContact C-N 3.25Å; H297-Q299 PolarHBondContact O-N 3.42Å; H297-L300 PolarHBondContact O-N 2.67Å; H297-L300 VanDerWaalsContact O-N 3.11Å; H297-D301 WeakPolarHBondContact O-CB 3.39Å; H297-D301 PolarHBondContact O-N 3.37Å
298	H	55.4	Low	65.6	Low	133 Å²	133	83 Å²	83	62%	0.616	43%	0.428	S	S	*	.	H	α-helix	trans	-60.9	-27.9	176.1	-80.6	-55.5	0	0	0	114.7	Q294 S295 S302	Q294-H298 PolarHBondContact O-CD2 3.45Å; Q294-H298 PolarHBondContact O-N 3.25Å; Q294-H298 VanDerWaalsContact O-N 3.11Å; S295-H298 PolarHBondContact O-N 2.93Å; H298-S302 VanDerWaalsContact O-CB 3.24Å; H298-S302 WeakPolarHBondContact O-CB 3.45Å; H298-S302 PolarHBondContact O-N 2.91Å; H298-S302 PolarHBondContact O-OG 2.8Å
299	Q	52.7	Low	63.5	Low	117 Å²	117	89.6 Å²	89.6	55%	0.547	46%	0.463	S	S	.	.	H	α-helix	trans	-72.9	-45	171.5	-77.9	-169.8	-14.8	0	0	112.8	S295 H296 H297 S302 F303	S295-Q299 PolarHBondContact O-N 3Å; H296-Q299 PolarHBondContact O-N 3.28Å; H297-Q299 VanDerWaalsContact C-N 3.25Å; H297-Q299 PolarHBondContact O-N 3.42Å; Q299-S302 PolarHBondContact O-N 3.24Å; Q299-F303 WeakPolarHBondContact O-CD2 3.3Å; Q299-F303 PolarHBondContact O-N 2.92Å; Q299-F303 VanDerWaalsContact O-N 3.13Å
300	L	49.7	Very low	61.1	Low	107 Å²	107	91.3 Å²	91.3	56%	0.56	48%	0.479	S	S	*	.	H	α-helix	trans	-64.4	-43.4	175.9	-74.6	169.1	0	0	0	111.2	H296 H297 S302 F303 L304	H296-L300 PolarHBondContact O-N 3.18Å; H297-L300 PolarHBondContact O-N 2.67Å; H297-L300 VanDerWaalsContact O-N 3.11Å; L300-S302 VanDerWaalsContact C-N 3.28Å; L300-S302 PolarHBondContact O-N 3.47Å; L300-F303 PolarHBondContact O-N 3.34Å; L300-F303 VanDerWaalsContact O-N 3.11Å; L300-L304 PolarHBondContact O-N 3.41Å
301	D	50.3	Low	58.8	Low	82 Å²	82	96.6 Å²	96.6	44%	0.439	50%	0.503	S	S	.	.	H	α-helix	trans	-65.1	-30	175.3	-62	-24.9	0	0	0	111.6	H297 S305	H297-D301 WeakPolarHBondContact O-CB 3.39Å; H297-D301 PolarHBondContact O-N 3.37Å; D301-S305 WeakPolarHBondContact O-CA 3.45Å; D301-S305 WeakPolarHBondContact O-CB 3.44Å; D301-S305 PolarHBondContact O-N 2.79Å; D301-S305 PolarHBondContact O-OG 2.87Å
302	S	48.3	Very low	56.6	Low	77 Å²	77	98.2 Å²	98.2	54%	0.538	53%	0.53	S	S	.	.	H	α-helix	trans	-71.7	-28.9	172.6	-64.3	0	0	0	0	113.3	H298 Q299 L300 C306	H298-S302 VanDerWaalsContact O-CB 3.24Å; H298-S302 WeakPolarHBondContact O-CB 3.45Å; H298-S302 PolarHBondContact O-N 2.91Å; H298-S302 PolarHBondContact O-OG 2.8Å; Q299-S302 PolarHBondContact O-N 3.24Å; L300-S302 VanDerWaalsContact C-N 3.28Å; L300-S302 PolarHBondContact O-N 3.47Å; S302-C306 WeakPolarHBondContact O-CB 3.39Å
303	F	48.3	Very low	54.4	Low	157 Å²	157	102 Å²	102	69%	0.689	55%	0.552	S	S	*	*	H	α-helix	trans	-84.5	-34.1	174	-83.7	-76.8	0	0	0	112.8	Q299 L300 C306 T307	Q299-F303 WeakPolarHBondContact O-CD2 3.3Å; Q299-F303 PolarHBondContact O-N 2.92Å; Q299-F303 VanDerWaalsContact O-N 3.13Å; L300-F303 PolarHBondContact O-N 3.34Å; L300-F303 VanDerWaalsContact O-N 3.11Å; F303-C306 WeakPolarHBondContact O-CB 3.4Å; F303-T307 PolarHBondContact O-N 3.3Å
304	L	49.5	Very low	52	Low	95 Å²	95	107.6 Å²	107.6	50%	0.497	58%	0.575	S	S	.	*	H	α-helix	trans	-80.4	-38.8	176.3	-93.8	62.8	0	0	0	113.2	L300 C306 T307 D308	L300-L304 PolarHBondContact O-N 3.41Å; L304-C306 PolarHBondContact O-N 3.02Å; L304-T307 PolarHBondContact O-N 3.48Å; L304-T307 PolarHBondContact O-OG1 2.89Å; L304-D308 PolarHBondContact O-N 3.36Å
305	S	45.4	Very low	49.6	Very low	65 Å²	65	108.2 Å²	108.2	46%	0.455	59%	0.589	S	S	.	*	H	α-helix	trans	-65.7	-20.8	171.5	63.6	0	0	0	0	112.5	D301 L309	D301-S305 WeakPolarHBondContact O-CA 3.45Å; D301-S305 WeakPolarHBondContact O-CB 3.44Å; D301-S305 PolarHBondContact O-N 2.79Å; D301-S305 PolarHBondContact O-OG 2.87Å; S305-L309 WeakPolarHBondContact O-CB 3.47Å; S305-L309 PolarHBondContact O-N 3.33Å
306	C	42.3	Very low	47.8	Very low	71 Å²	71	112.8 Å²	112.8	48%	0.48	61%	0.609	S	S	.	*	H	α-helix	trans	-69.5	-47.2	167.6	-171.9	0	0	0	0	111.3	S302 F303 L304 D308 C310	S302-C306 WeakPolarHBondContact O-CB 3.39Å; F303-C306 WeakPolarHBondContact O-CB 3.4Å; L304-C306 PolarHBondContact O-N 3.02Å; C306-D308 PolarHBondContact O-N 3.41Å; C306-C310 WeakPolarHBondContact O-CB 3.32Å; C306-C310 PolarHBondContact O-N 3.2Å; C306-C310 PolarHBondContact O-SG 3.35Å
307	T	50.1	Low	46.3	Very low	88 Å²	88	120.4 Å²	120.4	54%	0.54	64%	0.635	S	S	.	*	H	α-helix	trans	-65	-40.3	178.7	53.1	0	0	0	0	112.5	F303 L304	F303-T307 PolarHBondContact O-N 3.3Å; L304-T307 PolarHBondContact O-N 3.48Å; L304-T307 PolarHBondContact O-OG1 2.89Å
308	D	49.1	Very low	45.1	Very low	121 Å²	121	123.1 Å²	123.1	65%	0.647	65%	0.648	S	S	*	*	H	α-helix	trans	-87.7	-7.9	-168.7	-62.1	7.6	0	0	0	113.3	L304 C306	L304-D308 PolarHBondContact O-N 3.36Å; C306-D308 PolarHBondContact O-N 3.41Å
309	L	50	Low	44.2	Very low	139 Å²	139	121.5 Å²	121.5	73%	0.728	65%	0.652	S	S	*	*	H	α-helix	trans	-107.1	-9.3	169	-84.4	72.8	0	0	0	113.8	S305 E311	S305-L309 WeakPolarHBondContact O-CB 3.47Å; S305-L309 PolarHBondContact O-N 3.33Å; L309-E311 PolarHBondContact O-N 2.87Å
310	C	42.6	Very low	43.5	Very low	67 Å²	67	122.9 Å²	122.9	45%	0.453	66%	0.663	S	S	.	*	G	3₁₀ helix	trans	-85.1	5.7	-175.2	-78.7	0	0	0	0	115.9	C306 G312	C306-C310 WeakPolarHBondContact O-CB 3.32Å; C306-C310 PolarHBondContact O-N 3.2Å; C306-C310 PolarHBondContact O-SG 3.35Å; C310-G312 PolarHBondContact O-N 3.01Å
311	E	42.2	Very low	42.8	Very low	197 Å²	197	126.4 Å²	126.4	92%	0.921	68%	0.676	S	S	*	*	G	3₁₀ helix	trans	-59.5	-15.9	173.9	-69.4	-157.5	125.9	0	0	113.9	L309	L309-E311 PolarHBondContact O-N 2.87Å
312	G	46.5	Very low	42.1	Very low	70 Å²	70	133.4 Å²	133.4	72%	0.722	70%	0.696	S	S	*	*	G	3₁₀ helix	trans	-99.8	-16.2	-174.9	0	0	0	0	0	118	C310	C310-G312 PolarHBondContact O-N 3.01Å
313	I	44.7	Very low	41.5	Very low	130 Å²	130	137.1 Å²	137.1	67%	0.667	71%	0.71	S	S	*	*			trans	-131.6	118.8	-162.6	-55.7	-177.1	0	0	0	113.3	C315	I313-C315 PolarHBondContact O-N 3.29Å
314	K	37.9	Very low	40.9	Very low	206 Å²	206	136 Å²	136	90%	0.896	72%	0.719	S	S	*	*			trans	-77.1	99.7	172.6	-73	-178.4	175.8	179.3	0	111.7
315	C	35.2	Very low	40.1	Very low	118 Å²	118	134.5 Å²	134.5	80%	0.797	73%	0.726	S	S	*	*			trans	-82.6	118.2	166.8	-65.3	0	0	0	0	110.2	I313	I313-C315 PolarHBondContact O-N 3.29Å
316	L	36	Very low	39.7	Very low	144 Å²	144	141 Å²	141	75%	0.754	75%	0.747	S	S	*	*			trans	-113.5	115.3	-165.7	-172.9	103.1	0	0	0	113.6
317	R	35.3	Very low	39.3	Very low	230 Å²	230	144.2 Å²	144.2	87%	0.868	76%	0.758	S	S	*	*			trans	-152.1	120.2	151.9	-61.6	-168.8	-179.7	151.5	4.5	106
318	E	35.1	Very low	38.6	Very low	171 Å²	171	150.2 Å²	150.2	80%	0.799	78%	0.777	S	S	*	*				57.1	116.3	71.8	-60.2	175.1	149.5	0	0	111.9
319	S	37.6	Very low	37.9	Very low	100 Å²	100	151.9 Å²	151.9	70%	0.699	78%	0.781	S	S	*	*			cis	-141.6	167.5	-11.7	60.9	0	0	0	0	107.2
320	D	37.1	Very low	37.2	Very low	146 Å²	146	152.6 Å²	152.6	78%	0.781	78%	0.784	S	S	*	*			cis	-153	172.9	38.4	-98.8	-67.3	0	0	0	113.5
321	H	36	Very low	36.5	Very low	180 Å²	180	155.7 Å²	155.7	83%	0.833	81%	0.807	S	S	*	*			trans	-81.5	142.6	-169.8	-72.7	-103.7	0	0	0	116.7
322	R	35	Very low	36	Very low	229 Å²	229	148.9 Å²	148.9	86%	0.864	79%	0.789	S	S	*	*			trans	-162.1	149.2	132.3	-102.1	159.9	-150	-106.3	5.8	110.8
323	D	35.5	Very low	35.2	Very low	155 Å²	155	154.1 Å²	154.1	83%	0.829	80%	0.795	S	S	*	*			trans	-64.1	131.1	-157.1	-62	-79.1	0	0	0	118.1
324	P	36	Very low	34.6	Very low	133 Å²	133	154.7 Å²	154.7	86%	0.864	80%	0.798	S	S	*	*			trans	-101.7	93.1	155.6	34.2	-24.5	0	0	0	110.2
325	G	33.3	Very low	34.2	Very low	64 Å²	64	156 Å²	156	66%	0.66	80%	0.799	S	S	*	*			trans	-156.7	37.1	-162.3	0	0	0	0	0	119.5
326	K	37	Very low	33.9	Very low	202 Å²	202	155.6 Å²	155.6	88%	0.878	80%	0.797	S	S	*	*			trans	-161.5	152.9	163.5	-115.2	156.1	-171.8	174	0	114.4
327	L	33.1	Very low	33.8	Very low	138 Å²	138	152.6 Å²	152.6	72%	0.723	79%	0.793	S	S	*	*			trans	60.3	75.1	163.5	-63.9	166.1	0	0	0	117.4	E329	L327-E329 HydrophobicContact CD2-CB 4.12Å; L327-E329 PolarHBondContact O-N 2.83Å
328	K	35.8	Very low	33.7	Very low	214 Å²	214	149.2 Å²	149.2	93%	0.93	79%	0.792	S	S	*	*				-71.5	99.4	127.2	-90.8	-172.8	173	-177.7	0	107.5
329	E	34.9	Very low	33.6	Very low	156 Å²	156	144.4 Å²	144.4	73%	0.729	79%	0.789	S	S	*	*			trans	-163.5	165.6	161.1	-128.1	165.6	-179.5	0	0	111.4	L327	L327-E329 HydrophobicContact CD2-CB 4.12Å; L327-E329 PolarHBondContact O-N 2.83Å
330	L	33.7	Very low	33.3	Very low	154 Å²	154	147.1 Å²	147.1	81%	0.806	80%	0.796	S	S	*	*			trans	58.6	72.7	173.4	-57.2	178.7	0	0	0	116.1	G332	L330-G332 VanDerWaalsContact C-N 3.28Å; L330-G332 PolarHBondContact O-N 3Å
331	S	29.3	Very low	33.2	Very low	133 Å²	133	145.5 Å²	145.5	93%	0.93	79%	0.791	S	S	*	*			trans	-61	93.3	138.8	54.1	0	0	0	0	109.5
332	G	30.4	Very low	33	Very low	53 Å²	53	144.3 Å²	144.3	55%	0.546	79%	0.791	S	S	.	*			trans	161.9	142.8	170.2	0	0	0	0	0	116.8	L330	L330-G332 VanDerWaalsContact C-N 3.28Å; L330-G332 PolarHBondContact O-N 3Å
333	Q	31.4	Very low	32.6	Very low	180 Å²	180	140.9 Å²	140.9	84%	0.841	79%	0.789	S	S	*	*			trans	77.2	141.3	150.6	-55.3	-174.8	4	0	0	120.2
334	I	31.2	Very low	32.4	Very low	142 Å²	142	140.1 Å²	140.1	73%	0.728	79%	0.785	S	S	*	*			trans	77.1	108.4	153.6	-65	152.4	0	0	0	118.1
335	Y	28.6	Very low	32	Very low	234 Å²	234	143.1 Å²	143.1	92%	0.918	79%	0.785	S	S	*	*			trans	-65.6	139.4	150.3	-88.5	-109.5	0	0	0	110.1
336	S	29.4	Very low	31.9	Very low	109 Å²	109	145.9 Å²	145.9	76%	0.762	79%	0.789	S	S	*	*			trans	-161.5	150.8	149.4	-76.5	0	0	0	0	109
337	A	33.4	Very low	31.6	Very low	81 Å²	81	145 Å²	145	67%	0.669	79%	0.787	S	S	*	*			cis	175.5	126.7	-24.1	0	0	0	0	0	103.7
338	D	34.7	Very low	31.6	Very low	159 Å²	159	141.7 Å²	141.7	85%	0.85	78%	0.78	S	S	*	*			trans	24.1	122.5	144.2	-46.1	-27.6	0	0	0	118.8
339	G	33.2	Very low	31.6	Very low	71 Å²	71	136.6 Å²	136.6	73%	0.732	77%	0.771	S	S	*	*			trans	-74.6	139.5	160.9	0	0	0	0	0	111.1
340	N	31.3	Very low	31.7	Very low	157 Å²	157	135.6 Å²	135.6	84%	0.84	77%	0.771	S	S	*	*			trans	-152.7	144.5	144.7	-103	-37.2	0	0	0	113.4
341	T	34.8	Very low	31.9	Very low	111 Å²	111	133.3 Å²	133.3	68%	0.681	76%	0.763	S	S	*	*			trans	-7.7	133.9	165.5	56.9	0	0	0	0	120.7
342	N	31.2	Very low	32.3	Very low	155 Å²	155	133.7 Å²	133.7	83%	0.829	75%	0.754	S	S	*	*			trans	60.9	114	144.1	-65.8	-24.7	0	0	0	120.6	N344	N342-N344 PolarHBondContact O-N 2.94Å
343	L	26.9	Very low	32.4	Very low	157 Å²	157	135.6 Å²	135.6	82%	0.822	76%	0.759	S	S	*	*			trans	-7.1	110	146.2	-65.2	161.9	0	0	0	117
344	N	30.7	Very low	32.7	Very low	139 Å²	139	134.1 Å²	134.1	74%	0.743	76%	0.755	S	S	*	*				158.8	119.4	111.5	-82.5	-41.2	0	0	0	114.6	N342	N342-N344 PolarHBondContact O-N 2.94Å
345	F	27.5	Very low	33	Very low	196 Å²	196	137.4 Å²	137.4	86%	0.86	76%	0.758	S	S	*	*			trans	65.6	140.3	136.8	-101.9	-95.6	0	0	0	123.4
346	V	31.9	Very low	33.4	Very low	123 Å²	123	132 Å²	132	75%	0.745	75%	0.745	S	S	*	*			trans	82	111.2	162.1	-169.2	0	0	0	0	119.5
347	H	30.3	Very low	33.8	Very low	182 Å²	182	133.4 Å²	133.4	84%	0.843	75%	0.75	S	S	*	*				20	152.1	126.2	-105	-113.9	0	0	0	120.6
348	A	32.7	Very low	33.9	Very low	70 Å²	70	136.8 Å²	136.8	58%	0.579	76%	0.756	S	S	*	*			cis	178	174.3	-20.9	0	0	0	0	0	107.9
349	S	37.1	Very low	34.4	Very low	106 Å²	106	134 Å²	134	74%	0.741	75%	0.747	S	S	*	*			trans	68.1	158.7	163.2	-77.5	0	0	0	0	116.9
350	D	36.1	Very low	34.6	Very low	135 Å²	135	137.6 Å²	137.6	72%	0.722	75%	0.75	S	S	*	*			cis	-168.6	168.2	-4.3	-111.2	26.7	0	0	0	107.7
351	V	38.1	Very low	35.2	Very low	106 Å²	106	137 Å²	137	64%	0.642	75%	0.745	S	S	*	*			cis	-174.9	164.4	-18.8	63.2	0	0	0	0	110.2
352	L	36.6	Very low	35.7	Very low	141 Å²	141	139.7 Å²	139.7	74%	0.738	75%	0.75	S	S	*	*			trans	71.8	142	171.2	-52.7	170.7	0	0	0	117.9
353	S	33.7	Very low	36.2	Very low	93 Å²	93	139.5 Å²	139.5	65%	0.65	75%	0.749	S	S	*	*			cis	90.9	123	5.1	91.5	0	0	0	0	119.9
354	I	38.1	Very low	36.6	Very low	149 Å²	149	139.1 Å²	139.1	76%	0.764	75%	0.747	S	S	*	*			trans	165.4	118.2	155.7	-92.6	153.6	0	0	0	106.5
355	R	37.1	Very low	37.2	Very low	211 Å²	211	138.6 Å²	138.6	80%	0.796	75%	0.751	S	S	*	*				70.3	142.3	72.2	-71.4	-169.8	159.5	177.3	-3.2	114.1
356	D	36.3	Very low	37.6	Very low	120 Å²	120	135 Å²	135	64%	0.642	75%	0.745	S	S	*	*			cis	-165.7	176.7	-8.8	-94.8	-24.1	0	0	0	109.3
357	T	39.3	Very low	37.8	Very low	139 Å²	139	137.1 Å²	137.1	85%	0.853	75%	0.747	S	S	*	*			trans	81.1	129	154.1	34.2	0	0	0	0	124.4
358	D	34	Very low	38.1	Very low	152 Å²	152	132.7 Å²	132.7	81%	0.813	74%	0.737	S	S	*	*			trans	-70.5	-171.5	164.9	-63.1	-72.4	0	0	0	115.2
359	P	45.9	Very low	38.2	Very low	100 Å²	100	134.4 Å²	134.4	65%	0.649	74%	0.744	S	S	*	*			cis	-137.7	-155.4	-46.8	37.2	-17.1	0	0	0	113.5
360	D	37.9	Very low	38	Very low	148 Å²	148	133.6 Å²	133.6	79%	0.791	74%	0.739	S	S	*	*			trans	80.3	165.4	156.9	-65.6	-23.8	0	0	0	120.8
361	I	43.5	Very low	37.9	Very low	144 Å²	144	137.4 Å²	137.4	74%	0.738	74%	0.743	S	S	*	*			trans	99.5	100.7	161.8	-64.6	177.2	0	0	0	119.7
362	E	44.7	Very low	37.5	Very low	167 Å²	167	137.7 Å²	137.7	78%	0.78	75%	0.745	S	S	*	*			trans	83.1	147	131.8	-69.6	174.1	169.1	0	0	126.1
363	D	41.5	Very low	37.3	Very low	152 Å²	152	137 Å²	137	81%	0.813	74%	0.742	S	S	*	*			trans	75.4	113.9	152.7	-69	-1.7	0	0	0	126.1
364	L	36.8	Very low	37	Very low	149 Å²	149	141.3 Å²	141.3	78%	0.78	75%	0.749	S	S	*	*			trans	-83.2	169.6	151.6	-82.6	158.8	0	0	0	110.5
365	P	42.8	Very low	36.7	Very low	127 Å²	127	142.5 Å²	142.5	83%	0.825	76%	0.756	S	S	*	*				-140	161.4	111.9	37	-26.2	0	0	0	116.1
366	T	35.1	Very low	36.3	Very low	121 Å²	121	139.7 Å²	139.7	74%	0.742	75%	0.753	S	S	*	*			trans	-100.5	145.7	176.8	-50.1	0	0	0	0	111.3
367	E	37.3	Very low	36.2	Very low	167 Å²	167	142.1 Å²	142.1	78%	0.78	76%	0.76	S	S	*	*			trans	-152.2	117.3	154.7	-88.3	-65.6	137.4	0	0	106
368	S	35.4	Very low	36	Very low	90 Å²	90	139.2 Å²	139.2	63%	0.629	76%	0.757	S	S	*	*				66.8	151.4	92.7	99	0	0	0	0	114.1
369	S	35.8	Very low	35.8	Very low	106 Å²	106	139.7 Å²	139.7	74%	0.741	76%	0.759	S	S	*	*			cis	-167.7	159.2	0.2	-135.8	0	0	0	0	105.3
370	S	31.9	Very low	35.4	Very low	89 Å²	89	143.6 Å²	143.6	62%	0.622	77%	0.766	S	S	*	*			cis	169.4	179.2	1.5	44.6	0	0	0	0	106.7
371	R	33.8	Very low	35.1	Very low	214 Å²	214	142.8 Å²	142.8	81%	0.808	76%	0.761	S	S	*	*			trans	76.1	127.7	169.8	-43.2	-178.6	99.5	124.9	2.7	115.3
372	T	29.4	Very low	34.4	Very low	112 Å²	112	142.5 Å²	142.5	69%	0.687	76%	0.761	S	S	*	*			cis	72.3	140.8	36.6	86.2	0	0	0	0	112.8
373	D	32.6	Very low	33.7	Very low	127 Å²	127	141.5 Å²	141.5	68%	0.679	76%	0.761	S	S	*	*			cis	-145.8	177.9	24.9	-88.8	-72.1	0	0	0	114.9
374	F	27.8	Very low	33.2	Very low	183 Å²	183	141.5 Å²	141.5	80%	0.803	76%	0.759	S	S	*	*			trans	-44.3	148.3	168.1	-55.4	-109.3	0	0	0	115.9
375	L	32.9	Very low	32.7	Very low	174 Å²	174	141.2 Å²	141.2	91%	0.911	76%	0.758	S	S	*	*				-171.6	-170.8	101.2	-138	68.5	0	0	0	112.9
376	E	28.1	Very low	32.3	Very low	153 Å²	153	145.6 Å²	145.6	72%	0.715	76%	0.76	S	S	*	*			trans	-121.3	166.8	-157.5	-174.3	-175.4	-156.9	0	0	113
377	H	34.5	Very low	32.1	Very low	171 Å²	171	142.5 Å²	142.5	79%	0.792	75%	0.752	S	S	*	*			trans	89.5	137.3	168.7	-53.5	83.4	0	0	0	118.4
378	G	34.3	Very low	31.9	Very low	77 Å²	77	140.7 Å²	140.7	79%	0.794	75%	0.752	S	S	*	*			trans	149.1	68.1	160.9	0	0	0	0	0	117.8	K380	G378-K380 PolarHBondContact O-N 3.15Å
379	N	31	Very low	31.6	Very low	162 Å²	162	143 Å²	143	87%	0.866	76%	0.757	S	S	*	*			trans	-58.1	128.7	173.7	-65.9	-49.8	0	0	0	113.2
380	K	35.7	Very low	31.3	Very low	182 Å²	182	146 Å²	146	79%	0.791	76%	0.756	S	S	*	*				174.6	135.6	114.2	-97	173.8	176.7	-179.7	0	116.3	G378	G378-K380 PolarHBondContact O-N 3.15Å
381	L	32	Very low	31.4	Very low	132 Å²	132	150.1 Å²	150.1	69%	0.691	77%	0.766	S	S	*	*			trans	61.2	100.7	138	-63.9	167.8	0	0	0	121.1
382	N	29.5	Very low	31.1	Very low	138 Å²	138	147.7 Å²	147.7	74%	0.738	76%	0.764	S	S	*	*				61.2	117.7	113.7	-71	8.9	0	0	0	122
383	L	29.5	Very low	31.3	Very low	146 Å²	146	148.5 Å²	148.5	76%	0.764	77%	0.771	S	S	*	*				117.3	99.6	118.5	-134.5	69.1	0	0	0	118.4
384	I	30.3	Very low	31.1	Very low	152 Å²	152	151.6 Å²	151.6	78%	0.779	78%	0.779	S	S	*	*			trans	51.8	113.6	138.1	-54.7	173.1	0	0	0	118.7
385	D	28.3	Very low	31.4	Very low	143 Å²	143	148.9 Å²	148.9	77%	0.765	78%	0.782	S	S	*	*			trans	-149.6	-175.2	138	-153.5	-18.4	0	0	0	108.9
386	Y	33.1	Very low	31.1	Very low	219 Å²	219	146 Å²	146	86%	0.859	78%	0.777	S	S	*	*			trans	74.6	124.4	-171.5	-57.3	-80.3	0	0	0	115.3
387	G	32.1	Very low	31.2	Very low	55 Å²	55	145.8 Å²	145.8	57%	0.567	79%	0.786	S	S	*	*			cis	106.6	118.9	-14.9	0	0	0	0	0	117.1
388	V	31.6	Very low	30.7	Very low	129 Å²	129	143.1 Å²	143.1	78%	0.782	79%	0.786	S	S	*	*				78.9	95.5	127.2	177.7	0	0	0	0	119.2
389	N	28.7	Very low	30.6	Very low	138 Å²	138	145.2 Å²	145.2	74%	0.738	79%	0.789	S	S	*	*				71.1	148.8	125	-81.5	-44.4	0	0	0	124.2
390	K	30.9	Very low	30.7	Very low	169 Å²	169	143 Å²	143	74%	0.735	78%	0.781	S	S	*	*			trans	99.8	135.4	133.1	-92.5	166.4	-174.7	175.4	0	122.1
391	Q	33.6	Very low	30.6	Very low	176 Å²	176	142 Å²	142	82%	0.822	78%	0.783	S	S	*	*			trans	88.6	127.4	144.8	-74.4	163.4	-12.9	0	0	120.7
392	Q	26.5	Very low	30.6	Very low	163 Å²	163	141.4 Å²	141.4	76%	0.762	78%	0.78	S	S	*	*			trans	-82.4	169.6	163.6	-57.8	176.8	-29.6	0	0	109.6
393	P	35.2	Very low	30.9	Very low	130 Å²	130	144.7 Å²	144.7	84%	0.844	79%	0.788	S	S	*	*				-135.4	179.3	100.1	36.8	-26.2	0	0	0	114.4
394	K	27.4	Very low	31.1	Very low	192 Å²	192	144.8 Å²	144.8	84%	0.835	78%	0.784	S	S	*	*			trans	-96.7	146.7	-175	-51.9	162.5	-175.8	170.3	0	111.2
395	S	33.4	Very low	31.1	Very low	125 Å²	125	146.1 Å²	146.1	87%	0.874	78%	0.784	S	S	*	*			trans	-156.3	166.9	143.7	63.1	0	0	0	0	110
396	S	27.2	Very low	31.3	Very low	115 Å²	115	146.9 Å²	146.9	80%	0.804	79%	0.788	S	S	*	*			trans	-153.1	120.1	-169.2	54.7	0	0	0	0	112.3
397	V	31.4	Very low	31.3	Very low	148 Å²	148	145.9 Å²	145.9	90%	0.897	79%	0.791	S	S	*	*			trans	-140.2	135.4	166.4	-177.7	0	0	0	0	108.4
398	S	23.8	Very low	31.4	Very low	114 Å²	114	153 Å²	153	80%	0.797	81%	0.807	S	S	*	*			trans	-89.4	148.9	175.7	-56	0	0	0	0	111.4
399	S	31.9	Very low	31.3	Very low	122 Å²	122	157.8 Å²	157.8	85%	0.853	81%	0.812	S	S	*	*			trans	-134.2	145.1	153.6	54.5	0	0	0	0	108.9
400	V	31.9	Very low	31.3	Very low	116 Å²	116	155.3 Å²	155.3	70%	0.703	81%	0.806	S	S	*	*			trans	-112.4	134.6	-172.2	175.3	0	0	0	0	108.9
401	I	34.5	Very low	31.5	Very low	161 Å²	161	154.6 Å²	154.6	83%	0.826	80%	0.798	S	S	*	*			trans	-131.8	109.8	162.3	-60.7	-178.4	0	0	0	107.2
402	D	31.3	Very low	31.6	Very low	118 Å²	118	153.1 Å²	153.1	63%	0.631	79%	0.79	S	S	*	*			trans	-71.9	133.6	177.4	-96.6	-65	0	0	0	112.1	H404	D402-H404 IonicContact OD1-CD2 2.64Å
403	K	37.1	Very low	32.2	Very low	208 Å²	208	150 Å²	150	90%	0.904	78%	0.778	S	S	*	*			trans	-137.2	115.3	151	-75.7	-165.4	174.9	-177.4	0	108.6
404	H	33.4	Very low	32.7	Very low	147 Å²	147	145.6 Å²	145.6	68%	0.681	75%	0.75	S	S	*	*			trans	-117	139.8	-164	-136.3	-66.7	0	0	0	110.1	D402	D402-H404 IonicContact OD1-CD2 2.64Å
405	K	30.5	Very low	34.1	Very low	180 Å²	180	139.2 Å²	139.2	78%	0.783	72%	0.721	S	S	*	*			trans	70.7	126.8	174.8	-47	165.9	-177.3	172.9	0	112.4
406	D	31.4	Very low	35	Very low	160 Å²	160	136.8 Å²	136.8	86%	0.856	70%	0.704	S	S	*	*			cis	-156.4	124.8	42.9	-81.3	-48.5	0	0	0	111.5
407	E	33.8	Very low	36.3	Very low	197 Å²	197	131.9 Å²	131.9	92%	0.921	67%	0.669	S	S	*	*			trans	-148.5	22.6	-177.4	-145.6	177.8	-148.1	0	0	114.2
408	K	33.6	Very low	36.9	Very low	205 Å²	205	128.9 Å²	128.9	89%	0.891	65%	0.653	S	S	*	*			trans	-90.9	1.6	-168.7	-119.6	178.8	-177.4	-179.7	0	116.5
409	Y	30.3	Very low	37.6	Very low	229 Å²	229	130.4 Å²	130.4	90%	0.898	65%	0.651	S	S	*	*	S	Bend	trans	-129.3	55.7	-171.6	-89.9	-87.8	0	0	0	114.1
410	S	28.5	Very low	37.9	Very low	87 Å²	87	131.3 Å²	131.3	61%	0.608	65%	0.645	S	S	*	*			trans	-159.3	82.8	161	-88.9	0	0	0	0	113.1	F412	S410-F412 WeakPolarHBondContact OG-CE2 3.41Å
411	R	34.8	Very low	37.9	Very low	153 Å²	153	129 Å²	129	58%	0.577	64%	0.644	S	S	*	*			trans	-98.5	82.1	158	-76.9	-171.8	-179.8	149.9	8.5	109	N413 Y441	R411-N413 PolarHBondContact O-N 3.09Å; R411-N413 VanDerWaalsContact O-N 3.08Å; R411-Y441 PolarHBondContact NH1-OH 2.98Å
412	F	36	Very low	37.9	Very low	146 Å²	146	130.1 Å²	130.1	64%	0.64	64%	0.643	S	S	*	*			trans	-65.6	105.1	169.6	-76.8	-80.7	0	0	0	109.6	W289 S410	W289-F412 HydrophobicContact CH2-CD1 4.21Å; S410-F412 WeakPolarHBondContact OG-CE2 3.41Å
413	N	38.7	Very low	38	Very low	97 Å²	97	131.8 Å²	131.8	52%	0.519	65%	0.652	S	S	.	*			trans	-65.9	135.8	156	-74.3	-21	0	0	0	107.9	R411 Y415	R411-N413 PolarHBondContact O-N 3.09Å; R411-N413 VanDerWaalsContact O-N 3.08Å; N413-Y415 HydrophobicContact CB-CE2 4.17Å; N413-Y415 PolarHBondContact ND2-OH 3.32Å
414	S	44.9	Very low	37.9	Very low	37 Å²	37	127 Å²	127	26%	0.259	65%	0.645	S	S	.	*			trans	-157.8	126.6	169.3	75.3	0	0	0	0	107.8	R276	R276-S414 PolarHBondContact NE-OG 2.92Å; R276-S414 PolarHBondContact NH2-OG 2.9Å
415	Y	57.1	Low	37.8	Very low	58 Å²	58	126.5 Å²	126.5	23%	0.227	66%	0.658	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-108.9	129.4	-170.9	-54.3	-66.9	0	0	0	111.2	I252 R276 Y277 E278 N413	I252-Y415 HydrophobicContact CD1-CD1 3.46Å; I252-Y415 VanDerWaalsContact CD1-CD1 3.46Å; I252-Y415 HydrophobicContact CD1-CE1 3.37Å; I252-Y415 HydrophobicContact CD1-CG 4.29Å; I252-Y415 HydrophobicContact CG2-CD1 4.17Å; I252-Y415 HydrophobicContact CG2-CD2 3.93Å; I252-Y415 HydrophobicContact CG2-CE1 4.33Å; I252-Y415 HydrophobicContact CG2-CE2 4.08Å; I252-Y415 HydrophobicContact CG2-CG 3.95Å; R276-Y415 CarbonylContact C-O 3.57Å; R276-Y415 WeakPolarHBondContact CA-O 3.36Å; Y277-Y415 WeakPolarHBondContact CD1-O 3.27Å; Y277-Y415 WeakPolarHBondContact CE1-O 3.33Å; Y277-Y415 PolarHBondContact N-O 3.02Å; Y277-Y415 PolarHBondContact O-N 3.25Å; E278-Y415 WeakPolarHBondContact OE1-CE2 3.42Å; E278-Y415 WeakPolarHBondContact OE2-CD2 3.43Å; E278-Y415 WeakPolarHBondContact OE2-CE2 3.39Å; N413-Y415 HydrophobicContact CB-CE2 4.17Å; N413-Y415 PolarHBondContact ND2-OH 3.32Å
416	S	52.4	Low	38	Very low	74 Å²	74	121.5 Å²	121.5	52%	0.517	65%	0.651	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-91.6	136.7	171.9	55.8	0	0	0	0	110.5	D275	D275-S416 WeakPolarHBondContact O-CA 3.38Å
417	I	55.6	Low	38.3	Very low	12 Å²	12	118.2 Å²	118.2	6%	0.062	63%	0.632	C	S	.	*	P	Polyproline II helix	trans	-62.8	124.6	168.8	-63.3	164.6	0	0	0	108.9	F262 M271 K272 C273 G274 D275 Y277	F262-I417 HydrophobicContact CD1-CD1 3.91Å; F262-I417 HydrophobicContact CE1-CD1 3.76Å; F262-I417 HydrophobicContact CE1-CG1 3.93Å; M271-I417 HydrophobicContact CB-CD1 3.69Å; M271-I417 HydrophobicContact CE-CD1 3.96Å; K272-I417 VanDerWaalsContact O-CD1 3.27Å; K272-I417 WeakPolarHBondContact O-CD1 3.42Å; C273-I417 HydrophobicContact CB-CG2 4.41Å; G274-I417 PolarHBondContact N-O 2.94Å; D275-I417 HydrophobicContact CB-CD1 4.41Å; D275-I417 PolarHBondContact O-N 3.33Å; D275-I417 VanDerWaalsContact O-N 3.11Å; Y277-I417 HydrophobicContact CD1-CG1 4.1Å; Y277-I417 HydrophobicContact CE1-CG1 3.88Å
418	P	44.4	Very low	38.2	Very low	85 Å²	85	117.7 Å²	117.7	55%	0.552	63%	0.63	S	S	*	*	P	Polyproline II helix	trans	-64.9	141.2	-177.7	26.1	-34.7	0	0	0	112.3	I420	P418-I420 PolarHBondContact O-N 2.8Å; P418-I420 VanDerWaalsContact O-N 3.13Å
419	L	37.9	Very low	38.1	Very low	147 Å²	147	114.8 Å²	114.8	77%	0.77	62%	0.623	S	S	*	*			trans	-67.8	107.6	179.6	-67.8	169.6	0	0	0	111.1	C273	C273-L419 HydrophobicContact CB-CD2 4.14Å
420	I	38.5	Very low	38.3	Very low	140 Å²	140	110.9 Å²	110.9	72%	0.718	62%	0.617	S	S	*	*			trans	-103.6	91.4	165.5	-56.7	179.8	0	0	0	107.5	P418	P418-I420 PolarHBondContact O-N 2.8Å; P418-I420 VanDerWaalsContact O-N 3.13Å
421	G	31.9	Very low	38.5	Very low	67 Å²	67	111 Å²	111	69%	0.691	62%	0.616	S	S	*	*			trans	-61.5	145.5	172.9	0	0	0	0	0	111.6
422	K	33.7	Very low	38.5	Very low	185 Å²	185	111.1 Å²	111.1	80%	0.804	63%	0.628	S	S	*	*	S	Bend	trans	-70.9	166.5	154.8	-65.1	173	-177.8	173.4	0	107.9
423	D	33.1	Very low	38.2	Very low	153 Å²	153	110.1 Å²	110.1	82%	0.818	64%	0.638	S	S	*	*	S	Bend	trans	68.2	52.9	163.2	-42.3	-41	0	0	0	117.3
424	S	36.2	Very low	38	Very low	107 Å²	107	112.4 Å²	112.4	75%	0.748	65%	0.649	S	S	*	*			trans	-153.9	139.1	147.6	-93.3	0	0	0	0	113.7
425	S	30.6	Very low	37.1	Very low	138 Å²	138	116.4 Å²	116.4	97%	0.965	68%	0.677	S	S	*	*	S	Bend	trans	-103.5	17.6	179.3	66.9	0	0	0	0	114.2
426	A	35.5	Very low	36	Very low	75 Å²	75	121.8 Å²	121.8	62%	0.62	70%	0.704	S	S	*	*			trans	-132	146.4	162.3	0	0	0	0	0	108
427	I	36	Very low	35	Very low	91 Å²	91	126.7 Å²	126.7	47%	0.467	72%	0.716	S	S	.	*			trans	-131.7	89.6	175	-59.4	175.9	0	0	0	107.2	L429 I623	I427-L429 HydrophobicContact CG2-CD1 3.9Å; I427-L429 HydrophobicContact CG2-CG 3.78Å; I427-I623 HydrophobicContact CB-CD1 3.96Å; I427-I623 HydrophobicContact CB-CG1 3.96Å; I427-I623 HydrophobicContact CB-CG2 4.22Å; I427-I623 HydrophobicContact CD1-CG2 4.36Å; I427-I623 HydrophobicContact CG2-CG2 4.2Å; I427-I623 WeakPolarHBondContact O-CG1 3.34Å
428	E	31.7	Very low	33.7	Very low	186 Å²	186	132.1 Å²	132.1	87%	0.869	75%	0.752	S	S	*	*			trans	-93.9	122.6	150.8	-69	-176.9	150.6	0	0	105.9
429	L	32.8	Very low	33.1	Very low	144 Å²	144	133 Å²	133	75%	0.754	75%	0.751	S	S	*	*			trans	-107.4	119.9	171.8	-78.1	165.5	0	0	0	106.8	I427	I427-L429 HydrophobicContact CG2-CD1 3.9Å; I427-L429 HydrophobicContact CG2-CG 3.78Å
430	L	33.3	Very low	32.7	Very low	147 Å²	147	134.2 Å²	134.2	77%	0.77	75%	0.752	S	S	*	*			trans	-61.2	137.7	174.4	-82.5	71.1	0	0	0	109.5	N432	L430-N432 PolarHBondContact O-N 3.26Å
431	P	32.9	Very low	32.3	Very low	90 Å²	90	136.2 Å²	136.2	58%	0.584	75%	0.752	S	S	*	*			trans	-72.1	107.5	170.3	29.3	-32.1	0	0	0	109.5	C433	P431-C433 PolarHBondContact O-N 3.24Å; P431-C433 PolarHBondContact O-SG 2.74Å
432	N	36.2	Very low	32.3	Very low	154 Å²	154	140 Å²	140	82%	0.824	76%	0.755	S	S	*	*			trans	-61.3	112.1	174.8	-90.9	6.5	0	0	0	110.5	L430 L434	L430-N432 PolarHBondContact O-N 3.26Å; N432-L434 PolarHBondContact O-N 3.07Å; N432-L434 VanDerWaalsContact O-N 3.11Å
433	C	28.1	Very low	32.3	Very low	126 Å²	126	136.6 Å²	136.6	85%	0.851	75%	0.752	S	S	*	*			trans	-79.5	90.4	-179.6	-66.1	0	0	0	0	110.9	P431	P431-C433 PolarHBondContact O-N 3.24Å; P431-C433 PolarHBondContact O-SG 2.74Å
434	L	34.7	Very low	32.4	Very low	144 Å²	144	135.3 Å²	135.3	75%	0.754	75%	0.753	S	S	*	*			trans	-119	125.4	164.5	-73.5	176.5	0	0	0	110.3	N432 H436	N432-L434 PolarHBondContact O-N 3.07Å; N432-L434 VanDerWaalsContact O-N 3.11Å; L434-H436 PolarHBondContact O-N 3.08Å; L434-H436 VanDerWaalsContact O-N 3.08Å
435	S	27.5	Very low	31.9	Very low	122 Å²	122	138.7 Å²	138.7	85%	0.853	76%	0.761	S	S	*	*			trans	-86.2	76.1	-161.3	44.7	0	0	0	0	113.9	K437	S435-K437 PolarHBondContact O-N 2.8Å
436	H	33	Very low	31.9	Very low	170 Å²	170	137.2 Å²	137.2	79%	0.787	75%	0.751	S	S	*	*			trans	-87.4	102.1	168.8	-72	-72.4	0	0	0	112	L434	L434-H436 PolarHBondContact O-N 3.08Å; L434-H436 VanDerWaalsContact O-N 3.08Å
437	K	31.3	Very low	31.6	Very low	178 Å²	178	141.3 Å²	141.3	77%	0.774	76%	0.757	S	S	*	*			trans	-56.6	145.3	163.4	-65.8	178.6	179.5	177.6	0	109.6	S435 I439	S435-K437 PolarHBondContact O-N 2.8Å; K437-I439 PolarHBondContact O-N 3.34Å
438	P	29.4	Very low	31.4	Very low	126 Å²	126	146.1 Å²	146.1	82%	0.818	78%	0.777	S	S	*	*			trans	-66.8	100.3	172.6	28	-33.6	0	0	0	109.8
439	I	30	Very low	31.4	Very low	102 Å²	102	143.7 Å²	143.7	52%	0.523	77%	0.769	S	S	.	*			trans	-82.4	117.4	172.4	-62	176	0	0	0	107.5	K437 Y441	K437-I439 PolarHBondContact O-N 3.34Å; I439-Y441 PolarHBondContact O-N 3.24Å; I439-Y441 VanDerWaalsContact O-N 3.15Å
440	H	29.9	Very low	31.4	Very low	173 Å²	173	143.6 Å²	143.6	80%	0.801	77%	0.769	S	S	*	*			trans	-55.3	117.9	172.2	-71.7	-108.9	0	0	0	110	L442	H440-L442 PolarHBondContact O-N 2.92Å
441	Y	30.6	Very low	31.4	Very low	183 Å²	183	143.6 Å²	143.6	72%	0.718	77%	0.765	S	S	*	*			trans	-85	106.2	165.8	-84.9	-89.5	0	0	0	108.6	R411 I439	R411-Y441 PolarHBondContact NH1-OH 2.98Å; I439-Y441 PolarHBondContact O-N 3.24Å; I439-Y441 VanDerWaalsContact O-N 3.15Å
442	L	31.5	Very low	31.2	Very low	145 Å²	145	145.3 Å²	145.3	76%	0.759	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-70.6	145.7	160.3	-72.2	85.4	0	0	0	108.8	H440	H440-L442 PolarHBondContact O-N 2.92Å
443	P	33.8	Very low	30.9	Very low	114 Å²	114	144.7 Å²	144.7	74%	0.74	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-65.5	148.9	168.3	29.4	-34.4	0	0	0	110.4	L445	P443-L445 PolarHBondContact O-N 3.35Å
444	P	34.9	Very low	31.1	Very low	127 Å²	127	144.5 Å²	144.5	83%	0.825	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-65.7	132.6	178.6	-20.8	33.3	0	0	0	112.7
445	L	26.2	Very low	31	Very low	177 Å²	177	142 Å²	142	93%	0.927	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-86.4	126.9	166.6	-82.5	161.9	0	0	0	109.8	P443	P443-L445 PolarHBondContact O-N 3.35Å
446	S	31.1	Very low	31.3	Very low	107 Å²	107	147.7 Å²	147.7	75%	0.748	77%	0.765	S	S	*	*			trans	-137.8	102.1	169.6	-69.4	0	0	0	0	110.4
447	H	29	Very low	31.2	Very low	162 Å²	162	144.5 Å²	144.5	75%	0.75	76%	0.762	S	S	*	*			trans	14.3	119.8	157.9	-65.6	-102.4	0	0	0	118.9
448	H	32.6	Very low	31.4	Very low	192 Å²	192	142 Å²	142	89%	0.889	76%	0.764	S	S	*	*				-147	133.8	101.4	-115.8	-81.2	0	0	0	111.7
449	L	31.1	Very low	31.5	Very low	135 Å²	135	141.3 Å²	141.3	71%	0.707	76%	0.761	S	S	*	*			trans	-96.1	138.5	168.4	-72.9	152.2	0	0	0	108
450	L	32.8	Very low	31.4	Very low	142 Å²	142	143.7 Å²	143.7	74%	0.743	77%	0.774	S	S	*	*				168	141.6	111.7	-88.8	167.1	0	0	0	110.5
451	Q	32.5	Very low	31.5	Very low	147 Å²	147	141.5 Å²	141.5	69%	0.687	77%	0.768	S	S	*	*			trans	40.1	143	140.1	-68.6	173.3	-20	0	0	120.8
452	D	29.8	Very low	31.6	Very low	125 Å²	125	140.8 Å²	140.8	67%	0.668	77%	0.769	S	S	*	*			cis	177.1	165.8	-22.5	-115	-31.4	0	0	0	105.3
453	N	28.7	Very low	31.7	Very low	141 Å²	141	140.1 Å²	140.1	75%	0.754	77%	0.766	S	S	*	*			trans	46.7	98.5	156	-59.9	-39.8	0	0	0	118.5
454	S	33.2	Very low	31.5	Very low	122 Å²	122	142.9 Å²	142.9	85%	0.853	77%	0.769	S	S	*	*				-169.8	145	98.2	35.8	0	0	0	0	113.9
455	S	31.9	Very low	31.5	Very low	93 Å²	93	142.7 Å²	142.7	65%	0.65	77%	0.768	S	S	*	*			trans	-55.8	141.3	174.5	50.4	0	0	0	0	114.9
456	Y	33.1	Very low	31.5	Very low	240 Å²	240	141.4 Å²	141.4	94%	0.941	76%	0.761	S	S	*	*				-142.9	146.8	119.8	-110.6	-78.1	0	0	0	110.6
457	S	32	Very low	31.6	Very low	104 Å²	104	148 Å²	148	73%	0.727	77%	0.77	S	S	*	*			trans	-104.9	157	-159	-56.3	0	0	0	0	114.5
458	P	36	Very low	31.6	Very low	124 Å²	124	147.9 Å²	147.9	81%	0.805	77%	0.767	S	S	*	*			trans	-88.7	145	176.1	35	-34.7	0	0	0	113.8
459	C	30.2	Very low	31.6	Very low	113 Å²	113	146.6 Å²	146.6	76%	0.764	77%	0.766	S	S	*	*			trans	-148.4	137.6	156.7	-82.8	0	0	0	0	106.1
460	N	29.1	Very low	31.4	Very low	151 Å²	151	147.3 Å²	147.3	81%	0.807	77%	0.766	S	S	*	*			cis	74.1	147.9	30.3	-147.3	2.3	0	0	0	113.4
461	L	32	Very low	31.4	Very low	128 Å²	128	144.9 Å²	144.9	67%	0.67	76%	0.76	S	S	*	*			trans	88.1	123.3	173.9	-54.2	155.4	0	0	0	120.1
462	F	31.8	Very low	31.4	Very low	167 Å²	167	144.9 Å²	144.9	73%	0.732	77%	0.765	S	S	*	*			trans	87.3	109.2	130.8	-84	-138	0	0	0	122.9
463	N	34	Very low	31.5	Very low	132 Å²	132	143.9 Å²	143.9	71%	0.706	77%	0.768	S	S	*	*				71.6	136.1	123.9	-60.8	-1.6	0	0	0	122.6
464	Q	30.2	Very low	31.7	Very low	172 Å²	172	142 Å²	142	80%	0.804	77%	0.766	S	S	*	*			trans	-58.5	154.8	154.5	-56.6	179.9	-13.4	0	0	110.4
465	P	34.1	Very low	31.5	Very low	123 Å²	123	140.6 Å²	140.6	80%	0.799	76%	0.756	S	S	*	*				-142.9	154.7	86	37.2	-21.7	0	0	0	116.9
466	L	25.9	Very low	31.6	Very low	149 Å²	149	142.8 Å²	142.8	78%	0.78	76%	0.756	S	S	*	*			trans	-35	135.6	164.5	-68.3	149.4	0	0	0	116.6
467	R	33.3	Very low	31.4	Very low	246 Å²	246	141 Å²	141	93%	0.928	75%	0.748	S	S	*	*			trans	-163.4	91.2	143	-103.8	179.5	-70.8	-179.6	-0.5	105.4
468	K	29.6	Very low	31.6	Very low	160 Å²	160	143.9 Å²	143.9	70%	0.696	75%	0.754	S	S	*	*				54.9	95.5	67.4	-160.5	175.5	-168.4	176.3	0	112.5	E470	K468-E470 WeakPolarHBondContact CE-OE2 3.36Å; K468-E470 IonicContact NZ-OE2 3.26Å; K468-E470 PolarHBondContact NZ-OE2 2.98Å
469	L	32.1	Very low	31.6	Very low	164 Å²	164	142.9 Å²	142.9	86%	0.859	75%	0.75	S	S	*	*			trans	-139.9	100.7	155.4	-149.8	83.7	0	0	0	107.5
470	E	26.2	Very low	31.7	Very low	150 Å²	150	142.4 Å²	142.4	70%	0.701	75%	0.748	S	S	*	*			trans	-109.5	119.2	168.7	-68.4	168.4	116.1	0	0	106.4	K468	K468-E470 WeakPolarHBondContact CE-OE2 3.36Å; K468-E470 IonicContact NZ-OE2 3.26Å; K468-E470 PolarHBondContact NZ-OE2 2.98Å
471	S	33.5	Very low	32.1	Very low	91 Å²	91	142 Å²	142	64%	0.636	75%	0.745	S	S	*	*			trans	-170.2	98.4	166	55.8	0	0	0	0	106
472	D	31.6	Very low	32.5	Very low	148 Å²	148	143.2 Å²	143.2	79%	0.791	75%	0.747	S	S	*	*				85.9	143.3	75.1	-86	-44	0	0	0	112.4
473	S	31.9	Very low	32.7	Very low	103 Å²	103	142.2 Å²	142.2	72%	0.72	75%	0.745	S	S	*	*			trans	67.7	118.5	168.1	81.7	0	0	0	0	114.3
474	S	33.1	Very low	33	Very low	102 Å²	102	140.8 Å²	140.8	71%	0.713	74%	0.74	S	S	*	*				67.5	139.2	90.4	88.7	0	0	0	0	112.9
475	S	29.7	Very low	33.4	Very low	93 Å²	93	137.5 Å²	137.5	65%	0.65	74%	0.737	S	S	*	*			cis	171.7	175.2	-3.2	42.1	0	0	0	0	105.8
476	E	33.5	Very low	33.4	Very low	139 Å²	139	137.2 Å²	137.2	65%	0.65	74%	0.736	S	S	*	*			trans	72.9	113.5	164.3	-45.7	-137.5	106.1	0	0	114.9
477	R	30.1	Very low	34	Very low	203 Å²	203	134.8 Å²	134.8	77%	0.766	73%	0.732	S	S	*	*				87.6	165.1	85.3	-77.2	169.5	163.3	167.5	-11.9	112.7
478	L	35.4	Very low	34.2	Very low	163 Å²	163	128.7 Å²	128.7	85%	0.853	73%	0.727	S	S	*	*			trans	73.7	135	175.4	-47.3	173.7	0	0	0	114.4
479	S	35.7	Very low	34.3	Very low	104 Å²	104	126.8 Å²	126.8	73%	0.727	73%	0.732	S	S	*	*			cis	-149.7	146.2	-15.2	-94.9	0	0	0	0	111.8
480	S	32.3	Very low	34.6	Very low	102 Å²	102	124.1 Å²	124.1	71%	0.713	73%	0.725	S	S	*	*			trans	-59.6	163.7	160.4	45.5	0	0	0	0	113.2
481	L	38.7	Very low	35	Very low	142 Å²	142	124.5 Å²	124.5	74%	0.743	73%	0.731	S	S	*	*				173.7	122.2	118.8	-90	166.9	0	0	0	111.9
482	H	39	Very low	34.9	Very low	155 Å²	155	125 Å²	125	72%	0.718	73%	0.734	S	S	*	*			trans	63.6	154.3	138.7	-74.1	-135	0	0	0	118.9
483	E	37.5	Very low	35.1	Very low	146 Å²	146	123.3 Å²	123.3	68%	0.682	73%	0.734	S	S	*	*			cis	-168.8	169.1	-7	-120.5	-168.2	97.5	0	0	108.9
484	T	40	Very low	35.2	Very low	101 Å²	101	123.1 Å²	123.1	62%	0.62	73%	0.733	S	S	*	*			cis	-153.3	167.3	-11	-20.8	0	0	0	0	108.3
485	S	39	Very low	35.4	Very low	103 Å²	103	122.6 Å²	122.6	72%	0.72	73%	0.729	S	S	*	*			trans	62.5	129.4	156	49	0	0	0	0	119.8
486	C	33.4	Very low	35.8	Very low	118 Å²	118	126.6 Å²	126.6	80%	0.797	74%	0.737	S	S	*	*				71.4	133.2	59.5	-67.7	0	0	0	0	113.9
487	S	38	Very low	35.6	Very low	97 Å²	97	125.3 Å²	125.3	68%	0.678	74%	0.744	S	S	*	*			cis	-164.8	170.6	-2.9	-86.3	0	0	0	0	111.7
488	S	37.9	Very low	36.1	Very low	118 Å²	118	121.8 Å²	121.8	83%	0.825	75%	0.747	S	S	*	*			trans	82	139.4	150.8	-57.7	0	0	0	0	121.7
489	C	30.9	Very low	36	Very low	121 Å²	121	119.3 Å²	119.3	82%	0.818	74%	0.743	S	S	*	*			trans	-80.7	-168.6	164.4	-45.8	0	0	0	0	110.1
490	P	40.2	Very low	36.2	Very low	108 Å²	108	121.2 Å²	121.2	70%	0.701	75%	0.75	S	S	*	*			cis	-143.1	-176.3	1.9	44.5	-25.3	0	0	0	117
491	L	32.8	Very low	36.3	Very low	158 Å²	158	124 Å²	124	83%	0.827	76%	0.756	S	S	*	*			trans	43.8	138.3	140.7	-79.1	161.9	0	0	0	123.6
492	S	33.4	Very low	36.5	Very low	100 Å²	100	123.4 Å²	123.4	70%	0.699	76%	0.761	S	S	*	*			trans	87.2	136.6	139.9	78.1	0	0	0	0	120.7
493	S	34.1	Very low	36.3	Very low	113 Å²	113	123.6 Å²	123.6	79%	0.79	77%	0.767	S	S	*	*			trans	64.2	154.5	160.5	70.9	0	0	0	0	118.3
494	S	34.7	Very low	36.2	Very low	100 Å²	100	121.4 Å²	121.4	70%	0.699	77%	0.766	S	S	*	*			cis	-167.3	168.9	-28.2	54.9	0	0	0	0	110
495	S	36.8	Very low	36.1	Very low	90 Å²	90	123 Å²	123	63%	0.629	78%	0.776	S	S	*	*			trans	81.8	150.1	145.3	85.1	0	0	0	0	121.9
496	H	37.7	Very low	36	Very low	177 Å²	177	122.5 Å²	122.5	82%	0.819	77%	0.773	S	S	*	*			trans	65.9	107.8	152.2	-59.1	-48.9	0	0	0	123.2
497	S	29.4	Very low	36.3	Very low	113 Å²	113	124.3 Å²	124.3	79%	0.79	77%	0.773	S	S	*	*			trans	-51.7	161.6	143.5	-18.1	0	0	0	0	112.6
498	P	40.3	Very low	36.2	Very low	128 Å²	128	128.6 Å²	128.6	83%	0.831	78%	0.78	S	S	*	*				-146.9	179.9	79.3	39.6	-21.6	0	0	0	116.4
499	S	34.4	Very low	36.1	Very low	112 Å²	112	128.1 Å²	128.1	78%	0.783	78%	0.776	S	S	*	*			trans	-95.7	165.4	177.6	50.4	0	0	0	0	113.4
500	V	38.8	Very low	36.4	Very low	144 Å²	144	130 Å²	130	87%	0.873	78%	0.777	S	S	*	*			trans	-171.3	153.4	148.5	133.9	0	0	0	0	111.2
501	L	35.6	Very low	36.2	Very low	160 Å²	160	129.7 Å²	129.7	84%	0.838	78%	0.777	S	S	*	*			trans	-110.4	163.8	177	-77.2	163.2	0	0	0	111.8
502	P	43.6	Very low	36.4	Very low	130 Å²	130	126.6 Å²	126.6	84%	0.844	77%	0.769	S	S	*	*			trans	-138.3	-172.3	132.2	32.7	-15.5	0	0	0	115
503	L	34.6	Very low	36.6	Very low	159 Å²	159	132.1 Å²	132.1	83%	0.832	78%	0.776	S	S	*	*			trans	-151.4	171.8	-150	-168.1	68	0	0	0	113.5
504	C	34.2	Very low	37.1	Very low	100 Å²	100	131.3 Å²	131.3	68%	0.676	77%	0.768	S	S	*	*			trans	74.9	129.1	166.7	-65.6	0	0	0	0	116.3
505	T	39.3	Very low	37.1	Very low	135 Å²	135	131.4 Å²	131.4	83%	0.828	77%	0.769	S	S	*	*				-169	-178	59.5	40.4	0	0	0	0	111.3
506	S	36.9	Very low	37.3	Very low	92 Å²	92	132.3 Å²	132.3	64%	0.643	78%	0.775	S	S	*	*			cis	-175	156.2	-43.5	-80.3	0	0	0	0	111.1
507	L	38.7	Very low	37.3	Very low	156 Å²	156	128 Å²	128	82%	0.817	77%	0.769	S	S	*	*			trans	70.5	147.2	165.2	-60.1	169.1	0	0	0	119.4
508	K	36.3	Very low	37.7	Very low	186 Å²	186	127.9 Å²	127.9	81%	0.809	77%	0.768	S	S	*	*			cis	-171	118	-30.1	-152.5	-171.8	-150.2	174.8	0	112.6
509	S	35.9	Very low	37.4	Very low	108 Å²	108	127.3 Å²	127.3	76%	0.755	77%	0.765	S	S	*	*			trans	-179.8	102.2	144.4	54.7	0	0	0	0	113.8
510	I	36.4	Very low	37.6	Very low	162 Å²	162	126.1 Å²	126.1	83%	0.831	76%	0.757	S	S	*	*			trans	30.6	124.4	130.7	-52.6	163.9	0	0	0	117.2
511	S	35.8	Very low	37.5	Very low	100 Å²	100	126.8 Å²	126.8	70%	0.699	75%	0.754	S	S	*	*			cis	-169.7	-166.9	-11.9	64.4	0	0	0	0	106.7
512	S	37.9	Very low	37.8	Very low	94 Å²	94	124 Å²	124	66%	0.657	75%	0.746	S	S	*	*			cis	-172.6	143.5	-4.6	26.4	0	0	0	0	106.9
513	Y	37.4	Very low	37.3	Very low	215 Å²	215	127 Å²	127	84%	0.843	75%	0.746	S	S	*	*			cis	-147.6	150.4	-10	-135.8	-95.6	0	0	0	110.2
514	P	44	Very low	37.2	Very low	97 Å²	97	125.1 Å²	125.1	63%	0.63	74%	0.741	S	S	*	*			trans	-95.3	-171.7	-177.7	25.7	-6.6	0	0	0	112.1
515	S	36.2	Very low	37.3	Very low	102 Å²	102	125.6 Å²	125.6	71%	0.713	75%	0.745	S	S	*	*			cis	-160.7	164.6	36	-52.9	0	0	0	0	110.7
516	S	39.4	Very low	37.1	Very low	108 Å²	108	123.6 Å²	123.6	76%	0.755	74%	0.743	S	S	*	*			cis	77.4	138.6	19.5	77.3	0	0	0	0	117.1
517	A	38.4	Very low	36.9	Very low	86 Å²	86	124.6 Å²	124.6	71%	0.711	75%	0.749	S	S	*	*			cis	-173.1	178.4	-13.2	0	0	0	0	0	111
518	C	37	Very low	36.8	Very low	112 Å²	112	123.3 Å²	123.3	76%	0.757	75%	0.747	S	S	*	*			trans	6	142.6	157	63.1	0	0	0	0	122.2
519	C	35.1	Very low	37.1	Very low	115 Å²	115	119.6 Å²	119.6	78%	0.777	74%	0.742	S	S	*	*				173.2	-176.6	76.3	-103.3	0	0	0	0	111.3
520	S	37.6	Very low	37.1	Very low	87 Å²	87	121.4 Å²	121.4	61%	0.608	75%	0.749	S	S	*	*			cis	177.4	128.5	-46.1	-84.8	0	0	0	0	114
521	I	36.4	Very low	37	Very low	159 Å²	159	123.2 Å²	123.2	82%	0.815	75%	0.751	S	S	*	*			trans	68.1	147.1	136.5	-58.4	171.4	0	0	0	119.5
522	P	42.1	Very low	37	Very low	102 Å²	102	124.3 Å²	124.3	66%	0.662	76%	0.759	S	S	*	*			cis	-136	-174	-18	40	-20.4	0	0	0	117.4
523	F	33.9	Very low	36.8	Very low	191 Å²	191	126.7 Å²	126.7	84%	0.838	76%	0.764	S	S	*	*			trans	23.8	149.3	147.7	-68.1	-61.4	0	0	0	123.2
524	T	32.4	Very low	36.8	Very low	121 Å²	121	123 Å²	123	74%	0.742	76%	0.757	S	S	*	*			cis	-160.4	166.6	19.4	-10.5	0	0	0	0	114.3
525	S	36.1	Very low	36.5	Very low	109 Å²	109	123.9 Å²	123.9	76%	0.762	77%	0.766	S	S	*	*			trans	69.7	122.2	146.6	59.7	0	0	0	0	126
526	A	35.2	Very low	36.4	Very low	93 Å²	93	123.3 Å²	123.3	77%	0.769	77%	0.768	S	S	*	*			trans	87.7	119.3	130.2	0	0	0	0	0	125.4
527	C	33.3	Very low	36.7	Very low	114 Å²	114	123.2 Å²	123.2	77%	0.77	77%	0.765	S	S	*	*			trans	62.9	96.1	134.3	-62	0	0	0	0	125
528	T	36.8	Very low	36.6	Very low	128 Å²	128	126.1 Å²	126.1	79%	0.785	77%	0.767	S	S	*	*				28.6	159.9	110.8	63.7	0	0	0	0	122.6
529	P	42	Very low	36.6	Very low	108 Å²	108	128.5 Å²	128.5	70%	0.701	77%	0.772	S	S	*	*				-141.4	-174.1	-50.8	42.1	-24.5	0	0	0	112.7
530	T	35.5	Very low	36.6	Very low	146 Å²	146	127.6 Å²	127.6	90%	0.896	77%	0.766	S	S	*	*			trans	-179	171.5	141.1	19.2	0	0	0	0	114.4
531	F	34.5	Very low	36.9	Very low	201 Å²	201	131.1 Å²	131.1	88%	0.882	78%	0.778	S	S	*	*			trans	-102.9	152.5	-169.6	-73.9	-108	0	0	0	115
532	S	37	Very low	37.2	Very low	123 Å²	123	128.9 Å²	128.9	86%	0.86	77%	0.774	S	S	*	*			trans	160.9	159.6	134.6	46.3	0	0	0	0	112.3
533	N	33.6	Very low	37.6	Very low	143 Å²	143	129 Å²	129	77%	0.765	77%	0.774	S	S	*	*			cis	-165.1	177.2	-40	-158.2	-1.9	0	0	0	108.5
534	I	36.7	Very low	37.9	Very low	137 Å²	137	129.3 Å²	129.3	70%	0.703	78%	0.778	S	S	*	*			trans	79	107	155	-63.1	158.5	0	0	0	120
535	S	37.4	Very low	38.3	Very low	116 Å²	116	131.2 Å²	131.2	81%	0.811	78%	0.784	S	S	*	*			trans	68.9	145	133.8	-57.9	0	0	0	0	125.6
536	A	35.1	Very low	39	Very low	91 Å²	91	131.2 Å²	131.2	75%	0.752	78%	0.781	S	S	*	*			trans	-110.9	-152.1	167.8	0	0	0	0	0	108.9
537	P	44.7	Very low	39.3	Very low	106 Å²	106	132.3 Å²	132.3	69%	0.688	78%	0.783	S	S	*	*			cis	-143.2	-164.7	-3.7	28	-0.1	0	0	0	116.2
538	L	35.7	Very low	39.7	Very low	146 Å²	146	131.2 Å²	131.2	76%	0.764	78%	0.777	S	S	*	*			trans	107.6	145	146.6	-56.6	-178.8	0	0	0	121.8
539	L	37.1	Very low	39.8	Very low	163 Å²	163	132.7 Å²	132.7	85%	0.853	78%	0.779	S	S	*	*			trans	69.9	144.1	160.4	-59.9	138.2	0	0	0	118.4
540	S	36.4	Very low	39.7	Very low	95 Å²	95	131.6 Å²	131.6	66%	0.664	77%	0.774	S	S	*	*			cis	-169.1	130.3	-16.8	50.6	0	0	0	0	113.6
541	L	42.3	Very low	39.8	Very low	162 Å²	162	130.2 Å²	130.2	85%	0.848	77%	0.77	S	S	*	*				25.4	153.7	122.1	-80.5	164.7	0	0	0	121.7
542	P	42.7	Very low	40.1	Very low	112 Å²	112	126.1 Å²	126.1	73%	0.727	77%	0.766	S	S	*	*			cis	-141.9	-139.7	-3.6	50.2	-29	0	0	0	114
543	P	50.4	Low	40	Very low	105 Å²	105	125.7 Å²	125.7	68%	0.682	76%	0.764	S	S	*	*			trans	-133.4	-160.6	-143.4	37.3	-9.4	0	0	0	115.9
544	H	41.7	Very low	40.8	Very low	196 Å²	196	124.5 Å²	124.5	91%	0.907	76%	0.764	S	S	*	*			trans	-158.7	175.4	147.9	-100.2	-60.2	0	0	0	112.9
545	N	40.7	Very low	41	Very low	162 Å²	162	123.4 Å²	123.4	87%	0.866	77%	0.765	S	S	*	*			trans	-127.6	-177.4	-148.2	-121.3	7	0	0	0	115.1
546	P	50	Low	40.9	Very low	108 Å²	108	122.7 Å²	122.7	70%	0.701	76%	0.76	S	S	*	*			trans	-121.3	-176.5	-147.5	46.2	-38	0	0	0	117.2
547	S	41.2	Very low	41	Very low	116 Å²	116	124.2 Å²	124.2	81%	0.811	77%	0.766	S	S	*	*			trans	-165.6	155.6	168.1	-68.1	0	0	0	0	109.8
548	S	41.4	Very low	40.5	Very low	92 Å²	92	123 Å²	123	64%	0.643	77%	0.773	S	S	*	*			cis	-175.2	160.6	-19.7	54.2	0	0	0	0	110.6
549	L	39.2	Very low	40.6	Very low	159 Å²	159	122.2 Å²	122.2	83%	0.832	77%	0.774	S	S	*	*			trans	65.9	154.4	157.9	-62.2	154.9	0	0	0	119.3
550	S	39.9	Very low	40.5	Very low	85 Å²	85	124.7 Å²	124.7	59%	0.594	77%	0.772	S	S	*	*			cis	-175.7	145.1	-28.6	52.5	0	0	0	0	113.2
551	S	39.1	Very low	40.3	Very low	117 Å²	117	128.5 Å²	128.5	82%	0.818	78%	0.777	S	S	*	*			trans	64.4	160.7	151.4	73.7	0	0	0	0	118.6
552	S	39.3	Very low	39.8	Very low	114 Å²	114	127.3 Å²	127.3	80%	0.797	77%	0.768	S	S	*	*			cis	-144.8	173.2	6.6	56.6	0	0	0	0	112.7
553	S	36.6	Very low	39.4	Very low	115 Å²	115	129.1 Å²	129.1	80%	0.804	77%	0.767	S	S	*	*			trans	-112.9	175.5	-164.1	-43.7	0	0	0	0	113.7
554	P	48.5	Very low	38.4	Very low	118 Å²	118	132.9 Å²	132.9	77%	0.766	77%	0.772	S	S	*	*			trans	-89.7	-170.6	-169.6	40	-37.6	0	0	0	113.6
555	P	42	Very low	38.1	Very low	113 Å²	113	131.9 Å²	131.9	73%	0.734	77%	0.768	S	S	*	*				-157.1	158.6	95.9	42.5	-24	0	0	0	119.5
556	S	34.7	Very low	37.8	Very low	101 Å²	101	130.9 Å²	130.9	71%	0.706	76%	0.762	S	S	*	*			trans	40.5	144.9	138.8	73.8	0	0	0	0	125.9
557	S	37.7	Very low	36.7	Very low	124 Å²	124	132.8 Å²	132.8	87%	0.867	77%	0.766	S	S	*	*			trans	104.2	137.6	140.6	-57.4	0	0	0	0	119.3
558	G	35	Very low	36.5	Very low	81 Å²	81	134.2 Å²	134.2	84%	0.835	77%	0.77	S	S	*	*			trans	139.8	90.7	167	0	0	0	0	0	115.7
559	T	36.5	Very low	36	Very low	129 Å²	129	134.4 Å²	134.4	79%	0.791	77%	0.771	S	S	*	*			trans	-79.5	146.5	177.9	50.4	0	0	0	0	113.4
560	R	34.6	Very low	35.7	Very low	215 Å²	215	133 Å²	133	81%	0.811	77%	0.772	S	S	*	*				160	131.3	111.7	-83.6	-167.1	-174.3	-170.9	0.9	116.1
561	F	32.7	Very low	35.5	Very low	174 Å²	174	136.6 Å²	136.6	76%	0.763	78%	0.783	S	S	*	*			trans	68.6	125.3	136.8	-80.2	-112.5	0	0	0	123.9
562	M	32.5	Very low	35	Very low	137 Å²	137	136.8 Å²	136.8	68%	0.675	78%	0.775	S	S	*	*			trans	85.7	100.7	138.2	-57.9	-90.1	90.4	0	0	122.5
563	H	33.2	Very low	34.6	Very low	151 Å²	151	142.2 Å²	142.2	70%	0.699	78%	0.78	S	S	*	*			trans	74.7	132.4	130.7	-83.8	-61.5	0	0	0	124.3
564	K	30.3	Very low	34.2	Very low	183 Å²	183	141.3 Å²	141.3	80%	0.796	77%	0.773	S	S	*	*			trans	64.4	108.7	151.8	-63.8	173.6	-177.6	-179.8	0	117
565	H	36.2	Very low	33.3	Very low	176 Å²	176	140.9 Å²	140.9	82%	0.815	77%	0.773	S	S	*	*				-163	159.6	107.2	-113.2	-88.7	0	0	0	113
566	L	34.1	Very low	32.9	Very low	141 Å²	141	143 Å²	143	74%	0.738	78%	0.777	S	S	*	*			trans	-23.2	161.3	178	-62.8	165.1	0	0	0	122.5
567	D	27.1	Very low	32.7	Very low	147 Å²	147	145.3 Å²	145.3	79%	0.786	78%	0.781	S	S	*	*			trans	-47.4	135.5	174.1	-46.2	-92.3	0	0	0	117.3
568	V	36.1	Very low	32.3	Very low	147 Å²	147	145 Å²	145	89%	0.891	78%	0.778	S	S	*	*			trans	-146	140.9	145	-173.8	0	0	0	0	109.4
569	S	29.8	Very low	32.2	Very low	95 Å²	95	148.1 Å²	148.1	66%	0.664	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-76.5	152.8	-177.8	-43.2	0	0	0	0	114.6
570	P	34.8	Very low	32.1	Very low	131 Å²	131	148.3 Å²	148.3	85%	0.851	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-68.8	133.6	155.8	-12.7	28.9	0	0	0	110.2
571	L	34.7	Very low	32	Very low	159 Å²	159	145.3 Å²	145.3	83%	0.832	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-84.2	144.8	-171.3	-75.8	164.5	0	0	0	114.4
572	N	29.2	Very low	31.9	Very low	122 Å²	122	142.4 Å²	142.4	65%	0.652	77%	0.771	S	S	*	*			trans	-32.6	127.7	158.5	179.8	15	0	0	0	114.7	S574	N572-S574 VanDerWaalsContact OD1-CB 3.31Å; N572-S574 WeakPolarHBondContact OD1-CB 3.31Å; N572-S574 PolarHBondContact OD1-N 3.04Å; N572-S574 PolarHBondContact OD1-OG 3.26Å
573	Y	31.1	Very low	31.8	Very low	228 Å²	228	141.4 Å²	141.4	89%	0.894	78%	0.778	S	S	*	*			trans	-120.6	83.3	158.2	-104.7	-87	0	0	0	110
574	S	26.6	Very low	32	Very low	96 Å²	96	141 Å²	141	67%	0.671	79%	0.786	S	S	*	*			trans	-129.8	77.3	169.9	-69.3	0	0	0	0	109.7	N572	N572-S574 VanDerWaalsContact OD1-CB 3.31Å; N572-S574 WeakPolarHBondContact OD1-CB 3.31Å; N572-S574 PolarHBondContact OD1-N 3.04Å; N572-S574 PolarHBondContact OD1-OG 3.26Å
575	S	29.8	Very low	32	Very low	108 Å²	108	140 Å²	140	76%	0.755	79%	0.788	S	S	*	*			trans	-167.5	113.2	163.8	-83.4	0	0	0	0	110
576	L	33.3	Very low	31.9	Very low	159 Å²	159	137.5 Å²	137.5	83%	0.832	79%	0.785	S	S	*	*				-179.3	143.2	119.9	-95.3	172.4	0	0	0	110.4
577	L	32.2	Very low	31.7	Very low	149 Å²	149	136.9 Å²	136.9	78%	0.78	78%	0.783	S	S	*	*			trans	60.1	75.9	158.1	-61	165.8	0	0	0	117.4	N579	L577-N579 PolarHBondContact O-N 3.33Å
578	S	28.9	Very low	32	Very low	116 Å²	116	139.3 Å²	139.3	81%	0.811	79%	0.786	S	S	*	*			trans	-59.5	117.1	140.5	52.6	0	0	0	0	110.1
579	N	32.7	Very low	31.9	Very low	147 Å²	147	139.4 Å²	139.4	79%	0.786	78%	0.78	S	S	*	*			trans	-157.8	155.1	152.6	-122.9	-21.9	0	0	0	114.4	L577	L577-N579 PolarHBondContact O-N 3.33Å
580	N	33.1	Very low	32	Very low	134 Å²	134	141.4 Å²	141.4	72%	0.717	78%	0.784	S	S	*	*			trans	-78.2	128.6	-168	-48.5	-76.6	0	0	0	113.3
581	N	33.5	Very low	31.9	Very low	151 Å²	151	140.2 Å²	140.2	81%	0.807	77%	0.774	S	S	*	*				163.4	135.2	120	-86.9	-18.3	0	0	0	112.4
582	P	30.4	Very low	31.9	Very low	113 Å²	113	140.9 Å²	140.9	73%	0.734	77%	0.77	S	S	*	*			trans	-79.6	160	153	34.8	-31.5	0	0	0	110.8
583	S	31.5	Very low	31.9	Very low	117 Å²	117	142.1 Å²	142.1	82%	0.818	78%	0.777	S	S	*	*			trans	75.8	82.9	171.9	-52.4	0	0	0	0	118
584	T	36	Very low	31.8	Very low	142 Å²	142	137.6 Å²	137.6	87%	0.871	78%	0.775	S	S	*	*			trans	-157.8	160.2	131.9	23.9	0	0	0	0	109.8
585	L	30.8	Very low	31.9	Very low	162 Å²	162	138.1 Å²	138.1	85%	0.848	78%	0.779	S	S	*	*			trans	64.5	85	175.5	-69.3	168.5	0	0	0	116.8
586	V	33.1	Very low	32	Very low	123 Å²	123	142.1 Å²	142.1	75%	0.745	79%	0.786	S	S	*	*				-59	165.2	129.8	175.5	0	0	0	0	109.2
587	D	30.3	Very low	32	Very low	128 Å²	128	141.9 Å²	141.9	68%	0.684	79%	0.785	S	S	*	*			trans	72.3	125.7	-173.7	-48.6	-44.6	0	0	0	113.1
588	F	33.5	Very low	31.8	Very low	198 Å²	198	143 Å²	143	87%	0.868	79%	0.791	S	S	*	*			cis	-128	154.3	34.2	-95	-105.7	0	0	0	115.3
589	I	34	Very low	32.2	Very low	149 Å²	149	146.1 Å²	146.1	76%	0.764	79%	0.79	S	S	*	*			trans	-114	152.3	166.5	-73.3	174	0	0	0	108.8
590	D	31.4	Very low	32.1	Very low	137 Å²	137	144.5 Å²	144.5	73%	0.733	79%	0.79	S	S	*	*			trans	68.3	148.2	174.6	-86.1	-43.4	0	0	0	117.1
591	T	33.1	Very low	32.5	Very low	106 Å²	106	146.1 Å²	146.1	65%	0.65	80%	0.797	S	S	*	*			cis	-146.1	160.9	21.6	-3.9	0	0	0	0	113.9
592	K	35.2	Very low	32.7	Very low	173 Å²	173	143.4 Å²	143.4	75%	0.752	78%	0.783	S	S	*	*			trans	60.6	97.5	149.4	-66.6	161.8	-176.4	171.6	0	119.8
593	N	30.4	Very low	33.5	Very low	149 Å²	149	141.9 Å²	141.9	80%	0.797	78%	0.775	S	S	*	*				177.7	122	97.1	-95.1	-15.6	0	0	0	112.3	S595	N593-S595 PolarHBondContact O-N 3.28Å
594	P	28.1	Very low	34.1	Very low	132 Å²	132	140.4 Å²	140.4	86%	0.857	76%	0.758	S	S	*	*			trans	-100.3	69.4	-179.4	38.5	-33.6	0	0	0	113
595	S	27.9	Very low	34.9	Very low	107 Å²	107	137.7 Å²	137.7	75%	0.748	74%	0.741	S	S	*	*			trans	-139	144.9	173.4	-66.9	0	0	0	0	111.4	N593	N593-S595 PolarHBondContact O-N 3.28Å
596	E	31.9	Very low	35.8	Very low	192 Å²	192	135.8 Å²	135.8	90%	0.897	73%	0.731	S	S	*	*			trans	52.8	91.3	165.5	-59.7	-173.5	-176.2	0	0	118.5
597	L	33.1	Very low	36.8	Very low	154 Å²	154	134.2 Å²	134.2	81%	0.806	72%	0.718	S	S	*	*				-164.9	62.1	112.6	-159	66	0	0	0	113.1	K599	L597-K599 PolarHBondContact O-N 2.98Å
598	N	28.6	Very low	37.9	Very low	172 Å²	172	134.4 Å²	134.4	92%	0.92	71%	0.714	S	S	*	*			trans	-72.4	107.3	167.1	-95.2	-32.6	0	0	0	110.3
599	K	36.7	Very low	38.7	Very low	182 Å²	182	129.7 Å²	129.7	79%	0.791	70%	0.695	S	S	*	*			trans	-122.6	99.6	157.8	-75.2	-169.4	176.1	-179.2	0	109.1	L597 I601	L597-K599 PolarHBondContact O-N 2.98Å; K599-I601 PolarHBondContact O-N 2.73Å
600	S	31.6	Very low	39.8	Very low	113 Å²	113	125.5 Å²	125.5	79%	0.79	68%	0.676	S	S	*	*			trans	-68.2	121.9	-177.6	48.4	0	0	0	0	111.8
601	I	40.5	Very low	41.1	Very low	168 Å²	168	124.2 Å²	124.2	86%	0.862	67%	0.665	S	S	*	*			trans	-94.9	123.2	159.7	-65.4	175	0	0	0	106.9	K599 S603	K599-I601 PolarHBondContact O-N 2.73Å; I601-S603 PolarHBondContact O-N 3Å; I601-S603 VanDerWaalsContact O-N 3.15Å
602	D	39.7	Very low	42.4	Very low	95 Å²	95	124.5 Å²	124.5	51%	0.508	66%	0.66	S	S	.	*			trans	-57.2	113.5	-165.7	-97.8	-73.9	0	0	0	115	N604 V605	D602-N604 PolarHBondContact O-N 2.91Å; D602-N604 VanDerWaalsContact O-N 3.12Å; D602-N604 PolarHBondContact OD1-ND2 3.11Å; D602-V605 HydrophobicContact CB-CG2 3.96Å; D602-V605 PolarHBondContact O-N 2.88Å; D602-V605 VanDerWaalsContact O-N 3.13Å
603	S	46.8	Very low	43.4	Very low	81 Å²	81	119.4 Å²	119.4	57%	0.566	64%	0.638	S	S	*	*	H	α-helix	trans	-59.1	-22.1	171	53.6	0	0	0	0	112.8	I601 I607	I601-S603 PolarHBondContact O-N 3Å; I601-S603 VanDerWaalsContact O-N 3.15Å; S603-I607 WeakPolarHBondContact O-CG1 3.38Å; S603-I607 PolarHBondContact O-N 3.08Å
604	N	44	Very low	44.5	Very low	85 Å²	85	119.6 Å²	119.6	46%	0.455	63%	0.632	S	S	.	*	H	α-helix	trans	-64.9	-37.9	175.4	-64.9	-52.7	0	0	0	113.3	D602 L606 I607 Q608	D602-N604 PolarHBondContact O-N 2.91Å; D602-N604 VanDerWaalsContact O-N 3.12Å; D602-N604 PolarHBondContact OD1-ND2 3.11Å; N604-L606 PolarHBondContact O-N 3.48Å; N604-I607 PolarHBondContact O-N 3.01Å; N604-Q608 PolarHBondContact O-N 3.19Å
605	V	52.9	Low	45.4	Very low	85 Å²	85	120.9 Å²	120.9	52%	0.515	62%	0.62	S	S	.	*	H	α-helix	trans	-67.7	-38.2	-178.9	179.7	0	0	0	0	111.1	D602 Q608 H609	D602-V605 HydrophobicContact CB-CG2 3.96Å; D602-V605 PolarHBondContact O-N 2.88Å; D602-V605 VanDerWaalsContact O-N 3.13Å; V605-Q608 PolarHBondContact O-N 3.44Å; V605-H609 PolarHBondContact O-N 2.86Å; V605-H609 PolarHBondContact O-ND1 3.03Å
606	L	49.9	Very low	46.2	Very low	122 Å²	122	120.6 Å²	120.6	64%	0.639	61%	0.61	S	S	*	*	H	α-helix	trans	-66.4	-39.2	176	-174.3	61.8	0	0	0	111.7	N604 H609 V610	N604-L606 PolarHBondContact O-N 3.48Å; L606-H609 PolarHBondContact O-N 3.04Å; L606-V610 WeakPolarHBondContact O-CG2 3.25Å; L606-V610 PolarHBondContact O-N 3.4Å
607	I	54.2	Low	47	Very low	91 Å²	91	118.5 Å²	118.5	47%	0.467	59%	0.594	S	S	.	*	H	α-helix	trans	-65	-43.6	176.7	-68.5	167.1	0	0	0	110.8	S603 N604 V610 Q611	S603-I607 WeakPolarHBondContact O-CG1 3.38Å; S603-I607 PolarHBondContact O-N 3.08Å; N604-I607 PolarHBondContact O-N 3.01Å; I607-V610 PolarHBondContact O-N 2.92Å; I607-Q611 WeakPolarHBondContact O-CG 3.33Å; I607-Q611 PolarHBondContact O-N 3.39Å
608	Q	53	Low	47.5	Very low	132 Å²	132	119.8 Å²	119.8	62%	0.617	59%	0.593	S	S	*	*	H	α-helix	trans	-62.2	-44.5	174.9	-69.6	-167.8	11.1	0	0	112	N604 V605 V610 Q611 Q612	N604-Q608 PolarHBondContact O-N 3.19Å; V605-Q608 PolarHBondContact O-N 3.44Å; Q608-V610 PolarHBondContact O-N 3.16Å; Q608-Q611 PolarHBondContact O-N 3.16Å; Q608-Q611 VanDerWaalsContact O-N 3.14Å; Q608-Q612 PolarHBondContact O-N 3.3Å
609	H	50.3	Low	48.2	Very low	99 Å²	99	122.2 Å²	122.2	46%	0.458	59%	0.589	S	S	.	*	H	α-helix	trans	-57.5	-47.4	175.2	-97.2	87.6	0	0	0	112.6	V605 L606 Q611 Q612 Q613	V605-H609 PolarHBondContact O-N 2.86Å; V605-H609 PolarHBondContact O-ND1 3.03Å; L606-H609 PolarHBondContact O-N 3.04Å; H609-Q611 VanDerWaalsContact C-N 3.27Å; H609-Q611 PolarHBondContact O-N 3.42Å; H609-Q612 PolarHBondContact O-N 2.8Å; H609-Q613 WeakPolarHBondContact O-CB 3.4Å; H609-Q613 WeakPolarHBondContact O-CG 3.4Å; H609-Q613 PolarHBondContact O-N 3.37Å
610	V	57.5	Low	48.7	Very low	60 Å²	60	123.3 Å²	123.3	36%	0.364	59%	0.588	S	S	.	*	H	α-helix	trans	-63.4	-33.3	177.4	169.9	0	0	0	0	111.7	L606 I607 Q608 K614	L606-V610 WeakPolarHBondContact O-CG2 3.25Å; L606-V610 PolarHBondContact O-N 3.4Å; I607-V610 PolarHBondContact O-N 2.92Å; Q608-V610 PolarHBondContact O-N 3.16Å; V610-K614 HydrophobicContact CG1-CD 4.36Å; V610-K614 WeakPolarHBondContact O-CB 3.19Å; V610-K614 WeakPolarHBondContact O-CG 3.31Å; V610-K614 PolarHBondContact O-N 3.19Å; V610-K614 VanDerWaalsContact O-N 3.16Å
611	Q	58.9	Low	49.2	Very low	110 Å²	110	121.4 Å²	121.4	51%	0.514	58%	0.575	S	S	.	*	H	α-helix	trans	-73.5	-39.7	175.1	-71.1	-167.3	49.2	0	0	113.2	I607 Q608 H609 K614 R615	I607-Q611 WeakPolarHBondContact O-CG 3.33Å; I607-Q611 PolarHBondContact O-N 3.39Å; Q608-Q611 PolarHBondContact O-N 3.16Å; Q608-Q611 VanDerWaalsContact O-N 3.14Å; H609-Q611 VanDerWaalsContact C-N 3.27Å; H609-Q611 PolarHBondContact O-N 3.42Å; Q611-K614 PolarHBondContact O-N 2.86Å; Q611-R615 WeakPolarHBondContact O-CG 3.49Å; Q611-R615 PolarHBondContact O-N 3.1Å; Q611-R615 VanDerWaalsContact O-N 3.16Å
612	Q	58.4	Low	48.8	Very low	113 Å²	113	116.6 Å²	116.6	53%	0.528	57%	0.567	S	S	.	*	H	α-helix	trans	-64.8	-45.4	173	-77.5	-173.6	-9.6	0	0	111.7	Q608 H609 K614 R615 N616	Q608-Q612 PolarHBondContact O-N 3.3Å; H609-Q612 PolarHBondContact O-N 2.8Å; Q612-K614 VanDerWaalsContact C-N 3.28Å; Q612-K614 PolarHBondContact O-N 3.02Å; Q612-R615 WeakPolarHBondContact O-CA 3.43Å; Q612-R615 WeakPolarHBondContact O-CB 3.19Å; Q612-R615 PolarHBondContact O-N 3.24Å; Q612-N616 PolarHBondContact O-N 3.27Å
613	Q	58.1	Low	48.5	Very low	65 Å²	65	117 Å²	117	30%	0.304	57%	0.568	S	S	.	*	H	α-helix	trans	-57.3	-40.5	175.3	-71.9	178.7	13.1	0	0	112	N245 H609 R615 N616 R617	N245-Q613 PolarHBondContact ND2-NE2 3.21Å; H609-Q613 WeakPolarHBondContact O-CB 3.4Å; H609-Q613 WeakPolarHBondContact O-CG 3.4Å; H609-Q613 PolarHBondContact O-N 3.37Å; Q613-R615 VanDerWaalsContact C-N 3.3Å; Q613-R615 PolarHBondContact O-N 3.14Å; Q613-N616 PolarHBondContact O-N 2.84Å; Q613-R617 WeakPolarHBondContact O-CB 3.49Å; Q613-R617 WeakPolarHBondContact O-CG 3.45Å; Q613-R617 PolarHBondContact O-N 3.47Å
614	K	52.6	Low	48.1	Very low	153 Å²	153	120.7 Å²	120.7	67%	0.665	58%	0.576	S	S	*	*	H	α-helix	trans	-66.1	-24.7	173.6	-78	173.7	179.5	171.6	0	113.9	V610 Q611 Q612	V610-K614 HydrophobicContact CG1-CD 4.36Å; V610-K614 WeakPolarHBondContact O-CB 3.19Å; V610-K614 WeakPolarHBondContact O-CG 3.31Å; V610-K614 PolarHBondContact O-N 3.19Å; V610-K614 VanDerWaalsContact O-N 3.16Å; Q611-K614 PolarHBondContact O-N 2.86Å; Q612-K614 VanDerWaalsContact C-N 3.28Å; Q612-K614 PolarHBondContact O-N 3.02Å
615	R	46.9	Very low	48	Very low	159 Å²	159	123.8 Å²	123.8	60%	0.6	59%	0.588	S	S	*	*	H	α-helix	trans	-80.1	-43.5	172.9	-67.7	169	88	128.1	-5	111	Q611 Q612 Q613 K618	Q611-R615 WeakPolarHBondContact O-CG 3.49Å; Q611-R615 PolarHBondContact O-N 3.1Å; Q611-R615 VanDerWaalsContact O-N 3.16Å; Q612-R615 WeakPolarHBondContact O-CA 3.43Å; Q612-R615 WeakPolarHBondContact O-CB 3.19Å; Q612-R615 PolarHBondContact O-N 3.24Å; Q613-R615 VanDerWaalsContact C-N 3.3Å; Q613-R615 PolarHBondContact O-N 3.14Å; R615-K618 PolarHBondContact O-N 2.91Å
616	N	45.4	Very low	47	Very low	102 Å²	102	125.2 Å²	125.2	55%	0.545	60%	0.596	S	S	.	*	H	α-helix	trans	-67.3	-42.5	-177.6	-67.4	-6.4	0	0	0	112.5	Q612 Q613 K618 R619 R620	Q612-N616 PolarHBondContact O-N 3.27Å; Q613-N616 PolarHBondContact O-N 2.84Å; N616-K618 PolarHBondContact O-N 3.08Å; N616-R619 PolarHBondContact O-N 3.25Å; N616-R620 PolarHBondContact O-N 3.18Å
617	R	47.9	Very low	46.1	Very low	148 Å²	148	128 Å²	128	56%	0.558	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.8	-22.4	173.8	-74.4	-179.5	-179.8	-170.4	-0.8	113.7	Q613	Q613-R617 WeakPolarHBondContact O-CB 3.49Å; Q613-R617 WeakPolarHBondContact O-CG 3.45Å; Q613-R617 PolarHBondContact O-N 3.47Å
618	K	44.7	Very low	45.2	Very low	181 Å²	181	132.4 Å²	132.4	79%	0.787	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.7	-11.8	-179.7	-155.7	162.4	-171.5	166.9	0	114.5	R615 N616	R615-K618 PolarHBondContact O-N 2.91Å; N616-K618 PolarHBondContact O-N 3.08Å
619	R	42	Very low	44.3	Very low	222 Å²	222	132.7 Å²	132.7	84%	0.838	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.7	-39.6	173.5	-79.7	-177.8	162.9	174.4	-7.9	112.7	N616 S621	N616-R619 PolarHBondContact O-N 3.25Å; R619-S621 PolarHBondContact O-N 2.94Å
620	R	46.7	Very low	43.5	Very low	206 Å²	206	135.1 Å²	135.1	78%	0.777	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.3	30.3	-176.1	-146.4	-179.9	-164.2	-176.3	5.8	115	N616	N616-R620 PolarHBondContact O-N 3.18Å
621	S	42.2	Very low	42.3	Very low	73 Å²	73	137.4 Å²	137.4	51%	0.51	66%	0.662	S	S	.	*	T	Hydrogen-bonded Turn	trans	-127.9	10.6	-169.9	-77.7	0	0	0	0	114.3	R619 K647	R619-S621 PolarHBondContact O-N 2.94Å; S621-K647 PolarHBondContact O-NZ 3.05Å
622	G	33.4	Very low	41.1	Very low	67 Å²	67	141.2 Å²	141.2	69%	0.691	68%	0.677	S	S	*	*	S	Bend	trans	-131	16.3	-162.8	0	0	0	0	0	117.1
623	I	32.7	Very low	39.9	Very low	103 Å²	103	142.7 Å²	142.7	53%	0.528	69%	0.689	S	S	.	*			trans	-133.1	128.2	170.1	-112.3	106.8	0	0	0	109.3	I427	I427-I623 HydrophobicContact CB-CD1 3.96Å; I427-I623 HydrophobicContact CB-CG1 3.96Å; I427-I623 HydrophobicContact CB-CG2 4.22Å; I427-I623 HydrophobicContact CD1-CG2 4.36Å; I427-I623 HydrophobicContact CG2-CG2 4.2Å; I427-I623 WeakPolarHBondContact O-CG1 3.34Å
624	H	39.4	Very low	38.8	Very low	159 Å²	159	144 Å²	144	74%	0.736	71%	0.705	S	S	*	*			trans	-168.6	132.1	165	-139.5	-108.3	0	0	0	109.6
625	Q	40.5	Very low	37.9	Very low	149 Å²	149	139.8 Å²	139.8	70%	0.696	71%	0.705	S	S	*	*			trans	45	101.3	158.3	-70.6	168.2	-38.8	0	0	118.1
626	V	31.5	Very low	37.4	Very low	116 Å²	116	136.1 Å²	136.1	70%	0.703	70%	0.7	S	S	*	*			trans	-65.1	120.5	132.9	176	0	0	0	0	107.1
627	F	32.9	Very low	36.9	Very low	179 Å²	179	135.2 Å²	135.2	79%	0.785	70%	0.695	S	S	*	*			trans	-164.3	147.8	148.1	-90	-59.3	0	0	0	107.7
628	E	34.1	Very low	36.2	Very low	184 Å²	184	136.8 Å²	136.8	86%	0.86	71%	0.706	S	S	*	*			trans	-85.7	176.9	-171.8	-64.2	-174.9	113.4	0	0	112.8
629	N	33.3	Very low	35.7	Very low	138 Å²	138	137.7 Å²	137.7	74%	0.738	71%	0.706	S	S	*	*			trans	-75.1	150.5	-171.3	-40.2	-77.9	0	0	0	111.8
630	D	34.3	Very low	35.6	Very low	151 Å²	151	134 Å²	134	81%	0.807	70%	0.703	S	S	*	*				-173.3	157.2	99.8	-96.5	-24.1	0	0	0	115.6
631	C	32.3	Very low	34.7	Very low	108 Å²	108	127.8 Å²	127.8	73%	0.73	70%	0.702	S	S	*	*			trans	49.8	93.4	153.5	-63.2	0	0	0	0	122.1
632	F	34.7	Very low	34.6	Very low	189 Å²	189	129 Å²	129	83%	0.829	70%	0.702	S	S	*	*				21	136.8	124.1	-73.5	-87.5	0	0	0	122.8
633	N	33	Very low	35	Very low	145 Å²	145	131 Å²	131	78%	0.775	70%	0.701	S	S	*	*			trans	63	148.4	143.3	-68.6	2.2	0	0	0	118.8
634	S	34.8	Very low	35.8	Very low	93 Å²	93	132 Å²	132	65%	0.65	71%	0.712	S	S	*	*			cis	-157	146.9	-10.4	-96.8	0	0	0	0	108.1	M939	S634-M939 VanDerWaalsContact O-CE 3.31Å; S634-M939 WeakPolarHBondContact O-CE 3.3Å
635	G	32.5	Very low	35.9	Very low	63 Å²	63	132 Å²	132	65%	0.649	71%	0.706	S	S	*	*			trans	168.3	116.2	175.7	0	0	0	0	0	113.2
636	T	36.6	Very low	36.1	Very low	82 Å²	82	133.9 Å²	133.9	50%	0.503	72%	0.715	S	S	.	*			trans	-60.8	144.1	176.6	46.4	0	0	0	0	113.5	L935	T636-L935 HydrophobicContact CG2-CD2 4.3Å; T636-L935 WeakPolarHBondContact OG1-CD2 3.45Å
637	N	35.5	Very low	37	Very low	83 Å²	83	136.1 Å²	136.1	44%	0.444	72%	0.715	S	S	.	*				-155.7	159.8	124.7	-93.9	-12.5	0	0	0	110.6	E932	N637-E932 WeakPolarHBondContact CB-OE1 3.39Å; N637-E932 PolarHBondContact ND2-OE1 3.23Å; N637-E932 VanDerWaalsContact ND2-OE1 3.15Å; N637-E932 PolarHBondContact ND2-OE2 3.24Å
638	F	34.1	Very low	37.9	Very low	182 Å²	182	139.1 Å²	139.1	80%	0.798	72%	0.721	S	S	*	*			trans	-98.2	120.7	-168.4	-102.6	-119.6	0	0	0	111.2
639	Y	32.4	Very low	39	Very low	200 Å²	200	139.4 Å²	139.4	78%	0.784	72%	0.724	S	S	*	*	S	Bend	trans	167.9	155.4	136	-103.3	-85.5	0	0	0	108.7
640	L	40.8	Very low	40.7	Very low	145 Å²	145	143.1 Å²	143.1	76%	0.759	73%	0.728	S	S	*	*			trans	55.4	66.9	176	-110.7	70.3	0	0	0	117.1	I642	L640-I642 PolarHBondContact O-N 2.95Å
641	G	27.1	Very low	42.7	Very low	75 Å²	75	141.4 Å²	141.4	77%	0.773	72%	0.723	S	S	*	*			trans	-65.5	77.7	174.9	0	0	0	0	0	115.7
642	I	41.4	Very low	45.2	Very low	98 Å²	98	141.8 Å²	141.8	50%	0.503	73%	0.727	S	S	.	*			trans	-101.3	60.6	169.7	-43.9	-177	0	0	0	110.3	L640 T644	L640-I642 PolarHBondContact O-N 2.95Å; I642-T644 PolarHBondContact O-N 3.12Å; I642-T644 VanDerWaalsContact O-N 3.11Å
643	T	40.3	Very low	48	Very low	108 Å²	108	135 Å²	135	66%	0.663	70%	0.697	S	S	*	*			trans	-60.7	118	173.2	50.9	0	0	0	0	110.7	R645	T643-R645 PolarHBondContact O-N 3.36Å
644	T	50.3	Low	50.8	Low	126 Å²	126	135.8 Å²	135.8	77%	0.773	69%	0.694	S	S	*	*			trans	-79.5	95.1	175.6	37.9	0	0	0	0	108.8	I642 Q646	I642-T644 PolarHBondContact O-N 3.12Å; I642-T644 VanDerWaalsContact O-N 3.11Å; T644-Q646 PolarHBondContact O-N 3.47Å
645	R	40.7	Very low	53.6	Low	157 Å²	157	137.7 Å²	137.7	59%	0.592	69%	0.692	S	S	*	*			trans	-54	112	174.5	-74	-168.4	-179	-170.2	4.7	110	S147 T643 K647	S147-R645 VanDerWaalsContact C-NH2 3.31Å; S147-R645 PolarHBondContact O-NH2 2.92Å; S147-R645 PolarHBondContact OG-NH2 3.38Å; T643-R645 PolarHBondContact O-N 3.36Å; R645-K647 PolarHBondContact O-N 3.46Å
646	Q	46.2	Very low	56.5	Low	190 Å²	190	140 Å²	140	89%	0.888	69%	0.686	S	S	*	*	P	Polyproline II helix	trans	-52.3	123.9	172.1	-71.5	173.6	-24.8	0	0	109.4	T644 R648	T644-Q646 PolarHBondContact O-N 3.47Å; Q646-R648 PolarHBondContact O-N 3.44Å
647	K	50.4	Low	59.3	Low	162 Å²	162	137.3 Å²	137.3	70%	0.704	67%	0.667	S	S	*	*	P	Polyproline II helix	trans	-73.9	126.4	170.4	-75	172.8	-178.4	160.4	0	107.6	S621 R645 M649	S621-K647 PolarHBondContact O-NZ 3.05Å; R645-K647 PolarHBondContact O-N 3.46Å; K647-M649 PolarHBondContact O-N 3.18Å
648	R	51.9	Low	62.2	Low	243 Å²	243	135.9 Å²	135.9	92%	0.917	66%	0.659	S	S	*	*	P	Polyproline II helix	trans	-51.9	128.8	167.4	-81.5	-176.8	-85.2	169	-9.2	109.3	Q646 R650	Q646-R648 PolarHBondContact O-N 3.44Å; R648-R650 PolarHBondContact O-N 3.3Å
649	M	56.3	Low	65.1	Low	189 Å²	189	134.8 Å²	134.8	93%	0.931	65%	0.65	S	S	*	*	P	Polyproline II helix	trans	-53.9	137	172.4	-65.1	-178.6	-178.5	0	0	109.4	K647	K647-M649 PolarHBondContact O-N 3.18Å
650	R	69.1	Low	68.1	Low	217 Å²	217	126.6 Å²	126.6	82%	0.819	62%	0.621	S	S	*	*			trans	-104.8	125.5	179.5	-176.3	-178.5	-179.1	120.8	8.6	108.9	R648 S652	R648-R650 PolarHBondContact O-N 3.3Å; R650-S652 PolarHBondContact O-N 3.08Å
651	T	76.4	Confident	70.8	Confident	115 Å²	115	119.7 Å²	119.7	71%	0.706	59%	0.585	S	S	*	*			trans	-57.1	125.9	170.7	46.2	0	0	0	0	110.5
652	S	85.6	Confident	74	Confident	115 Å²	115	122.1 Å²	122.1	80%	0.804	57%	0.574	S	S	*	*			trans	-89.3	154.5	171	-163.8	0	0	0	0	110.1	R650	R650-S652 PolarHBondContact O-N 3.08Å
653	F	91.7	Very high	76.6	Confident	48 Å²	48	120.1 Å²	120.1	21%	0.211	57%	0.572	C	S	.	*			trans	-108.9	136.8	176.4	-64.6	-73.6	0	0	0	109.1	L658 M661 L685 V689 W693	F653-L658 HydrophobicContact CB-CD1 4.14Å; F653-L658 HydrophobicContact CB-CD2 3.75Å; F653-L658 HydrophobicContact CB-CG 3.67Å; F653-L658 HydrophobicContact CD2-CD2 4.06Å; F653-L658 HydrophobicContact CG-CD2 4.14Å; F653-M661 HydrophobicContact CD1-CE 4.07Å; F653-M661 HydrophobicContact CE1-CE 4.41Å; F653-M661 HydrophobicContact CG-CE 4.29Å; F653-L685 HydrophobicContact CD1-CD1 3.73Å; F653-L685 HydrophobicContact CD1-CD2 4.11Å; F653-L685 HydrophobicContact CE1-CD1 3.82Å; F653-L685 HydrophobicContact CE1-CD2 4.18Å; F653-V689 HydrophobicContact CE1-CG1 3.64Å; F653-V689 HydrophobicContact CZ-CG1 4.04Å; F653-W693 AromaticContact CE2-CD1 3.78Å; F653-W693 AromaticContact CZ-CD1 3.9Å
654	K	92.9	Very high	79.2	Confident	161 Å²	161	117.1 Å²	117.1	70%	0.7	55%	0.549	S	S	*	.			trans	-63	150.2	174.3	-64.6	-171.7	177.3	-174.1	0	110	H656 Q657 L658	K654-H656 VanDerWaalsContact C-N 3.29Å; K654-H656 PolarHBondContact O-N 3.43Å; K654-Q657 HydrophobicContact CB-CG 4.18Å; K654-Q657 WeakPolarHBondContact O-CB 3.37Å; K654-Q657 PolarHBondContact O-N 3.04Å; K654-Q657 VanDerWaalsContact O-N 3.08Å; K654-L658 PolarHBondContact O-N 3.25Å; K654-L658 VanDerWaalsContact O-N 3.14Å
655	H	92.7	Very high	81.4	Confident	132 Å²	132	112.2 Å²	112.2	61%	0.611	52%	0.517	S	S	*	.	H	α-helix	trans	-56.1	-42.7	-176.4	-172	118.3	0	0	0	112.2	Q657 L658 R659	H655-Q657 PolarHBondContact O-N 3.04Å; H655-L658 PolarHBondContact O-N 3.36Å; H655-R659 PolarHBondContact CD2-NH2 3.48Å; H655-R659 VanDerWaalsContact CD2-NH2 3.3Å; H655-R659 PolarHBondContact NE2-NH2 2.88Å; H655-R659 PolarHBondContact O-N 3.27Å
656	H	94.5	Very high	83.9	Confident	111 Å²	111	111.1 Å²	111.1	51%	0.514	52%	0.523	S	S	.	.	H	α-helix	trans	-51.2	-54.5	173.3	173.1	57.4	0	0	0	112.2	K654 L658 R659 T660 K682	K654-H656 VanDerWaalsContact C-N 3.29Å; K654-H656 PolarHBondContact O-N 3.43Å; H656-L658 VanDerWaalsContact C-N 3.29Å; H656-L658 PolarHBondContact O-N 3.21Å; H656-R659 WeakPolarHBondContact O-CA 3.29Å; H656-R659 WeakPolarHBondContact O-CB 3.5Å; H656-R659 PolarHBondContact O-N 3.37Å; H656-T660 PolarHBondContact CE1-OG1 2.56Å; H656-T660 PolarHBondContact O-N 3.06Å; H656-T660 PolarHBondContact O-OG1 3.13Å; H656-K682 PolarHBondContact NE2-O 3.16Å
657	Q	95.6	Very high	86.1	Confident	26 Å²	26	108.9 Å²	108.9	12%	0.121	52%	0.516	C	S	.	.	H	α-helix	trans	-56.8	-42.9	-179.9	-58	173.6	-38.3	0	0	111.6	K654 H655 R659 M661 T683 L685	K654-Q657 HydrophobicContact CB-CG 4.18Å; K654-Q657 WeakPolarHBondContact O-CB 3.37Å; K654-Q657 PolarHBondContact O-N 3.04Å; K654-Q657 VanDerWaalsContact O-N 3.08Å; H655-Q657 PolarHBondContact O-N 3.04Å; Q657-R659 VanDerWaalsContact C-N 3.35Å; Q657-M661 HydrophobicContact CB-CE 4.11Å; Q657-M661 WeakPolarHBondContact O-CB 3.34Å; Q657-M661 VanDerWaalsContact O-CE 3.27Å; Q657-M661 WeakPolarHBondContact O-CE 3.34Å; Q657-M661 VanDerWaalsContact O-CG 3.31Å; Q657-M661 WeakPolarHBondContact O-CG 3.49Å; Q657-M661 PolarHBondContact O-N 3.28Å; Q657-T683 WeakPolarHBondContact CG-O 3.48Å; Q657-T683 PolarHBondContact NE2-O 3.11Å; Q657-L685 HydrophobicContact CB-CD1 4.08Å; Q657-L685 HydrophobicContact CG-CD1 4.38Å; Q657-L685 HydrophobicContact CG-CG 4.46Å
658	L	95.6	Very high	88.1	Confident	53 Å²	53	103.5 Å²	103.5	28%	0.277	50%	0.495	S	S	.	.	H	α-helix	trans	-66.7	-33.4	175.7	-69.8	174.1	0	0	0	113	F653 K654 H655 H656 M661 K662	F653-L658 HydrophobicContact CB-CD1 4.14Å; F653-L658 HydrophobicContact CB-CD2 3.75Å; F653-L658 HydrophobicContact CB-CG 3.67Å; F653-L658 HydrophobicContact CD2-CD2 4.06Å; F653-L658 HydrophobicContact CG-CD2 4.14Å; K654-L658 PolarHBondContact O-N 3.25Å; K654-L658 VanDerWaalsContact O-N 3.14Å; H655-L658 PolarHBondContact O-N 3.36Å; H656-L658 VanDerWaalsContact C-N 3.29Å; H656-L658 PolarHBondContact O-N 3.21Å; L658-M661 HydrophobicContact CD2-CE 4.19Å; L658-K662 VanDerWaalsContact O-CB 3.3Å; L658-K662 WeakPolarHBondContact O-CB 3.38Å; L658-K662 WeakPolarHBondContact O-CD 3.34Å; L658-K662 WeakPolarHBondContact O-CG 3.47Å; L658-K662 PolarHBondContact O-N 3.22Å; L658-K662 VanDerWaalsContact O-N 3.12Å
659	R	95.6	Very high	90	Very high	159 Å²	159	95 Å²	95	60%	0.6	47%	0.465	S	S	*	.	H	α-helix	trans	-68.4	-51.1	176.4	-165.8	-178.1	-65.1	173.1	-2.3	110.3	H655 H656 Q657 K662 A663	H655-R659 PolarHBondContact CD2-NH2 3.48Å; H655-R659 VanDerWaalsContact CD2-NH2 3.3Å; H655-R659 PolarHBondContact NE2-NH2 2.88Å; H655-R659 PolarHBondContact O-N 3.27Å; H656-R659 WeakPolarHBondContact O-CA 3.29Å; H656-R659 WeakPolarHBondContact O-CB 3.5Å; H656-R659 PolarHBondContact O-N 3.37Å; Q657-R659 VanDerWaalsContact C-N 3.35Å; R659-K662 PolarHBondContact O-N 3.26Å; R659-A663 WeakPolarHBondContact O-CB 3.36Å; R659-A663 PolarHBondContact O-N 3.46Å
660	T	95.3	Very high	91.8	Very high	29 Å²	29	90.8 Å²	90.8	18%	0.178	45%	0.446	C	S	.	.	H	α-helix	trans	-59.4	-48.4	177.2	-47.3	0	0	0	0	112.2	H656 K662 A663 Y664 L679 K682 T683	H656-T660 PolarHBondContact CE1-OG1 2.56Å; H656-T660 PolarHBondContact O-N 3.06Å; H656-T660 PolarHBondContact O-OG1 3.13Å; T660-K662 PolarHBondContact O-N 2.88Å; T660-A663 PolarHBondContact O-N 3.04Å; T660-Y664 PolarHBondContact O-N 2.96Å; T660-L679 HydrophobicContact CG2-CD2 4.11Å; T660-K682 HydrophobicContact CG2-CB 4.13Å; T660-T683 HydrophobicContact CG2-CG2 3.93Å
661	M	96.6	Very high	93	Very high	0 Å²	0	81.2 Å²	81.2	0%	0	41%	0.413	C	S	.	.	H	α-helix	trans	-64.7	-37.9	179.9	-72.4	-174.3	-74.3	0	0	112.7	F653 Q657 L658 F665 T683 L685 L690 W693	F653-M661 HydrophobicContact CD1-CE 4.07Å; F653-M661 HydrophobicContact CE1-CE 4.41Å; F653-M661 HydrophobicContact CG-CE 4.29Å; Q657-M661 HydrophobicContact CB-CE 4.11Å; Q657-M661 WeakPolarHBondContact O-CB 3.34Å; Q657-M661 VanDerWaalsContact O-CE 3.27Å; Q657-M661 WeakPolarHBondContact O-CE 3.34Å; Q657-M661 VanDerWaalsContact O-CG 3.31Å; Q657-M661 WeakPolarHBondContact O-CG 3.49Å; Q657-M661 PolarHBondContact O-N 3.28Å; L658-M661 HydrophobicContact CD2-CE 4.19Å; M661-F665 VanDerWaalsContact O-CB 3.25Å; M661-F665 WeakPolarHBondContact O-CB 3.39Å; M661-F665 PolarHBondContact O-N 3.42Å; M661-T683 HydrophobicContact CG-CG2 4.41Å; M661-L685 HydrophobicContact CE-CD1 3.59Å; M661-L685 HydrophobicContact SD-CD1 3.85Å; M661-L690 HydrophobicContact CG-CD2 3.94Å; M661-L690 HydrophobicContact SD-CD2 3.56Å; M661-L690 VanDerWaalsContact SD-CD2 3.56Å; M661-W693 HydrophobicContact CB-CD2 4.11Å; M661-W693 HydrophobicContact CB-CE3 4.05Å; M661-W693 HydrophobicContact CB-CH2 3.67Å; M661-W693 HydrophobicContact CB-CZ2 3.69Å; M661-W693 HydrophobicContact CB-CZ3 3.84Å; M661-W693 HydrophobicContact CE-CD2 4.39Å; M661-W693 HydrophobicContact CE-CG 4.24Å; M661-W693 HydrophobicContact CG-CD2 4.44Å; M661-W693 HydrophobicContact SD-CB 4.1Å; M661-W693 HydrophobicContact SD-CD2 3.63Å; M661-W693 HydrophobicContact SD-CE3 4.19Å; M661-W693 HydrophobicContact SD-CG 3.56Å; M661-W693 VanDerWaalsContact SD-CG 3.56Å
662	K	95.9	Very high	93.8	Very high	126 Å²	126	79.6 Å²	79.6	55%	0.548	40%	0.4	S	S	.	.	H	α-helix	trans	-68.5	-44.2	174.6	-75.4	171.8	-174.9	177.5	0	112.5	L658 R659 T660 Y664 F665 N666 W693	L658-K662 VanDerWaalsContact O-CB 3.3Å; L658-K662 WeakPolarHBondContact O-CB 3.38Å; L658-K662 WeakPolarHBondContact O-CD 3.34Å; L658-K662 WeakPolarHBondContact O-CG 3.47Å; L658-K662 PolarHBondContact O-N 3.22Å; L658-K662 VanDerWaalsContact O-N 3.12Å; R659-K662 PolarHBondContact O-N 3.26Å; T660-K662 PolarHBondContact O-N 2.88Å; K662-Y664 VanDerWaalsContact C-N 3.33Å; K662-Y664 PolarHBondContact O-N 3.14Å; K662-F665 WeakPolarHBondContact O-CB 3.49Å; K662-F665 PolarHBondContact O-N 3.19Å; K662-F665 VanDerWaalsContact O-N 3.15Å; K662-N666 PolarHBondContact O-N 3.24Å; K662-N666 PolarHBondContact O-OD1 2.88Å; K662-W693 HydrophobicContact CG-CH2 4.38Å; K662-W693 HydrophobicContact CG-CZ2 4.37Å
663	A	95.3	Very high	94.2	Very high	56 Å²	56	78.3 Å²	78.3	46%	0.463	39%	0.386	S	S	.	.	H	α-helix	trans	-59.7	-46.7	179.4	0	0	0	0	0	110.7	R659 T660 N666	R659-A663 WeakPolarHBondContact O-CB 3.36Å; R659-A663 PolarHBondContact O-N 3.46Å; T660-A663 PolarHBondContact O-N 3.04Å; A663-N666 PolarHBondContact O-N 3.5Å
664	Y	95.5	Very high	94.3	Very high	44 Å²	44	83.9 Å²	83.9	17%	0.173	41%	0.411	C	S	.	.	H	α-helix	trans	-64.2	-41	173.4	-170.2	-76.7	0	0	0	112.1	T660 K662 N666 I667 N668 P671 D675 L679 F694	T660-Y664 PolarHBondContact O-N 2.96Å; K662-Y664 VanDerWaalsContact C-N 3.33Å; K662-Y664 PolarHBondContact O-N 3.14Å; Y664-N666 PolarHBondContact O-N 2.93Å; Y664-I667 PolarHBondContact O-N 3.02Å; Y664-N668 HydrophobicContact CE1-CB 3.65Å; Y664-N668 WeakPolarHBondContact CE1-O 3.41Å; Y664-N668 PolarHBondContact O-N 3.4Å; Y664-N668 PolarHBondContact OH-ND2 2.89Å; Y664-P671 HydrophobicContact CD1-CB 4.41Å; Y664-P671 HydrophobicContact CE1-CB 3.69Å; Y664-P671 HydrophobicContact CE1-CG 4.41Å; Y664-D675 HydrophobicContact CE1-CB 4.45Å; Y664-D675 HydrophobicContact CE2-CB 4.05Å; Y664-D675 WeakPolarHBondContact CE2-OD1 3.35Å; Y664-D675 WeakPolarHBondContact OH-CB 3.13Å; Y664-D675 PolarHBondContact OH-OD1 2.9Å; Y664-D675 PolarHBondContact OH-OD2 3.29Å; Y664-L679 HydrophobicContact CD1-CD1 3.96Å; Y664-L679 HydrophobicContact CD2-CD1 4.24Å; Y664-L679 HydrophobicContact CD2-CD2 4.26Å; Y664-L679 HydrophobicContact CD2-CG 4.42Å; Y664-L679 HydrophobicContact CE1-CD1 4.41Å; Y664-L679 HydrophobicContact CG-CD1 3.91Å; Y664-L679 HydrophobicContact CG-CD2 4.07Å; Y664-L679 HydrophobicContact CG-CG 4.4Å; Y664-F694 AromaticContact CD1-CE1 3.85Å; Y664-F694 HydrophobicContact CD1-CE1 3.85Å; Y664-F694 AromaticContact CD1-CZ 3.71Å; Y664-F694 HydrophobicContact CD1-CZ 3.71Å; Y664-F694 HydrophobicContact CE1-CE1 4.46Å; Y664-F694 HydrophobicContact CG-CZ 4.43Å
665	F	96.1	Very high	94.4	Very high	24 Å²	24	78.4 Å²	78.4	11%	0.105	39%	0.389	C	S	.	.	H	α-helix	trans	-59.1	-28.2	177.5	-171.7	-86.8	0	0	0	113.3	M661 K662 I667 H669 W693 F694 A697 R698	M661-F665 VanDerWaalsContact O-CB 3.25Å; M661-F665 WeakPolarHBondContact O-CB 3.39Å; M661-F665 PolarHBondContact O-N 3.42Å; K662-F665 WeakPolarHBondContact O-CB 3.49Å; K662-F665 PolarHBondContact O-N 3.19Å; K662-F665 VanDerWaalsContact O-N 3.15Å; F665-I667 VanDerWaalsContact C-N 3.31Å; F665-H669 PolarHBondContact O-CD2 2.96Å; F665-W693 HydrophobicContact CB-CH2 4.21Å; F665-W693 HydrophobicContact CB-CZ3 4.07Å; F665-W693 HydrophobicContact CD2-CZ3 4Å; F665-W693 HydrophobicContact CG-CZ3 4.31Å; F665-F694 HydrophobicContact CB-CE1 4.05Å; F665-F694 AromaticContact CD2-CD1 3.76Å; F665-F694 HydrophobicContact CD2-CD1 3.76Å; F665-F694 AromaticContact CD2-CE1 3.82Å; F665-F694 HydrophobicContact CD2-CE1 3.82Å; F665-F694 HydrophobicContact CE2-CD1 4.43Å; F665-F694 HydrophobicContact CG-CE1 4.44Å; F665-A697 HydrophobicContact CD2-CB 3.69Å; F665-A697 HydrophobicContact CE2-CB 3.37Å; F665-A697 HydrophobicContact CZ-CB 4Å; F665-R698 HydrophobicContact CE2-CG 3.98Å; F665-R698 HydrophobicContact CZ-CG 4.35Å
666	N	92.8	Very high	94.4	Very high	133 Å²	133	72.6 Å²	72.6	71%	0.711	36%	0.362	S	S	*	.	H	α-helix	trans	-77.2	-16.5	174.9	-70	4.7	0	0	0	113.5	K662 A663 Y664	K662-N666 PolarHBondContact O-N 3.24Å; K662-N666 PolarHBondContact O-OD1 2.88Å; A663-N666 PolarHBondContact O-N 3.5Å; Y664-N666 PolarHBondContact O-N 2.93Å
667	I	92.2	Very high	94.5	Very high	143 Å²	143	73.8 Å²	73.8	73%	0.733	37%	0.366	S	S	*	.	H	α-helix	trans	-94.3	-47	178.2	-59.7	167.9	0	0	0	110	Y664 F665	Y664-I667 PolarHBondContact O-N 3.02Å; F665-I667 VanDerWaalsContact C-N 3.31Å
668	N	91.8	Very high	94.4	Very high	50 Å²	50	75.6 Å²	75.6	27%	0.267	38%	0.379	S	S	.	.			trans	-144.2	119.9	179.5	175.8	16.3	0	0	0	111.2	Y664 N670	Y664-N668 HydrophobicContact CE1-CB 3.65Å; Y664-N668 WeakPolarHBondContact CE1-O 3.41Å; Y664-N668 PolarHBondContact O-N 3.4Å; Y664-N668 PolarHBondContact OH-ND2 2.89Å; N668-N670 VanDerWaalsContact C-N 3.27Å; N668-N670 VanDerWaalsContact ND2-C 3.32Å; N668-N670 PolarHBondContact ND2-O 3.08Å; N668-N670 PolarHBondContact O-N 2.8Å; N668-N670 VanDerWaalsContact OD1-C 3.29Å; N668-N670 WeakPolarHBondContact OD1-CA 3.43Å; N668-N670 PolarHBondContact OD1-N 3.18Å; N668-N670 PolarHBondContact OD1-O 3.28Å
669	H	93.3	Very high	94.4	Very high	65 Å²	65	73.2 Å²	73.2	30%	0.301	37%	0.366	S	S	.	.	S	Bend	trans	-71	-23.7	177.3	-66.2	-173	0	0	0	112.4	F665 P671 R698 Y701	F665-H669 PolarHBondContact O-CD2 2.96Å; H669-P671 WeakPolarHBondContact O-CD 3.39Å; H669-R698 HydrophobicContact CB-CG 4.29Å; H669-R698 WeakPolarHBondContact O-CD 3.34Å; H669-R698 PolarHBondContact O-NE 3.21Å; H669-Y701 AromaticContact CE1-CE1 3.76Å; H669-Y701 AromaticContact CE1-CZ 3.67Å
670	N	94	Very high	94.4	Very high	99 Å²	99	67.8 Å²	67.8	53%	0.529	35%	0.351	S	S	.	.	S	Bend	trans	-121.9	71.7	-172.1	-69	2.1	0	0	0	111	N668 D672 R698	N668-N670 VanDerWaalsContact C-N 3.27Å; N668-N670 VanDerWaalsContact ND2-C 3.32Å; N668-N670 PolarHBondContact ND2-O 3.08Å; N668-N670 PolarHBondContact O-N 2.8Å; N668-N670 VanDerWaalsContact OD1-C 3.29Å; N668-N670 WeakPolarHBondContact OD1-CA 3.43Å; N668-N670 PolarHBondContact OD1-N 3.18Å; N668-N670 PolarHBondContact OD1-O 3.28Å; N670-D672 PolarHBondContact O-N 3.06Å; N670-R698 VanDerWaalsContact CG-NH1 3.31Å; N670-R698 WeakPolarHBondContact OD1-CD 3.3Å; N670-R698 PolarHBondContact OD1-NH1 3.07Å
671	P	92.9	Very high	94.4	Very high	17 Å²	17	71.9 Å²	71.9	11%	0.11	37%	0.368	C	S	.	.			trans	-59.8	133.4	176.3	24.4	-34.5	0	0	0	111.9	Y664 H669 D675 L676 L679 F694	Y664-P671 HydrophobicContact CD1-CB 4.41Å; Y664-P671 HydrophobicContact CE1-CB 3.69Å; Y664-P671 HydrophobicContact CE1-CG 4.41Å; H669-P671 WeakPolarHBondContact O-CD 3.39Å; P671-D675 HydrophobicContact CB-CB 3.66Å; P671-L676 HydrophobicContact CB-CG 4.32Å; P671-L676 HydrophobicContact CG-CD2 4.36Å; P671-L679 HydrophobicContact CB-CD1 4.26Å; P671-F694 HydrophobicContact CG-CB 4.26Å; P671-F694 HydrophobicContact CG-CD1 3.57Å; P671-F694 HydrophobicContact CG-CD2 3.9Å; P671-F694 HydrophobicContact CG-CE1 3.8Å; P671-F694 HydrophobicContact CG-CE2 4.13Å; P671-F694 HydrophobicContact CG-CG 3.63Å; P671-F694 HydrophobicContact CG-CZ 4.09Å
672	D	94	Very high	94.3	Very high	81 Å²	81	78.1 Å²	78.1	43%	0.433	40%	0.395	S	S	.	.			trans	-76.3	173.6	174.2	175.4	50.8	0	0	0	111.7	N670 K674 D675 L676	N670-D672 PolarHBondContact O-N 3.06Å; D672-K674 PolarHBondContact O-N 3.41Å; D672-K674 PolarHBondContact OD2-N 3.29Å; D672-D675 WeakPolarHBondContact CB-OD2 3.38Å; D672-D675 PolarHBondContact N-OD2 2.97Å; D672-D675 PolarHBondContact O-N 3.45Å; D672-L676 VanDerWaalsContact O-CB 3.32Å; D672-L676 WeakPolarHBondContact O-CB 3.45Å; D672-L676 VanDerWaalsContact O-CG 3.26Å; D672-L676 WeakPolarHBondContact O-CG 3.39Å; D672-L676 PolarHBondContact O-N 3.4Å
673	V	93.4	Very high	94.2	Very high	87 Å²	87	72.5 Å²	72.5	53%	0.527	37%	0.371	S	S	.	.	H	α-helix	trans	-46.8	-41.5	166.7	-178.6	0	0	0	0	112.6	K677	V673-K677 PolarHBondContact O-N 3.14Å
674	K	94	Very high	94.2	Very high	166 Å²	166	73.1 Å²	73.1	72%	0.722	38%	0.383	S	S	*	.	H	α-helix	trans	-66	-50.6	177.5	-66.6	176.8	-176.2	176	0	111.7	D672 L676 K677 V678	D672-K674 PolarHBondContact O-N 3.41Å; D672-K674 PolarHBondContact OD2-N 3.29Å; K674-L676 VanDerWaalsContact C-N 3.33Å; K674-L676 PolarHBondContact O-N 2.87Å; K674-K677 WeakPolarHBondContact O-CB 3.3Å; K674-K677 PolarHBondContact O-N 3.03Å; K674-K677 VanDerWaalsContact O-N 3.09Å; K674-V678 PolarHBondContact O-N 3.06Å
675	D	94.3	Very high	94.2	Very high	46 Å²	46	72 Å²	72	25%	0.246	38%	0.38	C	S	.	.	H	α-helix	trans	-61.4	-41.8	178.2	-57.8	-72.6	0	0	0	112.2	Y664 P671 D672 K677 V678 L679	Y664-D675 HydrophobicContact CE1-CB 4.45Å; Y664-D675 HydrophobicContact CE2-CB 4.05Å; Y664-D675 WeakPolarHBondContact CE2-OD1 3.35Å; Y664-D675 WeakPolarHBondContact OH-CB 3.13Å; Y664-D675 PolarHBondContact OH-OD1 2.9Å; Y664-D675 PolarHBondContact OH-OD2 3.29Å; P671-D675 HydrophobicContact CB-CB 3.66Å; D672-D675 WeakPolarHBondContact CB-OD2 3.38Å; D672-D675 PolarHBondContact N-OD2 2.97Å; D672-D675 PolarHBondContact O-N 3.45Å; D675-K677 PolarHBondContact O-N 3.17Å; D675-V678 PolarHBondContact O-N 2.9Å; D675-L679 WeakPolarHBondContact O-CB 3.45Å; D675-L679 VanDerWaalsContact O-CG 3.3Å; D675-L679 WeakPolarHBondContact O-CG 3.48Å; D675-L679 PolarHBondContact O-N 3.3Å
676	L	94.3	Very high	94.1	Very high	9 Å²	9	74.1 Å²	74.1	5%	0.047	40%	0.397	C	S	.	.	H	α-helix	trans	-60.3	-30.4	176.2	-77.2	167.9	0	0	0	112.1	P671 D672 K674 T680 K687 L690 Q691	P671-L676 HydrophobicContact CB-CG 4.32Å; P671-L676 HydrophobicContact CG-CD2 4.36Å; D672-L676 VanDerWaalsContact O-CB 3.32Å; D672-L676 WeakPolarHBondContact O-CB 3.45Å; D672-L676 VanDerWaalsContact O-CG 3.26Å; D672-L676 WeakPolarHBondContact O-CG 3.39Å; D672-L676 PolarHBondContact O-N 3.4Å; K674-L676 VanDerWaalsContact C-N 3.33Å; K674-L676 PolarHBondContact O-N 2.87Å; L676-T680 WeakPolarHBondContact O-CB 3.18Å; L676-T680 PolarHBondContact O-N 3.35Å; L676-T680 PolarHBondContact O-OG1 3.13Å; L676-K687 HydrophobicContact CB-CG 4.31Å; L676-K687 HydrophobicContact CD1-CG 4.34Å; L676-L690 HydrophobicContact CD2-CB 3.77Å; L676-Q691 HydrophobicContact CD1-CG 3.82Å; L676-Q691 HydrophobicContact CD2-CG 4.13Å
677	K	95	Very high	94.2	Very high	136 Å²	136	72.1 Å²	72.1	59%	0.591	38%	0.383	S	S	*	.	H	α-helix	trans	-69.9	-52.2	173.5	-161.8	-163.4	179.9	-134.9	0	110.9	V673 K674 D675 L679 T680 E681	V673-K677 PolarHBondContact O-N 3.14Å; K674-K677 WeakPolarHBondContact O-CB 3.3Å; K674-K677 PolarHBondContact O-N 3.03Å; K674-K677 VanDerWaalsContact O-N 3.09Å; D675-K677 PolarHBondContact O-N 3.17Å; K677-L679 VanDerWaalsContact C-N 3.25Å; K677-L679 PolarHBondContact O-N 3.42Å; K677-T680 WeakPolarHBondContact O-CA 3.4Å; K677-T680 VanDerWaalsContact O-CB 3.31Å; K677-T680 WeakPolarHBondContact O-CB 3.21Å; K677-T680 PolarHBondContact O-N 3.05Å; K677-E681 WeakPolarHBondContact CD-OE1 3.46Å; K677-E681 WeakPolarHBondContact CE-OE1 3.43Å; K677-E681 IonicContact NZ-OE1 3.63Å; K677-E681 PolarHBondContact NZ-OE1 3.13Å; K677-E681 WeakPolarHBondContact O-CG 3.45Å; K677-E681 PolarHBondContact O-N 3.07Å
678	V	94.6	Very high	94.3	Very high	64 Å²	64	74.4 Å²	74.4	39%	0.388	38%	0.382	S	S	.	.	H	α-helix	trans	-59.6	-36.7	178	178.3	0	0	0	0	111.6	K674 D675 K682	K674-V678 PolarHBondContact O-N 3.06Å; D675-V678 PolarHBondContact O-N 2.9Å; V678-K682 HydrophobicContact CG1-CD 3.94Å; V678-K682 HydrophobicContact CG1-CG 4.48Å; V678-K682 WeakPolarHBondContact O-CB 3.17Å; V678-K682 VanDerWaalsContact O-CG 3.3Å; V678-K682 WeakPolarHBondContact O-CG 3.2Å; V678-K682 PolarHBondContact O-N 3.32Å
679	L	95.3	Very high	94.5	Very high	4 Å²	4	74.5 Å²	74.5	2%	0.021	38%	0.384	C	S	.	.	H	α-helix	trans	-72.6	-33.6	174.1	-71.8	168	0	0	0	112.8	T660 Y664 P671 D675 K677 T683 L690 F694	T660-L679 HydrophobicContact CG2-CD2 4.11Å; Y664-L679 HydrophobicContact CD1-CD1 3.96Å; Y664-L679 HydrophobicContact CD2-CD1 4.24Å; Y664-L679 HydrophobicContact CD2-CD2 4.26Å; Y664-L679 HydrophobicContact CD2-CG 4.42Å; Y664-L679 HydrophobicContact CE1-CD1 4.41Å; Y664-L679 HydrophobicContact CG-CD1 3.91Å; Y664-L679 HydrophobicContact CG-CD2 4.07Å; Y664-L679 HydrophobicContact CG-CG 4.4Å; P671-L679 HydrophobicContact CB-CD1 4.26Å; D675-L679 WeakPolarHBondContact O-CB 3.45Å; D675-L679 VanDerWaalsContact O-CG 3.3Å; D675-L679 WeakPolarHBondContact O-CG 3.48Å; D675-L679 PolarHBondContact O-N 3.3Å; K677-L679 VanDerWaalsContact C-N 3.25Å; K677-L679 PolarHBondContact O-N 3.42Å; L679-T683 WeakPolarHBondContact O-CB 3.43Å; L679-T683 WeakPolarHBondContact O-CG2 3.49Å; L679-T683 PolarHBondContact O-N 2.74Å; L679-T683 VanDerWaalsContact O-N 3.13Å; L679-T683 PolarHBondContact O-OG1 3.01Å; L679-L690 HydrophobicContact CB-CD1 3.77Å; L679-L690 HydrophobicContact CB-CD2 4.47Å; L679-F694 HydrophobicContact CD1-CE2 3.87Å; L679-F694 HydrophobicContact CD1-CZ 3.94Å
680	T	96.2	Very high	94.6	Very high	44 Å²	44	71.4 Å²	71.4	27%	0.27	37%	0.37	S	S	.	.	H	α-helix	trans	-61.3	-50.7	172.5	-63.3	0	0	0	0	109.4	L676 K677 T683 G684 L685 L690	L676-T680 WeakPolarHBondContact O-CB 3.18Å; L676-T680 PolarHBondContact O-N 3.35Å; L676-T680 PolarHBondContact O-OG1 3.13Å; K677-T680 WeakPolarHBondContact O-CA 3.4Å; K677-T680 VanDerWaalsContact O-CB 3.31Å; K677-T680 WeakPolarHBondContact O-CB 3.21Å; K677-T680 PolarHBondContact O-N 3.05Å; T680-T683 PolarHBondContact O-N 2.94Å; T680-G684 WeakPolarHBondContact O-CA 3.46Å; T680-G684 PolarHBondContact O-N 3.3Å; T680-L685 WeakPolarHBondContact CA-O 3.42Å; T680-L685 WeakPolarHBondContact CG2-O 3.43Å; T680-L690 WeakPolarHBondContact OG1-CD1 3.39Å
681	E	94.9	Very high	94.7	Very high	116 Å²	116	70.2 Å²	70.2	54%	0.542	36%	0.361	S	S	.	.	H	α-helix	trans	-60.4	-50.1	178.3	-67.7	160.2	-179.6	0	0	111.4	K677 T683	K677-E681 WeakPolarHBondContact CD-OE1 3.46Å; K677-E681 WeakPolarHBondContact CE-OE1 3.43Å; K677-E681 IonicContact NZ-OE1 3.63Å; K677-E681 PolarHBondContact NZ-OE1 3.13Å; K677-E681 WeakPolarHBondContact O-CG 3.45Å; K677-E681 PolarHBondContact O-N 3.07Å; E681-T683 VanDerWaalsContact C-N 3.32Å; E681-T683 PolarHBondContact O-N 3.49Å
682	K	94.4	Very high	94.8	Very high	130 Å²	130	72.6 Å²	72.6	57%	0.565	38%	0.375	S	S	*	.	H	α-helix	trans	-71.7	-14.7	-177.8	-71.6	179.5	179.8	179.7	0	115.7	H656 T660 V678	H656-K682 PolarHBondContact NE2-O 3.16Å; T660-K682 HydrophobicContact CG2-CB 4.13Å; V678-K682 HydrophobicContact CG1-CD 3.94Å; V678-K682 HydrophobicContact CG1-CG 4.48Å; V678-K682 WeakPolarHBondContact O-CB 3.17Å; V678-K682 VanDerWaalsContact O-CG 3.3Å; V678-K682 WeakPolarHBondContact O-CG 3.2Å; V678-K682 PolarHBondContact O-N 3.32Å
683	T	94.4	Very high	94.9	Very high	9 Å²	9	70.6 Å²	70.6	6%	0.055	36%	0.362	C	S	.	.	H	α-helix	trans	-120.9	-16.7	-176.5	67	0	0	0	0	115.1	Q657 T660 M661 L679 T680 E681 L685	Q657-T683 WeakPolarHBondContact CG-O 3.48Å; Q657-T683 PolarHBondContact NE2-O 3.11Å; T660-T683 HydrophobicContact CG2-CG2 3.93Å; M661-T683 HydrophobicContact CG-CG2 4.41Å; L679-T683 WeakPolarHBondContact O-CB 3.43Å; L679-T683 WeakPolarHBondContact O-CG2 3.49Å; L679-T683 PolarHBondContact O-N 2.74Å; L679-T683 VanDerWaalsContact O-N 3.13Å; L679-T683 PolarHBondContact O-OG1 3.01Å; T680-T683 PolarHBondContact O-N 2.94Å; E681-T683 VanDerWaalsContact C-N 3.32Å; E681-T683 PolarHBondContact O-N 3.49Å; T683-L685 PolarHBondContact O-N 3.03Å; T683-L685 WeakPolarHBondContact OG1-CB 3.49Å; T683-L685 PolarHBondContact OG1-N 3.43Å
684	G	94.7	Very high	95.1	Very high	68 Å²	68	66.4 Å²	66.4	70%	0.701	34%	0.337	S	S	*	.			trans	65.7	17.8	-170.7	0	0	0	0	0	113.8	T680	T680-G684 WeakPolarHBondContact O-CA 3.46Å; T680-G684 PolarHBondContact O-N 3.3Å
685	L	94.7	Very high	95.1	Very high	21 Å²	21	64 Å²	64	11%	0.11	33%	0.328	C	S	.	.			trans	-101.6	134.4	177.3	-62.5	175.5	0	0	0	110.2	F653 Q657 M661 T680 T683 V689 L690	F653-L685 HydrophobicContact CD1-CD1 3.73Å; F653-L685 HydrophobicContact CD1-CD2 4.11Å; F653-L685 HydrophobicContact CE1-CD1 3.82Å; F653-L685 HydrophobicContact CE1-CD2 4.18Å; Q657-L685 HydrophobicContact CB-CD1 4.08Å; Q657-L685 HydrophobicContact CG-CD1 4.38Å; Q657-L685 HydrophobicContact CG-CG 4.46Å; M661-L685 HydrophobicContact CE-CD1 3.59Å; M661-L685 HydrophobicContact SD-CD1 3.85Å; T680-L685 WeakPolarHBondContact CA-O 3.42Å; T680-L685 WeakPolarHBondContact CG2-O 3.43Å; T683-L685 PolarHBondContact O-N 3.03Å; T683-L685 WeakPolarHBondContact OG1-CB 3.49Å; T683-L685 PolarHBondContact OG1-N 3.43Å; L685-V689 HydrophobicContact CB-CG1 4.33Å; L685-V689 HydrophobicContact CD1-CG1 4.47Å; L685-V689 HydrophobicContact CD2-CG1 4.3Å; L685-L690 HydrophobicContact CB-CD2 4.06Å; L685-L690 HydrophobicContact CB-CG 4.08Å; L685-L690 HydrophobicContact CD1-CD2 4.13Å
686	S	95.3	Very high	95.2	Very high	68 Å²	68	66.3 Å²	66.3	48%	0.476	34%	0.34	S	S	.	.			trans	-63.6	149.9	-179.7	72.7	0	0	0	0	112.5	R688 V689 L690	S686-R688 PolarHBondContact O-N 2.94Å; S686-V689 WeakPolarHBondContact O-CA 3.35Å; S686-V689 WeakPolarHBondContact O-CB 3.33Å; S686-V689 PolarHBondContact O-N 2.6Å; S686-V689 WeakPolarHBondContact OG-CG2 3.48Å; S686-L690 PolarHBondContact O-N 3.37Å
687	K	94.5	Very high	95.2	Very high	92 Å²	92	66.7 Å²	66.7	40%	0.4	35%	0.345	S	S	.	.	H	α-helix	trans	-44.7	-40.6	177.1	-177.3	174	-179.3	-178.5	0	113.2	L676 L690 Q691	L676-K687 HydrophobicContact CB-CG 4.31Å; L676-K687 HydrophobicContact CD1-CG 4.34Å; K687-L690 PolarHBondContact O-N 2.98Å; K687-Q691 WeakPolarHBondContact O-CB 3.24Å; K687-Q691 WeakPolarHBondContact O-CG 3.34Å; K687-Q691 PolarHBondContact O-N 3.35Å
688	R	94.6	Very high	95.3	Very high	190 Å²	190	63.2 Å²	63.2	72%	0.717	33%	0.328	S	S	*	.	H	α-helix	trans	-67.1	-40.9	177.5	-171.8	175.1	-177.3	84.5	-5.8	112.9	S686 Q691 V692	S686-R688 PolarHBondContact O-N 2.94Å; R688-Q691 PolarHBondContact O-N 3.23Å; R688-V692 WeakPolarHBondContact O-CB 3.37Å; R688-V692 VanDerWaalsContact O-CG2 3.31Å; R688-V692 WeakPolarHBondContact O-CG2 3.37Å; R688-V692 PolarHBondContact O-N 2.82Å
689	V	95.2	Very high	95.2	Very high	53 Å²	53	61.2 Å²	61.2	32%	0.321	32%	0.318	S	S	.	.	H	α-helix	trans	-65.9	-42	176.6	172.8	0	0	0	0	110.5	F653 L685 S686 V692 W693	F653-V689 HydrophobicContact CE1-CG1 3.64Å; F653-V689 HydrophobicContact CZ-CG1 4.04Å; L685-V689 HydrophobicContact CB-CG1 4.33Å; L685-V689 HydrophobicContact CD1-CG1 4.47Å; L685-V689 HydrophobicContact CD2-CG1 4.3Å; S686-V689 WeakPolarHBondContact O-CA 3.35Å; S686-V689 WeakPolarHBondContact O-CB 3.33Å; S686-V689 PolarHBondContact O-N 2.6Å; S686-V689 WeakPolarHBondContact OG-CG2 3.48Å; V689-V692 PolarHBondContact O-N 3Å; V689-W693 WeakPolarHBondContact O-CB 3.36Å; V689-W693 PolarHBondContact O-N 2.84Å
690	L	95.9	Very high	95.1	Very high	0 Å²	0	67.6 Å²	67.6	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-63	-48.7	174.4	-66.9	171.3	0	0	0	111.8	M661 L676 L679 T680 L685 S686 K687 V692 W693 F694	M661-L690 HydrophobicContact CG-CD2 3.94Å; M661-L690 HydrophobicContact SD-CD2 3.56Å; M661-L690 VanDerWaalsContact SD-CD2 3.56Å; L676-L690 HydrophobicContact CD2-CB 3.77Å; L679-L690 HydrophobicContact CB-CD1 3.77Å; L679-L690 HydrophobicContact CB-CD2 4.47Å; T680-L690 WeakPolarHBondContact OG1-CD1 3.39Å; L685-L690 HydrophobicContact CB-CD2 4.06Å; L685-L690 HydrophobicContact CB-CG 4.08Å; L685-L690 HydrophobicContact CD1-CD2 4.13Å; S686-L690 PolarHBondContact O-N 3.37Å; K687-L690 PolarHBondContact O-N 2.98Å; L690-V692 VanDerWaalsContact C-N 3.33Å; L690-V692 PolarHBondContact O-N 3.17Å; L690-W693 WeakPolarHBondContact O-CA 3.4Å; L690-W693 WeakPolarHBondContact O-CB 3.42Å; L690-W693 PolarHBondContact O-N 2.93Å; L690-F694 WeakPolarHBondContact O-CD2 3.5Å; L690-F694 PolarHBondContact O-N 3.11Å
691	Q	95.3	Very high	94.9	Very high	73 Å²	73	70.6 Å²	70.6	34%	0.341	35%	0.353	S	S	.	.	H	α-helix	trans	-53.9	-48.1	175.3	-76.8	169.2	-29.8	0	0	111.9	L676 K687 R688 W693 F694 Q695	L676-Q691 HydrophobicContact CD1-CG 3.82Å; L676-Q691 HydrophobicContact CD2-CG 4.13Å; K687-Q691 WeakPolarHBondContact O-CB 3.24Å; K687-Q691 WeakPolarHBondContact O-CG 3.34Å; K687-Q691 PolarHBondContact O-N 3.35Å; R688-Q691 PolarHBondContact O-N 3.23Å; Q691-W693 VanDerWaalsContact C-N 3.34Å; Q691-W693 PolarHBondContact O-N 2.78Å; Q691-F694 PolarHBondContact O-N 2.64Å; Q691-Q695 WeakPolarHBondContact O-CB 3.46Å; Q691-Q695 VanDerWaalsContact O-CG 3.24Å; Q691-Q695 WeakPolarHBondContact O-CG 3.45Å; Q691-Q695 PolarHBondContact O-N 3.11Å
692	V	95.4	Very high	94.7	Very high	67 Å²	67	72.8 Å²	72.8	41%	0.406	36%	0.356	S	S	.	.	H	α-helix	trans	-64.9	-36.2	176.9	170.9	0	0	0	0	111.7	R688 V689 L690 N696	R688-V692 WeakPolarHBondContact O-CB 3.37Å; R688-V692 VanDerWaalsContact O-CG2 3.31Å; R688-V692 WeakPolarHBondContact O-CG2 3.37Å; R688-V692 PolarHBondContact O-N 2.82Å; V689-V692 PolarHBondContact O-N 3Å; L690-V692 VanDerWaalsContact C-N 3.33Å; L690-V692 PolarHBondContact O-N 3.17Å; V692-N696 WeakPolarHBondContact O-CB 3.24Å; V692-N696 PolarHBondContact O-N 3.48Å; V692-N696 PolarHBondContact O-ND2 3.32Å
693	W	96.3	Very high	94.4	Very high	39 Å²	39	73.9 Å²	73.9	15%	0.148	36%	0.357	C	S	.	.	H	α-helix	trans	-63.7	-50.5	174.4	-170	103.1	0	0	0	111.3	F653 M661 K662 F665 V689 L690 Q691 Q695 N696 A697	F653-W693 AromaticContact CE2-CD1 3.78Å; F653-W693 AromaticContact CZ-CD1 3.9Å; M661-W693 HydrophobicContact CB-CD2 4.11Å; M661-W693 HydrophobicContact CB-CE3 4.05Å; M661-W693 HydrophobicContact CB-CH2 3.67Å; M661-W693 HydrophobicContact CB-CZ2 3.69Å; M661-W693 HydrophobicContact CB-CZ3 3.84Å; M661-W693 HydrophobicContact CE-CD2 4.39Å; M661-W693 HydrophobicContact CE-CG 4.24Å; M661-W693 HydrophobicContact CG-CD2 4.44Å; M661-W693 HydrophobicContact SD-CB 4.1Å; M661-W693 HydrophobicContact SD-CD2 3.63Å; M661-W693 HydrophobicContact SD-CE3 4.19Å; M661-W693 HydrophobicContact SD-CG 3.56Å; M661-W693 VanDerWaalsContact SD-CG 3.56Å; K662-W693 HydrophobicContact CG-CH2 4.38Å; K662-W693 HydrophobicContact CG-CZ2 4.37Å; F665-W693 HydrophobicContact CB-CH2 4.21Å; F665-W693 HydrophobicContact CB-CZ3 4.07Å; F665-W693 HydrophobicContact CD2-CZ3 4Å; F665-W693 HydrophobicContact CG-CZ3 4.31Å; V689-W693 WeakPolarHBondContact O-CB 3.36Å; V689-W693 PolarHBondContact O-N 2.84Å; L690-W693 WeakPolarHBondContact O-CA 3.4Å; L690-W693 WeakPolarHBondContact O-CB 3.42Å; L690-W693 PolarHBondContact O-N 2.93Å; Q691-W693 VanDerWaalsContact C-N 3.34Å; Q691-W693 PolarHBondContact O-N 2.78Å; W693-Q695 PolarHBondContact O-N 3.28Å; W693-N696 PolarHBondContact O-N 3.07Å; W693-N696 VanDerWaalsContact O-N 3.15Å; W693-A697 HydrophobicContact CE3-CB 4.03Å; W693-A697 HydrophobicContact CH2-CB 4.27Å; W693-A697 HydrophobicContact CZ3-CB 3.83Å; W693-A697 WeakPolarHBondContact O-CB 3.45Å; W693-A697 PolarHBondContact O-N 3.45Å
694	F	97.2	Very high	93.9	Very high	0 Å²	0	77.1 Å²	77.1	0%	0	37%	0.374	C	S	.	.	H	α-helix	trans	-67.5	-32.2	179.9	-84.7	-91.8	0	0	0	113.1	Y664 F665 P671 L679 L690 Q691 R698	Y664-F694 AromaticContact CD1-CE1 3.85Å; Y664-F694 HydrophobicContact CD1-CE1 3.85Å; Y664-F694 AromaticContact CD1-CZ 3.71Å; Y664-F694 HydrophobicContact CD1-CZ 3.71Å; Y664-F694 HydrophobicContact CE1-CE1 4.46Å; Y664-F694 HydrophobicContact CG-CZ 4.43Å; F665-F694 HydrophobicContact CB-CE1 4.05Å; F665-F694 AromaticContact CD2-CD1 3.76Å; F665-F694 HydrophobicContact CD2-CD1 3.76Å; F665-F694 AromaticContact CD2-CE1 3.82Å; F665-F694 HydrophobicContact CD2-CE1 3.82Å; F665-F694 HydrophobicContact CE2-CD1 4.43Å; F665-F694 HydrophobicContact CG-CE1 4.44Å; P671-F694 HydrophobicContact CG-CB 4.26Å; P671-F694 HydrophobicContact CG-CD1 3.57Å; P671-F694 HydrophobicContact CG-CD2 3.9Å; P671-F694 HydrophobicContact CG-CE1 3.8Å; P671-F694 HydrophobicContact CG-CE2 4.13Å; P671-F694 HydrophobicContact CG-CG 3.63Å; P671-F694 HydrophobicContact CG-CZ 4.09Å; L679-F694 HydrophobicContact CD1-CE2 3.87Å; L679-F694 HydrophobicContact CD1-CZ 3.94Å; L690-F694 WeakPolarHBondContact O-CD2 3.5Å; L690-F694 PolarHBondContact O-N 3.11Å; Q691-F694 PolarHBondContact O-N 2.64Å; F694-R698 WeakPolarHBondContact O-CB 3.31Å; F694-R698 WeakPolarHBondContact O-CG 3.11Å; F694-R698 PolarHBondContact O-N 3.33Å; F694-R698 PolarHBondContact O-NE 3.16Å
695	Q	94.7	Very high	93.2	Very high	114 Å²	114	76.9 Å²	76.9	53%	0.533	36%	0.356	S	S	.	.	H	α-helix	trans	-62.5	-48.1	168.6	-74.7	170	-0	0	0	111.3	Q691 W693 A697 A699	Q691-Q695 WeakPolarHBondContact O-CB 3.46Å; Q691-Q695 VanDerWaalsContact O-CG 3.24Å; Q691-Q695 WeakPolarHBondContact O-CG 3.45Å; Q691-Q695 PolarHBondContact O-N 3.11Å; W693-Q695 PolarHBondContact O-N 3.28Å; Q695-A697 PolarHBondContact O-N 2.92Å; Q695-A699 WeakPolarHBondContact O-CB 3.38Å; Q695-A699 PolarHBondContact O-N 3.3Å
696	N	96.3	Very high	92.3	Very high	95 Å²	95	79.8 Å²	79.8	51%	0.508	38%	0.375	S	S	.	.	H	α-helix	trans	-65.8	-37.2	178.3	-84.3	-75.1	0	0	0	112.8	V692 W693 A699 K700	V692-N696 WeakPolarHBondContact O-CB 3.24Å; V692-N696 PolarHBondContact O-N 3.48Å; V692-N696 PolarHBondContact O-ND2 3.32Å; W693-N696 PolarHBondContact O-N 3.07Å; W693-N696 VanDerWaalsContact O-N 3.15Å; N696-A699 PolarHBondContact O-N 3.47Å; N696-K700 WeakPolarHBondContact O-CB 3.33Å; N696-K700 PolarHBondContact O-N 2.92Å
697	A	95.2	Very high	91.2	Very high	18 Å²	18	83.5 Å²	83.5	15%	0.149	38%	0.378	C	S	.	.	H	α-helix	trans	-65	-50.9	176.3	0	0	0	0	0	111.3	F665 W693 Q695 A699 K700 Y701	F665-A697 HydrophobicContact CD2-CB 3.69Å; F665-A697 HydrophobicContact CE2-CB 3.37Å; F665-A697 HydrophobicContact CZ-CB 4Å; W693-A697 HydrophobicContact CE3-CB 4.03Å; W693-A697 HydrophobicContact CH2-CB 4.27Å; W693-A697 HydrophobicContact CZ3-CB 3.83Å; W693-A697 WeakPolarHBondContact O-CB 3.45Å; W693-A697 PolarHBondContact O-N 3.45Å; Q695-A697 PolarHBondContact O-N 2.92Å; A697-A699 VanDerWaalsContact C-N 3.33Å; A697-A699 PolarHBondContact O-N 3.35Å; A697-K700 WeakPolarHBondContact O-CA 3.48Å; A697-K700 WeakPolarHBondContact O-CB 3.24Å; A697-K700 PolarHBondContact O-N 2.87Å; A697-Y701 PolarHBondContact O-N 3.16Å
698	R	96.1	Very high	89.7	Confident	63 Å²	63	85.3 Å²	85.3	24%	0.238	39%	0.388	C	S	.	.	H	α-helix	trans	-57.5	-42.5	173.1	-75.7	177.4	-77.9	-169	-2.7	112.6	F665 H669 N670 F694 K700 Y701 R702	F665-R698 HydrophobicContact CE2-CG 3.98Å; F665-R698 HydrophobicContact CZ-CG 4.35Å; H669-R698 HydrophobicContact CB-CG 4.29Å; H669-R698 WeakPolarHBondContact O-CD 3.34Å; H669-R698 PolarHBondContact O-NE 3.21Å; N670-R698 VanDerWaalsContact CG-NH1 3.31Å; N670-R698 WeakPolarHBondContact OD1-CD 3.3Å; N670-R698 PolarHBondContact OD1-NH1 3.07Å; F694-R698 WeakPolarHBondContact O-CB 3.31Å; F694-R698 WeakPolarHBondContact O-CG 3.11Å; F694-R698 PolarHBondContact O-N 3.33Å; F694-R698 PolarHBondContact O-NE 3.16Å; R698-K700 VanDerWaalsContact C-N 3.3Å; R698-K700 PolarHBondContact O-N 3.37Å; R698-Y701 PolarHBondContact O-N 3.39Å; R698-R702 PolarHBondContact O-N 2.97Å
699	A	92.4	Very high	88.1	Confident	22 Å²	22	81.2 Å²	81.2	18%	0.182	38%	0.377	C	S	.	.	H	α-helix	trans	-65.9	-30.7	175.6	0	0	0	0	0	112.7	Q695 N696 A697 R703	Q695-A699 WeakPolarHBondContact O-CB 3.38Å; Q695-A699 PolarHBondContact O-N 3.3Å; N696-A699 PolarHBondContact O-N 3.47Å; A697-A699 VanDerWaalsContact C-N 3.33Å; A697-A699 PolarHBondContact O-N 3.35Å; A699-R703 WeakPolarHBondContact O-CG 3.34Å; A699-R703 VanDerWaalsContact O-CZ 3.29Å; A699-R703 PolarHBondContact O-N 2.81Å; A699-R703 PolarHBondContact O-NH1 2.98Å
700	K	92.8	Very high	86.2	Confident	138 Å²	138	84.5 Å²	84.5	60%	0.6	39%	0.393	S	S	*	.	H	α-helix	trans	-71.9	-42.9	172.3	-172.3	-174.8	173.9	-166.7	0	111.4	N696 A697 R698 R703 N704	N696-K700 WeakPolarHBondContact O-CB 3.33Å; N696-K700 PolarHBondContact O-N 2.92Å; A697-K700 WeakPolarHBondContact O-CA 3.48Å; A697-K700 WeakPolarHBondContact O-CB 3.24Å; A697-K700 PolarHBondContact O-N 2.87Å; R698-K700 VanDerWaalsContact C-N 3.3Å; R698-K700 PolarHBondContact O-N 3.37Å; K700-R703 PolarHBondContact O-N 3.24Å; K700-N704 PolarHBondContact O-N 3.25Å
701	Y	92.1	Very high	84.3	Confident	106 Å²	106	88.9 Å²	88.9	42%	0.416	42%	0.42	S	S	.	.	H	α-helix	trans	-57.7	-54	177	-176.8	-100	0	0	0	111.8	H669 A697 R698 R703 N704 L705	H669-Y701 AromaticContact CE1-CE1 3.76Å; H669-Y701 AromaticContact CE1-CZ 3.67Å; A697-Y701 PolarHBondContact O-N 3.16Å; R698-Y701 PolarHBondContact O-N 3.39Å; Y701-R703 VanDerWaalsContact C-N 3.27Å; Y701-R703 PolarHBondContact O-N 2.94Å; Y701-N704 WeakPolarHBondContact O-CB 3.47Å; Y701-N704 PolarHBondContact O-N 3Å; Y701-L705 HydrophobicContact CD1-CD1 3.86Å; Y701-L705 HydrophobicContact CD2-CD1 4.4Å; Y701-L705 HydrophobicContact CE1-CD1 3.6Å; Y701-L705 HydrophobicContact CE2-CD1 4.17Å; Y701-L705 HydrophobicContact CG-CD1 4.26Å; Y701-L705 WeakPolarHBondContact O-CD1 3.06Å; Y701-L705 PolarHBondContact O-N 3.1Å
702	R	91.5	Very high	82.1	Confident	163 Å²	163	88.9 Å²	88.9	62%	0.615	43%	0.428	S	S	*	.	H	α-helix	trans	-58.5	-33.8	177.6	-66.2	-162.9	-60.9	-97.9	8.3	113.9	R698 N704	R698-R702 PolarHBondContact O-N 2.97Å; R702-N704 PolarHBondContact O-N 3.37Å
703	R	87.3	Confident	79.9	Confident	152 Å²	152	90.4 Å²	90.4	57%	0.574	44%	0.437	S	S	*	.	H	α-helix	trans	-73.6	-9.1	175.3	-70.8	-173	-139.5	98.5	-8.8	114.1	A699 K700 Y701 R707	A699-R703 WeakPolarHBondContact O-CG 3.34Å; A699-R703 VanDerWaalsContact O-CZ 3.29Å; A699-R703 PolarHBondContact O-N 2.81Å; A699-R703 PolarHBondContact O-NH1 2.98Å; K700-R703 PolarHBondContact O-N 3.24Å; Y701-R703 VanDerWaalsContact C-N 3.27Å; Y701-R703 PolarHBondContact O-N 2.94Å; R703-R707 WeakPolarHBondContact O-CD 3.43Å; R703-R707 WeakPolarHBondContact O-CG 3.29Å
704	N	84	Confident	77.4	Confident	78 Å²	78	92.9 Å²	92.9	42%	0.417	46%	0.461	S	S	.	.	H	α-helix	trans	-93.8	-37.6	174.8	-75.3	-3	0	0	0	112.2	K700 Y701 R702 R707 Q708	K700-N704 PolarHBondContact O-N 3.25Å; Y701-N704 WeakPolarHBondContact O-CB 3.47Å; Y701-N704 PolarHBondContact O-N 3Å; R702-N704 PolarHBondContact O-N 3.37Å; N704-R707 WeakPolarHBondContact O-CA 3.27Å; N704-R707 WeakPolarHBondContact O-CB 3.45Å; N704-R707 PolarHBondContact O-N 3.44Å; N704-Q708 PolarHBondContact O-N 3.27Å
705	L	81.4	Confident	75	Confident	63 Å²	63	97.2 Å²	97.2	33%	0.33	49%	0.487	S	S	.	.	H	α-helix	trans	-58.2	-51.1	175.9	-83.3	74.9	0	0	0	111.2	Y701 R707 Q708 E709	Y701-L705 HydrophobicContact CD1-CD1 3.86Å; Y701-L705 HydrophobicContact CD2-CD1 4.4Å; Y701-L705 HydrophobicContact CE1-CD1 3.6Å; Y701-L705 HydrophobicContact CE2-CD1 4.17Å; Y701-L705 HydrophobicContact CG-CD1 4.26Å; Y701-L705 WeakPolarHBondContact O-CD1 3.06Å; Y701-L705 PolarHBondContact O-N 3.1Å; L705-R707 PolarHBondContact O-N 3.05Å; L705-Q708 PolarHBondContact O-N 3.47Å; L705-E709 PolarHBondContact O-N 3.49Å; L705-E709 VanDerWaalsContact O-N 3.1Å
706	V	75.7	Confident	72.4	Confident	82 Å²	82	97.4 Å²	97.4	50%	0.497	49%	0.491	S	S	.	.	H	α-helix	trans	-61	-5.3	175.5	-175.4	0	0	0	0	113.5	E709 N710	V706-E709 WeakPolarHBondContact CA-OE2 3.44Å; V706-N710 PolarHBondContact O-ND2 3.4Å
707	R	71.3	Confident	69.8	Low	145 Å²	145	99.8 Å²	99.8	55%	0.547	50%	0.504	S	S	.	.	H	α-helix	trans	-102.8	-22.8	171.2	-72.6	177.4	160.3	-156.4	-12.1	113.9	R703 N704 L705 T711	R703-R707 WeakPolarHBondContact O-CD 3.43Å; R703-R707 WeakPolarHBondContact O-CG 3.29Å; N704-R707 WeakPolarHBondContact O-CA 3.27Å; N704-R707 WeakPolarHBondContact O-CB 3.45Å; N704-R707 PolarHBondContact O-N 3.44Å; L705-R707 PolarHBondContact O-N 3.05Å; R707-T711 PolarHBondContact O-OG1 3.13Å
708	Q	63.2	Low	67.3	Low	131 Å²	131	107.3 Å²	107.3	61%	0.612	54%	0.536	S	S	*	.	H	α-helix	trans	-81.2	-40.4	175.3	-72.7	176	-41.6	0	0	111	N704 L705 N710 T711 S712	N704-Q708 PolarHBondContact O-N 3.27Å; L705-Q708 PolarHBondContact O-N 3.47Å; Q708-N710 VanDerWaalsContact C-N 3.31Å; Q708-N710 PolarHBondContact O-N 3.11Å; Q708-T711 WeakPolarHBondContact CA-OG1 3.12Å; Q708-T711 PolarHBondContact O-N 2.92Å; Q708-T711 PolarHBondContact O-OG1 3.44Å; Q708-S712 PolarHBondContact O-N 3.39Å; Q708-S712 VanDerWaalsContact O-N 3.16Å
709	E	61.5	Low	65	Low	103 Å²	103	110.2 Å²	110.2	48%	0.481	56%	0.555	S	S	.	*	H	α-helix	trans	-51.5	-49.8	171.9	-68.4	156.9	-167.1	0	0	111.2	L705 V706 T711 S712 T713	L705-E709 PolarHBondContact O-N 3.49Å; L705-E709 VanDerWaalsContact O-N 3.1Å; V706-E709 WeakPolarHBondContact CA-OE2 3.44Å; E709-T711 PolarHBondContact O-N 3.39Å; E709-S712 PolarHBondContact O-N 3.49Å; E709-S712 PolarHBondContact O-OG 3.03Å; E709-S712 VanDerWaalsContact O-OG 3.13Å; E709-T713 PolarHBondContact O-N 3.45Å; E709-T713 PolarHBondContact O-OG1 3.13Å; E709-T713 VanDerWaalsContact O-OG1 3.07Å
710	N	55.2	Low	62.6	Low	122 Å²	122	115.8 Å²	115.8	65%	0.652	58%	0.582	S	S	*	*	H	α-helix	trans	-67.7	-2.5	177.6	-74	-43.1	0	0	0	115.1	V706 Q708	V706-N710 PolarHBondContact O-ND2 3.4Å; Q708-N710 VanDerWaalsContact C-N 3.31Å; Q708-N710 PolarHBondContact O-N 3.11Å
711	T	56.2	Low	60	Low	92 Å²	92	117.1 Å²	117.1	56%	0.564	60%	0.595	S	S	*	*	H	α-helix	trans	-108.5	-27.2	174.3	43.6	0	0	0	0	113.5	R707 Q708 E709	R707-T711 PolarHBondContact O-OG1 3.13Å; Q708-T711 WeakPolarHBondContact CA-OG1 3.12Å; Q708-T711 PolarHBondContact O-N 2.92Å; Q708-T711 PolarHBondContact O-OG1 3.44Å; E709-T711 PolarHBondContact O-N 3.39Å
712	S	48.9	Very low	57.4	Low	73 Å²	73	117.2 Å²	117.2	51%	0.51	61%	0.612	S	S	.	*	H	α-helix	trans	-75.7	-32.2	176.5	47.3	0	0	0	0	112.9	Q708 E709 S714 V715	Q708-S712 PolarHBondContact O-N 3.39Å; Q708-S712 VanDerWaalsContact O-N 3.16Å; E709-S712 PolarHBondContact O-N 3.49Å; E709-S712 PolarHBondContact O-OG 3.03Å; E709-S712 VanDerWaalsContact O-OG 3.13Å; S712-S714 PolarHBondContact O-N 3.12Å; S712-S714 VanDerWaalsContact O-N 3.13Å; S712-V715 PolarHBondContact O-N 3.15Å
713	T	48	Very low	54.7	Low	100 Å²	100	117.8 Å²	117.8	61%	0.613	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.5	-19.2	178.1	-30.3	0	0	0	0	113.7	E709	E709-T713 PolarHBondContact O-N 3.45Å; E709-T713 PolarHBondContact O-OG1 3.13Å; E709-T713 VanDerWaalsContact O-OG1 3.07Å
714	S	43.4	Very low	52.5	Low	91 Å²	91	116.9 Å²	116.9	64%	0.636	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.7	-6.6	-176.9	-166	0	0	0	0	114.5	S712	S712-S714 PolarHBondContact O-N 3.12Å; S712-S714 VanDerWaalsContact O-N 3.13Å
715	V	46.8	Very low	50.4	Low	91 Å²	91	119.1 Å²	119.1	55%	0.552	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.2	-33.2	-172.2	-155	0	0	0	0	112.4	S712 N717	S712-V715 PolarHBondContact O-N 3.15Å; V715-N717 VanDerWaalsContact C-N 3.34Å; V715-N717 PolarHBondContact O-N 3.34Å
716	N	42.1	Very low	48.2	Very low	117 Å²	117	119.8 Å²	119.8	63%	0.626	68%	0.681	S	S	*	*	G	3₁₀ helix	trans	-77.4	-14.2	-174.3	-71.9	8.3	0	0	0	114.6	H718	N716-H718 VanDerWaalsContact C-N 3.26Å; N716-H718 PolarHBondContact O-N 3.23Å
717	N	41.5	Very low	46.2	Very low	145 Å²	145	123.7 Å²	123.7	78%	0.775	70%	0.698	S	S	*	*	G	3₁₀ helix	trans	-80.7	-0.6	179.7	-76	3.8	0	0	0	114.1	V715	V715-N717 VanDerWaalsContact C-N 3.34Å; V715-N717 PolarHBondContact O-N 3.34Å
718	H	41.9	Very low	44.6	Very low	177 Å²	177	123.9 Å²	123.9	82%	0.819	71%	0.709	S	S	*	*	G	3₁₀ helix	trans	-108.1	1.7	-173	-137.2	-58.8	0	0	0	115.1	N716	N716-H718 VanDerWaalsContact C-N 3.26Å; N716-H718 PolarHBondContact O-N 3.23Å
719	I	48.1	Very low	43.3	Very low	123 Å²	123	123.3 Å²	123.3	63%	0.631	71%	0.714	S	S	*	*	S	Bend	trans	-101.5	-22.7	-172.3	-66.6	167.1	0	0	0	112.5	N721	I719-N721 PolarHBondContact O-N 3.39Å
720	N	40.8	Very low	41.9	Very low	139 Å²	139	123.3 Å²	123.3	74%	0.743	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.8	15	-165.5	-63.4	-0.6	0	0	0	115.5
721	N	39.8	Very low	41.1	Very low	167 Å²	167	122.6 Å²	122.6	89%	0.893	73%	0.73	S	S	*	*	T	Hydrogen-bonded Turn	trans	-127.6	24.6	-168.8	-109	13.4	0	0	0	114.6	I719	I719-N721 PolarHBondContact O-N 3.39Å
722	S	36.3	Very low	40	Very low	108 Å²	108	125.7 Å²	125.7	76%	0.755	74%	0.744	S	S	*	*			trans	-147.9	62.7	-177.9	-174.8	0	0	0	0	113.8
723	L	35.9	Very low	38.9	Very low	174 Å²	174	127.6 Å²	127.6	91%	0.911	76%	0.755	S	S	*	*			trans	-137.3	56.2	176.3	-82.7	176	0	0	0	113.5
724	T	39.7	Very low	38.1	Very low	134 Å²	134	126 Å²	126	82%	0.822	76%	0.759	S	S	*	*			trans	-153.2	152.1	161	37	0	0	0	0	112
725	S	40.3	Very low	37.4	Very low	124 Å²	124	127.2 Å²	127.2	87%	0.867	77%	0.768	S	S	*	*			trans	76.2	122	165.5	-54.3	0	0	0	0	119.5
726	G	35.9	Very low	36.8	Very low	77 Å²	77	127.1 Å²	127.1	79%	0.794	77%	0.771	S	S	*	*			trans	111.4	105.4	153.6	0	0	0	0	0	116.5
727	L	33.6	Very low	36.4	Very low	164 Å²	164	129.3 Å²	129.3	86%	0.859	78%	0.777	S	S	*	*			trans	-100.9	-179.8	168.6	-80.3	80.4	0	0	0	111.2
728	I	37.4	Very low	35.9	Very low	149 Å²	149	130.7 Å²	130.7	76%	0.764	78%	0.781	S	S	*	*			trans	98.4	120.3	148.3	-34.7	-175.8	0	0	0	118
729	T	35.4	Very low	35.4	Very low	119 Å²	119	130.6 Å²	130.6	73%	0.73	79%	0.785	S	S	*	*			trans	60	94.5	158.3	46.4	0	0	0	0	122.3
730	S	33.3	Very low	34.4	Very low	103 Å²	103	128.3 Å²	128.3	72%	0.72	79%	0.792	S	S	*	*				14.2	128.2	117.5	59.3	0	0	0	0	120.6
731	S	38.2	Very low	33.9	Very low	107 Å²	107	129.1 Å²	129.1	75%	0.748	80%	0.796	S	S	*	*				166.5	143.2	92.8	51.6	0	0	0	0	113.7
732	N	33.3	Very low	33.6	Very low	158 Å²	158	126.7 Å²	126.7	85%	0.845	79%	0.792	S	S	*	*			trans	55.5	157.8	163.2	-80.5	4.6	0	0	0	120.4
733	C	26.3	Very low	33.4	Very low	112 Å²	112	129.3 Å²	129.3	76%	0.757	80%	0.796	S	S	*	*			cis	-164.7	156.1	-34.4	56.4	0	0	0	0	109.8
734	G	29.2	Very low	33.5	Very low	68 Å²	68	125.3 Å²	125.3	70%	0.701	78%	0.782	S	S	*	*			trans	90	131.4	159.4	0	0	0	0	0	119.2
735	S	30.6	Very low	33.4	Very low	116 Å²	116	127.1 Å²	127.1	81%	0.811	78%	0.782	S	S	*	*			trans	13.8	140.1	139.3	53.9	0	0	0	0	119.8
736	S	32.9	Very low	33.1	Very low	89 Å²	89	125.7 Å²	125.7	62%	0.622	77%	0.77	S	S	*	*			cis	-178.6	174.5	8	-102.8	0	0	0	0	108.9
737	E	33.1	Very low	33.1	Very low	162 Å²	162	128.7 Å²	128.7	76%	0.757	77%	0.768	S	S	*	*			cis	-135	154.6	-7.3	-114.5	102.4	-132.7	0	0	105.6
738	M	32.5	Very low	33.3	Very low	174 Å²	174	124.6 Å²	124.6	86%	0.857	75%	0.754	S	S	*	*				70.8	94.8	53.3	-55.9	-61.6	-178.3	0	0	116	G740	M738-G740 PolarHBondContact O-N 3.37Å
739	I	30.9	Very low	33.2	Very low	176 Å²	176	126.5 Å²	126.5	90%	0.903	76%	0.759	S	S	*	*			trans	-74.2	103.4	173.4	-61.3	167.7	0	0	0	109.3
740	G	27.5	Very low	33.1	Very low	74 Å²	74	126.3 Å²	126.3	76%	0.763	76%	0.762	S	S	*	*			trans	-92.7	110.3	175.9	0	0	0	0	0	112.3	M738	M738-G740 PolarHBondContact O-N 3.37Å
741	N	29.6	Very low	33.3	Very low	157 Å²	157	126.4 Å²	126.4	84%	0.84	76%	0.763	S	S	*	*			trans	-145.2	66.6	171.4	-151.4	53.5	0	0	0	111.2
742	S	33.1	Very low	33.1	Very low	116 Å²	116	129.7 Å²	129.7	81%	0.811	77%	0.767	S	S	*	*			trans	-131.2	130.5	178.8	-63.3	0	0	0	0	110.3
743	I	33	Very low	33.2	Very low	163 Å²	163	130.3 Å²	130.3	84%	0.836	77%	0.768	S	S	*	*			trans	-136.1	118.2	145.1	52.9	167.5	0	0	0	109.3
744	S	37.3	Very low	33.5	Very low	89 Å²	89	131.9 Å²	131.9	62%	0.622	77%	0.769	S	S	*	*			trans	-74.9	-171.2	142.1	39.9	0	0	0	0	107.7
745	E	37.1	Very low	33.7	Very low	173 Å²	173	133.9 Å²	133.9	81%	0.808	77%	0.77	S	S	*	*			cis	-159.5	-161.7	25.1	-137.5	129.4	-102.6	0	0	105.3
746	C	34.5	Very low	33.8	Very low	93 Å²	93	135.7 Å²	135.7	63%	0.628	77%	0.77	S	S	*	*			cis	-134.9	176.1	-7.1	46.1	0	0	0	0	106.9
747	D	36.4	Very low	33.9	Very low	141 Å²	141	138.5 Å²	138.5	75%	0.754	78%	0.778	S	S	*	*				-168.5	165.2	60.8	-94.5	-39.2	0	0	0	109.9
748	S	38.6	Very low	34	Very low	78 Å²	78	139 Å²	139	55%	0.545	78%	0.779	S	S	.	*			cis	-174.3	127.6	-29.6	-105	0	0	0	0	108.5
749	Q	34.1	Very low	33.9	Very low	188 Å²	188	135.7 Å²	135.7	88%	0.879	77%	0.768	S	S	*	*			trans	64	151.3	165.6	-50.4	170.7	24.5	0	0	115.2
750	S	33.4	Very low	34	Very low	115 Å²	115	133.8 Å²	133.8	80%	0.804	76%	0.758	S	S	*	*			cis	-151.3	172	-7.6	-140.4	0	0	0	0	107.2
751	S	38.2	Very low	34.4	Very low	105 Å²	105	135.4 Å²	135.4	73%	0.734	76%	0.758	S	S	*	*			cis	-145.8	-154.3	7.5	63.9	0	0	0	0	110.6
752	Q	33.3	Very low	34.6	Very low	176 Å²	176	136.1 Å²	136.1	82%	0.822	76%	0.756	S	S	*	*			trans	-131.1	161.1	174	-64.8	172.7	-21	0	0	111
753	I	36.1	Very low	34.7	Very low	172 Å²	172	137.3 Å²	137.3	88%	0.882	76%	0.759	S	S	*	*			trans	-167.2	152.7	140.2	-98	151.5	0	0	0	108.1
754	N	31.2	Very low	34.8	Very low	145 Å²	145	135.9 Å²	135.9	78%	0.775	76%	0.758	S	S	*	*			trans	-85.1	161.1	-162	-65.1	-35.4	0	0	0	115.4
755	P	34.9	Very low	34.8	Very low	110 Å²	110	136.8 Å²	136.8	71%	0.714	76%	0.762	S	S	*	*			trans	-78.8	175.1	159.4	36.6	-36.1	0	0	0	112.6
756	D	31.5	Very low	34.6	Very low	153 Å²	153	133.6 Å²	133.6	82%	0.818	76%	0.759	S	S	*	*			trans	102	100.4	173.6	-61.8	-18	0	0	0	116.2
757	D	35.4	Very low	34.6	Very low	148 Å²	148	134 Å²	134	79%	0.791	76%	0.763	S	S	*	*			trans	-169	123.2	136.2	-119.1	18.4	0	0	0	114.7
758	F	35.4	Very low	34.5	Very low	174 Å²	174	133.5 Å²	133.5	76%	0.763	77%	0.765	S	S	*	*			trans	65.8	105.8	135.4	-83.5	-116.3	0	0	0	125.8
759	T	31.3	Very low	34.2	Very low	103 Å²	103	135 Å²	135	63%	0.632	78%	0.775	S	S	*	*				92.8	110.9	99.5	-66.3	0	0	0	0	124.6
760	I	32.2	Very low	34.4	Very low	137 Å²	137	131.1 Å²	131.1	70%	0.703	77%	0.766	S	S	*	*			trans	73.7	119.4	136.6	-70.1	176.6	0	0	0	124.1
761	S	35.9	Very low	34.4	Very low	108 Å²	108	133.9 Å²	133.9	76%	0.755	77%	0.766	S	S	*	*				158.8	100.7	127.6	-71.3	0	0	0	0	111.9
762	Q	33.8	Very low	34.3	Very low	172 Å²	172	137 Å²	137	80%	0.804	77%	0.766	S	S	*	*				66.8	110.3	85.9	-70.6	-165.2	27.3	0	0	118.4
763	T	34.2	Very low	34.2	Very low	140 Å²	140	134.3 Å²	134.3	86%	0.859	76%	0.758	S	S	*	*				-178.2	161.3	114.6	25.7	0	0	0	0	112.8
764	T	36.1	Very low	34	Very low	133 Å²	133	132.3 Å²	132.3	82%	0.816	75%	0.749	S	S	*	*			trans	-131.9	-167.3	-168.4	49.4	0	0	0	0	109.6
765	P	37.2	Very low	34.3	Very low	109 Å²	109	132.4 Å²	132.4	71%	0.708	75%	0.749	S	S	*	*			cis	-152.3	176.4	15.7	46.4	-24.4	0	0	0	121.3
766	S	32.8	Very low	34.2	Very low	106 Å²	106	133.3 Å²	133.3	74%	0.741	75%	0.746	S	S	*	*			trans	34.9	147.7	143.4	60.9	0	0	0	0	123.4
767	S	34.9	Very low	34.6	Very low	102 Å²	102	133.7 Å²	133.7	71%	0.713	74%	0.743	S	S	*	*			cis	-167.6	-160.1	-6.3	48.4	0	0	0	0	108.6
768	T	34.5	Very low	34.7	Very low	130 Å²	130	132.8 Å²	132.8	80%	0.798	74%	0.738	S	S	*	*			cis	-161.3	-157.8	17.4	-24	0	0	0	0	111.6
769	S	32.8	Very low	35.2	Very low	110 Å²	110	131.3 Å²	131.3	77%	0.769	74%	0.738	S	S	*	*			trans	-138.9	-158.3	-174	-46.4	0	0	0	0	111.1
770	P	38.4	Very low	36	Very low	106 Å²	106	133.1 Å²	133.1	69%	0.688	74%	0.744	S	S	*	*			cis	-146.5	170.8	-5	43.5	-23.7	0	0	0	120.1
771	Q	32.4	Very low	36.7	Very low	173 Å²	173	133 Å²	133	81%	0.808	75%	0.745	S	S	*	*			trans	51.9	159.8	143.2	-65.9	175.3	-15.2	0	0	122
772	K	35.2	Very low	37.5	Very low	169 Å²	169	134.1 Å²	134.1	74%	0.735	74%	0.742	S	S	*	*			cis	-175.1	153.3	37.1	-151.5	166.3	-179.3	-174.4	0	114.4
773	N	31.2	Very low	38.2	Very low	121 Å²	121	132.2 Å²	132.2	65%	0.647	74%	0.738	S	S	*	*			trans	23.5	161.2	147.2	-60	51	0	0	0	123.7
774	D	33.6	Very low	38.9	Very low	130 Å²	130	131.6 Å²	131.6	70%	0.695	73%	0.729	S	S	*	*			cis	-174.6	174.9	-12.7	-90.4	-14.4	0	0	0	112
775	L	36.5	Very low	39.4	Very low	146 Å²	146	131 Å²	131	76%	0.764	72%	0.721	S	S	*	*			trans	95.7	109.6	147.5	-108.4	75.7	0	0	0	125.7
776	I	33.7	Very low	39.8	Very low	129 Å²	129	131.1 Å²	131.1	66%	0.662	72%	0.72	S	S	*	*				74.3	140.8	121.4	-77.4	-179.6	0	0	0	126.2
777	Q	39.4	Very low	40.2	Very low	162 Å²	162	132.8 Å²	132.8	76%	0.757	72%	0.72	S	S	*	*			trans	77.3	147.6	156.3	-94.1	157	-17.5	0	0	122.3
778	D	37.3	Very low	40.8	Very low	128 Å²	128	134.8 Å²	134.8	68%	0.684	72%	0.723	S	S	*	*			cis	-168.7	-171.1	-38.4	-93.1	-7.6	0	0	0	107.9
779	D	45.7	Very low	41.3	Very low	143 Å²	143	135.2 Å²	135.2	77%	0.765	72%	0.72	S	S	*	*			trans	78.9	93.6	160.9	-51.3	-19.8	0	0	0	121.6
780	D	47.3	Very low	41.8	Very low	142 Å²	142	136.9 Å²	136.9	76%	0.759	72%	0.721	S	S	*	*				69.9	149.5	111.3	-62.1	-5.8	0	0	0	127.5
781	D	48.6	Very low	41.8	Very low	134 Å²	134	139 Å²	139	72%	0.717	72%	0.721	S	S	*	*			trans	80.3	116.7	150.8	-61.1	-10.9	0	0	0	126.6
782	D	51.4	Low	42	Very low	131 Å²	131	136.8 Å²	136.8	70%	0.701	71%	0.711	S	S	*	*				85.6	121.2	125	-65.1	-6.8	0	0	0	127.4
783	D	49.5	Very low	42.1	Very low	132 Å²	132	138.6 Å²	138.6	71%	0.706	71%	0.713	S	S	*	*			trans	73.5	139.8	130.8	-77.1	-6.2	0	0	0	126.2
784	D	49	Very low	42.4	Very low	128 Å²	128	138.2 Å²	138.2	68%	0.684	72%	0.715	S	S	*	*			trans	65.9	151.2	139.2	-82.8	22.2	0	0	0	122.3
785	N	45.8	Very low	42.3	Very low	121 Å²	121	138.8 Å²	138.8	65%	0.647	72%	0.718	S	S	*	*			cis	-167.4	-174	-24.3	-124.8	-32.4	0	0	0	107.7
786	V	46.6	Very low	42.1	Very low	111 Å²	111	138.7 Å²	138.7	67%	0.673	72%	0.718	S	S	*	*			trans	72.4	114.9	168.9	-166.4	0	0	0	0	113.6
787	D	41.1	Very low	42.3	Very low	141 Å²	141	140.9 Å²	140.9	75%	0.754	73%	0.728	S	S	*	*				80.4	163.2	52.6	-64.8	-50.9	0	0	0	114.4
788	D	45.9	Very low	42	Very low	143 Å²	143	140.1 Å²	140.1	77%	0.765	73%	0.729	S	S	*	*			trans	68.2	150.6	179.2	-53.2	-15.2	0	0	0	118
789	D	45	Very low	41.7	Very low	140 Å²	140	141.1 Å²	141.1	75%	0.749	73%	0.734	S	S	*	*				-162	-179.8	-50.5	-137.3	-22.2	0	0	0	108.5
790	D	43.4	Very low	41.3	Very low	145 Å²	145	142.3 Å²	142.3	78%	0.775	74%	0.739	S	S	*	*			trans	62.2	166.9	161.2	-75.8	-24	0	0	0	119.4
791	E	39	Very low	40.5	Very low	150 Å²	150	141.9 Å²	141.9	70%	0.701	74%	0.737	S	S	*	*				-166.3	149.3	-53.8	-123	-83.7	130.6	0	0	108.5
792	E	36.8	Very low	39.7	Very low	127 Å²	127	142.2 Å²	142.2	59%	0.593	74%	0.739	S	S	*	*			trans	59	155.1	157.6	-114.6	-170.7	-170.9	0	0	124.5
793	R	36.7	Very low	38.7	Very low	207 Å²	207	144.5 Å²	144.5	78%	0.781	75%	0.745	S	S	*	*			trans	78.9	101.6	160.7	-67.3	162.6	-154.8	-144.2	-1.8	118.5
794	V	38.1	Very low	37.8	Very low	113 Å²	113	146.2 Å²	146.2	69%	0.685	75%	0.753	S	S	*	*			cis	93.7	113.8	40.8	175.5	0	0	0	0	112.9
795	N	30.6	Very low	37.1	Very low	141 Å²	141	149.5 Å²	149.5	75%	0.754	77%	0.765	S	S	*	*			trans	60.5	135.8	168.1	-54.2	-7.2	0	0	0	115.1
796	D	32.9	Very low	36.5	Very low	145 Å²	145	151.4 Å²	151.4	78%	0.775	77%	0.769	S	S	*	*			cis	-159.9	-170.5	41.5	-117.5	-39.9	0	0	0	112.2
797	M	38.6	Very low	35.8	Very low	175 Å²	175	151.9 Å²	151.9	86%	0.862	77%	0.768	S	S	*	*			trans	86.9	135.3	168.9	-60.4	-64.8	178.9	0	0	118.4
798	N	32.1	Very low	35.3	Very low	145 Å²	145	154.2 Å²	154.2	78%	0.775	77%	0.774	S	S	*	*			trans	-101.5	169.1	176.1	-57.6	-78.9	0	0	0	111
799	D	31.7	Very low	34.7	Very low	149 Å²	149	155.4 Å²	155.4	80%	0.797	78%	0.779	S	S	*	*			trans	61.5	121.1	157.5	-54.2	-37.1	0	0	0	119
800	I	36.2	Very low	34.1	Very low	169 Å²	169	156.6 Å²	156.6	87%	0.867	78%	0.782	S	S	*	*				-171.9	150.9	119.6	-94.8	154.7	0	0	0	110.4
801	D	31.9	Very low	33.5	Very low	133 Å²	133	153.5 Å²	153.5	71%	0.711	78%	0.784	S	S	*	*			trans	-76.4	174.8	-164.3	-56.8	-80.1	0	0	0	117.9
802	N	30.8	Very low	33.2	Very low	141 Å²	141	152.7 Å²	152.7	75%	0.754	79%	0.789	S	S	*	*			trans	98.8	101.6	147.6	-59.6	-46.3	0	0	0	120.8
803	E	30.1	Very low	33	Very low	179 Å²	179	155 Å²	155	84%	0.836	81%	0.805	S	S	*	*				60.1	65.7	109.9	-158.4	178.3	-133.8	0	0	119.2
804	L	31.9	Very low	32.7	Very low	167 Å²	167	151.3 Å²	151.3	87%	0.874	80%	0.8	S	S	*	*			trans	-161	98.1	134.8	-147.8	75.7	0	0	0	115
805	E	34.1	Very low	32.3	Very low	198 Å²	198	154.2 Å²	154.2	93%	0.925	80%	0.804	S	S	*	*			trans	-153	45.4	147.9	-140.4	175.3	-143.6	0	0	113.6
806	H	33.4	Very low	32.2	Very low	160 Å²	160	154.5 Å²	154.5	74%	0.741	81%	0.805	S	S	*	*			trans	-91	95.7	162.3	178	70.1	0	0	0	109.1
807	N	30.7	Very low	32.4	Very low	122 Å²	122	154.8 Å²	154.8	65%	0.652	81%	0.807	S	S	*	*			trans	162.8	82.5	140.4	-89.1	-55.4	0	0	0	113.8
808	Q	31.7	Very low	31.9	Very low	189 Å²	189	151.9 Å²	151.9	88%	0.883	80%	0.803	S	S	*	*	S	Bend	trans	-153.3	159.4	142.7	-109.4	157.3	40.9	0	0	109.9
809	I	34	Very low	31.7	Very low	168 Å²	168	152.7 Å²	152.7	86%	0.862	80%	0.802	S	S	*	*	S	Bend	trans	63.8	40.4	-172.6	-33.1	174.8	0	0	0	115
810	M	32.3	Very low	31.6	Very low	166 Å²	166	151.4 Å²	151.4	82%	0.818	80%	0.799	S	S	*	*			trans	-139.9	19.4	150.8	-85.5	-52.3	-56.2	0	0	112.8	V812	M810-V812 VanDerWaalsContact C-N 3.28Å; M810-V812 PolarHBondContact O-N 3.45Å; M810-V812 VanDerWaalsContact O-N 3.08Å
811	G	29	Very low	31.4	Very low	80 Å²	80	150.4 Å²	150.4	83%	0.825	80%	0.796	S	S	*	*			trans	-79	21.7	-169.9	0	0	0	0	0	117.4
812	V	34.4	Very low	31.2	Very low	132 Å²	132	152.2 Å²	152.2	80%	0.8	80%	0.8	S	S	*	*	S	Bend	trans	-137.2	82.1	179	-172	0	0	0	0	110.7	M810	M810-V812 VanDerWaalsContact C-N 3.28Å; M810-V812 PolarHBondContact O-N 3.45Å; M810-V812 VanDerWaalsContact O-N 3.08Å
813	L	31.5	Very low	31.1	Very low	176 Å²	176	152.9 Å²	152.9	92%	0.921	80%	0.803	S	S	*	*			trans	167.9	81.6	154.2	-95.9	169.5	0	0	0	107.2
814	N	29.7	Very low	31.2	Very low	129 Å²	129	151.7 Å²	151.7	69%	0.69	80%	0.801	S	S	*	*			trans	-128.6	124.3	-175	-163.6	-2	0	0	0	109.6
815	K	31.1	Very low	31.1	Very low	174 Å²	174	152.2 Å²	152.2	76%	0.757	80%	0.799	S	S	*	*			trans	57.6	105.8	170.6	-65.4	153.2	-172.1	-177.9	0	117.2
816	N	28.9	Very low	30.8	Very low	147 Å²	147	147.5 Å²	147.5	79%	0.786	79%	0.794	S	S	*	*				-151.9	161.6	114.4	-90.1	-19.6	0	0	0	108.7
817	D	35.3	Very low	30.6	Very low	152 Å²	152	149.1 Å²	149.1	81%	0.813	80%	0.799	S	S	*	*			trans	56.3	87.2	164.7	-47.6	-31.9	0	0	0	116.4
818	C	28.7	Very low	30.4	Very low	114 Å²	114	151.2 Å²	151.2	77%	0.77	81%	0.805	S	S	*	*			cis	97.5	147.3	32.5	-155.2	0	0	0	0	114.2
819	Q	28.7	Very low	30.4	Very low	162 Å²	162	148.5 Å²	148.5	76%	0.757	81%	0.805	S	S	*	*			trans	-61.5	149.9	-165.7	-64.9	106.9	-65.5	0	0	114.8
820	T	28.9	Very low	30	Very low	121 Å²	121	149.1 Å²	149.1	74%	0.742	80%	0.804	S	S	*	*				-179.1	162.5	89.9	33.5	0	0	0	0	109.7
821	N	32	Very low	30	Very low	148 Å²	148	148.9 Å²	148.9	79%	0.791	81%	0.807	S	S	*	*			cis	-147.9	152.3	-0.8	-121.3	-21.7	0	0	0	110.6
822	Q	28.8	Very low	30	Very low	171 Å²	171	149.6 Å²	149.6	80%	0.799	80%	0.799	S	S	*	*			trans	-120.9	156.7	163.2	-84.6	-171.1	-14.4	0	0	109.8
823	N	27.4	Very low	29.9	Very low	155 Å²	155	149.8 Å²	149.8	83%	0.829	80%	0.796	S	S	*	*			trans	84.5	123.2	-177.9	-53	-65.9	0	0	0	116.3
824	I	32.2	Very low	29.7	Very low	154 Å²	154	148.7 Å²	148.7	79%	0.79	79%	0.79	S	S	*	*				-146.5	122.5	112.8	-100.3	157	0	0	0	108.7
825	Q	30.5	Very low	29.8	Very low	178 Å²	178	149.2 Å²	149.2	83%	0.832	79%	0.791	S	S	*	*			trans	46.1	127.9	151.6	-58.5	176.1	0.6	0	0	121.1
826	A	26.9	Very low	29.6	Very low	99 Å²	99	147.5 Å²	147.5	82%	0.818	79%	0.79	S	S	*	*			trans	-77	152.5	166.3	0	0	0	0	0	112.6
827	K	29.9	Very low	29.9	Very low	195 Å²	195	150 Å²	150	85%	0.848	80%	0.795	S	S	*	*			trans	-154	156.6	139.4	-117.5	170.1	-173.7	178.1	0	112
828	Q	27.1	Very low	29.6	Very low	166 Å²	166	151.3 Å²	151.3	78%	0.776	80%	0.796	S	S	*	*			trans	-67.5	147.9	-173.4	-55.6	119	-63.7	0	0	112.4
829	C	30.9	Very low	29.7	Very low	132 Å²	132	152.6 Å²	152.6	89%	0.892	80%	0.795	S	S	*	*			trans	-155.6	102.8	131.9	-103.2	0	0	0	0	108.5
830	E	26.6	Very low	29.8	Very low	180 Å²	180	152.7 Å²	152.7	84%	0.841	80%	0.801	S	S	*	*			trans	-72.8	140.5	160.2	-62.4	168.3	128	0	0	108.1
831	N	31.5	Very low	29.9	Very low	162 Å²	162	153.6 Å²	153.6	87%	0.866	80%	0.8	S	S	*	*			trans	-160.4	146	140	-108.3	-37.2	0	0	0	111.8
832	S	28.9	Very low	29.6	Very low	94 Å²	94	154 Å²	154	66%	0.657	80%	0.802	S	S	*	*			trans	-91.1	-166.4	-178.1	58.6	0	0	0	0	112
833	N	32.4	Very low	29.5	Very low	137 Å²	137	151.4 Å²	151.4	73%	0.733	80%	0.802	S	S	*	*			trans	92.6	102.4	171.1	-43.5	-16.4	0	0	0	111.8
834	L	26.5	Very low	29.5	Very low	152 Å²	152	148.5 Å²	148.5	80%	0.796	79%	0.794	S	S	*	*				65.7	86.1	53.5	-166.1	81.7	0	0	0	112.2
835	I	32.5	Very low	29.4	Very low	141 Å²	141	148.6 Å²	148.6	72%	0.723	79%	0.791	S	S	*	*			trans	-141.3	114.4	154.2	-60.2	-177.9	0	0	0	106.8	F837	I835-F837 HydrophobicContact CG2-CD2 3.53Å; I835-F837 HydrophobicContact CG2-CE2 3.84Å
836	D	27.3	Very low	29.4	Very low	137 Å²	137	150 Å²	150	73%	0.733	79%	0.789	S	S	*	*			trans	-83.6	142.8	160.1	-62.5	-67.4	0	0	0	108.7
837	F	34.8	Very low	29.5	Very low	201 Å²	201	152.7 Å²	152.7	88%	0.882	79%	0.785	S	S	*	*			trans	-149	137.9	156.4	-94.6	-65.3	0	0	0	111.2	I835	I835-F837 HydrophobicContact CG2-CD2 3.53Å; I835-F837 HydrophobicContact CG2-CE2 3.84Å
838	E	29	Very low	29.5	Very low	178 Å²	178	149.2 Å²	149.2	83%	0.832	78%	0.776	S	S	*	*			trans	-87.7	164.6	-178.2	-62	172.4	124.4	0	0	112.1
839	D	30.6	Very low	29.8	Very low	142 Å²	142	148.8 Å²	148.8	76%	0.759	77%	0.774	S	S	*	*			trans	25.9	120.2	152.3	-64.9	-2.9	0	0	0	120.3
840	N	31.9	Very low	29.8	Very low	164 Å²	164	150.5 Å²	150.5	88%	0.877	77%	0.768	S	S	*	*			trans	-153.4	160.1	132.3	-114.6	-75.6	0	0	0	113.1
841	L	29.9	Very low	30	Very low	140 Å²	140	149.6 Å²	149.6	73%	0.733	77%	0.768	S	S	*	*			trans	-100.2	155.9	-168.4	-66.8	78	0	0	0	113.1
842	N	27	Very low	30.1	Very low	155 Å²	155	146.9 Å²	146.9	83%	0.829	76%	0.758	S	S	*	*			trans	64.6	150.8	163.2	-65.2	-16.4	0	0	0	115.9
843	C	26.7	Very low	30.3	Very low	118 Å²	118	149.5 Å²	149.5	80%	0.797	76%	0.764	S	S	*	*			cis	-148.4	177.5	27.9	-149.7	0	0	0	0	114.1
844	S	27	Very low	30.5	Very low	94 Å²	94	150.8 Å²	150.8	66%	0.657	77%	0.766	S	S	*	*			trans	-69.6	137.1	-177.9	51.9	0	0	0	0	115.5
845	H	29.5	Very low	30.8	Very low	156 Å²	156	152 Å²	152	72%	0.722	77%	0.772	S	S	*	*			trans	171.5	151.8	145.6	-97.3	-69.4	0	0	0	107.3
846	Y	30.9	Very low	30.8	Very low	206 Å²	206	154 Å²	154	81%	0.808	78%	0.778	S	S	*	*			cis	-130.3	176.7	6	-115.3	-79.5	0	0	0	111.3
847	H	28.5	Very low	31	Very low	156 Å²	156	156.5 Å²	156.5	72%	0.722	78%	0.782	S	S	*	*			trans	-118.4	175.5	-179.7	-152	-96.8	0	0	0	111.4
848	D	30.5	Very low	30.7	Very low	123 Å²	123	154.6 Å²	154.6	66%	0.658	78%	0.781	S	S	*	*			trans	77.9	158.4	167	-51.4	-48.1	0	0	0	117.2
849	H	33	Very low	30.8	Very low	157 Å²	157	152.6 Å²	152.6	73%	0.727	78%	0.78	S	S	*	*			cis	-149.9	136.3	14.1	-121.4	-58.8	0	0	0	111.2
850	H	31.6	Very low	30.9	Very low	168 Å²	168	151.4 Å²	151.4	78%	0.778	78%	0.783	S	S	*	*			trans	-168.4	95	137	-137.7	-83	0	0	0	114.3
851	L	30.7	Very low	30.9	Very low	161 Å²	161	152.5 Å²	152.5	84%	0.843	78%	0.783	S	S	*	*			trans	-164.5	97.6	165	-126.1	172.9	0	0	0	111
852	T	33.8	Very low	31.1	Very low	105 Å²	105	151.3 Å²	151.3	64%	0.644	79%	0.786	S	S	*	*			trans	-148.1	112.5	175.6	49.9	0	0	0	0	111.7
853	N	33.2	Very low	31.2	Very low	148 Å²	148	152.8 Å²	152.8	79%	0.791	79%	0.788	S	S	*	*				-174.9	162.3	122.5	-93.6	-7.9	0	0	0	110.4
854	E	35.9	Very low	31.5	Very low	165 Å²	165	155 Å²	155	77%	0.771	79%	0.786	S	S	*	*	S	Bend	trans	57.7	81.8	176.8	-56.2	-46.5	124.6	0	0	117.5
855	L	32.9	Very low	31.6	Very low	176 Å²	176	157 Å²	157	92%	0.921	79%	0.785	S	S	*	*				-172.9	107.2	105.2	-98.7	167	0	0	0	110.9
856	H	32.2	Very low	31.7	Very low	183 Å²	183	156.2 Å²	156.2	85%	0.847	78%	0.782	S	S	*	*			trans	-118.9	97.5	-171	-166.7	-144.8	0	0	0	111.5
857	K	32.6	Very low	31.7	Very low	191 Å²	191	154 Å²	154	83%	0.83	78%	0.779	S	S	*	*			trans	-179.8	144.3	146.3	-106.2	162.2	-173.9	-179.7	0	115.3
858	L	28.2	Very low	31.9	Very low	161 Å²	161	153.5 Å²	153.5	84%	0.843	78%	0.779	S	S	*	*			trans	65.1	83.1	156.5	-59.9	170.9	0	0	0	118.7
859	T	30.9	Very low	32	Very low	135 Å²	135	155.6 Å²	155.6	83%	0.828	78%	0.784	S	S	*	*				-158.1	115.1	117.1	36.1	0	0	0	0	109.9
860	S	32.6	Very low	31.7	Very low	118 Å²	118	156.4 Å²	156.4	83%	0.825	79%	0.789	S	S	*	*			trans	-133	103.3	164.4	56	0	0	0	0	107.5
861	H	31.7	Very low	31.7	Very low	187 Å²	187	154.2 Å²	154.2	87%	0.866	79%	0.789	S	S	*	*			trans	-82	129.2	174.3	-83.4	-86.1	0	0	0	109.8
862	S	34.1	Very low	31.5	Very low	114 Å²	114	151 Å²	151	80%	0.797	78%	0.78	S	S	*	*			trans	-136.6	126.4	162.7	58.4	0	0	0	0	108.4
863	E	28	Very low	31.6	Very low	186 Å²	186	153.7 Å²	153.7	87%	0.869	79%	0.789	S	S	*	*			trans	-56.5	138.3	-169.6	-60.1	147.5	147	0	0	114.2
864	H	33.6	Very low	31.3	Very low	164 Å²	164	152.9 Å²	152.9	76%	0.759	79%	0.785	S	S	*	*			trans	-159	110.6	136.2	-111.5	-73	0	0	0	111.1
865	E	28.5	Very low	31	Very low	137 Å²	137	151.5 Å²	151.5	64%	0.64	78%	0.782	S	S	*	*			trans	48.1	143.5	130.9	-74.4	-166.7	91.7	0	0	125.4
866	Q	32.4	Very low	30.9	Very low	140 Å²	140	148.8 Å²	148.8	65%	0.654	77%	0.773	S	S	*	*			trans	81.3	110.5	145.8	-72.2	166.5	44.5	0	0	121.1
867	Q	31.4	Very low	30.6	Very low	160 Å²	160	144.3 Å²	144.3	75%	0.748	76%	0.762	S	S	*	*			trans	56.9	108.3	136.3	-52.8	177	14.1	0	0	117.6
868	M	33	Very low	30.5	Very low	145 Å²	145	141.6 Å²	141.6	71%	0.714	77%	0.766	S	S	*	*				-172.2	147.7	74.3	-93.2	-63	-150.7	0	0	113.9
869	Q	32.3	Very low	30.4	Very low	166 Å²	166	140.7 Å²	140.7	78%	0.776	76%	0.76	S	S	*	*			trans	47.5	129.8	145.2	-71.1	163.1	-24.8	0	0	122.7
870	Q	25.9	Very low	30.3	Very low	175 Å²	175	140.4 Å²	140.4	82%	0.818	76%	0.759	S	S	*	*			trans	-75.6	173.6	160.8	-51.9	174.8	-4.5	0	0	110.8
871	P	31.7	Very low	30.2	Very low	121 Å²	121	138.9 Å²	138.9	79%	0.786	75%	0.748	S	S	*	*				-145.2	171.5	87.2	39.4	-24	0	0	0	115.6
872	S	26.8	Very low	30.2	Very low	94 Å²	94	136.8 Å²	136.8	66%	0.657	74%	0.741	S	S	*	*			trans	-102.2	139.4	175.9	48.9	0	0	0	0	113
873	I	35.1	Very low	29.8	Very low	161 Å²	161	138.2 Å²	138.2	83%	0.826	74%	0.74	S	S	*	*			trans	-147.4	113.3	170.4	-50.4	177.1	0	0	0	106
874	N	27.9	Very low	29.8	Very low	132 Å²	132	134.4 Å²	134.4	71%	0.706	73%	0.734	S	S	*	*			cis	94.1	131	10.7	-141.2	17.1	0	0	0	116.1
875	L	29	Very low	29.6	Very low	136 Å²	136	135.4 Å²	135.4	71%	0.712	74%	0.737	S	S	*	*			trans	74.3	112.1	170.1	-85.2	72.1	0	0	0	122.5
876	T	30.6	Very low	29.5	Very low	119 Å²	119	134.2 Å²	134.2	73%	0.73	74%	0.739	S	S	*	*				81.8	108.5	111.6	-55.9	0	0	0	0	123.4
877	S	27.2	Very low	29.4	Very low	89 Å²	89	135 Å²	135	62%	0.622	75%	0.747	S	S	*	*				36.9	132	126.3	-160.3	0	0	0	0	122.4
878	C	29.7	Very low	29.2	Very low	134 Å²	134	133.9 Å²	133.9	91%	0.905	75%	0.746	S	S	*	*			trans	-138.1	135.4	139.2	-87.7	0	0	0	0	110.4
879	I	25.5	Very low	29.1	Very low	142 Å²	142	132.5 Å²	132.5	73%	0.728	75%	0.751	S	S	*	*			trans	-105.2	168	172	-72.4	170.6	0	0	0	107.8
880	T	28.5	Very low	29	Very low	129 Å²	129	128.2 Å²	128.2	79%	0.791	74%	0.744	S	S	*	*			trans	70.1	151.2	175.7	25	0	0	0	0	114.6
881	S	30.6	Very low	29.3	Very low	86 Å²	86	130 Å²	130	60%	0.601	74%	0.744	S	S	*	*			cis	-157.2	151.1	17.6	-122.6	0	0	0	0	114.7
882	I	31.7	Very low	29.3	Very low	142 Å²	142	130.1 Å²	130.1	73%	0.728	74%	0.738	S	S	*	*			trans	60.1	118.5	138.5	-59.6	162	0	0	0	120.6
883	N	25.9	Very low	29.7	Very low	145 Å²	145	130.2 Å²	130.2	78%	0.775	74%	0.735	S	S	*	*			trans	1.5	136.6	143.4	-43.8	-15	0	0	0	119.6
884	S	29	Very low	29.6	Very low	106 Å²	106	129.6 Å²	129.6	74%	0.741	73%	0.733	S	S	*	*				169	134.2	117.2	-78.4	0	0	0	0	116.1
885	F	28.5	Very low	29.6	Very low	185 Å²	185	130.5 Å²	130.5	81%	0.811	74%	0.738	S	S	*	*			trans	48.8	102.3	144.1	-75.1	-92.5	0	0	0	122.7
886	T	27.9	Very low	29.7	Very low	112 Å²	112	131.9 Å²	131.9	69%	0.687	74%	0.743	S	S	*	*				44.8	149	119.5	61.4	0	0	0	0	123.4
887	L	29.8	Very low	29.7	Very low	156 Å²	156	132.6 Å²	132.6	82%	0.817	74%	0.742	S	S	*	*			trans	116.8	139.3	160.6	-68.1	168.1	0	0	0	113.2
888	N	27.8	Very low	29.8	Very low	137 Å²	137	135.3 Å²	135.3	73%	0.733	75%	0.748	S	S	*	*			cis	-163.1	173.7	-19	-156.6	-1	0	0	0	110.4
889	S	31	Very low	30	Very low	116 Å²	116	132.9 Å²	132.9	81%	0.811	73%	0.732	S	S	*	*			trans	101.8	132.4	169.3	-44.2	0	0	0	0	115.9
890	A	28.7	Very low	30.3	Very low	76 Å²	76	133.7 Å²	133.7	63%	0.628	73%	0.733	S	S	*	*			cis	160.4	167	-35.4	0	0	0	0	0	108.4
891	Y	32.4	Very low	30.3	Very low	212 Å²	212	133.8 Å²	133.8	83%	0.831	73%	0.729	S	S	*	*			trans	73.7	128.7	-176.4	-54.2	-76.2	0	0	0	116.1
892	N	32.3	Very low	30.4	Very low	124 Å²	124	136.2 Å²	136.2	66%	0.663	74%	0.735	S	S	*	*			cis	-162.5	144.7	-20.2	-131.8	32.9	0	0	0	111.7
893	T	34.5	Very low	30.5	Very low	96 Å²	96	135.7 Å²	135.7	59%	0.589	73%	0.733	S	S	*	*			trans	34.1	140	140	61.9	0	0	0	0	121.7
894	D	32.7	Very low	30.8	Very low	147 Å²	147	135.5 Å²	135.5	79%	0.786	73%	0.733	S	S	*	*			cis	-168.8	166.1	-5.1	-103.7	-25.9	0	0	0	111.1
895	N	27.6	Very low	31.1	Very low	152 Å²	152	136.8 Å²	136.8	81%	0.813	73%	0.731	S	S	*	*			trans	-117.1	130.8	168.9	-87.1	-54	0	0	0	111.6
896	M	32.9	Very low	31.4	Very low	164 Å²	164	134.1 Å²	134.1	81%	0.808	73%	0.725	S	S	*	*			trans	-143.6	124.2	163	-79.2	-76.8	142.6	0	0	107.8
897	L	29.1	Very low	31.7	Very low	134 Å²	134	134.9 Å²	134.9	70%	0.702	73%	0.725	S	S	*	*			cis	95.8	142.9	45.6	-90.5	165.7	0	0	0	113.8
898	I	30.8	Very low	31.9	Very low	147 Å²	147	134.4 Å²	134.4	75%	0.754	72%	0.723	S	S	*	*			trans	72.7	137.7	161.2	-62.5	152.7	0	0	0	115.6
899	S	32.5	Very low	32.4	Very low	83 Å²	83	132.5 Å²	132.5	58%	0.58	72%	0.721	S	S	*	*			cis	-163.1	151.2	-18.2	-108.9	0	0	0	0	113.4
900	Q	32	Very low	32.5	Very low	159 Å²	159	133.7 Å²	133.7	74%	0.743	72%	0.718	S	S	*	*			trans	38.6	128.3	133	-59.2	171.3	-34.4	0	0	123.6
901	N	28.1	Very low	32.9	Very low	131 Å²	131	135 Å²	135	70%	0.701	72%	0.723	S	S	*	*				59.6	127.2	128.8	-58.5	-4	0	0	0	122.5
902	N	33	Very low	32.9	Very low	136 Å²	136	132.7 Å²	132.7	73%	0.727	73%	0.725	S	S	*	*				178.5	151.2	93.4	-94.1	-48	0	0	0	114.3
903	N	34.4	Very low	32.8	Very low	131 Å²	131	134.5 Å²	134.5	70%	0.701	74%	0.735	S	S	*	*			trans	49.9	120.5	153.1	-58.9	-27.4	0	0	0	120
904	N	31.3	Very low	32.9	Very low	142 Å²	142	135.1 Å²	135.1	76%	0.759	74%	0.742	S	S	*	*				88.8	139.3	54.7	-81.8	-12.8	0	0	0	115.5
905	N	35.5	Very low	33.1	Very low	132 Å²	132	137.3 Å²	137.3	71%	0.706	75%	0.745	S	S	*	*			trans	88.3	103.4	157.8	-62.1	-3.2	0	0	0	121.1
906	N	34.2	Very low	33.2	Very low	130 Å²	130	137 Å²	137	70%	0.695	74%	0.743	S	S	*	*				100.6	127.3	114.9	-69.2	8.7	0	0	0	122.2
907	N	34.8	Very low	33.2	Very low	127 Å²	127	135.4 Å²	135.4	68%	0.679	74%	0.738	S	S	*	*			trans	72.1	110.3	146.4	-59.7	24.2	0	0	0	117
908	D	35.2	Very low	33.3	Very low	146 Å²	146	135.5 Å²	135.5	78%	0.781	74%	0.74	S	S	*	*				77.1	132.4	81.4	-65.4	-41	0	0	0	112.8
909	S	38	Very low	33.1	Very low	97 Å²	97	137.8 Å²	137.8	68%	0.678	74%	0.74	S	S	*	*			cis	-164.9	-172.9	-9.4	63.6	0	0	0	0	107
910	N	33.2	Very low	33	Very low	142 Å²	142	140.6 Å²	140.6	76%	0.759	75%	0.748	S	S	*	*			cis	-161.7	152.2	0.5	-131.7	-15.4	0	0	0	106.8
911	S	36.1	Very low	33	Very low	104 Å²	104	140.6 Å²	140.6	73%	0.727	75%	0.753	S	S	*	*	S	Bend	cis	-136.5	40.5	-15.4	-178.2	0	0	0	0	109.2
912	N	32.6	Very low	32.8	Very low	162 Å²	162	141.4 Å²	141.4	87%	0.866	76%	0.756	S	S	*	*			trans	-106	105.5	-177.5	-79.2	-48.6	0	0	0	110.5
913	N	31	Very low	32.8	Very low	163 Å²	163	143.4 Å²	143.4	87%	0.872	76%	0.761	S	S	*	*			trans	-130.4	98.4	178.6	-129.5	-14.6	0	0	0	111.8
914	S	35.7	Very low	32.7	Very low	108 Å²	108	141.9 Å²	141.9	76%	0.755	76%	0.756	S	S	*	*			trans	-107	115.4	164.5	174.5	0	0	0	0	108.4
915	K	37	Very low	32.5	Very low	194 Å²	194	142.4 Å²	142.4	84%	0.843	76%	0.759	S	S	*	*			trans	178.8	122.2	155	-98.6	146.1	-168	175.5	0	111.4
916	N	29.7	Very low	32.3	Very low	145 Å²	145	146 Å²	146	78%	0.775	77%	0.768	S	S	*	*			trans	-159.9	140.4	143.6	-114.6	-20.5	0	0	0	108.8
917	N	32.5	Very low	32.1	Very low	131 Å²	131	146.3 Å²	146.3	70%	0.701	77%	0.769	S	S	*	*			trans	32.7	110.9	147.1	-46.1	-24.5	0	0	0	116.9
918	N	32.2	Very low	31.7	Very low	136 Å²	136	150.7 Å²	150.7	73%	0.727	78%	0.777	S	S	*	*			cis	61.5	120.6	26.1	-127.2	21.1	0	0	0	114
919	Y	26.9	Very low	31.6	Very low	195 Å²	195	149.8 Å²	149.8	77%	0.765	77%	0.772	S	S	*	*			trans	70.7	146.7	-176.3	-58.1	-82	0	0	0	118.1
920	N	30.5	Very low	31.3	Very low	141 Å²	141	152.5 Å²	152.5	75%	0.754	77%	0.774	S	S	*	*			trans	62.6	119.1	163.6	-54.3	-17	0	0	0	116
921	L	30.3	Very low	31.3	Very low	159 Å²	159	152.3 Å²	152.3	83%	0.832	77%	0.773	S	S	*	*	S	Bend	cis	56.6	98.7	25.5	-143.3	79	0	0	0	112.5
922	L	25.4	Very low	31.4	Very low	148 Å²	148	151.4 Å²	151.4	78%	0.775	76%	0.757	S	S	*	*			trans	61	83.4	-169.7	-63.7	99.4	0	0	0	115.8
923	H	32.3	Very low	31.8	Very low	178 Å²	178	149.6 Å²	149.6	82%	0.824	74%	0.743	S	S	*	*			trans	-164.6	118.1	131.3	-103.5	65.7	0	0	0	106.3
924	T	32.1	Very low	32	Very low	99 Å²	99	148.8 Å²	148.8	61%	0.607	73%	0.734	S	S	*	*				81.4	113.7	51.8	66	0	0	0	0	115.4
925	N	27.6	Very low	32	Very low	154 Å²	154	147.7 Å²	147.7	82%	0.824	72%	0.72	S	S	*	*			trans	48.8	82.8	142.6	-56.4	-12.3	0	0	0	120.2
926	K	30.2	Very low	32.2	Very low	206 Å²	206	141.2 Å²	141.2	90%	0.896	70%	0.696	S	S	*	*			trans	-171.8	172.3	131.6	-108.1	167.6	-179.5	-179.4	0	111.8
927	I	30	Very low	32.8	Very low	138 Å²	138	138 Å²	138	71%	0.708	68%	0.682	S	S	*	*			trans	63.6	66.9	173.6	-35.8	-176.5	0	0	0	115.7
928	Y	27.4	Very low	33	Very low	218 Å²	218	137.1 Å²	137.1	86%	0.855	68%	0.677	S	S	*	*			trans	-143.1	63.6	140.8	-112.4	-83.8	0	0	0	107.2
929	L	31.8	Very low	33.2	Very low	127 Å²	127	134.9 Å²	134.9	67%	0.665	66%	0.664	S	S	*	*			trans	-152.1	51.2	-163.6	-138.8	172.4	0	0	0	111.9
930	E	32.8	Very low	34	Very low	155 Å²	155	130.7 Å²	130.7	72%	0.724	65%	0.653	S	S	*	*	S	Bend	trans	-136.1	-39.8	178.7	-104.2	163.4	-177.8	0	0	112.7	E932	E930-E932 PolarHBondContact O-N 2.98Å
931	N	32.6	Very low	34.5	Very low	138 Å²	138	129.2 Å²	129.2	74%	0.738	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.6	-16	-179.3	-74.8	-19.3	0	0	0	115.3	H933	N931-H933 VanDerWaalsContact C-N 3.32Å
932	E	39.2	Very low	34.6	Very low	85 Å²	85	130.5 Å²	130.5	40%	0.397	64%	0.64	S	S	.	*	H	α-helix	trans	-76.1	-20	177	-61.3	-156.7	149.6	0	0	113	N637 E930 Q934 T936	N637-E932 WeakPolarHBondContact CB-OE1 3.39Å; N637-E932 PolarHBondContact ND2-OE1 3.23Å; N637-E932 VanDerWaalsContact ND2-OE1 3.15Å; N637-E932 PolarHBondContact ND2-OE2 3.24Å; E930-E932 PolarHBondContact O-N 2.98Å; E932-Q934 PolarHBondContact O-N 3.46Å; E932-T936 PolarHBondContact O-N 3.2Å; E932-T936 PolarHBondContact O-OG1 3.49Å
933	H	39.5	Very low	35.3	Very low	123 Å²	123	127.6 Å²	127.6	57%	0.569	63%	0.629	S	S	*	*	H	α-helix	trans	-69.9	-30.5	-179.7	-92	-68.5	0	0	0	113.4	N931 T936 T937	N931-H933 VanDerWaalsContact C-N 3.32Å; H933-T936 WeakPolarHBondContact CA-OG1 3.42Å; H933-T936 PolarHBondContact O-OG1 3.11Å; H933-T936 VanDerWaalsContact O-OG1 3.09Å; H933-T937 PolarHBondContact O-N 3.34Å; H933-T937 PolarHBondContact O-OG1 3.36Å
934	Q	36	Very low	35.6	Very low	147 Å²	147	124.7 Å²	124.7	69%	0.687	62%	0.619	S	S	*	*	H	α-helix	trans	-82.7	-21.9	179	-72	-175.6	-7.2	0	0	114.1	E932 N938	E932-Q934 PolarHBondContact O-N 3.46Å; Q934-N938 PolarHBondContact O-ND2 3.41Å
935	L	35.8	Very low	36	Very low	85 Å²	85	129 Å²	129	45%	0.445	63%	0.63	S	S	.	*	H	α-helix	trans	-77.3	-39.1	169	-82	83.1	0	0	0	111.4	T636 N938 M939	T636-L935 HydrophobicContact CG2-CD2 4.3Å; T636-L935 WeakPolarHBondContact OG1-CD2 3.45Å; L935-N938 PolarHBondContact O-N 2.82Å; L935-M939 PolarHBondContact O-N 2.83Å
936	T	41.6	Very low	36.7	Very low	58 Å²	58	128 Å²	128	36%	0.356	62%	0.624	S	S	.	*	H	α-helix	trans	-66.9	-41.8	179.3	45.4	0	0	0	0	112.8	E932 H933 N938 M939 I940	E932-T936 PolarHBondContact O-N 3.2Å; E932-T936 PolarHBondContact O-OG1 3.49Å; H933-T936 WeakPolarHBondContact CA-OG1 3.42Å; H933-T936 PolarHBondContact O-OG1 3.11Å; H933-T936 VanDerWaalsContact O-OG1 3.09Å; T936-N938 VanDerWaalsContact C-N 3.28Å; T936-N938 PolarHBondContact O-N 3.19Å; T936-M939 PolarHBondContact O-N 3.06Å; T936-I940 WeakPolarHBondContact O-CG1 3.32Å; T936-I940 PolarHBondContact O-N 3.46Å
937	T	41.3	Very low	36.8	Very low	78 Å²	78	124.4 Å²	124.4	48%	0.479	61%	0.614	S	S	.	*	H	α-helix	trans	-60.2	-34	174.4	-59.1	0	0	0	0	113.2	H933 N941	H933-T937 PolarHBondContact O-N 3.34Å; H933-T937 PolarHBondContact O-OG1 3.36Å; T937-N941 PolarHBondContact O-ND2 2.91Å
938	N	37.4	Very low	37.1	Very low	111 Å²	111	125 Å²	125	59%	0.594	62%	0.619	S	S	*	*	H	α-helix	trans	-77.6	-28	178.6	-78.4	-56.6	0	0	0	113.5	Q934 L935 T936	Q934-N938 PolarHBondContact O-ND2 3.41Å; L935-N938 PolarHBondContact O-N 2.82Å; T936-N938 VanDerWaalsContact C-N 3.28Å; T936-N938 PolarHBondContact O-N 3.19Å
939	M	36.9	Very low	37.3	Very low	90 Å²	90	121.7 Å²	121.7	44%	0.443	62%	0.615	S	S	.	*	H	α-helix	trans	-70.7	-39.9	173.6	-75.7	-68.4	-63.5	0	0	112.5	S634 L935 T936 N941 Y942	S634-M939 VanDerWaalsContact O-CE 3.31Å; S634-M939 WeakPolarHBondContact O-CE 3.3Å; L935-M939 PolarHBondContact O-N 2.83Å; T936-M939 PolarHBondContact O-N 3.06Å; M939-N941 VanDerWaalsContact C-N 3.35Å; M939-N941 PolarHBondContact O-N 3.28Å; M939-Y942 PolarHBondContact O-N 2.71Å
940	I	44	Very low	37.3	Very low	106 Å²	106	122.2 Å²	122.2	54%	0.544	62%	0.623	S	S	.	*	H	α-helix	trans	-64.3	-37.8	-176.9	-68.1	165.3	0	0	0	111.8	T936 Y942 T943	T936-I940 WeakPolarHBondContact O-CG1 3.32Å; T936-I940 PolarHBondContact O-N 3.46Å; I940-Y942 PolarHBondContact O-N 2.91Å; I940-T943 PolarHBondContact O-N 3.22Å; I940-T943 PolarHBondContact O-OG1 3.18Å
941	N	39.3	Very low	37.2	Very low	110 Å²	110	122.3 Å²	122.3	59%	0.588	63%	0.628	S	S	*	*	H	α-helix	trans	-68.9	-11.6	177.9	-78.9	-42.6	0	0	0	114.6	T937 M939	T937-N941 PolarHBondContact O-ND2 2.91Å; M939-N941 VanDerWaalsContact C-N 3.35Å; M939-N941 PolarHBondContact O-N 3.28Å
942	Y	33	Very low	37	Very low	187 Å²	187	120.7 Å²	120.7	73%	0.733	63%	0.627	S	S	*	*	H	α-helix	trans	-89.8	-26.2	177.3	-111.6	-84	0	0	0	113.4	M939 I940	M939-Y942 PolarHBondContact O-N 2.71Å; I940-Y942 PolarHBondContact O-N 2.91Å
943	T	40.1	Very low	36.6	Very low	87 Å²	87	124.7 Å²	124.7	53%	0.534	65%	0.652	S	S	.	*	H	α-helix	trans	-75.2	-34.1	-176.8	37.2	0	0	0	0	114	I940 K945 L946	I940-T943 PolarHBondContact O-N 3.22Å; I940-T943 PolarHBondContact O-OG1 3.18Å; T943-K945 PolarHBondContact O-N 3.07Å; T943-L946 PolarHBondContact O-N 2.7Å
944	D	38.6	Very low	36	Very low	116 Å²	116	128.5 Å²	128.5	62%	0.62	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.9	-12.2	-176.2	-75.4	-19	0	0	0	114.5
945	K	41.2	Very low	35.7	Very low	189 Å²	189	128 Å²	128	82%	0.822	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.6	-7.5	178.5	-89.9	-177.1	174.5	176.5	0	115.5	T943	T943-K945 PolarHBondContact O-N 3.07Å
946	L	41.4	Very low	35.4	Very low	135 Å²	135	132.4 Å²	132.4	71%	0.707	70%	0.696	S	S	*	*	S	Bend	trans	-100.5	-14.1	-177.7	-70.5	172.9	0	0	0	114.6	T943 N948	T943-L946 PolarHBondContact O-N 2.7Å; L946-N948 VanDerWaalsContact C-N 3.25Å; L946-N948 PolarHBondContact O-N 3.26Å; L946-N948 VanDerWaalsContact O-N 3.14Å
947	N	33.8	Very low	34.8	Very low	130 Å²	130	135.1 Å²	135.1	70%	0.695	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.7	12.3	-172.9	-74.2	-32.3	0	0	0	115.8
948	N	35.1	Very low	34.4	Very low	151 Å²	151	138 Å²	138	81%	0.807	73%	0.731	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.3	16.1	-174.2	-88.4	-34.2	0	0	0	115.3	L946	L946-N948 VanDerWaalsContact C-N 3.25Å; L946-N948 PolarHBondContact O-N 3.26Å; L946-N948 VanDerWaalsContact O-N 3.14Å
949	L	32.6	Very low	34	Very low	147 Å²	147	138.9 Å²	138.9	77%	0.77	74%	0.736	S	S	*	*			trans	-110.6	75.7	177	-87.8	157.4	0	0	0	112	L951	L949-L951 PolarHBondContact O-N 3.41Å
950	V	30.5	Very low	33.6	Very low	138 Å²	138	141.1 Å²	141.1	84%	0.836	76%	0.759	S	S	*	*			trans	-79.8	111.5	170.5	177	0	0	0	0	109.6
951	L	31.3	Very low	32.9	Very low	157 Å²	157	144.5 Å²	144.5	82%	0.822	77%	0.77	S	S	*	*			trans	-131.1	109	168.2	-89.6	167.1	0	0	0	109.8	L949	L949-L951 PolarHBondContact O-N 3.41Å
952	S	28.3	Very low	32.6	Very low	104 Å²	104	145.8 Å²	145.8	73%	0.727	78%	0.782	S	S	*	*			trans	-82.7	135.1	175.7	61.6	0	0	0	0	111.4
953	N	30.2	Very low	32.6	Very low	170 Å²	170	144.2 Å²	144.2	91%	0.909	79%	0.786	S	S	*	*			trans	-149.5	145.5	153.1	-101.3	-41.8	0	0	0	111.5
954	K	27.7	Very low	32.1	Very low	203 Å²	203	146.7 Å²	146.7	88%	0.883	80%	0.801	S	S	*	*			trans	-95.6	137.7	-175.5	-59.7	171.7	-178.3	173.7	0	110.3
955	C	30.1	Very low	31.7	Very low	137 Å²	137	151.4 Å²	151.4	93%	0.926	81%	0.81	S	S	*	*			trans	-143.7	157.3	161	-102.3	0	0	0	0	111.2
956	H	29.1	Very low	31.4	Very low	177 Å²	177	149.3 Å²	149.3	82%	0.819	81%	0.806	S	S	*	*			trans	-75.7	148	-164.2	-110.2	-96.3	0	0	0	115.1
957	P	29.7	Very low	30.8	Very low	114 Å²	114	154.7 Å²	154.7	74%	0.74	83%	0.827	S	S	*	*			trans	-77.3	149.4	156.1	34.1	-33.2	0	0	0	110.9
958	V	33	Very low	30.7	Very low	138 Å²	138	155.9 Å²	155.9	84%	0.836	83%	0.834	S	S	*	*			trans	-129.3	143.1	172.3	178.3	0	0	0	0	109.2
959	N	27.3	Very low	30.4	Very low	131 Å²	131	156.2 Å²	156.2	70%	0.701	84%	0.835	S	S	*	*			trans	-70.4	136.2	-165.2	-64.3	-40.6	0	0	0	115	F961	N959-F961 HydrophobicContact CB-CD2 4.29Å
960	C	30.3	Very low	30.3	Very low	137 Å²	137	156.7 Å²	156.7	93%	0.926	84%	0.839	S	S	*	*			trans	-125.5	97.2	146.5	-79.5	0	0	0	0	109.4
961	F	29.2	Very low	30.3	Very low	176 Å²	176	157.8 Å²	157.8	77%	0.772	84%	0.839	S	S	*	*			trans	-86	119	170.1	-94.4	-101.3	0	0	0	110.3	N959	N959-F961 HydrophobicContact CB-CD2 4.29Å
962	T	32.9	Very low	30.3	Very low	138 Å²	138	157.8 Å²	157.8	85%	0.847	84%	0.84	S	S	*	*			trans	-146.1	138.2	146.4	-28.4	0	0	0	0	109.4
963	L	32.7	Very low	30.4	Very low	154 Å²	154	161.4 Å²	161.4	81%	0.806	85%	0.848	S	S	*	*			trans	-78.6	137.9	-169.9	-68.4	90.6	0	0	0	113.2
964	T	29.2	Very low	30.4	Very low	139 Å²	139	160.8 Å²	160.8	85%	0.853	84%	0.843	S	S	*	*			trans	-82.2	122.3	152.2	50.4	0	0	0	0	110
965	R	31.2	Very low	30.6	Very low	215 Å²	215	157.5 Å²	157.5	81%	0.811	84%	0.84	S	S	*	*			trans	-155.2	105	155	-154.3	165.7	-171.8	143.9	5.1	114.7
966	I	34.3	Very low	30.7	Very low	144 Å²	144	159.3 Å²	159.3	74%	0.738	83%	0.833	S	S	*	*			trans	51.6	106.3	142.8	-52.8	169.7	0	0	0	117.1
967	H	29.1	Very low	30.8	Very low	248 Å²	248	157.6 Å²	157.6	100%	1.148	83%	0.834	S	S	*	*				-134.9	0	105.3	-154	-47.9	0	0	0	109.2

Retrieved 967 of 967 residues in 121.2 ms (Link to these results)

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