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Protein no-on-transient A

Required for normal vision and courtship behavior in Drosophila.

AlphaFold DB , UniProt , Accession Q04047, Species DROME (Drosophila melanogaster, Fruit fly), Gene nonA, Length 700 aa.

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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	42	Very low	45.9	Very low	240 Å²	240	149.1 Å²	149.1	100%	1.182	86%	0.859	S	S	*	*				0	107.7	0	-66	158.4	174.5	0	0	105.8
2	E	42.7	Very low	45.6	Very low	180 Å²	180	144.6 Å²	144.6	84%	0.841	84%	0.836	S	S	*	*			cis	-142.2	170.5	0.7	-89.1	-177	85.3	0	0	112.2
3	S	42.5	Very low	45.6	Very low	107 Å²	107	148.9 Å²	148.9	75%	0.748	84%	0.844	S	S	*	*			trans	-17.3	124.4	164.7	-43.9	0	0	0	0	115.9
4	A	43.9	Very low	45.4	Very low	108 Å²	108	149.8 Å²	149.8	89%	0.893	84%	0.838	S	S	*	*				74.8	116.7	56	0	0	0	0	0	114.7
5	G	57.2	Low	44.8	Very low	82 Å²	82	149.3 Å²	149.3	85%	0.845	83%	0.832	S	S	*	*			trans	-152.8	131.3	168.1	0	0	0	0	0	109.7
6	K	45.4	Very low	45.2	Very low	185 Å²	185	148.4 Å²	148.4	80%	0.804	83%	0.834	S	S	*	*			trans	-118.4	145.4	-176.9	-70.7	-177.2	175.6	-175.2	0	111.4
7	Q	48.9	Very low	44.8	Very low	188 Å²	188	150 Å²	150	88%	0.879	83%	0.833	S	S	*	*			trans	-172.4	103.2	143.6	-100.8	154.6	19.3	0	0	105.7
8	D	41.9	Very low	45	Very low	126 Å²	126	153.8 Å²	153.8	67%	0.674	83%	0.833	S	S	*	*				68.2	97.9	68.9	-66.1	-49.1	0	0	0	113.8
9	N	49.5	Very low	45.1	Very low	178 Å²	178	154.2 Å²	154.2	95%	0.952	83%	0.829	S	S	*	*				-161	149	127.9	-105	-59.9	0	0	0	110.9
10	N	41.7	Very low	44.9	Very low	137 Å²	137	155.8 Å²	155.8	73%	0.733	83%	0.831	S	S	*	*			trans	-143.6	128.8	-166.7	174.4	15.8	0	0	0	111.2	T12	N10-T12 PolarHBondContact OD1-N 3.07Å; N10-T12 PolarHBondContact OD1-OG1 2.95Å
11	A	49	Very low	44.6	Very low	109 Å²	109	160.6 Å²	160.6	90%	0.901	84%	0.837	S	S	*	*			trans	-148.4	81.5	169.4	0	0	0	0	0	110.8
12	T	42.8	Very low	44.7	Very low	95 Å²	95	152.6 Å²	152.6	58%	0.583	82%	0.817	S	S	*	*			trans	-106.4	130.7	175.1	-55.7	0	0	0	0	110.8	N10 Q14	N10-T12 PolarHBondContact OD1-N 3.07Å; N10-T12 PolarHBondContact OD1-OG1 2.95Å; T12-Q14 HydrophobicContact CG2-CG 4.04Å
13	Q	46.1	Very low	44.6	Very low	201 Å²	201	151.3 Å²	151.3	94%	0.939	82%	0.815	S	S	*	*			trans	-131.7	141.9	159.9	-68.4	-167.9	10.8	0	0	110.1
14	Q	42	Very low	44.6	Very low	161 Å²	161	155.6 Å²	155.6	75%	0.752	82%	0.824	S	S	*	*			trans	-133.1	150	-176.3	-61.6	-178.8	16.7	0	0	111	T12	T12-Q14 HydrophobicContact CG2-CG 4.04Å
15	L	36.9	Very low	44.4	Very low	143 Å²	143	159.9 Å²	159.9	75%	0.749	83%	0.825	S	S	*	*			trans	18.4	145.9	153.9	-81.8	69.4	0	0	0	120.4
16	P	50.4	Low	43.9	Very low	135 Å²	135	161.2 Å²	161.2	88%	0.877	83%	0.828	S	S	*	*				-131.6	159.7	103.1	37	-30.2	0	0	0	114.7
17	Q	38.9	Very low	43.6	Very low	175 Å²	175	159.4 Å²	159.4	82%	0.818	83%	0.827	S	S	*	*			trans	-122	130.1	-175.6	177	-163.9	97	0	0	109.8
18	R	47.6	Very low	43.7	Very low	219 Å²	219	160.1 Å²	160.1	83%	0.826	83%	0.828	S	S	*	*			trans	-155.4	106.7	171.9	-158.4	171	-178.2	-177.5	1.5	118
19	Q	47.9	Very low	43.5	Very low	161 Å²	161	161.4 Å²	161.4	75%	0.752	83%	0.834	S	S	*	*			trans	59.2	154.4	140.2	-62.7	173.1	-42.9	0	0	122.5
20	Q	40.4	Very low	43.2	Very low	186 Å²	186	161.8 Å²	161.8	87%	0.869	84%	0.836	S	S	*	*			trans	-101	157	-162.7	-54.1	151.4	-18.8	0	0	113.8
21	R	39.7	Very low	43.1	Very low	256 Å²	256	158.6 Å²	158.6	97%	0.966	84%	0.835	S	S	*	*			trans	148	140.1	148.1	-84.1	165.7	-174.2	-151.2	2.5	109
22	G	42.5	Very low	42.8	Very low	73 Å²	73	163 Å²	163	75%	0.753	83%	0.834	S	S	*	*			cis	-173.1	178.6	-2.8	0	0	0	0	0	112.1
23	N	41.8	Very low	43	Very low	152 Å²	152	167.9 Å²	167.9	81%	0.813	85%	0.849	S	S	*	*			trans	-45.9	143.2	-171.6	-60.8	-11.9	0	0	0	118
24	Q	42	Very low	42.6	Very low	198 Å²	198	165.3 Å²	165.3	93%	0.925	84%	0.842	S	S	*	*				-169.8	165.5	105.4	-102.6	159.5	105.9	0	0	114.3
25	Q	40	Very low	43.1	Very low	198 Å²	198	162.2 Å²	162.2	93%	0.925	84%	0.844	S	S	*	*			trans	-103.6	144.8	-174.5	-63.9	170.9	-20	0	0	112
26	A	46.1	Very low	43.2	Very low	110 Å²	110	162.8 Å²	162.8	91%	0.909	84%	0.843	S	S	*	*			trans	-153.2	139.1	155.2	0	0	0	0	0	110.2
27	N	38.9	Very low	42.8	Very low	146 Å²	146	165 Å²	165	78%	0.781	84%	0.838	S	S	*	*			trans	-132.1	134.3	-179.5	-178.1	8.3	0	0	0	109.3
28	K	52	Low	43.1	Very low	204 Å²	204	165.4 Å²	165.4	89%	0.887	84%	0.841	S	S	*	*			trans	-166.1	129.1	171	-109.3	154.2	-172.4	177.4	0	112.5
29	N	38.2	Very low	42.7	Very low	152 Å²	152	161.8 Å²	161.8	81%	0.813	84%	0.838	S	S	*	*			trans	-83.8	143.6	169.9	-74.7	-40.2	0	0	0	111.6
30	L	41.9	Very low	42.6	Very low	187 Å²	187	161.3 Å²	161.3	98%	0.979	84%	0.84	S	S	*	*			trans	173.5	148.9	155.8	-94.6	150	0	0	0	106.7
31	G	40.9	Very low	42.7	Very low	69 Å²	69	157.9 Å²	157.9	71%	0.711	84%	0.837	S	S	*	*			cis	-166	175.6	-3.5	0	0	0	0	0	109.9
32	K	40.8	Very low	43	Very low	202 Å²	202	150.1 Å²	150.1	88%	0.878	83%	0.827	S	S	*	*			trans	-79.4	149.5	-176.9	-59.5	173.1	-178.8	175.2	0	112.4
33	H	48.6	Very low	43	Very low	198 Å²	198	154.5 Å²	154.5	92%	0.917	83%	0.833	S	S	*	*			trans	-140.7	165.6	150.4	-107.1	-84.9	0	0	0	111.4
34	N	38	Very low	43.1	Very low	147 Å²	147	150.2 Å²	150.2	79%	0.786	83%	0.825	S	S	*	*			trans	-145.9	137.1	-156.9	-177.5	26.6	0	0	0	111.9
35	A	50.7	Low	43.3	Very low	95 Å²	95	144.2 Å²	144.2	79%	0.785	82%	0.817	S	S	*	*			trans	-160.8	139.6	170	0	0	0	0	0	109.3
36	Q	40.8	Very low	43.7	Very low	156 Å²	156	141.4 Å²	141.4	73%	0.729	82%	0.815	S	S	*	*			cis	158.5	121.8	-37.4	179.3	179.3	22.7	0	0	106
37	K	41.5	Very low	43.6	Very low	180 Å²	180	140.6 Å²	140.6	78%	0.783	81%	0.809	S	S	*	*			trans	73.5	147.8	-176.5	-60.9	164.6	-177.1	-180	0	114.5
38	Q	44	Very low	44	Very low	185 Å²	185	143.3 Å²	143.3	86%	0.864	82%	0.817	S	S	*	*			cis	-134.1	169.8	11.6	-139.6	153.9	-8.9	0	0	111.8
39	N	39.2	Very low	43.7	Very low	143 Å²	143	142.8 Å²	142.8	77%	0.765	82%	0.815	S	S	*	*			trans	-102.2	167.2	-167.2	-70.6	-1.5	0	0	0	114.6
40	D	46.3	Very low	44.1	Very low	150 Å²	150	144.4 Å²	144.4	80%	0.802	82%	0.815	S	S	*	*			trans	136.8	130.7	138.5	-68.6	-9.6	0	0	0	111.1
41	S	41.9	Very low	44.1	Very low	114 Å²	114	144.1 Å²	144.1	80%	0.797	81%	0.808	S	S	*	*			cis	-147.9	175	-2	-91.4	0	0	0	0	111.4
42	A	46.3	Very low	43.8	Very low	93 Å²	93	152 Å²	152	77%	0.769	82%	0.816	S	S	*	*			trans	-76.8	177.6	-175.7	0	0	0	0	0	113.9
43	D	44	Very low	43.9	Very low	165 Å²	165	153 Å²	153	88%	0.882	82%	0.821	S	S	*	*			cis	-150.6	-173.8	-1.3	-149	29.5	0	0	0	107.9
44	G	42.2	Very low	43.5	Very low	62 Å²	62	146.9 Å²	146.9	64%	0.639	81%	0.811	S	S	*	*			cis	173.1	-179.3	7.7	0	0	0	0	0	113
45	G	47.6	Very low	43.5	Very low	73 Å²	73	143.6 Å²	143.6	75%	0.753	81%	0.813	S	S	*	*			trans	111.8	117.8	167.9	0	0	0	0	0	116.1
46	P	47.7	Very low	43.4	Very low	138 Å²	138	145.8 Å²	145.8	90%	0.896	82%	0.819	S	S	*	*			trans	-94.3	170.1	-169.8	37.1	-36.6	0	0	0	115.5
47	A	44.5	Very low	43.2	Very low	94 Å²	94	146 Å²	146	78%	0.777	83%	0.825	S	S	*	*			trans	-108.1	160.1	-174.5	0	0	0	0	0	114.3
48	E	47.4	Very low	43.3	Very low	202 Å²	202	140.6 Å²	140.6	94%	0.944	81%	0.814	S	S	*	*			trans	-110.3	154.1	158.3	-72.6	-154.9	99.1	0	0	111.9
49	K	44.9	Very low	43.2	Very low	193 Å²	193	140.4 Å²	140.4	84%	0.839	81%	0.813	S	S	*	*			trans	-127.7	150.3	-176.7	-68.3	176.4	177.5	174.1	0	110.5
50	K	46	Very low	43.2	Very low	187 Å²	187	140 Å²	140	81%	0.813	81%	0.811	S	S	*	*			trans	135.9	148.4	155.9	-78.5	160.7	-175.9	175.6	0	110.2
51	Q	42.8	Very low	43	Very low	180 Å²	180	141.6 Å²	141.6	84%	0.841	81%	0.813	S	S	*	*			cis	-156.4	157.1	-19	-121	165	-20.1	0	0	107.5
52	R	34.5	Very low	43	Very low	234 Å²	234	142.4 Å²	142.4	88%	0.883	81%	0.809	S	S	*	*			trans	-140.7	84.5	-175.6	-171.9	-172.9	-179.2	-125.5	2.9	113.5
53	F	42.8	Very low	42.8	Very low	225 Å²	225	144.6 Å²	144.6	99%	0.987	80%	0.803	S	S	*	*			trans	-162.5	148	162.8	-81.3	-77.5	0	0	0	105.9
54	G	39.9	Very low	42.6	Very low	68 Å²	68	139.1 Å²	139.1	70%	0.701	77%	0.774	S	S	*	*			cis	-170.2	164.6	-6.4	0	0	0	0	0	108.4
55	G	37.6	Very low	42.7	Very low	79 Å²	79	142.1 Å²	142.1	81%	0.814	77%	0.771	S	S	*	*			trans	-74.5	162.1	179.3	0	0	0	0	0	113.6
56	P	49.9	Very low	42.3	Very low	141 Å²	141	143.4 Å²	143.4	92%	0.916	76%	0.761	S	S	*	*				-131.9	-168	111.7	39.3	-31.5	0	0	0	113.7
57	N	35.8	Very low	42.1	Very low	159 Å²	159	144.9 Å²	144.9	85%	0.85	76%	0.756	S	S	*	*			trans	-121.2	171	-158.5	-173.4	21.5	0	0	0	112.8
58	A	45	Very low	41.9	Very low	68 Å²	68	147.3 Å²	147.3	56%	0.562	76%	0.756	S	S	*	*			trans	98	143.1	151.3	0	0	0	0	0	121.5
59	Q	40.9	Very low	41.4	Very low	180 Å²	180	141.6 Å²	141.6	84%	0.841	75%	0.752	S	S	*	*			trans	73.5	77.8	150.3	-72.2	160.4	-83.4	0	0	122
60	N	40	Very low	41	Very low	135 Å²	135	135.7 Å²	135.7	72%	0.722	75%	0.745	S	S	*	*				41.6	109.1	104.9	-177.1	32.3	0	0	0	119.9
61	Q	40.8	Very low	40.7	Very low	183 Å²	183	133.5 Å²	133.5	86%	0.855	75%	0.747	S	S	*	*				-171	113.3	122.3	-103.4	169.8	49.2	0	0	115.9
62	N	41.8	Very low	40.5	Very low	132 Å²	132	131.2 Å²	131.2	71%	0.706	75%	0.746	S	S	*	*			trans	5.6	153.9	146.1	-155	11.6	0	0	0	124.7
63	Q	42	Very low	40.7	Very low	138 Å²	138	124.1 Å²	124.1	65%	0.645	75%	0.746	S	S	*	*			trans	105	113	151.5	-54	-163.4	19.8	0	0	121.9	Q175	Q63-Q175 PolarHBondContact O-NE2 2.88Å
64	N	41.6	Very low	40.5	Very low	51 Å²	51	117.3 Å²	117.3	27%	0.273	74%	0.738	S	S	.	*				39	145.9	108.8	-63.3	-1.1	0	0	0	120.2	G176 N177	N64-G176 WeakPolarHBondContact CB-O 3.34Å; N64-G176 PolarHBondContact ND2-O 2.81Å; N64-G176 VanDerWaalsContact ND2-O 3.12Å; N64-G176 PolarHBondContact OD1-O 3.35Å; N64-N177 PolarHBondContact ND2-O 3.37Å; N64-N177 VanDerWaalsContact ND2-O 3.15Å
65	Q	43.3	Very low	40.3	Very low	124 Å²	124	118.2 Å²	118.2	58%	0.579	75%	0.748	S	S	*	*			cis	-153.2	173	28	-164.4	138.4	88.7	0	0	115.7	G174 Q175 G176 N177	Q65-G174 CarbonylContact O-C 3.54Å; Q65-Q175 CarbonylContact C-O 3.58Å; Q65-Q175 CarbonylContact O-C 3.45Å; Q65-Q175 PolarHBondContact O-N 2.81Å; Q65-G176 VanDerWaalsContact CA-N 3.32Å; Q65-G176 WeakPolarHBondContact CA-O 3.45Å; Q65-G176 WeakPolarHBondContact CG-O 3.49Å; Q65-G176 PolarHBondContact NE2-O 3.36Å; Q65-N177 PolarHBondContact NE2-O 3.49Å
66	N	40.1	Very low	40.2	Very low	100 Å²	100	117.9 Å²	117.9	54%	0.535	75%	0.745	S	S	.	*			trans	-84.1	156.9	-164.2	166	49.1	0	0	0	117.4	Q175	N66-Q175 WeakPolarHBondContact CA-O 3.46Å; N66-Q175 PolarHBondContact N-O 3.33Å
67	Q	43.1	Very low	39.7	Very low	170 Å²	170	115.8 Å²	115.8	79%	0.794	74%	0.739	S	S	*	*			trans	-169.9	121.1	132.1	-107.9	161.3	108.4	0	0	119.2
68	N	39.4	Very low	39.7	Very low	144 Å²	144	115.6 Å²	115.6	77%	0.77	74%	0.743	S	S	*	*			trans	58.5	134.6	132.9	-81.6	-15.4	0	0	0	126.1
69	G	36.6	Very low	39.3	Very low	83 Å²	83	116 Å²	116	86%	0.856	75%	0.754	S	S	*	*			trans	115.2	120	154.2	0	0	0	0	0	115
70	G	36.8	Very low	39.1	Very low	69 Å²	69	111.1 Å²	111.1	71%	0.711	75%	0.752	S	S	*	*			cis	167.7	168.9	-6.9	0	0	0	0	0	111.5
71	V	40.9	Very low	39.2	Very low	140 Å²	140	111 Å²	111	85%	0.848	76%	0.759	S	S	*	*			trans	70.4	141.3	168.6	-173.6	0	0	0	0	116.7
72	T	38.8	Very low	39.1	Very low	133 Å²	133	109.2 Å²	109.2	82%	0.816	76%	0.755	S	S	*	*				-164.6	149.5	-65	24.3	0	0	0	0	110.7
73	G	38.9	Very low	39.1	Very low	85 Å²	85	110.8 Å²	110.8	88%	0.876	76%	0.758	S	S	*	*			trans	105	134.7	162.8	0	0	0	0	0	116
74	G	37	Very low	38.8	Very low	81 Å²	81	110.9 Å²	110.9	84%	0.835	76%	0.763	S	S	*	*			cis	178.2	143.6	-11.1	0	0	0	0	0	115.5
75	G	36.5	Very low	38.8	Very low	87 Å²	87	116.4 Å²	116.4	90%	0.897	79%	0.785	S	S	*	*			trans	75.8	129.8	154.3	0	0	0	0	0	119.4
76	G	35.7	Very low	38.3	Very low	73 Å²	73	117.2 Å²	117.2	75%	0.753	79%	0.793	S	S	*	*			cis	163.3	143.7	-10.9	0	0	0	0	0	113.6
77	A	38.1	Very low	38.3	Very low	97 Å²	97	122.2 Å²	122.2	80%	0.802	81%	0.81	S	S	*	*			trans	52.9	127.5	169.1	0	0	0	0	0	118.5
78	V	37.5	Very low	37.9	Very low	154 Å²	154	117.1 Å²	117.1	93%	0.933	80%	0.803	S	S	*	*			cis	72.7	109.1	13.8	-163.8	0	0	0	0	116.2
79	G	36	Very low	37.6	Very low	77 Å²	77	117.5 Å²	117.5	79%	0.794	81%	0.805	S	S	*	*			trans	168.6	131.5	168.1	0	0	0	0	0	113.6
80	G	36.3	Very low	37.5	Very low	77 Å²	77	120 Å²	120	79%	0.794	80%	0.799	S	S	*	*			trans	-93.9	-159.6	172.7	0	0	0	0	0	113
81	P	42.5	Very low	37.6	Very low	132 Å²	132	126 Å²	126	86%	0.857	81%	0.806	S	S	*	*			cis	-138.7	-170	21	43.4	-24.6	0	0	0	116.4
82	N	38.5	Very low	37.2	Very low	146 Å²	146	123 Å²	123	78%	0.781	80%	0.803	S	S	*	*			trans	-57.5	133.6	177.4	177.4	15	0	0	0	115.3
83	Q	41.2	Very low	36.8	Very low	165 Å²	165	120.3 Å²	120.3	77%	0.771	80%	0.802	S	S	*	*			trans	-140.1	131.9	151.9	-76.1	-159.3	10.8	0	0	112.6
84	N	35.4	Very low	36.7	Very low	140 Å²	140	125.8 Å²	125.8	75%	0.749	80%	0.801	S	S	*	*			trans	-89.8	120.2	175.1	170.7	9.8	0	0	0	111.2	N86	N84-N86 PolarHBondContact OD1-N 3.18Å
85	K	42.1	Very low	36.6	Very low	168 Å²	168	128.7 Å²	128.7	73%	0.73	80%	0.803	S	S	*	*			trans	-139.9	75.9	166.7	-75.4	-169.4	179.6	169.5	0	113.9	F87	K85-F87 PolarHBondContact O-N 3.36Å
86	N	33.4	Very low	36.6	Very low	141 Å²	141	127.4 Å²	127.4	75%	0.754	79%	0.79	S	S	*	*			trans	11	100.4	133.6	-169.9	22	0	0	0	118.1	N84	N84-N86 PolarHBondContact OD1-N 3.18Å
87	F	39.8	Very low	36.5	Very low	205 Å²	205	130.8 Å²	130.8	90%	0.899	79%	0.79	S	S	*	*			trans	-143.2	142.5	146.6	-83.1	-85.8	0	0	0	106.9	K85	K85-F87 PolarHBondContact O-N 3.36Å
88	G	35.3	Very low	36.4	Very low	62 Å²	62	136.7 Å²	136.7	64%	0.639	79%	0.792	S	S	*	*			cis	140.2	90.7	2.8	0	0	0	0	0	110.2
89	N	32.9	Very low	36.3	Very low	152 Å²	152	135.3 Å²	135.3	81%	0.813	78%	0.779	S	S	*	*			trans	0.2	122	176.5	-66.2	-8.3	0	0	0	118.4
90	N	33.5	Very low	36.3	Very low	136 Å²	136	142.2 Å²	142.2	73%	0.727	78%	0.781	S	S	*	*				-174.8	151.3	108.4	-105.3	-67.4	0	0	0	115.3
91	K	38.2	Very low	36.3	Very low	196 Å²	196	144.4 Å²	144.4	85%	0.852	78%	0.775	S	S	*	*			trans	51.2	136.3	146.3	-67.8	167.2	-175.2	179.1	0	120.7
92	G	34.3	Very low	36	Very low	76 Å²	76	145.5 Å²	145.5	78%	0.784	77%	0.774	S	S	*	*			trans	124.2	66.2	150.4	0	0	0	0	0	114.9
93	G	29.8	Very low	35.9	Very low	77 Å²	77	144.9 Å²	144.9	79%	0.794	77%	0.77	S	S	*	*			trans	-69.3	135	166.6	0	0	0	0	0	110.8
94	F	37.1	Very low	35.6	Very low	199 Å²	199	149 Å²	149	87%	0.873	78%	0.778	S	S	*	*			trans	-133.9	98.2	166	-122.9	-81.5	0	0	0	110.8	G96	F94-G96 VanDerWaalsContact C-N 3.27Å; F94-G96 PolarHBondContact O-N 3.18Å
95	V	34.2	Very low	35.6	Very low	143 Å²	143	147.3 Å²	147.3	87%	0.867	79%	0.785	S	S	*	*			trans	-72.9	84.5	171.8	-178.1	0	0	0	0	108.2	N97	V95-N97 PolarHBondContact O-N 2.84Å
96	G	37	Very low	35.4	Very low	60 Å²	60	143 Å²	143	62%	0.619	79%	0.787	S	S	*	*			trans	-90.8	45.4	-172	0	0	0	0	0	114.8	F94 R98	F94-G96 VanDerWaalsContact C-N 3.27Å; F94-G96 PolarHBondContact O-N 3.18Å; G96-R98 PolarHBondContact O-N 3.06Å
97	N	34.3	Very low	35.5	Very low	143 Å²	143	142.9 Å²	142.9	77%	0.765	79%	0.787	S	S	*	*			trans	-61.2	108.1	-175.5	-168.4	0.6	0	0	0	111	V95 N99	V95-N97 PolarHBondContact O-N 2.84Å; N97-N99 PolarHBondContact O-N 2.85Å
98	R	35.3	Very low	35.7	Very low	222 Å²	222	142.1 Å²	142.1	84%	0.838	79%	0.786	S	S	*	*			trans	-84.4	49.3	-160.4	-159.2	-179.7	-71.4	176.4	-2.6	113.3	G96 R100	G96-R98 PolarHBondContact O-N 3.06Å; R98-R100 PolarHBondContact O-N 3.35Å; R98-R100 VanDerWaalsContact O-N 3.08Å
99	N	35.1	Very low	35.6	Very low	124 Å²	124	145.3 Å²	145.3	66%	0.663	79%	0.788	S	S	*	*			trans	-73.1	95.7	-177.6	-168.7	-2.1	0	0	0	111.4	N97 N101	N97-N99 PolarHBondContact O-N 2.85Å; N99-N101 PolarHBondContact O-N 3.37Å
100	R	35.8	Very low	35.8	Very low	223 Å²	223	149.4 Å²	149.4	84%	0.842	79%	0.792	S	S	*	*			trans	-73.9	67.2	177.8	-76.5	-173.3	174.1	170.1	-1.3	112.2	R98 N102	R98-R100 PolarHBondContact O-N 3.35Å; R98-R100 VanDerWaalsContact O-N 3.08Å; R100-N102 PolarHBondContact O-N 3.07Å; R100-N102 VanDerWaalsContact O-N 3.08Å
101	N	37.1	Very low	35.8	Very low	123 Å²	123	148.8 Å²	148.8	66%	0.658	79%	0.794	S	S	*	*			trans	-82.8	82.4	177.6	-156.4	3.1	0	0	0	110.9	N99 N103	N99-N101 PolarHBondContact O-N 3.37Å; N101-N103 VanDerWaalsContact C-N 3.32Å; N101-N103 PolarHBondContact O-N 3.06Å
102	N	36.1	Very low	35.9	Very low	155 Å²	155	149 Å²	149	83%	0.829	80%	0.795	S	S	*	*			trans	-72.2	79.1	-179.7	-95	5.5	0	0	0	112.1	R100	R100-N102 PolarHBondContact O-N 3.07Å; R100-N102 VanDerWaalsContact O-N 3.08Å
103	N	36.3	Very low	36.2	Very low	133 Å²	133	151.2 Å²	151.2	71%	0.711	80%	0.795	S	S	*	*			trans	-131	88.3	168.3	-101.3	-13.4	0	0	0	109.7	N101	N101-N103 VanDerWaalsContact C-N 3.32Å; N101-N103 PolarHBondContact O-N 3.06Å
104	R	33.7	Very low	36.5	Very low	250 Å²	250	151.2 Å²	151.2	94%	0.943	80%	0.795	S	S	*	*			trans	-150.5	79.3	173.2	-161.5	177.6	-169.5	-178	3.7	112.6
105	A	36	Very low	36.6	Very low	106 Å²	106	148.6 Å²	148.6	88%	0.876	79%	0.791	S	S	*	*			trans	-135.7	45.6	169.4	0	0	0	0	0	110.7	N107	A105-N107 PolarHBondContact O-N 2.99Å
106	G	38.1	Very low	36.8	Very low	76 Å²	76	148.2 Å²	148.2	78%	0.784	78%	0.784	S	S	*	*			trans	-75.6	108	175.2	0	0	0	0	0	111.2
107	N	34.7	Very low	36.9	Very low	139 Å²	139	152.4 Å²	152.4	74%	0.743	79%	0.792	S	S	*	*			trans	-28.5	127.1	169.1	173.9	15.5	0	0	0	115.5	A105 N109	A105-N107 PolarHBondContact O-N 2.99Å; N107-N109 PolarHBondContact OD1-N 3.29Å
108	Q	44.6	Very low	37.3	Very low	189 Å²	189	150.4 Å²	150.4	88%	0.883	79%	0.787	S	S	*	*			trans	-157	89.9	144.3	-115.2	165.7	42.4	0	0	113.4
109	N	33.5	Very low	37.5	Very low	130 Å²	130	146.2 Å²	146.2	70%	0.695	78%	0.781	S	S	*	*			trans	17.8	116.7	141.3	-168.6	11.5	0	0	0	118.9	N107	N107-N109 PolarHBondContact OD1-N 3.29Å
110	R	37.8	Very low	37.9	Very low	238 Å²	238	146.9 Å²	146.9	90%	0.898	78%	0.78	S	S	*	*			trans	-136.9	126	149	-75.1	-162.8	-173.5	-171.8	4.2	111.5
111	T	33.7	Very low	38	Very low	122 Å²	122	144.6 Å²	144.6	75%	0.748	78%	0.776	S	S	*	*			trans	-68.7	146.4	172.6	29.1	0	0	0	0	112.9
112	F	39.5	Very low	38.2	Very low	201 Å²	201	143.8 Å²	143.8	88%	0.882	78%	0.778	S	S	*	*			trans	-117.8	124.8	154.4	-90.1	-89	0	0	0	108.2
113	P	41.5	Very low	38.4	Very low	122 Å²	122	143 Å²	143	79%	0.792	77%	0.774	S	S	*	*			trans	-77.8	136.3	164.5	32.4	-31.1	0	0	0	109.3
114	G	34.4	Very low	38.5	Very low	77 Å²	77	141.9 Å²	141.9	79%	0.794	77%	0.768	S	S	*	*			trans	-87.9	168.9	171.5	0	0	0	0	0	112.2
115	N	39.8	Very low	38.8	Very low	145 Å²	145	137.6 Å²	137.6	78%	0.775	76%	0.758	S	S	*	*			trans	-148.8	145.7	152.7	-153.6	7	0	0	0	111.6
116	N	38.1	Very low	39	Very low	135 Å²	135	138.2 Å²	138.2	72%	0.722	75%	0.751	S	S	*	*			trans	-21.8	152.9	171.5	-57.2	-21.5	0	0	0	117.1
117	N	40	Very low	39	Very low	147 Å²	147	139.1 Å²	139.1	79%	0.786	75%	0.746	S	S	*	*				-163.4	141	53.5	-160.4	30.7	0	0	0	114.1
118	P	41.9	Very low	39.2	Very low	102 Å²	102	141.6 Å²	141.6	66%	0.662	75%	0.75	S	S	*	*			trans	-103.5	154.9	177.1	38.1	-32.6	0	0	0	114.1
119	N	40.9	Very low	39	Very low	134 Å²	134	136.1 Å²	136.1	72%	0.717	74%	0.737	S	S	*	*			trans	-166.2	132.8	156.2	-117.2	-28	0	0	0	113.9
120	Q	42	Very low	39.3	Very low	138 Å²	138	137.7 Å²	137.7	65%	0.645	75%	0.745	S	S	*	*			trans	40.6	141	142	-63.9	177.3	73.9	0	0	121
121	K	39.3	Very low	39.3	Very low	174 Å²	174	129.5 Å²	129.5	76%	0.757	74%	0.735	S	S	*	*			cis	-161.9	162.6	5.5	-120.3	165.4	179	157	0	110.2
122	P	41.3	Very low	39.9	Very low	107 Å²	107	129.3 Å²	129.3	70%	0.695	74%	0.736	S	S	*	*			trans	-101.5	-166.6	-179.4	40.1	-33.9	0	0	0	114.3
123	N	38.8	Very low	40	Very low	138 Å²	138	127.8 Å²	127.8	74%	0.738	74%	0.737	S	S	*	*			trans	88.7	148	178.3	-56.9	10.9	0	0	0	114.3
124	N	38.7	Very low	39.9	Very low	109 Å²	109	125.2 Å²	125.2	58%	0.583	73%	0.726	S	S	*	*			cis	-160.4	159.4	-8.4	-122.3	19.5	0	0	0	111.1
125	E	40.2	Very low	40.1	Very low	161 Å²	161	129.7 Å²	129.7	75%	0.752	73%	0.73	S	S	*	*			trans	60.7	159.9	145.8	-66.8	162.8	141.1	0	0	118.6
126	T	39.5	Very low	40.1	Very low	118 Å²	118	126 Å²	126	72%	0.724	72%	0.72	S	S	*	*			cis	-151.7	157	3.5	-11.9	0	0	0	0	111.2
127	S	39.6	Very low	40.3	Very low	96 Å²	96	128.4 Å²	128.4	67%	0.671	72%	0.724	S	S	*	*			trans	15.4	156.5	140.6	76.4	0	0	0	0	122.4
128	K	38.4	Very low	40.3	Very low	191 Å²	191	127.4 Å²	127.4	83%	0.83	72%	0.719	S	S	*	*			cis	-176.1	164.4	17.8	-137	172.2	-173.9	-178.9	0	111.1
129	A	40	Very low	40.2	Very low	74 Å²	74	129.6 Å²	129.6	61%	0.612	73%	0.725	S	S	*	*			trans	60	163.9	145	0	0	0	0	0	120.1
130	D	40.3	Very low	40.2	Very low	163 Å²	163	131.9 Å²	131.9	87%	0.872	73%	0.731	S	S	*	*			cis	-167.7	168.7	-33.1	-87	-36.2	0	0	0	106
131	G	37.7	Very low	40.4	Very low	66 Å²	66	130.5 Å²	130.5	68%	0.68	73%	0.734	S	S	*	*			cis	-171.7	-172.9	3.4	0	0	0	0	0	111.1
132	P	46.7	Very low	40.4	Very low	118 Å²	118	126.1 Å²	126.1	77%	0.766	73%	0.731	S	S	*	*			trans	-107.6	151.4	-163.2	38.6	-34	0	0	0	116.9
133	N	40.1	Very low	40.4	Very low	169 Å²	169	128.3 Å²	128.3	90%	0.904	74%	0.742	S	S	*	*			trans	171.4	163.6	158	-94.8	-25.9	0	0	0	110.4
134	A	40.2	Very low	40.2	Very low	67 Å²	67	126.7 Å²	126.7	55%	0.554	75%	0.749	S	S	*	*			cis	-172.6	164.5	-22.5	0	0	0	0	0	111.7
135	L	38.7	Very low	40.3	Very low	171 Å²	171	126 Å²	126	90%	0.895	76%	0.758	S	S	*	*			trans	65.3	161.9	157.9	-60.5	146.8	0	0	0	118.9
136	A	40.5	Very low	40.2	Very low	68 Å²	68	123.4 Å²	123.4	56%	0.562	76%	0.764	S	S	*	*			cis	-174.4	164.7	-38.8	0	0	0	0	0	110.7
137	K	40.9	Very low	40.2	Very low	186 Å²	186	121.4 Å²	121.4	81%	0.809	77%	0.766	S	S	*	*			trans	73.2	150.9	163.7	-56.9	178.6	-175.9	175.7	0	116.5
138	N	40.4	Very low	40.3	Very low	126 Å²	126	126.4 Å²	126.4	67%	0.674	78%	0.779	S	S	*	*			cis	-162.1	157.7	-11.8	-111.5	12.5	0	0	0	112.4
139	N	40.8	Very low	40.2	Very low	147 Å²	147	124.8 Å²	124.8	79%	0.786	78%	0.78	S	S	*	*			trans	73.2	130.1	146.6	-64.9	18.7	0	0	0	124
140	E	41.2	Very low	40.3	Very low	182 Å²	182	131 Å²	131	85%	0.85	80%	0.796	S	S	*	*			trans	-82.5	-161.4	166.7	-57.9	174.1	93.4	0	0	112.5
141	P	46.2	Very low	40.3	Very low	109 Å²	109	127.5 Å²	127.5	71%	0.708	79%	0.79	S	S	*	*				-136.6	-171.7	-64	38.8	-21.6	0	0	0	114.2
142	A	38.9	Very low	40.4	Very low	83 Å²	83	131.2 Å²	131.2	69%	0.686	79%	0.794	S	S	*	*			trans	68.5	138.2	145.4	0	0	0	0	0	121.9
143	T	39.8	Very low	40.2	Very low	152 Å²	152	134 Å²	134	93%	0.933	80%	0.797	S	S	*	*				173.3	169.7	124.6	30.8	0	0	0	0	111
144	A	36.5	Very low	40.2	Very low	105 Å²	105	134 Å²	134	87%	0.868	80%	0.797	S	S	*	*			trans	-144.5	142	-177.3	0	0	0	0	0	113.7
145	A	39.9	Very low	40.2	Very low	95 Å²	95	134.6 Å²	134.6	79%	0.785	80%	0.802	S	S	*	*			trans	-161.3	140.5	162.8	0	0	0	0	0	107.1
146	A	37.6	Very low	40.1	Very low	106 Å²	106	133 Å²	133	88%	0.876	79%	0.794	S	S	*	*			cis	74.7	99.2	37.9	0	0	0	0	0	113.3
147	G	38.9	Very low	40.1	Very low	75 Å²	75	139.2 Å²	139.2	77%	0.773	81%	0.808	S	S	*	*			trans	-168.9	58.6	-168.7	0	0	0	0	0	118.9
148	Q	42.6	Very low	40	Very low	202 Å²	202	134 Å²	134	94%	0.944	81%	0.807	S	S	*	*			trans	64.1	149.2	146.7	-62.6	-178.9	-12.4	0	0	122.7
149	N	36.7	Very low	40	Very low	156 Å²	156	136.8 Å²	136.8	83%	0.834	82%	0.816	S	S	*	*			trans	-82.6	159.6	175.4	-55.2	-59.4	0	0	0	112.8
150	Q	42.2	Very low	39.9	Very low	204 Å²	204	135.9 Å²	135.9	95%	0.953	81%	0.811	S	S	*	*			trans	-156.5	161.3	131	-115.6	171.3	57.4	0	0	111.7
151	A	39.2	Very low	40	Very low	91 Å²	91	136 Å²	136	75%	0.752	81%	0.812	S	S	*	*			trans	-144.1	144.4	-171.2	0	0	0	0	0	113
152	N	39.9	Very low	39.7	Very low	144 Å²	144	141.3 Å²	141.3	77%	0.77	82%	0.818	S	S	*	*			trans	-162.8	128.7	154.8	-93.5	-33	0	0	0	106.5
153	Q	43.3	Very low	39.7	Very low	176 Å²	176	146.9 Å²	146.9	82%	0.822	83%	0.83	S	S	*	*				58.7	95.1	65.7	-63.9	-163.7	53.5	0	0	114.1
154	N	40.8	Very low	39.7	Very low	170 Å²	170	143 Å²	143	91%	0.909	82%	0.821	S	S	*	*				-164.4	170.5	111.1	-130.3	-43.9	0	0	0	112.3
155	A	38.3	Very low	40	Very low	78 Å²	78	147.7 Å²	147.7	65%	0.645	82%	0.824	S	S	*	*			trans	-144.3	145.3	-179.9	0	0	0	0	0	112.8
156	N	38.5	Very low	39.9	Very low	139 Å²	139	149.6 Å²	149.6	74%	0.743	82%	0.822	S	S	*	*			trans	-166.4	137	148	-112.2	-38.2	0	0	0	116.2
157	K	39.2	Very low	40.1	Very low	197 Å²	197	153.3 Å²	153.3	86%	0.857	82%	0.821	S	S	*	*			trans	7	141.5	142.8	-56	163.7	-164.8	167.4	0	120.7
158	G	39.1	Very low	40.1	Very low	76 Å²	76	155.6 Å²	155.6	78%	0.784	82%	0.815	S	S	*	*			trans	-157.3	140.9	158.3	0	0	0	0	0	113
159	Q	41.4	Very low	40	Very low	185 Å²	185	153.9 Å²	153.9	86%	0.864	81%	0.807	S	S	*	*			trans	-74.5	157.2	-176.1	-72.3	136.9	-31.7	0	0	113.2
160	N	38.2	Very low	40	Very low	128 Å²	128	152.5 Å²	152.5	68%	0.684	80%	0.8	S	S	*	*			cis	93.8	102.8	26.8	180	45.1	0	0	0	116.5
161	Q	41.8	Very low	39.9	Very low	185 Å²	185	150.5 Å²	150.5	86%	0.864	79%	0.791	S	S	*	*			trans	-171.6	134.9	154.2	-102	155.7	85.4	0	0	107.5
162	R	40.1	Very low	39.9	Very low	220 Å²	220	151.3 Å²	151.3	83%	0.83	79%	0.786	S	S	*	*			cis	88.9	93.9	25.2	-86.9	-162.5	168.9	-157.8	-0.6	117.8
163	Q	40.1	Very low	39.8	Very low	200 Å²	200	153.2 Å²	153.2	94%	0.935	79%	0.79	S	S	*	*			trans	177.3	145.8	138.5	-99.8	163.1	73.2	0	0	109.4
164	G	39.6	Very low	39.4	Very low	72 Å²	72	147.8 Å²	147.8	74%	0.742	78%	0.781	S	S	*	*			cis	136.5	97.4	-24.2	0	0	0	0	0	116.2
165	Q	41.7	Very low	39.3	Very low	202 Å²	202	145.6 Å²	145.6	94%	0.944	77%	0.765	S	S	*	*			trans	-161	157.5	154.4	-113.5	169	28.8	0	0	112.8
166	N	38	Very low	39.2	Very low	136 Å²	136	142.7 Å²	142.7	73%	0.727	74%	0.743	S	S	*	*			trans	-162.7	140.2	-165.4	179.2	20.2	0	0	0	111.9
167	Q	41.7	Very low	39.2	Very low	184 Å²	184	142.5 Å²	142.5	86%	0.86	74%	0.742	S	S	*	*			trans	177.3	122.6	168.2	-102.3	153	85	0	0	107.7
168	N	39.8	Very low	39.2	Very low	122 Å²	122	141.4 Å²	141.4	65%	0.652	74%	0.74	S	S	*	*			cis	93.7	94	5.6	-164	34	0	0	0	119.3
169	Q	40.3	Very low	39.2	Very low	167 Å²	167	141.8 Å²	141.8	78%	0.78	74%	0.744	S	S	*	*			trans	-177.6	130.3	138.4	-97.4	151.7	101.7	0	0	109.1
170	N	37.7	Very low	39	Very low	127 Å²	127	136.7 Å²	136.7	68%	0.679	74%	0.741	S	S	*	*				51.1	135.3	95.6	-70.4	-25.2	0	0	0	115.2
171	Q	39.4	Very low	39.6	Very low	162 Å²	162	137.3 Å²	137.3	76%	0.757	75%	0.752	S	S	*	*			cis	-174.8	167.7	-0.1	-111.8	171.2	54.8	0	0	108
172	V	38.4	Very low	39.5	Very low	107 Å²	107	132.2 Å²	132.2	65%	0.648	75%	0.749	S	S	*	*			cis	-165.6	159.3	-9.6	74.7	0	0	0	0	110.6
173	H	37.6	Very low	39.6	Very low	184 Å²	184	128.8 Å²	128.8	85%	0.852	75%	0.747	S	S	*	*			trans	60.9	174.4	170.8	-75.7	106.8	0	0	0	117.5
174	G	36.1	Very low	39.8	Very low	63 Å²	63	127.9 Å²	127.9	65%	0.649	74%	0.743	S	S	*	*			cis	130.6	141.4	-1.7	0	0	0	0	0	111.6	Q65	Q65-G174 CarbonylContact O-C 3.54Å
175	Q	37.3	Very low	39.8	Very low	123 Å²	123	128.2 Å²	128.2	58%	0.575	75%	0.747	S	S	*	*			cis	-149.5	-115.7	6.1	-163	-169.3	116.9	0	0	113.6	Q63 Q65 N66	Q63-Q175 PolarHBondContact O-NE2 2.88Å; Q65-Q175 CarbonylContact C-O 3.58Å; Q65-Q175 CarbonylContact O-C 3.45Å; Q65-Q175 PolarHBondContact O-N 2.81Å; N66-Q175 WeakPolarHBondContact CA-O 3.46Å; N66-Q175 PolarHBondContact N-O 3.33Å
176	G	36.7	Very low	39.7	Very low	17 Å²	17	122.5 Å²	122.5	18%	0.175	74%	0.742	C	S	.	*			trans	-155.4	-156.4	-172.1	0	0	0	0	0	124.2	N64 Q65	N64-G176 WeakPolarHBondContact CB-O 3.34Å; N64-G176 PolarHBondContact ND2-O 2.81Å; N64-G176 VanDerWaalsContact ND2-O 3.12Å; N64-G176 PolarHBondContact OD1-O 3.35Å; Q65-G176 VanDerWaalsContact CA-N 3.32Å; Q65-G176 WeakPolarHBondContact CA-O 3.45Å; Q65-G176 WeakPolarHBondContact CG-O 3.49Å; Q65-G176 PolarHBondContact NE2-O 3.36Å
177	N	38.8	Very low	39.9	Very low	135 Å²	135	121.1 Å²	121.1	72%	0.722	75%	0.749	S	S	*	*			trans	44.2	158.4	158.9	-141	11.1	0	0	0	128.8	N64 Q65	N64-N177 PolarHBondContact ND2-O 3.37Å; N64-N177 VanDerWaalsContact ND2-O 3.15Å; Q65-N177 PolarHBondContact NE2-O 3.49Å
178	Q	40.1	Very low	39.8	Very low	174 Å²	174	116.1 Å²	116.1	81%	0.813	75%	0.748	S	S	*	*			trans	90.7	138.3	176.7	-58.6	-168.7	55.4	0	0	117.1
179	G	37.5	Very low	40	Very low	84 Å²	84	117.4 Å²	117.4	87%	0.866	75%	0.754	S	S	*	*			cis	156.3	132.4	-15.6	0	0	0	0	0	115.2
180	G	39	Very low	40.2	Very low	79 Å²	79	118.2 Å²	118.2	81%	0.814	76%	0.758	S	S	*	*			trans	158.2	156.3	168.7	0	0	0	0	0	117.9
181	P	49.4	Very low	40.2	Very low	140 Å²	140	116.2 Å²	116.2	91%	0.909	77%	0.767	S	S	*	*			trans	-139.9	173.9	-160.1	42.8	-24.1	0	0	0	120.2
182	G	39.6	Very low	40.2	Very low	78 Å²	78	112.2 Å²	112.2	80%	0.804	77%	0.77	S	S	*	*			trans	128.9	161.6	163.2	0	0	0	0	0	114.9
183	N	42.6	Very low	40.4	Very low	148 Å²	148	116.9 Å²	116.9	79%	0.791	79%	0.785	S	S	*	*			cis	-167.4	169.9	-18	-173.1	14.9	0	0	0	109.2
184	Q	44.3	Very low	40.5	Very low	182 Å²	182	111.8 Å²	111.8	85%	0.85	78%	0.782	S	S	*	*			trans	73	152.4	171.1	-46.8	176.2	15.5	0	0	117.4
185	G	38.7	Very low	40.8	Very low	79 Å²	79	115.2 Å²	115.2	81%	0.814	79%	0.785	S	S	*	*			cis	164.7	111.2	-15.5	0	0	0	0	0	116.9
186	G	40.5	Very low	41	Very low	81 Å²	81	117.5 Å²	117.5	84%	0.835	80%	0.796	S	S	*	*			trans	79.5	172.3	160.9	0	0	0	0	0	119.2
187	A	42.5	Very low	41	Very low	107 Å²	107	120.8 Å²	120.8	88%	0.884	83%	0.829	S	S	*	*			cis	-169.5	134.2	-25.7	0	0	0	0	0	114.2
188	G	39.4	Very low	41.1	Very low	80 Å²	80	118.3 Å²	118.3	83%	0.825	84%	0.836	S	S	*	*			trans	76.3	175.3	157.4	0	0	0	0	0	119.6
189	N	43.5	Very low	41.2	Very low	148 Å²	148	115.5 Å²	115.5	79%	0.791	84%	0.843	S	S	*	*			cis	-168.4	168.3	-33.1	-168.9	18.6	0	0	0	110.5
190	Q	45.2	Very low	41.2	Very low	184 Å²	184	114.9 Å²	114.9	86%	0.86	84%	0.836	S	S	*	*			trans	74.1	150.9	171.2	-45.1	-179	42.6	0	0	116.3
191	G	37.3	Very low	41.4	Very low	85 Å²	85	118.3 Å²	118.3	88%	0.876	84%	0.836	S	S	*	*			cis	160.8	134.1	-10.4	0	0	0	0	0	113
192	G	40.2	Very low	41.1	Very low	78 Å²	78	120.7 Å²	120.7	80%	0.804	84%	0.835	S	S	*	*			trans	179.3	160.8	179.1	0	0	0	0	0	115
193	Q	42.5	Very low	41.2	Very low	206 Å²	206	120.6 Å²	120.6	96%	0.963	83%	0.834	S	S	*	*			trans	-145.2	160.3	-170.3	-65.1	-176.6	-6	0	0	114.9
194	G	39.5	Very low	41.1	Very low	77 Å²	77	121.6 Å²	121.6	79%	0.794	84%	0.84	S	S	*	*			trans	100.2	159	161.9	0	0	0	0	0	116.4
195	N	42.6	Very low	40.9	Very low	134 Å²	134	115.5 Å²	115.5	72%	0.717	83%	0.826	S	S	*	*			cis	-160.2	163	-15.2	-169.1	30	0	0	0	111.6
196	Q	41.4	Very low	41.1	Very low	171 Å²	171	120.9 Å²	120.9	80%	0.799	83%	0.83	S	S	*	*			trans	-1.3	145.2	165.4	-70.5	158.3	57.4	0	0	123.4
197	G	37	Very low	40.8	Very low	86 Å²	86	120 Å²	120	89%	0.887	82%	0.82	S	S	*	*				128.3	140.6	126.1	0	0	0	0	0	119
198	G	40.8	Very low	40.7	Very low	84 Å²	84	123.5 Å²	123.5	87%	0.866	82%	0.816	S	S	*	*			trans	143.6	141.6	166.2	0	0	0	0	0	115.9
199	A	41.1	Very low	40.5	Very low	114 Å²	114	131 Å²	131	94%	0.942	82%	0.819	S	S	*	*			trans	-157.5	164.2	179.5	0	0	0	0	0	112.6
200	G	39.2	Very low	40.4	Very low	71 Å²	71	127.4 Å²	127.4	73%	0.732	82%	0.817	S	S	*	*			trans	165.4	143	166.1	0	0	0	0	0	117.8
201	N	43.1	Very low	40	Very low	152 Å²	152	130.2 Å²	130.2	81%	0.813	82%	0.82	S	S	*	*			trans	49.9	137.6	167.5	-71.3	-1.9	0	0	0	121.3
202	Q	43.4	Very low	40.1	Very low	189 Å²	189	133.7 Å²	133.7	88%	0.883	82%	0.818	S	S	*	*			cis	108.8	130.1	12.1	-75.5	-164.3	15.5	0	0	116.3
203	G	40.5	Very low	40.2	Very low	77 Å²	77	134.2 Å²	134.2	79%	0.794	82%	0.815	S	S	*	*			trans	115.5	147.7	156.2	0	0	0	0	0	116
204	N	41	Very low	40.1	Very low	169 Å²	169	128 Å²	128	90%	0.904	81%	0.806	S	S	*	*			cis	-164.5	162.6	-25.3	-162.4	1.8	0	0	0	109.6
205	G	39.5	Very low	40.2	Very low	54 Å²	54	131.9 Å²	131.9	56%	0.557	81%	0.809	S	S	*	*			trans	100.7	98.1	152.4	0	0	0	0	0	120.7
206	Q	42.2	Very low	40.4	Very low	192 Å²	192	131.1 Å²	131.1	90%	0.897	81%	0.805	S	S	*	*				42.3	142.8	122.5	-55.3	166.6	18.7	0	0	121.3
207	G	36.2	Very low	40.5	Very low	62 Å²	62	131 Å²	131	64%	0.639	80%	0.804	S	S	*	*			cis	162.3	175.2	-4	0	0	0	0	0	114
208	F	39.5	Very low	40.7	Very low	181 Å²	181	130.9 Å²	130.9	79%	0.794	80%	0.802	S	S	*	*			trans	69	161.8	167.3	-58.2	-89.8	0	0	0	119.6
209	R	36	Very low	40.7	Very low	238 Å²	238	130.5 Å²	130.5	90%	0.898	80%	0.799	S	S	*	*				-171.3	146	-54.8	-120.5	-174.5	-175.7	178.7	3.6	111.1
210	G	40	Very low	40.6	Very low	71 Å²	71	128.3 Å²	128.3	73%	0.732	79%	0.787	S	S	*	*			trans	135	124.1	164.9	0	0	0	0	0	112.6
211	R	37.9	Very low	40.7	Very low	244 Å²	244	135 Å²	135	92%	0.921	80%	0.796	S	S	*	*			cis	81	91.3	44.5	-84.9	-157.5	175.4	-167.8	1.1	116.3
212	N	39.2	Very low	40.5	Very low	157 Å²	157	133.1 Å²	133.1	84%	0.84	80%	0.795	S	S	*	*				168.6	166.9	120.4	-101.2	7.3	0	0	0	109.1
213	A	41.7	Very low	40.3	Very low	90 Å²	90	128 Å²	128	74%	0.744	79%	0.793	S	S	*	*			cis	175.6	131.5	-38.2	0	0	0	0	0	105.4
214	G	40.5	Very low	40.1	Very low	76 Å²	76	127.9 Å²	127.9	78%	0.784	79%	0.792	S	S	*	*			trans	175.2	110	-176.4	0	0	0	0	0	114.1
215	N	42.2	Very low	40.6	Very low	158 Å²	158	126 Å²	126	85%	0.845	79%	0.789	S	S	*	*			trans	-64.9	168.5	171.5	-73.4	-6.7	0	0	0	111
216	N	45.6	Very low	40.7	Very low	118 Å²	118	132.5 Å²	132.5	63%	0.631	81%	0.805	S	S	*	*			cis	-156.1	173.6	34.9	-160	26.2	0	0	0	116.2
217	Q	44.7	Very low	40.5	Very low	169 Å²	169	129.9 Å²	129.9	79%	0.79	80%	0.797	S	S	*	*			trans	-25.2	150.4	166.7	-60.9	142	-4.5	0	0	116.2
218	G	40.5	Very low	41	Very low	82 Å²	82	133.6 Å²	133.6	85%	0.845	80%	0.798	S	S	*	*			cis	171	177.3	2.2	0	0	0	0	0	109
219	G	40.2	Very low	41	Very low	77 Å²	77	131.2 Å²	131.2	79%	0.794	79%	0.789	S	S	*	*			cis	172.4	160.7	-6	0	0	0	0	0	111.3
220	G	39.2	Very low	41.1	Very low	67 Å²	67	129.3 Å²	129.3	69%	0.691	78%	0.782	S	S	*	*			trans	70.5	146.7	168.3	0	0	0	0	0	117.2
221	F	40.8	Very low	41.2	Very low	212 Å²	212	132 Å²	132	93%	0.93	78%	0.78	S	S	*	*			cis	-146.9	170.2	-6.4	-73.6	-101.6	0	0	0	107.2
222	S	39	Very low	41.3	Very low	112 Å²	112	126.8 Å²	126.8	78%	0.783	77%	0.77	S	S	*	*			cis	155.7	136.6	-28.6	-174.5	0	0	0	0	106.9
223	G	39	Very low	41.4	Very low	82 Å²	82	130.6 Å²	130.6	85%	0.845	77%	0.773	S	S	*	*			trans	90.7	136.5	175	0	0	0	0	0	115.3
224	G	38.2	Very low	41.3	Very low	75 Å²	75	133.4 Å²	133.4	77%	0.773	78%	0.775	S	S	*	*			cis	173.4	125.7	-6.1	0	0	0	0	0	111.6
225	P	49.9	Very low	41.2	Very low	129 Å²	129	141.2 Å²	141.2	84%	0.838	78%	0.781	S	S	*	*			trans	-112.3	136.9	-172.1	37.6	-30.1	0	0	0	115.4
226	Q	41.8	Very low	41.3	Very low	191 Å²	191	139.1 Å²	139.1	89%	0.893	78%	0.779	S	S	*	*			trans	-156.8	139.6	152.5	-99.9	165.2	0.5	0	0	106.6
227	N	38.4	Very low	41.1	Very low	136 Å²	136	136.7 Å²	136.7	73%	0.727	78%	0.782	S	S	*	*			cis	120.7	147.3	16.9	-173.6	21.1	0	0	0	108.7
228	Q	45.9	Very low	41.1	Very low	140 Å²	140	135 Å²	135	65%	0.654	79%	0.786	S	S	*	*			trans	78.7	105.1	171	-51	-166.2	36.1	0	0	120.1
229	Q	41.4	Very low	41.3	Very low	132 Å²	132	142.9 Å²	142.9	62%	0.617	79%	0.79	S	S	*	*				84.7	132.8	118.4	-75.5	-169.7	57.1	0	0	122.8
230	R	37.7	Very low	41.4	Very low	197 Å²	197	145.6 Å²	145.6	74%	0.743	79%	0.793	S	S	*	*			trans	85	118.2	143.2	-73.6	176.6	-161.3	-128.9	5.3	121.5
231	D	41.5	Very low	41.6	Very low	128 Å²	128	146.3 Å²	146.3	68%	0.684	80%	0.801	S	S	*	*				73.3	84.2	122.8	-51.7	-19.1	0	0	0	120.6
232	N	40.3	Very low	41.5	Very low	134 Å²	134	140.1 Å²	140.1	72%	0.717	80%	0.796	S	S	*	*				52.6	103.1	105.7	-177.6	20.1	0	0	0	118.2
233	R	40.5	Very low	41.5	Very low	238 Å²	238	138.5 Å²	138.5	90%	0.898	80%	0.798	S	S	*	*			trans	-167.4	151.4	131.4	-102.8	152.2	-155	-154.6	6.4	114.5
234	N	39.9	Very low	41.8	Very low	149 Å²	149	139.6 Å²	139.6	80%	0.797	80%	0.799	S	S	*	*			trans	-60.9	148.1	177.4	-55.5	-48.3	0	0	0	114.5
235	R	38.6	Very low	41.8	Very low	239 Å²	239	140.2 Å²	140.2	90%	0.902	81%	0.805	S	S	*	*				-174.3	156.4	107	-107.6	178.6	172.4	174.1	-2.8	114.4
236	S	45	Very low	41.3	Very low	115 Å²	115	138.2 Å²	138.2	80%	0.804	81%	0.807	S	S	*	*			trans	8.8	143.8	155.8	55.3	0	0	0	0	120.4
237	G	41.2	Very low	41.1	Very low	67 Å²	67	133.9 Å²	133.9	69%	0.691	80%	0.804	S	S	*	*			cis	152.9	147.2	7.2	0	0	0	0	0	109.9
238	P	44.9	Very low	41.3	Very low	134 Å²	134	136.9 Å²	136.9	87%	0.87	82%	0.817	S	S	*	*			trans	-85.3	154	-164.6	33.2	-36.2	0	0	0	115.1
239	R	44.4	Very low	41	Very low	247 Å²	247	137.6 Å²	137.6	93%	0.932	83%	0.825	S	S	*	*			trans	-122.4	131.8	169.7	-90.3	-176.8	158.9	-163.2	-5.7	110.6
240	P	42.1	Very low	41	Very low	134 Å²	134	136.7 Å²	136.7	87%	0.87	83%	0.833	S	S	*	*			trans	-102.1	156.4	169.8	37.3	-31.7	0	0	0	113.1
241	G	42.5	Very low	40.9	Very low	82 Å²	82	133.2 Å²	133.2	85%	0.845	83%	0.834	S	S	*	*			trans	150.1	146.5	171.2	0	0	0	0	0	112
242	G	39.7	Very low	40.9	Very low	81 Å²	81	133.5 Å²	133.5	84%	0.835	84%	0.835	S	S	*	*			cis	163.7	110.1	-7.4	0	0	0	0	0	112.8
243	G	39.8	Very low	41	Very low	79 Å²	79	135 Å²	135	81%	0.814	84%	0.84	S	S	*	*			trans	80.9	170.4	175.9	0	0	0	0	0	115.8
244	A	43.5	Very low	40.8	Very low	105 Å²	105	127.7 Å²	127.7	87%	0.868	84%	0.839	S	S	*	*			cis	-166.1	145.6	-17.2	0	0	0	0	0	112
245	G	39.7	Very low	40.6	Very low	87 Å²	87	124.3 Å²	124.3	90%	0.897	84%	0.84	S	S	*	*			trans	79.2	165.3	156.5	0	0	0	0	0	118.4
246	G	39.3	Very low	40.6	Very low	87 Å²	87	117 Å²	117	90%	0.897	84%	0.839	S	S	*	*			trans	108.4	69.7	168.6	0	0	0	0	0	116.2
247	A	37.3	Very low	40.1	Very low	100 Å²	100	115.7 Å²	115.7	83%	0.826	84%	0.843	S	S	*	*			trans	-98.2	126	168.9	0	0	0	0	0	111.2
248	M	43.1	Very low	40	Very low	200 Å²	200	116.4 Å²	116.4	99%	0.985	85%	0.851	S	S	*	*			trans	-143.9	144.3	157.4	-77.5	-158.4	172.5	0	0	110.7
249	N	38	Very low	39.6	Very low	154 Å²	154	114.3 Å²	114.3	82%	0.824	85%	0.853	S	S	*	*			trans	-102.1	126	-178.1	169.8	29.2	0	0	0	110.2
250	S	42.3	Very low	39.2	Very low	114 Å²	114	106.4 Å²	106.4	80%	0.797	85%	0.848	S	S	*	*			trans	-153.4	137.6	149.3	-173.4	0	0	0	0	111.5
251	T	36.2	Very low	39	Very low	123 Å²	123	103.8 Å²	103.8	76%	0.755	85%	0.846	S	S	*	*			trans	-66.1	159.4	168.2	-45.7	0	0	0	0	111.8
252	N	40.9	Very low	38.6	Very low	134 Å²	134	104.4 Å²	104.4	72%	0.717	85%	0.853	S	S	*	*			trans	113.5	149.2	152.2	-157.8	22.3	0	0	0	116.9
253	M	41.3	Very low	38.6	Very low	165 Å²	165	104 Å²	104	81%	0.813	85%	0.848	S	S	*	*			trans	60.9	118.9	178.2	-64.1	-61.3	173.7	0	0	117.3
254	G	36.6	Very low	38.8	Very low	85 Å²	85	102.9 Å²	102.9	88%	0.876	84%	0.836	S	S	*	*			trans	-91.2	175.8	174.5	0	0	0	0	0	113.5
255	G	36.5	Very low	39.3	Very low	79 Å²	79	104.2 Å²	104.2	81%	0.814	84%	0.836	S	S	*	*			trans	153.7	126.3	175.3	0	0	0	0	0	111.3
256	G	38	Very low	40.1	Very low	86 Å²	86	109.1 Å²	109.1	89%	0.887	83%	0.828	S	S	*	*			trans	79	148.9	-177.9	0	0	0	0	0	114.3
257	G	34.8	Very low	41.1	Very low	86 Å²	86	107.7 Å²	107.7	89%	0.887	81%	0.813	S	S	*	*			cis	145	80.5	-1.1	0	0	0	0	0	112.1
258	G	38.4	Very low	42.9	Very low	83 Å²	83	104.6 Å²	104.6	86%	0.856	79%	0.79	S	S	*	*			trans	-164.4	110.7	176.8	0	0	0	0	0	109.7
259	G	37	Very low	44.6	Very low	89 Å²	89	98.5 Å²	98.5	92%	0.918	76%	0.76	S	S	*	*			trans	-101.7	168.5	-171.8	0	0	0	0	0	114.1
260	G	36.6	Very low	46.7	Very low	81 Å²	81	93 Å²	93	84%	0.835	73%	0.73	S	S	*	*			trans	155.6	122.2	167.3	0	0	0	0	0	114
261	G	38	Very low	48.7	Very low	80 Å²	80	93.8 Å²	93.8	83%	0.825	72%	0.719	S	S	*	*			trans	88.7	104.9	166.7	0	0	0	0	0	115.7	G263	G261-G263 PolarHBondContact O-N 3.19Å; G261-G263 VanDerWaalsContact O-N 3.08Å
262	G	34.2	Very low	51.1	Low	95 Å²	95	94 Å²	94	98%	0.979	71%	0.71	S	S	*	*			trans	-75.6	91.8	175.6	0	0	0	0	0	113.2
263	G	39.4	Very low	53.3	Low	72 Å²	72	88.3 Å²	88.3	74%	0.742	68%	0.679	S	S	*	*			trans	-96.5	123.9	163.8	0	0	0	0	0	111.2	G261	G261-G263 PolarHBondContact O-N 3.19Å; G261-G263 VanDerWaalsContact O-N 3.08Å
264	G	44	Very low	55.5	Low	55 Å²	55	83.4 Å²	83.4	57%	0.567	66%	0.659	S	S	*	*			trans	-68	177	171.8	0	0	0	0	0	112.9	R266	G264-R266 PolarHBondContact O-N 2.84Å
265	P	54	Low	57.9	Low	133 Å²	133	84.8 Å²	84.8	86%	0.864	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.6	15.1	-167.6	26.9	-36.7	0	0	0	116.9	G267	P265-G267 VanDerWaalsContact C-N 3.33Å; P265-G267 PolarHBondContact O-N 3.23Å
266	R	56.1	Low	60.4	Low	191 Å²	191	86.5 Å²	86.5	72%	0.721	62%	0.624	S	S	*	*	H	α-helix	trans	-63.1	-32.4	-177.6	-64.3	-177.8	175.3	-161.7	-3.7	113.7	G264 G268 E269	G264-R266 PolarHBondContact O-N 2.84Å; R266-G268 VanDerWaalsContact C-N 3.25Å; R266-G268 PolarHBondContact O-N 3.38Å; R266-E269 PolarHBondContact O-N 3.12Å
267	G	60.5	Low	62.8	Low	56 Å²	56	85.9 Å²	85.9	58%	0.577	60%	0.601	S	S	*	*	H	α-helix	trans	-62.9	-26.4	-174.5	0	0	0	0	0	114.8	P265 F271	P265-G267 VanDerWaalsContact C-N 3.33Å; P265-G267 PolarHBondContact O-N 3.23Å; G267-F271 WeakPolarHBondContact O-CB 3.38Å; G267-F271 PolarHBondContact O-N 3.04Å
268	G	75.7	Confident	65.3	Low	35 Å²	35	91.2 Å²	91.2	36%	0.361	59%	0.594	S	S	.	*	H	α-helix	trans	-72.2	-44.8	179.4	0	0	0	0	0	113.3	R266 F271 F272	R266-G268 VanDerWaalsContact C-N 3.25Å; R266-G268 PolarHBondContact O-N 3.38Å; G268-F271 PolarHBondContact O-N 3.46Å; G268-F272 WeakPolarHBondContact O-CD2 3.45Å; G268-F272 PolarHBondContact O-N 2.75Å; G268-F272 VanDerWaalsContact O-N 3.07Å
269	E	77.4	Confident	67.5	Low	73 Å²	73	92 Å²	92	34%	0.341	59%	0.586	S	S	.	*	H	α-helix	trans	-62.3	-49.3	-178.6	-175.3	174.4	-115.2	0	0	111.2	R266 F271 F272 I273 A431 R434	R266-E269 PolarHBondContact O-N 3.12Å; E269-F271 VanDerWaalsContact C-N 3.29Å; E269-F271 PolarHBondContact O-N 3.48Å; E269-F272 PolarHBondContact O-N 2.87Å; E269-I273 HydrophobicContact CG-CD1 3.95Å; E269-I273 WeakPolarHBondContact O-CD1 3.48Å; E269-I273 WeakPolarHBondContact O-CG1 3.48Å; E269-I273 PolarHBondContact O-N 3.08Å; E269-A431 HydrophobicContact CG-CB 4.4Å; E269-R434 IonicContact OE2-CZ 2.66Å; E269-R434 VanDerWaalsContact OE2-CZ 3.22Å; E269-R434 IonicContact OE2-NH1 3.86Å; E269-R434 PolarHBondContact OE2-NH1 3.43Å; E269-R434 IonicContact OE2-NH2 2.73Å; E269-R434 PolarHBondContact OE2-NH2 3.4Å
270	D	81.9	Confident	69.8	Low	38 Å²	38	90.6 Å²	90.6	20%	0.203	56%	0.557	C	S	.	*	H	α-helix	trans	-59.3	-36.8	176.2	-85.1	49.7	0	0	0	112.6	T274 R434 M435 K439	D270-T274 WeakPolarHBondContact O-CB 3.39Å; D270-T274 PolarHBondContact O-N 3.38Å; D270-T274 PolarHBondContact O-OG1 3.12Å; D270-R434 IonicContact OD1-CZ 3.74Å; D270-R434 IonicContact OD1-NH2 2.76Å; D270-R434 PolarHBondContact OD1-NH2 3.16Å; D270-M435 HydrophobicContact CB-CE 4.38Å; D270-K439 IonicContact OD2-NZ 3.16Å; D270-K439 PolarHBondContact OD2-NZ 3.44Å
271	F	85.3	Confident	72.1	Confident	130 Å²	130	91.4 Å²	91.4	57%	0.57	55%	0.55	S	S	*	*	H	α-helix	trans	-66.6	-49.4	176.8	-179.9	-90.5	0	0	0	112	G267 G268 E269 I273 T274 Q275	G267-F271 WeakPolarHBondContact O-CB 3.38Å; G267-F271 PolarHBondContact O-N 3.04Å; G268-F271 PolarHBondContact O-N 3.46Å; E269-F271 VanDerWaalsContact C-N 3.29Å; E269-F271 PolarHBondContact O-N 3.48Å; F271-I273 VanDerWaalsContact C-N 3.35Å; F271-I273 PolarHBondContact O-N 3.11Å; F271-T274 PolarHBondContact O-N 3.16Å; F271-T274 VanDerWaalsContact O-N 3.16Å; F271-Q275 PolarHBondContact O-N 3.23Å
272	F	86.7	Confident	74.3	Confident	129 Å²	129	89.9 Å²	89.9	57%	0.566	53%	0.534	S	S	*	.	H	α-helix	trans	-63.3	-39	179.1	-72.2	-61.4	0	0	0	112.5	G268 E269 Q275 R276	G268-F272 WeakPolarHBondContact O-CD2 3.45Å; G268-F272 PolarHBondContact O-N 2.75Å; G268-F272 VanDerWaalsContact O-N 3.07Å; E269-F272 PolarHBondContact O-N 2.87Å; F272-Q275 PolarHBondContact O-N 3.01Å; F272-R276 WeakPolarHBondContact O-CB 3.3Å; F272-R276 VanDerWaalsContact O-CG 3.29Å; F272-R276 WeakPolarHBondContact O-CG 3.48Å; F272-R276 PolarHBondContact O-N 2.81Å
273	I	87.2	Confident	76.7	Confident	13 Å²	13	90.5 Å²	90.5	7%	0.067	52%	0.521	C	S	.	.	H	α-helix	trans	-61.5	-45.3	173.6	-66.9	162.2	0	0	0	110.2	E269 F271 Q275 R276 L277 I398 F399 M435	E269-I273 HydrophobicContact CG-CD1 3.95Å; E269-I273 WeakPolarHBondContact O-CD1 3.48Å; E269-I273 WeakPolarHBondContact O-CG1 3.48Å; E269-I273 PolarHBondContact O-N 3.08Å; F271-I273 VanDerWaalsContact C-N 3.35Å; F271-I273 PolarHBondContact O-N 3.11Å; I273-Q275 VanDerWaalsContact C-N 3.35Å; I273-Q275 PolarHBondContact O-N 3.05Å; I273-R276 PolarHBondContact O-N 2.96Å; I273-L277 WeakPolarHBondContact O-CB 3.32Å; I273-L277 PolarHBondContact O-N 3.23Å; I273-I398 HydrophobicContact CG2-CD1 4.22Å; I273-I398 HydrophobicContact CG2-CG1 4.27Å; I273-F399 HydrophobicContact CD1-CD1 3.91Å; I273-F399 HydrophobicContact CD1-CE1 4.42Å; I273-F399 HydrophobicContact CG1-CD1 4.23Å; I273-F399 HydrophobicContact CG2-CD1 4.09Å; I273-F399 HydrophobicContact CG2-CE1 3.88Å; I273-M435 HydrophobicContact CD1-CE 3.69Å; I273-M435 HydrophobicContact CG2-CE 4.34Å
274	T	87.8	Confident	78.9	Confident	63 Å²	63	90.1 Å²	90.1	39%	0.387	50%	0.504	S	S	.	.	H	α-helix	trans	-63.6	-38.6	178.5	-55.9	0	0	0	0	112.2	D270 F271 R278	D270-T274 WeakPolarHBondContact O-CB 3.39Å; D270-T274 PolarHBondContact O-N 3.38Å; D270-T274 PolarHBondContact O-OG1 3.12Å; F271-T274 PolarHBondContact O-N 3.16Å; F271-T274 VanDerWaalsContact O-N 3.16Å; T274-R278 PolarHBondContact O-N 3.23Å
275	Q	87.4	Confident	80.7	Confident	113 Å²	113	96.6 Å²	96.6	53%	0.528	52%	0.517	S	S	.	.	H	α-helix	trans	-67.4	-42.9	176.6	-172.8	176.2	0.1	0	0	111.8	F271 F272 I273 R278 S279	F271-Q275 PolarHBondContact O-N 3.23Å; F272-Q275 PolarHBondContact O-N 3.01Å; I273-Q275 VanDerWaalsContact C-N 3.35Å; I273-Q275 PolarHBondContact O-N 3.05Å; Q275-R278 WeakPolarHBondContact O-CB 3.39Å; Q275-R278 PolarHBondContact O-N 3.38Å; Q275-S279 PolarHBondContact O-N 2.92Å
276	R	88.2	Confident	81.9	Confident	115 Å²	115	99.2 Å²	99.2	43%	0.434	52%	0.518	S	S	.	.	H	α-helix	trans	-64.6	-38.9	175.4	-73.5	166.9	161.1	-139.9	-14.5	112.7	F272 I273 R278 S279 I280 E397 I398	F272-R276 WeakPolarHBondContact O-CB 3.3Å; F272-R276 VanDerWaalsContact O-CG 3.29Å; F272-R276 WeakPolarHBondContact O-CG 3.48Å; F272-R276 PolarHBondContact O-N 2.81Å; I273-R276 PolarHBondContact O-N 2.96Å; R276-R278 VanDerWaalsContact C-N 3.27Å; R276-R278 PolarHBondContact O-N 3.37Å; R276-S279 WeakPolarHBondContact CA-OG 3.23Å; R276-S279 PolarHBondContact O-N 2.79Å; R276-S279 VanDerWaalsContact O-N 3.12Å; R276-S279 PolarHBondContact O-OG 2.79Å; R276-I280 PolarHBondContact O-N 3.44Å; R276-E397 PolarHBondContact NH1-O 2.99Å; R276-I398 HydrophobicContact CB-CB 4Å; R276-I398 HydrophobicContact CB-CG2 4.02Å; R276-I398 VanDerWaalsContact CD-O 3.22Å; R276-I398 WeakPolarHBondContact CD-O 3.29Å; R276-I398 PolarHBondContact NH1-O 3.3Å
277	L	88.4	Confident	83.2	Confident	74 Å²	74	92.3 Å²	92.3	39%	0.387	50%	0.495	S	S	.	.	H	α-helix	trans	-60.1	-37.8	175.6	-175.9	59.9	0	0	0	111.7	I273 I280 S281 I398 F441	I273-L277 WeakPolarHBondContact O-CB 3.32Å; I273-L277 PolarHBondContact O-N 3.23Å; L277-I280 HydrophobicContact CD1-CD1 4.26Å; L277-I280 HydrophobicContact CD1-CG1 4.29Å; L277-I280 WeakPolarHBondContact O-CG1 3.41Å; L277-I280 PolarHBondContact O-N 2.88Å; L277-S281 PolarHBondContact O-N 3.15Å; L277-I398 HydrophobicContact CB-CD1 4.46Å; L277-I398 HydrophobicContact CD1-CD1 4.11Å; L277-F441 HydrophobicContact CD1-CE2 3.93Å
278	R	87.3	Confident	84.1	Confident	198 Å²	198	96.3 Å²	96.3	75%	0.747	50%	0.499	S	S	*	.	H	α-helix	trans	-63.7	-39.7	173.5	-67.9	178.8	-175.3	-164.9	0.6	112.7	T274 Q275 R276 I280 S281	T274-R278 PolarHBondContact O-N 3.23Å; Q275-R278 WeakPolarHBondContact O-CB 3.39Å; Q275-R278 PolarHBondContact O-N 3.38Å; R276-R278 VanDerWaalsContact C-N 3.27Å; R276-R278 PolarHBondContact O-N 3.37Å; R278-I280 VanDerWaalsContact C-N 3.26Å; R278-I280 PolarHBondContact O-N 3.2Å; R278-S281 WeakPolarHBondContact O-CB 3.21Å; R278-S281 PolarHBondContact O-N 2.74Å
279	S	84.7	Confident	84.2	Confident	99 Å²	99	100 Å²	100	69%	0.692	52%	0.516	S	S	*	.	H	α-helix	trans	-67.9	-20.8	178.9	45.3	0	0	0	0	114.5	Q275 R276	Q275-S279 PolarHBondContact O-N 2.92Å; R276-S279 WeakPolarHBondContact CA-OG 3.23Å; R276-S279 PolarHBondContact O-N 2.79Å; R276-S279 VanDerWaalsContact O-N 3.12Å; R276-S279 PolarHBondContact O-OG 2.79Å
280	I	85.9	Confident	84	Confident	59 Å²	59	98.4 Å²	98.4	30%	0.303	51%	0.511	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.9	6.1	174.9	66.3	165.5	0	0	0	113.6	R276 L277 R278 G282 I398	R276-I280 PolarHBondContact O-N 3.44Å; L277-I280 HydrophobicContact CD1-CD1 4.26Å; L277-I280 HydrophobicContact CD1-CG1 4.29Å; L277-I280 WeakPolarHBondContact O-CG1 3.41Å; L277-I280 PolarHBondContact O-N 2.88Å; R278-I280 VanDerWaalsContact C-N 3.26Å; R278-I280 PolarHBondContact O-N 3.2Å; I280-G282 PolarHBondContact O-N 2.74Å; I280-G282 VanDerWaalsContact O-N 3.14Å; I280-I398 HydrophobicContact CD1-CG2 3.55Å; I280-I398 HydrophobicContact CG1-CG2 4.23Å
281	S	83.9	Confident	83.1	Confident	99 Å²	99	105.1 Å²	105.1	69%	0.692	54%	0.542	S	S	*	.			trans	-77.9	9.3	-173.1	-169.9	0	0	0	0	114.7	L277 R278	L277-S281 PolarHBondContact O-N 3.15Å; R278-S281 WeakPolarHBondContact O-CB 3.21Å; R278-S281 PolarHBondContact O-N 2.74Å
282	G	83.7	Confident	82	Confident	47 Å²	47	105.2 Å²	105.2	49%	0.485	55%	0.552	S	S	.	*	S	Bend	trans	-83.1	173.9	175.8	0	0	0	0	0	113.1	I280 T284	I280-G282 PolarHBondContact O-N 2.74Å; I280-G282 VanDerWaalsContact O-N 3.14Å; G282-T284 PolarHBondContact O-N 2.92Å
283	P	86	Confident	80.6	Confident	108 Å²	108	101.4 Å²	101.4	70%	0.701	54%	0.541	S	S	*	.			trans	-66	125.1	176.4	-17.8	31.7	0	0	0	111.9	F285	P283-F285 VanDerWaalsContact C-N 3.34Å; P283-F285 HydrophobicContact CB-CD2 3.65Å; P283-F285 HydrophobicContact CB-CE2 3.41Å; P283-F285 VanDerWaalsContact CB-CE2 3.41Å; P283-F285 HydrophobicContact CB-CG 4.4Å; P283-F285 HydrophobicContact CB-CZ 3.97Å; P283-F285 HydrophobicContact CG-CE2 4.3Å; P283-F285 PolarHBondContact O-N 2.98Å
284	T	85.2	Confident	79.2	Confident	65 Å²	65	107.2 Å²	107.2	40%	0.399	58%	0.577	S	S	.	*			trans	-95.1	35.9	-174.6	47	0	0	0	0	113.2	G282 L287 L391	G282-T284 PolarHBondContact O-N 2.92Å; T284-L287 HydrophobicContact CG2-CD2 4.18Å; T284-L391 HydrophobicContact CG2-CD1 3.97Å
285	F	81.5	Confident	78.2	Confident	190 Å²	190	107.9 Å²	107.9	83%	0.833	58%	0.576	S	S	*	*	S	Bend	trans	-66.4	-37.9	-174.1	-59.8	-51.1	0	0	0	113.8	P283	P283-F285 VanDerWaalsContact C-N 3.34Å; P283-F285 HydrophobicContact CB-CD2 3.65Å; P283-F285 HydrophobicContact CB-CE2 3.41Å; P283-F285 VanDerWaalsContact CB-CE2 3.41Å; P283-F285 HydrophobicContact CB-CG 4.4Å; P283-F285 HydrophobicContact CB-CZ 3.97Å; P283-F285 HydrophobicContact CG-CE2 4.3Å; P283-F285 PolarHBondContact O-N 2.98Å
286	E	79.2	Confident	77.6	Confident	188 Å²	188	104.4 Å²	104.4	88%	0.879	56%	0.562	S	S	*	*	S	Bend	trans	-124.3	115	176.9	-69.3	179.6	-164.2	0	0	108.1
287	L	83.1	Confident	77.4	Confident	47 Å²	47	103.3 Å²	103.3	25%	0.246	56%	0.561	C	S	.	*			trans	-112.8	129.7	175	-60.2	-175.4	0	0	0	108.6	T284 E390 L391 K394	T284-L287 HydrophobicContact CG2-CD2 4.18Å; L287-E390 HydrophobicContact CB-CB 4.13Å; L287-E390 HydrophobicContact CD1-CB 4.14Å; L287-L391 HydrophobicContact CD1-CB 3.75Å; L287-L391 HydrophobicContact CD1-CD1 4.05Å; L287-K394 HydrophobicContact CD2-CD 4.33Å
288	E	79.8	Confident	77.1	Confident	139 Å²	139	102 Å²	102	65%	0.65	55%	0.552	S	S	*	*			trans	-53.3	134.4	168.6	-62	155.6	133.6	0	0	109.7	V290 K394	E288-V290 PolarHBondContact O-N 2.97Å; E288-K394 IonicContact OE2-NZ 2.7Å; E288-K394 PolarHBondContact OE2-NZ 3.36Å
289	P	78.2	Confident	77	Confident	113 Å²	113	92.6 Å²	92.6	73%	0.734	52%	0.517	S	S	*	.			trans	-54.2	127.3	172.6	-25.1	34.4	0	0	0	110.1	E291	P289-E291 PolarHBondContact O-N 3.49Å; P289-E291 VanDerWaalsContact O-N 3.09Å
290	V	72	Confident	76.9	Confident	39 Å²	39	88.6 Å²	88.6	24%	0.236	49%	0.491	C	S	.	.			trans	-68.4	111.2	172.6	173.6	0	0	0	0	107.3	E288 V292 E390 Y393	E288-V290 PolarHBondContact O-N 2.97Å; V290-V292 PolarHBondContact O-N 2.87Å; V290-E390 HydrophobicContact CB-CG 4.48Å; V290-E390 HydrophobicContact CG2-CB 4.05Å; V290-E390 HydrophobicContact CG2-CG 4.1Å; V290-Y393 HydrophobicContact CG1-CD2 3.96Å; V290-Y393 HydrophobicContact CG1-CE2 4.16Å; V290-Y393 HydrophobicContact CG1-CG 4.16Å; V290-Y393 HydrophobicContact CG2-CD1 4.02Å; V290-Y393 HydrophobicContact CG2-CG 3.89Å
291	E	64.3	Low	76.8	Confident	180 Å²	180	88.9 Å²	88.9	84%	0.841	49%	0.488	S	S	*	.			trans	-55.3	110.1	165.7	-68.6	-169	169.2	0	0	107.8	P289 P293	P289-E291 PolarHBondContact O-N 3.49Å; P289-E291 VanDerWaalsContact O-N 3.09Å; E291-P293 WeakPolarHBondContact O-CD 3.09Å
292	V	61.4	Low	77	Confident	131 Å²	131	84.2 Å²	84.2	79%	0.794	46%	0.455	S	S	*	.			trans	-57.9	114.1	178.9	177.8	0	0	0	0	107.2	V290 T294	V290-V292 PolarHBondContact O-N 2.87Å; V292-T294 PolarHBondContact O-N 3.24Å; V292-T294 VanDerWaalsContact O-N 3.11Å
293	P	57.3	Low	77.4	Confident	49 Å²	49	85.5 Å²	85.5	32%	0.318	45%	0.446	S	S	.	.			trans	-58.6	122.9	-168.5	-28.5	36.6	0	0	0	111.2	E291 E295 T296	E291-P293 WeakPolarHBondContact O-CD 3.09Å; P293-E295 PolarHBondContact O-N 3.05Å; P293-T296 HydrophobicContact CB-CG2 4.24Å
294	T	58.6	Low	77.7	Confident	135 Å²	135	80.3 Å²	80.3	83%	0.828	41%	0.412	S	S	*	.	S	Bend	trans	-51.2	125.4	172.6	52.6	0	0	0	0	108.6	V292 T296	V292-T294 PolarHBondContact O-N 3.24Å; V292-T294 VanDerWaalsContact O-N 3.11Å; T294-T296 PolarHBondContact O-N 3.09Å; T294-T296 VanDerWaalsContact O-N 3.15Å
295	E	66	Low	78.1	Confident	77 Å²	77	80.6 Å²	80.6	36%	0.36	41%	0.406	S	S	.	.			trans	-34.4	113.3	-156.5	-72.4	-160.1	167.1	0	0	113.9	P293 K297 Y346 H347 P348	P293-E295 PolarHBondContact O-N 3.05Å; E295-K297 PolarHBondContact O-N 2.97Å; E295-Y346 HydrophobicContact CB-CD1 3.77Å; E295-Y346 HydrophobicContact CB-CE1 4.1Å; E295-Y346 WeakPolarHBondContact O-CE1 3.43Å; E295-H347 PolarHBondContact OE2-N 2.9Å; E295-P348 WeakPolarHBondContact OE2-CD 3.4Å
296	T	74.2	Confident	78.7	Confident	40 Å²	40	71.5 Å²	71.5	25%	0.245	37%	0.367	C	S	.	.			trans	-61.5	113.8	-176.1	47.6	0	0	0	0	110.5	P293 T294 F298 S299 E403	P293-T296 HydrophobicContact CB-CG2 4.24Å; T294-T296 PolarHBondContact O-N 3.09Å; T294-T296 VanDerWaalsContact O-N 3.15Å; T296-F298 PolarHBondContact O-N 3.39Å; T296-S299 WeakPolarHBondContact O-CB 3.36Å; T296-S299 PolarHBondContact O-N 2.9Å; T296-S299 VanDerWaalsContact O-N 3.12Å; T296-E403 WeakPolarHBondContact CB-OE1 3.39Å; T296-E403 PolarHBondContact OG1-OE1 3.47Å
297	K	83.7	Confident	79.3	Confident	92 Å²	92	62.6 Å²	62.6	40%	0.4	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.3	130.2	175.9	-88.6	-162	172.1	-168.6	0	109.6	E295 S299 E327 D345 Y346	E295-K297 PolarHBondContact O-N 2.97Å; K297-S299 VanDerWaalsContact C-N 3.32Å; K297-S299 PolarHBondContact O-N 2.83Å; K297-E327 IonicContact NZ-OE1 2.72Å; K297-E327 PolarHBondContact NZ-OE1 3.49Å; K297-E327 IonicContact NZ-OE2 2.72Å; K297-E327 PolarHBondContact NZ-OE2 3.47Å; K297-D345 CarbonylContact C-O 3.54Å; K297-D345 WeakPolarHBondContact CA-O 3.41Å; K297-D345 HydrophobicContact CG-CB 4.44Å; K297-Y346 HydrophobicContact CD-CE2 4.46Å; K297-Y346 WeakPolarHBondContact CE-OH 3.49Å; K297-Y346 HydrophobicContact CG-CE1 3.9Å; K297-Y346 HydrophobicContact CG-CE2 4.12Å
298	F	83.7	Confident	79.6	Confident	48 Å²	48	63 Å²	63	21%	0.211	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	64.2	28.7	180	-42.7	-69.8	0	0	0	115.2	T296 E327 S329 K343 V344 D345	T296-F298 PolarHBondContact O-N 3.39Å; F298-E327 HydrophobicContact CE1-CB 4.23Å; F298-E327 HydrophobicContact CZ-CB 4.01Å; F298-S329 VanDerWaalsContact CG-CB 3.44Å; F298-K343 HydrophobicContact CB-CB 4.31Å; F298-K343 HydrophobicContact CB-CD 4.2Å; F298-K343 HydrophobicContact CD1-CB 4.33Å; F298-V344 WeakPolarHBondContact CD1-O 2.77Å; F298-D345 HydrophobicContact CE1-CB 4Å; F298-D345 HydrophobicContact CZ-CB 4.24Å; F298-D345 PolarHBondContact N-O 3.34Å
299	S	84	Confident	80.1	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	30%	0.297	C	S	.	.			trans	-47.6	156.2	168.6	172.1	0	0	0	0	113.4	T296 K297 R301 N302 E403	T296-S299 WeakPolarHBondContact O-CB 3.36Å; T296-S299 PolarHBondContact O-N 2.9Å; T296-S299 VanDerWaalsContact O-N 3.12Å; K297-S299 VanDerWaalsContact C-N 3.32Å; K297-S299 PolarHBondContact O-N 2.83Å; S299-R301 PolarHBondContact O-N 3.36Å; S299-R301 VanDerWaalsContact O-N 3.15Å; S299-R301 PolarHBondContact OG-N 3.02Å; S299-N302 PolarHBondContact O-N 3.41Å; S299-E403 WeakPolarHBondContact CA-OE1 3.38Å; S299-E403 WeakPolarHBondContact CB-OE1 3.35Å; S299-E403 WeakPolarHBondContact CB-OE2 3.5Å; S299-E403 PolarHBondContact OG-OE2 3.24Å
300	G	82.5	Confident	80.5	Confident	15 Å²	15	51.9 Å²	51.9	16%	0.155	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-53.4	-31.2	171.2	0	0	0	0	0	113.6	N302 R303 E403	G300-N302 VanDerWaalsContact C-N 3.27Å; G300-N302 PolarHBondContact O-N 2.85Å; G300-R303 WeakPolarHBondContact O-CB 3.26Å; G300-R303 PolarHBondContact O-N 3.45Å; G300-E403 PolarHBondContact N-OE2 3Å
301	R	84.4	Confident	81.1	Confident	65 Å²	65	54.3 Å²	54.3	25%	0.245	28%	0.279	C	S	.	.	G	3₁₀ helix	trans	-71.2	-16.2	176.7	-58.5	-175.8	-71.1	135.4	-1.3	114.4	S299 R303 H347 F371 E422	S299-R301 PolarHBondContact O-N 3.36Å; S299-R301 VanDerWaalsContact O-N 3.15Å; S299-R301 PolarHBondContact OG-N 3.02Å; R301-R303 VanDerWaalsContact C-N 3.35Å; R301-H347 PolarHBondContact O-ND1 2.89Å; R301-H347 VanDerWaalsContact O-ND1 3.14Å; R301-F371 WeakPolarHBondContact O-CE1 3.49Å; R301-E422 WeakPolarHBondContact CD-OE1 3.35Å; R301-E422 WeakPolarHBondContact CD-OE2 3.39Å; R301-E422 WeakPolarHBondContact CG-OE1 3.4Å; R301-E422 IonicContact NE-OE2 2.77Å
302	N	88.9	Confident	82.2	Confident	1 Å²	1	49.6 Å²	49.6	1%	0.005	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-100.4	7.5	-175	-49	-7.1	0	0	0	110.7	S299 G300 V344 D345 Y346 H347	S299-N302 PolarHBondContact O-N 3.41Å; G300-N302 VanDerWaalsContact C-N 3.27Å; G300-N302 PolarHBondContact O-N 2.85Å; N302-V344 WeakPolarHBondContact CB-O 3.39Å; N302-V344 PolarHBondContact O-N 2.83Å; N302-D345 PolarHBondContact ND2-O 2.84Å; N302-Y346 WeakPolarHBondContact ND2-CA 3.48Å; N302-H347 WeakPolarHBondContact OD1-CA 3.37Å; N302-H347 VanDerWaalsContact OD1-CB 3.32Å; N302-H347 WeakPolarHBondContact OD1-CB 3.28Å; N302-H347 PolarHBondContact OD1-N 2.78Å
303	R	91.2	Very high	83.5	Confident	73 Å²	73	43.9 Å²	43.9	28%	0.275	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	121.3	179.7	-164.7	-179.8	-168.5	-131.5	0.3	110.7	G300 R301 L342 K343 A372	G300-R303 WeakPolarHBondContact O-CB 3.26Å; G300-R303 PolarHBondContact O-N 3.45Å; R301-R303 VanDerWaalsContact C-N 3.35Å; R303-L342 CarbonylContact C-O 3.39Å; R303-L342 VanDerWaalsContact CA-O 3.28Å; R303-L342 WeakPolarHBondContact CA-O 3.39Å; R303-L342 WeakPolarHBondContact CG-O 3.46Å; R303-K343 HydrophobicContact CB-CG 4.19Å; R303-K343 HydrophobicContact CG-CG 4.03Å; R303-A372 HydrophobicContact CB-CB 4.03Å; R303-A372 HydrophobicContact CG-CB 3.8Å; R303-A372 WeakPolarHBondContact O-CB 3.25Å; R303-A372 PolarHBondContact O-N 3.42Å
304	L	93.3	Very high	85	Confident	0 Å²	0	45 Å²	45	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	146.7	177.4	-63.6	176.7	0	0	0	111.2	F322 F341 L342 V344 A350 A353 K354 V369 R370 F371	L304-F322 HydrophobicContact CD1-CD1 4.39Å; L304-F322 HydrophobicContact CD1-CE1 3.72Å; L304-F341 WeakPolarHBondContact O-CA 3.38Å; L304-L342 HydrophobicContact CB-CD1 4.11Å; L304-L342 HydrophobicContact CB-CG 4.47Å; L304-L342 HydrophobicContact CD1-CD1 4.34Å; L304-L342 PolarHBondContact N-O 3.19Å; L304-L342 PolarHBondContact O-N 3.27Å; L304-V344 HydrophobicContact CD1-CG2 3.88Å; L304-V344 HydrophobicContact CG-CG2 4.41Å; L304-A350 HydrophobicContact CD1-CB 4.31Å; L304-A350 HydrophobicContact CD2-CB 4.23Å; L304-A350 HydrophobicContact CG-CB 4.26Å; L304-A353 HydrophobicContact CD1-CB 3.9Å; L304-K354 HydrophobicContact CD2-CB 4.45Å; L304-V369 HydrophobicContact CB-CG1 4.46Å; L304-V369 HydrophobicContact CD1-CG1 4.22Å; L304-V369 HydrophobicContact CD2-CG1 4.49Å; L304-R370 CarbonylContact C-O 3.54Å; L304-R370 WeakPolarHBondContact CA-O 3.41Å; L304-F371 HydrophobicContact CD2-CD1 3.74Å; L304-F371 HydrophobicContact CD2-CE1 3.86Å; L304-F371 HydrophobicContact CD2-CG 4.32Å
305	Y	93	Very high	86.6	Confident	70 Å²	70	42.1 Å²	42.1	28%	0.275	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	127.8	164.7	170	-93.8	0	0	0	108.5	F339 F341 V369 R370	Y305-F339 HydrophobicContact CD2-CB 4.36Å; Y305-F339 HydrophobicContact CD2-CD2 4.45Å; Y305-F339 HydrophobicContact CE2-CB 3.45Å; Y305-F339 VanDerWaalsContact CE2-CB 3.45Å; Y305-F339 HydrophobicContact CE2-CD1 4.29Å; Y305-F339 AromaticContact CE2-CD2 3.96Å; Y305-F339 HydrophobicContact CE2-CD2 3.96Å; Y305-F339 AromaticContact CE2-CG 3.66Å; Y305-F339 HydrophobicContact CE2-CG 3.66Å; Y305-F341 HydrophobicContact CD2-CD1 4.26Å; Y305-F341 AromaticContact CD2-CE1 3.7Å; Y305-F341 HydrophobicContact CD2-CE1 3.7Å; Y305-F341 HydrophobicContact CD2-CE2 4.35Å; Y305-F341 AromaticContact CD2-CZ 3.76Å; Y305-F341 HydrophobicContact CD2-CZ 3.76Å; Y305-F341 HydrophobicContact CE2-CZ 4.47Å; Y305-F341 HydrophobicContact CG-CE1 4.27Å; Y305-V369 WeakPolarHBondContact O-CA 3.37Å; Y305-R370 HydrophobicContact CD1-CB 4.43Å; Y305-R370 PolarHBondContact N-O 2.76Å; Y305-R370 PolarHBondContact O-N 3.25Å
306	V	93.4	Very high	87.8	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	102.9	176.4	-173.2	0	0	0	0	107.8	L309 F322 F339 T340 L342 R368 V369	V306-L309 HydrophobicContact CB-CD1 4.42Å; V306-L309 HydrophobicContact CG1-CD1 4.09Å; V306-L309 HydrophobicContact CG1-CD2 3.99Å; V306-L309 HydrophobicContact CG1-CG 4.13Å; V306-L309 WeakPolarHBondContact O-CD1 3.33Å; V306-F322 HydrophobicContact CG2-CE1 4.5Å; V306-F322 HydrophobicContact CG2-CE2 3.91Å; V306-F322 HydrophobicContact CG2-CZ 3.54Å; V306-F339 CarbonylContact O-C 3.58Å; V306-F339 WeakPolarHBondContact O-CA 3.21Å; V306-T340 PolarHBondContact N-O 2.69Å; V306-T340 PolarHBondContact O-N 3.38Å; V306-L342 HydrophobicContact CG2-CD2 4.02Å; V306-L342 HydrophobicContact CG2-CG 4.49Å; V306-R368 CarbonylContact C-O 3.49Å; V306-R368 WeakPolarHBondContact CA-O 3.37Å; V306-V369 HydrophobicContact CG1-CG2 4.45Å
307	G	92.5	Very high	88.6	Confident	1 Å²	1	44.9 Å²	44.9	1%	0.01	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	171.7	-178.3	0	0	0	0	0	113.7	L309 R368	G307-L309 PolarHBondContact O-N 3.03Å; G307-R368 PolarHBondContact N-O 3.43Å; G307-R368 PolarHBondContact O-N 3.23Å
308	N	90.1	Very high	89	Confident	55 Å²	55	40.5 Å²	40.5	29%	0.294	21%	0.205	S	C	.	.	S	Bend	trans	63	24.9	-177.3	-160.5	35.6	0	0	0	114.4	N338 R365 Q366 R368	N308-N338 PolarHBondContact N-O 3.17Å; N308-N338 VanDerWaalsContact N-O 3.12Å; N308-R365 PolarHBondContact O-NE 3.14Å; N308-R365 PolarHBondContact O-NH2 3.24Å; N308-R365 PolarHBondContact OD1-NE 2.95Å; N308-R365 VanDerWaalsContact OD1-NE 3.09Å; N308-R365 PolarHBondContact OD1-NH2 3.47Å; N308-Q366 PolarHBondContact ND2-O 3.12Å; N308-R368 HydrophobicContact CB-CG 4.27Å
309	L	89.4	Confident	89.5	Confident	1 Å²	1	43.3 Å²	43.3	1%	0.005	21%	0.214	C	C	.	.			trans	-63.6	168.1	170.6	-67.1	166	0	0	0	110.9	V306 G307 I313 L318 N338 T340 R365 L367	V306-L309 HydrophobicContact CB-CD1 4.42Å; V306-L309 HydrophobicContact CG1-CD1 4.09Å; V306-L309 HydrophobicContact CG1-CD2 3.99Å; V306-L309 HydrophobicContact CG1-CG 4.13Å; V306-L309 WeakPolarHBondContact O-CD1 3.33Å; G307-L309 PolarHBondContact O-N 3.03Å; L309-I313 HydrophobicContact CB-CG2 4.27Å; L309-I313 HydrophobicContact CD1-CG2 4.28Å; L309-I313 HydrophobicContact CD2-CD1 4.12Å; L309-I313 HydrophobicContact CD2-CG1 4.07Å; L309-L318 HydrophobicContact CD1-CD2 4.45Å; L309-L318 HydrophobicContact CD2-CD2 4.19Å; L309-N338 PolarHBondContact N-O 2.97Å; L309-N338 VanDerWaalsContact N-O 3.16Å; L309-N338 WeakPolarHBondContact O-CB 3.3Å; L309-N338 PolarHBondContact O-OD1 2.94Å; L309-T340 WeakPolarHBondContact CD1-OG1 3.18Å; L309-R365 PolarHBondContact O-NH1 3.28Å; L309-R365 PolarHBondContact O-NH2 2.71Å; L309-L367 HydrophobicContact CD2-CD2 3.71Å
310	T	86.5	Confident	89.9	Confident	17 Å²	17	50 Å²	50	10%	0.104	25%	0.245	C	C	.	.			trans	-105.6	153.3	167.5	54.4	0	0	0	0	109.6	D312 I313 N338 R362	T310-D312 WeakPolarHBondContact CB-OD1 3.21Å; T310-D312 PolarHBondContact O-N 2.81Å; T310-D312 PolarHBondContact OG1-OD1 3.38Å; T310-D312 PolarHBondContact OG1-OD2 2.94Å; T310-I313 WeakPolarHBondContact O-CB 3.36Å; T310-I313 WeakPolarHBondContact O-CG2 3.42Å; T310-I313 PolarHBondContact O-N 3.32Å; T310-N338 VanDerWaalsContact C-OD1 3.23Å; T310-N338 WeakPolarHBondContact CA-OD1 3.27Å; T310-R362 PolarHBondContact OG1-NH2 3.32Å
311	N	85.7	Confident	90.3	Very high	91 Å²	91	51.4 Å²	51.4	49%	0.487	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-12	-170	-59.8	65.9	0	0	0	114.8	L335 N338	N311-L335 PolarHBondContact ND2-O 3.02Å; N311-L335 VanDerWaalsContact ND2-O 3.12Å; N311-N338 PolarHBondContact N-OD1 2.86Å; N311-N338 VanDerWaalsContact N-OD1 3.15Å; N311-N338 PolarHBondContact OD1-ND2 3.16Å; N311-N338 PolarHBondContact OD1-OD1 3.4Å; N311-N338 VanDerWaalsContact OD1-OD1 3.11Å
312	D	86.9	Confident	90.7	Very high	80 Å²	80	48.4 Å²	48.4	43%	0.428	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.7	5.4	177.1	61.2	-75.5	0	0	0	114.5	T310 R362 K363	T310-D312 WeakPolarHBondContact CB-OD1 3.21Å; T310-D312 PolarHBondContact O-N 2.81Å; T310-D312 PolarHBondContact OG1-OD1 3.38Å; T310-D312 PolarHBondContact OG1-OD2 2.94Å; D312-R362 IonicContact OD1-NH2 3.22Å; D312-R362 IonicContact OD2-NH1 2.76Å; D312-R362 IonicContact OD2-NH2 2.75Å; D312-R362 PolarHBondContact OD2-NH2 2.77Å; D312-K363 VanDerWaalsContact OD2-CD 3.23Å; D312-K363 WeakPolarHBondContact OD2-CD 3.36Å; D312-K363 WeakPolarHBondContact OD2-CE 3.07Å; D312-K363 IonicContact OD2-NZ 3.81Å; D312-K363 PolarHBondContact OD2-NZ 2.98Å
313	I	87.4	Confident	90.8	Very high	11 Å²	11	55.7 Å²	55.7	6%	0.056	27%	0.268	C	S	.	.			trans	-65.5	133.8	174.2	-169.3	71.5	0	0	0	111	L309 T310 E317 L318 L335 R362	L309-I313 HydrophobicContact CB-CG2 4.27Å; L309-I313 HydrophobicContact CD1-CG2 4.28Å; L309-I313 HydrophobicContact CD2-CD1 4.12Å; L309-I313 HydrophobicContact CD2-CG1 4.07Å; T310-I313 WeakPolarHBondContact O-CB 3.36Å; T310-I313 WeakPolarHBondContact O-CG2 3.42Å; T310-I313 PolarHBondContact O-N 3.32Å; I313-E317 HydrophobicContact CD1-CB 4.18Å; I313-E317 HydrophobicContact CD1-CG 4.1Å; I313-L318 HydrophobicContact CD1-CD2 3.85Å; I313-L318 HydrophobicContact CD1-CG 3.81Å; I313-L318 HydrophobicContact CG1-CD1 3.74Å; I313-L318 HydrophobicContact CG1-CD2 3.85Å; I313-L318 HydrophobicContact CG1-CG 3.54Å; I313-L335 HydrophobicContact CG2-CD2 3.71Å; I313-R362 VanDerWaalsContact CD1-CZ 3.5Å
314	T	90.4	Very high	90.9	Very high	73 Å²	73	56.9 Å²	56.9	45%	0.448	29%	0.286	S	S	.	.			trans	-104	154.9	170.2	61.5	0	0	0	0	111	D316 E317 L318	T314-D316 PolarHBondContact O-N 2.9Å; T314-E317 PolarHBondContact O-N 3.02Å; T314-E317 WeakPolarHBondContact OG1-CB 3.36Å; T314-E317 PolarHBondContact OG1-N 2.9Å; T314-E317 VanDerWaalsContact OG1-N 3.11Å; T314-L318 PolarHBondContact O-N 2.94Å; T314-L318 VanDerWaalsContact O-N 3.09Å
315	D	90.5	Very high	90.9	Very high	74 Å²	74	59.6 Å²	59.6	40%	0.396	30%	0.296	S	S	.	.	H	α-helix	trans	-65.3	-25.3	175.3	-69.2	-18.9	0	0	0	111.9	R319 I331 S333	D315-R319 WeakPolarHBondContact O-CB 3.37Å; D315-R319 PolarHBondContact O-N 3.34Å; D315-I331 HydrophobicContact CB-CD1 4.36Å; D315-I331 HydrophobicContact CB-CG2 4.16Å; D315-I331 WeakPolarHBondContact OD1-CG2 3.27Å; D315-S333 VanDerWaalsContact OD1-CB 3.3Å; D315-S333 WeakPolarHBondContact OD1-CB 3.18Å; D315-S333 PolarHBondContact OD1-OG 3.44Å
316	D	92.1	Very high	90.8	Very high	125 Å²	125	57 Å²	57	67%	0.668	29%	0.291	S	S	*	.	H	α-helix	trans	-71.2	-42.8	172.3	-61	-61.4	0	0	0	112.7	T314 L318 R319 E320	T314-D316 PolarHBondContact O-N 2.9Å; D316-L318 VanDerWaalsContact C-N 3.3Å; D316-L318 PolarHBondContact O-N 2.97Å; D316-R319 PolarHBondContact O-N 3.12Å; D316-R319 VanDerWaalsContact O-N 3.13Å; D316-E320 PolarHBondContact O-N 2.84Å
317	E	91.7	Very high	90.8	Very high	50 Å²	50	61.9 Å²	61.9	23%	0.234	31%	0.314	C	S	.	.	H	α-helix	trans	-62.5	-40.6	174.6	-173.2	-179.7	175.7	0	0	110.3	I313 T314 E320 M321 R362 K363	I313-E317 HydrophobicContact CD1-CB 4.18Å; I313-E317 HydrophobicContact CD1-CG 4.1Å; T314-E317 PolarHBondContact O-N 3.02Å; T314-E317 WeakPolarHBondContact OG1-CB 3.36Å; T314-E317 PolarHBondContact OG1-N 2.9Å; T314-E317 VanDerWaalsContact OG1-N 3.11Å; E317-E320 PolarHBondContact O-N 3.36Å; E317-M321 WeakPolarHBondContact O-CB 3.41Å; E317-M321 VanDerWaalsContact O-CG 3.31Å; E317-M321 WeakPolarHBondContact O-CG 3.46Å; E317-M321 PolarHBondContact O-N 3.42Å; E317-R362 IonicContact OE1-CZ 3.26Å; E317-R362 IonicContact OE1-NH1 2.74Å; E317-R362 PolarHBondContact OE1-NH1 3.31Å; E317-R362 IonicContact OE2-CZ 3.94Å; E317-R362 IonicContact OE2-NH1 3.81Å; E317-R362 PolarHBondContact OE2-NH1 2.67Å; E317-K363 IonicContact OE2-NZ 3.65Å
318	L	91.9	Very high	90.8	Very high	0 Å²	0	62.5 Å²	62.5	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-64.5	-39.7	172.7	-69.6	169.5	0	0	0	112.2	L309 I313 T314 D316 M321 F322 I331 T340	L309-L318 HydrophobicContact CD1-CD2 4.45Å; L309-L318 HydrophobicContact CD2-CD2 4.19Å; I313-L318 HydrophobicContact CD1-CD2 3.85Å; I313-L318 HydrophobicContact CD1-CG 3.81Å; I313-L318 HydrophobicContact CG1-CD1 3.74Å; I313-L318 HydrophobicContact CG1-CD2 3.85Å; I313-L318 HydrophobicContact CG1-CG 3.54Å; T314-L318 PolarHBondContact O-N 2.94Å; T314-L318 VanDerWaalsContact O-N 3.09Å; D316-L318 VanDerWaalsContact C-N 3.3Å; D316-L318 PolarHBondContact O-N 2.97Å; L318-M321 PolarHBondContact O-N 2.8Å; L318-F322 WeakPolarHBondContact O-CD2 3.31Å; L318-F322 PolarHBondContact O-N 3.29Å; L318-F322 VanDerWaalsContact O-N 3.11Å; L318-I331 HydrophobicContact CD1-CG2 4.48Å; L318-T340 HydrophobicContact CD1-CG2 3.73Å; L318-T340 WeakPolarHBondContact CD1-OG1 3.4Å
319	R	92.9	Very high	90.8	Very high	108 Å²	108	62.9 Å²	62.9	41%	0.408	32%	0.323	S	S	.	.	H	α-helix	trans	-63.6	-41.8	175.7	-174.7	173.6	-69.8	-82.4	-0.9	111.3	D315 D316 K323 I328 I331	D315-R319 WeakPolarHBondContact O-CB 3.37Å; D315-R319 PolarHBondContact O-N 3.34Å; D316-R319 PolarHBondContact O-N 3.12Å; D316-R319 VanDerWaalsContact O-N 3.13Å; R319-K323 VanDerWaalsContact O-CB 3.3Å; R319-K323 WeakPolarHBondContact O-CB 3.45Å; R319-K323 PolarHBondContact O-N 3.07Å; R319-I328 HydrophobicContact CB-CD1 4.41Å; R319-I328 HydrophobicContact CG-CD1 4.28Å; R319-I328 PolarHBondContact NH1-O 3.49Å; R319-I328 PolarHBondContact NH2-O 2.83Å; R319-I331 HydrophobicContact CB-CD1 4.29Å
320	E	92.5	Very high	90.7	Very high	139 Å²	139	67.2 Å²	67.2	65%	0.65	34%	0.344	S	S	*	.	H	α-helix	trans	-66.4	-44.6	175.8	-175.8	162.7	-135	0	0	112.5	D316 E317 F322 K323	D316-E320 PolarHBondContact O-N 2.84Å; E317-E320 PolarHBondContact O-N 3.36Å; E320-F322 VanDerWaalsContact C-N 3.28Å; E320-F322 PolarHBondContact O-N 3.37Å; E320-K323 WeakPolarHBondContact O-CB 3.48Å; E320-K323 PolarHBondContact O-N 2.86Å
321	M	91.1	Very high	90.9	Very high	46 Å²	46	68.1 Å²	68.1	23%	0.227	35%	0.348	C	S	.	.	H	α-helix	trans	-60.4	-34.4	177.3	-75.7	-168.7	67.4	0	0	113.5	E317 L318 Y325 L357 L367	E317-M321 WeakPolarHBondContact O-CB 3.41Å; E317-M321 VanDerWaalsContact O-CG 3.31Å; E317-M321 WeakPolarHBondContact O-CG 3.46Å; E317-M321 PolarHBondContact O-N 3.42Å; L318-M321 PolarHBondContact O-N 2.8Å; M321-Y325 WeakPolarHBondContact O-CE2 3.44Å; M321-L357 HydrophobicContact CE-CD2 4.05Å; M321-L367 HydrophobicContact CE-CD1 3.54Å; M321-L367 HydrophobicContact SD-CD1 4.32Å
322	F	92.8	Very high	91.2	Very high	2 Å²	2	69.4 Å²	69.4	1%	0.009	35%	0.349	C	S	.	.	H	α-helix	trans	-95.6	-17.2	-177.6	-80.8	-99.5	0	0	0	114.1	L304 V306 L318 E320 Y325 I328 L342 A353 L357 V369	L304-F322 HydrophobicContact CD1-CD1 4.39Å; L304-F322 HydrophobicContact CD1-CE1 3.72Å; V306-F322 HydrophobicContact CG2-CE1 4.5Å; V306-F322 HydrophobicContact CG2-CE2 3.91Å; V306-F322 HydrophobicContact CG2-CZ 3.54Å; L318-F322 WeakPolarHBondContact O-CD2 3.31Å; L318-F322 PolarHBondContact O-N 3.29Å; L318-F322 VanDerWaalsContact O-N 3.11Å; E320-F322 VanDerWaalsContact C-N 3.28Å; E320-F322 PolarHBondContact O-N 3.37Å; F322-Y325 PolarHBondContact O-N 3.46Å; F322-I328 HydrophobicContact CB-CD1 3.44Å; F322-I328 VanDerWaalsContact CB-CD1 3.44Å; F322-I328 HydrophobicContact CB-CG1 4.25Å; F322-I328 HydrophobicContact CG-CD1 4.5Å; F322-L342 HydrophobicContact CD1-CD1 3.92Å; F322-L342 HydrophobicContact CD1-CD2 4.01Å; F322-L342 HydrophobicContact CD2-CD2 3.69Å; F322-L342 HydrophobicContact CE1-CD1 4.09Å; F322-L342 HydrophobicContact CE1-CD2 4.04Å; F322-L342 HydrophobicContact CE2-CD2 3.73Å; F322-L342 HydrophobicContact CG-CD1 4.4Å; F322-L342 HydrophobicContact CG-CD2 3.85Å; F322-L342 HydrophobicContact CZ-CD2 3.91Å; F322-A353 HydrophobicContact CD1-CB 3.84Å; F322-A353 HydrophobicContact CE1-CB 3.83Å; F322-L357 HydrophobicContact CD1-CD1 3.92Å; F322-L357 HydrophobicContact CD2-CD1 3.81Å; F322-L357 HydrophobicContact CE1-CD1 3.62Å; F322-L357 HydrophobicContact CE2-CD1 3.51Å; F322-L357 HydrophobicContact CG-CD1 4.01Å; F322-L357 HydrophobicContact CZ-CD1 3.4Å; F322-L357 VanDerWaalsContact CZ-CD1 3.4Å; F322-V369 HydrophobicContact CZ-CG1 4.49Å; F322-V369 HydrophobicContact CZ-CG2 4.47Å
323	K	92.3	Very high	91.4	Very high	153 Å²	153	67.1 Å²	67.1	67%	0.665	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-44.4	-42.1	175.8	-174.9	177.4	179.2	-177.2	0	116.3	R319 E320 Y325	R319-K323 VanDerWaalsContact O-CB 3.3Å; R319-K323 WeakPolarHBondContact O-CB 3.45Å; R319-K323 PolarHBondContact O-N 3.07Å; E320-K323 WeakPolarHBondContact O-CB 3.48Å; E320-K323 PolarHBondContact O-N 2.86Å; K323-Y325 PolarHBondContact O-N 3.09Å
324	P	92.4	Very high	91.6	Very high	99 Å²	99	68.3 Å²	68.3	64%	0.643	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.6	-7.5	-179.3	28.8	-35.6	0	0	0	114.3
325	Y	92.9	Very high	91.4	Very high	56 Å²	56	68.6 Å²	68.6	22%	0.22	34%	0.344	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.2	-25.5	-179	-51.8	-70.4	0	0	0	113.8	M321 F322 K323 N349 K352 A353 A356 L357	M321-Y325 WeakPolarHBondContact O-CE2 3.44Å; F322-Y325 PolarHBondContact O-N 3.46Å; K323-Y325 PolarHBondContact O-N 3.09Å; Y325-N349 WeakPolarHBondContact O-CB 3.5Å; Y325-N349 PolarHBondContact O-ND2 3.48Å; Y325-K352 HydrophobicContact CD1-CB 4.08Å; Y325-A353 HydrophobicContact CD1-CB 4.45Å; Y325-A353 HydrophobicContact CD2-CB 3.84Å; Y325-A353 HydrophobicContact CG-CB 3.73Å; Y325-A356 HydrophobicContact CE1-CB 3.57Å; Y325-A356 VanDerWaalsContact OH-CB 3.25Å; Y325-A356 WeakPolarHBondContact OH-CB 3.23Å; Y325-L357 HydrophobicContact CD2-CD1 4.2Å; Y325-L357 HydrophobicContact CE2-CD1 3.74Å; Y325-L357 HydrophobicContact CE2-CD2 4.12Å; Y325-L357 HydrophobicContact CE2-CG 3.83Å
326	G	91	Very high	91.3	Very high	15 Å²	15	72 Å²	72	16%	0.155	36%	0.362	C	S	.	.			trans	169	175.9	178.8	0	0	0	0	0	113.1	D345	G326-D345 VanDerWaalsContact CA-OD2 3.32Å; G326-D345 WeakPolarHBondContact CA-OD2 3.27Å
327	E	93.2	Very high	91.2	Very high	103 Å²	103	72.6 Å²	72.6	48%	0.481	36%	0.359	S	S	.	.			trans	-68.3	154.8	170.7	-60.5	172.1	166.6	0	0	111.2	K297 F298 V344 D345	K297-E327 IonicContact NZ-OE1 2.72Å; K297-E327 PolarHBondContact NZ-OE1 3.49Å; K297-E327 IonicContact NZ-OE2 2.72Å; K297-E327 PolarHBondContact NZ-OE2 3.47Å; F298-E327 HydrophobicContact CE1-CB 4.23Å; F298-E327 HydrophobicContact CZ-CB 4.01Å; E327-V344 CarbonylContact O-C 3.6Å; E327-V344 WeakPolarHBondContact O-CA 3.21Å; E327-D345 HydrophobicContact CB-CB 4.17Å; E327-D345 PolarHBondContact N-OD2 3.37Å; E327-D345 PolarHBondContact O-N 3.37Å
328	I	93	Very high	91.1	Very high	15 Å²	15	71.5 Å²	71.5	8%	0.077	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	119.8	177.6	-45.9	171.5	0	0	0	110	R319 F322 I331 L342 K343	R319-I328 HydrophobicContact CB-CD1 4.41Å; R319-I328 HydrophobicContact CG-CD1 4.28Å; R319-I328 PolarHBondContact NH1-O 3.49Å; R319-I328 PolarHBondContact NH2-O 2.83Å; F322-I328 HydrophobicContact CB-CD1 3.44Å; F322-I328 VanDerWaalsContact CB-CD1 3.44Å; F322-I328 HydrophobicContact CB-CG1 4.25Å; F322-I328 HydrophobicContact CG-CD1 4.5Å; I328-I331 HydrophobicContact CG2-CD1 4.21Å; I328-I331 HydrophobicContact CG2-CG1 3.78Å; I328-L342 HydrophobicContact CG2-CB 4.18Å; I328-K343 WeakPolarHBondContact CA-O 3.34Å; I328-K343 WeakPolarHBondContact CG2-O 3.46Å
329	S	89.5	Confident	91.2	Very high	62 Å²	62	73.4 Å²	73.4	43%	0.434	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	-65.2	178	173.1	0	0	0	0	111.7	F298 K343	F298-S329 VanDerWaalsContact CG-CB 3.44Å; S329-K343 PolarHBondContact N-O 2.93Å
330	E	87.4	Confident	91.2	Very high	93 Å²	93	68.3 Å²	68.3	44%	0.435	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	140.4	-177.7	-70.8	167.7	-150.3	0	0	111.2	L342 K343	E330-L342 CarbonylContact O-C 3.5Å; E330-L342 VanDerWaalsContact O-CA 3.23Å; E330-L342 WeakPolarHBondContact O-CA 3.34Å; E330-K343 HydrophobicContact CB-CB 4.44Å; E330-K343 HydrophobicContact CB-CD 4.18Å; E330-K343 HydrophobicContact CB-CG 4.31Å; E330-K343 VanDerWaalsContact CD-CE 3.45Å; E330-K343 VanDerWaalsContact CD-NZ 3.26Å; E330-K343 HydrophobicContact CG-CD 4.21Å; E330-K343 PolarHBondContact O-N 2.92Å; E330-K343 WeakPolarHBondContact OE1-CE 3.29Å; E330-K343 IonicContact OE1-NZ 3.86Å; E330-K343 PolarHBondContact OE1-NZ 3.5Å; E330-K343 WeakPolarHBondContact OE2-CD 3.49Å; E330-K343 WeakPolarHBondContact OE2-CE 3.41Å; E330-K343 IonicContact OE2-NZ 3.19Å; E330-K343 PolarHBondContact OE2-NZ 3.47Å
331	I	92.4	Very high	91.3	Very high	36 Å²	36	63.3 Å²	63.3	19%	0.185	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	136.8	165.5	-56.6	179.6	0	0	0	107.3	D315 L318 R319 I328 T340 F341 L342	D315-I331 HydrophobicContact CB-CD1 4.36Å; D315-I331 HydrophobicContact CB-CG2 4.16Å; D315-I331 WeakPolarHBondContact OD1-CG2 3.27Å; L318-I331 HydrophobicContact CD1-CG2 4.48Å; R319-I331 HydrophobicContact CB-CD1 4.29Å; I328-I331 HydrophobicContact CG2-CD1 4.21Å; I328-I331 HydrophobicContact CG2-CG1 3.78Å; I331-T340 HydrophobicContact CG2-CG2 3.63Å; I331-F341 CarbonylContact C-O 3.59Å; I331-L342 HydrophobicContact CG1-CB 4.33Å
332	F	91.8	Very high	91.4	Very high	117 Å²	117	61.2 Å²	61.2	51%	0.513	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	95	175.8	176.9	-94.2	0	0	0	109.6	T340 F341	F332-T340 WeakPolarHBondContact O-CA 3.25Å; F332-F341 HydrophobicContact CD1-CD2 4.24Å; F332-F341 PolarHBondContact N-O 2.94Å; F332-F341 PolarHBondContact O-N 3.29Å
333	S	91.1	Very high	91.4	Very high	32 Å²	32	63 Å²	63	22%	0.224	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	136.2	-178.4	-67.2	0	0	0	0	112	D315 T340	D315-S333 VanDerWaalsContact OD1-CB 3.3Å; D315-S333 WeakPolarHBondContact OD1-CB 3.18Å; D315-S333 PolarHBondContact OD1-OG 3.44Å; S333-T340 WeakPolarHBondContact CA-OG1 3.21Å; S333-T340 WeakPolarHBondContact CB-OG1 3.3Å; S333-T340 VanDerWaalsContact OG-CG2 3.27Å; S333-T340 WeakPolarHBondContact OG-CG2 3.47Å; S333-T340 PolarHBondContact OG-OG1 3.41Å
334	N	90.6	Very high	91.4	Very high	37 Å²	37	55.8 Å²	55.8	20%	0.198	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	90.6	175.5	-167.4	-86.3	0	0	0	109.9	D336 K337 N338 F339	N334-D336 PolarHBondContact O-N 3.33Å; N334-K337 CarbonylContact O-C 3.58Å; N334-K337 PolarHBondContact O-N 2.78Å; N334-K337 WeakPolarHBondContact OD1-CB 3.48Å; N334-K337 VanDerWaalsContact OD1-CG 3.28Å; N334-K337 WeakPolarHBondContact OD1-CG 3.32Å; N334-K337 PolarHBondContact OD1-N 3.48Å; N334-N338 PolarHBondContact O-N 3.48Å; N334-F339 WeakPolarHBondContact CA-O 3.47Å; N334-F339 HydrophobicContact CB-CD2 4.16Å; N334-F339 HydrophobicContact CB-CE1 4.24Å; N334-F339 HydrophobicContact CB-CE2 3.75Å; N334-F339 HydrophobicContact CB-CZ 3.8Å; N334-F339 PolarHBondContact N-O 3.09Å; N334-F339 PolarHBondContact O-N 3.48Å
335	L	85.9	Confident	91.4	Very high	78 Å²	78	51.6 Å²	51.6	41%	0.408	26%	0.259	S	S	.	.	G	3₁₀ helix	trans	-63.5	-38.3	-173.9	-55.9	179.2	0	0	0	112.3	N311 I313 K337 N338	N311-L335 PolarHBondContact ND2-O 3.02Å; N311-L335 VanDerWaalsContact ND2-O 3.12Å; I313-L335 HydrophobicContact CG2-CD2 3.71Å; L335-K337 PolarHBondContact O-N 3.42Å; L335-N338 PolarHBondContact O-N 3.05Å
336	D	88.6	Confident	91.3	Very high	146 Å²	146	52.9 Å²	52.9	78%	0.781	26%	0.264	S	S	*	.	G	3₁₀ helix	trans	-56.3	-35.3	177.4	-58.6	-32.1	0	0	0	113.1	N334	N334-D336 PolarHBondContact O-N 3.33Å
337	K	89.6	Confident	91.2	Very high	137 Å²	137	54.4 Å²	54.4	60%	0.596	27%	0.267	S	S	*	.	G	3₁₀ helix	trans	-111	7.8	-175.7	-59	176.8	-178	179.4	0	113	N334 L335 F339	N334-K337 CarbonylContact O-C 3.58Å; N334-K337 PolarHBondContact O-N 2.78Å; N334-K337 WeakPolarHBondContact OD1-CB 3.48Å; N334-K337 VanDerWaalsContact OD1-CG 3.28Å; N334-K337 WeakPolarHBondContact OD1-CG 3.32Å; N334-K337 PolarHBondContact OD1-N 3.48Å; L335-K337 PolarHBondContact O-N 3.42Å; K337-F339 VanDerWaalsContact C-N 3.31Å; K337-F339 HydrophobicContact CB-CD1 3.57Å; K337-F339 HydrophobicContact CB-CE1 3.43Å; K337-F339 VanDerWaalsContact CB-CE1 3.43Å; K337-F339 HydrophobicContact CB-CZ 4.5Å; K337-F339 HydrophobicContact CD-CE1 3.87Å; K337-F339 HydrophobicContact CG-CE1 4.26Å; K337-F339 PolarHBondContact O-N 2.82Å
338	N	91.1	Very high	91.1	Very high	28 Å²	28	52.1 Å²	52.1	15%	0.15	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	51.9	44.6	174.4	-84.2	-45.2	0	0	0	114.1	N308 L309 T310 N311 N334 L335	N308-N338 PolarHBondContact N-O 3.17Å; N308-N338 VanDerWaalsContact N-O 3.12Å; L309-N338 PolarHBondContact N-O 2.97Å; L309-N338 VanDerWaalsContact N-O 3.16Å; L309-N338 WeakPolarHBondContact O-CB 3.3Å; L309-N338 PolarHBondContact O-OD1 2.94Å; T310-N338 VanDerWaalsContact C-OD1 3.23Å; T310-N338 WeakPolarHBondContact CA-OD1 3.27Å; N311-N338 PolarHBondContact N-OD1 2.86Å; N311-N338 VanDerWaalsContact N-OD1 3.15Å; N311-N338 PolarHBondContact OD1-ND2 3.16Å; N311-N338 PolarHBondContact OD1-OD1 3.4Å; N311-N338 VanDerWaalsContact OD1-OD1 3.11Å; N334-N338 PolarHBondContact O-N 3.48Å; L335-N338 PolarHBondContact O-N 3.05Å
339	F	92.6	Very high	91.2	Very high	39 Å²	39	52.9 Å²	52.9	17%	0.171	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	155.7	172.3	72.1	-106	0	0	0	112.9	Y305 V306 N334 K337 F341	Y305-F339 HydrophobicContact CD2-CB 4.36Å; Y305-F339 HydrophobicContact CD2-CD2 4.45Å; Y305-F339 HydrophobicContact CE2-CB 3.45Å; Y305-F339 VanDerWaalsContact CE2-CB 3.45Å; Y305-F339 HydrophobicContact CE2-CD1 4.29Å; Y305-F339 AromaticContact CE2-CD2 3.96Å; Y305-F339 HydrophobicContact CE2-CD2 3.96Å; Y305-F339 AromaticContact CE2-CG 3.66Å; Y305-F339 HydrophobicContact CE2-CG 3.66Å; V306-F339 CarbonylContact O-C 3.58Å; V306-F339 WeakPolarHBondContact O-CA 3.21Å; N334-F339 WeakPolarHBondContact CA-O 3.47Å; N334-F339 HydrophobicContact CB-CD2 4.16Å; N334-F339 HydrophobicContact CB-CE1 4.24Å; N334-F339 HydrophobicContact CB-CE2 3.75Å; N334-F339 HydrophobicContact CB-CZ 3.8Å; N334-F339 PolarHBondContact N-O 3.09Å; N334-F339 PolarHBondContact O-N 3.48Å; K337-F339 VanDerWaalsContact C-N 3.31Å; K337-F339 HydrophobicContact CB-CD1 3.57Å; K337-F339 HydrophobicContact CB-CE1 3.43Å; K337-F339 VanDerWaalsContact CB-CE1 3.43Å; K337-F339 HydrophobicContact CB-CZ 4.5Å; K337-F339 HydrophobicContact CD-CE1 3.87Å; K337-F339 HydrophobicContact CG-CE1 4.26Å; K337-F339 PolarHBondContact O-N 2.82Å; F339-F341 HydrophobicContact CD2-CD2 4.11Å; F339-F341 AromaticContact CD2-CE2 3.96Å; F339-F341 HydrophobicContact CD2-CE2 3.96Å; F339-F341 AromaticContact CE2-CD2 3.87Å; F339-F341 HydrophobicContact CE2-CD2 3.87Å; F339-F341 AromaticContact CE2-CE2 3.56Å; F339-F341 HydrophobicContact CE2-CE2 3.56Å; F339-F341 HydrophobicContact CZ-CE2 4.42Å
340	T	93.7	Very high	91.3	Very high	1 Å²	1	49.9 Å²	49.9	1%	0.006	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	147	170.5	-61.6	0	0	0	0	110.2	V306 L309 L318 I331 F332 S333	V306-T340 PolarHBondContact N-O 2.69Å; V306-T340 PolarHBondContact O-N 3.38Å; L309-T340 WeakPolarHBondContact CD1-OG1 3.18Å; L318-T340 HydrophobicContact CD1-CG2 3.73Å; L318-T340 WeakPolarHBondContact CD1-OG1 3.4Å; I331-T340 HydrophobicContact CG2-CG2 3.63Å; F332-T340 WeakPolarHBondContact O-CA 3.25Å; S333-T340 WeakPolarHBondContact CA-OG1 3.21Å; S333-T340 WeakPolarHBondContact CB-OG1 3.3Å; S333-T340 VanDerWaalsContact OG-CG2 3.27Å; S333-T340 WeakPolarHBondContact OG-CG2 3.47Å; S333-T340 PolarHBondContact OG-OG1 3.41Å
341	F	93.8	Very high	91.5	Very high	35 Å²	35	48.8 Å²	48.8	15%	0.154	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	140.7	161.2	-70.4	-80.8	0	0	0	109.8	L304 Y305 I331 F332 F339 A372	L304-F341 WeakPolarHBondContact O-CA 3.38Å; Y305-F341 HydrophobicContact CD2-CD1 4.26Å; Y305-F341 AromaticContact CD2-CE1 3.7Å; Y305-F341 HydrophobicContact CD2-CE1 3.7Å; Y305-F341 HydrophobicContact CD2-CE2 4.35Å; Y305-F341 AromaticContact CD2-CZ 3.76Å; Y305-F341 HydrophobicContact CD2-CZ 3.76Å; Y305-F341 HydrophobicContact CE2-CZ 4.47Å; Y305-F341 HydrophobicContact CG-CE1 4.27Å; I331-F341 CarbonylContact C-O 3.59Å; F332-F341 HydrophobicContact CD1-CD2 4.24Å; F332-F341 PolarHBondContact N-O 2.94Å; F332-F341 PolarHBondContact O-N 3.29Å; F339-F341 HydrophobicContact CD2-CD2 4.11Å; F339-F341 AromaticContact CD2-CE2 3.96Å; F339-F341 HydrophobicContact CD2-CE2 3.96Å; F339-F341 AromaticContact CE2-CD2 3.87Å; F339-F341 HydrophobicContact CE2-CD2 3.87Å; F339-F341 AromaticContact CE2-CE2 3.56Å; F339-F341 HydrophobicContact CE2-CE2 3.56Å; F339-F341 HydrophobicContact CZ-CE2 4.42Å; F341-A372 HydrophobicContact CD1-CB 3.71Å; F341-A372 HydrophobicContact CE1-CB 3.69Å
342	L	93.9	Very high	91.6	Very high	1 Å²	1	51.8 Å²	51.8	1%	0.005	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	157.1	173.2	61.6	84.1	0	0	0	111.6	R303 L304 V306 F322 I328 E330 I331 V344	R303-L342 CarbonylContact C-O 3.39Å; R303-L342 VanDerWaalsContact CA-O 3.28Å; R303-L342 WeakPolarHBondContact CA-O 3.39Å; R303-L342 WeakPolarHBondContact CG-O 3.46Å; L304-L342 HydrophobicContact CB-CD1 4.11Å; L304-L342 HydrophobicContact CB-CG 4.47Å; L304-L342 HydrophobicContact CD1-CD1 4.34Å; L304-L342 PolarHBondContact N-O 3.19Å; L304-L342 PolarHBondContact O-N 3.27Å; V306-L342 HydrophobicContact CG2-CD2 4.02Å; V306-L342 HydrophobicContact CG2-CG 4.49Å; F322-L342 HydrophobicContact CD1-CD1 3.92Å; F322-L342 HydrophobicContact CD1-CD2 4.01Å; F322-L342 HydrophobicContact CD2-CD2 3.69Å; F322-L342 HydrophobicContact CE1-CD1 4.09Å; F322-L342 HydrophobicContact CE1-CD2 4.04Å; F322-L342 HydrophobicContact CE2-CD2 3.73Å; F322-L342 HydrophobicContact CG-CD1 4.4Å; F322-L342 HydrophobicContact CG-CD2 3.85Å; F322-L342 HydrophobicContact CZ-CD2 3.91Å; I328-L342 HydrophobicContact CG2-CB 4.18Å; E330-L342 CarbonylContact O-C 3.5Å; E330-L342 VanDerWaalsContact O-CA 3.23Å; E330-L342 WeakPolarHBondContact O-CA 3.34Å; I331-L342 HydrophobicContact CG1-CB 4.33Å; L342-V344 HydrophobicContact CD1-CG2 3.63Å
343	K	92.4	Very high	91.7	Very high	40 Å²	40	46.2 Å²	46.2	17%	0.174	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	118.2	174.4	-72.9	-178.1	178.7	178	0	111	F298 R303 I328 S329 E330	F298-K343 HydrophobicContact CB-CB 4.31Å; F298-K343 HydrophobicContact CB-CD 4.2Å; F298-K343 HydrophobicContact CD1-CB 4.33Å; R303-K343 HydrophobicContact CB-CG 4.19Å; R303-K343 HydrophobicContact CG-CG 4.03Å; I328-K343 WeakPolarHBondContact CA-O 3.34Å; I328-K343 WeakPolarHBondContact CG2-O 3.46Å; S329-K343 PolarHBondContact N-O 2.93Å; E330-K343 HydrophobicContact CB-CB 4.44Å; E330-K343 HydrophobicContact CB-CD 4.18Å; E330-K343 HydrophobicContact CB-CG 4.31Å; E330-K343 VanDerWaalsContact CD-CE 3.45Å; E330-K343 VanDerWaalsContact CD-NZ 3.26Å; E330-K343 HydrophobicContact CG-CD 4.21Å; E330-K343 PolarHBondContact O-N 2.92Å; E330-K343 WeakPolarHBondContact OE1-CE 3.29Å; E330-K343 IonicContact OE1-NZ 3.86Å; E330-K343 PolarHBondContact OE1-NZ 3.5Å; E330-K343 WeakPolarHBondContact OE2-CD 3.49Å; E330-K343 WeakPolarHBondContact OE2-CE 3.41Å; E330-K343 IonicContact OE2-NZ 3.19Å; E330-K343 PolarHBondContact OE2-NZ 3.47Å
344	V	93.2	Very high	91.8	Very high	2 Å²	2	45.2 Å²	45.2	1%	0.012	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	157.5	172.2	-171.5	0	0	0	0	109.7	F298 N302 L304 E327 L342 N349 A350	F298-V344 WeakPolarHBondContact CD1-O 2.77Å; N302-V344 WeakPolarHBondContact CB-O 3.39Å; N302-V344 PolarHBondContact O-N 2.83Å; L304-V344 HydrophobicContact CD1-CG2 3.88Å; L304-V344 HydrophobicContact CG-CG2 4.41Å; E327-V344 CarbonylContact O-C 3.6Å; E327-V344 WeakPolarHBondContact O-CA 3.21Å; L342-V344 HydrophobicContact CD1-CG2 3.63Å; V344-N349 HydrophobicContact CG1-CB 3.87Å; V344-A350 HydrophobicContact CB-CB 4.14Å; V344-A350 HydrophobicContact CG2-CB 4.29Å
345	D	91.6	Very high	91.9	Very high	11 Å²	11	51.6 Å²	51.6	6%	0.059	24%	0.239	C	C	.	.	S	Bend	trans	-53.7	-61.5	177.7	49.3	23.9	0	0	0	114	K297 F298 N302 G326 E327 N349	K297-D345 CarbonylContact C-O 3.54Å; K297-D345 WeakPolarHBondContact CA-O 3.41Å; K297-D345 HydrophobicContact CG-CB 4.44Å; F298-D345 HydrophobicContact CE1-CB 4Å; F298-D345 HydrophobicContact CZ-CB 4.24Å; F298-D345 PolarHBondContact N-O 3.34Å; N302-D345 PolarHBondContact ND2-O 2.84Å; G326-D345 VanDerWaalsContact CA-OD2 3.32Å; G326-D345 WeakPolarHBondContact CA-OD2 3.27Å; E327-D345 HydrophobicContact CB-CB 4.17Å; E327-D345 PolarHBondContact N-OD2 3.37Å; E327-D345 PolarHBondContact O-N 3.37Å; D345-N349 VanDerWaalsContact OD1-CB 3.28Å; D345-N349 WeakPolarHBondContact OD1-CB 3.48Å; D345-N349 PolarHBondContact OD1-ND2 2.88Å
346	Y	91.2	Very high	92.2	Very high	83 Å²	83	50.3 Å²	50.3	33%	0.325	24%	0.24	S	C	.	.	S	Bend	trans	-123.5	157.6	-170	-65	-74.3	0	0	0	112.7	E295 K297 N302 N349 A350	E295-Y346 HydrophobicContact CB-CD1 3.77Å; E295-Y346 HydrophobicContact CB-CE1 4.1Å; E295-Y346 WeakPolarHBondContact O-CE1 3.43Å; K297-Y346 HydrophobicContact CD-CE2 4.46Å; K297-Y346 WeakPolarHBondContact CE-OH 3.49Å; K297-Y346 HydrophobicContact CG-CE1 3.9Å; K297-Y346 HydrophobicContact CG-CE2 4.12Å; N302-Y346 WeakPolarHBondContact ND2-CA 3.48Å; Y346-N349 WeakPolarHBondContact O-CB 3.5Å; Y346-N349 PolarHBondContact O-N 3.33Å; Y346-A350 PolarHBondContact O-N 3.42Å
347	H	89	Confident	92.5	Very high	46 Å²	46	44 Å²	44	21%	0.213	21%	0.206	C	C	.	.	H	α-helix	trans	-66.9	-44.8	-176.9	-172.6	66.4	0	0	0	112.8	E295 R301 N302 N349 A350 E351 F371	E295-H347 PolarHBondContact OE2-N 2.9Å; R301-H347 PolarHBondContact O-ND1 2.89Å; R301-H347 VanDerWaalsContact O-ND1 3.14Å; N302-H347 WeakPolarHBondContact OD1-CA 3.37Å; N302-H347 VanDerWaalsContact OD1-CB 3.32Å; N302-H347 WeakPolarHBondContact OD1-CB 3.28Å; N302-H347 PolarHBondContact OD1-N 2.78Å; H347-N349 PolarHBondContact O-N 3.03Å; H347-A350 WeakPolarHBondContact O-CB 3.46Å; H347-A350 PolarHBondContact O-N 2.85Å; H347-A350 VanDerWaalsContact O-N 3.17Å; H347-E351 IonicContact NE2-OE1 2.63Å; H347-E351 PolarHBondContact O-N 2.72Å; H347-F371 AromaticContact CE1-CE1 3.68Å; H347-F371 AromaticContact CE1-CZ 3.65Å; H347-F371 AromaticContact ND1-CE1 3.88Å
348	P	91.5	Very high	92.5	Very high	56 Å²	56	39.5 Å²	39.5	36%	0.364	19%	0.189	S	C	.	.	H	α-helix	trans	-63.4	-23.2	174.7	-22.6	35.2	0	0	0	113.6	E295 K352	E295-P348 WeakPolarHBondContact OE2-CD 3.4Å; P348-K352 WeakPolarHBondContact O-CD 3.46Å; P348-K352 WeakPolarHBondContact O-CE 3.32Å; P348-K352 VanDerWaalsContact O-CG 3.25Å; P348-K352 WeakPolarHBondContact O-CG 3.27Å; P348-K352 PolarHBondContact O-N 2.98Å
349	N	93.5	Very high	92.4	Very high	30 Å²	30	39.4 Å²	39.4	16%	0.16	19%	0.194	C	C	.	.	H	α-helix	trans	-79.1	-40.9	175.4	-78	-2.7	0	0	0	111.5	Y325 V344 D345 Y346 H347 E351 K352 A353	Y325-N349 WeakPolarHBondContact O-CB 3.5Å; Y325-N349 PolarHBondContact O-ND2 3.48Å; V344-N349 HydrophobicContact CG1-CB 3.87Å; D345-N349 VanDerWaalsContact OD1-CB 3.28Å; D345-N349 WeakPolarHBondContact OD1-CB 3.48Å; D345-N349 PolarHBondContact OD1-ND2 2.88Å; Y346-N349 WeakPolarHBondContact O-CB 3.5Å; Y346-N349 PolarHBondContact O-N 3.33Å; H347-N349 PolarHBondContact O-N 3.03Å; N349-E351 VanDerWaalsContact C-N 3.3Å; N349-E351 PolarHBondContact O-N 3.45Å; N349-K352 PolarHBondContact O-N 2.73Å; N349-K352 PolarHBondContact OD1-NZ 3.39Å; N349-A353 PolarHBondContact O-N 3.02Å
350	A	92.5	Very high	92.3	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-59.4	-39.5	169.7	0	0	0	0	0	112.1	L304 V344 Y346 H347 A353 K354 F371	L304-A350 HydrophobicContact CD1-CB 4.31Å; L304-A350 HydrophobicContact CD2-CB 4.23Å; L304-A350 HydrophobicContact CG-CB 4.26Å; V344-A350 HydrophobicContact CB-CB 4.14Å; V344-A350 HydrophobicContact CG2-CB 4.29Å; Y346-A350 PolarHBondContact O-N 3.42Å; H347-A350 WeakPolarHBondContact O-CB 3.46Å; H347-A350 PolarHBondContact O-N 2.85Å; H347-A350 VanDerWaalsContact O-N 3.17Å; A350-A353 PolarHBondContact O-N 2.83Å; A350-K354 WeakPolarHBondContact O-CB 3.28Å; A350-K354 PolarHBondContact O-N 3.26Å; A350-F371 HydrophobicContact CB-CE1 3.88Å; A350-F371 HydrophobicContact CB-CZ 4.47Å
351	E	92.4	Very high	92.1	Very high	69 Å²	69	45.4 Å²	45.4	32%	0.322	23%	0.228	S	C	.	.	H	α-helix	trans	-62.5	-46.1	172.6	-77.1	-163.9	173.9	0	0	113.3	H347 N349 A353 K354 R355 F371	H347-E351 IonicContact NE2-OE1 2.63Å; H347-E351 PolarHBondContact O-N 2.72Å; N349-E351 VanDerWaalsContact C-N 3.3Å; N349-E351 PolarHBondContact O-N 3.45Å; E351-A353 VanDerWaalsContact C-N 3.32Å; E351-A353 PolarHBondContact O-N 3.02Å; E351-K354 PolarHBondContact O-N 2.92Å; E351-R355 WeakPolarHBondContact O-CB 3.32Å; E351-R355 WeakPolarHBondContact O-CG 3.45Å; E351-R355 PolarHBondContact O-N 2.83Å; E351-R355 IonicContact OE2-CZ 2.78Å; E351-R355 IonicContact OE2-NE 3.84Å; E351-R355 IonicContact OE2-NH2 2.87Å; E351-R355 PolarHBondContact OE2-NH2 3.04Å; E351-F371 HydrophobicContact CG-CE2 4.34Å; E351-F371 HydrophobicContact CG-CZ 3.82Å
352	K	93.9	Very high	91.7	Very high	99 Å²	99	44.6 Å²	44.6	43%	0.43	22%	0.224	S	C	.	.	H	α-helix	trans	-58.5	-46.4	176.8	-69.7	162.8	-159.5	164.6	0	110.6	Y325 P348 N349 R355 A356	Y325-K352 HydrophobicContact CD1-CB 4.08Å; P348-K352 WeakPolarHBondContact O-CD 3.46Å; P348-K352 WeakPolarHBondContact O-CE 3.32Å; P348-K352 VanDerWaalsContact O-CG 3.25Å; P348-K352 WeakPolarHBondContact O-CG 3.27Å; P348-K352 PolarHBondContact O-N 2.98Å; N349-K352 PolarHBondContact O-N 2.73Å; N349-K352 PolarHBondContact OD1-NZ 3.39Å; K352-R355 PolarHBondContact O-N 2.76Å; K352-A356 WeakPolarHBondContact O-CB 3.38Å; K352-A356 PolarHBondContact O-N 3.03Å
353	A	94.2	Very high	91.3	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-60	-46.4	177	0	0	0	0	0	111.9	L304 F322 Y325 N349 A350 E351 A356 L357	L304-A353 HydrophobicContact CD1-CB 3.9Å; F322-A353 HydrophobicContact CD1-CB 3.84Å; F322-A353 HydrophobicContact CE1-CB 3.83Å; Y325-A353 HydrophobicContact CD1-CB 4.45Å; Y325-A353 HydrophobicContact CD2-CB 3.84Å; Y325-A353 HydrophobicContact CG-CB 3.73Å; N349-A353 PolarHBondContact O-N 3.02Å; A350-A353 PolarHBondContact O-N 2.83Å; E351-A353 VanDerWaalsContact C-N 3.32Å; E351-A353 PolarHBondContact O-N 3.02Å; A353-A356 PolarHBondContact O-N 3.44Å; A353-L357 VanDerWaalsContact O-CB 3.28Å; A353-L357 WeakPolarHBondContact O-CB 3.44Å; A353-L357 PolarHBondContact O-N 2.89Å
354	K	93	Very high	91	Very high	12 Å²	12	52.4 Å²	52.4	5%	0.052	28%	0.278	C	S	.	.	H	α-helix	trans	-56.6	-51.5	173.5	177	176	-179.6	-80.9	0	111.4	L304 A350 E351 A356 D358 V369 F371 D462	L304-K354 HydrophobicContact CD2-CB 4.45Å; A350-K354 WeakPolarHBondContact O-CB 3.28Å; A350-K354 PolarHBondContact O-N 3.26Å; E351-K354 PolarHBondContact O-N 2.92Å; K354-A356 VanDerWaalsContact C-N 3.32Å; K354-A356 PolarHBondContact O-N 3.28Å; K354-D358 VanDerWaalsContact O-CB 3.28Å; K354-D358 WeakPolarHBondContact O-CB 3.49Å; K354-D358 PolarHBondContact O-N 3.49Å; K354-V369 HydrophobicContact CB-CG1 4.2Å; K354-V369 HydrophobicContact CG-CG1 4.47Å; K354-F371 HydrophobicContact CD-CD2 3.84Å; K354-F371 HydrophobicContact CD-CE2 3.73Å; K354-D462 WeakPolarHBondContact CE-OD2 3.34Å; K354-D462 IonicContact NZ-OD1 2.94Å; K354-D462 PolarHBondContact NZ-OD1 2.91Å; K354-D462 IonicContact NZ-OD2 2.67Å; K354-D462 PolarHBondContact NZ-OD2 3.45Å
355	R	92.2	Very high	90.7	Very high	170 Å²	170	55.9 Å²	55.9	64%	0.642	29%	0.291	S	S	*	.	H	α-helix	trans	-66.2	-28.9	-175.9	-73.8	-173.4	-98.6	134.7	-14	113.7	E351 K352	E351-R355 WeakPolarHBondContact O-CB 3.32Å; E351-R355 WeakPolarHBondContact O-CG 3.45Å; E351-R355 PolarHBondContact O-N 2.83Å; E351-R355 IonicContact OE2-CZ 2.78Å; E351-R355 IonicContact OE2-NE 3.84Å; E351-R355 IonicContact OE2-NH2 2.87Å; E351-R355 PolarHBondContact OE2-NH2 3.04Å; K352-R355 PolarHBondContact O-N 2.76Å
356	A	93.2	Very high	90.7	Very high	52 Å²	52	60.2 Å²	60.2	43%	0.43	31%	0.311	S	S	.	.	H	α-helix	trans	-93.8	-27.2	-179.7	0	0	0	0	0	114.3	Y325 K352 A353 K354	Y325-A356 HydrophobicContact CE1-CB 3.57Å; Y325-A356 VanDerWaalsContact OH-CB 3.25Å; Y325-A356 WeakPolarHBondContact OH-CB 3.23Å; K352-A356 WeakPolarHBondContact O-CB 3.38Å; K352-A356 PolarHBondContact O-N 3.03Å; A353-A356 PolarHBondContact O-N 3.44Å; K354-A356 VanDerWaalsContact C-N 3.32Å; K354-A356 PolarHBondContact O-N 3.28Å
357	L	93.2	Very high	90.7	Very high	13 Å²	13	56.4 Å²	56.4	7%	0.068	30%	0.296	C	S	.	.	H	α-helix	trans	-104.7	-19.7	-175.4	-61.7	177	0	0	0	114.6	M321 F322 Y325 A353 G359 S360 V369	M321-L357 HydrophobicContact CE-CD2 4.05Å; F322-L357 HydrophobicContact CD1-CD1 3.92Å; F322-L357 HydrophobicContact CD2-CD1 3.81Å; F322-L357 HydrophobicContact CE1-CD1 3.62Å; F322-L357 HydrophobicContact CE2-CD1 3.51Å; F322-L357 HydrophobicContact CG-CD1 4.01Å; F322-L357 HydrophobicContact CZ-CD1 3.4Å; F322-L357 VanDerWaalsContact CZ-CD1 3.4Å; Y325-L357 HydrophobicContact CD2-CD1 4.2Å; Y325-L357 HydrophobicContact CE2-CD1 3.74Å; Y325-L357 HydrophobicContact CE2-CD2 4.12Å; Y325-L357 HydrophobicContact CE2-CG 3.83Å; A353-L357 VanDerWaalsContact O-CB 3.28Å; A353-L357 WeakPolarHBondContact O-CB 3.44Å; A353-L357 PolarHBondContact O-N 2.89Å; L357-G359 PolarHBondContact O-N 2.89Å; L357-S360 WeakPolarHBondContact O-CB 3.26Å; L357-S360 PolarHBondContact O-N 3.36Å; L357-S360 VanDerWaalsContact O-N 3.15Å; L357-S360 PolarHBondContact O-OG 3.12Å; L357-V369 HydrophobicContact CB-CG2 3.88Å
358	D	91.5	Very high	90.7	Very high	43 Å²	43	62 Å²	62	23%	0.23	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	124.8	174.2	-167.8	43.7	0	0	0	111.4	K354 S360 R368 V369 R370	K354-D358 VanDerWaalsContact O-CB 3.28Å; K354-D358 WeakPolarHBondContact O-CB 3.49Å; K354-D358 PolarHBondContact O-N 3.49Å; D358-S360 VanDerWaalsContact C-N 3.3Å; D358-S360 PolarHBondContact O-N 2.95Å; D358-R368 VanDerWaalsContact OD1-CA 3.29Å; D358-R368 WeakPolarHBondContact OD1-CA 3.3Å; D358-V369 HydrophobicContact CB-CB 4.12Å; D358-V369 PolarHBondContact OD1-N 3.09Å; D358-R370 IonicContact OD1-NH1 3.41Å; D358-R370 PolarHBondContact OD1-NH1 3.05Å; D358-R370 IonicContact OD2-CZ 2.66Å; D358-R370 IonicContact OD2-NH1 3.33Å; D358-R370 PolarHBondContact OD2-NH1 3.32Å; D358-R370 IonicContact OD2-NH2 3.72Å
359	G	88.1	Confident	90.8	Very high	25 Å²	25	59.3 Å²	59.3	26%	0.258	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.2	-3.8	-175.3	0	0	0	0	0	115.4	L357 L367	L357-G359 PolarHBondContact O-N 2.89Å; G359-L367 WeakPolarHBondContact CA-O 3.36Å; G359-L367 PolarHBondContact N-O 3.35Å
360	S	91.1	Very high	90.7	Very high	32 Å²	32	61.1 Å²	61.1	22%	0.224	30%	0.303	C	S	.	.			trans	-61.4	140.4	177	63.1	0	0	0	0	111.9	L357 D358 Q366 L367	L357-S360 WeakPolarHBondContact O-CB 3.26Å; L357-S360 PolarHBondContact O-N 3.36Å; L357-S360 VanDerWaalsContact O-N 3.15Å; L357-S360 PolarHBondContact O-OG 3.12Å; D358-S360 VanDerWaalsContact C-N 3.3Å; D358-S360 PolarHBondContact O-N 2.95Å; S360-Q366 CarbonylContact O-C 3.59Å; S360-Q366 WeakPolarHBondContact O-CA 3.38Å; S360-L367 PolarHBondContact O-N 3.38Å
361	M	88.5	Confident	90.6	Very high	134 Å²	134	63.7 Å²	63.7	66%	0.66	31%	0.314	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.8	115.4	-176.3	-76.4	-70.8	-161.1	0	0	111.5	Q366	M361-Q366 HydrophobicContact CE-CG 3.67Å; M361-Q366 HydrophobicContact CG-CG 4.44Å; M361-Q366 HydrophobicContact SD-CB 4.48Å; M361-Q366 HydrophobicContact SD-CG 3.52Å; M361-Q366 VanDerWaalsContact SD-CG 3.52Å
362	R	86.4	Confident	90.5	Very high	19 Å²	19	60.9 Å²	60.9	7%	0.072	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	123.3	171.2	-159.3	-166	84.7	105	-10.6	109.9	T310 D312 I313 E317 G364 R365 L367	T310-R362 PolarHBondContact OG1-NH2 3.32Å; D312-R362 IonicContact OD1-NH2 3.22Å; D312-R362 IonicContact OD2-NH1 2.76Å; D312-R362 IonicContact OD2-NH2 2.75Å; D312-R362 PolarHBondContact OD2-NH2 2.77Å; I313-R362 VanDerWaalsContact CD1-CZ 3.5Å; E317-R362 IonicContact OE1-CZ 3.26Å; E317-R362 IonicContact OE1-NH1 2.74Å; E317-R362 PolarHBondContact OE1-NH1 3.31Å; E317-R362 IonicContact OE2-CZ 3.94Å; E317-R362 IonicContact OE2-NH1 3.81Å; E317-R362 PolarHBondContact OE2-NH1 2.67Å; R362-G364 PolarHBondContact O-N 2.93Å; R362-G364 VanDerWaalsContact O-N 3.09Å; R362-R365 PolarHBondContact N-O 2.92Å; R362-R365 PolarHBondContact O-N 3.32Å; R362-L367 HydrophobicContact CB-CD1 4.5Å; R362-L367 HydrophobicContact CB-CD2 4.09Å; R362-L367 HydrophobicContact CB-CG 4.27Å
363	K	85.5	Confident	90	Very high	132 Å²	132	61.3 Å²	61.3	57%	0.574	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.9	42.5	177.1	-64.1	172.5	178.7	162.2	0	113.1	D312 E317 R365	D312-K363 VanDerWaalsContact OD2-CD 3.23Å; D312-K363 WeakPolarHBondContact OD2-CD 3.36Å; D312-K363 WeakPolarHBondContact OD2-CE 3.07Å; D312-K363 IonicContact OD2-NZ 3.81Å; D312-K363 PolarHBondContact OD2-NZ 2.98Å; E317-K363 IonicContact OE2-NZ 3.65Å; K363-R365 PolarHBondContact O-N 3.19Å
364	G	85.7	Confident	89.5	Confident	72 Å²	72	62.6 Å²	62.6	74%	0.742	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.5	1	179.1	0	0	0	0	0	116.6	R362	R362-G364 PolarHBondContact O-N 2.93Å; R362-G364 VanDerWaalsContact O-N 3.09Å
365	R	87.6	Confident	89.2	Confident	76 Å²	76	64.6 Å²	64.6	29%	0.287	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	138.3	177.1	-72.9	169	69.5	-173.2	-4.4	111.3	N308 L309 R362 K363	N308-R365 PolarHBondContact O-NE 3.14Å; N308-R365 PolarHBondContact O-NH2 3.24Å; N308-R365 PolarHBondContact OD1-NE 2.95Å; N308-R365 VanDerWaalsContact OD1-NE 3.09Å; N308-R365 PolarHBondContact OD1-NH2 3.47Å; L309-R365 PolarHBondContact O-NH1 3.28Å; L309-R365 PolarHBondContact O-NH2 2.71Å; R362-R365 PolarHBondContact N-O 2.92Å; R362-R365 PolarHBondContact O-N 3.32Å; K363-R365 PolarHBondContact O-N 3.19Å
366	Q	90.2	Very high	89.1	Confident	102 Å²	102	57.1 Å²	57.1	48%	0.477	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	121	171.8	-69.4	179.7	-15.3	0	0	109.8	N308 S360 M361	N308-Q366 PolarHBondContact ND2-O 3.12Å; S360-Q366 CarbonylContact O-C 3.59Å; S360-Q366 WeakPolarHBondContact O-CA 3.38Å; M361-Q366 HydrophobicContact CE-CG 3.67Å; M361-Q366 HydrophobicContact CG-CG 4.44Å; M361-Q366 HydrophobicContact SD-CB 4.48Å; M361-Q366 HydrophobicContact SD-CG 3.52Å; M361-Q366 VanDerWaalsContact SD-CG 3.52Å
367	L	92	Very high	89.1	Confident	3 Å²	3	55.4 Å²	55.4	2%	0.016	30%	0.298	C	S	.	.			trans	-64	148.7	171.4	-59	-168.4	0	0	0	110.5	L309 M321 G359 S360 R362	L309-L367 HydrophobicContact CD2-CD2 3.71Å; M321-L367 HydrophobicContact CE-CD1 3.54Å; M321-L367 HydrophobicContact SD-CD1 4.32Å; G359-L367 WeakPolarHBondContact CA-O 3.36Å; G359-L367 PolarHBondContact N-O 3.35Å; S360-L367 PolarHBondContact O-N 3.38Å; R362-L367 HydrophobicContact CB-CD1 4.5Å; R362-L367 HydrophobicContact CB-CD2 4.09Å; R362-L367 HydrophobicContact CB-CG 4.27Å
368	R	89.6	Confident	89.2	Confident	163 Å²	163	55 Å²	55	62%	0.615	30%	0.296	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.4	109.1	173.6	-69	-174	175.8	-164.4	-2.6	109.6	V306 G307 N308 D358	V306-R368 CarbonylContact C-O 3.49Å; V306-R368 WeakPolarHBondContact CA-O 3.37Å; G307-R368 PolarHBondContact N-O 3.43Å; G307-R368 PolarHBondContact O-N 3.23Å; N308-R368 HydrophobicContact CB-CG 4.27Å; D358-R368 VanDerWaalsContact OD1-CA 3.29Å; D358-R368 WeakPolarHBondContact OD1-CA 3.3Å
369	V	92.6	Very high	89.4	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	125.1	179.7	-170.6	0	0	0	0	109.8	L304 Y305 V306 F322 K354 L357 D358	L304-V369 HydrophobicContact CB-CG1 4.46Å; L304-V369 HydrophobicContact CD1-CG1 4.22Å; L304-V369 HydrophobicContact CD2-CG1 4.49Å; Y305-V369 WeakPolarHBondContact O-CA 3.37Å; V306-V369 HydrophobicContact CG1-CG2 4.45Å; F322-V369 HydrophobicContact CZ-CG1 4.49Å; F322-V369 HydrophobicContact CZ-CG2 4.47Å; K354-V369 HydrophobicContact CB-CG1 4.2Å; K354-V369 HydrophobicContact CG-CG1 4.47Å; L357-V369 HydrophobicContact CB-CG2 3.88Å; D358-V369 HydrophobicContact CB-CB 4.12Å; D358-V369 PolarHBondContact OD1-N 3.09Å
370	R	91.2	Very high	89.8	Confident	68 Å²	68	56.5 Å²	56.5	26%	0.257	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	161.8	180	-72.9	-67.9	178.7	-83.7	18.3	109.7	L304 Y305 D358 D462	L304-R370 CarbonylContact C-O 3.54Å; L304-R370 WeakPolarHBondContact CA-O 3.41Å; Y305-R370 HydrophobicContact CD1-CB 4.43Å; Y305-R370 PolarHBondContact N-O 2.76Å; Y305-R370 PolarHBondContact O-N 3.25Å; D358-R370 IonicContact OD1-NH1 3.41Å; D358-R370 PolarHBondContact OD1-NH1 3.05Å; D358-R370 IonicContact OD2-CZ 2.66Å; D358-R370 IonicContact OD2-NH1 3.33Å; D358-R370 PolarHBondContact OD2-NH1 3.32Å; D358-R370 IonicContact OD2-NH2 3.72Å; R370-D462 WeakPolarHBondContact CD-OD2 3.47Å; R370-D462 IonicContact CZ-OD2 2.63Å; R370-D462 IonicContact NE-OD2 2.78Å; R370-D462 PolarHBondContact NE-OD2 3.2Å; R370-D462 IonicContact NH1-OD2 3.65Å; R370-D462 PolarHBondContact NH1-OD2 2.7Å; R370-D462 IonicContact NH2-OD2 3.99Å; R370-D462 PolarHBondContact NH2-OD2 3.17Å; R370-D462 VanDerWaalsContact NH2-OD2 3.07Å
371	F	91.3	Very high	90	Very high	53 Å²	53	55.8 Å²	55.8	23%	0.232	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	142.7	163.1	-74.4	-73.8	0	0	0	109.9	R301 L304 H347 A350 E351 K354	R301-F371 WeakPolarHBondContact O-CE1 3.49Å; L304-F371 HydrophobicContact CD2-CD1 3.74Å; L304-F371 HydrophobicContact CD2-CE1 3.86Å; L304-F371 HydrophobicContact CD2-CG 4.32Å; H347-F371 AromaticContact CE1-CE1 3.68Å; H347-F371 AromaticContact CE1-CZ 3.65Å; H347-F371 AromaticContact ND1-CE1 3.88Å; A350-F371 HydrophobicContact CB-CE1 3.88Å; A350-F371 HydrophobicContact CB-CZ 4.47Å; E351-F371 HydrophobicContact CG-CE2 4.34Å; E351-F371 HydrophobicContact CG-CZ 3.82Å; K354-F371 HydrophobicContact CD-CD2 3.84Å; K354-F371 HydrophobicContact CD-CE2 3.73Å
372	A	88.8	Confident	90.2	Very high	10 Å²	10	51.7 Å²	51.7	8%	0.083	27%	0.266	C	S	.	.			trans	-76.9	143	174.8	0	0	0	0	0	109.9	R303 F341 N374	R303-A372 HydrophobicContact CB-CB 4.03Å; R303-A372 HydrophobicContact CG-CB 3.8Å; R303-A372 WeakPolarHBondContact O-CB 3.25Å; R303-A372 PolarHBondContact O-N 3.42Å; F341-A372 HydrophobicContact CD1-CB 3.71Å; F341-A372 HydrophobicContact CE1-CB 3.69Å; A372-N374 PolarHBondContact O-N 2.74Å
373	P	84.4	Confident	90.6	Very high	109 Å²	109	51.3 Å²	51.3	71%	0.708	27%	0.265	S	S	*	.			trans	-62.5	114	177.7	24.8	-33.6	0	0	0	110.5	A375	P373-A375 PolarHBondContact O-N 3.43Å
374	N	84.2	Confident	90.9	Very high	27 Å²	27	45.8 Å²	45.8	14%	0.144	24%	0.243	C	C	.	.			trans	-83.6	95.4	-174.2	-169.7	13.3	0	0	0	112.3	A372 T376 I377 E422	A372-N374 PolarHBondContact O-N 2.74Å; N374-T376 PolarHBondContact ND2-OG1 3.39Å; N374-T376 VanDerWaalsContact ND2-OG1 3.15Å; N374-T376 PolarHBondContact O-N 2.87Å; N374-T376 VanDerWaalsContact O-N 3.09Å; N374-T376 PolarHBondContact OD1-N 3.45Å; N374-T376 PolarHBondContact OD1-OG1 2.9Å; N374-T376 VanDerWaalsContact OD1-OG1 3.09Å; N374-I377 HydrophobicContact CB-CD1 4.08Å; N374-I377 HydrophobicContact CB-CG1 4.12Å; N374-I377 WeakPolarHBondContact ND2-CG1 3.44Å; N374-E422 PolarHBondContact ND2-OE1 3.33Å
375	A	86.2	Confident	91.3	Very high	54 Å²	54	47 Å²	47	45%	0.446	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.8	23.6	176.3	0	0	0	0	0	114.5	P373 K426	P373-A375 PolarHBondContact O-N 3.43Å; A375-K426 HydrophobicContact CB-CD 4.17Å
376	T	91.1	Very high	91.5	Very high	13 Å²	13	52 Å²	52	8%	0.08	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.7	-5.7	170.7	77.1	0	0	0	0	114.3	N374 F423 K426	N374-T376 PolarHBondContact ND2-OG1 3.39Å; N374-T376 VanDerWaalsContact ND2-OG1 3.15Å; N374-T376 PolarHBondContact O-N 2.87Å; N374-T376 VanDerWaalsContact O-N 3.09Å; N374-T376 PolarHBondContact OD1-N 3.45Å; N374-T376 PolarHBondContact OD1-OG1 2.9Å; N374-T376 VanDerWaalsContact OD1-OG1 3.09Å; T376-F423 WeakPolarHBondContact CB-O 3.17Å; T376-F423 PolarHBondContact O-N 3.07Å; T376-F423 PolarHBondContact OG1-O 3.48Å; T376-K426 HydrophobicContact CG2-CB 4.15Å
377	I	92.6	Very high	91.7	Very high	15 Å²	15	47.5 Å²	47.5	8%	0.077	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	125.8	178.2	-43.8	-176.6	0	0	0	109.8	N374 I420 E422 M455 V457	N374-I377 HydrophobicContact CB-CD1 4.08Å; N374-I377 HydrophobicContact CB-CG1 4.12Å; N374-I377 WeakPolarHBondContact ND2-CG1 3.44Å; I377-I420 HydrophobicContact CG2-CG2 3.46Å; I377-I420 VanDerWaalsContact CG2-CG2 3.46Å; I377-E422 VanDerWaalsContact CD1-OE1 3.25Å; I377-E422 WeakPolarHBondContact CD1-OE1 3.41Å; I377-E422 HydrophobicContact CG1-CB 4.4Å; I377-E422 HydrophobicContact CG1-CG 4Å; I377-E422 WeakPolarHBondContact CG1-OE1 3.34Å; I377-M455 HydrophobicContact CB-CB 4.12Å; I377-M455 HydrophobicContact CG2-CB 3.81Å; I377-M455 HydrophobicContact CG2-CG 4.28Å; I377-M455 HydrophobicContact CG2-SD 3.59Å; I377-M455 VanDerWaalsContact CG2-SD 3.59Å; I377-M455 PolarHBondContact O-N 3.2Å; I377-M455 VanDerWaalsContact O-N 3.09Å; I377-V457 HydrophobicContact CD1-CG2 4.16Å
378	L	95	Very high	91.8	Very high	6 Å²	6	49.4 Å²	49.4	3%	0.031	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	140.8	174.4	-55.1	-179	0	0	0	109.7	V421 F423 A429 C432 L433 V452 D453	L378-V421 PolarHBondContact N-O 3.07Å; L378-V421 PolarHBondContact O-N 3.05Å; L378-F423 HydrophobicContact CD1-CD2 4.4Å; L378-F423 HydrophobicContact CD1-CE2 3.98Å; L378-A429 HydrophobicContact CD1-CB 4.37Å; L378-A429 HydrophobicContact CG-CB 4.41Å; L378-C432 HydrophobicContact CD1-CB 4.01Å; L378-L433 HydrophobicContact CD1-CB 4.48Å; L378-V452 HydrophobicContact CB-CG1 4Å; L378-V452 HydrophobicContact CD1-CG1 3.63Å; L378-V452 HydrophobicContact CG-CG1 4.33Å; L378-D453 CarbonylContact C-O 3.58Å; L378-D453 VanDerWaalsContact CA-O 3.26Å; L378-D453 WeakPolarHBondContact CA-O 3.2Å; L378-D453 WeakPolarHBondContact CB-O 3.49Å
379	R	95.5	Very high	91.9	Very high	99 Å²	99	44.8 Å²	44.8	37%	0.374	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	131	164.3	176.1	-178.2	63.6	-149.4	-0.6	107.8	V452 D453	R379-V452 WeakPolarHBondContact O-CA 3.4Å; R379-D453 HydrophobicContact CB-CB 4.49Å; R379-D453 IonicContact CZ-OD2 2.97Å; R379-D453 PolarHBondContact N-O 2.67Å; R379-D453 IonicContact NE-OD2 3.71Å; R379-D453 PolarHBondContact NE-OD2 3.26Å; R379-D453 IonicContact NH2-OD2 3.2Å; R379-D453 PolarHBondContact NH2-OD2 3.09Å; R379-D453 PolarHBondContact O-N 2.9Å
380	V	95.9	Very high	91.9	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	128.4	170.7	-170.9	0	0	0	0	107.9	L383 L392 F396 E418 G419 V421 C450 L451 V452	V380-L383 HydrophobicContact CB-CD1 4.37Å; V380-L383 HydrophobicContact CG1-CD1 4.17Å; V380-L383 HydrophobicContact CG1-CD2 3.72Å; V380-L383 HydrophobicContact CG1-CG 4.1Å; V380-L392 HydrophobicContact CB-CD1 4.49Å; V380-L392 HydrophobicContact CG1-CD1 4.39Å; V380-L392 HydrophobicContact CG2-CD1 4.45Å; V380-F396 HydrophobicContact CB-CZ 4.35Å; V380-F396 HydrophobicContact CG1-CE2 4.27Å; V380-F396 HydrophobicContact CG1-CZ 3.75Å; V380-F396 HydrophobicContact CG2-CE1 3.74Å; V380-F396 HydrophobicContact CG2-CE2 4.32Å; V380-F396 HydrophobicContact CG2-CZ 3.6Å; V380-E418 CarbonylContact O-C 3.58Å; V380-E418 VanDerWaalsContact O-CA 3.25Å; V380-E418 WeakPolarHBondContact O-CA 3.45Å; V380-G419 PolarHBondContact N-O 3.44Å; V380-G419 PolarHBondContact O-N 3.33Å; V380-V421 HydrophobicContact CG2-CB 4.37Å; V380-V421 HydrophobicContact CG2-CG2 3.75Å; V380-C450 HydrophobicContact CG1-CB 3.79Å; V380-L451 CarbonylContact C-O 3.51Å; V380-L451 VanDerWaalsContact CA-O 3.3Å; V380-L451 WeakPolarHBondContact CA-O 3.22Å; V380-V452 HydrophobicContact CG1-CG2 4.45Å; V380-V452 HydrophobicContact CG2-CG2 4.47Å
381	S	94.9	Very high	92	Very high	16 Å²	16	44.5 Å²	44.5	11%	0.112	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	176.7	-179.9	66.3	0	0	0	0	111.7	L383 G417 L451	S381-L383 VanDerWaalsContact C-N 3.26Å; S381-L383 PolarHBondContact O-N 2.78Å; S381-G417 CarbonylContact C-O 3.57Å; S381-L451 PolarHBondContact N-O 2.91Å; S381-L451 PolarHBondContact O-N 3.08Å
382	N	93.9	Very high	92.2	Very high	48 Å²	48	42 Å²	42	26%	0.257	23%	0.233	S	C	.	.	S	Bend	trans	61.4	30	-168.2	-167.4	35.4	0	0	0	113.7	G417 R448 P449 L451	N382-G417 PolarHBondContact N-O 3.05Å; N382-G417 VanDerWaalsContact N-O 3.16Å; N382-R448 PolarHBondContact OD1-NE 2.74Å; N382-R448 PolarHBondContact OD1-NH2 2.76Å; N382-P449 PolarHBondContact ND2-O 3.23Å; N382-L451 HydrophobicContact CB-CD1 4.19Å; N382-L451 HydrophobicContact CB-CG 4.05Å
383	L	94.6	Very high	92.4	Very high	11 Å²	11	43.4 Å²	43.4	6%	0.058	24%	0.237	C	C	.	.			trans	-77.8	140.5	177.1	-62.2	-178.6	0	0	0	111.2	V380 S381 V387 L392 I407 H415 G417 L443 C450	V380-L383 HydrophobicContact CB-CD1 4.37Å; V380-L383 HydrophobicContact CG1-CD1 4.17Å; V380-L383 HydrophobicContact CG1-CD2 3.72Å; V380-L383 HydrophobicContact CG1-CG 4.1Å; S381-L383 VanDerWaalsContact C-N 3.26Å; S381-L383 PolarHBondContact O-N 2.78Å; L383-V387 HydrophobicContact CB-CG2 4.46Å; L383-V387 HydrophobicContact CD2-CG2 4.47Å; L383-L392 HydrophobicContact CD1-CD1 4.25Å; L383-I407 HydrophobicContact CD1-CD1 3.61Å; L383-H415 PolarHBondContact O-CE1 3.24Å; L383-G417 PolarHBondContact N-O 2.93Å; L383-G417 WeakPolarHBondContact O-CA 3.4Å; L383-L443 HydrophobicContact CD2-CD1 3.55Å; L383-C450 HydrophobicContact CD2-CB 3.97Å
384	T	92.1	Very high	92.8	Very high	16 Å²	16	41.1 Å²	41.1	10%	0.098	22%	0.215	C	C	.	.			trans	-82.2	154.6	175.2	57.1	0	0	0	0	111.6	F386 V387 H415 S446 R448	T384-F386 PolarHBondContact O-N 3.01Å; T384-V387 PolarHBondContact O-N 3.33Å; T384-H415 PolarHBondContact O-CE1 2.81Å; T384-H415 PolarHBondContact O-NE2 2.96Å; T384-H415 VanDerWaalsContact O-NE2 3.16Å; T384-S446 WeakPolarHBondContact CG2-OG 3.33Å; T384-R448 HydrophobicContact CG2-CB 4.47Å
385	P	92.8	Very high	93.2	Very high	98 Å²	98	40.3 Å²	40.3	64%	0.636	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-3.8	-179.1	-24.7	35.4	0	0	0	116.4
386	F	92.5	Very high	93.6	Very high	180 Å²	180	37.7 Å²	37.7	79%	0.789	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	-99.3	2.2	177.7	-54.6	-71.1	0	0	0	113	T384	T384-F386 PolarHBondContact O-N 3.01Å
387	V	94	Very high	93.7	Very high	8 Å²	8	41.1 Å²	41.1	5%	0.048	21%	0.206	C	C	.	.			trans	-84.8	117.9	173.2	-174.8	0	0	0	0	109.4	L383 T384 L391 L392 I407 H415 L443 T444	L383-V387 HydrophobicContact CB-CG2 4.46Å; L383-V387 HydrophobicContact CD2-CG2 4.47Å; T384-V387 PolarHBondContact O-N 3.33Å; V387-L391 HydrophobicContact CG1-CD2 4.36Å; V387-L391 HydrophobicContact CG2-CD2 4.45Å; V387-L392 HydrophobicContact CG1-CB 4.25Å; V387-I407 HydrophobicContact CB-CD1 4.46Å; V387-I407 HydrophobicContact CG1-CD1 4.06Å; V387-H415 PolarHBondContact O-CD2 2.89Å; V387-L443 HydrophobicContact CG1-CD1 4.14Å; V387-L443 HydrophobicContact CG2-CB 4.43Å; V387-L443 HydrophobicContact CG2-CD1 4.42Å; V387-T444 HydrophobicContact CG2-CG2 4.04Å
388	S	93.6	Very high	93.7	Very high	43 Å²	43	40.8 Å²	40.8	30%	0.301	20%	0.204	S	C	.	.			trans	-94.4	173.6	174.1	82.5	0	0	0	0	111.8	E390 L391 L392	S388-E390 WeakPolarHBondContact CB-OE2 3.29Å; S388-E390 PolarHBondContact O-N 3.29Å; S388-E390 PolarHBondContact OG-N 3.28Å; S388-E390 PolarHBondContact OG-OE2 2.98Å; S388-L391 PolarHBondContact O-N 3.38Å; S388-L391 PolarHBondContact OG-N 2.89Å; S388-L392 WeakPolarHBondContact O-CB 3.45Å; S388-L392 PolarHBondContact O-N 3.37Å
389	N	93.2	Very high	93.7	Very high	66 Å²	66	41.1 Å²	41.1	35%	0.353	21%	0.205	S	C	.	.	H	α-helix	trans	-61.8	-37.9	175.1	-58.8	-41.2	0	0	0	111.3	L392 Y393 S406 I407	N389-L392 PolarHBondContact O-N 3.33Å; N389-Y393 WeakPolarHBondContact O-CB 3.41Å; N389-Y393 PolarHBondContact O-N 2.9Å; N389-S406 WeakPolarHBondContact OD1-CA 3.46Å; N389-I407 PolarHBondContact OD1-N 3.37Å
390	E	92.3	Very high	93.5	Very high	51 Å²	51	36.6 Å²	36.6	24%	0.238	19%	0.19	C	C	.	.	H	α-helix	trans	-71.7	-41	-177	-52.7	67.9	-144.1	0	0	110.8	L287 V290 S388 Y393 K394	L287-E390 HydrophobicContact CB-CB 4.13Å; L287-E390 HydrophobicContact CD1-CB 4.14Å; V290-E390 HydrophobicContact CB-CG 4.48Å; V290-E390 HydrophobicContact CG2-CB 4.05Å; V290-E390 HydrophobicContact CG2-CG 4.1Å; S388-E390 WeakPolarHBondContact CB-OE2 3.29Å; S388-E390 PolarHBondContact O-N 3.29Å; S388-E390 PolarHBondContact OG-N 3.28Å; S388-E390 PolarHBondContact OG-OE2 2.98Å; E390-Y393 PolarHBondContact O-N 3.43Å; E390-K394 PolarHBondContact O-N 2.97Å
391	L	93.7	Very high	93.3	Very high	12 Å²	12	39.5 Å²	39.5	6%	0.063	21%	0.208	C	C	.	.	H	α-helix	trans	-65.2	-46.4	172.7	-175.6	62.4	0	0	0	110.6	T284 L287 V387 S388 Y393 K394 S395 T444	T284-L391 HydrophobicContact CG2-CD1 3.97Å; L287-L391 HydrophobicContact CD1-CB 3.75Å; L287-L391 HydrophobicContact CD1-CD1 4.05Å; V387-L391 HydrophobicContact CG1-CD2 4.36Å; V387-L391 HydrophobicContact CG2-CD2 4.45Å; S388-L391 PolarHBondContact O-N 3.38Å; S388-L391 PolarHBondContact OG-N 2.89Å; L391-Y393 VanDerWaalsContact C-N 3.3Å; L391-Y393 PolarHBondContact O-N 2.71Å; L391-K394 PolarHBondContact O-N 3.2Å; L391-S395 VanDerWaalsContact O-CB 3.23Å; L391-S395 WeakPolarHBondContact O-CB 3.2Å; L391-S395 PolarHBondContact O-N 3.48Å; L391-S395 PolarHBondContact O-OG 3.33Å; L391-T444 HydrophobicContact CD2-CG2 3.94Å
392	L	94.5	Very high	93.2	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-58.4	-42.1	176.6	-173	69	0	0	0	111.6	V380 L383 V387 S388 N389 F396 A405 I407 V421 L443	V380-L392 HydrophobicContact CB-CD1 4.49Å; V380-L392 HydrophobicContact CG1-CD1 4.39Å; V380-L392 HydrophobicContact CG2-CD1 4.45Å; L383-L392 HydrophobicContact CD1-CD1 4.25Å; V387-L392 HydrophobicContact CG1-CB 4.25Å; S388-L392 WeakPolarHBondContact O-CB 3.45Å; S388-L392 PolarHBondContact O-N 3.37Å; N389-L392 PolarHBondContact O-N 3.33Å; L392-F396 HydrophobicContact CD1-CD2 3.84Å; L392-F396 HydrophobicContact CD1-CE2 3.65Å; L392-F396 HydrophobicContact CD1-CZ 4.48Å; L392-F396 HydrophobicContact CG-CD2 4.5Å; L392-F396 WeakPolarHBondContact O-CD2 3.38Å; L392-F396 PolarHBondContact O-N 3.16Å; L392-F396 VanDerWaalsContact O-N 3.16Å; L392-A405 HydrophobicContact CD2-CB 4.25Å; L392-A405 HydrophobicContact CG-CB 4.29Å; L392-I407 HydrophobicContact CD2-CD1 4.02Å; L392-V421 HydrophobicContact CD1-CG2 4.04Å; L392-V421 HydrophobicContact CD2-CG2 3.87Å; L392-V421 HydrophobicContact CG-CG2 3.79Å; L392-L443 HydrophobicContact CD1-CD1 4.22Å
393	Y	93.6	Very high	92.9	Very high	40 Å²	40	38 Å²	38	16%	0.157	20%	0.198	C	C	.	.	H	α-helix	trans	-61.2	-61.4	175	-172.8	-80.9	0	0	0	111.6	V290 N389 E390 L391 S395 F396 E397 I402 A405	V290-Y393 HydrophobicContact CG1-CD2 3.96Å; V290-Y393 HydrophobicContact CG1-CE2 4.16Å; V290-Y393 HydrophobicContact CG1-CG 4.16Å; V290-Y393 HydrophobicContact CG2-CD1 4.02Å; V290-Y393 HydrophobicContact CG2-CG 3.89Å; N389-Y393 WeakPolarHBondContact O-CB 3.41Å; N389-Y393 PolarHBondContact O-N 2.9Å; E390-Y393 PolarHBondContact O-N 3.43Å; L391-Y393 VanDerWaalsContact C-N 3.3Å; L391-Y393 PolarHBondContact O-N 2.71Å; Y393-S395 PolarHBondContact O-N 2.58Å; Y393-F396 PolarHBondContact O-N 3.11Å; Y393-F396 VanDerWaalsContact O-N 3.11Å; Y393-E397 WeakPolarHBondContact O-CB 3.47Å; Y393-E397 PolarHBondContact O-N 3.46Å; Y393-I402 HydrophobicContact CD2-CB 4.09Å; Y393-I402 HydrophobicContact CD2-CD1 4.41Å; Y393-I402 HydrophobicContact CD2-CG2 3.69Å; Y393-I402 HydrophobicContact CE2-CB 3.68Å; Y393-I402 HydrophobicContact CE2-CG2 3.6Å; Y393-I402 WeakPolarHBondContact O-CD1 3.06Å; Y393-A405 HydrophobicContact CD2-CB 4.18Å
394	K	92.1	Very high	92.7	Very high	60 Å²	60	41.8 Å²	41.8	26%	0.261	21%	0.212	S	C	.	.	H	α-helix	trans	-63	-30.9	-174.9	-67.7	-166.2	-178.9	-166	0	112.1	L287 E288 E390 L391	L287-K394 HydrophobicContact CD2-CD 4.33Å; E288-K394 IonicContact OE2-NZ 2.7Å; E288-K394 PolarHBondContact OE2-NZ 3.36Å; E390-K394 PolarHBondContact O-N 2.97Å; L391-K394 PolarHBondContact O-N 3.2Å
395	S	93.3	Very high	92.7	Very high	10 Å²	10	41.8 Å²	41.8	7%	0.07	21%	0.213	C	C	.	.	H	α-helix	trans	-68.4	-42.5	173.2	-68.7	0	0	0	0	113.6	L391 Y393 I398 F441	L391-S395 VanDerWaalsContact O-CB 3.23Å; L391-S395 WeakPolarHBondContact O-CB 3.2Å; L391-S395 PolarHBondContact O-N 3.48Å; L391-S395 PolarHBondContact O-OG 3.33Å; Y393-S395 PolarHBondContact O-N 2.58Å; S395-I398 WeakPolarHBondContact O-CD1 3.37Å; S395-I398 WeakPolarHBondContact O-CG1 3.32Å; S395-F441 WeakPolarHBondContact O-CZ 3.37Å
396	F	94.4	Very high	92.7	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-86.3	-18.4	-176	-80.7	-109.8	0	0	0	113.4	V380 L392 Y393 I398 F399 I402 V421 F423 C432 F441 L443 V452	V380-F396 HydrophobicContact CB-CZ 4.35Å; V380-F396 HydrophobicContact CG1-CE2 4.27Å; V380-F396 HydrophobicContact CG1-CZ 3.75Å; V380-F396 HydrophobicContact CG2-CE1 3.74Å; V380-F396 HydrophobicContact CG2-CE2 4.32Å; V380-F396 HydrophobicContact CG2-CZ 3.6Å; L392-F396 HydrophobicContact CD1-CD2 3.84Å; L392-F396 HydrophobicContact CD1-CE2 3.65Å; L392-F396 HydrophobicContact CD1-CZ 4.48Å; L392-F396 HydrophobicContact CG-CD2 4.5Å; L392-F396 WeakPolarHBondContact O-CD2 3.38Å; L392-F396 PolarHBondContact O-N 3.16Å; L392-F396 VanDerWaalsContact O-N 3.16Å; Y393-F396 PolarHBondContact O-N 3.11Å; Y393-F396 VanDerWaalsContact O-N 3.11Å; F396-I398 PolarHBondContact O-N 3.41Å; F396-F399 HydrophobicContact CB-CD2 4.48Å; F396-F399 HydrophobicContact CD1-CD2 4.21Å; F396-F399 HydrophobicContact CD1-CE2 4.2Å; F396-F399 VanDerWaalsContact O-CD2 3.31Å; F396-F399 WeakPolarHBondContact O-CD2 3.36Å; F396-F399 PolarHBondContact O-N 2.88Å; F396-I402 HydrophobicContact CB-CD1 3.65Å; F396-V421 HydrophobicContact CB-CG1 3.99Å; F396-V421 HydrophobicContact CB-CG2 4.46Å; F396-V421 HydrophobicContact CD1-CB 4.38Å; F396-V421 HydrophobicContact CD1-CG1 4.11Å; F396-V421 HydrophobicContact CD1-CG2 4.1Å; F396-V421 HydrophobicContact CD2-CG2 4.39Å; F396-V421 HydrophobicContact CE1-CG2 4.49Å; F396-V421 HydrophobicContact CG-CG1 4.24Å; F396-V421 HydrophobicContact CG-CG2 4.06Å; F396-F423 HydrophobicContact CB-CZ 4.22Å; F396-F423 HydrophobicContact CD1-CZ 4.22Å; F396-C432 VanDerWaalsContact CD1-SG 3.54Å; F396-C432 VanDerWaalsContact CE1-SG 3.52Å; F396-F441 HydrophobicContact CD2-CE1 4.22Å; F396-F441 HydrophobicContact CE2-CD1 4.48Å; F396-F441 AromaticContact CE2-CE1 3.96Å; F396-F441 HydrophobicContact CE2-CE1 3.96Å; F396-F441 HydrophobicContact CZ-CD1 4.41Å; F396-F441 HydrophobicContact CZ-CE1 4.25Å; F396-L443 HydrophobicContact CE2-CD1 4.14Å; F396-L443 HydrophobicContact CE2-CD2 4.1Å; F396-V452 HydrophobicContact CE1-CG2 4.02Å; F396-V452 HydrophobicContact CZ-CG2 4.11Å
397	E	93.4	Very high	92.8	Very high	85 Å²	85	31.3 Å²	31.3	40%	0.397	16%	0.162	S	C	.	.	G	3₁₀ helix	trans	-56.9	-23.2	176.5	-177.9	171.2	-156.6	0	0	113.1	R276 Y393 F399 G400 I402	R276-E397 PolarHBondContact NH1-O 2.99Å; Y393-E397 WeakPolarHBondContact O-CB 3.47Å; Y393-E397 PolarHBondContact O-N 3.46Å; E397-F399 PolarHBondContact O-N 3.12Å; E397-G400 WeakPolarHBondContact O-CA 3.41Å; E397-G400 PolarHBondContact O-N 3Å; E397-I402 HydrophobicContact CB-CD1 4.4Å
398	I	93.3	Very high	92.8	Very high	7 Å²	7	33 Å²	33	4%	0.036	17%	0.173	C	C	.	.	G	3₁₀ helix	trans	-54.1	-36.2	174.4	70.9	-176.2	0	0	0	112.2	I273 R276 L277 I280 S395 F396 G400 F441	I273-I398 HydrophobicContact CG2-CD1 4.22Å; I273-I398 HydrophobicContact CG2-CG1 4.27Å; R276-I398 HydrophobicContact CB-CB 4Å; R276-I398 HydrophobicContact CB-CG2 4.02Å; R276-I398 VanDerWaalsContact CD-O 3.22Å; R276-I398 WeakPolarHBondContact CD-O 3.29Å; R276-I398 PolarHBondContact NH1-O 3.3Å; L277-I398 HydrophobicContact CB-CD1 4.46Å; L277-I398 HydrophobicContact CD1-CD1 4.11Å; I280-I398 HydrophobicContact CD1-CG2 3.55Å; I280-I398 HydrophobicContact CG1-CG2 4.23Å; S395-I398 WeakPolarHBondContact O-CD1 3.37Å; S395-I398 WeakPolarHBondContact O-CG1 3.32Å; F396-I398 PolarHBondContact O-N 3.41Å; I398-G400 VanDerWaalsContact C-N 3.34Å; I398-F441 HydrophobicContact CD1-CE1 4.5Å; I398-F441 HydrophobicContact CD1-CE2 4.03Å; I398-F441 HydrophobicContact CD1-CZ 3.76Å
399	F	93.9	Very high	92.9	Very high	13 Å²	13	34.7 Å²	34.7	6%	0.057	18%	0.181	C	C	.	.	G	3₁₀ helix	trans	-78.1	-16.5	178.7	-55.4	-67.2	0	0	0	113.4	I273 F396 E397 F423 S428 C432 M435 F441	I273-F399 HydrophobicContact CD1-CD1 3.91Å; I273-F399 HydrophobicContact CD1-CE1 4.42Å; I273-F399 HydrophobicContact CG1-CD1 4.23Å; I273-F399 HydrophobicContact CG2-CD1 4.09Å; I273-F399 HydrophobicContact CG2-CE1 3.88Å; F396-F399 HydrophobicContact CB-CD2 4.48Å; F396-F399 HydrophobicContact CD1-CD2 4.21Å; F396-F399 HydrophobicContact CD1-CE2 4.2Å; F396-F399 VanDerWaalsContact O-CD2 3.31Å; F396-F399 WeakPolarHBondContact O-CD2 3.36Å; F396-F399 PolarHBondContact O-N 2.88Å; E397-F399 PolarHBondContact O-N 3.12Å; F399-F423 HydrophobicContact CB-CE1 3.91Å; F399-F423 HydrophobicContact CB-CZ 3.97Å; F399-F423 HydrophobicContact CD2-CZ 4.24Å; F399-S428 WeakPolarHBondContact O-CB 3.4Å; F399-S428 PolarHBondContact O-OG 2.95Å; F399-C432 HydrophobicContact CB-CB 4.01Å; F399-C432 HydrophobicContact CD1-CB 4.12Å; F399-C432 HydrophobicContact CD2-CB 3.74Å; F399-C432 VanDerWaalsContact CD2-SG 3.56Å; F399-C432 HydrophobicContact CE2-CB 4.23Å; F399-C432 HydrophobicContact CG-CB 3.68Å; F399-M435 HydrophobicContact CE1-CB 3.72Å; F399-M435 HydrophobicContact CE1-CG 3.93Å; F399-M435 HydrophobicContact CZ-CB 4.35Å; F399-F441 HydrophobicContact CE2-CD1 4.3Å; F399-F441 AromaticContact CE2-CE1 3.89Å; F399-F441 HydrophobicContact CE2-CE1 3.89Å; F399-F441 HydrophobicContact CZ-CD1 4.34Å; F399-F441 HydrophobicContact CZ-CE1 4.25Å
400	G	91.8	Very high	92.9	Very high	5 Å²	5	33.7 Å²	33.7	5%	0.052	18%	0.176	C	C	.	.	S	Bend	trans	140.1	-179.7	177.9	0	0	0	0	0	113.4	E397 I398 I402 S428	E397-G400 WeakPolarHBondContact O-CA 3.41Å; E397-G400 PolarHBondContact O-N 3Å; I398-G400 VanDerWaalsContact C-N 3.34Å; G400-I402 PolarHBondContact O-N 2.95Å; G400-S428 WeakPolarHBondContact CA-OG 3.4Å
401	P	91.9	Very high	93	Very high	60 Å²	60	38 Å²	38	39%	0.39	20%	0.201	S	C	.	.			trans	-63.1	132.5	-173.4	24.9	-34.3	0	0	0	112.5	A424	P401-A424 HydrophobicContact CB-CB 4.31Å; P401-A424 HydrophobicContact CG-CB 4.22Å; P401-A424 PolarHBondContact O-N 3.28Å
402	I	91.8	Very high	93	Very high	10 Å²	10	47.1 Å²	47.1	5%	0.051	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	136.9	178.6	-69.5	171.2	0	0	0	108.8	Y393 F396 E397 G400 R404 A405 V421 F423	Y393-I402 HydrophobicContact CD2-CB 4.09Å; Y393-I402 HydrophobicContact CD2-CD1 4.41Å; Y393-I402 HydrophobicContact CD2-CG2 3.69Å; Y393-I402 HydrophobicContact CE2-CB 3.68Å; Y393-I402 HydrophobicContact CE2-CG2 3.6Å; Y393-I402 WeakPolarHBondContact O-CD1 3.06Å; F396-I402 HydrophobicContact CB-CD1 3.65Å; E397-I402 HydrophobicContact CB-CD1 4.4Å; G400-I402 PolarHBondContact O-N 2.95Å; I402-R404 VanDerWaalsContact CG2-N 3.35Å; I402-R404 WeakPolarHBondContact CG2-O 3.16Å; I402-A405 HydrophobicContact CG2-CB 4.2Å; I402-V421 HydrophobicContact CD1-CG1 4.02Å; I402-V421 HydrophobicContact CG1-CG1 4.18Å; I402-F423 HydrophobicContact CD1-CE1 4.42Å; I402-F423 HydrophobicContact CG1-CD1 3.93Å; I402-F423 HydrophobicContact CG1-CE1 3.84Å
403	E	88.7	Confident	92.8	Very high	22 Å²	22	49.7 Å²	49.7	10%	0.103	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	-33.3	168.8	-51.2	-159.8	109	0	0	111.3	T296 S299 G300 E422 A424	T296-E403 WeakPolarHBondContact CB-OE1 3.39Å; T296-E403 PolarHBondContact OG1-OE1 3.47Å; S299-E403 WeakPolarHBondContact CA-OE1 3.38Å; S299-E403 WeakPolarHBondContact CB-OE1 3.35Å; S299-E403 WeakPolarHBondContact CB-OE2 3.5Å; S299-E403 PolarHBondContact OG-OE2 3.24Å; G300-E403 PolarHBondContact N-OE2 3Å; E403-E422 HydrophobicContact CB-CG 4.43Å; E403-E422 PolarHBondContact N-O 3.46Å; E403-A424 HydrophobicContact CG-CB 3.71Å
404	R	89.1	Confident	92.7	Very high	92 Å²	92	54.8 Å²	54.8	35%	0.347	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.5	135.5	-179.4	176.7	170.8	57.6	135.4	0.4	111.5	I402 E422	I402-R404 VanDerWaalsContact CG2-N 3.35Å; I402-R404 WeakPolarHBondContact CG2-O 3.16Å; R404-E422 HydrophobicContact CB-CB 4.25Å; R404-E422 IonicContact CZ-OE2 2.84Å; R404-E422 VanDerWaalsContact CZ-OE2 3.27Å; R404-E422 PolarHBondContact N-O 3.35Å; R404-E422 IonicContact NE-OE2 3.07Å; R404-E422 PolarHBondContact NE-OE2 3.35Å; R404-E422 IonicContact NH2-OE2 3.31Å; R404-E422 PolarHBondContact NH2-OE2 2.7Å; R404-E422 PolarHBondContact O-N 3.31Å
405	A	93	Very high	92.8	Very high	16 Å²	16	53.3 Å²	53.3	13%	0.132	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	132.2	164.5	0	0	0	0	0	108.5	L392 Y393 I402 I420 V421	L392-A405 HydrophobicContact CD2-CB 4.25Å; L392-A405 HydrophobicContact CG-CB 4.29Å; Y393-A405 HydrophobicContact CD2-CB 4.18Å; I402-A405 HydrophobicContact CG2-CB 4.2Å; A405-I420 WeakPolarHBondContact CA-O 3.23Å; A405-V421 HydrophobicContact CB-CG2 4.4Å
406	S	93.1	Very high	92.8	Very high	34 Å²	34	57.9 Å²	57.9	24%	0.238	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.5	131.4	-176.5	57.6	0	0	0	0	112.4	N389 G419 I420	N389-S406 WeakPolarHBondContact OD1-CA 3.46Å; S406-G419 CarbonylContact O-C 3.58Å; S406-G419 VanDerWaalsContact O-CA 3.3Å; S406-G419 WeakPolarHBondContact O-CA 3.44Å; S406-I420 PolarHBondContact N-O 3.49Å; S406-I420 PolarHBondContact O-N 2.99Å
407	I	94.7	Very high	92.7	Very high	23 Å²	23	58.7 Å²	58.7	12%	0.118	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	140.5	173.1	-64.6	-64.4	0	0	0	110.7	L383 V387 N389 L392 V409 H415	L383-I407 HydrophobicContact CD1-CD1 3.61Å; V387-I407 HydrophobicContact CB-CD1 4.46Å; V387-I407 HydrophobicContact CG1-CD1 4.06Å; N389-I407 PolarHBondContact OD1-N 3.37Å; L392-I407 HydrophobicContact CD2-CD1 4.02Å; I407-V409 HydrophobicContact CG2-CG1 4.33Å; I407-H415 VanDerWaalsContact CG2-CD2 3.4Å; I407-H415 WeakPolarHBondContact CG2-CD2 3.39Å
408	T	94.3	Very high	92.8	Very high	44 Å²	44	58 Å²	58	27%	0.27	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	128.7	171.2	-50.4	0	0	0	0	109.5	M416 E418	T408-M416 HydrophobicContact CG2-CB 4.47Å; T408-M416 HydrophobicContact CG2-CE 3.81Å; T408-M416 HydrophobicContact CG2-CG 4.19Å; T408-M416 VanDerWaalsContact O-CB 3.29Å; T408-M416 WeakPolarHBondContact O-CB 3.34Å; T408-M416 WeakPolarHBondContact O-CG 3.45Å; T408-M416 PolarHBondContact O-N 3.11Å; T408-E418 WeakPolarHBondContact CB-O 3.46Å; T408-E418 PolarHBondContact N-O 3.49Å
409	V	94.5	Very high	92.9	Very high	78 Å²	78	57.7 Å²	57.7	47%	0.473	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	156	178.2	-64.2	0	0	0	0	111.9	I407 K414	I407-V409 HydrophobicContact CG2-CG1 4.33Å; V409-K414 CarbonylContact C-O 3.58Å; V409-K414 VanDerWaalsContact CA-O 3.26Å; V409-K414 WeakPolarHBondContact CA-O 3.09Å
410	D	94.3	Very high	92.9	Very high	46 Å²	46	58.5 Å²	58.5	25%	0.246	31%	0.307	C	S	.	.			trans	-78.8	-176.5	174	75.4	2.4	0	0	0	113	R412 G413 K414 M416	D410-R412 PolarHBondContact O-N 3.02Å; D410-R412 WeakPolarHBondContact OD1-CA 3.49Å; D410-R412 WeakPolarHBondContact OD1-CB 3.5Å; D410-R412 PolarHBondContact OD1-N 2.7Å; D410-G413 PolarHBondContact O-N 2.95Å; D410-G413 VanDerWaalsContact O-N 3.09Å; D410-G413 PolarHBondContact OD1-N 3.42Å; D410-K414 PolarHBondContact N-O 3.37Å; D410-K414 VanDerWaalsContact OD1-CB 3.3Å; D410-K414 WeakPolarHBondContact OD1-CB 3.33Å; D410-K414 PolarHBondContact OD1-N 3.45Å; D410-K414 WeakPolarHBondContact OD2-CB 3.48Å; D410-M416 HydrophobicContact CB-CG 4.43Å; D410-M416 HydrophobicContact CB-SD 4.23Å
411	D	94	Very high	93	Very high	141 Å²	141	58.3 Å²	58.3	75%	0.754	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-9	176.9	58.3	-67.8	0	0	0	114.6
412	R	93.9	Very high	93.1	Very high	204 Å²	204	55.4 Å²	55.4	77%	0.77	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-121.2	5.8	-172.8	-42.8	-176.5	-178.4	-170.1	-2.3	112	D410 K414	D410-R412 PolarHBondContact O-N 3.02Å; D410-R412 WeakPolarHBondContact OD1-CA 3.49Å; D410-R412 WeakPolarHBondContact OD1-CB 3.5Å; D410-R412 PolarHBondContact OD1-N 2.7Å; R412-K414 VanDerWaalsContact C-N 3.31Å
413	G	90.6	Very high	93.1	Very high	54 Å²	54	55 Å²	55	56%	0.557	28%	0.284	S	S	*	.	S	Bend	trans	76.8	12.3	-176.5	0	0	0	0	0	114.3	D410	D410-G413 PolarHBondContact O-N 2.95Å; D410-G413 VanDerWaalsContact O-N 3.09Å; D410-G413 PolarHBondContact OD1-N 3.42Å
414	K	92	Very high	93.2	Very high	146 Å²	146	56.2 Å²	56.2	64%	0.635	30%	0.298	S	S	*	.			trans	-80.5	133.1	178.4	-172	-165.3	170.5	-164.1	0	110.5	V409 D410 R412 M416	V409-K414 CarbonylContact C-O 3.58Å; V409-K414 VanDerWaalsContact CA-O 3.26Å; V409-K414 WeakPolarHBondContact CA-O 3.09Å; D410-K414 PolarHBondContact N-O 3.37Å; D410-K414 VanDerWaalsContact OD1-CB 3.3Å; D410-K414 WeakPolarHBondContact OD1-CB 3.33Å; D410-K414 PolarHBondContact OD1-N 3.45Å; D410-K414 WeakPolarHBondContact OD2-CB 3.48Å; R412-K414 VanDerWaalsContact C-N 3.31Å; K414-M416 PolarHBondContact O-N 3.04Å
415	H	93.1	Very high	93.2	Very high	30 Å²	30	57.6 Å²	57.6	14%	0.139	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-51.6	119.6	173.1	-177.3	-74.4	0	0	0	112.3	L383 T384 V387 I407 G417	L383-H415 PolarHBondContact O-CE1 3.24Å; T384-H415 PolarHBondContact O-CE1 2.81Å; T384-H415 PolarHBondContact O-NE2 2.96Å; T384-H415 VanDerWaalsContact O-NE2 3.16Å; V387-H415 PolarHBondContact O-CD2 2.89Å; I407-H415 VanDerWaalsContact CG2-CD2 3.4Å; I407-H415 WeakPolarHBondContact CG2-CD2 3.39Å; H415-G417 PolarHBondContact CE1-N 2.97Å; H415-G417 PolarHBondContact ND1-N 3.18Å; H415-G417 VanDerWaalsContact ND1-N 3.1Å
416	M	93.4	Very high	93.1	Very high	106 Å²	106	63 Å²	63	52%	0.522	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	-18.3	-175.8	-70.4	-115	-65.4	0	0	114.8	T408 D410 K414	T408-M416 HydrophobicContact CG2-CB 4.47Å; T408-M416 HydrophobicContact CG2-CE 3.81Å; T408-M416 HydrophobicContact CG2-CG 4.19Å; T408-M416 VanDerWaalsContact O-CB 3.29Å; T408-M416 WeakPolarHBondContact O-CB 3.34Å; T408-M416 WeakPolarHBondContact O-CG 3.45Å; T408-M416 PolarHBondContact O-N 3.11Å; D410-M416 HydrophobicContact CB-CG 4.43Å; D410-M416 HydrophobicContact CB-SD 4.23Å; K414-M416 PolarHBondContact O-N 3.04Å
417	G	93.1	Very high	93.1	Very high	16 Å²	16	64.6 Å²	64.6	17%	0.165	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	97.7	2	-169.6	0	0	0	0	0	114	S381 N382 L383 H415	S381-G417 CarbonylContact C-O 3.57Å; N382-G417 PolarHBondContact N-O 3.05Å; N382-G417 VanDerWaalsContact N-O 3.16Å; L383-G417 PolarHBondContact N-O 2.93Å; L383-G417 WeakPolarHBondContact O-CA 3.4Å; H415-G417 PolarHBondContact CE1-N 2.97Å; H415-G417 PolarHBondContact ND1-N 3.18Å; H415-G417 VanDerWaalsContact ND1-N 3.1Å
418	E	95.3	Very high	93	Very high	71 Å²	71	64 Å²	64	33%	0.332	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	157.8	-179.4	-57.8	-167.7	135.9	0	0	111.2	V380 T408	V380-E418 CarbonylContact O-C 3.58Å; V380-E418 VanDerWaalsContact O-CA 3.25Å; V380-E418 WeakPolarHBondContact O-CA 3.45Å; T408-E418 WeakPolarHBondContact CB-O 3.46Å; T408-E418 PolarHBondContact N-O 3.49Å
419	G	94.7	Very high	93	Very high	0 Å²	0	62 Å²	62	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	174.5	173.4	0	0	0	0	0	111.7	V380 S406	V380-G419 PolarHBondContact N-O 3.44Å; V380-G419 PolarHBondContact O-N 3.33Å; S406-G419 CarbonylContact O-C 3.58Å; S406-G419 VanDerWaalsContact O-CA 3.3Å; S406-G419 WeakPolarHBondContact O-CA 3.44Å
420	I	94.3	Very high	92.9	Very high	31 Å²	31	61.1 Å²	61.1	16%	0.159	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	132.9	-177.1	-58.8	172	0	0	0	108.3	I377 A405 S406 M455	I377-I420 HydrophobicContact CG2-CG2 3.46Å; I377-I420 VanDerWaalsContact CG2-CG2 3.46Å; A405-I420 WeakPolarHBondContact CA-O 3.23Å; S406-I420 PolarHBondContact N-O 3.49Å; S406-I420 PolarHBondContact O-N 2.99Å; I420-M455 HydrophobicContact CD1-CE 3.82Å; I420-M455 HydrophobicContact CD1-SD 3.96Å; I420-M455 HydrophobicContact CG1-CE 4.41Å; I420-M455 HydrophobicContact CG1-SD 4.09Å; I420-M455 HydrophobicContact CG2-SD 4.05Å
421	V	94.3	Very high	92.9	Very high	0 Å²	0	59 Å²	59	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	124	172.4	179.6	0	0	0	0	109.1	L378 V380 L392 F396 I402 A405 F423	L378-V421 PolarHBondContact N-O 3.07Å; L378-V421 PolarHBondContact O-N 3.05Å; V380-V421 HydrophobicContact CG2-CB 4.37Å; V380-V421 HydrophobicContact CG2-CG2 3.75Å; L392-V421 HydrophobicContact CD1-CG2 4.04Å; L392-V421 HydrophobicContact CD2-CG2 3.87Å; L392-V421 HydrophobicContact CG-CG2 3.79Å; F396-V421 HydrophobicContact CB-CG1 3.99Å; F396-V421 HydrophobicContact CB-CG2 4.46Å; F396-V421 HydrophobicContact CD1-CB 4.38Å; F396-V421 HydrophobicContact CD1-CG1 4.11Å; F396-V421 HydrophobicContact CD1-CG2 4.1Å; F396-V421 HydrophobicContact CD2-CG2 4.39Å; F396-V421 HydrophobicContact CE1-CG2 4.49Å; F396-V421 HydrophobicContact CG-CG1 4.24Å; F396-V421 HydrophobicContact CG-CG2 4.06Å; I402-V421 HydrophobicContact CD1-CG1 4.02Å; I402-V421 HydrophobicContact CG1-CG1 4.18Å; A405-V421 HydrophobicContact CB-CG2 4.4Å; V421-F423 HydrophobicContact CG1-CD2 4.18Å; V421-F423 HydrophobicContact CG1-CE2 3.71Å; V421-F423 HydrophobicContact CG1-CZ 3.94Å
422	E	92.1	Very high	92.9	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	108.8	-176.4	178.7	160.4	-137.2	0	0	109.8	R301 N374 I377 E403 R404	R301-E422 WeakPolarHBondContact CD-OE1 3.35Å; R301-E422 WeakPolarHBondContact CD-OE2 3.39Å; R301-E422 WeakPolarHBondContact CG-OE1 3.4Å; R301-E422 IonicContact NE-OE2 2.77Å; N374-E422 PolarHBondContact ND2-OE1 3.33Å; I377-E422 VanDerWaalsContact CD1-OE1 3.25Å; I377-E422 WeakPolarHBondContact CD1-OE1 3.41Å; I377-E422 HydrophobicContact CG1-CB 4.4Å; I377-E422 HydrophobicContact CG1-CG 4Å; I377-E422 WeakPolarHBondContact CG1-OE1 3.34Å; E403-E422 HydrophobicContact CB-CG 4.43Å; E403-E422 PolarHBondContact N-O 3.46Å; R404-E422 HydrophobicContact CB-CB 4.25Å; R404-E422 IonicContact CZ-OE2 2.84Å; R404-E422 VanDerWaalsContact CZ-OE2 3.27Å; R404-E422 PolarHBondContact N-O 3.35Å; R404-E422 IonicContact NE-OE2 3.07Å; R404-E422 PolarHBondContact NE-OE2 3.35Å; R404-E422 IonicContact NH2-OE2 3.31Å; R404-E422 PolarHBondContact NH2-OE2 2.7Å; R404-E422 PolarHBondContact O-N 3.31Å
423	F	93.4	Very high	92.9	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	146.6	-179.5	-71.5	-83.5	0	0	0	112.1	T376 L378 F396 F399 I402 V421 K425 A429 C432	T376-F423 WeakPolarHBondContact CB-O 3.17Å; T376-F423 PolarHBondContact O-N 3.07Å; T376-F423 PolarHBondContact OG1-O 3.48Å; L378-F423 HydrophobicContact CD1-CD2 4.4Å; L378-F423 HydrophobicContact CD1-CE2 3.98Å; F396-F423 HydrophobicContact CB-CZ 4.22Å; F396-F423 HydrophobicContact CD1-CZ 4.22Å; F399-F423 HydrophobicContact CB-CE1 3.91Å; F399-F423 HydrophobicContact CB-CZ 3.97Å; F399-F423 HydrophobicContact CD2-CZ 4.24Å; I402-F423 HydrophobicContact CD1-CE1 4.42Å; I402-F423 HydrophobicContact CG1-CD1 3.93Å; I402-F423 HydrophobicContact CG1-CE1 3.84Å; V421-F423 HydrophobicContact CG1-CD2 4.18Å; V421-F423 HydrophobicContact CG1-CE2 3.71Å; V421-F423 HydrophobicContact CG1-CZ 3.94Å; F423-K425 PolarHBondContact O-N 3.3Å; F423-A429 HydrophobicContact CB-CB 4.24Å; F423-A429 HydrophobicContact CD2-CB 3.77Å; F423-A429 HydrophobicContact CG-CB 4.3Å; F423-C432 HydrophobicContact CE2-CB 3.92Å; F423-C432 HydrophobicContact CZ-CB 3.94Å
424	A	90.1	Very high	93.1	Very high	48 Å²	48	45.2 Å²	45.2	40%	0.397	23%	0.234	S	C	.	.	S	Bend	trans	-70	-14.6	172.5	0	0	0	0	0	112.9	P401 E403	P401-A424 HydrophobicContact CB-CB 4.31Å; P401-A424 HydrophobicContact CG-CB 4.22Å; P401-A424 PolarHBondContact O-N 3.28Å; E403-A424 HydrophobicContact CG-CB 3.71Å
425	K	89.5	Confident	93.1	Very high	121 Å²	121	38.9 Å²	38.9	53%	0.526	21%	0.207	S	C	.	.			trans	-135.7	130.8	-176.7	-64.1	-177.3	-178.9	177.4	0	111.9	F423 S427 S428 A429	F423-K425 PolarHBondContact O-N 3.3Å; K425-S427 PolarHBondContact O-N 3.41Å; K425-S428 PolarHBondContact O-N 3.16Å; K425-S428 VanDerWaalsContact O-N 3.14Å; K425-A429 PolarHBondContact O-N 3.41Å
426	K	90.4	Very high	93.1	Very high	129 Å²	129	38.1 Å²	38.1	56%	0.561	21%	0.205	S	C	*	.	H	α-helix	trans	-59.3	-30.3	174.6	-176.4	175.1	179.6	-179.5	0	113.1	A375 T376 S430	A375-K426 HydrophobicContact CB-CD 4.17Å; T376-K426 HydrophobicContact CG2-CB 4.15Å; K426-S430 VanDerWaalsContact O-CB 3.32Å; K426-S430 WeakPolarHBondContact O-CB 3.34Å; K426-S430 PolarHBondContact O-N 3.31Å; K426-S430 PolarHBondContact O-OG 2.86Å
427	S	92.2	Very high	93.1	Very high	69 Å²	69	38.5 Å²	38.5	48%	0.483	21%	0.209	S	C	.	.	H	α-helix	trans	-59.2	-49.6	174.2	52.6	0	0	0	0	111.3	K425 S430 A431	K425-S427 PolarHBondContact O-N 3.41Å; S427-S430 CarbonylContact O-C 3.47Å; S427-S430 WeakPolarHBondContact O-CB 3.3Å; S427-S430 PolarHBondContact O-N 2.92Å; S427-S430 VanDerWaalsContact O-N 3.14Å; S427-A431 WeakPolarHBondContact O-CB 3.49Å; S427-A431 PolarHBondContact O-N 3.49Å
428	S	93.1	Very high	93	Very high	11 Å²	11	43.6 Å²	43.6	8%	0.077	23%	0.229	C	C	.	.	H	α-helix	trans	-63.5	-43.6	179.4	-64.8	0	0	0	0	112.5	F399 G400 K425 S430 A431 C432	F399-S428 WeakPolarHBondContact O-CB 3.4Å; F399-S428 PolarHBondContact O-OG 2.95Å; G400-S428 WeakPolarHBondContact CA-OG 3.4Å; K425-S428 PolarHBondContact O-N 3.16Å; K425-S428 VanDerWaalsContact O-N 3.14Å; S428-S430 VanDerWaalsContact C-N 3.32Å; S428-S430 PolarHBondContact O-N 2.96Å; S428-A431 PolarHBondContact O-N 2.85Å; S428-C432 VanDerWaalsContact O-CB 3.29Å; S428-C432 WeakPolarHBondContact O-CB 3.35Å; S428-C432 PolarHBondContact O-N 2.87Å
429	A	94	Very high	92.9	Very high	2 Å²	2	44.9 Å²	44.9	2%	0.017	23%	0.233	C	C	.	.	H	α-helix	trans	-60.2	-41.1	172.1	0	0	0	0	0	112.3	L378 F423 K425 L433	L378-A429 HydrophobicContact CD1-CB 4.37Å; L378-A429 HydrophobicContact CG-CB 4.41Å; F423-A429 HydrophobicContact CB-CB 4.24Å; F423-A429 HydrophobicContact CD2-CB 3.77Å; F423-A429 HydrophobicContact CG-CB 4.3Å; K425-A429 PolarHBondContact O-N 3.41Å; A429-L433 VanDerWaalsContact O-CB 3.27Å; A429-L433 WeakPolarHBondContact O-CB 3.37Å; A429-L433 PolarHBondContact O-N 2.92Å
430	S	93.7	Very high	92.9	Very high	59 Å²	59	49.2 Å²	49.2	41%	0.413	26%	0.262	S	S	.	.	H	α-helix	trans	-69.8	-34.2	178.4	-54.1	0	0	0	0	112.7	K426 S427 S428 R434	K426-S430 VanDerWaalsContact O-CB 3.32Å; K426-S430 WeakPolarHBondContact O-CB 3.34Å; K426-S430 PolarHBondContact O-N 3.31Å; K426-S430 PolarHBondContact O-OG 2.86Å; S427-S430 CarbonylContact O-C 3.47Å; S427-S430 WeakPolarHBondContact O-CB 3.3Å; S427-S430 PolarHBondContact O-N 2.92Å; S427-S430 VanDerWaalsContact O-N 3.14Å; S428-S430 VanDerWaalsContact C-N 3.32Å; S428-S430 PolarHBondContact O-N 2.96Å; S430-R434 WeakPolarHBondContact O-CB 3.31Å; S430-R434 PolarHBondContact O-N 3.2Å
431	A	93.3	Very high	92.9	Very high	1 Å²	1	48.8 Å²	48.8	1%	0.008	26%	0.259	C	S	.	.	H	α-helix	trans	-72.3	-42.8	175.7	0	0	0	0	0	111.6	E269 S427 S428 R434 M435	E269-A431 HydrophobicContact CG-CB 4.4Å; S427-A431 WeakPolarHBondContact O-CB 3.49Å; S427-A431 PolarHBondContact O-N 3.49Å; S428-A431 PolarHBondContact O-N 2.85Å; A431-R434 PolarHBondContact O-N 2.84Å; A431-M435 VanDerWaalsContact O-CB 3.31Å; A431-M435 WeakPolarHBondContact O-CB 3.31Å; A431-M435 PolarHBondContact O-N 3.42Å
432	C	94.6	Very high	92.9	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-57.7	-52.3	171.9	-178.6	0	0	0	0	111.3	L378 F396 F399 F423 S428 R434 M435 C436	L378-C432 HydrophobicContact CD1-CB 4.01Å; F396-C432 VanDerWaalsContact CD1-SG 3.54Å; F396-C432 VanDerWaalsContact CE1-SG 3.52Å; F399-C432 HydrophobicContact CB-CB 4.01Å; F399-C432 HydrophobicContact CD1-CB 4.12Å; F399-C432 HydrophobicContact CD2-CB 3.74Å; F399-C432 VanDerWaalsContact CD2-SG 3.56Å; F399-C432 HydrophobicContact CE2-CB 4.23Å; F399-C432 HydrophobicContact CG-CB 3.68Å; F423-C432 HydrophobicContact CE2-CB 3.92Å; F423-C432 HydrophobicContact CZ-CB 3.94Å; S428-C432 VanDerWaalsContact O-CB 3.29Å; S428-C432 WeakPolarHBondContact O-CB 3.35Å; S428-C432 PolarHBondContact O-N 2.87Å; C432-R434 VanDerWaalsContact C-N 3.31Å; C432-R434 PolarHBondContact O-N 3.04Å; C432-M435 PolarHBondContact O-N 3.19Å; C432-C436 WeakPolarHBondContact O-CB 3.32Å; C432-C436 PolarHBondContact O-N 3.15Å; C432-C436 PolarHBondContact O-SG 2.67Å
433	L	94.2	Very high	92.9	Very high	49 Å²	49	53.8 Å²	53.8	26%	0.257	28%	0.282	S	S	.	.	H	α-helix	trans	-60.7	-38.8	179.1	-175.2	70	0	0	0	112.1	L378 A429 N437 V452 P454	L378-L433 HydrophobicContact CD1-CB 4.48Å; A429-L433 VanDerWaalsContact O-CB 3.27Å; A429-L433 WeakPolarHBondContact O-CB 3.37Å; A429-L433 PolarHBondContact O-N 2.92Å; L433-N437 WeakPolarHBondContact O-CB 3.4Å; L433-N437 PolarHBondContact O-N 2.79Å; L433-N437 PolarHBondContact O-ND2 3.04Å; L433-V452 HydrophobicContact CD1-CG1 4.26Å; L433-V452 WeakPolarHBondContact CD1-O 3.41Å; L433-P454 HydrophobicContact CD1-CG 4.33Å; L433-P454 HydrophobicContact CD2-CG 3.95Å
434	R	93.8	Very high	92.8	Very high	60 Å²	60	55.9 Å²	55.9	23%	0.226	30%	0.295	C	S	.	.	H	α-helix	trans	-61.9	-56.3	171.8	-177.5	-179.8	79.8	-121.3	10.6	110.8	E269 D270 S430 A431 C432 C436 N437 E438	E269-R434 IonicContact OE2-CZ 2.66Å; E269-R434 VanDerWaalsContact OE2-CZ 3.22Å; E269-R434 IonicContact OE2-NH1 3.86Å; E269-R434 PolarHBondContact OE2-NH1 3.43Å; E269-R434 IonicContact OE2-NH2 2.73Å; E269-R434 PolarHBondContact OE2-NH2 3.4Å; D270-R434 IonicContact OD1-CZ 3.74Å; D270-R434 IonicContact OD1-NH2 2.76Å; D270-R434 PolarHBondContact OD1-NH2 3.16Å; S430-R434 WeakPolarHBondContact O-CB 3.31Å; S430-R434 PolarHBondContact O-N 3.2Å; A431-R434 PolarHBondContact O-N 2.84Å; C432-R434 VanDerWaalsContact C-N 3.31Å; C432-R434 PolarHBondContact O-N 3.04Å; R434-C436 PolarHBondContact O-N 2.67Å; R434-N437 PolarHBondContact O-N 3.46Å; R434-E438 HydrophobicContact CG-CG 4.41Å; R434-E438 VanDerWaalsContact CG-OE1 3.26Å; R434-E438 WeakPolarHBondContact CG-OE1 3.43Å; R434-E438 WeakPolarHBondContact O-CB 3.12Å; R434-E438 WeakPolarHBondContact O-CG 3.47Å; R434-E438 PolarHBondContact O-N 3.06Å
435	M	91.8	Very high	92.7	Very high	14 Å²	14	58.7 Å²	58.7	7%	0.069	32%	0.318	C	S	.	.	H	α-helix	trans	-62.8	-43.8	-170.9	-162.6	72	68.9	0	0	112.7	D270 I273 F399 A431 C432 N437 E438 K439	D270-M435 HydrophobicContact CB-CE 4.38Å; I273-M435 HydrophobicContact CD1-CE 3.69Å; I273-M435 HydrophobicContact CG2-CE 4.34Å; F399-M435 HydrophobicContact CE1-CB 3.72Å; F399-M435 HydrophobicContact CE1-CG 3.93Å; F399-M435 HydrophobicContact CZ-CB 4.35Å; A431-M435 VanDerWaalsContact O-CB 3.31Å; A431-M435 WeakPolarHBondContact O-CB 3.31Å; A431-M435 PolarHBondContact O-N 3.42Å; C432-M435 PolarHBondContact O-N 3.19Å; M435-N437 VanDerWaalsContact C-N 3.31Å; M435-N437 PolarHBondContact O-N 3.06Å; M435-E438 PolarHBondContact O-N 2.94Å; M435-K439 HydrophobicContact CG-CD 4.41Å; M435-K439 WeakPolarHBondContact O-CB 3.32Å; M435-K439 PolarHBondContact O-N 3.47Å; M435-K439 HydrophobicContact SD-CD 3.6Å; M435-K439 VanDerWaalsContact SD-CD 3.6Å; M435-K439 VanDerWaalsContact SD-CE 3.51Å; M435-K439 HydrophobicContact SD-CG 4.45Å; M435-K439 PolarHBondContact SD-NZ 3.29Å
436	C	93.2	Very high	92.4	Very high	14 Å²	14	54.6 Å²	54.6	10%	0.095	31%	0.305	C	S	.	.	H	α-helix	trans	-76.3	-17.5	-176.7	-57.5	0	0	0	0	113.4	C432 R434 V452	C432-C436 WeakPolarHBondContact O-CB 3.32Å; C432-C436 PolarHBondContact O-N 3.15Å; C432-C436 PolarHBondContact O-SG 2.67Å; R434-C436 PolarHBondContact O-N 2.67Å; C436-V452 HydrophobicContact CB-CB 3.96Å; C436-V452 HydrophobicContact CB-CG2 3.6Å
437	N	92.9	Very high	92.2	Very high	114 Å²	114	54.1 Å²	54.1	61%	0.61	31%	0.308	S	S	*	.	H	α-helix	trans	-89.9	-23.4	170.2	-77.7	-75.3	0	0	0	112.6	L433 R434 M435 V452	L433-N437 WeakPolarHBondContact O-CB 3.4Å; L433-N437 PolarHBondContact O-N 2.79Å; L433-N437 PolarHBondContact O-ND2 3.04Å; R434-N437 PolarHBondContact O-N 3.46Å; M435-N437 VanDerWaalsContact C-N 3.31Å; M435-N437 PolarHBondContact O-N 3.06Å; N437-V452 PolarHBondContact ND2-O 2.88Å
438	E	92.7	Very high	92.2	Very high	123 Å²	123	53.1 Å²	53.1	58%	0.575	29%	0.293	S	S	*	.	H	α-helix	trans	-90	-24.2	176.1	-72	175.8	-176.6	0	0	113.4	R434 M435	R434-E438 HydrophobicContact CG-CG 4.41Å; R434-E438 VanDerWaalsContact CG-OE1 3.26Å; R434-E438 WeakPolarHBondContact CG-OE1 3.43Å; R434-E438 WeakPolarHBondContact O-CB 3.12Å; R434-E438 WeakPolarHBondContact O-CG 3.47Å; R434-E438 PolarHBondContact O-N 3.06Å; M435-E438 PolarHBondContact O-N 2.94Å
439	K	92.9	Very high	92.2	Very high	97 Å²	97	54.3 Å²	54.3	42%	0.422	30%	0.301	S	S	.	.	S	Bend	trans	-142.3	142.4	-172.4	-54.1	177.6	-163.9	162.9	0	110.7	D270 M435 F441	D270-K439 IonicContact OD2-NZ 3.16Å; D270-K439 PolarHBondContact OD2-NZ 3.44Å; M435-K439 HydrophobicContact CG-CD 4.41Å; M435-K439 WeakPolarHBondContact O-CB 3.32Å; M435-K439 PolarHBondContact O-N 3.47Å; M435-K439 HydrophobicContact SD-CD 3.6Å; M435-K439 VanDerWaalsContact SD-CD 3.6Å; M435-K439 VanDerWaalsContact SD-CE 3.51Å; M435-K439 HydrophobicContact SD-CG 4.45Å; M435-K439 PolarHBondContact SD-NZ 3.29Å; K439-F441 PolarHBondContact O-N 2.9Å
440	C	93.7	Very high	92.2	Very high	91 Å²	91	54.4 Å²	54.4	62%	0.615	30%	0.301	S	S	*	.			trans	-68.2	118.2	174	-65.9	0	0	0	0	110.4	F442 P449	C440-F442 HydrophobicContact CB-CE1 4.31Å; C440-F442 HydrophobicContact CB-CE2 3.87Å; C440-F442 HydrophobicContact CB-CZ 3.65Å; C440-P449 HydrophobicContact CB-CB 4.14Å
441	F	94.4	Very high	92.3	Very high	22 Å²	22	56 Å²	56	10%	0.096	31%	0.305	C	S	.	.			trans	-107.9	119	174.7	-174.7	-144	0	0	0	109.7	L277 S395 F396 I398 F399 K439 L443 P449 C450	L277-F441 HydrophobicContact CD1-CE2 3.93Å; S395-F441 WeakPolarHBondContact O-CZ 3.37Å; F396-F441 HydrophobicContact CD2-CE1 4.22Å; F396-F441 HydrophobicContact CE2-CD1 4.48Å; F396-F441 AromaticContact CE2-CE1 3.96Å; F396-F441 HydrophobicContact CE2-CE1 3.96Å; F396-F441 HydrophobicContact CZ-CD1 4.41Å; F396-F441 HydrophobicContact CZ-CE1 4.25Å; I398-F441 HydrophobicContact CD1-CE1 4.5Å; I398-F441 HydrophobicContact CD1-CE2 4.03Å; I398-F441 HydrophobicContact CD1-CZ 3.76Å; F399-F441 HydrophobicContact CE2-CD1 4.3Å; F399-F441 AromaticContact CE2-CE1 3.89Å; F399-F441 HydrophobicContact CE2-CE1 3.89Å; F399-F441 HydrophobicContact CZ-CD1 4.34Å; F399-F441 HydrophobicContact CZ-CE1 4.25Å; K439-F441 PolarHBondContact O-N 2.9Å; F441-L443 HydrophobicContact CD1-CD2 3.91Å; F441-L443 HydrophobicContact CE1-CD2 3.55Å; F441-L443 HydrophobicContact CE2-CD2 4.24Å; F441-L443 HydrophobicContact CG-CD2 4.41Å; F441-L443 HydrophobicContact CZ-CD2 3.73Å; F441-P449 CarbonylContact O-C 3.57Å; F441-P449 VanDerWaalsContact O-CA 3.3Å; F441-P449 WeakPolarHBondContact O-CA 3.3Å; F441-C450 VanDerWaalsContact CD1-SG 3.55Å; F441-C450 PolarHBondContact O-N 3.37Å; F441-C450 PolarHBondContact O-SG 2.73Å
442	F	94.1	Very high	92.4	Very high	87 Å²	87	56 Å²	56	38%	0.382	31%	0.305	S	S	.	.			trans	-108	133.4	-178.3	-53.3	-73	0	0	0	109.7	C440 L447 P449	C440-F442 HydrophobicContact CB-CE1 4.31Å; C440-F442 HydrophobicContact CB-CE2 3.87Å; C440-F442 HydrophobicContact CB-CZ 3.65Å; F442-L447 VanDerWaalsContact CE1-C 3.48Å; F442-L447 HydrophobicContact CE1-CB 4.41Å; F442-L447 WeakPolarHBondContact CE1-O 3.26Å; F442-P449 HydrophobicContact CD1-CB 4.25Å; F442-P449 HydrophobicContact CE1-CB 3.96Å; F442-P449 HydrophobicContact CE1-CG 4.39Å
443	L	92.3	Very high	92.5	Very high	19 Å²	19	58.8 Å²	58.8	10%	0.099	32%	0.32	C	S	.	.	S	Bend	trans	-99.9	-15	-178.3	-50	-171.5	0	0	0	113.7	L383 V387 L392 F396 F441 C450	L383-L443 HydrophobicContact CD2-CD1 3.55Å; V387-L443 HydrophobicContact CG1-CD1 4.14Å; V387-L443 HydrophobicContact CG2-CB 4.43Å; V387-L443 HydrophobicContact CG2-CD1 4.42Å; L392-L443 HydrophobicContact CD1-CD1 4.22Å; F396-L443 HydrophobicContact CE2-CD1 4.14Å; F396-L443 HydrophobicContact CE2-CD2 4.1Å; F441-L443 HydrophobicContact CD1-CD2 3.91Å; F441-L443 HydrophobicContact CE1-CD2 3.55Å; F441-L443 HydrophobicContact CE2-CD2 4.24Å; F441-L443 HydrophobicContact CG-CD2 4.41Å; F441-L443 HydrophobicContact CZ-CD2 3.73Å; L443-C450 HydrophobicContact CD1-CB 4.33Å; L443-C450 HydrophobicContact CG-CB 4.33Å
444	T	91.3	Very high	92.4	Very high	43 Å²	43	60.2 Å²	60.2	26%	0.264	33%	0.332	S	S	.	.	S	Bend	trans	-144.7	179.9	-178.4	71.5	0	0	0	0	109.7	V387 L391 S446	V387-T444 HydrophobicContact CG2-CG2 4.04Å; L391-T444 HydrophobicContact CD2-CG2 3.94Å; T444-S446 PolarHBondContact O-N 3.3Å; T444-S446 VanDerWaalsContact O-N 3.12Å; T444-S446 PolarHBondContact OG1-N 3.08Å; T444-S446 PolarHBondContact OG1-OG 2.81Å
445	A	88.2	Confident	92.2	Very high	108 Å²	108	60.7 Å²	60.7	89%	0.893	34%	0.337	S	S	*	.	S	Bend	trans	-63.5	-9.9	174.5	0	0	0	0	0	114.7
446	S	83.2	Confident	91.7	Very high	35 Å²	35	68 Å²	68	25%	0.245	37%	0.371	C	S	.	.	S	Bend	trans	-72.3	130.7	169.9	68.4	0	0	0	0	110.6	T384 T444 R448	T384-S446 WeakPolarHBondContact CG2-OG 3.33Å; T444-S446 PolarHBondContact O-N 3.3Å; T444-S446 VanDerWaalsContact O-N 3.12Å; T444-S446 PolarHBondContact OG1-N 3.08Å; T444-S446 PolarHBondContact OG1-OG 2.81Å; S446-R448 PolarHBondContact O-N 2.94Å
447	L	87.6	Confident	90.9	Very high	118 Å²	118	71.7 Å²	71.7	62%	0.618	39%	0.393	S	S	*	.			trans	-73.8	36.3	173.7	-58.8	178.9	0	0	0	113.1	F442 M529	F442-L447 VanDerWaalsContact CE1-C 3.48Å; F442-L447 HydrophobicContact CE1-CB 4.41Å; F442-L447 WeakPolarHBondContact CE1-O 3.26Å; L447-M529 HydrophobicContact CB-SD 4.47Å
448	R	90.3	Very high	89.9	Confident	48 Å²	48	71.5 Å²	71.5	18%	0.181	39%	0.392	C	S	.	.			trans	-100.1	106.7	177.1	-64.4	178.8	66	116.7	8.1	107.8	N382 T384 S446 E522 E526	N382-R448 PolarHBondContact OD1-NE 2.74Å; N382-R448 PolarHBondContact OD1-NH2 2.76Å; T384-R448 HydrophobicContact CG2-CB 4.47Å; S446-R448 PolarHBondContact O-N 2.94Å; R448-E522 IonicContact CZ-OE1 3.98Å; R448-E522 IonicContact NH1-OE1 3.75Å; R448-E522 PolarHBondContact NH1-OE1 3.03Å; R448-E522 IonicContact NH2-OE1 3.84Å; R448-E522 PolarHBondContact NH2-OE1 2.75Å; R448-E526 IonicContact CZ-OE1 2.78Å; R448-E526 IonicContact NH1-OE1 2.88Å; R448-E526 PolarHBondContact NH1-OE1 3.47Å; R448-E526 IonicContact NH1-OE2 2.8Å
449	P	93.8	Very high	88.8	Confident	37 Å²	37	68.7 Å²	68.7	24%	0.24	38%	0.381	C	S	.	.	P	Polyproline II helix	trans	-73.7	138.2	-179.2	30.2	-32.8	0	0	0	109.8	N382 C440 F441 F442	N382-P449 PolarHBondContact ND2-O 3.23Å; C440-P449 HydrophobicContact CB-CB 4.14Å; F441-P449 CarbonylContact O-C 3.57Å; F441-P449 VanDerWaalsContact O-CA 3.3Å; F441-P449 WeakPolarHBondContact O-CA 3.3Å; F442-P449 HydrophobicContact CD1-CB 4.25Å; F442-P449 HydrophobicContact CE1-CB 3.96Å; F442-P449 HydrophobicContact CE1-CG 4.39Å
450	C	94.6	Very high	87.8	Confident	3 Å²	3	70.8 Å²	70.8	2%	0.02	40%	0.397	C	S	.	.	P	Polyproline II helix	trans	-70.4	132.3	173	64	0	0	0	0	110	V380 L383 F441 L443	V380-C450 HydrophobicContact CG1-CB 3.79Å; L383-C450 HydrophobicContact CD2-CB 3.97Å; F441-C450 VanDerWaalsContact CD1-SG 3.55Å; F441-C450 PolarHBondContact O-N 3.37Å; F441-C450 PolarHBondContact O-SG 2.73Å; L443-C450 HydrophobicContact CD1-CB 4.33Å; L443-C450 HydrophobicContact CG-CB 4.33Å
451	L	95.6	Very high	86.9	Confident	92 Å²	92	71.6 Å²	71.6	48%	0.482	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	141.2	175.4	-56.5	178.5	0	0	0	108.6	V380 S381 N382	V380-L451 CarbonylContact C-O 3.51Å; V380-L451 VanDerWaalsContact CA-O 3.3Å; V380-L451 WeakPolarHBondContact CA-O 3.22Å; S381-L451 PolarHBondContact N-O 2.91Å; S381-L451 PolarHBondContact O-N 3.08Å; N382-L451 HydrophobicContact CB-CD1 4.19Å; N382-L451 HydrophobicContact CB-CG 4.05Å
452	V	96	Very high	86.1	Confident	3 Å²	3	72.7 Å²	72.7	2%	0.018	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	115.2	-173.2	-176.7	0	0	0	0	110.3	L378 R379 V380 F396 L433 C436 N437	L378-V452 HydrophobicContact CB-CG1 4Å; L378-V452 HydrophobicContact CD1-CG1 3.63Å; L378-V452 HydrophobicContact CG-CG1 4.33Å; R379-V452 WeakPolarHBondContact O-CA 3.4Å; V380-V452 HydrophobicContact CG1-CG2 4.45Å; V380-V452 HydrophobicContact CG2-CG2 4.47Å; F396-V452 HydrophobicContact CE1-CG2 4.02Å; F396-V452 HydrophobicContact CZ-CG2 4.11Å; L433-V452 HydrophobicContact CD1-CG1 4.26Å; L433-V452 WeakPolarHBondContact CD1-O 3.41Å; C436-V452 HydrophobicContact CB-CB 3.96Å; C436-V452 HydrophobicContact CB-CG2 3.6Å; N437-V452 PolarHBondContact ND2-O 2.88Å
453	D	94.8	Very high	85.6	Confident	57 Å²	57	71.4 Å²	71.4	31%	0.305	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	152.7	178.3	-66	-54.6	0	0	0	111	L378 R379 M455	L378-D453 CarbonylContact C-O 3.58Å; L378-D453 VanDerWaalsContact CA-O 3.26Å; L378-D453 WeakPolarHBondContact CA-O 3.2Å; L378-D453 WeakPolarHBondContact CB-O 3.49Å; R379-D453 HydrophobicContact CB-CB 4.49Å; R379-D453 IonicContact CZ-OD2 2.97Å; R379-D453 PolarHBondContact N-O 2.67Å; R379-D453 IonicContact NE-OD2 3.71Å; R379-D453 PolarHBondContact NE-OD2 3.26Å; R379-D453 IonicContact NH2-OD2 3.2Å; R379-D453 PolarHBondContact NH2-OD2 3.09Å; R379-D453 PolarHBondContact O-N 2.9Å; D453-M455 PolarHBondContact O-N 2.95Å
454	P	93.7	Very high	85.3	Confident	79 Å²	79	76.4 Å²	76.4	51%	0.513	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60	133.7	160.3	-14.9	29.9	0	0	0	109.8	L433 E456	L433-P454 HydrophobicContact CD1-CG 4.33Å; L433-P454 HydrophobicContact CD2-CG 3.95Å; P454-E456 PolarHBondContact O-N 3.27Å
455	M	88.2	Confident	85.1	Confident	70 Å²	70	76.6 Å²	76.6	35%	0.345	45%	0.445	S	S	.	.			trans	-76.8	120.7	175	-170.2	171.4	-176.5	0	0	110.3	I377 I420 D453 V457	I377-M455 HydrophobicContact CB-CB 4.12Å; I377-M455 HydrophobicContact CG2-CB 3.81Å; I377-M455 HydrophobicContact CG2-CG 4.28Å; I377-M455 HydrophobicContact CG2-SD 3.59Å; I377-M455 VanDerWaalsContact CG2-SD 3.59Å; I377-M455 PolarHBondContact O-N 3.2Å; I377-M455 VanDerWaalsContact O-N 3.09Å; I420-M455 HydrophobicContact CD1-CE 3.82Å; I420-M455 HydrophobicContact CD1-SD 3.96Å; I420-M455 HydrophobicContact CG1-CE 4.41Å; I420-M455 HydrophobicContact CG1-SD 4.09Å; I420-M455 HydrophobicContact CG2-SD 4.05Å; D453-M455 PolarHBondContact O-N 2.95Å; M455-V457 HydrophobicContact CG-CG2 4.41Å; M455-V457 PolarHBondContact O-N 2.86Å
456	E	81.7	Confident	85	Confident	168 Å²	168	75.1 Å²	75.1	79%	0.785	42%	0.42	S	S	*	.			trans	-72.5	112.6	165.6	-65.2	-168.5	165.2	0	0	108.4	P454	P454-E456 PolarHBondContact O-N 3.27Å
457	V	76.5	Confident	85.1	Confident	91 Å²	91	80.9 Å²	80.9	55%	0.552	44%	0.441	S	S	*	.			trans	-97.1	100.4	177.4	-177.9	0	0	0	0	108.4	I377 M455	I377-V457 HydrophobicContact CD1-CG2 4.16Å; M455-V457 HydrophobicContact CG-CG2 4.41Å; M455-V457 PolarHBondContact O-N 2.86Å
458	N	72.1	Confident	85	Confident	111 Å²	111	78.1 Å²	78.1	59%	0.594	44%	0.435	S	S	*	.			trans	-73.1	128.1	171.5	-65.9	67.6	0	0	0	109.8	D460	N458-D460 VanDerWaalsContact C-N 3.27Å; N458-D460 WeakPolarHBondContact CB-OD1 3.42Å; N458-D460 PolarHBondContact O-N 2.96Å; N458-D460 VanDerWaalsContact O-N 3.1Å
459	D	70.4	Confident	84.8	Confident	63 Å²	63	79.3 Å²	79.3	34%	0.337	44%	0.442	S	S	.	.			trans	-84.6	75	170.7	-170.6	1.1	0	0	0	109.6	T461	D459-T461 PolarHBondContact O-N 3.45Å; D459-T461 VanDerWaalsContact O-N 3.11Å; D459-T461 WeakPolarHBondContact OD1-CB 3.29Å; D459-T461 PolarHBondContact OD1-N 3.1Å; D459-T461 PolarHBondContact OD1-OG1 3.38Å
460	D	71.7	Confident	84.6	Confident	141 Å²	141	82 Å²	82	75%	0.754	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-3.7	178.4	-63.4	-28.2	0	0	0	112.6	N458	N458-D460 VanDerWaalsContact C-N 3.27Å; N458-D460 WeakPolarHBondContact CB-OD1 3.42Å; N458-D460 PolarHBondContact O-N 2.96Å; N458-D460 VanDerWaalsContact O-N 3.1Å
461	T	74.2	Confident	84.4	Confident	108 Å²	108	86.9 Å²	86.9	66%	0.663	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.3	-48	-176.7	-34.2	0	0	0	0	112.9	D459	D459-T461 PolarHBondContact O-N 3.45Å; D459-T461 VanDerWaalsContact O-N 3.11Å; D459-T461 WeakPolarHBondContact OD1-CB 3.29Å; D459-T461 PolarHBondContact OD1-N 3.1Å; D459-T461 PolarHBondContact OD1-OG1 3.38Å
462	D	78.1	Confident	84.1	Confident	46 Å²	46	91.6 Å²	91.6	25%	0.246	49%	0.492	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.6	-21.2	-171.4	-69.4	-18.8	0	0	0	112.9	K354 R370	K354-D462 WeakPolarHBondContact CE-OD2 3.34Å; K354-D462 IonicContact NZ-OD1 2.94Å; K354-D462 PolarHBondContact NZ-OD1 2.91Å; K354-D462 IonicContact NZ-OD2 2.67Å; K354-D462 PolarHBondContact NZ-OD2 3.45Å; R370-D462 WeakPolarHBondContact CD-OD2 3.47Å; R370-D462 IonicContact CZ-OD2 2.63Å; R370-D462 IonicContact NE-OD2 2.78Å; R370-D462 PolarHBondContact NE-OD2 3.2Å; R370-D462 IonicContact NH1-OD2 3.65Å; R370-D462 PolarHBondContact NH1-OD2 2.7Å; R370-D462 IonicContact NH2-OD2 3.99Å; R370-D462 PolarHBondContact NH2-OD2 3.17Å; R370-D462 VanDerWaalsContact NH2-OD2 3.07Å
463	G	84.4	Confident	83.8	Confident	59 Å²	59	95.4 Å²	95.4	61%	0.608	51%	0.51	S	S	*	.			trans	53.3	-145.4	-179.3	0	0	0	0	0	114	P465	G463-P465 WeakPolarHBondContact O-CD 3.3Å
464	L	85.1	Confident	83.6	Confident	124 Å²	124	97 Å²	97	65%	0.649	52%	0.524	S	S	*	.			trans	-116.2	86.8	174.7	-174.3	64.4	0	0	0	110.4	A468 F469	L464-A468 HydrophobicContact CD1-CB 3.89Å; L464-F469 HydrophobicContact CD2-CE1 4.24Å; L464-F469 HydrophobicContact CD2-CE2 4Å; L464-F469 HydrophobicContact CD2-CZ 3.62Å; L464-F469 HydrophobicContact CG-CE2 3.86Å; L464-F469 HydrophobicContact CG-CZ 4.02Å
465	P	86.1	Confident	83.5	Confident	47 Å²	47	97.6 Å²	97.6	31%	0.305	52%	0.522	S	S	.	.			trans	-73.4	151.4	-174.9	30.4	-36	0	0	0	111.8	G463 K467 A468	G463-P465 WeakPolarHBondContact O-CD 3.3Å; P465-K467 HydrophobicContact CB-CG 4.16Å; P465-K467 HydrophobicContact CG-CG 4.05Å; P465-K467 PolarHBondContact O-N 3.13Å; P465-A468 HydrophobicContact CG-CB 4.45Å; P465-A468 VanDerWaalsContact O-CB 3.29Å; P465-A468 WeakPolarHBondContact O-CB 3.44Å; P465-A468 PolarHBondContact O-N 2.86Å
466	E	87.3	Confident	83.7	Confident	77 Å²	77	95.8 Å²	95.8	36%	0.36	51%	0.513	S	S	.	.	G	3₁₀ helix	trans	-52.8	-27.2	-177.6	-176.6	63	-154.5	0	0	113.9	A468 F469 K471 R480	E466-A468 PolarHBondContact O-N 2.82Å; E466-F469 PolarHBondContact O-N 3.23Å; E466-K471 WeakPolarHBondContact OE1-CE 3.25Å; E466-K471 IonicContact OE1-NZ 2.7Å; E466-K471 PolarHBondContact OE1-NZ 2.82Å; E466-R480 IonicContact OE1-NH2 2.79Å; E466-R480 IonicContact OE2-CZ 3.32Å; E466-R480 IonicContact OE2-NH1 3.63Å; E466-R480 IonicContact OE2-NH2 2.69Å; E466-R480 PolarHBondContact OE2-NH2 2.87Å
467	K	85.7	Confident	84.1	Confident	156 Å²	156	92.2 Å²	92.2	68%	0.678	50%	0.499	S	S	*	.	G	3₁₀ helix	trans	-69	-11.7	174.1	66.8	178.3	178.4	179	0	115	P465	P465-K467 HydrophobicContact CB-CG 4.16Å; P465-K467 HydrophobicContact CG-CG 4.05Å; P465-K467 PolarHBondContact O-N 3.13Å
468	A	84.9	Confident	84.9	Confident	61 Å²	61	94.4 Å²	94.4	50%	0.504	50%	0.503	S	S	.	.	G	3₁₀ helix	trans	-91.6	-15.1	178.8	0	0	0	0	0	113.5	L464 P465 E466	L464-A468 HydrophobicContact CD1-CB 3.89Å; P465-A468 HydrophobicContact CG-CB 4.45Å; P465-A468 VanDerWaalsContact O-CB 3.29Å; P465-A468 WeakPolarHBondContact O-CB 3.44Å; P465-A468 PolarHBondContact O-N 2.86Å; E466-A468 PolarHBondContact O-N 2.82Å
469	F	86.9	Confident	85.9	Confident	73 Å²	73	96.4 Å²	96.4	32%	0.32	51%	0.509	S	S	.	.	S	Bend	trans	-76.1	133.3	-179.1	-72.9	-98.1	0	0	0	111.8	L464 E466 K471 F476	L464-F469 HydrophobicContact CD2-CE1 4.24Å; L464-F469 HydrophobicContact CD2-CE2 4Å; L464-F469 HydrophobicContact CD2-CZ 3.62Å; L464-F469 HydrophobicContact CG-CE2 3.86Å; L464-F469 HydrophobicContact CG-CZ 4.02Å; E466-F469 PolarHBondContact O-N 3.23Å; F469-K471 PolarHBondContact O-N 2.81Å; F469-F476 HydrophobicContact CB-CD2 4.11Å; F469-F476 HydrophobicContact CB-CE2 3.73Å; F469-F476 AromaticContact CD1-CD2 3.87Å; F469-F476 HydrophobicContact CD1-CD2 3.87Å; F469-F476 AromaticContact CD1-CE2 3.77Å; F469-F476 HydrophobicContact CD1-CE2 3.77Å; F469-F476 HydrophobicContact CG-CD2 4.31Å; F469-F476 AromaticContact CG-CE2 3.88Å; F469-F476 HydrophobicContact CG-CE2 3.88Å
470	N	88.1	Confident	86.9	Confident	92 Å²	92	100 Å²	100	49%	0.492	52%	0.518	S	S	.	.			trans	-77.5	85.9	170.2	-177.7	15.3	0	0	0	110.5	K472 M473	N470-K472 PolarHBondContact O-N 2.98Å; N470-K472 WeakPolarHBondContact OD1-CB 3.38Å; N470-K472 PolarHBondContact OD1-N 3.45Å; N470-M473 HydrophobicContact CB-CG 4.07Å; N470-M473 WeakPolarHBondContact O-CG 3.49Å; N470-M473 PolarHBondContact O-N 3.16Å
471	K	90.8	Very high	87.9	Confident	107 Å²	107	97.4 Å²	97.4	47%	0.465	51%	0.511	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-6.7	-178.2	-48.7	-160.8	-174.5	-155.7	0	114.9	E466 F469 F476 N477	E466-K471 WeakPolarHBondContact OE1-CE 3.25Å; E466-K471 IonicContact OE1-NZ 2.7Å; E466-K471 PolarHBondContact OE1-NZ 2.82Å; F469-K471 PolarHBondContact O-N 2.81Å; K471-F476 HydrophobicContact CB-CD1 4.13Å; K471-F476 HydrophobicContact CB-CE1 3.99Å; K471-F476 HydrophobicContact CD-CE1 4.08Å; K471-F476 HydrophobicContact CD-CZ 4.13Å; K471-F476 HydrophobicContact CG-CD1 4.4Å; K471-F476 HydrophobicContact CG-CE1 3.89Å; K471-F476 HydrophobicContact CG-CZ 4Å; K471-N477 PolarHBondContact O-ND2 2.91Å
472	K	89.5	Confident	88.7	Confident	191 Å²	191	96.7 Å²	96.7	83%	0.83	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.5	-10.8	173.7	-57.9	-173.9	178	-174.4	0	113.6	N470	N470-K472 PolarHBondContact O-N 2.98Å; N470-K472 WeakPolarHBondContact OD1-CB 3.38Å; N470-K472 PolarHBondContact OD1-N 3.45Å
473	M	90.2	Very high	89.5	Confident	82 Å²	82	96.7 Å²	96.7	40%	0.404	51%	0.512	S	S	.	.	S	Bend	trans	-69.3	135	174.3	-62.2	-60.7	-68	0	0	109.9	N470 D475 F476 N477	N470-M473 HydrophobicContact CB-CG 4.07Å; N470-M473 WeakPolarHBondContact O-CG 3.49Å; N470-M473 PolarHBondContact O-N 3.16Å; M473-D475 VanDerWaalsContact C-N 3.29Å; M473-D475 PolarHBondContact O-N 2.69Å; M473-F476 HydrophobicContact CB-CB 4.28Å; M473-F476 PolarHBondContact O-N 3.45Å; M473-N477 PolarHBondContact O-ND2 3.35Å
474	P	89.7	Confident	90.1	Very high	91 Å²	91	100.9 Å²	100.9	59%	0.591	53%	0.529	S	S	*	.	H	α-helix	trans	-61.2	-42.4	175.5	23.8	-30.5	0	0	0	110.6	F476 N477 Q478	P474-F476 VanDerWaalsContact C-N 3.26Å; P474-F476 PolarHBondContact O-N 3.06Å; P474-N477 WeakPolarHBondContact O-CA 3.38Å; P474-N477 PolarHBondContact O-N 2.92Å; P474-Q478 PolarHBondContact O-N 2.79Å
475	D	91.8	Very high	90.5	Very high	91 Å²	91	100.9 Å²	100.9	49%	0.487	52%	0.52	S	S	.	.	H	α-helix	trans	-52.2	-40.7	178	-33.3	-25.9	0	0	0	112.4	M473 N477 Q478 E479	M473-D475 VanDerWaalsContact C-N 3.29Å; M473-D475 PolarHBondContact O-N 2.69Å; D475-N477 VanDerWaalsContact C-N 3.34Å; D475-N477 PolarHBondContact O-N 3.08Å; D475-Q478 PolarHBondContact O-N 3.43Å; D475-E479 WeakPolarHBondContact O-CB 3.32Å; D475-E479 WeakPolarHBondContact O-CG 3.38Å; D475-E479 PolarHBondContact O-N 2.96Å
476	F	92.6	Very high	91	Very high	33 Å²	33	108.2 Å²	108.2	15%	0.145	55%	0.548	C	S	.	.	H	α-helix	trans	-62.3	-42.1	177.1	175.2	-89.5	0	0	0	111.6	F469 K471 M473 P474 R480	F469-F476 HydrophobicContact CB-CD2 4.11Å; F469-F476 HydrophobicContact CB-CE2 3.73Å; F469-F476 AromaticContact CD1-CD2 3.87Å; F469-F476 HydrophobicContact CD1-CD2 3.87Å; F469-F476 AromaticContact CD1-CE2 3.77Å; F469-F476 HydrophobicContact CD1-CE2 3.77Å; F469-F476 HydrophobicContact CG-CD2 4.31Å; F469-F476 AromaticContact CG-CE2 3.88Å; F469-F476 HydrophobicContact CG-CE2 3.88Å; K471-F476 HydrophobicContact CB-CD1 4.13Å; K471-F476 HydrophobicContact CB-CE1 3.99Å; K471-F476 HydrophobicContact CD-CE1 4.08Å; K471-F476 HydrophobicContact CD-CZ 4.13Å; K471-F476 HydrophobicContact CG-CD1 4.4Å; K471-F476 HydrophobicContact CG-CE1 3.89Å; K471-F476 HydrophobicContact CG-CZ 4Å; M473-F476 HydrophobicContact CB-CB 4.28Å; M473-F476 PolarHBondContact O-N 3.45Å; P474-F476 VanDerWaalsContact C-N 3.26Å; P474-F476 PolarHBondContact O-N 3.06Å; F476-R480 HydrophobicContact CD1-CG 4.5Å; F476-R480 HydrophobicContact CD2-CG 4.4Å; F476-R480 HydrophobicContact CE1-CG 4.23Å; F476-R480 HydrophobicContact CE2-CG 4.15Å; F476-R480 HydrophobicContact CZ-CG 4.05Å; F476-R480 WeakPolarHBondContact O-CB 3.36Å; F476-R480 WeakPolarHBondContact O-CG 3.44Å; F476-R480 PolarHBondContact O-N 2.71Å; F476-R480 VanDerWaalsContact O-N 3.08Å
477	N	90.1	Very high	91.4	Very high	93 Å²	93	106 Å²	106	50%	0.497	54%	0.543	S	S	.	.	H	α-helix	trans	-75.9	-30.7	-179.4	-62.7	-70.3	0	0	0	111.5	K471 M473 P474 D475 S481	K471-N477 PolarHBondContact O-ND2 2.91Å; M473-N477 PolarHBondContact O-ND2 3.35Å; P474-N477 WeakPolarHBondContact O-CA 3.38Å; P474-N477 PolarHBondContact O-N 2.92Å; D475-N477 VanDerWaalsContact C-N 3.34Å; D475-N477 PolarHBondContact O-N 3.08Å; N477-S481 WeakPolarHBondContact O-CB 3.3Å; N477-S481 PolarHBondContact O-N 2.92Å; N477-S481 VanDerWaalsContact O-N 3.15Å
478	Q	93.2	Very high	91.8	Very high	136 Å²	136	104.2 Å²	104.2	64%	0.636	54%	0.541	S	S	*	.	H	α-helix	trans	-68.6	-53.1	173.3	-176.6	171.9	-7.2	0	0	111.7	P474 D475 R480 S481	P474-Q478 PolarHBondContact O-N 2.79Å; D475-Q478 PolarHBondContact O-N 3.43Å; Q478-R480 VanDerWaalsContact C-N 3.29Å; Q478-R480 PolarHBondContact O-N 2.96Å; Q478-S481 VanDerWaalsContact O-CB 3.28Å; Q478-S481 WeakPolarHBondContact O-CB 3.32Å; Q478-S481 PolarHBondContact O-N 2.85Å; Q478-S481 VanDerWaalsContact O-N 3.09Å; Q478-S481 PolarHBondContact O-OG 2.84Å
479	E	92.6	Very high	92.3	Very high	154 Å²	154	106 Å²	106	72%	0.72	55%	0.547	S	S	*	.	H	α-helix	trans	-63.8	-32.9	178.8	-69.6	-64.3	136.9	0	0	112.5	D475 S481	D475-E479 WeakPolarHBondContact O-CB 3.32Å; D475-E479 WeakPolarHBondContact O-CG 3.38Å; D475-E479 PolarHBondContact O-N 2.96Å; E479-S481 VanDerWaalsContact C-N 3.34Å
480	R	92.7	Very high	92.6	Very high	138 Å²	138	110.5 Å²	110.5	52%	0.521	58%	0.575	S	S	.	*	T	Hydrogen-bonded Turn	trans	-85	-0.5	175.7	-62.3	-66.4	-166.1	116.5	17.3	114.1	E466 F476 Q478 I482	E466-R480 IonicContact OE1-NH2 2.79Å; E466-R480 IonicContact OE2-CZ 3.32Å; E466-R480 IonicContact OE2-NH1 3.63Å; E466-R480 IonicContact OE2-NH2 2.69Å; E466-R480 PolarHBondContact OE2-NH2 2.87Å; F476-R480 HydrophobicContact CD1-CG 4.5Å; F476-R480 HydrophobicContact CD2-CG 4.4Å; F476-R480 HydrophobicContact CE1-CG 4.23Å; F476-R480 HydrophobicContact CE2-CG 4.15Å; F476-R480 HydrophobicContact CZ-CG 4.05Å; F476-R480 WeakPolarHBondContact O-CB 3.36Å; F476-R480 WeakPolarHBondContact O-CG 3.44Å; F476-R480 PolarHBondContact O-N 2.71Å; F476-R480 VanDerWaalsContact O-N 3.08Å; Q478-R480 VanDerWaalsContact C-N 3.29Å; Q478-R480 PolarHBondContact O-N 2.96Å; R480-I482 PolarHBondContact O-N 2.85Å
481	S	92.3	Very high	93	Very high	87 Å²	87	107.6 Å²	107.6	61%	0.608	56%	0.561	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.9	-20.9	-179.2	67.8	0	0	0	0	113.8	N477 Q478 E479	N477-S481 WeakPolarHBondContact O-CB 3.3Å; N477-S481 PolarHBondContact O-N 2.92Å; N477-S481 VanDerWaalsContact O-N 3.15Å; Q478-S481 VanDerWaalsContact O-CB 3.28Å; Q478-S481 WeakPolarHBondContact O-CB 3.32Å; Q478-S481 PolarHBondContact O-N 2.85Å; Q478-S481 VanDerWaalsContact O-N 3.09Å; Q478-S481 PolarHBondContact O-OG 2.84Å; E479-S481 VanDerWaalsContact C-N 3.34Å
482	I	91.4	Very high	93.2	Very high	93 Å²	93	109.3 Å²	109.3	48%	0.477	57%	0.569	S	S	.	*	S	Bend	trans	-129	125.1	177.4	-32.6	176.3	0	0	0	109.9	R480 R485	R480-I482 PolarHBondContact O-N 2.85Å; I482-R485 VanDerWaalsContact CG2-CZ 3.43Å
483	G	93.7	Very high	93.4	Very high	45 Å²	45	103.8 Å²	103.8	46%	0.464	55%	0.546	S	S	.	.			trans	-73.5	176.7	-176.9	0	0	0	0	0	115.2	R485	G483-R485 PolarHBondContact O-N 2.88Å; G483-R485 PolarHBondContact O-NH1 2.79Å
484	P	96.8	Very high	93.8	Very high	147 Å²	147	103 Å²	103	96%	0.955	54%	0.541	S	S	*	.	S	Bend	trans	-57.1	128.8	173.4	-22.1	33.6	0	0	0	111.5
485	R	94.6	Very high	94.1	Very high	124 Å²	124	103 Å²	103	47%	0.468	53%	0.533	S	S	.	.			trans	-153.6	163.3	-177.8	66.4	-168.1	172.7	-76	6.9	110.8	I482 G483 E493	I482-R485 VanDerWaalsContact CG2-CZ 3.43Å; G483-R485 PolarHBondContact O-N 2.88Å; G483-R485 PolarHBondContact O-NH1 2.79Å; R485-E493 IonicContact CZ-OE1 3.06Å; R485-E493 IonicContact CZ-OE2 3.49Å; R485-E493 IonicContact NE-OE1 3.27Å; R485-E493 PolarHBondContact NE-OE1 3.03Å; R485-E493 IonicContact NE-OE2 3.41Å; R485-E493 PolarHBondContact NE-OE2 2.85Å; R485-E493 VanDerWaalsContact NH2-CD 3.27Å; R485-E493 IonicContact NH2-OE1 3.62Å; R485-E493 PolarHBondContact NH2-OE1 3.12Å; R485-E493 IonicContact NH2-OE2 2.71Å; R485-E493 PolarHBondContact NH2-OE2 3.22Å
486	F	96.6	Very high	94.3	Very high	201 Å²	201	103.5 Å²	103.5	88%	0.882	53%	0.529	S	S	*	.	P	Polyproline II helix	trans	-89.8	142.6	158.2	-65	-73.9	0	0	0	108.9
487	A	95.3	Very high	94.5	Very high	31 Å²	31	103.4 Å²	103.4	26%	0.256	54%	0.538	S	S	.	.	P	Polyproline II helix	trans	-82.4	123.8	176.3	0	0	0	0	0	110.8	E493 H494	A487-E493 HydrophobicContact CB-CB 3.65Å; A487-H494 HydrophobicContact CB-CB 3.97Å; A487-H494 PolarHBondContact O-ND1 3.47Å
488	D	94.8	Very high	94.8	Very high	119 Å²	119	100.6 Å²	100.6	64%	0.636	53%	0.525	S	S	*	.	P	Polyproline II helix	trans	-55.5	137.7	179.1	-68.8	-64	0	0	0	111.6	N490 S491 H494	D488-N490 PolarHBondContact O-N 3.31Å; D488-S491 VanDerWaalsContact O-CB 3.29Å; D488-S491 WeakPolarHBondContact O-CB 3.39Å; D488-S491 PolarHBondContact O-N 3.28Å; D488-S491 PolarHBondContact O-OG 3.09Å; D488-H494 WeakPolarHBondContact O-CB 3.34Å
489	P	95.2	Very high	95	Very high	97 Å²	97	100.4 Å²	100.4	63%	0.63	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.4	-28.7	-174.9	-30	36.3	0	0	0	115.9
490	N	93.8	Very high	95.2	Very high	169 Å²	169	100.5 Å²	100.5	90%	0.904	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.7	9.2	-178.6	-60	-15.2	0	0	0	113.4	D488	D488-N490 PolarHBondContact O-N 3.31Å
491	S	95.6	Very high	95.5	Very high	31 Å²	31	100.7 Å²	100.7	22%	0.217	52%	0.517	C	S	.	.	S	Bend	trans	-94.8	151.9	-176.7	69.7	0	0	0	0	113.3	D488 E493 H494 E495	D488-S491 VanDerWaalsContact O-CB 3.29Å; D488-S491 WeakPolarHBondContact O-CB 3.39Å; D488-S491 PolarHBondContact O-N 3.28Å; D488-S491 PolarHBondContact O-OG 3.09Å; S491-E493 PolarHBondContact O-N 2.6Å; S491-H494 WeakPolarHBondContact O-CB 3.4Å; S491-H494 PolarHBondContact O-N 3.26Å; S491-H494 WeakPolarHBondContact OG-CB 3.33Å; S491-H494 PolarHBondContact OG-N 2.81Å; S491-H494 VanDerWaalsContact OG-N 3.13Å; S491-E495 PolarHBondContact O-N 3.03Å
492	F	94.5	Very high	95.7	Very high	142 Å²	142	102.7 Å²	102.7	62%	0.623	52%	0.517	S	S	*	.	H	α-helix	trans	-54.3	-36.8	168.5	178.4	-92.1	0	0	0	112.3	H494 E495 Y496	F492-H494 VanDerWaalsContact C-N 3.3Å; F492-H494 PolarHBondContact O-N 3.25Å; F492-E495 PolarHBondContact O-N 2.7Å; F492-Y496 HydrophobicContact CD1-CD2 4.32Å; F492-Y496 HydrophobicContact CD2-CD2 4.12Å; F492-Y496 AromaticContact CD2-CE2 3.99Å; F492-Y496 HydrophobicContact CD2-CE2 3.99Å; F492-Y496 AromaticContact CE1-CD2 3.97Å; F492-Y496 HydrophobicContact CE1-CD2 3.97Å; F492-Y496 HydrophobicContact CE1-CE2 4.22Å; F492-Y496 HydrophobicContact CE1-CG 4.42Å; F492-Y496 AromaticContact CE2-CD2 3.76Å; F492-Y496 HydrophobicContact CE2-CD2 3.76Å; F492-Y496 AromaticContact CE2-CE2 3.31Å; F492-Y496 HydrophobicContact CE2-CE2 3.31Å; F492-Y496 HydrophobicContact CG-CD2 4.4Å; F492-Y496 AromaticContact CZ-CD2 3.67Å; F492-Y496 HydrophobicContact CZ-CD2 3.67Å; F492-Y496 AromaticContact CZ-CE2 3.45Å; F492-Y496 HydrophobicContact CZ-CE2 3.45Å; F492-Y496 VanDerWaalsContact CZ-CE2 3.45Å; F492-Y496 HydrophobicContact CZ-CG 4.36Å; F492-Y496 AromaticContact CZ-CZ 3.94Å; F492-Y496 PolarHBondContact O-N 3.24Å; F492-Y496 VanDerWaalsContact O-N 3.09Å
493	E	95.1	Very high	96	Very high	76 Å²	76	102.9 Å²	102.9	36%	0.355	52%	0.518	S	S	.	.	H	α-helix	trans	-61.8	-37.3	176.1	-57.2	-169.3	164.4	0	0	112.2	R485 A487 S491 G497	R485-E493 IonicContact CZ-OE1 3.06Å; R485-E493 IonicContact CZ-OE2 3.49Å; R485-E493 IonicContact NE-OE1 3.27Å; R485-E493 PolarHBondContact NE-OE1 3.03Å; R485-E493 IonicContact NE-OE2 3.41Å; R485-E493 PolarHBondContact NE-OE2 2.85Å; R485-E493 VanDerWaalsContact NH2-CD 3.27Å; R485-E493 IonicContact NH2-OE1 3.62Å; R485-E493 PolarHBondContact NH2-OE1 3.12Å; R485-E493 IonicContact NH2-OE2 2.71Å; R485-E493 PolarHBondContact NH2-OE2 3.22Å; A487-E493 HydrophobicContact CB-CB 3.65Å; S491-E493 PolarHBondContact O-N 2.6Å; E493-G497 WeakPolarHBondContact O-CA 3.27Å; E493-G497 PolarHBondContact O-N 3.15Å
494	H	97	Very high	96.2	Very high	65 Å²	65	106.2 Å²	106.2	30%	0.301	52%	0.521	S	S	.	.	H	α-helix	trans	-73.5	-35.8	178.6	-169	104.3	0	0	0	112.1	A487 D488 S491 F492 S498	A487-H494 HydrophobicContact CB-CB 3.97Å; A487-H494 PolarHBondContact O-ND1 3.47Å; D488-H494 WeakPolarHBondContact O-CB 3.34Å; S491-H494 WeakPolarHBondContact O-CB 3.4Å; S491-H494 PolarHBondContact O-N 3.26Å; S491-H494 WeakPolarHBondContact OG-CB 3.33Å; S491-H494 PolarHBondContact OG-N 2.81Å; S491-H494 VanDerWaalsContact OG-N 3.13Å; F492-H494 VanDerWaalsContact C-N 3.3Å; F492-H494 PolarHBondContact O-N 3.25Å; H494-S498 WeakPolarHBondContact O-CB 3.29Å; H494-S498 PolarHBondContact O-N 3.25Å; H494-S498 PolarHBondContact O-OG 2.86Å
495	E	96.8	Very high	96.2	Very high	90 Å²	90	104 Å²	104	42%	0.421	50%	0.502	S	S	.	.	H	α-helix	trans	-62.5	-54	174.7	-158.9	-146.5	138.3	0	0	110.9	S491 F492 S498 R499	S491-E495 PolarHBondContact O-N 3.03Å; F492-E495 PolarHBondContact O-N 2.7Å; E495-S498 WeakPolarHBondContact O-CB 3.49Å; E495-S498 PolarHBondContact O-N 2.94Å; E495-R499 WeakPolarHBondContact O-CG 3.49Å; E495-R499 PolarHBondContact O-N 3.39Å; E495-R499 IonicContact OE1-CZ 3.15Å; E495-R499 IonicContact OE1-NE 2.91Å; E495-R499 PolarHBondContact OE1-NE 3.24Å; E495-R499 IonicContact OE1-NH2 2.64Å; E495-R499 PolarHBondContact OE1-NH2 3.14Å
496	Y	96.7	Very high	96.3	Very high	103 Å²	103	102.4 Å²	102.4	40%	0.404	50%	0.502	S	S	.	.	H	α-helix	trans	-70.4	-37.6	-179.9	-83	-102.6	0	0	0	112.4	F492 S498 R499 W500	F492-Y496 HydrophobicContact CD1-CD2 4.32Å; F492-Y496 HydrophobicContact CD2-CD2 4.12Å; F492-Y496 AromaticContact CD2-CE2 3.99Å; F492-Y496 HydrophobicContact CD2-CE2 3.99Å; F492-Y496 AromaticContact CE1-CD2 3.97Å; F492-Y496 HydrophobicContact CE1-CD2 3.97Å; F492-Y496 HydrophobicContact CE1-CE2 4.22Å; F492-Y496 HydrophobicContact CE1-CG 4.42Å; F492-Y496 AromaticContact CE2-CD2 3.76Å; F492-Y496 HydrophobicContact CE2-CD2 3.76Å; F492-Y496 AromaticContact CE2-CE2 3.31Å; F492-Y496 HydrophobicContact CE2-CE2 3.31Å; F492-Y496 HydrophobicContact CG-CD2 4.4Å; F492-Y496 AromaticContact CZ-CD2 3.67Å; F492-Y496 HydrophobicContact CZ-CD2 3.67Å; F492-Y496 AromaticContact CZ-CE2 3.45Å; F492-Y496 HydrophobicContact CZ-CE2 3.45Å; F492-Y496 VanDerWaalsContact CZ-CE2 3.45Å; F492-Y496 HydrophobicContact CZ-CG 4.36Å; F492-Y496 AromaticContact CZ-CZ 3.94Å; F492-Y496 PolarHBondContact O-N 3.24Å; F492-Y496 VanDerWaalsContact O-N 3.09Å; Y496-S498 PolarHBondContact O-N 3.29Å; Y496-R499 WeakPolarHBondContact O-CB 3.01Å; Y496-R499 PolarHBondContact O-N 3.22Å; Y496-W500 VanDerWaalsContact O-CD1 3.28Å; Y496-W500 PolarHBondContact O-N 2.95Å
497	G	96.1	Very high	96.4	Very high	31 Å²	31	99 Å²	99	32%	0.32	49%	0.487	S	S	.	.	H	α-helix	trans	-60.7	-33.2	171.6	0	0	0	0	0	112.9	E493 K501	E493-G497 WeakPolarHBondContact O-CA 3.27Å; E493-G497 PolarHBondContact O-N 3.15Å; G497-K501 WeakPolarHBondContact O-CG 3.5Å; G497-K501 PolarHBondContact O-N 3.3Å
498	S	96.6	Very high	96.5	Very high	33 Å²	33	103.5 Å²	103.5	23%	0.231	50%	0.501	C	S	.	.	H	α-helix	trans	-72.3	-40.5	173	-64.5	0	0	0	0	112.3	H494 E495 Y496 W500 K501 Q502	H494-S498 WeakPolarHBondContact O-CB 3.29Å; H494-S498 PolarHBondContact O-N 3.25Å; H494-S498 PolarHBondContact O-OG 2.86Å; E495-S498 WeakPolarHBondContact O-CB 3.49Å; E495-S498 PolarHBondContact O-N 2.94Å; Y496-S498 PolarHBondContact O-N 3.29Å; S498-W500 VanDerWaalsContact C-N 3.32Å; S498-W500 PolarHBondContact O-N 3.42Å; S498-K501 PolarHBondContact O-N 3.43Å; S498-Q502 VanDerWaalsContact O-CG 3.3Å; S498-Q502 WeakPolarHBondContact O-CG 3.26Å; S498-Q502 PolarHBondContact O-N 3.3Å
499	R	97.1	Very high	96.6	Very high	132 Å²	132	102.4 Å²	102.4	50%	0.498	50%	0.498	S	S	.	.	H	α-helix	trans	-59.4	-41	171.1	-66.2	173.7	-178	-134.3	8.3	111.6	E495 Y496 Q502 L503	E495-R499 WeakPolarHBondContact O-CG 3.49Å; E495-R499 PolarHBondContact O-N 3.39Å; E495-R499 IonicContact OE1-CZ 3.15Å; E495-R499 IonicContact OE1-NE 2.91Å; E495-R499 PolarHBondContact OE1-NE 3.24Å; E495-R499 IonicContact OE1-NH2 2.64Å; E495-R499 PolarHBondContact OE1-NH2 3.14Å; Y496-R499 WeakPolarHBondContact O-CB 3.01Å; Y496-R499 PolarHBondContact O-N 3.22Å; R499-Q502 WeakPolarHBondContact O-CB 3.32Å; R499-Q502 PolarHBondContact O-N 2.82Å; R499-L503 PolarHBondContact O-N 3.44Å
500	W	97.7	Very high	96.7	Very high	157 Å²	157	104.4 Å²	104.4	60%	0.595	50%	0.497	S	S	*	.	H	α-helix	trans	-62.9	-45.2	173	-85.3	105.1	0	0	0	112.6	Y496 S498 Q502 L503 H504	Y496-W500 VanDerWaalsContact O-CD1 3.28Å; Y496-W500 PolarHBondContact O-N 2.95Å; S498-W500 VanDerWaalsContact C-N 3.32Å; S498-W500 PolarHBondContact O-N 3.42Å; W500-Q502 VanDerWaalsContact C-N 3.33Å; W500-Q502 PolarHBondContact O-N 3Å; W500-L503 HydrophobicContact CE3-CD2 4.24Å; W500-L503 HydrophobicContact CZ3-CD2 4.24Å; W500-L503 WeakPolarHBondContact O-CB 3.46Å; W500-L503 PolarHBondContact O-N 3.45Å; W500-H504 AromaticContact CE3-NE2 3.92Å; W500-H504 PolarHBondContact O-CD2 2.84Å; W500-H504 VanDerWaalsContact O-CD2 3.27Å; W500-H504 PolarHBondContact O-N 3.49Å
501	K	97.7	Very high	96.9	Very high	141 Å²	141	100.5 Å²	100.5	61%	0.613	47%	0.473	S	S	*	.	H	α-helix	trans	-59.4	-41.9	174.1	-74.2	170.7	-178.9	175.1	0	112.1	G497 S498 H504 N505	G497-K501 WeakPolarHBondContact O-CG 3.5Å; G497-K501 PolarHBondContact O-N 3.3Å; S498-K501 PolarHBondContact O-N 3.43Å; K501-H504 PolarHBondContact O-N 2.84Å; K501-N505 WeakPolarHBondContact O-CB 3.39Å; K501-N505 VanDerWaalsContact O-CG 3.24Å; K501-N505 PolarHBondContact O-N 2.82Å; K501-N505 PolarHBondContact O-ND2 3.38Å
502	Q	97.6	Very high	96.9	Very high	129 Å²	129	101.6 Å²	101.6	60%	0.603	48%	0.477	S	S	*	.	H	α-helix	trans	-61	-42.6	174.3	-70.7	168.1	5.9	0	0	111.7	S498 R499 W500 N505 L506	S498-Q502 VanDerWaalsContact O-CG 3.3Å; S498-Q502 WeakPolarHBondContact O-CG 3.26Å; S498-Q502 PolarHBondContact O-N 3.3Å; R499-Q502 WeakPolarHBondContact O-CB 3.32Å; R499-Q502 PolarHBondContact O-N 2.82Å; W500-Q502 VanDerWaalsContact C-N 3.33Å; W500-Q502 PolarHBondContact O-N 3Å; Q502-N505 PolarHBondContact O-N 3.14Å; Q502-L506 WeakPolarHBondContact O-CB 3.36Å; Q502-L506 PolarHBondContact O-N 3.04Å
503	L	97.3	Very high	97	Very high	98 Å²	98	97 Å²	97	51%	0.513	47%	0.465	S	S	.	.	H	α-helix	trans	-63.2	-44.5	177.1	-178.5	60.9	0	0	0	112.4	R499 W500 L506 F507	R499-L503 PolarHBondContact O-N 3.44Å; W500-L503 HydrophobicContact CE3-CD2 4.24Å; W500-L503 HydrophobicContact CZ3-CD2 4.24Å; W500-L503 WeakPolarHBondContact O-CB 3.46Å; W500-L503 PolarHBondContact O-N 3.45Å; L503-L506 PolarHBondContact O-N 2.87Å; L503-F507 WeakPolarHBondContact O-CB 3.45Å; L503-F507 PolarHBondContact O-N 2.84Å
504	H	97.1	Very high	97.1	Very high	114 Å²	114	97.6 Å²	97.6	53%	0.528	47%	0.47	S	S	.	.	H	α-helix	trans	-66	-38.3	175.3	-78.2	-74.2	0	0	0	112.7	W500 K501 F507 K508	W500-H504 AromaticContact CE3-NE2 3.92Å; W500-H504 PolarHBondContact O-CD2 2.84Å; W500-H504 VanDerWaalsContact O-CD2 3.27Å; W500-H504 PolarHBondContact O-N 3.49Å; K501-H504 PolarHBondContact O-N 2.84Å; H504-F507 PolarHBondContact O-N 2.98Å; H504-K508 WeakPolarHBondContact O-CB 3.4Å; H504-K508 PolarHBondContact O-N 3.18Å
505	N	97.2	Very high	97.1	Very high	101 Å²	101	99.8 Å²	99.8	54%	0.54	48%	0.479	S	S	.	.	H	α-helix	trans	-64.5	-40	173.7	-73.6	-18.9	0	0	0	111.9	K501 Q502 K508 T509	K501-N505 WeakPolarHBondContact O-CB 3.39Å; K501-N505 VanDerWaalsContact O-CG 3.24Å; K501-N505 PolarHBondContact O-N 2.82Å; K501-N505 PolarHBondContact O-ND2 3.38Å; Q502-N505 PolarHBondContact O-N 3.14Å; N505-K508 PolarHBondContact O-N 2.92Å; N505-T509 WeakPolarHBondContact O-CB 3.45Å; N505-T509 PolarHBondContact O-N 2.8Å; N505-T509 PolarHBondContact O-OG1 2.69Å
506	L	96.9	Very high	97	Very high	90 Å²	90	102.7 Å²	102.7	47%	0.471	49%	0.486	S	S	.	.	H	α-helix	trans	-65.3	-42.6	174.8	-179.2	64.1	0	0	0	111.7	Q502 L503 T509 K510	Q502-L506 WeakPolarHBondContact O-CB 3.36Å; Q502-L506 PolarHBondContact O-N 3.04Å; L503-L506 PolarHBondContact O-N 2.87Å; L506-T509 PolarHBondContact O-N 2.93Å; L506-K510 WeakPolarHBondContact O-CG 3.49Å; L506-K510 PolarHBondContact O-N 3.16Å
507	F	97.6	Very high	97	Very high	130 Å²	130	103.4 Å²	103.4	57%	0.57	49%	0.493	S	S	*	.	H	α-helix	trans	-59	-51.8	174	176	-92.1	0	0	0	111.2	L503 H504 T509 K510 Q511	L503-F507 WeakPolarHBondContact O-CB 3.45Å; L503-F507 PolarHBondContact O-N 2.84Å; H504-F507 PolarHBondContact O-N 2.98Å; F507-T509 PolarHBondContact O-N 3.28Å; F507-K510 PolarHBondContact O-N 3.13Å; F507-Q511 WeakPolarHBondContact O-CB 3.5Å; F507-Q511 PolarHBondContact O-N 2.64Å
508	K	97.5	Very high	96.9	Very high	126 Å²	126	107.2 Å²	107.2	55%	0.548	51%	0.506	S	S	.	.	H	α-helix	trans	-58.4	-46.3	177.7	-177	177.8	179.5	-179.6	0	111.7	H504 N505 K510 Q511 D512	H504-K508 WeakPolarHBondContact O-CB 3.4Å; H504-K508 PolarHBondContact O-N 3.18Å; N505-K508 PolarHBondContact O-N 2.92Å; K508-K510 VanDerWaalsContact C-N 3.33Å; K508-K510 PolarHBondContact O-N 3.4Å; K508-Q511 PolarHBondContact O-N 2.68Å; K508-D512 WeakPolarHBondContact CE-OD2 3.07Å; K508-D512 WeakPolarHBondContact CG-OD2 3.28Å; K508-D512 WeakPolarHBondContact O-CB 3.17Å; K508-D512 PolarHBondContact O-N 3.19Å
509	T	97.5	Very high	96.8	Very high	95 Å²	95	110.6 Å²	110.6	58%	0.583	52%	0.516	S	S	*	.	H	α-helix	trans	-59.7	-42.1	178.3	-55.5	0	0	0	0	111.7	N505 L506 F507 A513	N505-T509 WeakPolarHBondContact O-CB 3.45Å; N505-T509 PolarHBondContact O-N 2.8Å; N505-T509 PolarHBondContact O-OG1 2.69Å; L506-T509 PolarHBondContact O-N 2.93Å; F507-T509 PolarHBondContact O-N 3.28Å; T509-A513 VanDerWaalsContact O-CB 3.29Å; T509-A513 WeakPolarHBondContact O-CB 3.48Å; T509-A513 PolarHBondContact O-N 3.23Å
510	K	97.7	Very high	96.6	Very high	139 Å²	139	109.7 Å²	109.7	60%	0.604	52%	0.519	S	S	*	.	H	α-helix	trans	-67.6	-40.7	174.9	-73.3	-177.6	176.8	-174.1	0	112.5	L506 F507 K508 A513 L514	L506-K510 WeakPolarHBondContact O-CG 3.49Å; L506-K510 PolarHBondContact O-N 3.16Å; F507-K510 PolarHBondContact O-N 3.13Å; K508-K510 VanDerWaalsContact C-N 3.33Å; K508-K510 PolarHBondContact O-N 3.4Å; K510-A513 PolarHBondContact O-N 3.2Å; K510-L514 WeakPolarHBondContact O-CB 3.45Å; K510-L514 PolarHBondContact O-N 2.97Å
511	Q	97.1	Very high	96.5	Very high	87 Å²	87	107.2 Å²	107.2	41%	0.407	51%	0.514	S	S	.	.	H	α-helix	trans	-63.7	-44.3	177.8	-166.2	-172	16.1	0	0	111.5	F507 K508 A513 L514 K515	F507-Q511 WeakPolarHBondContact O-CB 3.5Å; F507-Q511 PolarHBondContact O-N 2.64Å; K508-Q511 PolarHBondContact O-N 2.68Å; Q511-A513 VanDerWaalsContact C-N 3.35Å; Q511-L514 PolarHBondContact O-N 3.17Å; Q511-K515 VanDerWaalsContact O-CG 3.31Å; Q511-K515 WeakPolarHBondContact O-CG 3.49Å; Q511-K515 PolarHBondContact O-N 2.97Å
512	D	96.6	Very high	96.2	Very high	54 Å²	54	104.1 Å²	104.1	29%	0.289	50%	0.502	S	S	.	.	H	α-helix	trans	-78.1	-18.4	179.3	-64.9	-23.5	0	0	0	112.7	K508 K515 R516	K508-D512 WeakPolarHBondContact CE-OD2 3.07Å; K508-D512 WeakPolarHBondContact CG-OD2 3.28Å; K508-D512 WeakPolarHBondContact O-CB 3.17Å; K508-D512 PolarHBondContact O-N 3.19Å; D512-K515 IonicContact OD1-NZ 3.47Å; D512-K515 PolarHBondContact OD1-NZ 3.14Å; D512-R516 PolarHBondContact O-NH1 2.93Å
513	A	96.9	Very high	95.9	Very high	45 Å²	45	101.3 Å²	101.3	37%	0.372	49%	0.491	S	S	.	.	H	α-helix	trans	-69.8	-53.5	164.2	0	0	0	0	0	111.1	T509 K510 Q511 K515 R516 E517	T509-A513 VanDerWaalsContact O-CB 3.29Å; T509-A513 WeakPolarHBondContact O-CB 3.48Å; T509-A513 PolarHBondContact O-N 3.23Å; K510-A513 PolarHBondContact O-N 3.2Å; Q511-A513 VanDerWaalsContact C-N 3.35Å; A513-K515 PolarHBondContact O-N 3.31Å; A513-R516 WeakPolarHBondContact O-CB 3.32Å; A513-R516 PolarHBondContact O-N 2.86Å; A513-E517 PolarHBondContact O-N 2.7Å
514	L	97	Very high	95.7	Very high	90 Å²	90	101.3 Å²	101.3	47%	0.471	49%	0.487	S	S	.	.	H	α-helix	trans	-60.6	-41.5	-179.2	-178	63.5	0	0	0	112.7	K510 Q511 R516 E517 L518	K510-L514 WeakPolarHBondContact O-CB 3.45Å; K510-L514 PolarHBondContact O-N 2.97Å; Q511-L514 PolarHBondContact O-N 3.17Å; L514-R516 VanDerWaalsContact C-N 3.27Å; L514-R516 PolarHBondContact O-N 3.36Å; L514-E517 PolarHBondContact O-N 3.28Å; L514-L518 HydrophobicContact CD1-CD1 4.2Å; L514-L518 HydrophobicContact CD1-CG 4.19Å; L514-L518 HydrophobicContact CG-CD1 4.05Å; L514-L518 HydrophobicContact CG-CG 4.44Å; L514-L518 WeakPolarHBondContact O-CB 3.33Å; L514-L518 WeakPolarHBondContact O-CG 3.39Å; L514-L518 PolarHBondContact O-N 3Å
515	K	95.8	Very high	95.5	Very high	111 Å²	111	100.4 Å²	100.4	48%	0.483	49%	0.485	S	S	.	.	H	α-helix	trans	-57.3	-39.3	173.3	-74.6	171	-171.5	158.2	0	112.6	Q511 D512 A513 K519	Q511-K515 VanDerWaalsContact O-CG 3.31Å; Q511-K515 WeakPolarHBondContact O-CG 3.49Å; Q511-K515 PolarHBondContact O-N 2.97Å; D512-K515 IonicContact OD1-NZ 3.47Å; D512-K515 PolarHBondContact OD1-NZ 3.14Å; A513-K515 PolarHBondContact O-N 3.31Å; K515-K519 WeakPolarHBondContact O-CB 3.03Å; K515-K519 PolarHBondContact O-N 2.95Å; K515-K519 VanDerWaalsContact O-N 3.11Å
516	R	95.9	Very high	95.1	Very high	151 Å²	151	99.5 Å²	99.5	57%	0.57	48%	0.478	S	S	*	.	H	α-helix	trans	-73	-40.4	179.2	-170.8	-172.1	-61.6	87.6	5.3	111.4	D512 A513 L514 K519 M520	D512-R516 PolarHBondContact O-NH1 2.93Å; A513-R516 WeakPolarHBondContact O-CB 3.32Å; A513-R516 PolarHBondContact O-N 2.86Å; L514-R516 VanDerWaalsContact C-N 3.27Å; L514-R516 PolarHBondContact O-N 3.36Å; R516-K519 PolarHBondContact O-N 3.39Å; R516-M520 HydrophobicContact CG-CE 4.42Å; R516-M520 WeakPolarHBondContact O-CG 3.2Å; R516-M520 PolarHBondContact O-N 3.09Å
517	E	96.8	Very high	94.8	Very high	117 Å²	117	97.9 Å²	97.9	55%	0.547	48%	0.478	S	S	.	.	H	α-helix	trans	-60.4	-52	175.7	-174.2	176.7	179.2	0	0	111.4	A513 L514 K519 M520 E521	A513-E517 PolarHBondContact O-N 2.7Å; L514-E517 PolarHBondContact O-N 3.28Å; E517-K519 VanDerWaalsContact C-N 3.33Å; E517-K519 PolarHBondContact O-N 3.15Å; E517-M520 PolarHBondContact O-N 3.46Å; E517-M520 VanDerWaalsContact O-N 3.13Å; E517-E521 PolarHBondContact O-N 3.33Å; E517-E521 VanDerWaalsContact O-N 3.16Å
518	L	94.3	Very high	94.5	Very high	111 Å²	111	97 Å²	97	58%	0.581	48%	0.475	S	S	*	.	H	α-helix	trans	-61.3	-39.3	177.2	-67.7	173.5	0	0	0	112.3	L514 E521 E522	L514-L518 HydrophobicContact CD1-CD1 4.2Å; L514-L518 HydrophobicContact CD1-CG 4.19Å; L514-L518 HydrophobicContact CG-CD1 4.05Å; L514-L518 HydrophobicContact CG-CG 4.44Å; L514-L518 WeakPolarHBondContact O-CB 3.33Å; L514-L518 WeakPolarHBondContact O-CG 3.39Å; L514-L518 PolarHBondContact O-N 3Å; L518-E521 PolarHBondContact O-N 3.49Å; L518-E522 PolarHBondContact O-N 2.97Å
519	K	93.4	Very high	94.1	Very high	105 Å²	105	94.2 Å²	94.2	46%	0.457	47%	0.465	S	S	.	.	H	α-helix	trans	-64.7	-38.3	174.2	177.8	164.3	176	59.7	0	112.8	K515 R516 E517 E521 E522 D523	K515-K519 WeakPolarHBondContact O-CB 3.03Å; K515-K519 PolarHBondContact O-N 2.95Å; K515-K519 VanDerWaalsContact O-N 3.11Å; R516-K519 PolarHBondContact O-N 3.39Å; E517-K519 VanDerWaalsContact C-N 3.33Å; E517-K519 PolarHBondContact O-N 3.15Å; K519-E521 VanDerWaalsContact C-N 3.26Å; K519-E521 PolarHBondContact O-N 3.07Å; K519-E522 WeakPolarHBondContact O-CB 3.47Å; K519-E522 PolarHBondContact O-N 3.09Å; K519-D523 IonicContact NZ-OD1 3.74Å; K519-D523 PolarHBondContact NZ-OD1 3.11Å; K519-D523 IonicContact NZ-OD2 3.19Å; K519-D523 WeakPolarHBondContact O-CB 3.39Å; K519-D523 PolarHBondContact O-N 3.19Å
520	M	94.1	Very high	93.6	Very high	113 Å²	113	94.5 Å²	94.5	56%	0.557	46%	0.46	S	S	*	.	H	α-helix	trans	-66.2	-30	176.5	-71.7	-177.8	-57.8	0	0	112.4	R516 E517 K524	R516-M520 HydrophobicContact CG-CE 4.42Å; R516-M520 WeakPolarHBondContact O-CG 3.2Å; R516-M520 PolarHBondContact O-N 3.09Å; E517-M520 PolarHBondContact O-N 3.46Å; E517-M520 VanDerWaalsContact O-N 3.13Å; M520-K524 WeakPolarHBondContact O-CB 3.35Å; M520-K524 PolarHBondContact O-N 3.39Å
521	E	94.7	Very high	93.3	Very high	104 Å²	104	94.8 Å²	94.8	49%	0.486	46%	0.458	S	S	.	.	H	α-helix	trans	-75.4	-33.9	170.6	-73.5	-65.5	147.3	0	0	112.6	E517 L518 K519 K524 L525	E517-E521 PolarHBondContact O-N 3.33Å; E517-E521 VanDerWaalsContact O-N 3.16Å; L518-E521 PolarHBondContact O-N 3.49Å; K519-E521 VanDerWaalsContact C-N 3.26Å; K519-E521 PolarHBondContact O-N 3.07Å; E521-K524 IonicContact OE1-NZ 2.74Å; E521-K524 PolarHBondContact OE1-NZ 3.05Å; E521-K524 IonicContact OE2-NZ 2.76Å; E521-K524 PolarHBondContact OE2-NZ 3.34Å; E521-L525 WeakPolarHBondContact O-CB 3.36Å; E521-L525 PolarHBondContact O-N 2.97Å
522	E	90.8	Very high	93	Very high	77 Å²	77	93 Å²	93	36%	0.36	46%	0.458	S	S	.	.	H	α-helix	trans	-62.7	-54.6	170.8	-171.8	-165.8	158.6	0	0	111.7	R448 L518 K519 K524 L525 E526	R448-E522 IonicContact CZ-OE1 3.98Å; R448-E522 IonicContact NH1-OE1 3.75Å; R448-E522 PolarHBondContact NH1-OE1 3.03Å; R448-E522 IonicContact NH2-OE1 3.84Å; R448-E522 PolarHBondContact NH2-OE1 2.75Å; L518-E522 PolarHBondContact O-N 2.97Å; K519-E522 WeakPolarHBondContact O-CB 3.47Å; K519-E522 PolarHBondContact O-N 3.09Å; E522-K524 PolarHBondContact O-N 3.44Å; E522-L525 PolarHBondContact O-N 3.29Å; E522-L525 VanDerWaalsContact O-N 3.08Å; E522-E526 PolarHBondContact O-N 2.67Å
523	D	91.4	Very high	92.6	Very high	70 Å²	70	97.4 Å²	97.4	37%	0.374	47%	0.471	S	S	.	.	H	α-helix	trans	-57.8	-35.4	178.7	-63.7	-20.1	0	0	0	110.9	K519 A527	K519-D523 IonicContact NZ-OD1 3.74Å; K519-D523 PolarHBondContact NZ-OD1 3.11Å; K519-D523 IonicContact NZ-OD2 3.19Å; K519-D523 WeakPolarHBondContact O-CB 3.39Å; K519-D523 PolarHBondContact O-N 3.19Å; D523-A527 WeakPolarHBondContact O-CB 3.25Å; D523-A527 PolarHBondContact O-N 3.18Å; D523-A527 VanDerWaalsContact O-N 3.13Å
524	K	94.6	Very high	92.2	Very high	97 Å²	97	100.9 Å²	100.9	42%	0.422	48%	0.475	S	S	.	.	H	α-helix	trans	-72.6	-38.2	176.2	170.7	-177.9	162.1	-137.9	0	113	M520 E521 E522 Q528	M520-K524 WeakPolarHBondContact O-CB 3.35Å; M520-K524 PolarHBondContact O-N 3.39Å; E521-K524 IonicContact OE1-NZ 2.74Å; E521-K524 PolarHBondContact OE1-NZ 3.05Å; E521-K524 IonicContact OE2-NZ 2.76Å; E521-K524 PolarHBondContact OE2-NZ 3.34Å; E522-K524 PolarHBondContact O-N 3.44Å; K524-Q528 VanDerWaalsContact O-CG 3.32Å; K524-Q528 WeakPolarHBondContact O-CG 3.26Å; K524-Q528 PolarHBondContact O-N 2.98Å
525	L	92.3	Very high	92	Very high	95 Å²	95	101.4 Å²	101.4	50%	0.497	48%	0.475	S	S	.	.	H	α-helix	trans	-68.3	-41.6	174.5	178.6	61.3	0	0	0	110.9	E521 E522 A527 Q528 M529	E521-L525 WeakPolarHBondContact O-CB 3.36Å; E521-L525 PolarHBondContact O-N 2.97Å; E522-L525 PolarHBondContact O-N 3.29Å; E522-L525 VanDerWaalsContact O-N 3.08Å; L525-A527 PolarHBondContact O-N 3.46Å; L525-Q528 PolarHBondContact O-N 2.96Å; L525-M529 HydrophobicContact CD1-CG 4.36Å; L525-M529 HydrophobicContact CG-CE 4.19Å; L525-M529 HydrophobicContact CG-SD 4.49Å; L525-M529 WeakPolarHBondContact O-CG 3.37Å; L525-M529 PolarHBondContact O-N 3.29Å
526	E	88.2	Confident	91.7	Very high	82 Å²	82	102.5 Å²	102.5	38%	0.383	48%	0.482	S	S	.	.	H	α-helix	trans	-60	-46	175.9	-164.9	155.4	-115.4	0	0	111	R448 E522 Q528 M529 E530	R448-E526 IonicContact CZ-OE1 2.78Å; R448-E526 IonicContact NH1-OE1 2.88Å; R448-E526 PolarHBondContact NH1-OE1 3.47Å; R448-E526 IonicContact NH1-OE2 2.8Å; E522-E526 PolarHBondContact O-N 2.67Å; E526-Q528 PolarHBondContact O-N 2.93Å; E526-M529 PolarHBondContact O-N 3.3Å; E526-E530 WeakPolarHBondContact O-CB 3.21Å; E526-E530 PolarHBondContact O-N 2.87Å
527	A	90.6	Very high	91.5	Very high	57 Å²	57	98.8 Å²	98.8	47%	0.471	47%	0.471	S	S	.	.	H	α-helix	trans	-63.8	-33.6	173.9	0	0	0	0	0	114.1	D523 L525 Y531	D523-A527 WeakPolarHBondContact O-CB 3.25Å; D523-A527 PolarHBondContact O-N 3.18Å; D523-A527 VanDerWaalsContact O-N 3.13Å; L525-A527 PolarHBondContact O-N 3.46Å; A527-Y531 WeakPolarHBondContact O-CB 3.3Å; A527-Y531 PolarHBondContact O-N 3.43Å
528	Q	92.3	Very high	91.3	Very high	112 Å²	112	96.1 Å²	96.1	52%	0.523	46%	0.463	S	S	.	.	H	α-helix	trans	-69.8	-42.2	174.5	-77.9	177.4	8.6	0	0	112.1	K524 L525 E526 Y531 A532	K524-Q528 VanDerWaalsContact O-CG 3.32Å; K524-Q528 WeakPolarHBondContact O-CG 3.26Å; K524-Q528 PolarHBondContact O-N 2.98Å; L525-Q528 PolarHBondContact O-N 2.96Å; E526-Q528 PolarHBondContact O-N 2.93Å; Q528-Y531 PolarHBondContact O-N 3.29Å; Q528-A532 WeakPolarHBondContact O-CB 3.43Å; Q528-A532 PolarHBondContact O-N 2.87Å
529	M	89	Confident	91.2	Very high	66 Å²	66	93.6 Å²	93.6	33%	0.325	45%	0.448	S	S	.	.	H	α-helix	trans	-65.8	-41.1	176	-68.9	-173.1	-60.9	0	0	111.6	L447 L525 E526 A532 R533	L447-M529 HydrophobicContact CB-SD 4.47Å; L525-M529 HydrophobicContact CD1-CG 4.36Å; L525-M529 HydrophobicContact CG-CE 4.19Å; L525-M529 HydrophobicContact CG-SD 4.49Å; L525-M529 WeakPolarHBondContact O-CG 3.37Å; L525-M529 PolarHBondContact O-N 3.29Å; E526-M529 PolarHBondContact O-N 3.3Å; M529-A532 PolarHBondContact O-N 2.92Å; M529-R533 WeakPolarHBondContact O-CB 3.47Å; M529-R533 PolarHBondContact O-N 3.25Å
530	E	86.7	Confident	91.2	Very high	101 Å²	101	93.2 Å²	93.2	47%	0.472	45%	0.451	S	S	.	.	H	α-helix	trans	-64.4	-44.8	175.9	-178.2	173	-154.7	0	0	111.7	E526 A532 R533 Y534	E526-E530 WeakPolarHBondContact O-CB 3.21Å; E526-E530 PolarHBondContact O-N 2.87Å; E530-A532 PolarHBondContact O-N 3.07Å; E530-R533 PolarHBondContact O-N 3.39Å; E530-Y534 HydrophobicContact CG-CD2 3.79Å; E530-Y534 HydrophobicContact CG-CE2 3.25Å; E530-Y534 VanDerWaalsContact O-CD2 3.32Å; E530-Y534 WeakPolarHBondContact O-CD2 3.41Å; E530-Y534 PolarHBondContact O-N 3.11Å; E530-Y534 WeakPolarHBondContact OE1-CE2 3.39Å; E530-Y534 PolarHBondContact OE1-OH 3.03Å
531	Y	89.9	Confident	91.1	Very high	146 Å²	146	93.4 Å²	93.4	57%	0.573	45%	0.453	S	S	*	.	H	α-helix	trans	-58.2	-49.9	174.1	176.6	-86.1	0	0	0	111.8	A527 Q528 R533 Y534 E535	A527-Y531 WeakPolarHBondContact O-CB 3.3Å; A527-Y531 PolarHBondContact O-N 3.43Å; Q528-Y531 PolarHBondContact O-N 3.29Å; Y531-R533 VanDerWaalsContact C-N 3.27Å; Y531-R533 PolarHBondContact O-N 3.42Å; Y531-Y534 PolarHBondContact O-N 2.9Å; Y531-E535 HydrophobicContact CE1-CB 4.22Å; Y531-E535 HydrophobicContact CE1-CG 4.48Å; Y531-E535 WeakPolarHBondContact CE1-OE1 3.47Å; Y531-E535 WeakPolarHBondContact O-CB 3.36Å; Y531-E535 PolarHBondContact O-N 2.84Å; Y531-E535 PolarHBondContact OH-OE1 3.11Å
532	A	91.6	Very high	91	Very high	50 Å²	50	94.4 Å²	94.4	41%	0.413	45%	0.453	S	S	.	.	H	α-helix	trans	-62.3	-35.7	-179.4	0	0	0	0	0	112.2	Q528 M529 E530 E535 Q536	Q528-A532 WeakPolarHBondContact O-CB 3.43Å; Q528-A532 PolarHBondContact O-N 2.87Å; M529-A532 PolarHBondContact O-N 2.92Å; E530-A532 PolarHBondContact O-N 3.07Å; A532-E535 PolarHBondContact O-N 2.85Å; A532-Q536 WeakPolarHBondContact O-CB 3.28Å; A532-Q536 PolarHBondContact O-N 3.25Å
533	R	87.4	Confident	91.1	Very high	145 Å²	145	95.5 Å²	95.5	55%	0.547	46%	0.458	S	S	.	.	H	α-helix	trans	-63.4	-51.4	173.4	-179.3	-177.7	168.4	-153.5	-15.8	111.6	M529 E530 Y531 E535 Q536 E537	M529-R533 WeakPolarHBondContact O-CB 3.47Å; M529-R533 PolarHBondContact O-N 3.25Å; E530-R533 PolarHBondContact O-N 3.39Å; Y531-R533 VanDerWaalsContact C-N 3.27Å; Y531-R533 PolarHBondContact O-N 3.42Å; R533-E535 VanDerWaalsContact C-N 3.28Å; R533-E535 PolarHBondContact O-N 3.37Å; R533-Q536 PolarHBondContact O-N 2.95Å; R533-E537 HydrophobicContact CG-CG 4.48Å; R533-E537 IonicContact CZ-OE1 2.67Å; R533-E537 IonicContact NE-OE1 3.98Å; R533-E537 PolarHBondContact NE-OE1 3.45Å; R533-E537 IonicContact NH2-OE1 3.84Å; R533-E537 PolarHBondContact NH2-OE1 2.89Å; R533-E537 IonicContact NH2-OE2 3.65Å; R533-E537 WeakPolarHBondContact O-CG 3.33Å; R533-E537 PolarHBondContact O-N 3.31Å
534	Y	88.6	Confident	91.2	Very high	118 Å²	118	95.5 Å²	95.5	46%	0.463	46%	0.455	S	S	.	.	H	α-helix	trans	-63.3	-34.6	177.9	-69.2	-49	0	0	0	112.3	E530 Y531 T538	E530-Y534 HydrophobicContact CG-CD2 3.79Å; E530-Y534 HydrophobicContact CG-CE2 3.25Å; E530-Y534 VanDerWaalsContact O-CD2 3.32Å; E530-Y534 WeakPolarHBondContact O-CD2 3.41Å; E530-Y534 PolarHBondContact O-N 3.11Å; E530-Y534 WeakPolarHBondContact OE1-CE2 3.39Å; E530-Y534 PolarHBondContact OE1-OH 3.03Å; Y531-Y534 PolarHBondContact O-N 2.9Å; Y534-T538 WeakPolarHBondContact O-CB 3.05Å; Y534-T538 PolarHBondContact O-N 3.09Å; Y534-T538 PolarHBondContact O-OG1 3.46Å
535	E	92.6	Very high	91.1	Very high	102 Å²	102	95.4 Å²	95.4	48%	0.477	46%	0.459	S	S	.	.	H	α-helix	trans	-63.6	-44.5	175.1	-172.5	165.2	-109.6	0	0	111.5	Y531 A532 R533 T538 E539	Y531-E535 HydrophobicContact CE1-CB 4.22Å; Y531-E535 HydrophobicContact CE1-CG 4.48Å; Y531-E535 WeakPolarHBondContact CE1-OE1 3.47Å; Y531-E535 WeakPolarHBondContact O-CB 3.36Å; Y531-E535 PolarHBondContact O-N 2.84Å; Y531-E535 PolarHBondContact OH-OE1 3.11Å; A532-E535 PolarHBondContact O-N 2.85Å; R533-E535 VanDerWaalsContact C-N 3.28Å; R533-E535 PolarHBondContact O-N 3.37Å; E535-T538 PolarHBondContact O-N 2.81Å; E535-E539 PolarHBondContact O-N 2.55Å
536	Q	90.8	Very high	91.1	Very high	133 Å²	133	97 Å²	97	62%	0.621	46%	0.459	S	S	*	.	H	α-helix	trans	-65.7	-46.5	175	-176	178.3	-6.4	0	0	112.6	A532 R533 T538 E539 L540	A532-Q536 WeakPolarHBondContact O-CB 3.28Å; A532-Q536 PolarHBondContact O-N 3.25Å; R533-Q536 PolarHBondContact O-N 2.95Å; Q536-T538 VanDerWaalsContact C-N 3.3Å; Q536-T538 PolarHBondContact O-N 2.92Å; Q536-E539 PolarHBondContact O-N 3.41Å; Q536-L540 HydrophobicContact CG-CD1 4.32Å; Q536-L540 WeakPolarHBondContact O-CG 3.35Å; Q536-L540 PolarHBondContact O-N 3.15Å
537	E	90.6	Very high	91.2	Very high	74 Å²	74	99 Å²	99	35%	0.346	47%	0.466	S	S	.	.	H	α-helix	trans	-61	-39.7	176.5	-72.5	177.8	179.1	0	0	111.2	R533 L541	R533-E537 HydrophobicContact CG-CG 4.48Å; R533-E537 IonicContact CZ-OE1 2.67Å; R533-E537 IonicContact NE-OE1 3.98Å; R533-E537 PolarHBondContact NE-OE1 3.45Å; R533-E537 IonicContact NH2-OE1 3.84Å; R533-E537 PolarHBondContact NH2-OE1 2.89Å; R533-E537 IonicContact NH2-OE2 3.65Å; R533-E537 WeakPolarHBondContact O-CG 3.33Å; R533-E537 PolarHBondContact O-N 3.31Å; E537-L541 WeakPolarHBondContact O-CG 3.37Å; E537-L541 PolarHBondContact O-N 3.13Å; E537-L541 VanDerWaalsContact O-N 3.12Å
538	T	92.4	Very high	91.3	Very high	60 Å²	60	103.4 Å²	103.4	37%	0.368	47%	0.47	S	S	.	.	H	α-helix	trans	-67.5	-42	176.3	-57.8	0	0	0	0	112.2	Y534 E535 Q536 L541 R542	Y534-T538 WeakPolarHBondContact O-CB 3.05Å; Y534-T538 PolarHBondContact O-N 3.09Å; Y534-T538 PolarHBondContact O-OG1 3.46Å; E535-T538 PolarHBondContact O-N 2.81Å; Q536-T538 VanDerWaalsContact C-N 3.3Å; Q536-T538 PolarHBondContact O-N 2.92Å; T538-L541 PolarHBondContact O-N 3.32Å; T538-R542 WeakPolarHBondContact O-CG 3.43Å; T538-R542 PolarHBondContact O-N 3.12Å
539	E	93	Very high	91.3	Very high	58 Å²	58	103.7 Å²	103.7	27%	0.271	47%	0.471	S	S	.	.	H	α-helix	trans	-71.3	-32.5	179.2	-169.4	57.9	-145.8	0	0	112.3	E535 Q536 R542 Q543 R546	E535-E539 PolarHBondContact O-N 2.55Å; Q536-E539 PolarHBondContact O-N 3.41Å; E539-R542 PolarHBondContact O-N 3.04Å; E539-R542 WeakPolarHBondContact OE2-CD 3.5Å; E539-R542 IonicContact OE2-CZ 2.78Å; E539-R542 IonicContact OE2-NE 3.27Å; E539-R542 IonicContact OE2-NH1 3.54Å; E539-R542 PolarHBondContact OE2-NH1 2.97Å; E539-Q543 VanDerWaalsContact O-CG 3.3Å; E539-Q543 WeakPolarHBondContact O-CG 3.37Å; E539-Q543 PolarHBondContact O-N 2.88Å; E539-R546 IonicContact OE1-NH2 3.2Å; E539-R546 PolarHBondContact OE1-NH2 3.37Å
540	L	92.8	Very high	91.5	Very high	98 Å²	98	104.5 Å²	104.5	51%	0.513	48%	0.48	S	S	.	.	H	α-helix	trans	-60.9	-44.7	169.2	-73.5	169.3	0	0	0	111.6	Q536 Q543 E544	Q536-L540 HydrophobicContact CG-CD1 4.32Å; Q536-L540 WeakPolarHBondContact O-CG 3.35Å; Q536-L540 PolarHBondContact O-N 3.15Å; L540-Q543 PolarHBondContact O-N 2.86Å; L540-E544 PolarHBondContact O-N 3.42Å
541	L	93.1	Very high	91.7	Very high	117 Å²	117	102.6 Å²	102.6	61%	0.613	47%	0.473	S	S	*	.	H	α-helix	trans	-63.5	-39.4	174.9	-71.6	169.9	0	0	0	112.4	E537 T538 E544 L545	E537-L541 WeakPolarHBondContact O-CG 3.37Å; E537-L541 PolarHBondContact O-N 3.13Å; E537-L541 VanDerWaalsContact O-N 3.12Å; T538-L541 PolarHBondContact O-N 3.32Å; L541-E544 PolarHBondContact O-N 3.04Å; L541-L545 WeakPolarHBondContact O-CB 3.25Å; L541-L545 VanDerWaalsContact O-CG 3.32Å; L541-L545 WeakPolarHBondContact O-CG 3.45Å; L541-L545 PolarHBondContact O-N 3.03Å
542	R	92.9	Very high	91.8	Very high	125 Å²	125	101 Å²	101	47%	0.472	48%	0.475	S	S	.	.	H	α-helix	trans	-65.1	-36.7	173.8	-71.9	167.8	-174.7	154.4	5.2	112.8	T538 E539 R546	T538-R542 WeakPolarHBondContact O-CG 3.43Å; T538-R542 PolarHBondContact O-N 3.12Å; E539-R542 PolarHBondContact O-N 3.04Å; E539-R542 WeakPolarHBondContact OE2-CD 3.5Å; E539-R542 IonicContact OE2-CZ 2.78Å; E539-R542 IonicContact OE2-NE 3.27Å; E539-R542 IonicContact OE2-NH1 3.54Å; E539-R542 PolarHBondContact OE2-NH1 2.97Å; R542-R546 VanDerWaalsContact O-CB 3.26Å; R542-R546 WeakPolarHBondContact O-CB 3.46Å; R542-R546 PolarHBondContact O-N 2.95Å
543	Q	91.9	Very high	91.8	Very high	100 Å²	100	104.6 Å²	104.6	47%	0.467	48%	0.483	S	S	.	.	H	α-helix	trans	-67.7	-42.1	176.6	-74	174	30.5	0	0	111.4	E539 L540 R546 K547	E539-Q543 VanDerWaalsContact O-CG 3.3Å; E539-Q543 WeakPolarHBondContact O-CG 3.37Å; E539-Q543 PolarHBondContact O-N 2.88Å; L540-Q543 PolarHBondContact O-N 2.86Å; Q543-R546 PolarHBondContact O-N 2.98Å; Q543-K547 VanDerWaalsContact O-CB 3.32Å; Q543-K547 WeakPolarHBondContact O-CB 3.35Å; Q543-K547 PolarHBondContact O-N 2.95Å
544	E	93.1	Very high	92	Very high	69 Å²	69	103.6 Å²	103.6	32%	0.322	48%	0.479	S	S	.	.	H	α-helix	trans	-67.2	-37.7	174.9	178	60.9	-171	0	0	112.1	L540 L541 K547 R548	L540-E544 PolarHBondContact O-N 3.42Å; L541-E544 PolarHBondContact O-N 3.04Å; E544-K547 IonicContact OE2-NZ 3.45Å; E544-R548 VanDerWaalsContact O-CG 3.27Å; E544-R548 WeakPolarHBondContact O-CG 3.43Å; E544-R548 PolarHBondContact O-N 3.41Å; E544-R548 IonicContact OE1-CZ 2.78Å; E544-R548 IonicContact OE1-NE 3.41Å; E544-R548 PolarHBondContact OE1-NE 3.32Å; E544-R548 IonicContact OE1-NH2 3.81Å; E544-R548 PolarHBondContact OE1-NH2 3.1Å
545	L	92.9	Very high	92	Very high	96 Å²	96	103.8 Å²	103.8	50%	0.503	48%	0.482	S	S	.	.	H	α-helix	trans	-61.8	-51.8	170.7	-75.5	169.5	0	0	0	111.6	L541 K547 R548 E549	L541-L545 WeakPolarHBondContact O-CB 3.25Å; L541-L545 VanDerWaalsContact O-CG 3.32Å; L541-L545 WeakPolarHBondContact O-CG 3.45Å; L541-L545 PolarHBondContact O-N 3.03Å; L545-K547 VanDerWaalsContact C-N 3.25Å; L545-K547 PolarHBondContact O-N 2.77Å; L545-R548 CarbonylContact O-C 3.52Å; L545-R548 WeakPolarHBondContact O-CA 3.4Å; L545-R548 WeakPolarHBondContact O-CB 3.23Å; L545-R548 PolarHBondContact O-N 3.11Å; L545-E549 WeakPolarHBondContact O-CG 3.34Å; L545-E549 PolarHBondContact O-N 2.95Å
546	R	92.1	Very high	92.1	Very high	129 Å²	129	104.8 Å²	104.8	49%	0.487	49%	0.485	S	S	.	.	H	α-helix	trans	-57.9	-37.5	178.6	-167.1	-173.8	-53.4	142.9	11.3	112.4	E539 R542 Q543 E549 V550	E539-R546 IonicContact OE1-NH2 3.2Å; E539-R546 PolarHBondContact OE1-NH2 3.37Å; R542-R546 VanDerWaalsContact O-CB 3.26Å; R542-R546 WeakPolarHBondContact O-CB 3.46Å; R542-R546 PolarHBondContact O-N 2.95Å; Q543-R546 PolarHBondContact O-N 2.98Å; R546-E549 WeakPolarHBondContact CA-OE2 3.27Å; R546-V550 WeakPolarHBondContact O-CG2 3.49Å; R546-V550 PolarHBondContact O-N 3.46Å
547	K	91.6	Very high	92.1	Very high	123 Å²	123	103.6 Å²	103.6	54%	0.535	48%	0.482	S	S	.	.	H	α-helix	trans	-64.9	-45.8	173.8	-178.8	-174.9	169	-162.1	0	111.6	Q543 E544 L545 V550 D551	Q543-K547 VanDerWaalsContact O-CB 3.32Å; Q543-K547 WeakPolarHBondContact O-CB 3.35Å; Q543-K547 PolarHBondContact O-N 2.95Å; E544-K547 IonicContact OE2-NZ 3.45Å; L545-K547 VanDerWaalsContact C-N 3.25Å; L545-K547 PolarHBondContact O-N 2.77Å; K547-V550 PolarHBondContact O-N 3.39Å; K547-D551 WeakPolarHBondContact O-CB 3.36Å; K547-D551 PolarHBondContact O-N 3.02Å
548	R	91.7	Very high	92.1	Very high	150 Å²	150	104.9 Å²	104.9	57%	0.566	49%	0.488	S	S	*	.	H	α-helix	trans	-64.6	-37.7	176	-70.4	170.5	-170.9	-170.6	5.3	112.4	E544 L545 D551 N552	E544-R548 VanDerWaalsContact O-CG 3.27Å; E544-R548 WeakPolarHBondContact O-CG 3.43Å; E544-R548 PolarHBondContact O-N 3.41Å; E544-R548 IonicContact OE1-CZ 2.78Å; E544-R548 IonicContact OE1-NE 3.41Å; E544-R548 PolarHBondContact OE1-NE 3.32Å; E544-R548 IonicContact OE1-NH2 3.81Å; E544-R548 PolarHBondContact OE1-NH2 3.1Å; L545-R548 CarbonylContact O-C 3.52Å; L545-R548 WeakPolarHBondContact O-CA 3.4Å; L545-R548 WeakPolarHBondContact O-CB 3.23Å; L545-R548 PolarHBondContact O-N 3.11Å; R548-D551 PolarHBondContact O-N 2.78Å; R548-N552 VanDerWaalsContact O-CB 3.28Å; R548-N552 WeakPolarHBondContact O-CB 3.13Å; R548-N552 PolarHBondContact O-N 2.81Å
549	E	92.3	Very high	91.9	Very high	117 Å²	117	109.3 Å²	109.3	55%	0.547	50%	0.498	S	S	.	.	H	α-helix	trans	-59.9	-53	173.4	-72.4	166.3	166.8	0	0	110.3	L545 R546 D551 N552 E553	L545-E549 WeakPolarHBondContact O-CG 3.34Å; L545-E549 PolarHBondContact O-N 2.95Å; R546-E549 WeakPolarHBondContact CA-OE2 3.27Å; E549-D551 PolarHBondContact O-N 2.72Å; E549-N552 WeakPolarHBondContact O-CA 3.3Å; E549-N552 WeakPolarHBondContact O-CB 3.47Å; E549-N552 PolarHBondContact O-N 2.98Å; E549-E553 WeakPolarHBondContact O-CG 3.39Å; E549-E553 PolarHBondContact O-N 3.43Å
550	V	92.6	Very high	91.9	Very high	83 Å²	83	110.3 Å²	110.3	50%	0.503	50%	0.503	S	S	.	.	H	α-helix	trans	-60.2	-42.3	176.4	170.6	0	0	0	0	112.3	R546 K547 N552 E553 R554	R546-V550 WeakPolarHBondContact O-CG2 3.49Å; R546-V550 PolarHBondContact O-N 3.46Å; K547-V550 PolarHBondContact O-N 3.39Å; V550-N552 PolarHBondContact O-N 2.83Å; V550-E553 PolarHBondContact O-N 2.66Å; V550-R554 VanDerWaalsContact O-CB 3.28Å; V550-R554 WeakPolarHBondContact O-CB 3.38Å; V550-R554 PolarHBondContact O-N 2.83Å
551	D	91.6	Very high	91.7	Very high	61 Å²	61	111.6 Å²	111.6	33%	0.326	51%	0.508	S	S	.	.	H	α-helix	trans	-64.6	-27	175.2	-89.8	-39.6	0	0	0	112.9	K547 R548 E549 R554 K555	K547-D551 WeakPolarHBondContact O-CB 3.36Å; K547-D551 PolarHBondContact O-N 3.02Å; R548-D551 PolarHBondContact O-N 2.78Å; E549-D551 PolarHBondContact O-N 2.72Å; D551-R554 IonicContact OD1-NH1 2.67Å; D551-K555 WeakPolarHBondContact O-CD 3.43Å; D551-K555 VanDerWaalsContact O-CG 3.27Å; D551-K555 WeakPolarHBondContact O-CG 3.14Å; D551-K555 PolarHBondContact O-N 3.02Å
552	N	91.1	Very high	91.5	Very high	114 Å²	114	115.1 Å²	115.1	61%	0.61	51%	0.513	S	S	*	.	H	α-helix	trans	-83.3	-41.5	177.8	-153.8	29.5	0	0	0	111.4	R548 E549 V550 R554 K555 K556	R548-N552 VanDerWaalsContact O-CB 3.28Å; R548-N552 WeakPolarHBondContact O-CB 3.13Å; R548-N552 PolarHBondContact O-N 2.81Å; E549-N552 WeakPolarHBondContact O-CA 3.3Å; E549-N552 WeakPolarHBondContact O-CB 3.47Å; E549-N552 PolarHBondContact O-N 2.98Å; V550-N552 PolarHBondContact O-N 2.83Å; N552-R554 VanDerWaalsContact C-N 3.33Å; N552-K555 PolarHBondContact O-N 3.27Å; N552-K556 WeakPolarHBondContact O-CB 3.25Å; N552-K556 PolarHBondContact O-N 3.33Å
553	E	92	Very high	91.3	Very high	124 Å²	124	114.2 Å²	114.2	58%	0.579	51%	0.514	S	S	*	.	H	α-helix	trans	-59.8	-42.4	169.7	-72	-174.8	155.6	0	0	111.4	E549 V550 K555 K556 L557	E549-E553 WeakPolarHBondContact O-CG 3.39Å; E549-E553 PolarHBondContact O-N 3.43Å; V550-E553 PolarHBondContact O-N 2.66Å; E553-K555 PolarHBondContact O-N 2.91Å; E553-K556 WeakPolarHBondContact O-CB 3.28Å; E553-K556 PolarHBondContact O-N 2.8Å; E553-L557 WeakPolarHBondContact O-CB 3.31Å; E553-L557 WeakPolarHBondContact O-CG 3.36Å; E553-L557 PolarHBondContact O-N 2.78Å
554	R	91.7	Very high	91.3	Very high	124 Å²	124	115.2 Å²	115.2	47%	0.468	52%	0.517	S	S	.	.	H	α-helix	trans	-59.9	-46.7	176.9	-155.4	-162.5	95.1	-135.3	-0.2	111.6	V550 D551 N552 K556 L557 E558	V550-R554 VanDerWaalsContact O-CB 3.28Å; V550-R554 WeakPolarHBondContact O-CB 3.38Å; V550-R554 PolarHBondContact O-N 2.83Å; D551-R554 IonicContact OD1-NH1 2.67Å; N552-R554 VanDerWaalsContact C-N 3.33Å; R554-K556 VanDerWaalsContact C-N 3.34Å; R554-K556 PolarHBondContact O-N 2.91Å; R554-L557 PolarHBondContact O-N 3.42Å; R554-E558 IonicContact CZ-OE1 2.9Å; R554-E558 IonicContact NE-OE1 3.9Å; R554-E558 PolarHBondContact NE-OE1 2.8Å; R554-E558 IonicContact NH2-OE1 3.2Å; R554-E558 PolarHBondContact NH2-OE1 2.87Å; R554-E558 IonicContact NH2-OE2 2.68Å; R554-E558 PolarHBondContact NH2-OE2 2.87Å; R554-E558 WeakPolarHBondContact O-CB 3.2Å; R554-E558 VanDerWaalsContact O-CG 3.29Å; R554-E558 WeakPolarHBondContact O-CG 3.28Å; R554-E558 PolarHBondContact O-N 3.45Å
555	K	89.9	Confident	91.1	Very high	123 Å²	123	117.1 Å²	117.1	54%	0.535	53%	0.526	S	S	.	.	H	α-helix	trans	-62.9	-39.2	174.9	-73.5	167.7	-173.3	171	0	112.2	D551 N552 E553 W559	D551-K555 WeakPolarHBondContact O-CD 3.43Å; D551-K555 VanDerWaalsContact O-CG 3.27Å; D551-K555 WeakPolarHBondContact O-CG 3.14Å; D551-K555 PolarHBondContact O-N 3.02Å; N552-K555 PolarHBondContact O-N 3.27Å; E553-K555 PolarHBondContact O-N 2.91Å; K555-W559 WeakPolarHBondContact O-CB 3.37Å; K555-W559 PolarHBondContact O-N 3.38Å
556	K	93.3	Very high	91	Very high	123 Å²	123	115.2 Å²	115.2	54%	0.535	52%	0.524	S	S	.	.	H	α-helix	trans	-63.4	-46.8	176	-177.4	-175.7	163.8	-173	0	111.1	N552 E553 R554 W559 E560	N552-K556 WeakPolarHBondContact O-CB 3.25Å; N552-K556 PolarHBondContact O-N 3.33Å; E553-K556 WeakPolarHBondContact O-CB 3.28Å; E553-K556 PolarHBondContact O-N 2.8Å; R554-K556 VanDerWaalsContact C-N 3.34Å; R554-K556 PolarHBondContact O-N 2.91Å; K556-W559 WeakPolarHBondContact O-CB 3.41Å; K556-W559 PolarHBondContact O-N 3.21Å; K556-W559 VanDerWaalsContact O-N 3.16Å; K556-E560 WeakPolarHBondContact CE-OE1 3.45Å; K556-E560 HydrophobicContact CG-CG 4.39Å; K556-E560 IonicContact NZ-OE1 3.36Å; K556-E560 PolarHBondContact NZ-OE1 2.97Å; K556-E560 WeakPolarHBondContact O-CG 3.46Å; K556-E560 PolarHBondContact O-N 3.07Å
557	L	90.9	Very high	90.9	Very high	108 Å²	108	115.2 Å²	115.2	57%	0.565	53%	0.53	S	S	*	.	H	α-helix	trans	-66.2	-39.6	177.5	-70.5	168.3	0	0	0	112.3	E553 R554 W559 M561	E553-L557 WeakPolarHBondContact O-CB 3.31Å; E553-L557 WeakPolarHBondContact O-CG 3.36Å; E553-L557 PolarHBondContact O-N 2.78Å; R554-L557 PolarHBondContact O-N 3.42Å; L557-W559 VanDerWaalsContact C-N 3.25Å; L557-W559 PolarHBondContact O-N 2.97Å; L557-M561 WeakPolarHBondContact O-CB 3.39Å; L557-M561 PolarHBondContact O-N 2.68Å
558	E	90.6	Very high	90.8	Very high	100 Å²	100	113.1 Å²	113.1	47%	0.467	52%	0.522	S	S	.	.	H	α-helix	trans	-59	-37.1	170.9	-77.1	171	-172	0	0	111.7	R554 R562	R554-E558 IonicContact CZ-OE1 2.9Å; R554-E558 IonicContact NE-OE1 3.9Å; R554-E558 PolarHBondContact NE-OE1 2.8Å; R554-E558 IonicContact NH2-OE1 3.2Å; R554-E558 PolarHBondContact NH2-OE1 2.87Å; R554-E558 IonicContact NH2-OE2 2.68Å; R554-E558 PolarHBondContact NH2-OE2 2.87Å; R554-E558 WeakPolarHBondContact O-CB 3.2Å; R554-E558 VanDerWaalsContact O-CG 3.29Å; R554-E558 WeakPolarHBondContact O-CG 3.28Å; R554-E558 PolarHBondContact O-N 3.45Å; E558-R562 VanDerWaalsContact O-CB 3.3Å; E558-R562 WeakPolarHBondContact O-CB 3.4Å; E558-R562 PolarHBondContact O-N 3.18Å
559	W	89.4	Confident	90.5	Very high	153 Å²	153	110.9 Å²	110.9	58%	0.58	52%	0.519	S	S	*	.	H	α-helix	trans	-74.6	-50.4	177.5	-174.3	89.7	0	0	0	112.5	K555 K556 L557 M561 R562 E563	K555-W559 WeakPolarHBondContact O-CB 3.37Å; K555-W559 PolarHBondContact O-N 3.38Å; K556-W559 WeakPolarHBondContact O-CB 3.41Å; K556-W559 PolarHBondContact O-N 3.21Å; K556-W559 VanDerWaalsContact O-N 3.16Å; L557-W559 VanDerWaalsContact C-N 3.25Å; L557-W559 PolarHBondContact O-N 2.97Å; W559-M561 VanDerWaalsContact C-N 3.32Å; W559-M561 PolarHBondContact O-N 3.49Å; W559-R562 WeakPolarHBondContact O-CB 3.31Å; W559-R562 PolarHBondContact O-N 2.8Å; W559-R562 VanDerWaalsContact O-N 3.09Å; W559-E563 VanDerWaalsContact CH2-CD 3.42Å; W559-E563 VanDerWaalsContact CH2-OE1 3.25Å; W559-E563 WeakPolarHBondContact CH2-OE1 3.38Å; W559-E563 VanDerWaalsContact CH2-OE2 3.3Å; W559-E563 WeakPolarHBondContact CH2-OE2 3.43Å; W559-E563 WeakPolarHBondContact CZ3-OE2 3.47Å; W559-E563 PolarHBondContact O-N 3.32Å
560	E	91.6	Very high	90.4	Very high	79 Å²	79	114 Å²	114	37%	0.369	53%	0.525	S	S	.	.	H	α-helix	trans	-60	-40.1	177.7	-73.3	178.3	156.5	0	0	111.6	K556 R562 E563 K564	K556-E560 WeakPolarHBondContact CE-OE1 3.45Å; K556-E560 HydrophobicContact CG-CG 4.39Å; K556-E560 IonicContact NZ-OE1 3.36Å; K556-E560 PolarHBondContact NZ-OE1 2.97Å; K556-E560 WeakPolarHBondContact O-CG 3.46Å; K556-E560 PolarHBondContact O-N 3.07Å; E560-R562 VanDerWaalsContact C-N 3.33Å; E560-R562 PolarHBondContact O-N 3.31Å; E560-E563 PolarHBondContact O-N 2.82Å; E560-K564 WeakPolarHBondContact O-CB 3.22Å; E560-K564 PolarHBondContact O-N 2.8Å
561	M	89.5	Confident	90.2	Very high	125 Å²	125	116.4 Å²	116.4	62%	0.616	53%	0.529	S	S	*	.	H	α-helix	trans	-65.8	-36.4	175.9	-170.6	176.1	-170.5	0	0	112	L557 W559 Q565	L557-M561 WeakPolarHBondContact O-CB 3.39Å; L557-M561 PolarHBondContact O-N 2.68Å; W559-M561 VanDerWaalsContact C-N 3.32Å; W559-M561 PolarHBondContact O-N 3.49Å; M561-Q565 WeakPolarHBondContact O-CB 3.48Å; M561-Q565 VanDerWaalsContact O-CG 3.27Å; M561-Q565 WeakPolarHBondContact O-CG 3.45Å; M561-Q565 PolarHBondContact O-N 2.83Å
562	R	89.5	Confident	90	Very high	192 Å²	192	120.1 Å²	120.1	73%	0.725	54%	0.539	S	S	*	.	H	α-helix	trans	-73.8	-39.4	177.6	-174.7	176.4	-175.3	159.5	2.3	112.3	E558 W559 E560 Q565 A566	E558-R562 VanDerWaalsContact O-CB 3.3Å; E558-R562 WeakPolarHBondContact O-CB 3.4Å; E558-R562 PolarHBondContact O-N 3.18Å; W559-R562 WeakPolarHBondContact O-CB 3.31Å; W559-R562 PolarHBondContact O-N 2.8Å; W559-R562 VanDerWaalsContact O-N 3.09Å; E560-R562 VanDerWaalsContact C-N 3.33Å; E560-R562 PolarHBondContact O-N 3.31Å; R562-Q565 PolarHBondContact O-N 3.15Å; R562-A566 PolarHBondContact O-N 2.93Å; R562-A566 VanDerWaalsContact O-N 3.09Å
563	E	87.1	Confident	89.8	Confident	106 Å²	106	120 Å²	120	50%	0.495	53%	0.534	S	S	.	.	H	α-helix	trans	-61.8	-50.1	173	-177.1	172.9	-122.2	0	0	110.3	W559 E560 Q565 A566 E567	W559-E563 VanDerWaalsContact CH2-CD 3.42Å; W559-E563 VanDerWaalsContact CH2-OE1 3.25Å; W559-E563 WeakPolarHBondContact CH2-OE1 3.38Å; W559-E563 VanDerWaalsContact CH2-OE2 3.3Å; W559-E563 WeakPolarHBondContact CH2-OE2 3.43Å; W559-E563 WeakPolarHBondContact CZ3-OE2 3.47Å; W559-E563 PolarHBondContact O-N 3.32Å; E560-E563 PolarHBondContact O-N 2.82Å; E563-Q565 VanDerWaalsContact C-N 3.32Å; E563-Q565 PolarHBondContact O-N 2.84Å; E563-A566 CarbonylContact O-C 3.56Å; E563-A566 WeakPolarHBondContact O-CA 3.32Å; E563-A566 WeakPolarHBondContact O-CB 3.35Å; E563-A566 PolarHBondContact O-N 3.2Å; E563-E567 PolarHBondContact O-N 2.63Å
564	K	92.2	Very high	89.7	Confident	121 Å²	121	120.1 Å²	120.1	53%	0.526	54%	0.535	S	S	.	.	H	α-helix	trans	-58.6	-40	176.1	-175.3	179.8	176.2	-170.1	0	112.8	E560 A566 E567 E568	E560-K564 WeakPolarHBondContact O-CB 3.22Å; E560-K564 PolarHBondContact O-N 2.8Å; K564-A566 VanDerWaalsContact C-N 3.31Å; K564-A566 PolarHBondContact O-N 3.12Å; K564-E567 PolarHBondContact O-N 2.72Å; K564-E568 WeakPolarHBondContact CE-OE1 3.43Å; K564-E568 HydrophobicContact CG-CG 4.5Å; K564-E568 IonicContact NZ-OE1 2.64Å; K564-E568 WeakPolarHBondContact O-CB 3.49Å; K564-E568 WeakPolarHBondContact O-CG 3.35Å; K564-E568 PolarHBondContact O-N 3.16Å
565	Q	90.4	Very high	89.4	Confident	109 Å²	109	118.4 Å²	118.4	51%	0.509	53%	0.532	S	S	.	.	H	α-helix	trans	-63.5	-36.6	174.9	-78.7	175.2	9	0	0	112.6	M561 R562 E563 M569	M561-Q565 WeakPolarHBondContact O-CB 3.48Å; M561-Q565 VanDerWaalsContact O-CG 3.27Å; M561-Q565 WeakPolarHBondContact O-CG 3.45Å; M561-Q565 PolarHBondContact O-N 2.83Å; R562-Q565 PolarHBondContact O-N 3.15Å; E563-Q565 VanDerWaalsContact C-N 3.32Å; E563-Q565 PolarHBondContact O-N 2.84Å; Q565-M569 WeakPolarHBondContact O-CB 3.46Å; Q565-M569 PolarHBondContact O-N 3.08Å
566	A	90.3	Very high	89.3	Confident	56 Å²	56	116.8 Å²	116.8	46%	0.463	53%	0.533	S	S	.	.	H	α-helix	trans	-72.5	-37.4	175	0	0	0	0	0	112.4	R562 E563 K564 M569 R570	R562-A566 PolarHBondContact O-N 2.93Å; R562-A566 VanDerWaalsContact O-N 3.09Å; E563-A566 CarbonylContact O-C 3.56Å; E563-A566 WeakPolarHBondContact O-CA 3.32Å; E563-A566 WeakPolarHBondContact O-CB 3.35Å; E563-A566 PolarHBondContact O-N 3.2Å; K564-A566 VanDerWaalsContact C-N 3.31Å; K564-A566 PolarHBondContact O-N 3.12Å; A566-M569 PolarHBondContact O-N 3.39Å; A566-R570 WeakPolarHBondContact O-CB 3.44Å; A566-R570 PolarHBondContact O-N 3.39Å
567	E	90.3	Very high	89	Confident	129 Å²	129	117.3 Å²	117.3	60%	0.603	54%	0.539	S	S	*	.	H	α-helix	trans	-65.8	-46.5	173.8	-167.5	-168.3	-173.1	0	0	111.3	E563 K564 M569 R570 K571	E563-E567 PolarHBondContact O-N 2.63Å; K564-E567 PolarHBondContact O-N 2.72Å; E567-M569 VanDerWaalsContact C-N 3.28Å; E567-M569 PolarHBondContact O-N 3.33Å; E567-R570 PolarHBondContact O-N 2.66Å; E567-K571 VanDerWaalsContact O-CB 3.23Å; E567-K571 WeakPolarHBondContact O-CB 3.49Å; E567-K571 PolarHBondContact O-N 2.98Å
568	E	89.2	Confident	88.8	Confident	79 Å²	79	120.4 Å²	120.4	37%	0.369	54%	0.543	S	S	.	.	H	α-helix	trans	-62.6	-34.7	175.3	-75.4	-171.3	-157.2	0	0	112.5	K564 R572	K564-E568 WeakPolarHBondContact CE-OE1 3.43Å; K564-E568 HydrophobicContact CG-CG 4.5Å; K564-E568 IonicContact NZ-OE1 2.64Å; K564-E568 WeakPolarHBondContact O-CB 3.49Å; K564-E568 WeakPolarHBondContact O-CG 3.35Å; K564-E568 PolarHBondContact O-N 3.16Å; E568-R572 WeakPolarHBondContact O-CB 3.29Å; E568-R572 VanDerWaalsContact O-CG 3.27Å; E568-R572 WeakPolarHBondContact O-CG 3.34Å; E568-R572 PolarHBondContact O-N 3.11Å; E568-R572 PolarHBondContact O-NE 3.29Å; E568-R572 IonicContact OE2-CZ 2.7Å; E568-R572 IonicContact OE2-NH2 3.57Å; E568-R572 PolarHBondContact OE2-NH2 3.34Å
569	M	86	Confident	88.7	Confident	103 Å²	103	122.8 Å²	122.8	51%	0.507	55%	0.548	S	S	.	.	H	α-helix	trans	-64.8	-54.5	174.1	-173.7	178.1	-63.1	0	0	110.6	Q565 A566 E567 K571 R572 E573	Q565-M569 WeakPolarHBondContact O-CB 3.46Å; Q565-M569 PolarHBondContact O-N 3.08Å; A566-M569 PolarHBondContact O-N 3.39Å; E567-M569 VanDerWaalsContact C-N 3.28Å; E567-M569 PolarHBondContact O-N 3.33Å; M569-K571 VanDerWaalsContact C-N 3.28Å; M569-K571 PolarHBondContact O-N 3.15Å; M569-R572 PolarHBondContact O-N 3.12Å; M569-R572 VanDerWaalsContact O-N 3.12Å; M569-E573 WeakPolarHBondContact O-CG 3.35Å; M569-E573 PolarHBondContact O-N 3.24Å
570	R	89	Confident	88.6	Confident	181 Å²	181	120.2 Å²	120.2	68%	0.683	54%	0.542	S	S	*	.	H	α-helix	trans	-55.1	-41.9	175.7	176.8	-177.2	-69.9	-121.2	-1	112	A566 E567 E573 E574	A566-R570 WeakPolarHBondContact O-CB 3.44Å; A566-R570 PolarHBondContact O-N 3.39Å; E567-R570 PolarHBondContact O-N 2.66Å; R570-E573 PolarHBondContact O-N 3.05Å; R570-E574 WeakPolarHBondContact O-CB 3.33Å; R570-E574 PolarHBondContact O-N 3.19Å
571	K	88.6	Confident	88.4	Confident	135 Å²	135	122.4 Å²	122.4	59%	0.587	55%	0.552	S	S	*	*	H	α-helix	trans	-69.1	-35.9	-180	-174.4	171.9	-178.2	172.6	0	112.3	E567 M569 E575	E567-K571 VanDerWaalsContact O-CB 3.23Å; E567-K571 WeakPolarHBondContact O-CB 3.49Å; E567-K571 PolarHBondContact O-N 2.98Å; M569-K571 VanDerWaalsContact C-N 3.28Å; M569-K571 PolarHBondContact O-N 3.15Å; K571-E575 VanDerWaalsContact O-CB 3.31Å; K571-E575 WeakPolarHBondContact O-CB 3.45Å; K571-E575 PolarHBondContact O-N 3.25Å
572	R	87.7	Confident	88.2	Confident	139 Å²	139	120 Å²	120	53%	0.525	55%	0.545	S	S	.	.	H	α-helix	trans	-66.8	-39.9	171.7	-74.3	179.3	-127.3	125.5	-3.5	111.4	E568 M569 E575 T576	E568-R572 WeakPolarHBondContact O-CB 3.29Å; E568-R572 VanDerWaalsContact O-CG 3.27Å; E568-R572 WeakPolarHBondContact O-CG 3.34Å; E568-R572 PolarHBondContact O-N 3.11Å; E568-R572 PolarHBondContact O-NE 3.29Å; E568-R572 IonicContact OE2-CZ 2.7Å; E568-R572 IonicContact OE2-NH2 3.57Å; E568-R572 PolarHBondContact OE2-NH2 3.34Å; M569-R572 PolarHBondContact O-N 3.12Å; M569-R572 VanDerWaalsContact O-N 3.12Å; R572-E575 PolarHBondContact O-N 3.43Å; R572-T576 WeakPolarHBondContact O-CG2 3.44Å; R572-T576 PolarHBondContact O-N 2.9Å; R572-T576 PolarHBondContact O-OG1 3.33Å
573	E	87.5	Confident	88.1	Confident	110 Å²	110	116.8 Å²	116.8	51%	0.514	54%	0.538	S	S	.	.	H	α-helix	trans	-65	-43.5	174.2	-68.3	167	172.2	0	0	112.2	M569 R570 T576 M577	M569-E573 WeakPolarHBondContact O-CG 3.35Å; M569-E573 PolarHBondContact O-N 3.24Å; R570-E573 PolarHBondContact O-N 3.05Å; E573-T576 PolarHBondContact O-N 3.2Å; E573-T576 PolarHBondContact O-OG1 3.49Å; E573-M577 WeakPolarHBondContact O-CB 3.22Å; E573-M577 WeakPolarHBondContact O-CG 3.44Å; E573-M577 PolarHBondContact O-N 2.99Å
574	E	88.1	Confident	87.8	Confident	128 Å²	128	116.9 Å²	116.9	60%	0.598	54%	0.54	S	S	*	.	H	α-helix	trans	-64.4	-40.1	174.8	-172	-179.2	172.6	0	0	111.4	R570 R578	R570-E574 WeakPolarHBondContact O-CB 3.33Å; R570-E574 PolarHBondContact O-N 3.19Å; E574-R578 WeakPolarHBondContact O-CB 3.22Å; E574-R578 PolarHBondContact O-N 3.36Å
575	E	87.2	Confident	87.5	Confident	88 Å²	88	116.7 Å²	116.7	41%	0.411	54%	0.541	S	S	.	.	H	α-helix	trans	-69.6	-38.9	177.7	-159.2	-171	140.2	0	0	112.3	K571 R572 R578 R579	K571-E575 VanDerWaalsContact O-CB 3.31Å; K571-E575 WeakPolarHBondContact O-CB 3.45Å; K571-E575 PolarHBondContact O-N 3.25Å; R572-E575 PolarHBondContact O-N 3.43Å; E575-R578 PolarHBondContact O-N 2.94Å; E575-R579 WeakPolarHBondContact O-CB 3.29Å; E575-R579 WeakPolarHBondContact O-CD 3.46Å; E575-R579 WeakPolarHBondContact O-CG 3.41Å; E575-R579 PolarHBondContact O-N 3.08Å; E575-R579 IonicContact OE1-CZ 2.71Å; E575-R579 IonicContact OE1-NE 2.74Å; E575-R579 PolarHBondContact OE1-NE 2.93Å; E575-R579 IonicContact OE1-NH2 3.25Å; E575-R579 PolarHBondContact OE1-NH2 2.88Å
576	T	87.9	Confident	87.1	Confident	89 Å²	89	113.9 Å²	113.9	55%	0.546	53%	0.533	S	S	.	.	H	α-helix	trans	-67.7	-41.4	173.9	53.2	0	0	0	0	111.8	R572 E573 R579 H580	R572-T576 WeakPolarHBondContact O-CG2 3.44Å; R572-T576 PolarHBondContact O-N 2.9Å; R572-T576 PolarHBondContact O-OG1 3.33Å; E573-T576 PolarHBondContact O-N 3.2Å; E573-T576 PolarHBondContact O-OG1 3.49Å; T576-R579 PolarHBondContact O-N 2.87Å; T576-H580 WeakPolarHBondContact O-CB 3.28Å; T576-H580 PolarHBondContact O-N 3.39Å
577	M	85	Confident	86.8	Confident	133 Å²	133	117.1 Å²	117.1	66%	0.655	54%	0.538	S	S	*	.	H	α-helix	trans	-60.7	-43.5	172.9	-74.2	-68	-70.9	0	0	111.9	E573 H580 Q581	E573-M577 WeakPolarHBondContact O-CB 3.22Å; E573-M577 WeakPolarHBondContact O-CG 3.44Å; E573-M577 PolarHBondContact O-N 2.99Å; M577-H580 PolarHBondContact O-N 2.72Å; M577-Q581 WeakPolarHBondContact O-CB 3.35Å; M577-Q581 PolarHBondContact O-N 2.89Å
578	R	87.9	Confident	86.2	Confident	174 Å²	174	116 Å²	116	66%	0.657	53%	0.534	S	S	*	.	H	α-helix	trans	-67.7	-39.6	177.5	-176	177.2	175.5	-174.8	-1.3	112.4	E574 E575 Q581 T582	E574-R578 WeakPolarHBondContact O-CB 3.22Å; E574-R578 PolarHBondContact O-N 3.36Å; E575-R578 PolarHBondContact O-N 2.94Å; R578-Q581 PolarHBondContact O-N 3.09Å; R578-T582 WeakPolarHBondContact O-CB 3.49Å; R578-T582 PolarHBondContact O-N 3.49Å; R578-T582 PolarHBondContact O-OG1 2.77Å
579	R	87.4	Confident	85.8	Confident	149 Å²	149	115.9 Å²	115.9	56%	0.562	54%	0.536	S	S	*	.	H	α-helix	trans	-59.4	-51	172.7	-75.6	163.3	177.6	-119.6	7.7	110.1	E575 T576 Q581 T582 E583	E575-R579 WeakPolarHBondContact O-CB 3.29Å; E575-R579 WeakPolarHBondContact O-CD 3.46Å; E575-R579 WeakPolarHBondContact O-CG 3.41Å; E575-R579 PolarHBondContact O-N 3.08Å; E575-R579 IonicContact OE1-CZ 2.71Å; E575-R579 IonicContact OE1-NE 2.74Å; E575-R579 PolarHBondContact OE1-NE 2.93Å; E575-R579 IonicContact OE1-NH2 3.25Å; E575-R579 PolarHBondContact OE1-NH2 2.88Å; T576-R579 PolarHBondContact O-N 2.87Å; R579-Q581 PolarHBondContact O-N 2.88Å; R579-T582 PolarHBondContact O-N 2.77Å; R579-T582 VanDerWaalsContact O-N 3.09Å; R579-E583 WeakPolarHBondContact O-CG 3.44Å; R579-E583 PolarHBondContact O-N 3.09Å
580	H	88.9	Confident	85.6	Confident	100 Å²	100	118.4 Å²	118.4	46%	0.463	54%	0.54	S	S	.	.	H	α-helix	trans	-59.8	-42.3	178.3	-174.5	53.8	0	0	0	112.9	T576 M577 E583 M584	T576-H580 WeakPolarHBondContact O-CB 3.28Å; T576-H580 PolarHBondContact O-N 3.39Å; M577-H580 PolarHBondContact O-N 2.72Å; H580-E583 PolarHBondContact O-N 2.56Å; H580-M584 WeakPolarHBondContact O-CG 3.23Å; H580-M584 PolarHBondContact O-N 3.48Å
581	Q	86.3	Confident	85.2	Confident	124 Å²	124	115.8 Å²	115.8	58%	0.579	54%	0.536	S	S	*	.	H	α-helix	trans	-62.6	-42.6	173.3	-175.4	179.6	49.7	0	0	112.1	M577 R578 R579 M584 Q585	M577-Q581 WeakPolarHBondContact O-CB 3.35Å; M577-Q581 PolarHBondContact O-N 2.89Å; R578-Q581 PolarHBondContact O-N 3.09Å; R579-Q581 PolarHBondContact O-N 2.88Å; Q581-M584 PolarHBondContact O-N 2.93Å; Q581-Q585 WeakPolarHBondContact O-CB 3.4Å; Q581-Q585 PolarHBondContact O-N 3.41Å
582	T	86.3	Confident	84.7	Confident	76 Å²	76	114 Å²	114	47%	0.466	53%	0.53	S	S	.	.	H	α-helix	trans	-67.2	-37	178.5	-52.9	0	0	0	0	111.7	R578 R579 S586	R578-T582 WeakPolarHBondContact O-CB 3.49Å; R578-T582 PolarHBondContact O-N 3.49Å; R578-T582 PolarHBondContact O-OG1 2.77Å; R579-T582 PolarHBondContact O-N 2.77Å; R579-T582 VanDerWaalsContact O-N 3.09Å; T582-S586 VanDerWaalsContact O-CB 3.25Å; T582-S586 WeakPolarHBondContact O-CB 3.39Å; T582-S586 PolarHBondContact O-N 2.97Å
583	E	85.7	Confident	84.3	Confident	123 Å²	123	113.6 Å²	113.6	58%	0.575	53%	0.534	S	S	*	.	H	α-helix	trans	-65.5	-47.2	175.1	-74.1	168.5	175.8	0	0	111.6	R579 H580 S586 H587	R579-E583 WeakPolarHBondContact O-CG 3.44Å; R579-E583 PolarHBondContact O-N 3.09Å; H580-E583 PolarHBondContact O-N 2.56Å; E583-S586 PolarHBondContact O-N 2.93Å; E583-H587 PolarHBondContact O-N 3.3Å
584	M	82.7	Confident	83.8	Confident	108 Å²	108	112.7 Å²	112.7	53%	0.532	53%	0.532	S	S	.	.	H	α-helix	trans	-60.5	-44.9	174	-74.1	-161	-70.1	0	0	112	H580 Q581 H587 M588	H580-M584 WeakPolarHBondContact O-CG 3.23Å; H580-M584 PolarHBondContact O-N 3.48Å; Q581-M584 PolarHBondContact O-N 2.93Å; M584-H587 PolarHBondContact O-N 2.88Å; M584-M588 PolarHBondContact O-N 3.41Å
585	Q	85	Confident	83.2	Confident	118 Å²	118	112 Å²	112	55%	0.551	53%	0.531	S	S	*	.	H	α-helix	trans	-68.4	-35.6	179.2	-166.8	166.4	30.9	0	0	111.9	Q581 H587 M588 N589	Q581-Q585 WeakPolarHBondContact O-CB 3.4Å; Q581-Q585 PolarHBondContact O-N 3.41Å; Q585-H587 VanDerWaalsContact C-N 3.34Å; Q585-H587 PolarHBondContact O-N 2.93Å; Q585-M588 PolarHBondContact O-N 3.01Å; Q585-N589 WeakPolarHBondContact O-CB 3Å; Q585-N589 VanDerWaalsContact O-CG 3.27Å; Q585-N589 PolarHBondContact O-N 3.4Å; Q585-N589 PolarHBondContact O-OD1 2.9Å
586	S	82.2	Confident	82.7	Confident	50 Å²	50	112.9 Å²	112.9	35%	0.35	54%	0.537	S	S	.	.	H	α-helix	trans	-66.8	-34	172.6	-172.8	0	0	0	0	112.5	T582 E583 R590	T582-S586 VanDerWaalsContact O-CB 3.25Å; T582-S586 WeakPolarHBondContact O-CB 3.39Å; T582-S586 PolarHBondContact O-N 2.97Å; E583-S586 PolarHBondContact O-N 2.93Å; S586-R590 WeakPolarHBondContact O-CB 3.49Å; S586-R590 VanDerWaalsContact O-CG 3.26Å; S586-R590 WeakPolarHBondContact O-CG 3.29Å; S586-R590 PolarHBondContact O-N 3.36Å
587	H	83.1	Confident	82.1	Confident	124 Å²	124	115.2 Å²	115.2	57%	0.574	54%	0.536	S	S	*	.	H	α-helix	trans	-66.6	-44	171.4	-98.8	46.2	0	0	0	112.7	E583 M584 Q585 Q591	E583-H587 PolarHBondContact O-N 3.3Å; M584-H587 PolarHBondContact O-N 2.88Å; Q585-H587 VanDerWaalsContact C-N 3.34Å; Q585-H587 PolarHBondContact O-N 2.93Å; H587-Q591 WeakPolarHBondContact O-CG 3.48Å; H587-Q591 PolarHBondContact O-N 3.43Å
588	M	77.8	Confident	81.7	Confident	104 Å²	104	117 Å²	117	51%	0.512	54%	0.535	S	S	.	.	H	α-helix	trans	-57.8	-56.7	172.3	-80.9	-70.2	-62	0	0	111.1	M584 Q585 R590 Q591 E592	M584-M588 PolarHBondContact O-N 3.41Å; Q585-M588 PolarHBondContact O-N 3.01Å; M588-R590 VanDerWaalsContact C-N 3.27Å; M588-R590 PolarHBondContact O-N 3.24Å; M588-Q591 PolarHBondContact O-N 3.39Å; M588-E592 PolarHBondContact O-N 3.27Å
589	N	80.7	Confident	81.1	Confident	77 Å²	77	113.8 Å²	113.8	41%	0.412	53%	0.528	S	S	.	.	H	α-helix	trans	-58.5	-37.4	-177.1	-71.5	29.7	0	0	0	112.2	Q585 E592 E593	Q585-N589 WeakPolarHBondContact O-CB 3Å; Q585-N589 VanDerWaalsContact O-CG 3.27Å; Q585-N589 PolarHBondContact O-N 3.4Å; Q585-N589 PolarHBondContact O-OD1 2.9Å; N589-E592 PolarHBondContact O-N 2.98Å; N589-E593 WeakPolarHBondContact O-CB 3.36Å; N589-E593 WeakPolarHBondContact O-CG 3.37Å; N589-E593 PolarHBondContact O-N 3.17Å
590	R	81.5	Confident	80.3	Confident	157 Å²	157	113.3 Å²	113.3	59%	0.592	53%	0.532	S	S	*	.	H	α-helix	trans	-66.1	-39	175.1	-77.5	176.3	-177.9	-166	2.3	113	S586 M588 E592 D594	S586-R590 WeakPolarHBondContact O-CB 3.49Å; S586-R590 VanDerWaalsContact O-CG 3.26Å; S586-R590 WeakPolarHBondContact O-CG 3.29Å; S586-R590 PolarHBondContact O-N 3.36Å; M588-R590 VanDerWaalsContact C-N 3.27Å; M588-R590 PolarHBondContact O-N 3.24Å; R590-E592 VanDerWaalsContact C-N 3.34Å; R590-D594 WeakPolarHBondContact O-CB 3.48Å; R590-D594 PolarHBondContact O-N 3.32Å
591	Q	80.5	Confident	79.4	Confident	125 Å²	125	112.9 Å²	112.9	58%	0.584	53%	0.53	S	S	*	.	H	α-helix	trans	-67.6	-37	175.7	-69.4	177	34.2	0	0	111.4	H587 M588 M595	H587-Q591 WeakPolarHBondContact O-CG 3.48Å; H587-Q591 PolarHBondContact O-N 3.43Å; M588-Q591 PolarHBondContact O-N 3.39Å; Q591-M595 VanDerWaalsContact O-CB 3.3Å; Q591-M595 WeakPolarHBondContact O-CB 3.49Å; Q591-M595 PolarHBondContact O-N 3.42Å; Q591-M595 VanDerWaalsContact O-N 3.12Å
592	E	80	Confident	78.7	Confident	99 Å²	99	111.7 Å²	111.7	46%	0.463	53%	0.532	S	S	.	.	H	α-helix	trans	-68.6	-45	173.2	-68.9	-177.2	171.3	0	0	112	M588 N589 R590 M595 L596	M588-E592 PolarHBondContact O-N 3.27Å; N589-E592 PolarHBondContact O-N 2.98Å; R590-E592 VanDerWaalsContact C-N 3.34Å; E592-M595 PolarHBondContact O-N 2.95Å; E592-L596 VanDerWaalsContact O-CB 3.32Å; E592-L596 WeakPolarHBondContact O-CB 3.2Å; E592-L596 VanDerWaalsContact O-CG 3.29Å; E592-L596 WeakPolarHBondContact O-CG 3.46Å; E592-L596 PolarHBondContact O-N 3.23Å
593	E	77.7	Confident	77.8	Confident	130 Å²	130	113.7 Å²	113.7	61%	0.607	54%	0.539	S	S	*	.	H	α-helix	trans	-60.6	-47	175.4	-79.3	-175.2	138.5	0	0	111.8	N589 M595 L596 R597	N589-E593 WeakPolarHBondContact O-CB 3.36Å; N589-E593 WeakPolarHBondContact O-CG 3.37Å; N589-E593 PolarHBondContact O-N 3.17Å; E593-M595 VanDerWaalsContact C-N 3.28Å; E593-M595 PolarHBondContact O-N 3.46Å; E593-L596 PolarHBondContact O-N 2.91Å; E593-R597 WeakPolarHBondContact O-CB 3.19Å; E593-R597 PolarHBondContact O-N 2.96Å
594	D	78.7	Confident	77.2	Confident	91 Å²	91	113.7 Å²	113.7	49%	0.487	54%	0.537	S	S	.	.	H	α-helix	trans	-62.5	-35	176.1	-92.1	-25.4	0	0	0	112.2	R590 R598	R590-D594 WeakPolarHBondContact O-CB 3.48Å; R590-D594 PolarHBondContact O-N 3.32Å; D594-R598 WeakPolarHBondContact O-CD 3.3Å; D594-R598 WeakPolarHBondContact O-CG 3.4Å; D594-R598 PolarHBondContact O-N 2.82Å
595	M	74.5	Confident	76.3	Confident	114 Å²	114	115.1 Å²	115.1	56%	0.562	54%	0.544	S	S	*	.	H	α-helix	trans	-72.4	-45.1	177.5	-163.6	-169.4	-47.8	0	0	111.8	Q591 E592 E593 R598 Q599	Q591-M595 VanDerWaalsContact O-CB 3.3Å; Q591-M595 WeakPolarHBondContact O-CB 3.49Å; Q591-M595 PolarHBondContact O-N 3.42Å; Q591-M595 VanDerWaalsContact O-N 3.12Å; E592-M595 PolarHBondContact O-N 2.95Å; E593-M595 VanDerWaalsContact C-N 3.28Å; E593-M595 PolarHBondContact O-N 3.46Å; M595-R598 PolarHBondContact O-N 2.74Å; M595-Q599 WeakPolarHBondContact O-CG 3.22Å; M595-Q599 PolarHBondContact O-N 3.38Å; M595-Q599 VanDerWaalsContact O-N 3.11Å
596	L	76.1	Confident	75.4	Confident	106 Å²	106	116.1 Å²	116.1	56%	0.555	55%	0.547	S	S	*	.	H	α-helix	trans	-63.5	-42.9	175.6	-76.4	165	0	0	0	111.3	E592 E593 R598 Q599 Q600	E592-L596 VanDerWaalsContact O-CB 3.32Å; E592-L596 WeakPolarHBondContact O-CB 3.2Å; E592-L596 VanDerWaalsContact O-CG 3.29Å; E592-L596 WeakPolarHBondContact O-CG 3.46Å; E592-L596 PolarHBondContact O-N 3.23Å; E593-L596 PolarHBondContact O-N 2.91Å; L596-R598 VanDerWaalsContact C-N 3.35Å; L596-R598 PolarHBondContact O-N 3.45Å; L596-Q599 WeakPolarHBondContact O-CB 3.47Å; L596-Q599 PolarHBondContact O-N 2.78Å; L596-Q599 VanDerWaalsContact O-N 3.16Å; L596-Q600 WeakPolarHBondContact O-CB 3.49Å; L596-Q600 PolarHBondContact O-N 3.04Å
597	R	75.6	Confident	74.5	Confident	138 Å²	138	116 Å²	116	52%	0.521	55%	0.549	S	S	.	.	H	α-helix	trans	-61.4	-41.8	178.8	-170.3	-179.5	175.3	-61.2	-23	111.5	E593 Q600 E601	E593-R597 WeakPolarHBondContact O-CB 3.19Å; E593-R597 PolarHBondContact O-N 2.96Å; R597-Q600 PolarHBondContact O-N 2.96Å; R597-E601 IonicContact CZ-OE1 3.09Å; R597-E601 IonicContact NH1-OE1 2.74Å; R597-E601 PolarHBondContact NH1-OE1 3Å; R597-E601 IonicContact NH1-OE2 3.15Å; R597-E601 PolarHBondContact NH1-OE2 3.19Å; R597-E601 VanDerWaalsContact NH1-OE2 3.15Å; R597-E601 IonicContact NH2-OE1 2.96Å; R597-E601 PolarHBondContact NH2-OE1 2.93Å; R597-E601 WeakPolarHBondContact O-CG 3.41Å; R597-E601 PolarHBondContact O-N 3.35Å
598	R	76.8	Confident	73.6	Confident	169 Å²	169	115.8 Å²	115.8	64%	0.638	55%	0.548	S	S	*	.	H	α-helix	trans	-63.9	-41.7	172.9	-70.4	168.5	-166.9	-146.5	4.1	112.6	D594 M595 L596 Q600 T602	D594-R598 WeakPolarHBondContact O-CD 3.3Å; D594-R598 WeakPolarHBondContact O-CG 3.4Å; D594-R598 PolarHBondContact O-N 2.82Å; M595-R598 PolarHBondContact O-N 2.74Å; L596-R598 VanDerWaalsContact C-N 3.35Å; L596-R598 PolarHBondContact O-N 3.45Å; R598-Q600 VanDerWaalsContact C-N 3.33Å; R598-T602 WeakPolarHBondContact O-CB 3.47Å; R598-T602 PolarHBondContact O-N 2.9Å; R598-T602 VanDerWaalsContact O-N 3.08Å; R598-T602 PolarHBondContact O-OG1 2.63Å
599	Q	75	Confident	72.8	Confident	108 Å²	108	118 Å²	118	51%	0.505	56%	0.558	S	S	.	*	H	α-helix	trans	-63	-41.1	174.2	-70.8	-177.7	42.2	0	0	111.3	M595 L596 T602 L603	M595-Q599 WeakPolarHBondContact O-CG 3.22Å; M595-Q599 PolarHBondContact O-N 3.38Å; M595-Q599 VanDerWaalsContact O-N 3.11Å; L596-Q599 WeakPolarHBondContact O-CB 3.47Å; L596-Q599 PolarHBondContact O-N 2.78Å; L596-Q599 VanDerWaalsContact O-N 3.16Å; Q599-T602 WeakPolarHBondContact O-CB 3.1Å; Q599-T602 PolarHBondContact O-N 3Å; Q599-L603 WeakPolarHBondContact O-CB 3.46Å; Q599-L603 WeakPolarHBondContact O-CG 3.13Å; Q599-L603 PolarHBondContact O-N 3.35Å
600	Q	70.5	Confident	71.6	Confident	139 Å²	139	119.5 Å²	119.5	65%	0.65	57%	0.565	S	S	*	*	H	α-helix	trans	-69.8	-39.2	-179.6	-163.6	175.5	47.8	0	0	112.4	L596 R597 R598 T602 L603 F604	L596-Q600 WeakPolarHBondContact O-CB 3.49Å; L596-Q600 PolarHBondContact O-N 3.04Å; R597-Q600 PolarHBondContact O-N 2.96Å; R598-Q600 VanDerWaalsContact C-N 3.33Å; Q600-T602 VanDerWaalsContact C-N 3.33Å; Q600-L603 PolarHBondContact O-N 2.79Å; Q600-F604 VanDerWaalsContact O-CB 3.23Å; Q600-F604 WeakPolarHBondContact O-CB 3.4Å; Q600-F604 PolarHBondContact O-N 2.71Å
601	E	69.8	Low	70.5	Confident	90 Å²	90	117.3 Å²	117.3	42%	0.421	57%	0.565	S	S	.	*	H	α-helix	trans	-61.1	-42.1	170.8	-74.9	174.1	147.9	0	0	111.3	R597 F604 M605	R597-E601 IonicContact CZ-OE1 3.09Å; R597-E601 IonicContact NH1-OE1 2.74Å; R597-E601 PolarHBondContact NH1-OE1 3Å; R597-E601 IonicContact NH1-OE2 3.15Å; R597-E601 PolarHBondContact NH1-OE2 3.19Å; R597-E601 VanDerWaalsContact NH1-OE2 3.15Å; R597-E601 IonicContact NH2-OE1 2.96Å; R597-E601 PolarHBondContact NH2-OE1 2.93Å; R597-E601 WeakPolarHBondContact O-CG 3.41Å; R597-E601 PolarHBondContact O-N 3.35Å; E601-F604 PolarHBondContact O-N 3.41Å; E601-M605 PolarHBondContact O-N 2.96Å
602	T	72.7	Confident	69.3	Low	100 Å²	100	116.5 Å²	116.5	61%	0.613	57%	0.573	S	S	*	*	H	α-helix	trans	-64.3	-42.5	176.3	-51.9	0	0	0	0	112	R598 Q599 Q600 K606	R598-T602 WeakPolarHBondContact O-CB 3.47Å; R598-T602 PolarHBondContact O-N 2.9Å; R598-T602 VanDerWaalsContact O-N 3.08Å; R598-T602 PolarHBondContact O-OG1 2.63Å; Q599-T602 WeakPolarHBondContact O-CB 3.1Å; Q599-T602 PolarHBondContact O-N 3Å; Q600-T602 VanDerWaalsContact C-N 3.33Å; T602-K606 PolarHBondContact O-N 3.26Å
603	L	67.3	Low	68.1	Low	118 Å²	118	118.6 Å²	118.6	62%	0.618	59%	0.587	S	S	*	*	H	α-helix	trans	-67.3	-39.7	175.1	-77.5	165.8	0	0	0	112.1	Q599 Q600 K606 A607	Q599-L603 WeakPolarHBondContact O-CB 3.46Å; Q599-L603 WeakPolarHBondContact O-CG 3.13Å; Q599-L603 PolarHBondContact O-N 3.35Å; Q600-L603 PolarHBondContact O-N 2.79Å; L603-K606 PolarHBondContact O-N 3.32Å; L603-A607 WeakPolarHBondContact O-CB 3.35Å; L603-A607 PolarHBondContact O-N 3.15Å
604	F	73.2	Confident	66.7	Low	122 Å²	122	117.5 Å²	117.5	54%	0.535	58%	0.584	S	S	.	*	H	α-helix	trans	-66.2	-42.9	-179.5	-176.6	-95.5	0	0	0	112.2	Q600 E601 K606 A607 Q608	Q600-F604 VanDerWaalsContact O-CB 3.23Å; Q600-F604 WeakPolarHBondContact O-CB 3.4Å; Q600-F604 PolarHBondContact O-N 2.71Å; E601-F604 PolarHBondContact O-N 3.41Å; F604-K606 VanDerWaalsContact C-N 3.29Å; F604-K606 PolarHBondContact O-N 3.34Å; F604-A607 PolarHBondContact O-N 3.08Å; F604-Q608 HydrophobicContact CD1-CG 4.35Å; F604-Q608 VanDerWaalsContact CE1-CD 3.48Å; F604-Q608 HydrophobicContact CE1-CG 3.82Å; F604-Q608 HydrophobicContact CZ-CG 3.97Å; F604-Q608 PolarHBondContact O-N 3.42Å
605	M	64.1	Low	65.3	Low	138 Å²	138	120.8 Å²	120.8	68%	0.68	60%	0.602	S	S	*	*	H	α-helix	trans	-55.1	-45.7	170.6	-92.8	178.2	57.1	0	0	111.7	E601 A607 Q608 Q609	E601-M605 PolarHBondContact O-N 2.96Å; M605-A607 VanDerWaalsContact C-N 3.34Å; M605-A607 PolarHBondContact O-N 3.35Å; M605-Q608 PolarHBondContact O-N 2.81Å; M605-Q609 WeakPolarHBondContact O-CB 3.29Å; M605-Q609 PolarHBondContact O-N 3.09Å; M605-Q609 VanDerWaalsContact O-N 3.12Å
606	K	65.6	Low	64.3	Low	140 Å²	140	124.6 Å²	124.6	61%	0.609	62%	0.618	S	S	*	*	H	α-helix	trans	-68.2	-32.8	179.5	-160.4	172.6	-174.5	177.8	0	112.5	T602 L603 F604 L610	T602-K606 PolarHBondContact O-N 3.26Å; L603-K606 PolarHBondContact O-N 3.32Å; F604-K606 VanDerWaalsContact C-N 3.29Å; F604-K606 PolarHBondContact O-N 3.34Å; K606-L610 PolarHBondContact O-N 3.09Å
607	A	63.6	Low	62.6	Low	48 Å²	48	127 Å²	127	40%	0.397	63%	0.627	S	S	.	*	H	α-helix	trans	-72.5	-41.7	175.6	0	0	0	0	0	112.6	L603 F604 M605 Q609 L610 N611	L603-A607 WeakPolarHBondContact O-CB 3.35Å; L603-A607 PolarHBondContact O-N 3.15Å; F604-A607 PolarHBondContact O-N 3.08Å; M605-A607 VanDerWaalsContact C-N 3.34Å; M605-A607 PolarHBondContact O-N 3.35Å; A607-Q609 VanDerWaalsContact C-N 3.29Å; A607-Q609 PolarHBondContact O-N 2.96Å; A607-L610 PolarHBondContact O-N 3.04Å; A607-N611 PolarHBondContact O-N 3.45Å
608	Q	64.3	Low	60.9	Low	118 Å²	118	129.7 Å²	129.7	55%	0.551	65%	0.645	S	S	*	*	H	α-helix	trans	-59.9	-41.6	171.9	-81.8	-167.5	-45.9	0	0	111.6	F604 M605 L610 N611 S612	F604-Q608 HydrophobicContact CD1-CG 4.35Å; F604-Q608 VanDerWaalsContact CE1-CD 3.48Å; F604-Q608 HydrophobicContact CE1-CG 3.82Å; F604-Q608 HydrophobicContact CZ-CG 3.97Å; F604-Q608 PolarHBondContact O-N 3.42Å; M605-Q608 PolarHBondContact O-N 2.81Å; Q608-L610 VanDerWaalsContact C-N 3.25Å; Q608-L610 PolarHBondContact O-N 2.93Å; Q608-N611 PolarHBondContact O-N 3.2Å; Q608-S612 PolarHBondContact O-N 2.87Å
609	Q	60.3	Low	58.8	Low	152 Å²	152	124.6 Å²	124.6	71%	0.71	65%	0.646	S	S	*	*	H	α-helix	trans	-65	-28.5	177.9	-161.4	171.9	34.3	0	0	112.9	M605 A607	M605-Q609 WeakPolarHBondContact O-CB 3.29Å; M605-Q609 PolarHBondContact O-N 3.09Å; M605-Q609 VanDerWaalsContact O-N 3.12Å; A607-Q609 VanDerWaalsContact C-N 3.29Å; A607-Q609 PolarHBondContact O-N 2.96Å
610	L	56.5	Low	57.2	Low	107 Å²	107	129.9 Å²	129.9	56%	0.56	67%	0.667	S	S	*	*	H	α-helix	trans	-81.1	-42.2	172.3	-78.5	165.9	0	0	0	112.9	K606 A607 Q608 S612 L613 L614	K606-L610 PolarHBondContact O-N 3.09Å; A607-L610 PolarHBondContact O-N 3.04Å; Q608-L610 VanDerWaalsContact C-N 3.25Å; Q608-L610 PolarHBondContact O-N 2.93Å; L610-S612 VanDerWaalsContact C-N 3.29Å; L610-S612 PolarHBondContact O-N 3.44Å; L610-L613 WeakPolarHBondContact O-CA 3.28Å; L610-L613 WeakPolarHBondContact O-CB 3.47Å; L610-L613 PolarHBondContact O-N 2.96Å; L610-L614 PolarHBondContact O-N 3.33Å; L610-L614 VanDerWaalsContact O-N 3.07Å
611	N	57.3	Low	55.6	Low	111 Å²	111	127.2 Å²	127.2	59%	0.594	68%	0.677	S	S	*	*	H	α-helix	trans	-60.6	-39.7	177.2	-96.3	28.5	0	0	0	111.7	A607 Q608 L613 L614 D615	A607-N611 PolarHBondContact O-N 3.45Å; Q608-N611 PolarHBondContact O-N 3.2Å; N611-L613 PolarHBondContact O-N 2.66Å; N611-L614 PolarHBondContact O-N 3.13Å; N611-D615 PolarHBondContact O-N 3.28Å
612	S	56.3	Low	54	Low	108 Å²	108	126.9 Å²	126.9	76%	0.755	70%	0.698	S	S	*	*	H	α-helix	trans	-65.9	-6.3	174.5	-169	0	0	0	0	114.3	Q608 L610	Q608-S612 PolarHBondContact O-N 2.87Å; L610-S612 VanDerWaalsContact C-N 3.29Å; L610-S612 PolarHBondContact O-N 3.44Å
613	L	53.8	Low	52.2	Low	144 Å²	144	126.2 Å²	126.2	75%	0.754	71%	0.711	S	S	*	*	H	α-helix	trans	-105.8	-18.4	171.8	-154.9	86.3	0	0	0	112.4	L610 N611	L610-L613 WeakPolarHBondContact O-CA 3.28Å; L610-L613 WeakPolarHBondContact O-CB 3.47Å; L610-L613 PolarHBondContact O-N 2.96Å; N611-L613 PolarHBondContact O-N 2.66Å
614	L	49.3	Very low	50.7	Low	107 Å²	107	124.7 Å²	124.7	56%	0.56	72%	0.723	S	S	*	*	H	α-helix	trans	-100.7	-22.1	-172	-170.3	61	0	0	0	113.3	L610 N611 Q616 Q617	L610-L614 PolarHBondContact O-N 3.33Å; L610-L614 VanDerWaalsContact O-N 3.07Å; N611-L614 PolarHBondContact O-N 3.13Å; L614-Q616 PolarHBondContact O-N 2.88Å; L614-Q617 PolarHBondContact O-N 3.2Å
615	D	49.7	Very low	48.9	Very low	160 Å²	160	123 Å²	123	86%	0.856	74%	0.74	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.2	8.8	178.6	-145.5	39.7	0	0	0	114.3	N611	N611-D615 PolarHBondContact O-N 3.28Å
616	Q	53.1	Low	47.7	Very low	193 Å²	193	120 Å²	120	90%	0.902	75%	0.745	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.9	-0.4	173.4	-160.6	167.7	70.7	0	0	112.6	L614	L614-Q616 PolarHBondContact O-N 2.88Å
617	Q	39	Very low	46.6	Very low	158 Å²	158	121.2 Å²	121.2	74%	0.738	76%	0.758	S	S	*	*	S	Bend	trans	-129.9	128.6	178.5	-165.1	164.8	9	0	0	112.9	L614	L614-Q617 PolarHBondContact O-N 3.2Å
618	E	39.9	Very low	45.7	Very low	193 Å²	193	126.7 Å²	126.7	90%	0.902	78%	0.781	S	S	*	*			trans	-43.8	151.8	174	-51.7	168.1	153	0	0	113.2
619	G	33.6	Very low	44.9	Very low	63 Å²	63	126.1 Å²	126.1	65%	0.649	79%	0.79	S	S	*	*			cis	148	169.1	9.9	0	0	0	0	0	110
620	F	40.5	Very low	43.6	Very low	218 Å²	218	125 Å²	125	96%	0.956	79%	0.794	S	S	*	*			trans	63.7	101.1	170.3	-72.1	-91.2	0	0	0	121
621	G	37	Very low	42.9	Very low	84 Å²	84	128.7 Å²	128.7	87%	0.866	81%	0.806	S	S	*	*			trans	76.2	156.8	132.1	0	0	0	0	0	120.9
622	G	36.9	Very low	42.1	Very low	83 Å²	83	130 Å²	130	86%	0.856	81%	0.813	S	S	*	*			cis	158.5	96.6	-13.6	0	0	0	0	0	117.6
623	G	35.4	Very low	41.6	Very low	86 Å²	86	132 Å²	132	89%	0.887	82%	0.815	S	S	*	*			trans	92.2	140.1	142.5	0	0	0	0	0	121.5
624	G	34.9	Very low	40.8	Very low	85 Å²	85	134.1 Å²	134.1	88%	0.876	82%	0.818	S	S	*	*			trans	94.1	137	160.2	0	0	0	0	0	117
625	G	36.1	Very low	40.3	Very low	86 Å²	86	133.2 Å²	133.2	89%	0.887	83%	0.827	S	S	*	*			cis	127.5	116.1	-14.6	0	0	0	0	0	115.5
626	G	38.9	Very low	39.9	Very low	76 Å²	76	129.6 Å²	129.6	78%	0.784	83%	0.827	S	S	*	*			trans	153.9	138.7	168.1	0	0	0	0	0	115.4
627	N	42.2	Very low	39.1	Very low	165 Å²	165	127.8 Å²	127.8	88%	0.882	82%	0.823	S	S	*	*			trans	-123.6	158.5	-179	-72.1	-16.2	0	0	0	112.4
628	N	45.4	Very low	39.4	Very low	164 Å²	164	125 Å²	125	88%	0.877	82%	0.821	S	S	*	*			trans	-163	153.9	161.4	-105.5	-21.1	0	0	0	108.2
629	S	46.9	Very low	39.6	Very low	106 Å²	106	122.6 Å²	122.6	74%	0.741	82%	0.815	S	S	*	*			cis	-161.1	163.2	-10.7	43.7	0	0	0	0	109.7
630	T	32.7	Very low	40.2	Very low	129 Å²	129	125 Å²	125	79%	0.791	82%	0.822	S	S	*	*			trans	-110	149.9	173.6	-58	0	0	0	0	110.3
631	F	41.6	Very low	40.3	Very low	184 Å²	184	120.2 Å²	120.2	81%	0.807	81%	0.812	S	S	*	*			trans	-143.7	122.6	167.5	-169.2	-94.7	0	0	0	111.4	N633	F631-N633 HydrophobicContact CE1-CB 4.42Å
632	D	40.3	Very low	40.3	Very low	138 Å²	138	126.2 Å²	126.2	74%	0.738	82%	0.815	S	S	*	*			trans	-91.8	157.5	173.5	-80.6	-77	0	0	0	111.7
633	N	45.9	Very low	40.8	Very low	150 Å²	150	130.2 Å²	130.2	80%	0.802	81%	0.811	S	S	*	*			trans	-150.8	152.2	152.5	-143.1	-23.1	0	0	0	112.6	F631	F631-N633 HydrophobicContact CE1-CB 4.42Å
634	F	38.3	Very low	41.2	Very low	188 Å²	188	132.3 Å²	132.3	83%	0.825	81%	0.806	S	S	*	*			trans	-136.2	138.1	-152.8	-165.1	-95.3	0	0	0	114
635	A	37.5	Very low	41.5	Very low	89 Å²	89	137.8 Å²	137.8	74%	0.736	81%	0.807	S	S	*	*			trans	30.7	129	162.4	0	0	0	0	0	122.1
636	G	41	Very low	41.8	Very low	83 Å²	83	145.2 Å²	145.2	86%	0.856	81%	0.808	S	S	*	*			trans	-155.6	136.6	158.9	0	0	0	0	0	111.2
637	N	36.8	Very low	41.7	Very low	156 Å²	156	145.2 Å²	145.2	83%	0.834	81%	0.807	S	S	*	*			trans	-136.9	130.6	-170.4	169.7	29.3	0	0	0	112
638	S	45	Very low	41.5	Very low	100 Å²	100	145.5 Å²	145.5	70%	0.699	81%	0.809	S	S	*	*			trans	-174.5	140	140.7	33.2	0	0	0	0	115.1
639	N	44.4	Very low	41.3	Very low	142 Å²	142	143.7 Å²	143.7	76%	0.759	80%	0.8	S	S	*	*			trans	57.8	100	144.8	-65.1	-6.3	0	0	0	122.8
640	S	46.9	Very low	41	Very low	114 Å²	114	144.2 Å²	144.2	80%	0.797	79%	0.794	S	S	*	*				91.4	143.4	120.8	-58.8	0	0	0	0	120.3
641	P	41.6	Very low	41.5	Very low	117 Å²	117	145.3 Å²	145.3	76%	0.76	80%	0.795	S	S	*	*			trans	-129.3	107.3	-160.6	34.5	-12.3	0	0	0	114.3
642	F	38.1	Very low	41.5	Very low	209 Å²	209	143.7 Å²	143.7	92%	0.917	80%	0.795	S	S	*	*			trans	-154.3	164.5	167	-118.7	-86.1	0	0	0	111.7
643	E	45.9	Very low	41.3	Very low	167 Å²	167	142.9 Å²	142.9	78%	0.78	80%	0.8	S	S	*	*			trans	67.8	86.2	175	-56.1	-150.5	158	0	0	118.9
644	V	45.5	Very low	41	Very low	130 Å²	130	141.4 Å²	141.4	79%	0.788	80%	0.797	S	S	*	*			trans	-133	152.8	133.4	-173.3	0	0	0	0	107.7
645	F	41.3	Very low	41.2	Very low	200 Å²	200	139.9 Å²	139.9	88%	0.877	79%	0.794	S	S	*	*			trans	82.2	76.9	-174.7	-58.8	-69.9	0	0	0	116.7
646	R	41.7	Very low	41.3	Very low	243 Å²	243	143 Å²	143	92%	0.917	80%	0.797	S	S	*	*			trans	-130.3	136.2	154.1	-129.3	-175.9	-169.3	-162.9	6.3	109.2
647	G	36.7	Very low	41.1	Very low	75 Å²	75	142 Å²	142	77%	0.773	79%	0.786	S	S	*	*			trans	93.7	141.5	-169.6	0	0	0	0	0	111.8
648	N	37.9	Very low	41.2	Very low	171 Å²	171	142 Å²	142	91%	0.914	79%	0.786	S	S	*	*			cis	-123	172.3	6.9	-158.3	6	0	0	0	112.5
649	N	40.9	Very low	40.9	Very low	127 Å²	127	144.3 Å²	144.3	68%	0.679	79%	0.791	S	S	*	*			trans	-97.6	165.5	-162.4	-150.2	8.3	0	0	0	114.3
650	N	41.1	Very low	40.7	Very low	117 Å²	117	142.3 Å²	142.3	63%	0.626	79%	0.794	S	S	*	*			trans	60.8	101.2	158	-62.3	-15.9	0	0	0	119.6
651	N	43.5	Very low	40.3	Very low	151 Å²	151	141.3 Å²	141.3	81%	0.807	79%	0.792	S	S	*	*				163.3	133.7	92.7	-87.7	-32.2	0	0	0	115.6
652	N	40.2	Very low	40.2	Very low	151 Å²	151	141 Å²	141	81%	0.807	79%	0.79	S	S	*	*			trans	51.6	113.3	146	-146.1	20.8	0	0	0	120.7
653	S	36.6	Very low	40.3	Very low	121 Å²	121	138.3 Å²	138.3	85%	0.846	79%	0.786	S	S	*	*			trans	-86.9	142.2	-179.9	-55.8	0	0	0	0	113.9
654	T	40.6	Very low	40.1	Very low	119 Å²	119	136.2 Å²	136.2	73%	0.73	78%	0.784	S	S	*	*			trans	-134.3	117.2	178.9	-24	0	0	0	0	111
655	M	41.9	Very low	39.6	Very low	155 Å²	155	138.7 Å²	138.7	76%	0.764	79%	0.787	S	S	*	*			trans	57.3	133.1	131.6	-70.6	-72.5	-157.3	0	0	123.1
656	I	38.9	Very low	39.3	Very low	156 Å²	156	135.8 Å²	135.8	80%	0.8	78%	0.781	S	S	*	*			trans	70.1	141.3	146	-59.6	159	0	0	0	116
657	G	38.1	Very low	39.2	Very low	61 Å²	61	129.1 Å²	129.1	63%	0.629	77%	0.771	S	S	*	*			cis	151.4	166.1	-6.5	0	0	0	0	0	112.7
658	N	39	Very low	39.1	Very low	156 Å²	156	135.3 Å²	135.3	83%	0.834	78%	0.777	S	S	*	*			trans	70.5	154.9	175.4	-66.4	-24.7	0	0	0	118.9
659	N	38.9	Very low	39.2	Very low	149 Å²	149	131.6 Å²	131.6	80%	0.797	77%	0.77	S	S	*	*			cis	-169.8	132.1	-39.3	-147.2	-17.7	0	0	0	110.3
660	A	39.3	Very low	39	Very low	100 Å²	100	134.8 Å²	134.8	83%	0.826	78%	0.779	S	S	*	*			trans	-167.6	137.4	162.8	0	0	0	0	0	112
661	A	37.9	Very low	38.9	Very low	93 Å²	93	137.9 Å²	137.9	77%	0.769	79%	0.789	S	S	*	*			trans	-111.7	-168.4	-175.4	0	0	0	0	0	111
662	P	41.2	Very low	38.6	Very low	109 Å²	109	139.8 Å²	139.8	71%	0.708	79%	0.791	S	S	*	*			cis	-139.3	-171.7	-3.9	42.4	-23.9	0	0	0	115.9
663	N	39.6	Very low	38.5	Very low	154 Å²	154	135.5 Å²	135.5	82%	0.824	78%	0.783	S	S	*	*			trans	69.1	147.7	160	-88.2	4.4	0	0	0	118.8
664	T	41.9	Very low	38.6	Very low	122 Å²	122	136.2 Å²	136.2	75%	0.748	78%	0.781	S	S	*	*			cis	-130.9	164.6	-5.9	46.1	0	0	0	0	111.1
665	Q	34.2	Very low	38.6	Very low	182 Å²	182	138.4 Å²	138.4	85%	0.85	79%	0.788	S	S	*	*			trans	-74.9	149.2	164	-61.6	166.9	-95.7	0	0	110.3
666	D	35.6	Very low	38.4	Very low	140 Å²	140	137.7 Å²	137.7	75%	0.749	79%	0.788	S	S	*	*				-164.5	158.4	111.1	-124.7	-40.2	0	0	0	115.8
667	S	39	Very low	38.5	Very low	102 Å²	102	138.5 Å²	138.5	71%	0.713	79%	0.79	S	S	*	*			trans	-59.6	136.9	-167.2	-49.5	0	0	0	0	117
668	F	35.4	Very low	38.5	Very low	205 Å²	205	142.1 Å²	142.1	90%	0.899	80%	0.795	S	S	*	*			trans	-88.8	103.9	169.9	-37.5	-75	0	0	0	111.3
669	A	39.4	Very low	38.8	Very low	93 Å²	93	143.3 Å²	143.3	77%	0.769	80%	0.796	S	S	*	*			trans	-103.3	126.2	170.4	0	0	0	0	0	110.7	E671	A669-E671 PolarHBondContact O-N 3.04Å
670	F	37.2	Very low	38.7	Very low	195 Å²	195	139.7 Å²	139.7	86%	0.855	79%	0.794	S	S	*	*			trans	-86.7	104	172.3	-97.1	-97.4	0	0	0	110.1
671	E	38.7	Very low	38.6	Very low	182 Å²	182	138.3 Å²	138.3	85%	0.85	79%	0.789	S	S	*	*			trans	-108.1	109.7	170.9	-171.1	169.6	-173.3	0	0	110.9	A669 G673	A669-E671 PolarHBondContact O-N 3.04Å; E671-G673 PolarHBondContact O-N 2.64Å
672	F	37.6	Very low	38.6	Very low	190 Å²	190	141.6 Å²	141.6	83%	0.833	79%	0.794	S	S	*	*			trans	-80.5	69.5	177.7	-111.9	-86.2	0	0	0	111.3	V674	F672-V674 PolarHBondContact O-N 2.63Å
673	G	38.2	Very low	38.7	Very low	62 Å²	62	143.7 Å²	143.7	64%	0.639	79%	0.794	S	S	*	*			trans	-68.8	95.7	176.6	0	0	0	0	0	112.5	E671 N675	E671-G673 PolarHBondContact O-N 2.64Å; G673-N675 PolarHBondContact O-N 2.91Å
674	V	38.9	Very low	38.7	Very low	136 Å²	136	147.4 Å²	147.4	82%	0.824	80%	0.796	S	S	*	*			trans	-63.3	122.4	174.7	179.2	0	0	0	0	110.1	F672	F672-V674 PolarHBondContact O-N 2.63Å
675	N	40	Very low	38.4	Very low	164 Å²	164	145.1 Å²	145.1	88%	0.877	80%	0.798	S	S	*	*			trans	-136.1	132.3	164.4	-109.4	-42.6	0	0	0	112.5	G673	G673-N675 PolarHBondContact O-N 2.91Å
676	N	38.2	Very low	38.4	Very low	140 Å²	140	143.5 Å²	143.5	75%	0.749	80%	0.795	S	S	*	*			trans	-91.2	122.2	-173.3	169.3	18.6	0	0	0	110.1	N678	N676-N678 PolarHBondContact OD1-N 2.91Å
677	M	40.6	Very low	38.5	Very low	173 Å²	173	144.2 Å²	144.2	85%	0.852	80%	0.798	S	S	*	*			trans	-133.3	83	167.7	-129.9	178.2	-166.1	0	0	112.6	Q679	M677-Q679 PolarHBondContact O-N 3.34Å
678	N	38.9	Very low	38.4	Very low	138 Å²	138	142.8 Å²	142.8	74%	0.738	80%	0.8	S	S	*	*			trans	-65	107.8	166.5	172.3	28.6	0	0	0	111.4	N676	N676-N678 PolarHBondContact OD1-N 2.91Å
679	Q	43.7	Very low	38.4	Very low	181 Å²	181	137.2 Å²	137.2	85%	0.846	80%	0.8	S	S	*	*			trans	-126.7	118.5	149.3	-68.3	-166.3	35.4	0	0	108.3	M677	M677-Q679 PolarHBondContact O-N 3.34Å
680	G	37.9	Very low	38.3	Very low	73 Å²	73	136.6 Å²	136.6	75%	0.753	80%	0.803	S	S	*	*			trans	-119.9	165.1	179.8	0	0	0	0	0	112.5
681	G	37.4	Very low	38.3	Very low	70 Å²	70	134.7 Å²	134.7	72%	0.722	80%	0.802	S	S	*	*			trans	142	109.5	165.4	0	0	0	0	0	115.2
682	N	38	Very low	38.5	Very low	163 Å²	163	133.5 Å²	133.5	87%	0.872	80%	0.801	S	S	*	*				46.3	125.3	126.3	-77.2	-17.4	0	0	0	118.8
683	Q	42.7	Very low	38.7	Very low	153 Å²	153	130.9 Å²	130.9	72%	0.715	80%	0.8	S	S	*	*			cis	-155.5	161.3	38.1	-66.7	-172.3	43.8	0	0	114.6
684	R	38.4	Very low	39	Very low	231 Å²	231	132.9 Å²	132.9	87%	0.872	80%	0.802	S	S	*	*			trans	24.5	129	138.3	-56.7	169.9	173.2	-175.3	-5.1	117.8
685	G	35.9	Very low	39.2	Very low	75 Å²	75	138.9 Å²	138.9	77%	0.773	81%	0.81	S	S	*	*			cis	135.7	170	22.8	0	0	0	0	0	111.7
686	N	35.8	Very low	39.2	Very low	148 Å²	148	134.1 Å²	134.1	79%	0.791	80%	0.799	S	S	*	*			trans	80.5	81	164.2	-159.5	76.6	0	0	0	120.9
687	N	36.3	Very low	39.4	Very low	154 Å²	154	138.9 Å²	138.9	82%	0.824	81%	0.807	S	S	*	*				68.3	142.4	110.4	-160.5	24.4	0	0	0	121.3
688	G	38.3	Very low	39.7	Very low	73 Å²	73	142.7 Å²	142.7	75%	0.753	81%	0.812	S	S	*	*			trans	100.8	122.2	179.8	0	0	0	0	0	112.3
689	G	35	Very low	40	Very low	87 Å²	87	147 Å²	147	90%	0.897	82%	0.818	S	S	*	*			cis	139.8	107.9	-4.4	0	0	0	0	0	111
690	G	36.7	Very low	40	Very low	80 Å²	80	152 Å²	152	83%	0.825	84%	0.837	S	S	*	*			trans	172.4	119.9	-179	0	0	0	0	0	113.9
691	N	37.7	Very low	40.1	Very low	155 Å²	155	155.9 Å²	155.9	83%	0.829	84%	0.841	S	S	*	*			trans	-60.1	138.1	179.7	-48.8	-41.3	0	0	0	112.9
692	N	41.6	Very low	40.2	Very low	158 Å²	158	160.4 Å²	160.4	85%	0.845	85%	0.848	S	S	*	*				-169.4	143.3	115.1	-105.6	-23.2	0	0	0	115.2
693	V	41.8	Very low	40.3	Very low	134 Å²	134	160.3 Å²	160.3	81%	0.812	85%	0.846	S	S	*	*			trans	-156.7	165.3	167.5	-112.1	0	0	0	0	105.9
694	P	45.9	Very low	40.2	Very low	105 Å²	105	160.7 Å²	160.7	68%	0.682	85%	0.854	S	S	*	*			cis	-127.4	170.1	-12	38.6	-24.2	0	0	0	112.9
695	W	41.5	Very low	40.3	Very low	262 Å²	262	156.3 Å²	156.3	99%	0.992	85%	0.853	S	S	*	*			trans	-133	130.9	154.8	-80	89.3	0	0	0	110
696	G	41.1	Very low	40.6	Very low	63 Å²	63	161.7 Å²	161.7	65%	0.649	86%	0.858	S	S	*	*			trans	-140.6	158.1	178.3	0	0	0	0	0	111.7
697	R	41.4	Very low	40.9	Very low	240 Å²	240	162.7 Å²	162.7	91%	0.906	86%	0.863	S	S	*	*			trans	53.8	110.8	172.9	-57.7	-176.5	-177	-144.3	-1.4	116.7
698	R	47.2	Very low	41.3	Very low	254 Å²	254	163.4 Å²	163.4	96%	0.958	87%	0.866	S	S	*	*				-126.8	153.1	119.7	-68.7	-164.7	-176	-142.3	1	109.1
699	R	44.7	Very low	41.5	Very low	228 Å²	228	170.9 Å²	170.9	86%	0.86	88%	0.875	S	S	*	*			trans	-88.5	150.1	170.6	-63.3	-179.5	176.7	-149	0.4	109
700	F	43.7	Very low	42.1	Very low	285 Å²	285	178.5 Å²	178.5	100%	1.25	87%	0.874	S	S	*	*				-118.9	0	125.8	-91.3	-84.3	0	0	0	107.5

Retrieved 700 of 700 residues in 87.6 ms (Link to these results)

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