A0A096MY33_PAPAN Loading...

E3 ubiquitin-protein ligase MARCHF7

E3 ubiquitin-protein ligase which may specifically enhance the E2 activity of HIP2. E3 ubiquitin ligases accept ubiquitin from an E2 ubiquitin-conjugating enzyme in the form of a thioester and then directly transfer the ubiquitin to targeted substrates. May be involved in T-cell proliferation by regulating LIF secretion. May play a role in lysosome homeostasis. Promotes 'Lys-6', 'Lys-11' and 'Lys-63'-linked mixed polyubiquitination on ATG14 leading to the inhibition of autophagy by impairing the interaction between ATG14 and STX7. Participates in the dopamine-mediated negative regulation of the NLRP3 inflammasome by promoting its uibiquitination and subsequent degradation.

AlphaFold DB , UniProt , Accession A0A096MY33, Species PAPAN (Papio anubis, Olive baboon), Gene MARCHF7, Length 704 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	34.6	Very low	40	Very low	223 Å²	223	170.6 Å²	170.6	100%	1.099	84%	0.836	S	S	*	*				0	113.7	0	-59.4	176.1	80.5	0	0	106.6
2	E	35.3	Very low	39.3	Very low	165 Å²	165	167.8 Å²	167.8	77%	0.771	83%	0.825	S	S	*	*			cis	-137	178	5.6	-141.4	81.9	129	0	0	111.3
3	S	39.8	Very low	38.4	Very low	111 Å²	111	162.8 Å²	162.8	78%	0.776	82%	0.816	S	S	*	*			trans	-100.7	171.8	-177.6	51.8	0	0	0	0	113.8
4	K	45.6	Very low	37.9	Very low	203 Å²	203	161.1 Å²	161.1	88%	0.883	82%	0.818	S	S	*	*			trans	-53	158.3	-177.5	-59.4	171.4	179.2	174.6	0	114
5	P	55.5	Low	37.9	Very low	131 Å²	131	161.9 Å²	161.9	85%	0.851	82%	0.817	S	S	*	*				-129.8	169	123.5	37.7	-31	0	0	0	114.2
6	S	41.1	Very low	38.3	Very low	110 Å²	110	158.9 Å²	158.9	77%	0.769	81%	0.812	S	S	*	*			trans	-129.2	149.9	-175.7	55.5	0	0	0	0	112.2
7	R	36.2	Very low	37.9	Very low	230 Å²	230	155.2 Å²	155.2	87%	0.868	81%	0.805	S	S	*	*			trans	-167.4	114.1	165.5	-111.2	161.3	-169	174	4.2	115.8
8	I	36.1	Very low	37.6	Very low	140 Å²	140	152.6 Å²	152.6	72%	0.718	80%	0.801	S	S	*	*				32.9	120.8	118.5	-57.4	167	0	0	0	117.1	R10	I8-R10 HydrophobicContact CG2-CG 4.49Å
9	P	48.9	Very low	37.5	Very low	121 Å²	121	149.7 Å²	149.7	79%	0.786	80%	0.795	S	S	*	*				-145.5	-176.9	88.4	22.8	0.7	0	0	0	113.9
10	R	35.2	Very low	37.6	Very low	217 Å²	217	150.4 Å²	150.4	82%	0.819	80%	0.798	S	S	*	*			cis	162	138.4	-34.4	-110.7	-176.8	172.3	171.3	-2	106.4	I8	I8-R10 HydrophobicContact CG2-CG 4.49Å
11	R	31.6	Very low	37.1	Very low	226 Å²	226	147.3 Å²	147.3	85%	0.853	79%	0.789	S	S	*	*			trans	65.5	162.5	163.8	-70.3	-158.3	170.3	-163.4	-2.6	117.4
12	I	32.3	Very low	37.1	Very low	137 Å²	137	142.6 Å²	142.6	70%	0.703	77%	0.773	S	S	*	*			cis	166.5	142.3	-32.6	-100.1	171.3	0	0	0	106.4
13	S	27.4	Very low	37.1	Very low	102 Å²	102	144.6 Å²	144.6	71%	0.713	77%	0.773	S	S	*	*			trans	81.4	121.6	158.6	-75.8	0	0	0	0	124.6
14	V	31.6	Very low	36.9	Very low	139 Å²	139	145.6 Å²	145.6	84%	0.842	77%	0.768	S	S	*	*				86.1	147.2	123.2	175	0	0	0	0	121.6
15	Q	38.1	Very low	36.3	Very low	173 Å²	173	143.7 Å²	143.7	81%	0.808	76%	0.763	S	S	*	*			trans	-82.6	177.3	178.8	-59	179.5	-20.5	0	0	114
16	P	44.3	Very low	35.1	Very low	114 Å²	114	143 Å²	143	74%	0.74	76%	0.762	S	S	*	*				-135.3	-158.3	92.5	44	-33.2	0	0	0	111.2
17	S	30.4	Very low	34.4	Very low	97 Å²	97	140.9 Å²	140.9	68%	0.678	76%	0.757	S	S	*	*			cis	-159.6	155	2.2	31.2	0	0	0	0	107.3
18	S	32.4	Very low	34.2	Very low	107 Å²	107	135.5 Å²	135.5	75%	0.748	76%	0.755	S	S	*	*			cis	76.7	139.3	31.6	74.3	0	0	0	0	115.9
19	S	36.1	Very low	34.3	Very low	98 Å²	98	141 Å²	141	69%	0.685	77%	0.767	S	S	*	*			cis	-174.8	174.9	-13.8	49	0	0	0	0	111.6
20	L	39	Very low	33.4	Very low	164 Å²	164	138.5 Å²	138.5	86%	0.859	76%	0.763	S	S	*	*			trans	79.6	160	164.3	-61.9	161.1	0	0	0	116.7
21	S	27.7	Very low	33.3	Very low	86 Å²	86	134.1 Å²	134.1	60%	0.601	77%	0.766	S	S	*	*			cis	-159.6	152.7	23	-163	0	0	0	0	116.3
22	T	33.6	Very low	33.2	Very low	124 Å²	124	128.4 Å²	128.4	76%	0.761	76%	0.76	S	S	*	*			trans	47.5	154.3	143.4	46.8	0	0	0	0	123.9
23	R	36	Very low	33.5	Very low	206 Å²	206	128.8 Å²	128.8	78%	0.777	76%	0.763	S	S	*	*			cis	-176.4	145.6	-28.4	-127	-167.3	-178.3	-167.4	3	110.1
24	M	34.9	Very low	33.7	Very low	133 Å²	133	129.9 Å²	129.9	66%	0.655	76%	0.761	S	S	*	*			trans	76.7	147.8	147.8	-63	-66.8	164	0	0	124.1
25	M	33.3	Very low	33.7	Very low	162 Å²	162	129.9 Å²	129.9	80%	0.798	76%	0.756	S	S	*	*			trans	94.3	138.4	155.5	-65.2	-53.5	100.2	0	0	122.3
26	S	30.7	Very low	33.4	Very low	117 Å²	117	126.3 Å²	126.3	82%	0.818	75%	0.747	S	S	*	*			trans	-94.6	162.3	-159.1	-38	0	0	0	0	116.4
27	G	27.6	Very low	32.9	Very low	65 Å²	65	130 Å²	130	67%	0.67	75%	0.747	S	S	*	*				121.9	105.5	118.3	0	0	0	0	0	121.9
28	S	31.6	Very low	33	Very low	118 Å²	118	133.2 Å²	133.2	83%	0.825	75%	0.751	S	S	*	*				84.2	142.7	128.5	-54.4	0	0	0	0	123.5
29	R	36.6	Very low	32.8	Very low	254 Å²	254	132.6 Å²	132.6	96%	0.958	75%	0.747	S	S	*	*			trans	78.4	134.2	165.5	-57.1	-177.4	174.9	-156.9	-3.1	117.9
30	G	30.2	Very low	32.7	Very low	69 Å²	69	138 Å²	138	71%	0.711	75%	0.752	S	S	*	*			cis	167.8	150.6	-12.6	0	0	0	0	0	115.9
31	S	33.9	Very low	32.1	Very low	125 Å²	125	135.7 Å²	135.7	87%	0.874	74%	0.741	S	S	*	*			trans	63	135.4	170.5	-54.1	0	0	0	0	116.7
32	S	30.4	Very low	32.1	Very low	106 Å²	106	136.7 Å²	136.7	74%	0.741	75%	0.748	S	S	*	*			cis	-157.1	171	42.2	-81.4	0	0	0	0	110.9
33	L	36.9	Very low	31.9	Very low	145 Å²	145	135.2 Å²	135.2	76%	0.759	74%	0.742	S	S	*	*			cis	-161.4	171.5	-4.9	-111.7	163.3	0	0	0	109.2
34	N	32.1	Very low	31.5	Very low	125 Å²	125	134.6 Å²	134.6	67%	0.668	75%	0.746	S	S	*	*			trans	37.8	110.3	161.4	-68.8	13.8	0	0	0	122.8
35	D	31.2	Very low	31.3	Very low	139 Å²	139	138.6 Å²	138.6	74%	0.743	75%	0.754	S	S	*	*				46	141.2	96.9	-73.2	-68.4	0	0	0	121.9
36	T	32.8	Very low	31.1	Very low	99 Å²	99	138 Å²	138	61%	0.607	75%	0.753	S	S	*	*			cis	-168.1	148.2	-1.5	-125.5	0	0	0	0	113.7
37	Y	33.4	Very low	30.9	Very low	190 Å²	190	139.5 Å²	139.5	75%	0.745	75%	0.752	S	S	*	*			trans	54.8	125.2	153.8	-75.8	-113.2	0	0	0	122.2
38	H	32	Very low	30.8	Very low	165 Å²	165	140.4 Å²	140.4	76%	0.764	75%	0.748	S	S	*	*				67.6	148.9	86.1	-78.3	-94.7	0	0	0	116.1
39	S	29	Very low	30.6	Very low	95 Å²	95	141.7 Å²	141.7	66%	0.664	74%	0.74	S	S	*	*			cis	-177.5	160	-23.7	-155.3	0	0	0	0	112.1
40	R	33.4	Very low	30.3	Very low	212 Å²	212	137.9 Å²	137.9	80%	0.8	73%	0.727	S	S	*	*			trans	71.3	135.5	157.2	-62.9	-172.6	91	146.4	8.5	124.5
41	D	26.6	Very low	30.2	Very low	115 Å²	115	142 Å²	142	62%	0.615	73%	0.728	S	S	*	*			trans	55.5	114.8	130.5	-61.4	-40.6	0	0	0	125.2
42	S	28.5	Very low	29.9	Very low	107 Å²	107	141.4 Å²	141.4	75%	0.748	72%	0.724	S	S	*	*				92	155.6	127	83.7	0	0	0	0	123.5
43	S	29.3	Very low	29.8	Very low	92 Å²	92	143.7 Å²	143.7	64%	0.643	73%	0.734	S	S	*	*			trans	92.7	101.2	146.6	-58.8	0	0	0	0	122.5
44	F	26.6	Very low	29.5	Very low	193 Å²	193	142.3 Å²	142.3	85%	0.846	74%	0.736	S	S	*	*				65.9	148.4	128.2	-75.8	-76	0	0	0	124.5
45	R	30.4	Very low	29.5	Very low	218 Å²	218	141 Å²	141	82%	0.823	74%	0.742	S	S	*	*			trans	80.5	128.8	165.9	-54.2	-147.8	174.8	-155	-3.6	115.5
46	L	29.6	Very low	29.4	Very low	150 Å²	150	139.6 Å²	139.6	79%	0.785	74%	0.744	S	S	*	*				71.8	89.4	53.5	-73.4	169.6	0	0	0	113
47	D	26.4	Very low	29.3	Very low	148 Å²	148	139.6 Å²	139.6	79%	0.791	75%	0.754	S	S	*	*				-159.6	139.8	103.8	-98.1	-54.9	0	0	0	107
48	S	27	Very low	29.1	Very low	84 Å²	84	136.4 Å²	136.4	59%	0.587	76%	0.759	S	S	*	*				73	141	76.9	-155.4	0	0	0	0	115.4
49	E	26.3	Very low	29	Very low	144 Å²	144	133.5 Å²	133.5	67%	0.673	76%	0.764	S	S	*	*			trans	81.4	132	152.1	-85.9	153.1	83.9	0	0	125.2
50	Y	29.4	Very low	29	Very low	175 Å²	175	134.4 Å²	134.4	69%	0.686	77%	0.77	S	S	*	*			trans	78.1	109.3	142.8	-71	-51.2	0	0	0	124.6
51	Q	28.9	Very low	29.5	Very low	154 Å²	154	130.7 Å²	130.7	72%	0.72	77%	0.774	S	S	*	*				65	106.5	125.6	-82	164.1	1.4	0	0	120.7
52	S	28.4	Very low	29.8	Very low	113 Å²	113	131.8 Å²	131.8	79%	0.79	77%	0.773	S	S	*	*				37.4	108.1	104.8	-49.2	0	0	0	0	118.6
53	T	28.3	Very low	30	Very low	154 Å²	154	135.5 Å²	135.5	95%	0.945	78%	0.779	S	S	*	*			trans	-137.3	146.9	137.9	33.1	0	0	0	0	111.1
54	S	29.7	Very low	29.9	Very low	116 Å²	116	136.5 Å²	136.5	81%	0.811	79%	0.785	S	S	*	*			trans	-116.3	134.7	-173.9	54.3	0	0	0	0	111.7
55	A	32.1	Very low	30.2	Very low	97 Å²	97	131.3 Å²	131.3	80%	0.802	78%	0.779	S	S	*	*			trans	-177.5	158.4	158.7	0	0	0	0	0	110.7
56	S	30.1	Very low	30.2	Very low	110 Å²	110	130.8 Å²	130.8	77%	0.769	78%	0.777	S	S	*	*			cis	-175.6	153.6	-27	-93.9	0	0	0	0	108.8
57	A	29.9	Very low	30.1	Very low	99 Å²	99	133 Å²	133	82%	0.818	78%	0.776	S	S	*	*			trans	64.4	160.1	161.5	0	0	0	0	0	117.8
58	S	28.7	Very low	30.3	Very low	123 Å²	123	130.8 Å²	130.8	86%	0.86	77%	0.772	S	S	*	*			cis	-158.8	176.3	-22	47.9	0	0	0	0	109.9
59	A	31	Very low	30.3	Very low	104 Å²	104	135 Å²	135	86%	0.86	78%	0.782	S	S	*	*			trans	-103.4	172.2	-165.7	0	0	0	0	0	116.1
60	S	28.9	Very low	30.9	Very low	115 Å²	115	132.8 Å²	132.8	80%	0.804	78%	0.783	S	S	*	*			trans	-143.8	167.8	171.2	67.1	0	0	0	0	112.5
61	P	43.8	Very low	31.1	Very low	134 Å²	134	133.4 Å²	133.4	87%	0.87	79%	0.792	S	S	*	*			trans	-112.9	-144.8	-155.9	43.4	-35.1	0	0	0	117.3
62	F	33.4	Very low	31.4	Very low	138 Å²	138	134.3 Å²	134.3	61%	0.605	80%	0.8	S	S	*	*			trans	-126.8	175.5	-142.4	-121.3	-85.3	0	0	0	115.4	L321	F62-L321 HydrophobicContact CD2-CD1 3.98Å; F62-L321 HydrophobicContact CE2-CD1 3.77Å; F62-L321 HydrophobicContact CE2-CG 4.02Å; F62-L321 HydrophobicContact CZ-CD1 4.33Å; F62-L321 HydrophobicContact CZ-CG 4.28Å
63	Q	32.2	Very low	31.6	Very low	185 Å²	185	134.1 Å²	134.1	86%	0.864	80%	0.795	S	S	*	*			trans	79.3	159.2	167.1	-62.6	179.9	8	0	0	117.3
64	S	27.8	Very low	31.7	Very low	112 Å²	112	136 Å²	136	78%	0.783	79%	0.792	S	S	*	*			cis	-141.9	-161.6	13.6	67	0	0	0	0	114.5
65	A	31.6	Very low	31.6	Very low	85 Å²	85	134.1 Å²	134.1	70%	0.702	79%	0.792	S	S	*	*			trans	-146.2	-145.8	-171.7	0	0	0	0	0	113.8
66	W	30.1	Very low	31.4	Very low	207 Å²	207	134.8 Å²	134.8	78%	0.784	80%	0.797	S	S	*	*			trans	87.1	161.5	178.5	-53.8	94.8	0	0	0	117.2
67	Y	29.1	Very low	31.2	Very low	196 Å²	196	140.7 Å²	140.7	77%	0.769	80%	0.802	S	S	*	*			cis	-137.6	-160.5	7	-131.8	-76.2	0	0	0	112.7
68	S	30	Very low	31.1	Very low	101 Å²	101	141.9 Å²	141.9	71%	0.706	81%	0.805	S	S	*	*			trans	-140.7	-154.4	-132.1	-160.2	0	0	0	0	116.8
69	E	26.2	Very low	31	Very low	172 Å²	172	146 Å²	146	80%	0.804	80%	0.801	S	S	*	*			trans	102.4	146.4	171	-63	-143.5	69.9	0	0	118.6
70	S	38.5	Very low	30.9	Very low	99 Å²	99	146.3 Å²	146.3	69%	0.692	80%	0.798	S	S	*	*			cis	-166.1	164.9	-17.2	-93.1	0	0	0	0	111.6
71	E	34.9	Very low	31	Very low	187 Å²	187	147.1 Å²	147.1	87%	0.874	79%	0.789	S	S	*	*			trans	-92	167.2	-177.1	-64.3	177	78.6	0	0	115.7
72	I	33.8	Very low	30.3	Very low	173 Å²	173	145.9 Å²	145.9	89%	0.887	77%	0.774	S	S	*	*			trans	-170.4	177.3	143.6	-104.5	159.6	0	0	0	114.4
73	T	33.4	Very low	30.1	Very low	110 Å²	110	146.4 Å²	146.4	68%	0.675	78%	0.779	S	S	*	*			trans	-105.4	157.3	-145.3	55.7	0	0	0	0	120.2
74	Q	30.5	Very low	30.1	Very low	193 Å²	193	143.9 Å²	143.9	90%	0.902	77%	0.767	S	S	*	*			trans	37.7	137.1	140	-60	-178.8	19.2	0	0	122.6
75	G	27.8	Very low	30.3	Very low	77 Å²	77	147.8 Å²	147.8	79%	0.794	77%	0.765	S	S	*	*			trans	173.1	120.9	154.4	0	0	0	0	0	121.3
76	A	27.9	Very low	30.2	Very low	110 Å²	110	148.3 Å²	148.3	91%	0.909	76%	0.755	S	S	*	*			trans	70.5	171.3	146.6	0	0	0	0	0	122.6
77	R	25.8	Very low	30.2	Very low	234 Å²	234	146.1 Å²	146.1	88%	0.883	75%	0.754	S	S	*	*			trans	-138.1	156.1	-168.1	-62.2	171.1	171.6	162.4	-5	112.5
78	S	28.6	Very low	30.3	Very low	124 Å²	124	143.2 Å²	143.2	87%	0.867	75%	0.751	S	S	*	*			trans	-177.3	132.5	142.8	-79.4	0	0	0	0	108.5
79	R	25.4	Very low	30.4	Very low	209 Å²	209	141.3 Å²	141.3	79%	0.789	74%	0.738	S	S	*	*			cis	83.8	71.2	6.3	-150	-159.6	178	-148	-3.3	120
80	S	29.1	Very low	30.8	Very low	112 Å²	112	142.4 Å²	142.4	78%	0.783	74%	0.74	S	S	*	*			trans	-152.4	141.1	133	47.7	0	0	0	0	108.4
81	Q	31.4	Very low	30.7	Very low	132 Å²	132	149.1 Å²	149.1	62%	0.617	75%	0.75	S	S	*	*			cis	81.3	121.3	26.8	-162.7	162.1	12.8	0	0	111.7
82	N	27.8	Very low	30.6	Very low	107 Å²	107	145.8 Å²	145.8	57%	0.572	75%	0.745	S	S	*	*			cis	-159.5	178.6	9.7	-144.8	-6.4	0	0	0	113.6
83	Q	29.1	Very low	30.3	Very low	150 Å²	150	147.1 Å²	147.1	70%	0.701	74%	0.744	S	S	*	*			trans	68.8	153.9	144.7	-76.8	156.7	-3.2	0	0	121
84	Q	32.3	Very low	30.2	Very low	131 Å²	131	149.9 Å²	149.9	61%	0.612	75%	0.754	S	S	*	*			cis	-172.6	133.5	-29	-166	154	-79.6	0	0	112.1
85	R	32.3	Very low	29.9	Very low	195 Å²	195	145.3 Å²	145.3	74%	0.736	74%	0.743	S	S	*	*			trans	61.6	171.6	151.2	-78.4	-167.8	-135.9	-174.7	-2.8	118.4
86	D	30.1	Very low	30	Very low	95 Å²	95	147.3 Å²	147.3	51%	0.508	74%	0.744	S	S	.	*			cis	-153.5	151.5	-6.3	-117	-17	0	0	0	111.1
87	H	31.1	Very low	30.1	Very low	161 Å²	161	148.2 Å²	148.2	75%	0.745	74%	0.739	S	S	*	*			trans	53.7	168.2	155.6	-54.5	-53.7	0	0	0	119.1
88	D	29.6	Very low	30.1	Very low	135 Å²	135	144 Å²	144	72%	0.722	73%	0.733	S	S	*	*			cis	-149.2	163.4	-4.4	-155.2	-27.1	0	0	0	111
89	S	33.2	Very low	30.1	Very low	62 Å²	62	143.7 Å²	143.7	43%	0.434	73%	0.73	S	S	.	*			trans	78.6	116	136	-82.6	0	0	0	0	124.8
90	K	34.4	Very low	30.2	Very low	195 Å²	195	140.3 Å²	140.3	85%	0.848	73%	0.733	S	S	*	*				76.7	116.3	126	-62.6	169.2	-173.9	111	0	119.3
91	R	35.9	Very low	30.1	Very low	239 Å²	239	141.6 Å²	141.6	90%	0.902	74%	0.736	S	S	*	*			trans	-118.3	133.9	168.2	-174	-171.5	-172.2	179.2	5.2	109.5
92	P	32.8	Very low	30	Very low	117 Å²	117	141.3 Å²	141.3	76%	0.76	75%	0.748	S	S	*	*			trans	-76.3	161.8	171.5	31.3	-33.6	0	0	0	112.4
93	K	28.3	Very low	30.2	Very low	201 Å²	201	141.5 Å²	141.5	87%	0.874	77%	0.765	S	S	*	*			trans	-77.9	158.8	-178.7	-59.2	171	179.9	173.4	0	111.8
94	L	30.6	Very low	30.1	Very low	169 Å²	169	138.1 Å²	138.1	89%	0.885	77%	0.771	S	S	*	*				-162.5	159.8	114.5	-102.8	171.4	0	0	0	111.4
95	S	25.3	Very low	30	Very low	96 Å²	96	143.1 Å²	143.1	67%	0.671	78%	0.784	S	S	*	*			trans	-101.4	171.5	179.2	51.9	0	0	0	0	109.8
96	C	28.7	Very low	29.9	Very low	119 Å²	119	140.7 Å²	140.7	80%	0.804	79%	0.785	S	S	*	*				-157.1	169.7	56	-74.7	0	0	0	0	114.1
97	T	29.6	Very low	29.9	Very low	130 Å²	130	142.7 Å²	142.7	80%	0.798	80%	0.801	S	S	*	*			trans	-92.3	145.5	178.5	47.3	0	0	0	0	114.1
98	N	26.7	Very low	29.8	Very low	145 Å²	145	138.2 Å²	138.2	78%	0.775	80%	0.798	S	S	*	*			trans	1.2	137.7	140.7	-52.2	0.4	0	0	0	118.5
99	C	27.8	Very low	29.7	Very low	118 Å²	118	139.8 Å²	139.8	80%	0.797	81%	0.806	S	S	*	*				-177.9	130.5	92.9	-97.2	0	0	0	0	114.4
100	T	27.8	Very low	29.4	Very low	137 Å²	137	139.8 Å²	139.8	84%	0.84	82%	0.817	S	S	*	*			trans	28.8	126.6	140.8	-30.8	0	0	0	0	121.2
101	T	26.9	Very low	29.2	Very low	140 Å²	140	138 Å²	138	86%	0.859	82%	0.816	S	S	*	*			trans	-93.7	153	167	46	0	0	0	0	112.9
102	S	28.9	Very low	28.8	Very low	125 Å²	125	132.9 Å²	132.9	87%	0.874	81%	0.806	S	S	*	*			trans	-129.4	156.4	163.2	59.9	0	0	0	0	109.8
103	A	31.7	Very low	28.6	Very low	112 Å²	112	132.7 Å²	132.7	93%	0.926	80%	0.803	S	S	*	*			trans	-99.8	144.5	-169	0	0	0	0	0	113.5
104	G	27.5	Very low	28.6	Very low	79 Å²	79	131 Å²	131	81%	0.814	80%	0.803	S	S	*	*			trans	-161.8	139.2	169.8	0	0	0	0	0	110.6
105	R	31.6	Very low	28.6	Very low	235 Å²	235	128.4 Å²	128.4	89%	0.887	80%	0.798	S	S	*	*			trans	-112.9	149.2	-179.5	-70.6	-179.2	171.9	-176.4	-1.8	111.5
106	N	30.1	Very low	28.6	Very low	144 Å²	144	130.6 Å²	130.6	77%	0.77	80%	0.803	S	S	*	*			trans	148.5	120.1	137.1	-75.9	-13.4	0	0	0	109.8
107	V	29.8	Very low	28.8	Very low	138 Å²	138	129.8 Å²	129.8	84%	0.836	80%	0.798	S	S	*	*				97.1	130.9	60.3	161.3	0	0	0	0	111.8
108	G	28	Very low	28.9	Very low	66 Å²	66	127.5 Å²	127.5	68%	0.68	79%	0.788	S	S	*	*			trans	130.7	84.6	177.7	0	0	0	0	0	112.2
109	N	27.8	Very low	29	Very low	168 Å²	168	129.7 Å²	129.7	90%	0.898	79%	0.785	S	S	*	*				85.4	131.5	65.5	-78.7	28.2	0	0	0	115.5
110	G	26.6	Very low	29.1	Very low	63 Å²	63	132.3 Å²	132.3	65%	0.649	78%	0.778	S	S	*	*			trans	148.2	83.4	-179.7	0	0	0	0	0	110.5
111	L	30.5	Very low	28.9	Very low	158 Å²	158	131.9 Å²	131.9	83%	0.827	77%	0.766	S	S	*	*				60.9	127.9	91.4	-58.3	171.7	0	0	0	112.3
112	N	27.2	Very low	28.9	Very low	131 Å²	131	131 Å²	131	70%	0.701	77%	0.766	S	S	*	*			cis	-159.8	170.2	7.6	-96.5	-20.1	0	0	0	108
113	T	28.6	Very low	28.9	Very low	112 Å²	112	133.3 Å²	133.3	69%	0.687	76%	0.763	S	S	*	*			cis	-153.6	174.2	2.2	0.9	0	0	0	0	107.8
114	L	28.9	Very low	29.2	Very low	167 Å²	167	133.9 Å²	133.9	87%	0.874	75%	0.754	S	S	*	*				-174.1	162.2	75.4	-86.5	169.6	0	0	0	110.6
115	S	30.2	Very low	30.1	Very low	113 Å²	113	135.7 Å²	135.7	79%	0.79	75%	0.752	S	S	*	*			trans	-80.7	177.7	177.7	-46.9	0	0	0	0	112.7
116	D	25.6	Very low	30.1	Very low	143 Å²	143	135 Å²	135	77%	0.765	75%	0.749	S	S	*	*			cis	-161.4	157	22.9	-168.5	24.3	0	0	0	115.6
117	S	33.9	Very low	30	Very low	101 Å²	101	133 Å²	133	71%	0.706	75%	0.746	S	S	*	*			trans	70.9	156.4	156.6	91.1	0	0	0	0	118.3
118	S	30.9	Very low	29.9	Very low	83 Å²	83	131.2 Å²	131.2	58%	0.58	74%	0.74	S	S	*	*			cis	-159.2	155.7	3.1	77.1	0	0	0	0	113.5
119	W	29.1	Very low	29.8	Very low	190 Å²	190	133.1 Å²	133.1	72%	0.72	74%	0.743	S	S	*	*			trans	62.5	142.4	149.6	-66.2	128.5	0	0	0	120.4
120	R	30.4	Very low	29.9	Very low	173 Å²	173	131.7 Å²	131.7	65%	0.653	74%	0.74	S	S	*	*			cis	-142.9	165.6	4.4	-79.3	-141.5	160.4	-97.9	-15.9	114.3
121	H	24.1	Very low	30.2	Very low	129 Å²	129	135.2 Å²	135.2	60%	0.597	75%	0.748	S	S	*	*			trans	-6.3	151.7	153.2	-74.1	11.3	0	0	0	120.2
122	S	26.3	Very low	30.1	Very low	121 Å²	121	135.5 Å²	135.5	85%	0.846	75%	0.75	S	S	*	*				-141.3	173.9	50.4	-66.4	0	0	0	0	117
123	Q	29.3	Very low	30	Very low	174 Å²	174	131.5 Å²	131.5	81%	0.813	74%	0.74	S	S	*	*			trans	-95.4	159.3	-162.8	-67.4	171.1	-42.8	0	0	115.1
124	V	37.3	Very low	30.1	Very low	123 Å²	123	131.4 Å²	131.4	75%	0.745	74%	0.743	S	S	*	*			trans	-99.8	168.1	168.5	-146.1	0	0	0	0	109.3
125	P	46.9	Very low	30.1	Very low	117 Å²	117	132.1 Å²	132.1	76%	0.76	74%	0.74	S	S	*	*				-141.8	149.7	99.5	44.4	-32.3	0	0	0	111.8
126	R	30.1	Very low	30.2	Very low	222 Å²	222	130 Å²	130	84%	0.838	74%	0.736	S	S	*	*				54.1	137.8	52.7	-84.6	-175.2	165.6	144.1	-1.9	112.3
127	S	28.6	Very low	30.4	Very low	100 Å²	100	129.6 Å²	129.6	70%	0.699	74%	0.739	S	S	*	*			cis	-165.2	166.9	10	-101.1	0	0	0	0	107.5
128	S	27.2	Very low	30.2	Very low	102 Å²	102	132.6 Å²	132.6	71%	0.713	75%	0.747	S	S	*	*			cis	179.5	169.9	-14	51.8	0	0	0	0	109.2
129	S	26.6	Very low	30.1	Very low	105 Å²	105	136.8 Å²	136.8	73%	0.734	76%	0.762	S	S	*	*			trans	69.6	116.3	157.7	173.6	0	0	0	0	119.3
130	V	29.2	Very low	30.1	Very low	139 Å²	139	135.5 Å²	135.5	84%	0.842	77%	0.766	S	S	*	*			trans	-145.9	153.3	136.1	-90.8	0	0	0	0	109.5
131	V	34.4	Very low	30.1	Very low	136 Å²	136	137.3 Å²	137.3	82%	0.824	77%	0.773	S	S	*	*			trans	-116.9	125.9	176.2	172.9	0	0	0	0	108.9
132	L	28.5	Very low	30.2	Very low	165 Å²	165	137.5 Å²	137.5	86%	0.864	77%	0.774	S	S	*	*			trans	-161.8	148.3	167.2	-93.3	134.3	0	0	0	107.8
133	G	24.6	Very low	30.2	Very low	47 Å²	47	141.4 Å²	141.4	49%	0.485	77%	0.77	S	S	.	*			cis	142	63.3	-7.3	0	0	0	0	0	113.9	F135	G133-F135 WeakPolarHBondContact O-CE2 3.38Å
134	S	30.2	Very low	30.4	Very low	109 Å²	109	142.7 Å²	142.7	76%	0.762	77%	0.768	S	S	*	*			trans	61.9	174.7	-175.2	-60.1	0	0	0	0	112.7
135	F	28.7	Very low	30.1	Very low	182 Å²	182	143 Å²	143	80%	0.798	77%	0.765	S	S	*	*			cis	-139.3	167	15.3	-60.2	-98.8	0	0	0	109.1	G133	G133-F135 WeakPolarHBondContact O-CE2 3.38Å
136	G	31.9	Very low	29.2	Very low	69 Å²	69	144.9 Å²	144.9	71%	0.711	77%	0.768	S	S	*	*			cis	96.8	48.2	12	0	0	0	0	0	112.8	D138	G136-D138 PolarHBondContact O-N 2.79Å
137	T	31.1	Very low	29.3	Very low	135 Å²	135	140.5 Å²	140.5	83%	0.828	76%	0.757	S	S	*	*			trans	-95.4	75.9	-173.4	54	0	0	0	0	112.9
138	D	28.6	Very low	29.4	Very low	163 Å²	163	144.3 Å²	144.3	87%	0.872	76%	0.756	S	S	*	*			trans	-71.4	145.8	146.6	-88.4	-57	0	0	0	109.3	G136	G136-D138 PolarHBondContact O-N 2.79Å
139	L	30	Very low	29.7	Very low	171 Å²	171	149.5 Å²	149.5	90%	0.895	76%	0.76	S	S	*	*			trans	-122.2	103.4	177	-115.8	172	0	0	0	110.9
140	M	29.1	Very low	29.9	Very low	163 Å²	163	149.7 Å²	149.7	80%	0.803	76%	0.757	S	S	*	*			trans	-69.3	159.7	165.5	-65.2	-173.7	166	0	0	110.1
141	R	29.9	Very low	29.8	Very low	211 Å²	211	149.3 Å²	149.3	80%	0.796	75%	0.75	S	S	*	*				-178.2	171.3	64.3	-150.8	174	-82.3	-173.1	-4.2	106.5
142	E	24.9	Very low	29.7	Very low	134 Å²	134	147.5 Å²	147.5	63%	0.626	74%	0.743	S	S	*	*			cis	-178	121.2	40.6	-167.4	159.5	117.6	0	0	108.9
143	R	26.9	Very low	29.7	Very low	202 Å²	202	144.3 Å²	144.3	76%	0.762	74%	0.735	S	S	*	*				65.3	103.3	86.2	-167.5	-142.7	-132.5	-155	-0.1	118.4
144	R	33	Very low	30.1	Very low	201 Å²	201	148.9 Å²	148.9	76%	0.758	75%	0.753	S	S	*	*				179.7	127.6	126.1	-97.7	164.8	-77.3	174.1	-5.7	108.5
145	D	30.9	Very low	30	Very low	131 Å²	131	148.8 Å²	148.8	70%	0.701	75%	0.752	S	S	*	*				73	93.5	67.6	-66.7	-58.7	0	0	0	114.5
146	L	29.7	Very low	30	Very low	156 Å²	156	147.8 Å²	147.8	82%	0.817	76%	0.755	S	S	*	*			trans	-152.5	129.5	141.6	-152.2	66.9	0	0	0	112.9
147	E	31	Very low	29.9	Very low	129 Å²	129	152.9 Å²	152.9	60%	0.603	77%	0.765	S	S	*	*			trans	2.7	154.9	156.1	-48.7	-170.9	95.6	0	0	121.7
148	R	30.7	Very low	30.2	Very low	181 Å²	181	153.6 Å²	153.6	68%	0.683	76%	0.761	S	S	*	*			cis	-164.6	135.7	23.7	-148.2	168.9	-101.5	-168.4	-4	114.5
149	R	33.5	Very low	30.2	Very low	211 Å²	211	151.9 Å²	151.9	80%	0.796	75%	0.752	S	S	*	*			trans	55.3	125.4	142	-78.7	179	177.1	-103.7	-1.8	123.8
150	T	30.9	Very low	30.2	Very low	108 Å²	108	155 Å²	155	66%	0.663	75%	0.754	S	S	*	*			trans	62.3	142	133.3	57.6	0	0	0	0	119.9
151	D	28.4	Very low	30.3	Very low	131 Å²	131	151.2 Å²	151.2	70%	0.701	74%	0.743	S	S	*	*			cis	-134.8	155.9	12.6	-85.7	-62.4	0	0	0	110
152	S	30.5	Very low	30.4	Very low	98 Å²	98	149 Å²	149	69%	0.685	74%	0.741	S	S	*	*			cis	66.4	135.3	49.8	108.6	0	0	0	0	114.5
153	S	29.7	Very low	30.8	Very low	98 Å²	98	153.8 Å²	153.8	69%	0.685	75%	0.754	S	S	*	*			cis	-169.5	175.7	-21.7	52.3	0	0	0	0	109.9
154	V	33.1	Very low	30.8	Very low	143 Å²	143	149.2 Å²	149.2	87%	0.867	75%	0.753	S	S	*	*			trans	62.6	155.8	169.5	-112.7	0	0	0	0	116.4
155	S	27.8	Very low	30.6	Very low	107 Å²	107	142.9 Å²	142.9	75%	0.748	75%	0.75	S	S	*	*			cis	-156.4	167.9	12.7	54.9	0	0	0	0	113.5
156	N	28.4	Very low	30.6	Very low	161 Å²	161	143 Å²	143	86%	0.861	75%	0.751	S	S	*	*			trans	-101.7	145.5	170.8	-53	-68.6	0	0	0	111.5
157	L	30.5	Very low	30.6	Very low	176 Å²	176	143.8 Å²	143.8	92%	0.921	75%	0.748	S	S	*	*			trans	-158.3	153.9	144.9	-155.4	52.1	0	0	0	115
158	M	35.9	Very low	30.6	Very low	150 Å²	150	143.5 Å²	143.5	74%	0.739	76%	0.755	S	S	*	*			trans	-68.9	163.6	-159.6	-72.3	-63.6	-139.9	0	0	122.2
159	D	30.4	Very low	30.6	Very low	127 Å²	127	141 Å²	141	68%	0.679	76%	0.76	S	S	*	*			trans	61.2	125.6	138.8	-69.8	-32.7	0	0	0	123.5
160	Y	29.9	Very low	30.3	Very low	237 Å²	237	136.3 Å²	136.3	93%	0.929	76%	0.759	S	S	*	*				-160.9	176.1	94.9	-119.2	-95.3	0	0	0	112.1
161	S	31.3	Very low	30.3	Very low	84 Å²	84	135.8 Å²	135.8	59%	0.587	76%	0.761	S	S	*	*			trans	-125.5	168.3	-150.1	-171.7	0	0	0	0	118.2
162	H	30.3	Very low	30.3	Very low	163 Å²	163	139.2 Å²	139.2	76%	0.755	77%	0.765	S	S	*	*			trans	88.3	104.8	157.2	-63.2	-66.5	0	0	0	122.5
163	R	34	Very low	30.3	Very low	235 Å²	235	139.8 Å²	139.8	89%	0.887	76%	0.764	S	S	*	*				158.2	153.9	112.6	-85.4	174.1	-167.7	-83.4	0.3	110.8
164	S	27.8	Very low	30.2	Very low	107 Å²	107	142.8 Å²	142.8	75%	0.748	77%	0.767	S	S	*	*			cis	-177.4	123.6	-32.4	-96.8	0	0	0	0	108.3
165	G	28.9	Very low	29.9	Very low	68 Å²	68	142.1 Å²	142.1	70%	0.701	76%	0.759	S	S	*	*			trans	90.3	153.7	170.3	0	0	0	0	0	116.7
166	D	29.2	Very low	30	Very low	133 Å²	133	147.3 Å²	147.3	71%	0.711	76%	0.762	S	S	*	*			cis	-166.7	135.1	-10.6	-117.2	-5.5	0	0	0	111.9
167	F	31.2	Very low	30.3	Very low	173 Å²	173	146.2 Å²	146.2	76%	0.759	76%	0.761	S	S	*	*			trans	60.2	154.4	168.5	-50.9	-60.9	0	0	0	117.3
168	T	30.8	Very low	30.9	Very low	123 Å²	123	143.4 Å²	143.4	76%	0.755	75%	0.753	S	S	*	*			cis	-165.8	160.8	-13.3	21.8	0	0	0	0	105.9
169	T	29.4	Very low	30.7	Very low	129 Å²	129	141.6 Å²	141.6	79%	0.791	76%	0.756	S	S	*	*			cis	-154.5	163.4	3.6	-107.5	0	0	0	0	108.6
170	S	28.3	Very low	30.6	Very low	111 Å²	111	145.9 Å²	145.9	78%	0.776	76%	0.763	S	S	*	*			trans	-76.3	161	-179.4	-172.1	0	0	0	0	115.2
171	S	30.1	Very low	30.7	Very low	98 Å²	98	138.6 Å²	138.6	69%	0.685	75%	0.748	S	S	*	*			trans	-82.9	178.5	162.6	-172.6	0	0	0	0	112.5
172	Y	29	Very low	30.9	Very low	202 Å²	202	143.7 Å²	143.7	79%	0.792	76%	0.762	S	S	*	*			trans	109.8	128.5	151.6	-112.9	-102.7	0	0	0	120.8
173	V	29.4	Very low	30.9	Very low	110 Å²	110	139.6 Å²	139.6	67%	0.667	76%	0.764	S	S	*	*			trans	57.2	159.3	163.8	-77	0	0	0	0	119.2
174	Q	28.8	Very low	30.8	Very low	162 Å²	162	133 Å²	133	76%	0.757	76%	0.76	S	S	*	*			cis	-151.4	142.3	7.4	-143.9	137.6	-10.4	0	0	113.8
175	D	26.2	Very low	30.9	Very low	128 Å²	128	139.6 Å²	139.6	68%	0.684	77%	0.768	S	S	*	*			trans	52.7	155.2	133.7	-164.6	32.4	0	0	0	123.8
176	R	30.3	Very low	31.5	Very low	216 Å²	216	141.3 Å²	141.3	82%	0.815	77%	0.767	S	S	*	*			trans	93.4	137.7	160.5	-54.2	-166.1	177	171.5	-2.6	122
177	V	35.4	Very low	31.5	Very low	139 Å²	139	142.9 Å²	142.9	84%	0.842	77%	0.767	S	S	*	*			trans	-121.1	142.5	170.8	175.8	0	0	0	0	108.3
178	P	42.8	Very low	31.3	Very low	116 Å²	116	140.6 Å²	140.6	75%	0.753	76%	0.759	S	S	*	*			trans	-149.3	141.5	136.3	34.9	-17.2	0	0	0	117.5
179	S	31.2	Very low	31.2	Very low	113 Å²	113	141.6 Å²	141.6	79%	0.79	76%	0.76	S	S	*	*			trans	41.9	113.2	132	-53.4	0	0	0	0	124.7
180	Y	28.7	Very low	31.4	Very low	216 Å²	216	139.2 Å²	139.2	85%	0.847	75%	0.749	S	S	*	*				70.7	100.7	109.2	-147	-108.1	0	0	0	123.3
181	S	32.3	Very low	31.4	Very low	85 Å²	85	141.9 Å²	141.9	59%	0.594	75%	0.751	S	S	*	*				93.8	158.8	124.4	83.2	0	0	0	0	124.9
182	Q	35.2	Very low	31.4	Very low	190 Å²	190	142.4 Å²	142.4	89%	0.888	75%	0.754	S	S	*	*			trans	81.6	146.8	158.1	-67	-168.3	3.1	0	0	122
183	G	29.7	Very low	31.3	Very low	77 Å²	77	138.3 Å²	138.3	79%	0.794	75%	0.75	S	S	*	*			trans	98.5	131.8	167	0	0	0	0	0	117.2
184	A	31.1	Very low	31.3	Very low	97 Å²	97	139.8 Å²	139.8	80%	0.802	75%	0.754	S	S	*	*				169.3	82.7	-59.7	0	0	0	0	0	111.3
185	R	31.3	Very low	31.4	Very low	246 Å²	246	139.1 Å²	139.1	93%	0.928	75%	0.751	S	S	*	*			trans	63.1	-180	157.8	-94.5	-174.1	176.8	173.5	0.7	116.9
186	P	41.6	Very low	31.5	Very low	103 Å²	103	140.1 Å²	140.1	67%	0.669	76%	0.755	S	S	*	*			cis	-129	-179.4	-0.1	42.1	-26.7	0	0	0	116.7
187	K	28.3	Very low	31.4	Very low	166 Å²	166	136.7 Å²	136.7	72%	0.722	75%	0.753	S	S	*	*			trans	72	158.1	147.6	-85.4	176.8	145.7	-135.4	0	119.3
188	E	28.1	Very low	31	Very low	126 Å²	126	135.7 Å²	135.7	59%	0.589	75%	0.747	S	S	*	*			cis	-155.2	153	-7.4	42.2	-139.2	125	0	0	114.9
189	N	28.7	Very low	30.3	Very low	143 Å²	143	135.7 Å²	135.7	77%	0.765	75%	0.75	S	S	*	*			trans	59.7	154	145.3	-65.2	-4.1	0	0	0	121.7
190	S	31.9	Very low	30.3	Very low	80 Å²	80	134.8 Å²	134.8	56%	0.559	74%	0.744	S	S	*	*			cis	-177.3	161.8	-22.7	56.4	0	0	0	0	112.2
191	M	30.1	Very low	30.3	Very low	166 Å²	166	129.6 Å²	129.6	82%	0.818	74%	0.735	S	S	*	*			trans	83	122.7	162.7	-57.8	-176.2	-103.2	0	0	116.8
192	S	28.3	Very low	30	Very low	109 Å²	109	132.1 Å²	132.1	76%	0.762	74%	0.742	S	S	*	*				78.4	144.5	70.2	-50.3	0	0	0	0	112.3
193	T	28.9	Very low	29.7	Very low	116 Å²	116	130.6 Å²	130.6	71%	0.712	73%	0.734	S	S	*	*			cis	-166.3	148	37.8	34.7	0	0	0	0	114.3
194	L	29.5	Very low	29.4	Very low	142 Å²	142	134 Å²	134	74%	0.743	73%	0.73	S	S	*	*			trans	64.1	163.7	140.3	-58	168	0	0	0	118.9
195	Q	30	Very low	29.2	Very low	148 Å²	148	136.5 Å²	136.5	69%	0.692	73%	0.729	S	S	*	*			cis	-158.3	145.6	-2.9	-133.6	164.4	-15.1	0	0	115.5
196	L	28.9	Very low	29.6	Very low	149 Å²	149	130.4 Å²	130.4	78%	0.78	72%	0.721	S	S	*	*			trans	57.2	157.6	142.8	-80.1	169.6	0	0	0	126.1
197	N	26.8	Very low	28.9	Very low	143 Å²	143	130.6 Å²	130.6	77%	0.765	73%	0.725	S	S	*	*			trans	-82.1	175	173.5	-73.9	-64.5	0	0	0	111.8
198	T	26.8	Very low	29	Very low	118 Å²	118	130 Å²	130	72%	0.724	73%	0.725	S	S	*	*				-173.2	143.8	55.2	46.5	0	0	0	0	115.9
199	S	28.8	Very low	29.2	Very low	116 Å²	116	132.3 Å²	132.3	81%	0.811	74%	0.735	S	S	*	*			trans	64.3	165.3	148.8	72.7	0	0	0	0	118.8
200	S	30.6	Very low	29.2	Very low	94 Å²	94	134 Å²	134	66%	0.657	74%	0.738	S	S	*	*			cis	-155.9	156.2	6.7	-158.9	0	0	0	0	114.1
201	T	29.3	Very low	29.1	Very low	108 Å²	108	135.6 Å²	135.6	66%	0.663	75%	0.745	S	S	*	*			trans	21.2	134.9	146.8	54.3	0	0	0	0	123.1
202	N	26.4	Very low	29	Very low	138 Å²	138	135.3 Å²	135.3	74%	0.738	75%	0.745	S	S	*	*				-176	168.5	108.1	-95.8	-12.4	0	0	0	117.3
203	H	27.7	Very low	28.9	Very low	157 Å²	157	136.9 Å²	136.9	73%	0.727	74%	0.744	S	S	*	*			trans	-36.8	175.1	174.4	-52	-68.4	0	0	0	120.1
204	Q	24.4	Very low	28.9	Very low	150 Å²	150	135.4 Å²	135.4	70%	0.701	74%	0.739	S	S	*	*			cis	162.5	129.6	-36	174.7	173.6	-3.8	0	0	110.3
205	L	27	Very low	28.9	Very low	149 Å²	149	132.8 Å²	132.8	78%	0.78	73%	0.732	S	S	*	*			trans	65.4	167.3	165.2	-74.7	171.2	0	0	0	119.1
206	P	40.4	Very low	29	Very low	117 Å²	117	134.5 Å²	134.5	76%	0.76	73%	0.732	S	S	*	*			cis	-132.7	-165.7	-15.1	30.9	-8.2	0	0	0	115.6
207	S	26.8	Very low	29	Very low	108 Å²	108	132.9 Å²	132.9	76%	0.755	72%	0.724	S	S	*	*			trans	92.5	121.3	170.8	-138.9	0	0	0	0	115.4
208	E	30	Very low	29.4	Very low	153 Å²	153	131 Å²	131	72%	0.715	72%	0.722	S	S	*	*			cis	71.4	134.6	27.3	-54.5	-168.5	179.4	0	0	114.7
209	H	31.5	Very low	29.6	Very low	175 Å²	175	135.3 Å²	135.3	81%	0.81	73%	0.726	S	S	*	*			cis	-163.1	147.5	-6.6	-109.2	-34.4	0	0	0	110.5
210	Q	29.4	Very low	29.6	Very low	178 Å²	178	137 Å²	137	83%	0.832	73%	0.726	S	S	*	*			trans	-174.8	115.9	139	-105.1	172.8	37.1	0	0	114.1
211	T	30	Very low	29.5	Very low	114 Å²	114	137.6 Å²	137.6	70%	0.699	73%	0.73	S	S	*	*			trans	23	145.6	134.8	47	0	0	0	0	122.1
212	I	27.6	Very low	29.4	Very low	159 Å²	159	140.5 Å²	140.5	82%	0.815	74%	0.74	S	S	*	*				-147.8	165.5	71.5	-88.5	172.2	0	0	0	115.4
213	L	26.3	Very low	29.5	Very low	143 Å²	143	145 Å²	145	75%	0.749	75%	0.747	S	S	*	*			trans	-47.8	173.5	-168.2	-75.9	74.3	0	0	0	120.7
214	S	28.6	Very low	29.5	Very low	85 Å²	85	143 Å²	143	59%	0.594	75%	0.751	S	S	*	*			trans	-139.1	163.5	176.9	58.6	0	0	0	0	112.9	R319	S214-R319 PolarHBondContact O-NH1 3.3Å; S214-R319 PolarHBondContact O-NH2 2.84Å; S214-R319 PolarHBondContact OG-NH2 3.24Å
215	S	28.9	Very low	29.5	Very low	87 Å²	87	143 Å²	143	61%	0.608	76%	0.756	S	S	*	*			trans	178.3	140.4	153.4	-101.6	0	0	0	0	108.5	R319	S215-R319 PolarHBondContact OG-NH1 2.91Å; S215-R319 PolarHBondContact OG-NH2 3.1Å
216	R	33.8	Very low	29.5	Very low	183 Å²	183	146.3 Å²	146.3	69%	0.691	76%	0.764	S	S	*	*			cis	74.9	136.5	39.7	-62.4	-166.1	75.5	167.8	-2.7	113.3
217	D	27.9	Very low	28.8	Very low	115 Å²	115	145.4 Å²	145.4	62%	0.615	76%	0.76	S	S	*	*			cis	-150.6	165.3	12.2	-120.6	-9.6	0	0	0	113.6
218	S	36.2	Very low	28.8	Very low	104 Å²	104	145.1 Å²	145.1	73%	0.727	76%	0.758	S	S	*	*			trans	-92.8	166.1	177.7	-43.6	0	0	0	0	113.7
219	R	30.3	Very low	28.7	Very low	209 Å²	209	147.1 Å²	147.1	79%	0.789	76%	0.759	S	S	*	*			trans	-157.3	170.3	147.6	-125.5	176.8	-73.6	-169	0.9	113.9
220	N	29.1	Very low	28.6	Very low	152 Å²	152	145.4 Å²	145.4	81%	0.813	75%	0.752	S	S	*	*			trans	-105.2	151.9	-155.3	-78.8	-9.8	0	0	0	116
221	S	27.2	Very low	28.7	Very low	106 Å²	106	142.7 Å²	142.7	74%	0.741	75%	0.752	S	S	*	*			trans	46.7	125.6	132.8	-166.1	0	0	0	0	120.9
222	L	28.1	Very low	28.4	Very low	169 Å²	169	146.2 Å²	146.2	89%	0.885	76%	0.761	S	S	*	*				-159.8	170.8	115.8	-108.6	170.9	0	0	0	112.2
223	R	28.5	Very low	28.4	Very low	231 Å²	231	143.8 Å²	143.8	87%	0.872	76%	0.758	S	S	*	*			trans	-84.6	152.3	-174.2	-59.5	173.6	170.6	-165.5	-4.1	113.3
224	S	26.9	Very low	28.3	Very low	116 Å²	116	141.3 Å²	141.3	81%	0.811	75%	0.753	S	S	*	*			trans	-164.2	154.6	133.2	48.4	0	0	0	0	111.9
225	N	26	Very low	28.4	Very low	151 Å²	151	148.5 Å²	148.5	81%	0.807	77%	0.767	S	S	*	*			trans	-90.8	148.5	174.7	-56.1	-30.4	0	0	0	110
226	F	26.6	Very low	28.3	Very low	217 Å²	217	149.3 Å²	149.3	95%	0.952	77%	0.772	S	S	*	*			trans	-147.9	155.3	144.4	-107.8	-76.9	0	0	0	110.6
227	S	25	Very low	28	Very low	98 Å²	98	148 Å²	148	69%	0.685	78%	0.779	S	S	*	*			trans	-150.5	152.1	-173.8	172	0	0	0	0	110.5
228	S	25.8	Very low	28.1	Very low	102 Å²	102	146.8 Å²	146.8	71%	0.713	79%	0.785	S	S	*	*			trans	71.4	148.1	167.1	-54.6	0	0	0	0	115.9
229	R	29.4	Very low	27.7	Very low	196 Å²	196	150.4 Å²	150.4	74%	0.74	79%	0.791	S	S	*	*			cis	-159.8	155.7	-5.9	-130.7	-178.8	155.1	-165.1	-20.2	113.4
230	E	28.7	Very low	28.4	Very low	138 Å²	138	145.7 Å²	145.7	65%	0.645	79%	0.787	S	S	*	*			trans	17.1	133.4	145.4	-71.4	159	-143	0	0	123
231	S	31.7	Very low	28.3	Very low	121 Å²	121	142 Å²	142	85%	0.846	79%	0.785	S	S	*	*				176.6	161.5	123.2	31	0	0	0	0	109.2
232	E	24.2	Very low	28.4	Very low	188 Å²	188	146.2 Å²	146.2	88%	0.879	79%	0.79	S	S	*	*			cis	-125.1	-176.6	5.4	-45.1	171.8	74.1	0	0	109.7
233	S	26.4	Very low	28.4	Very low	108 Å²	108	142.8 Å²	142.8	76%	0.755	78%	0.78	S	S	*	*			cis	-161.5	-175.7	5.9	74.2	0	0	0	0	107.6
234	S	25.7	Very low	28.4	Very low	92 Å²	92	142.6 Å²	142.6	64%	0.643	78%	0.781	S	S	*	*			cis	-164.3	148.8	-9.6	-148	0	0	0	0	109.9
235	R	29.2	Very low	28.7	Very low	236 Å²	236	142.1 Å²	142.1	89%	0.891	78%	0.778	S	S	*	*			trans	64.1	154.5	165	-61.4	173.6	167.3	-176.1	-5.8	116.6
236	S	27.6	Very low	28.7	Very low	103 Å²	103	141 Å²	141	72%	0.72	78%	0.782	S	S	*	*			cis	-150.5	122.8	0.2	-133.6	0	0	0	0	107.8
237	N	27.8	Very low	28.8	Very low	156 Å²	156	135.7 Å²	135.7	83%	0.834	77%	0.771	S	S	*	*				100.4	159.1	89.4	-168.9	28.1	0	0	0	113.5
238	A	30.3	Very low	29.1	Very low	90 Å²	90	141.2 Å²	141.2	74%	0.744	78%	0.777	S	S	*	*			trans	77.3	105.2	175.5	0	0	0	0	0	119.6
239	Q	27.1	Very low	29.2	Very low	180 Å²	180	142.1 Å²	142.1	84%	0.841	77%	0.774	S	S	*	*			trans	-96.5	-172.1	157.4	-82.8	-86.6	-18.1	0	0	109
240	P	45.6	Very low	29.1	Very low	109 Å²	109	141.7 Å²	141.7	71%	0.708	78%	0.781	S	S	*	*			cis	-130.5	-176.1	-15.3	23.7	0.6	0	0	0	113.9
241	G	26.3	Very low	29.2	Very low	74 Å²	74	140 Å²	140	76%	0.763	78%	0.78	S	S	*	*			trans	-173.7	135.3	162.4	0	0	0	0	0	113.3
242	F	29.6	Very low	29.8	Very low	195 Å²	195	139.9 Å²	139.9	86%	0.855	78%	0.776	S	S	*	*			trans	-121.4	142.9	-168.7	-96.5	-83.8	0	0	0	114.9
243	S	27.8	Very low	30	Very low	98 Å²	98	136.9 Å²	136.9	69%	0.685	77%	0.765	S	S	*	*			trans	77.7	141.6	137.9	-70.2	0	0	0	0	123.7
244	Y	28	Very low	30.2	Very low	227 Å²	227	139.2 Å²	139.2	89%	0.89	77%	0.767	S	S	*	*			trans	84.2	147.8	145.7	-109.3	-94.4	0	0	0	121
245	S	33	Very low	30.4	Very low	105 Å²	105	138.8 Å²	138.8	73%	0.734	77%	0.765	S	S	*	*			trans	-115.8	150	-179.9	50.4	0	0	0	0	111.1
246	S	26.5	Very low	30.4	Very low	127 Å²	127	134.6 Å²	134.6	89%	0.888	76%	0.76	S	S	*	*			trans	-156.2	163.2	162.6	-159.5	0	0	0	0	110.4
247	S	27.9	Very low	30.6	Very low	106 Å²	106	132.6 Å²	132.6	74%	0.741	75%	0.746	S	S	*	*			trans	-105.4	167.2	-170.3	54	0	0	0	0	113.6
248	R	32.1	Very low	30.9	Very low	214 Å²	214	133 Å²	133	81%	0.808	74%	0.743	S	S	*	*			trans	-170.9	131.1	134.6	-99.9	-163.7	128.5	141.9	4.4	110.5
249	D	28.3	Very low	31.1	Very low	121 Å²	121	139.1 Å²	139.1	65%	0.647	75%	0.746	S	S	*	*				62.5	129.6	101.9	-63.7	-18.3	0	0	0	112.8
250	E	27.2	Very low	31.3	Very low	187 Å²	187	136.7 Å²	136.7	87%	0.874	74%	0.744	S	S	*	*			cis	-143	-174.6	33.1	-78.7	-164.6	85.5	0	0	115.8
251	T	31.4	Very low	30.4	Very low	102 Å²	102	137.6 Å²	137.6	63%	0.626	75%	0.747	S	S	*	*			trans	-129.9	169.6	171.1	65.5	0	0	0	0	110.1	I253	T251-I253 WeakPolarHBondContact OG1-CD1 3.42Å
252	P	42.6	Very low	30.5	Very low	120 Å²	120	138.9 Å²	138.9	78%	0.779	74%	0.744	S	S	*	*				-137.2	162.6	82.7	20.3	3.1	0	0	0	112.7
253	I	30.2	Very low	30.4	Very low	125 Å²	125	134.1 Å²	134.1	64%	0.641	74%	0.735	S	S	*	*			cis	82.4	119.8	33.6	-51.9	166.3	0	0	0	115	T251	T251-I253 WeakPolarHBondContact OG1-CD1 3.42Å
254	I	28.9	Very low	30.4	Very low	156 Å²	156	137.9 Å²	137.9	80%	0.8	74%	0.742	S	S	*	*				169.2	134.3	125.4	-83.7	169.8	0	0	0	107.5
255	S	29.9	Very low	30.5	Very low	84 Å²	84	138.8 Å²	138.8	59%	0.587	74%	0.744	S	S	*	*			cis	95.1	149.6	24	-69.3	0	0	0	0	115.7
256	N	29.6	Very low	31.5	Very low	148 Å²	148	138.8 Å²	138.8	79%	0.791	74%	0.741	S	S	*	*			cis	-169.5	165.8	-11.2	-97	10.3	0	0	0	107.1
257	S	33.3	Very low	31.4	Very low	61 Å²	61	142.2 Å²	142.2	43%	0.427	74%	0.74	S	S	.	*			cis	-167.8	150.4	-21.3	-171.1	0	0	0	0	110.5	R259	S257-R259 PolarHBondContact O-NH2 3.47Å
258	E	32.5	Very low	31.3	Very low	165 Å²	165	145.8 Å²	145.8	77%	0.771	75%	0.745	S	S	*	*			trans	53.2	150.3	158.5	-67.9	153.4	98.4	0	0	123.1
259	R	34.1	Very low	31.1	Very low	217 Å²	217	144.3 Å²	144.3	82%	0.819	75%	0.747	S	S	*	*			trans	137.3	157.3	138.3	-80.4	154.6	-72	-166	-7.1	115.2	S257	S257-R259 PolarHBondContact O-NH2 3.47Å
260	V	31.7	Very low	31	Very low	129 Å²	129	144 Å²	144	78%	0.782	76%	0.755	S	S	*	*			cis	-171.9	164.4	-44.5	105.8	0	0	0	0	111.8
261	V	27.7	Very low	31.1	Very low	129 Å²	129	139.5 Å²	139.5	78%	0.782	74%	0.744	S	S	*	*			trans	81.5	117.2	160.4	137.9	0	0	0	0	122.3
262	S	28.7	Very low	31.1	Very low	100 Å²	100	141.9 Å²	141.9	70%	0.699	75%	0.753	S	S	*	*			trans	55.7	130.7	135	-156.2	0	0	0	0	125.3
263	S	27.3	Very low	30.5	Very low	95 Å²	95	143 Å²	143	66%	0.664	75%	0.753	S	S	*	*				149.3	131.6	110.2	-81.3	0	0	0	0	118.5
264	Q	27.2	Very low	30.6	Very low	177 Å²	177	146.1 Å²	146.1	83%	0.827	76%	0.764	S	S	*	*			trans	62.1	96	137.7	-59.1	-174	19	0	0	124.3
265	R	29.9	Very low	30.7	Very low	247 Å²	247	141 Å²	141	93%	0.932	75%	0.75	S	S	*	*				58	158.2	116	-88.6	-162.2	172	-175.3	-2.6	124.8
266	P	54.7	Low	31.2	Very low	104 Å²	104	147.3 Å²	147.3	68%	0.675	76%	0.761	S	S	*	*			trans	-119.7	175.8	-170.6	45.3	-33.8	0	0	0	116.2
267	F	23.9	Very low	31.5	Very low	200 Å²	200	151.6 Å²	151.6	88%	0.877	77%	0.766	S	S	*	*			trans	-152.5	167.5	148.6	-92	-76.6	0	0	0	106.7
268	Q	25.6	Very low	31.7	Very low	180 Å²	180	154.7 Å²	154.7	84%	0.841	78%	0.783	S	S	*	*			cis	-147.1	167.9	18.2	-161.2	157.5	-38.7	0	0	112.7
269	E	27.4	Very low	31.9	Very low	183 Å²	183	153 Å²	153	86%	0.855	78%	0.784	S	S	*	*			trans	-119.2	150.7	-177	179.2	176.3	-164.9	0	0	110.7
270	S	26.3	Very low	32.1	Very low	116 Å²	116	153.7 Å²	153.7	81%	0.811	79%	0.786	S	S	*	*			trans	-149.9	120.1	172.8	62.4	0	0	0	0	112.5
271	S	31.3	Very low	32.4	Very low	92 Å²	92	159.3 Å²	159.3	64%	0.643	79%	0.793	S	S	*	*			trans	-82.7	146	169	-175.9	0	0	0	0	110.4
272	D	29.6	Very low	32.8	Very low	152 Å²	152	160.9 Å²	160.9	81%	0.813	80%	0.797	S	S	*	*				179.9	172.4	106.8	-94.1	-21.6	0	0	0	115
273	N	30.8	Very low	33.1	Very low	144 Å²	144	163.3 Å²	163.3	77%	0.77	80%	0.801	S	S	*	*			trans	-94	151.2	-166.5	-62.6	-100	0	0	0	112.6
274	E	33.1	Very low	33.6	Very low	189 Å²	189	163.2 Å²	163.2	88%	0.883	80%	0.8	S	S	*	*				-161.8	158.3	128.9	-167.3	41.4	-111	0	0	110.4
275	G	31.2	Very low	34.3	Very low	48 Å²	48	165.5 Å²	165.5	50%	0.495	80%	0.801	S	S	.	*			trans	-125.9	158.3	-165.2	0	0	0	0	0	118.4
276	R	38.7	Very low	34.5	Very low	217 Å²	217	160.5 Å²	160.5	82%	0.819	79%	0.792	S	S	*	*			trans	55.8	109.8	153.6	-66.1	-176.7	169.6	-166.1	2	119.9
277	R	36.7	Very low	33.3	Very low	239 Å²	239	160.4 Å²	160.4	90%	0.902	80%	0.8	S	S	*	*				-166.5	145.4	127.8	-81.8	122.1	-149	-122.4	13.8	106.8
278	T	36.5	Very low	33.6	Very low	126 Å²	126	156.1 Å²	156.1	77%	0.773	80%	0.795	S	S	*	*			cis	-157.6	152.7	-4.6	12.7	0	0	0	0	109.1
279	T	36.8	Very low	33.8	Very low	130 Å²	130	152.7 Å²	152.7	80%	0.798	79%	0.791	S	S	*	*			trans	-86.4	138.1	173.3	45.7	0	0	0	0	112.7
280	R	39.7	Very low	33.8	Very low	230 Å²	230	152.1 Å²	152.1	87%	0.868	79%	0.79	S	S	*	*			trans	-179.7	105.8	149.3	-111.4	175.2	-74.3	-167.7	-1	114.1
281	R	37.5	Very low	33.8	Very low	247 Å²	247	152 Å²	152	93%	0.932	79%	0.789	S	S	*	*				172.3	154.5	116.5	-94.8	173.8	174.2	170.1	-1.4	111.2
282	L	34.9	Very low	33.7	Very low	163 Å²	163	153.1 Å²	153.1	85%	0.853	80%	0.797	S	S	*	*			trans	-132.3	173.5	179.5	-88.5	165.7	0	0	0	108.8
283	L	36.7	Very low	33.8	Very low	151 Å²	151	151.2 Å²	151.2	79%	0.791	79%	0.791	S	S	*	*			trans	95	93.7	159.8	-52.7	-172.9	0	0	0	119.5
284	S	37.9	Very low	33.8	Very low	93 Å²	93	152.2 Å²	152.2	65%	0.65	79%	0.789	S	S	*	*				69.8	110.6	105.3	-58.8	0	0	0	0	123.1
285	R	41.2	Very low	33.7	Very low	225 Å²	225	152.8 Å²	152.8	85%	0.849	79%	0.789	S	S	*	*				76.9	134	116.2	-77.4	-177.9	173.5	163.4	-0.3	123.1
286	I	34.1	Very low	33.5	Very low	142 Å²	142	155.4 Å²	155.4	73%	0.728	80%	0.799	S	S	*	*			trans	78.9	124.5	139.6	-66.6	162.8	0	0	0	119.7
287	A	29.1	Very low	33.1	Very low	102 Å²	102	156.2 Å²	156.2	84%	0.843	80%	0.802	S	S	*	*			trans	-142.9	144.4	133.9	0	0	0	0	0	108.2
288	S	30.3	Very low	32.8	Very low	110 Å²	110	156.8 Å²	156.8	77%	0.769	80%	0.804	S	S	*	*			trans	-132.7	154.7	-169.6	-50.5	0	0	0	0	111.9
289	S	30.5	Very low	32.4	Very low	108 Å²	108	156 Å²	156	76%	0.755	80%	0.804	S	S	*	*			trans	-162.8	120.9	150.9	-161.8	0	0	0	0	114.8
290	M	26.7	Very low	32.1	Very low	170 Å²	170	154.4 Å²	154.4	84%	0.837	80%	0.798	S	S	*	*			trans	25.5	140.1	140.3	-45.8	-169.5	74.1	0	0	120.4
291	S	26.5	Very low	31.8	Very low	114 Å²	114	152 Å²	152	80%	0.797	80%	0.797	S	S	*	*			cis	-155.3	156.2	40.7	-54.9	0	0	0	0	114.2
292	S	28.3	Very low	31.2	Very low	115 Å²	115	148.4 Å²	148.4	80%	0.804	80%	0.796	S	S	*	*			trans	-148.7	126	173.6	57	0	0	0	0	114.4
293	T	32.7	Very low	31	Very low	113 Å²	113	145.7 Å²	145.7	69%	0.693	79%	0.791	S	S	*	*			trans	-168.9	140.6	168.8	46.2	0	0	0	0	106.9
294	F	31.7	Very low	30.6	Very low	165 Å²	165	147 Å²	147	72%	0.724	80%	0.797	S	S	*	*			cis	-148.5	173.1	-7.8	-99.1	-49.1	0	0	0	106.5
295	F	30	Very low	30.2	Very low	201 Å²	201	150 Å²	150	88%	0.882	81%	0.807	S	S	*	*			cis	-142.8	175.1	36.9	-94.6	-89.3	0	0	0	112.8
296	S	26.1	Very low	29.4	Very low	103 Å²	103	146.4 Å²	146.4	72%	0.72	81%	0.81	S	S	*	*			trans	-90.2	155	-166.8	-57	0	0	0	0	116.1
297	R	31	Very low	29.1	Very low	233 Å²	233	151 Å²	151	88%	0.879	82%	0.818	S	S	*	*			trans	-60.1	161.7	163.1	-55.6	176.9	178.1	-160.5	-2.2	112.5
298	R	30	Very low	28.8	Very low	251 Å²	251	150.7 Å²	150.7	95%	0.947	81%	0.809	S	S	*	*			trans	-137.1	148.2	132.4	-104.7	-175.6	179.8	-96.4	-1.4	110.2
299	S	28.5	Very low	28.7	Very low	109 Å²	109	152.3 Å²	152.3	76%	0.762	81%	0.808	S	S	*	*			trans	-158.7	137.1	-178.8	175.2	0	0	0	0	110.3
300	S	30.9	Very low	28.5	Very low	97 Å²	97	154.1 Å²	154.1	68%	0.678	81%	0.81	S	S	*	*			trans	179.2	103	161.2	50.5	0	0	0	0	105.6
301	Q	33.8	Very low	28.6	Very low	181 Å²	181	150.9 Å²	150.9	85%	0.846	80%	0.804	S	S	*	*				60.1	114.8	90.1	-74.3	-174.6	-36.9	0	0	113.5
302	D	24.8	Very low	28.7	Very low	171 Å²	171	153.3 Å²	153.3	91%	0.914	80%	0.803	S	S	*	*				-156.2	156.3	107.4	-116.8	-32.4	0	0	0	111.1
303	S	29.7	Very low	28.6	Very low	105 Å²	105	154.3 Å²	154.3	73%	0.734	80%	0.799	S	S	*	*			trans	-159.9	120.8	-176	60.7	0	0	0	0	114
304	L	30.1	Very low	28.4	Very low	178 Å²	178	153.7 Å²	153.7	93%	0.932	80%	0.799	S	S	*	*			trans	-142.2	151.5	164.1	-77.4	-179.1	0	0	0	111.5
305	N	27.8	Very low	28.2	Very low	158 Å²	158	154.8 Å²	154.8	85%	0.845	80%	0.8	S	S	*	*			trans	-95.8	152.4	-176.4	-76.4	-86.5	0	0	0	112.7
306	T	25.9	Very low	28.2	Very low	149 Å²	149	149.9 Å²	149.9	91%	0.914	79%	0.786	S	S	*	*			trans	-161	161.2	134.9	12.8	0	0	0	0	113.3
307	R	27.3	Very low	28.2	Very low	239 Å²	239	148.7 Å²	148.7	90%	0.902	78%	0.778	S	S	*	*			trans	-70.7	167.9	173.7	-63.7	176.5	168.7	175.6	-5.5	110.6
308	S	22.4	Very low	28.1	Very low	94 Å²	94	143.8 Å²	143.8	66%	0.657	78%	0.776	S	S	*	*			cis	-174.2	146.9	38.8	-157.3	0	0	0	0	114.7
309	L	28.2	Very low	28.1	Very low	144 Å²	144	137.7 Å²	137.7	75%	0.754	75%	0.753	S	S	*	*			trans	45.7	147	144.3	-70	170	0	0	0	123.7
310	N	26.5	Very low	28.3	Very low	146 Å²	146	139.2 Å²	139.2	78%	0.781	75%	0.751	S	S	*	*			trans	72.3	149.8	159.4	-60	-6.6	0	0	0	117.3
311	S	29.2	Very low	28.2	Very low	103 Å²	103	140.4 Å²	140.4	72%	0.72	75%	0.75	S	S	*	*			cis	-165.2	159.7	-17.5	46.6	0	0	0	0	110.7
312	E	28.1	Very low	28.1	Very low	164 Å²	164	137.3 Å²	137.3	77%	0.766	74%	0.743	S	S	*	*			trans	10	139.5	154	-88.9	177.8	77.2	0	0	122.9
313	N	26.9	Very low	28.3	Very low	136 Å²	136	133.9 Å²	133.9	73%	0.727	74%	0.739	S	S	*	*			trans	69.1	151.7	150.9	-61.8	-37.7	0	0	0	117.6
314	S	27.7	Very low	28.5	Very low	100 Å²	100	133 Å²	133	70%	0.699	73%	0.733	S	S	*	*			cis	-162.7	166.3	-17.8	52.8	0	0	0	0	111.7
315	Y	27.5	Very low	28.8	Very low	189 Å²	189	133 Å²	133	74%	0.741	73%	0.728	S	S	*	*			trans	55.2	108.4	150.8	-106.9	-115.4	0	0	0	123.8
316	V	29.1	Very low	29	Very low	97 Å²	97	129.7 Å²	129.7	59%	0.588	72%	0.717	S	S	*	*				63.6	118.1	125.1	-178.3	0	0	0	0	122.3
317	S	27.3	Very low	29.4	Very low	79 Å²	79	133.9 Å²	133.9	55%	0.552	72%	0.716	S	S	*	*			trans	12.8	135.6	142.8	-50.2	0	0	0	0	123
318	P	28.3	Very low	29.6	Very low	130 Å²	130	126.8 Å²	126.8	84%	0.844	70%	0.703	S	S	*	*			trans	-99.6	154.2	158.4	37.3	-31.7	0	0	0	114
319	R	30.4	Very low	30.1	Very low	122 Å²	122	129.3 Å²	129.3	46%	0.46	71%	0.709	S	S	.	*			trans	-146.9	111.3	150.7	-178.9	177.5	-77.2	176.3	-5.5	113.1	S214 S215	S214-R319 PolarHBondContact O-NH1 3.3Å; S214-R319 PolarHBondContact O-NH2 2.84Å; S214-R319 PolarHBondContact OG-NH2 3.24Å; S215-R319 PolarHBondContact OG-NH1 2.91Å; S215-R319 PolarHBondContact OG-NH2 3.1Å
320	I	31.5	Very low	30.6	Very low	141 Å²	141	128.7 Å²	128.7	72%	0.723	71%	0.711	S	S	*	*			trans	18.3	118.6	135.8	-50.7	176.1	0	0	0	118.3
321	L	29.4	Very low	31.6	Very low	123 Å²	123	126.8 Å²	126.8	64%	0.644	71%	0.707	S	S	*	*			trans	-94.3	127.5	144.2	-66.4	169.3	0	0	0	106.7	F62	F62-L321 HydrophobicContact CD2-CD1 3.98Å; F62-L321 HydrophobicContact CE2-CD1 3.77Å; F62-L321 HydrophobicContact CE2-CG 4.02Å; F62-L321 HydrophobicContact CZ-CD1 4.33Å; F62-L321 HydrophobicContact CZ-CG 4.28Å
322	T	32	Very low	31.7	Very low	115 Å²	115	126.9 Å²	126.9	71%	0.706	71%	0.707	S	S	*	*				64.4	107.6	65.1	68.9	0	0	0	0	115.6
323	A	30.1	Very low	31.8	Very low	99 Å²	99	125 Å²	125	82%	0.818	71%	0.707	S	S	*	*			trans	-161.5	148.4	159.7	0	0	0	0	0	110.4
324	S	32.7	Very low	31.9	Very low	87 Å²	87	123.4 Å²	123.4	61%	0.608	71%	0.706	S	S	*	*			cis	-170.9	166	-21.6	65.8	0	0	0	0	111.4
325	Q	36.3	Very low	31.9	Very low	178 Å²	178	127.1 Å²	127.1	83%	0.832	71%	0.713	S	S	*	*			trans	75.4	145.1	151	-73	174.4	99.8	0	0	119.9
326	S	33.3	Very low	32.3	Very low	88 Å²	88	124.5 Å²	124.5	62%	0.615	72%	0.716	S	S	*	*			cis	-168.5	154.3	-8.5	53.6	0	0	0	0	115.7
327	R	33.4	Very low	33.4	Very low	238 Å²	238	124.8 Å²	124.8	90%	0.898	72%	0.72	S	S	*	*			trans	71.3	146.2	153.4	-73.9	171.6	179.9	-161.9	-1	118.3
328	S	32.3	Very low	33.8	Very low	90 Å²	90	127.4 Å²	127.4	63%	0.629	73%	0.728	S	S	*	*			cis	-168	157.5	-6.7	43.4	0	0	0	0	114
329	N	31.8	Very low	34	Very low	146 Å²	146	125.8 Å²	125.8	78%	0.781	71%	0.712	S	S	*	*			trans	76	121.6	166.2	-51.1	-14.8	0	0	0	117.1
330	V	38.2	Very low	34.2	Very low	132 Å²	132	130.7 Å²	130.7	80%	0.8	73%	0.731	S	S	*	*			cis	86.2	130.3	33.9	175.9	0	0	0	0	113.1
331	P	48.3	Very low	34.1	Very low	106 Å²	106	128.1 Å²	128.1	69%	0.688	73%	0.731	S	S	*	*			cis	-141.6	-167.8	-17	40.8	-21	0	0	0	116.6
332	S	32.3	Very low	34.4	Very low	104 Å²	104	127.5 Å²	127.5	73%	0.727	74%	0.736	S	S	*	*			trans	74	151.3	152.4	-62.8	0	0	0	0	119.2
333	T	29.8	Very low	34.3	Very low	126 Å²	126	130.7 Å²	130.7	77%	0.773	74%	0.743	S	S	*	*			cis	-158.5	133.8	-8.4	15.4	0	0	0	0	107.2
334	S	28.8	Very low	34.3	Very low	101 Å²	101	131 Å²	131	71%	0.706	75%	0.746	S	S	*	*				82.4	147.3	91.4	-154.6	0	0	0	0	117.1
335	E	27.7	Very low	34.4	Very low	178 Å²	178	132 Å²	132	83%	0.832	75%	0.753	S	S	*	*			trans	91.9	155.3	160.7	-46.9	-158.3	173.2	0	0	122
336	V	36.2	Very low	34.3	Very low	134 Å²	134	133.2 Å²	133.2	81%	0.812	76%	0.759	S	S	*	*			trans	-175.8	163.4	-142.1	158.8	0	0	0	0	105.7
337	P	52.5	Low	34	Very low	103 Å²	103	132.6 Å²	132.6	67%	0.669	77%	0.766	S	S	*	*			cis	-131.8	-169.9	-1.5	26.9	-0.8	0	0	0	115.4
338	D	34.3	Very low	34.1	Very low	135 Å²	135	131.5 Å²	131.5	72%	0.722	77%	0.768	S	S	*	*				125.3	151.9	107.3	-129.7	-7.6	0	0	0	123.7
339	N	32.8	Very low	34.1	Very low	95 Å²	95	137.3 Å²	137.3	51%	0.508	78%	0.776	S	S	.	*			trans	79.6	103	149.7	-80.3	-65.8	0	0	0	125.5
340	R	35.8	Very low	34.1	Very low	226 Å²	226	138.3 Å²	138.3	85%	0.853	77%	0.774	S	S	*	*				89.5	158.9	114.6	-92.4	-177.1	169.9	108.4	-9.1	125
341	A	28.1	Very low	34.1	Very low	87 Å²	87	140.6 Å²	140.6	72%	0.719	78%	0.78	S	S	*	*			trans	73.4	132.2	178.5	0	0	0	0	0	115.7
342	S	35.5	Very low	33.3	Very low	109 Å²	109	146.5 Å²	146.5	76%	0.762	79%	0.789	S	S	*	*			cis	74.7	133	40	-56.7	0	0	0	0	112.8
343	E	31.3	Very low	33.5	Very low	183 Å²	183	152.9 Å²	152.9	86%	0.855	80%	0.797	S	S	*	*			cis	-162.2	177.3	7.5	-132.9	173.4	139.5	0	0	112.8
344	A	29.8	Very low	33.5	Very low	106 Å²	106	158.7 Å²	158.7	88%	0.876	81%	0.805	S	S	*	*			trans	69.4	167.7	161.4	0	0	0	0	0	119.6
345	S	34.2	Very low	33.5	Very low	108 Å²	108	166.1 Å²	166.1	76%	0.755	82%	0.817	S	S	*	*			trans	-142.1	153.1	-162.3	58.9	0	0	0	0	113.6
346	Q	34.3	Very low	33.5	Very low	203 Å²	203	161.3 Å²	161.3	95%	0.949	82%	0.816	S	S	*	*			trans	-173.8	147.2	156.1	-112.7	161.5	75.8	0	0	114.2
347	G	27.4	Very low	33.3	Very low	74 Å²	74	163.1 Å²	163.1	76%	0.763	82%	0.82	S	S	*	*			trans	85.9	87.7	142.2	0	0	0	0	0	120.3	R349	G347-R349 PolarHBondContact O-N 3.15Å
348	F	34.4	Very low	32.1	Very low	215 Å²	215	164.3 Å²	164.3	94%	0.943	83%	0.831	S	S	*	*			trans	-65.4	116	153.6	-76.1	-94.2	0	0	0	110.5
349	R	31.9	Very low	31.8	Very low	213 Å²	213	163.5 Å²	163.5	80%	0.804	84%	0.836	S	S	*	*			trans	-146.6	118.1	158.8	-80.6	-152.7	146.9	115.6	7.7	115.7	G347	G347-R349 PolarHBondContact O-N 3.15Å
350	F	31.8	Very low	31.4	Very low	166 Å²	166	167.3 Å²	167.3	73%	0.728	86%	0.855	S	S	*	*			trans	64.3	106.8	150.8	-55.4	-52.6	0	0	0	121.8
351	L	38	Very low	31.1	Very low	180 Å²	180	160.9 Å²	160.9	94%	0.942	85%	0.845	S	S	*	*			trans	-68.3	120.1	142.3	-70.3	169.4	0	0	0	110.1
352	R	33.5	Very low	31.2	Very low	230 Å²	230	164.3 Å²	164.3	87%	0.868	85%	0.846	S	S	*	*			trans	-147.4	139.1	156	-157.8	170.8	-72.4	-127.2	3.7	111.7
353	R	34.9	Very low	30.9	Very low	239 Å²	239	164.1 Å²	164.1	90%	0.902	84%	0.836	S	S	*	*			trans	-70.3	150.9	-173.7	-59.1	170	-90.6	-175	-7.7	112.8
354	R	31.2	Very low	30.9	Very low	247 Å²	247	163 Å²	163	93%	0.932	83%	0.83	S	S	*	*				-170.7	158.8	107.7	-133.2	174	-175.6	166.3	2.4	114.8
355	W	28.5	Very low	30.9	Very low	257 Å²	257	162.7 Å²	162.7	97%	0.973	82%	0.822	S	S	*	*			trans	-65.3	156.8	165.4	-75	-46.2	0	0	0	113.3
356	G	27.1	Very low	30.9	Very low	77 Å²	77	162.9 Å²	162.9	79%	0.794	82%	0.823	S	S	*	*			trans	-150.7	139.8	156.7	0	0	0	0	0	110.8
357	L	32.8	Very low	30.7	Very low	172 Å²	172	162.2 Å²	162.2	90%	0.901	82%	0.82	S	S	*	*			trans	-117.7	137.3	173.1	-74.8	169.6	0	0	0	108.9
358	S	26.4	Very low	30.8	Very low	129 Å²	129	163.9 Å²	163.9	90%	0.902	82%	0.82	S	S	*	*			trans	-175.3	155.9	146	-85.9	0	0	0	0	112
359	S	27.4	Very low	30.7	Very low	117 Å²	117	161 Å²	161	82%	0.818	82%	0.815	S	S	*	*			trans	-104.4	156.1	-168	-44.8	0	0	0	0	113.6
360	L	26.3	Very low	30.9	Very low	175 Å²	175	155.5 Å²	155.5	92%	0.916	81%	0.809	S	S	*	*			trans	-151.6	151.6	156.3	-120.5	71.7	0	0	0	105.3
361	S	27.7	Very low	30.9	Very low	91 Å²	91	156 Å²	156	64%	0.636	81%	0.813	S	S	*	*			cis	162.9	156.3	-22.1	-178.4	0	0	0	0	104.6
362	H	30.1	Very low	30.4	Very low	160 Å²	160	153 Å²	153	74%	0.741	80%	0.798	S	S	*	*			trans	72.2	150.7	173.4	-78.9	51.6	0	0	0	119.1
363	N	29.6	Very low	30.1	Very low	104 Å²	104	149.9 Å²	149.9	56%	0.556	79%	0.791	S	S	*	*			cis	-175.3	155.5	-36.7	-123.5	-24.1	0	0	0	111.3
364	H	32.3	Very low	29.8	Very low	160 Å²	160	144.8 Å²	144.8	74%	0.741	78%	0.782	S	S	*	*			trans	62.6	143.2	163.3	-51.2	-45	0	0	0	117.9
365	S	29	Very low	29.7	Very low	100 Å²	100	142.4 Å²	142.4	70%	0.699	78%	0.781	S	S	*	*			cis	-156.8	-159.5	-17.1	-77.9	0	0	0	0	106.3
366	S	33.5	Very low	29.7	Very low	112 Å²	112	138.1 Å²	138.1	78%	0.783	77%	0.772	S	S	*	*			cis	-160.4	-178.6	14.5	-58.2	0	0	0	0	110.7
367	E	30.6	Very low	29.9	Very low	189 Å²	189	140.1 Å²	140.1	88%	0.883	77%	0.774	S	S	*	*			trans	-78.2	174.1	170.9	-66.3	139.5	118.1	0	0	112.9
368	S	31	Very low	29.8	Very low	109 Å²	109	141.3 Å²	141.3	76%	0.762	78%	0.775	S	S	*	*			cis	-155.1	-176.9	27.3	63.7	0	0	0	0	115.6
369	D	31.6	Very low	30	Very low	154 Å²	154	138.8 Å²	138.8	82%	0.824	77%	0.77	S	S	*	*			trans	-56.1	172.1	-178	-53.1	-89.3	0	0	0	116.5
370	S	34.8	Very low	30.3	Very low	98 Å²	98	144.3 Å²	144.3	69%	0.685	77%	0.773	S	S	*	*			cis	-164.5	153.9	32.5	59.6	0	0	0	0	117.3
371	E	31.9	Very low	30.3	Very low	175 Å²	175	144 Å²	144	82%	0.818	77%	0.772	S	S	*	*			trans	61.4	112.6	155.5	-65.7	-171.9	116.2	0	0	120.6
372	N	29.2	Very low	30.5	Very low	117 Å²	117	146.3 Å²	146.3	63%	0.626	78%	0.782	S	S	*	*				89.7	108.1	79.2	-157	12.4	0	0	0	112.4
373	F	27.4	Very low	30.6	Very low	165 Å²	165	141.9 Å²	141.9	72%	0.724	78%	0.78	S	S	*	*				-164.7	145.9	78.8	-117.5	-92.4	0	0	0	114.7
374	N	27.7	Very low	31	Very low	132 Å²	132	143.3 Å²	143.3	71%	0.706	80%	0.795	S	S	*	*			trans	33.9	112	157.4	-69.7	-0.1	0	0	0	122.2
375	Q	29.8	Very low	30.9	Very low	197 Å²	197	146.6 Å²	146.6	92%	0.921	80%	0.801	S	S	*	*				-152.1	163.1	102.7	-159.5	147.2	88.8	0	0	110.3
376	E	27.7	Very low	31.1	Very low	168 Å²	168	150 Å²	150	79%	0.785	81%	0.811	S	S	*	*			trans	-99.8	146.9	-150.9	-67.4	164.4	93.5	0	0	117.3
377	S	31.4	Very low	30.8	Very low	119 Å²	119	150.3 Å²	150.3	83%	0.832	81%	0.813	S	S	*	*			trans	69.2	125.7	148.6	-60.9	0	0	0	0	121.1
378	E	31.1	Very low	30.7	Very low	196 Å²	196	146.9 Å²	146.9	92%	0.916	81%	0.809	S	S	*	*			trans	-75.4	154.8	176.7	-59.1	166.5	79.6	0	0	114
379	G	29.9	Very low	30.8	Very low	77 Å²	77	146.9 Å²	146.9	79%	0.794	81%	0.809	S	S	*	*			trans	-148.1	10.5	-176.9	0	0	0	0	0	118.3
380	R	33.1	Very low	31.1	Very low	233 Å²	233	147.5 Å²	147.5	88%	0.879	81%	0.812	S	S	*	*			trans	47.3	94.7	172.4	-63.9	-175.6	174.8	-141.7	-4.7	117.3	T382	R380-T382 PolarHBondContact O-N 3.34Å
381	N	26.5	Very low	31.1	Very low	169 Å²	169	154 Å²	154	90%	0.904	82%	0.821	S	S	*	*			trans	-68.2	128.4	166.4	-82.7	-55.3	0	0	0	112.4
382	T	32.3	Very low	31.2	Very low	138 Å²	138	153.2 Å²	153.2	85%	0.847	82%	0.822	S	S	*	*			trans	-139.7	139.9	162.2	52.3	0	0	0	0	110.4	R380	R380-T382 PolarHBondContact O-N 3.34Å
383	G	31.3	Very low	31.4	Very low	67 Å²	67	159.3 Å²	159.3	69%	0.691	84%	0.837	S	S	*	*	S	Bend	trans	95.2	153.8	170.3	0	0	0	0	0	115.8
384	P	38.3	Very low	31.7	Very low	134 Å²	134	157.7 Å²	157.7	87%	0.87	84%	0.844	S	S	*	*			trans	-89.4	146.5	-168.5	-5.2	25.9	0	0	0	113.4
385	W	29.9	Very low	32.3	Very low	229 Å²	229	157.6 Å²	157.6	87%	0.867	85%	0.849	S	S	*	*			trans	-79.6	122.6	167.4	-76.7	47.9	0	0	0	111
386	L	33	Very low	32.6	Very low	173 Å²	173	154.2 Å²	154.2	91%	0.906	84%	0.844	S	S	*	*			trans	-157.3	101.8	134.2	-92.3	-166.7	0	0	0	109.2
387	S	28.7	Very low	32.7	Very low	118 Å²	118	153.8 Å²	153.8	83%	0.825	85%	0.846	S	S	*	*	P	Polyproline II helix	trans	-74.8	129.3	177.3	-64.4	0	0	0	0	111.4
388	S	28.8	Very low	32.7	Very low	117 Å²	117	158.1 Å²	158.1	82%	0.818	85%	0.85	S	S	*	*	P	Polyproline II helix	trans	-71.3	134.8	168.9	-38.9	0	0	0	0	110.9
389	S	32.5	Very low	32.7	Very low	108 Å²	108	153.7 Å²	153.7	76%	0.755	84%	0.841	S	S	*	*	P	Polyproline II helix	trans	-103.4	168.4	154.9	-169.5	0	0	0	0	109.6
390	L	36.7	Very low	32.8	Very low	168 Å²	168	161.1 Å²	161.1	88%	0.88	85%	0.845	S	S	*	*			trans	66.8	41.2	177.9	-53.1	-179.7	0	0	0	117.1	N392	L390-N392 PolarHBondContact O-N 3.05Å
391	R	36.3	Very low	32.8	Very low	235 Å²	235	160.6 Å²	160.6	89%	0.887	84%	0.843	S	S	*	*			trans	-79.1	101.6	145.4	-89.1	-171	175.2	-118	-0.6	109.5
392	N	33.2	Very low	33	Very low	157 Å²	157	163.3 Å²	163.3	84%	0.84	84%	0.841	S	S	*	*			trans	-169.2	89.8	152.1	-107.1	-24.2	0	0	0	113.9	L390	L390-N392 PolarHBondContact O-N 3.05Å
393	R	33.1	Very low	33.1	Very low	245 Å²	245	167.6 Å²	167.6	93%	0.925	84%	0.841	S	S	*	*	S	Bend	trans	168.3	95.9	137.1	-93.9	167.2	-169.5	-162.4	4.4	111.3
394	C	35.2	Very low	33.3	Very low	131 Å²	131	172.8 Å²	172.8	89%	0.885	85%	0.848	S	S	*	*			trans	173.5	123.1	141.4	-98.2	0	0	0	0	108.7
395	T	38.5	Very low	33.1	Very low	131 Å²	131	169.9 Å²	169.9	80%	0.804	84%	0.842	S	S	*	*			trans	-110.6	115.2	-178.8	47.2	0	0	0	0	110.7
396	P	37.4	Very low	33.2	Very low	125 Å²	125	169.8 Å²	169.8	81%	0.812	84%	0.841	S	S	*	*			trans	-76.1	148.8	165.5	32.8	-33.1	0	0	0	110.2
397	L	30.1	Very low	33.2	Very low	159 Å²	159	167.9 Å²	167.9	83%	0.832	83%	0.832	S	S	*	*			trans	-116.2	106	173.4	-72.6	178.7	0	0	0	110.7
398	F	29.9	Very low	33.3	Very low	210 Å²	210	172.1 Å²	172.1	92%	0.921	84%	0.839	S	S	*	*			trans	-136.3	137.7	152	-96.9	-73	0	0	0	111.6
399	S	31.9	Very low	33.5	Very low	103 Å²	103	171.5 Å²	171.5	72%	0.72	84%	0.835	S	S	*	*			trans	-44.7	139.7	-176.1	53.6	0	0	0	0	117.5
400	R	33.1	Very low	33.4	Very low	233 Å²	233	169.7 Å²	169.7	88%	0.879	82%	0.822	S	S	*	*				-164.2	119.8	120.2	-110.6	175.7	-174.6	-154.7	2.4	115.3
401	R	31.1	Very low	33.2	Very low	222 Å²	222	171.6 Å²	171.6	84%	0.838	82%	0.818	S	S	*	*				27.8	118.2	127.2	-175.7	-172.9	-66.5	-105.9	2.3	118.1
402	R	31.5	Very low	32.8	Very low	226 Å²	226	168.1 Å²	168.1	85%	0.853	82%	0.815	S	S	*	*			trans	-111	160.4	152.4	-139	-177.8	-158.6	-155.2	7.5	110.7
403	R	35.4	Very low	32.4	Very low	229 Å²	229	165.2 Å²	165.2	86%	0.864	81%	0.807	S	S	*	*			trans	-116.2	134.4	175.4	-74.3	-178.4	172.8	-152.1	2.7	110.1
404	E	35.2	Very low	32.2	Very low	175 Å²	175	159 Å²	159	82%	0.818	80%	0.797	S	S	*	*			trans	-150.9	146.6	150.6	-59	-176.5	-167	0	0	105.6
405	G	32.9	Very low	32	Very low	73 Å²	73	157.6 Å²	157.6	75%	0.753	79%	0.788	S	S	*	*			cis	179	134.3	-13.3	0	0	0	0	0	111.8
406	R	32.1	Very low	31.4	Very low	227 Å²	227	158 Å²	158	86%	0.857	79%	0.785	S	S	*	*			trans	66.5	114.3	156.5	-147.9	171.9	-161.8	160.1	3.5	121.7
407	D	33	Very low	31	Very low	134 Å²	134	157.9 Å²	157.9	72%	0.717	78%	0.782	S	S	*	*			trans	30.8	114	138.3	-33.2	-30.2	0	0	0	121.7
408	E	32.1	Very low	30.9	Very low	206 Å²	206	155.7 Å²	155.7	96%	0.963	78%	0.78	S	S	*	*				-147.1	179.6	129.7	-143	176	106.4	0	0	110.3
409	S	31.5	Very low	30.8	Very low	105 Å²	105	150.9 Å²	150.9	73%	0.734	77%	0.773	S	S	*	*			trans	-126	153.7	-143.2	-167.3	0	0	0	0	117.4
410	S	31.5	Very low	30.7	Very low	70 Å²	70	156.6 Å²	156.6	49%	0.49	78%	0.779	S	S	.	*			trans	103.3	130.7	138.1	84.3	0	0	0	0	121.2
411	R	31.9	Very low	30.5	Very low	208 Å²	208	148.9 Å²	148.9	79%	0.785	76%	0.76	S	S	*	*			trans	90.9	119.9	143.2	-65	151.2	-175	139.5	-9.8	121.8
412	I	28.4	Very low	30.4	Very low	161 Å²	161	145.4 Å²	145.4	83%	0.826	75%	0.754	S	S	*	*				52.7	140.6	116.9	-57.3	167.3	0	0	0	118.5
413	S	24.8	Very low	30.3	Very low	96 Å²	96	140.9 Å²	140.9	67%	0.671	75%	0.745	S	S	*	*			cis	-177.7	-167.1	-19	-167.4	0	0	0	0	108.5
414	T	29.2	Very low	29.9	Very low	116 Å²	116	138.8 Å²	138.8	71%	0.712	74%	0.742	S	S	*	*			trans	58.9	94	157.9	56	0	0	0	0	120.6
415	S	30.1	Very low	29.4	Very low	100 Å²	100	141.3 Å²	141.3	70%	0.699	74%	0.744	S	S	*	*				29	133.6	111.9	65.7	0	0	0	0	122.9
416	D	26.6	Very low	29.2	Very low	140 Å²	140	147.3 Å²	147.3	75%	0.749	74%	0.744	S	S	*	*				107.1	146.5	120.9	-115.3	-40.2	0	0	0	124
417	T	28.8	Very low	28.9	Very low	122 Å²	122	143.5 Å²	143.5	75%	0.748	74%	0.736	S	S	*	*			trans	55.7	131.1	166	59.7	0	0	0	0	119.2
418	S	27.8	Very low	28.9	Very low	113 Å²	113	142.1 Å²	142.1	79%	0.79	74%	0.737	S	S	*	*			cis	88.2	102.1	27.9	-165.9	0	0	0	0	116.3
419	S	28.3	Very low	28.8	Very low	110 Å²	110	138.6 Å²	138.6	77%	0.769	73%	0.725	S	S	*	*			trans	-171.1	133	150.1	-84	0	0	0	0	109.3
420	R	28.8	Very low	28.6	Very low	222 Å²	222	141.4 Å²	141.4	84%	0.838	73%	0.726	S	S	*	*			cis	84.2	124.8	47.8	-174.1	179.7	-172.4	-172.7	2.8	111
421	S	29.1	Very low	28.6	Very low	71 Å²	71	143.5 Å²	143.5	50%	0.497	74%	0.736	S	S	.	*			cis	176.2	175.7	-3.7	49.5	0	0	0	0	112.2
422	H	30	Very low	28.5	Very low	150 Å²	150	139.3 Å²	139.3	69%	0.694	73%	0.733	S	S	*	*			trans	72.8	159.7	150.1	-62.1	-35	0	0	0	119.1
423	I	29.6	Very low	28.3	Very low	130 Å²	130	139.6 Å²	139.6	67%	0.667	73%	0.731	S	S	*	*			cis	-163.5	152.9	-40.5	-129.3	174.4	0	0	0	111.5
424	F	27.3	Very low	28.6	Very low	186 Å²	186	141.6 Å²	141.6	82%	0.816	73%	0.733	S	S	*	*			trans	13	138.1	166.9	-61.9	-72.7	0	0	0	124.6
425	R	24.3	Very low	28.6	Very low	227 Å²	227	144.1 Å²	144.1	86%	0.857	74%	0.737	S	S	*	*				-173.2	148.2	118.4	-109.6	177.3	-173.6	-178.2	4.3	118.3
426	R	27.9	Very low	28.6	Very low	199 Å²	199	143.4 Å²	143.4	75%	0.751	74%	0.737	S	S	*	*			trans	32.6	129.5	147.1	-80.2	-163.4	155.2	134.7	3.6	122.5
427	E	27.1	Very low	28.7	Very low	148 Å²	148	145 Å²	145	69%	0.692	74%	0.74	S	S	*	*				96.9	139.6	51.9	-174.8	174.7	-145.2	0	0	114.5
428	S	31.7	Very low	28.5	Very low	105 Å²	105	146.9 Å²	146.9	73%	0.734	75%	0.746	S	S	*	*			trans	86.1	119.8	162	63.2	0	0	0	0	124
429	N	29.4	Very low	28.6	Very low	131 Å²	131	148.5 Å²	148.5	70%	0.701	75%	0.745	S	S	*	*			trans	57.7	134.2	132.6	-73.7	35.6	0	0	0	126.8
430	E	29.2	Very low	30.2	Very low	165 Å²	165	147.8 Å²	147.8	77%	0.771	74%	0.738	S	S	*	*			trans	64.6	157.7	132.6	-65.2	179.6	108.4	0	0	120.6
431	V	31.2	Very low	30.2	Very low	114 Å²	114	145.6 Å²	145.6	69%	0.691	74%	0.742	S	S	*	*			cis	-159.5	146.4	-19.8	127.8	0	0	0	0	110.1
432	V	28.5	Very low	30	Very low	120 Å²	120	146.1 Å²	146.1	73%	0.727	76%	0.759	S	S	*	*			trans	15.6	127.3	153.2	-171.2	0	0	0	0	121.2
433	H	24.2	Very low	30	Very low	166 Å²	166	144 Å²	144	77%	0.769	77%	0.767	S	S	*	*				-176.4	169.6	102.2	-146.7	-88.2	0	0	0	114.2
434	L	32.8	Very low	30	Very low	139 Å²	139	142.6 Å²	142.6	73%	0.728	78%	0.775	S	S	*	*			trans	-102	167.5	178.6	-74	149.4	0	0	0	114.3
435	E	28.1	Very low	30.3	Very low	169 Å²	169	138 Å²	138	79%	0.79	77%	0.771	S	S	*	*			trans	99.5	168.7	136.7	-100.7	176.8	118.2	0	0	123.8
436	A	29.2	Very low	30.6	Very low	85 Å²	85	134.4 Å²	134.4	70%	0.702	77%	0.769	S	S	*	*			trans	68.8	113.7	-170.9	0	0	0	0	0	116
437	Q	29.6	Very low	31.1	Very low	172 Å²	172	135.6 Å²	135.6	80%	0.804	77%	0.773	S	S	*	*				66.7	123.8	61.4	-67.9	-168.9	1.6	0	0	115.3
438	N	24.4	Very low	32.9	Very low	163 Å²	163	133.9 Å²	133.9	87%	0.872	78%	0.775	S	S	*	*				-174	149.8	115.8	-98.7	-72.3	0	0	0	112
439	D	30.9	Very low	32.9	Very low	147 Å²	147	137 Å²	137	79%	0.786	78%	0.778	S	S	*	*			trans	-113.1	-171.1	174.7	-124.7	-40.1	0	0	0	107.1
440	P	60.8	Low	33.1	Very low	95 Å²	95	134.2 Å²	134.2	62%	0.617	77%	0.773	S	S	*	*			cis	-137.7	-162.7	-12.8	27.8	-1.5	0	0	0	114.4
441	L	28.4	Very low	33.3	Very low	176 Å²	176	131.7 Å²	131.7	92%	0.921	77%	0.774	S	S	*	*			trans	83.5	129.4	158	-56.4	173.4	0	0	0	119.7
442	G	25.4	Very low	33.4	Very low	82 Å²	82	131 Å²	131	85%	0.845	78%	0.78	S	S	*	*			trans	160.7	148.7	166.3	0	0	0	0	0	113.4
443	A	31	Very low	33.7	Very low	106 Å²	106	129.1 Å²	129.1	88%	0.876	78%	0.777	S	S	*	*			trans	-145.6	170.4	-178.8	0	0	0	0	0	113.5
444	A	29.3	Very low	34.3	Very low	99 Å²	99	126.7 Å²	126.7	82%	0.818	78%	0.779	S	S	*	*			trans	88.1	95.2	165.3	0	0	0	0	0	120.8
445	A	33.7	Very low	34.4	Very low	89 Å²	89	124.8 Å²	124.8	74%	0.736	78%	0.777	S	S	*	*			trans	42	121.6	130.2	0	0	0	0	0	123.2
446	N	30	Very low	34.8	Very low	152 Å²	152	122.3 Å²	122.3	81%	0.813	78%	0.779	S	S	*	*				179.5	130.9	104.7	-102	-76.3	0	0	0	115.2
447	R	38.5	Very low	35.1	Very low	225 Å²	225	122.4 Å²	122.4	85%	0.849	78%	0.779	S	S	*	*			trans	43.3	145.8	136.4	-169.7	173.7	-174.2	160.1	2.6	121.6
448	P	63.7	Low	35.2	Very low	112 Å²	112	120.4 Å²	120.4	73%	0.727	78%	0.779	S	S	*	*			cis	-109	-156.5	-6.2	31.2	-10.3	0	0	0	110.8
449	Q	32	Very low	35.6	Very low	169 Å²	169	119.2 Å²	119.2	79%	0.79	78%	0.778	S	S	*	*			cis	-133	169.2	1.8	-98.8	-164.2	-138.7	0	0	108.8
450	A	34.3	Very low	35.5	Very low	74 Å²	74	116.4 Å²	116.4	61%	0.612	78%	0.784	S	S	*	*			cis	93.9	113.8	19.4	0	0	0	0	0	114.9
451	S	33	Very low	33.8	Very low	111 Å²	111	115.8 Å²	115.8	78%	0.776	79%	0.794	S	S	*	*			cis	-144.1	130.1	19.5	-59.6	0	0	0	0	111.7
452	A	32.6	Very low	33.9	Very low	100 Å²	100	112.6 Å²	112.6	83%	0.826	79%	0.787	S	S	*	*				87.4	143.9	90.1	0	0	0	0	0	114.5
453	A	35	Very low	34	Very low	81 Å²	81	114.9 Å²	114.9	67%	0.669	79%	0.785	S	S	*	*			cis	-164.6	145.4	-13.8	0	0	0	0	0	111.9
454	S	37.1	Very low	34	Very low	115 Å²	115	115.6 Å²	115.6	80%	0.804	78%	0.783	S	S	*	*				49.6	157.7	128.5	-45.2	0	0	0	0	121.9
455	S	35.8	Very low	33.9	Very low	99 Å²	99	118.6 Å²	118.6	69%	0.692	79%	0.785	S	S	*	*			cis	-168.3	133.7	1.7	17.7	0	0	0	0	108.2
456	S	35.8	Very low	33.6	Very low	117 Å²	117	120.3 Å²	120.3	82%	0.818	79%	0.792	S	S	*	*				53.3	137.4	84.8	72.7	0	0	0	0	116.4
457	A	36.1	Very low	33.9	Very low	86 Å²	86	117.5 Å²	117.5	71%	0.711	79%	0.79	S	S	*	*			cis	-171.8	-153.3	-5.1	0	0	0	0	0	111
458	T	30.5	Very low	33.6	Very low	131 Å²	131	116.5 Å²	116.5	80%	0.804	80%	0.795	S	S	*	*			trans	91.6	150.2	170.7	75.6	0	0	0	0	118.1
459	T	34.3	Very low	32	Very low	138 Å²	138	115.1 Å²	115.1	85%	0.847	80%	0.801	S	S	*	*			cis	-167.2	143.7	-34.2	33.6	0	0	0	0	112.1
460	G	28.3	Very low	31.7	Very low	88 Å²	88	110.4 Å²	110.4	91%	0.907	80%	0.798	S	S	*	*			trans	91.5	150.7	144.6	0	0	0	0	0	120.5
461	G	26	Very low	31.8	Very low	81 Å²	81	117.9 Å²	117.9	84%	0.835	81%	0.81	S	S	*	*			trans	151.9	127.8	170.7	0	0	0	0	0	114.5
462	S	29.3	Very low	31.8	Very low	110 Å²	110	120.5 Å²	120.5	77%	0.769	82%	0.815	S	S	*	*			trans	-110.8	161.3	-163.3	-56.6	0	0	0	0	116.7
463	T	28.3	Very low	32	Very low	130 Å²	130	121.4 Å²	121.4	80%	0.798	81%	0.811	S	S	*	*			trans	59.5	123.5	148	46.6	0	0	0	0	121.8
464	S	30.1	Very low	32.1	Very low	120 Å²	120	120.7 Å²	120.7	84%	0.839	81%	0.812	S	S	*	*				173	160.9	110.5	-72.9	0	0	0	0	113.3
465	D	28	Very low	32.4	Very low	163 Å²	163	124 Å²	124	87%	0.872	82%	0.818	S	S	*	*			trans	-71.4	151.6	178.1	-69	-74	0	0	0	114.9
466	S	27.6	Very low	32.6	Very low	124 Å²	124	122.9 Å²	122.9	87%	0.867	82%	0.815	S	S	*	*				-177.9	152.4	121.6	-171.6	0	0	0	0	111.2
467	A	35.6	Very low	32.7	Very low	93 Å²	93	121 Å²	121	77%	0.769	81%	0.814	S	S	*	*			trans	-117.8	119	178.9	0	0	0	0	0	112.2
468	Q	32.6	Very low	33.2	Very low	204 Å²	204	122.2 Å²	122.2	95%	0.953	81%	0.808	S	S	*	*			trans	-154.4	148	157.3	-110.6	170.7	27.7	0	0	110.3
469	G	29.1	Very low	33.6	Very low	83 Å²	83	122.8 Å²	122.8	86%	0.856	81%	0.805	S	S	*	*			trans	-100.4	145.4	-166.6	0	0	0	0	0	115.1
470	G	26.9	Very low	33.7	Very low	71 Å²	71	122.4 Å²	122.4	73%	0.732	81%	0.805	S	S	*	*			trans	-118.6	104.4	170	0	0	0	0	0	111.7	N472	G470-N472 PolarHBondContact O-N 2.79Å
471	R	36.6	Very low	34.6	Very low	231 Å²	231	122.3 Å²	122.3	87%	0.872	80%	0.804	S	S	*	*			trans	-89.1	91.1	176.3	-73.5	171.9	62.3	177.1	0.3	110.4	T473	R471-T473 PolarHBondContact O-N 3.15Å
472	N	33.1	Very low	35.7	Very low	165 Å²	165	121.6 Å²	121.6	88%	0.882	79%	0.787	S	S	*	*			trans	-81.4	99.5	174.4	-71.8	-3.7	0	0	0	110.5	G470	G470-N472 PolarHBondContact O-N 2.79Å
473	T	35.8	Very low	36.7	Very low	119 Å²	119	120.7 Å²	120.7	73%	0.73	77%	0.772	S	S	*	*			trans	-66	151.2	177.7	44.3	0	0	0	0	112.9	R471	R471-T473 PolarHBondContact O-N 3.15Å
474	G	36.6	Very low	37.3	Very low	67 Å²	67	118.9 Å²	118.9	69%	0.691	75%	0.754	S	S	*	*			trans	-58.8	155.8	172.7	0	0	0	0	0	113.5	A476	G474-A476 PolarHBondContact O-N 2.99Å
475	I	44.5	Very low	38.2	Very low	184 Å²	184	120 Å²	120	94%	0.944	74%	0.74	S	S	*	*			trans	-72	95.8	-170.3	-54.7	171.7	0	0	0	110.4
476	A	38.8	Very low	39.2	Very low	75 Å²	75	118.8 Å²	118.8	62%	0.62	73%	0.727	S	S	*	*			trans	-114.1	73	175.4	0	0	0	0	0	110.6	G474 I478	G474-A476 PolarHBondContact O-N 2.99Å; A476-I478 PolarHBondContact O-N 3.43Å
477	G	39.5	Very low	40.2	Very low	78 Å²	78	115.9 Å²	115.9	80%	0.804	71%	0.71	S	S	*	*			trans	-67.7	123	177.6	0	0	0	0	0	112
478	I	45.3	Very low	40.8	Very low	112 Å²	112	116.5 Å²	116.5	57%	0.574	70%	0.704	S	S	*	*			trans	-102.2	115.7	173.7	-54	162.1	0	0	0	107.7	A476 R485	A476-I478 PolarHBondContact O-N 3.43Å; I478-R485 VanDerWaalsContact CD1-NH2 3.3Å
479	L	38.9	Very low	41.3	Very low	142 Å²	142	111.5 Å²	111.5	74%	0.743	69%	0.689	S	S	*	*			trans	-81	127.8	164.8	-71.6	172.2	0	0	0	109	G481	L479-G481 PolarHBondContact O-N 2.98Å
480	P	36.3	Very low	42.4	Very low	130 Å²	130	114.1 Å²	114.1	84%	0.844	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.8	127.3	174.1	-22.8	33.7	0	0	0	111
481	G	48.8	Very low	43.3	Very low	87 Å²	87	114.9 Å²	114.9	90%	0.897	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	95.4	1.8	175.5	0	0	0	0	0	117	L479	L479-G481 PolarHBondContact O-N 2.98Å
482	S	47.4	Very low	43.7	Very low	66 Å²	66	112.5 Å²	112.5	46%	0.462	69%	0.694	S	S	.	*			trans	-87.4	133.8	171.9	-179.2	0	0	0	0	112.4	F484	S482-F484 VanDerWaalsContact C-N 3.26Å; S482-F484 PolarHBondContact O-N 3.46Å; S482-F484 PolarHBondContact OG-N 2.82Å; S482-F484 PolarHBondContact OG-O 3.39Å
483	L	51	Low	44.3	Very low	90 Å²	90	108.3 Å²	108.3	47%	0.471	69%	0.69	S	S	.	*	S	Bend	trans	-75.2	-9.5	174	-82.6	166.9	0	0	0	114.3	I507 S509	L483-I507 WeakPolarHBondContact CD2-O 3.36Å; L483-S509 WeakPolarHBondContact CD2-OG 3.27Å
484	F	41	Very low	45	Very low	93 Å²	93	108.2 Å²	108.2	41%	0.408	69%	0.694	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-116.6	136.2	-171	-53.8	-81.3	0	0	0	111.7	S482 F486 V504 I506	S482-F484 VanDerWaalsContact C-N 3.26Å; S482-F484 PolarHBondContact O-N 3.46Å; S482-F484 PolarHBondContact OG-N 2.82Å; S482-F484 PolarHBondContact OG-O 3.39Å; F484-F486 HydrophobicContact CB-CE2 4.25Å; F484-F486 HydrophobicContact CB-CZ 4.32Å; F484-V504 HydrophobicContact CB-CG1 4.34Å; F484-V504 HydrophobicContact CD1-CG1 3.64Å; F484-V504 HydrophobicContact CE1-CG1 4.4Å; F484-V504 HydrophobicContact CG-CG1 4.35Å; F484-I506 HydrophobicContact CD1-CG1 4.09Å; F484-I506 HydrophobicContact CE1-CD1 3.92Å; F484-I506 HydrophobicContact CE1-CG1 3.78Å
485	R	49.1	Very low	45.7	Very low	143 Å²	143	112.8 Å²	112.8	54%	0.54	70%	0.703	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-107.8	134.2	164	-74.8	-174.3	178	-106.6	2.3	110	I478	I478-R485 VanDerWaalsContact CD1-NH2 3.3Å
486	F	48	Very low	45.9	Very low	138 Å²	138	110.9 Å²	110.9	61%	0.605	69%	0.694	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-104	131.6	169.9	-58.2	-82	0	0	0	108.7	F484 I502 V504	F484-F486 HydrophobicContact CB-CE2 4.25Å; F484-F486 HydrophobicContact CB-CZ 4.32Å; F486-I502 HydrophobicContact CD1-CG2 4.06Å; F486-V504 HydrophobicContact CD1-CG2 3.95Å; F486-V504 HydrophobicContact CE1-CG1 4.34Å; F486-V504 HydrophobicContact CE1-CG2 3.69Å
487	A	49.3	Very low	46.2	Very low	63 Å²	63	112.5 Å²	112.5	52%	0.521	70%	0.696	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-132	137.9	174	0	0	0	0	0	109
488	V	49	Very low	46.6	Very low	106 Å²	106	116.1 Å²	116.1	64%	0.642	70%	0.697	S	S	*	*			trans	-125.6	128.4	179.7	-177.5	0	0	0	0	108.3
489	P	42.3	Very low	47	Very low	98 Å²	98	117.9 Å²	117.9	64%	0.636	71%	0.708	S	S	*	*			trans	-63.6	134.9	178	-23	34.2	0	0	0	112.2	A491	P489-A491 VanDerWaalsContact C-N 3.32Å; P489-A491 PolarHBondContact O-N 3.5Å
490	P	53.3	Low	48.1	Very low	139 Å²	139	115.5 Å²	115.5	90%	0.903	70%	0.699	S	S	*	*			trans	-79.7	77.2	177.6	32.7	-34.8	0	0	0	111.1
491	A	45.7	Very low	48.4	Very low	87 Å²	87	117.8 Å²	117.8	72%	0.719	70%	0.7	S	S	*	*			trans	-116.5	99.7	179.6	0	0	0	0	0	112	P489	P489-A491 VanDerWaalsContact C-N 3.32Å; P489-A491 PolarHBondContact O-N 3.5Å
492	L	43.4	Very low	48.6	Very low	181 Å²	181	118.7 Å²	118.7	95%	0.948	68%	0.683	S	S	*	*			trans	4.8	134.8	157.1	-64.8	164.6	0	0	0	120
493	G	45.8	Very low	48.5	Very low	76 Å²	76	119.9 Å²	119.9	78%	0.784	69%	0.688	S	S	*	*			trans	107.3	126.9	141.5	0	0	0	0	0	116.1	N495	G493-N495 PolarHBondContact O-N 3.11Å; G493-N495 VanDerWaalsContact O-N 3.13Å
494	S	51.9	Low	48.4	Very low	117 Å²	117	118.8 Å²	118.8	82%	0.818	69%	0.685	S	S	*	*	S	Bend	trans	-75.7	96	176.2	53.9	0	0	0	0	111.9
495	N	50.1	Low	48.4	Very low	163 Å²	163	120 Å²	120	87%	0.872	70%	0.696	S	S	*	*			trans	-172.2	91.5	150.6	-92.5	-34.9	0	0	0	108.6	G493	G493-N495 PolarHBondContact O-N 3.11Å; G493-N495 VanDerWaalsContact O-N 3.13Å
496	L	48.9	Very low	48.3	Very low	144 Å²	144	118.8 Å²	118.8	75%	0.754	70%	0.699	S	S	*	*			trans	-85.2	128.9	-177.1	-153.9	76.4	0	0	0	110.8	V500	L496-V500 HydrophobicContact CD1-CG2 3.92Å
497	T	46.2	Very low	48.2	Very low	110 Å²	110	117.1 Å²	117.1	68%	0.675	70%	0.695	S	S	*	*			trans	-110.3	148.9	160.3	54.6	0	0	0	0	108.6	N499	T497-N499 PolarHBondContact O-N 2.67Å
498	D	48	Very low	47.7	Very low	153 Å²	153	119.9 Å²	119.9	82%	0.818	71%	0.708	S	S	*	*	S	Bend	trans	-74.3	52.7	-162.8	-65.6	-57.6	0	0	0	115.7
499	N	52.3	Low	47.2	Very low	150 Å²	150	119.6 Å²	119.6	80%	0.802	71%	0.711	S	S	*	*			trans	-141.2	46.5	-178.4	-73	-80.9	0	0	0	113.6	T497	T497-N499 PolarHBondContact O-N 2.67Å
500	V	61.8	Low	47.4	Very low	92 Å²	92	118.1 Å²	118.1	56%	0.558	71%	0.713	S	S	*	*			trans	-89.9	113.3	171.9	-178	0	0	0	0	110.5	L496 I502	L496-V500 HydrophobicContact CD1-CG2 3.92Å; V500-I502 PolarHBondContact O-N 2.73Å
501	M	44.2	Very low	46.4	Very low	177 Å²	177	123 Å²	123	87%	0.872	71%	0.713	S	S	*	*	P	Polyproline II helix	trans	-73.9	124.4	170.7	-73.8	-165.7	-69.1	0	0	111.2
502	I	52.9	Low	45.9	Very low	106 Å²	106	126.8 Å²	126.8	54%	0.544	72%	0.721	S	S	.	*	P	Polyproline II helix	trans	-98.7	118.4	170.9	-58.3	175.8	0	0	0	108.1	F486 V500 V504	F486-I502 HydrophobicContact CD1-CG2 4.06Å; V500-I502 PolarHBondContact O-N 2.73Å; I502-V504 HydrophobicContact CG2-CG2 4.28Å
503	T	44.3	Very low	45.4	Very low	91 Å²	91	123.4 Å²	123.4	56%	0.558	71%	0.713	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-81	130.8	174	49.7	0	0	0	0	110.5
504	V	49.8	Very low	45.1	Very low	68 Å²	68	124 Å²	124	41%	0.412	71%	0.711	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-125.3	105.6	-179.9	-177.8	0	0	0	0	109.1	F484 F486 I502	F484-V504 HydrophobicContact CB-CG1 4.34Å; F484-V504 HydrophobicContact CD1-CG1 3.64Å; F484-V504 HydrophobicContact CE1-CG1 4.4Å; F484-V504 HydrophobicContact CG-CG1 4.35Å; F486-V504 HydrophobicContact CD1-CG2 3.95Å; F486-V504 HydrophobicContact CE1-CG1 4.34Å; F486-V504 HydrophobicContact CE1-CG2 3.69Å; I502-V504 HydrophobicContact CG2-CG2 4.28Å
505	D	40.7	Very low	44.3	Very low	118 Å²	118	126.6 Å²	126.6	63%	0.631	72%	0.715	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-90.2	141	175.5	-72.8	-38.5	0	0	0	111.1
506	I	47.4	Very low	44	Very low	118 Å²	118	122.4 Å²	122.4	61%	0.605	71%	0.711	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-110.2	119	174.9	-48.8	-175.2	0	0	0	108.4	F484	F484-I506 HydrophobicContact CD1-CG1 4.09Å; F484-I506 HydrophobicContact CE1-CD1 3.92Å; F484-I506 HydrophobicContact CE1-CG1 3.78Å
507	I	45.8	Very low	43.5	Very low	102 Å²	102	125.4 Å²	125.4	52%	0.523	72%	0.718	S	S	.	*			trans	-104	124.4	176.6	-57.8	177.3	0	0	0	108.9	L483 S509	L483-I507 WeakPolarHBondContact CD2-O 3.36Å; I507-S509 PolarHBondContact O-N 3.47Å
508	P	36.9	Very low	43.4	Very low	122 Å²	122	124.5 Å²	124.5	79%	0.792	72%	0.716	S	S	*	*			trans	-69	94.2	172.5	-18.4	32.3	0	0	0	111.4	G510	P508-G510 PolarHBondContact O-N 2.76Å; P508-G510 VanDerWaalsContact O-N 3.09Å
509	S	40.2	Very low	42.9	Very low	100 Å²	100	124 Å²	124	70%	0.699	71%	0.713	S	S	*	*			trans	-79.6	87.3	175.8	60	0	0	0	0	110.8	L483 I507	L483-S509 WeakPolarHBondContact CD2-OG 3.27Å; I507-S509 PolarHBondContact O-N 3.47Å
510	G	46.6	Very low	42.9	Very low	66 Å²	66	126.2 Å²	126.2	68%	0.68	72%	0.716	S	S	*	*			trans	-144.4	15.6	-168.6	0	0	0	0	0	117.2	P508	P508-G510 PolarHBondContact O-N 2.76Å; P508-G510 VanDerWaalsContact O-N 3.09Å
511	W	31.1	Very low	42.1	Very low	241 Å²	241	128.8 Å²	128.8	91%	0.913	73%	0.732	S	S	*	*			trans	-144.6	116.5	171	-104.1	-33.1	0	0	0	112.1
512	N	36.5	Very low	42.5	Very low	167 Å²	167	130.4 Å²	130.4	89%	0.893	73%	0.734	S	S	*	*			trans	-102	128.6	156.9	-72.6	-16.6	0	0	0	107.5
513	S	32.6	Very low	41.8	Very low	111 Å²	111	131 Å²	131	78%	0.776	75%	0.747	S	S	*	*			trans	-138	122.6	164	-66	0	0	0	0	107.6
514	A	39.4	Very low	41.9	Very low	88 Å²	88	130.8 Å²	130.8	73%	0.727	76%	0.755	S	S	*	*			trans	-83.2	-176.8	169.6	0	0	0	0	0	109.9
515	D	35.6	Very low	41.7	Very low	171 Å²	171	133.6 Å²	133.6	91%	0.914	78%	0.775	S	S	*	*			trans	64.9	128.9	178.7	-59.2	-31.1	0	0	0	116.2
516	G	42.2	Very low	41.8	Very low	76 Å²	76	133.3 Å²	133.3	78%	0.784	78%	0.782	S	S	*	*			trans	-123.2	135.7	-178	0	0	0	0	0	112.1
517	K	39.5	Very low	42.2	Very low	207 Å²	207	137.8 Å²	137.8	90%	0.9	79%	0.791	S	S	*	*			trans	-150.9	167.4	147.4	-145.6	156.7	-173.5	171.1	0	109.7
518	S	42.8	Very low	43.2	Very low	90 Å²	90	135.3 Å²	135.3	63%	0.629	78%	0.779	S	S	*	*			trans	-61.6	151.2	168.9	61.7	0	0	0	0	109.4
519	D	39.3	Very low	44.9	Very low	143 Å²	143	133.7 Å²	133.7	77%	0.765	77%	0.769	S	S	*	*				-164.8	-178.5	58.1	-118.4	-63.7	0	0	0	115.9	T521	D519-T521 PolarHBondContact O-N 3.25Å
520	K	51.4	Low	46.4	Very low	197 Å²	197	136 Å²	136	86%	0.857	77%	0.769	S	S	*	*			trans	-81.5	99.3	-171.8	178.5	-173.8	175.7	-179.2	0	113.9
521	T	44.8	Very low	47.7	Very low	145 Å²	145	141.4 Å²	141.4	89%	0.89	77%	0.769	S	S	*	*			trans	-139.9	160.5	162.6	12.8	0	0	0	0	113.7	D519	D519-T521 PolarHBondContact O-N 3.25Å
522	K	53.1	Low	49.6	Very low	211 Å²	211	135 Å²	135	92%	0.917	75%	0.751	S	S	*	*			trans	-114	111.9	-161.8	174.7	-174.8	177.5	-177.4	0	110.9
523	S	37.3	Very low	51.5	Low	118 Å²	118	133.1 Å²	133.1	83%	0.825	74%	0.737	S	S	*	*			trans	-125.9	144.7	169.1	52.8	0	0	0	0	110.7
524	A	47.8	Very low	53.8	Low	88 Å²	88	135 Å²	135	73%	0.727	73%	0.732	S	S	*	*			trans	-94	153.2	176.3	0	0	0	0	0	110	S526	A524-S526 PolarHBondContact O-N 3.25Å
525	P	44.4	Very low	55.6	Low	127 Å²	127	135.5 Å²	135.5	83%	0.825	72%	0.721	S	S	*	*			trans	-61	126.4	173.7	26	-33.9	0	0	0	109.9	R527	P525-R527 PolarHBondContact O-N 3.16Å; P525-R527 VanDerWaalsContact O-N 3.15Å
526	S	43.8	Very low	57.4	Low	112 Å²	112	134 Å²	134	78%	0.783	71%	0.706	S	S	*	*			trans	-65.2	114.1	-179.9	40.2	0	0	0	0	110.3	A524 D528	A524-S526 PolarHBondContact O-N 3.25Å; S526-D528 PolarHBondContact O-N 3Å
527	R	55.8	Low	58.9	Low	211 Å²	211	135.6 Å²	135.6	80%	0.796	69%	0.693	S	S	*	*			trans	-80.9	60.9	177.7	-167.9	-175.8	-174.4	150.5	4.9	110.1	P525 P529	P525-R527 PolarHBondContact O-N 3.16Å; P525-R527 VanDerWaalsContact O-N 3.15Å; R527-P529 WeakPolarHBondContact O-CD 3.42Å
528	D	66.9	Low	60.3	Low	50 Å²	50	128.1 Å²	128.1	27%	0.267	67%	0.667	S	S	.	*			trans	-58.7	110.4	-175.7	-177	-7.5	0	0	0	110.8	S526 E530 R531 L532	S526-D528 PolarHBondContact O-N 3Å; D528-E530 VanDerWaalsContact C-N 3.29Å; D528-E530 PolarHBondContact O-N 3.41Å; D528-E530 PolarHBondContact OD1-N 3.18Å; D528-E530 VanDerWaalsContact OD1-N 3.1Å; D528-R531 HydrophobicContact CB-CB 4.36Å; D528-R531 HydrophobicContact CB-CG 4.29Å; D528-R531 VanDerWaalsContact OD2-CD 3.27Å; D528-R531 WeakPolarHBondContact OD2-CD 3.44Å; D528-R531 VanDerWaalsContact OD2-CG 3.3Å; D528-R531 WeakPolarHBondContact OD2-CG 3.26Å; D528-R531 IonicContact OD2-NE 3.79Å; D528-R531 PolarHBondContact OD2-NE 2.91Å; D528-R531 VanDerWaalsContact OD2-NE 3.11Å; D528-L532 PolarHBondContact O-N 3.11Å
529	P	71.6	Confident	61.3	Low	89 Å²	89	128.5 Å²	128.5	58%	0.578	66%	0.661	S	S	*	*	H	α-helix	trans	-71	-27.3	-176.3	30.6	-34.5	0	0	0	111.8	R527 R531 L532 Q533	R527-P529 WeakPolarHBondContact O-CD 3.42Å; P529-R531 VanDerWaalsContact C-N 3.34Å; P529-L532 PolarHBondContact O-N 2.73Å; P529-Q533 WeakPolarHBondContact O-CB 3.29Å; P529-Q533 PolarHBondContact O-N 3.27Å
530	E	72.4	Confident	62.3	Low	149 Å²	149	126.6 Å²	126.6	70%	0.696	65%	0.651	S	S	*	*	H	α-helix	trans	-69.3	-35.7	-178.9	-61	-178.5	-175.5	0	0	110.8	D528 Q533 K534	D528-E530 VanDerWaalsContact C-N 3.29Å; D528-E530 PolarHBondContact O-N 3.41Å; D528-E530 PolarHBondContact OD1-N 3.18Å; D528-E530 VanDerWaalsContact OD1-N 3.1Å; E530-Q533 PolarHBondContact O-N 3.47Å; E530-K534 VanDerWaalsContact O-CB 3.29Å; E530-K534 WeakPolarHBondContact O-CB 3.42Å; E530-K534 PolarHBondContact O-N 3.11Å
531	R	73.4	Confident	62.6	Low	179 Å²	179	123.1 Å²	123.1	68%	0.675	64%	0.641	S	S	*	*	H	α-helix	trans	-66.5	-39	171.9	-72	177.9	-172.5	-137	-7.1	112.7	D528 P529 K534 I535	D528-R531 HydrophobicContact CB-CB 4.36Å; D528-R531 HydrophobicContact CB-CG 4.29Å; D528-R531 VanDerWaalsContact OD2-CD 3.27Å; D528-R531 WeakPolarHBondContact OD2-CD 3.44Å; D528-R531 VanDerWaalsContact OD2-CG 3.3Å; D528-R531 WeakPolarHBondContact OD2-CG 3.26Å; D528-R531 IonicContact OD2-NE 3.79Å; D528-R531 PolarHBondContact OD2-NE 2.91Å; D528-R531 VanDerWaalsContact OD2-NE 3.11Å; P529-R531 VanDerWaalsContact C-N 3.34Å; R531-K534 PolarHBondContact O-N 3.06Å; R531-I535 WeakPolarHBondContact O-CD1 3.45Å; R531-I535 VanDerWaalsContact O-CG1 3.26Å; R531-I535 WeakPolarHBondContact O-CG1 3.25Å; R531-I535 PolarHBondContact O-N 2.83Å
532	L	71	Confident	63.1	Low	105 Å²	105	122.9 Å²	122.9	55%	0.55	63%	0.63	S	S	.	*	H	α-helix	trans	-69	-36.8	175	-69	173.6	0	0	0	111.7	D528 P529 K536	D528-L532 PolarHBondContact O-N 3.11Å; P529-L532 PolarHBondContact O-N 2.73Å; L532-K536 WeakPolarHBondContact O-CB 3.27Å; L532-K536 PolarHBondContact O-N 2.88Å
533	Q	76.1	Confident	62.8	Low	129 Å²	129	119.7 Å²	119.7	60%	0.603	62%	0.622	S	S	*	*	H	α-helix	trans	-65.2	-45.1	173	-176.1	165.4	-21.1	0	0	110.9	P529 E530 I535 K536 E537	P529-Q533 WeakPolarHBondContact O-CB 3.29Å; P529-Q533 PolarHBondContact O-N 3.27Å; E530-Q533 PolarHBondContact O-N 3.47Å; Q533-I535 PolarHBondContact O-N 3.18Å; Q533-K536 CarbonylContact O-C 3.57Å; Q533-K536 WeakPolarHBondContact O-CB 3.28Å; Q533-K536 PolarHBondContact O-N 3.49Å; Q533-K536 VanDerWaalsContact O-N 3.15Å; Q533-E537 VanDerWaalsContact O-CB 3.25Å; Q533-E537 WeakPolarHBondContact O-CB 3.3Å; Q533-E537 PolarHBondContact O-N 2.79Å
534	K	81.1	Confident	63.4	Low	151 Å²	151	117.1 Å²	117.1	66%	0.657	61%	0.605	S	S	*	*	H	α-helix	trans	-65.5	-33.2	178	-170.8	162.4	-173.6	163.9	0	113.8	E530 R531 S538	E530-K534 VanDerWaalsContact O-CB 3.29Å; E530-K534 WeakPolarHBondContact O-CB 3.42Å; E530-K534 PolarHBondContact O-N 3.11Å; R531-K534 PolarHBondContact O-N 3.06Å; K534-S538 PolarHBondContact O-N 3.23Å
535	I	77.4	Confident	63.7	Low	97 Å²	97	121.8 Å²	121.8	50%	0.497	61%	0.611	S	S	.	*	H	α-helix	trans	-72.2	-37.8	171.7	-68.6	163.7	0	0	0	111	R531 Q533 E537 S538 L539	R531-I535 WeakPolarHBondContact O-CD1 3.45Å; R531-I535 VanDerWaalsContact O-CG1 3.26Å; R531-I535 WeakPolarHBondContact O-CG1 3.25Å; R531-I535 PolarHBondContact O-N 2.83Å; Q533-I535 PolarHBondContact O-N 3.18Å; I535-E537 VanDerWaalsContact C-N 3.31Å; I535-S538 PolarHBondContact O-OG 2.82Å; I535-S538 VanDerWaalsContact O-OG 3.11Å; I535-L539 HydrophobicContact CG2-CD1 4.06Å; I535-L539 WeakPolarHBondContact O-CB 3.49Å; I535-L539 VanDerWaalsContact O-CG 3.27Å; I535-L539 WeakPolarHBondContact O-CG 3.45Å; I535-L539 PolarHBondContact O-N 3.49Å
536	K	73.9	Confident	64	Low	141 Å²	141	124.7 Å²	124.7	61%	0.613	61%	0.614	S	S	*	*	H	α-helix	trans	-64.8	-39.2	172.8	-173.5	-169.7	173.5	-164.7	0	111.3	L532 Q533 L540	L532-K536 WeakPolarHBondContact O-CB 3.27Å; L532-K536 PolarHBondContact O-N 2.88Å; Q533-K536 CarbonylContact O-C 3.57Å; Q533-K536 WeakPolarHBondContact O-CB 3.28Å; Q533-K536 PolarHBondContact O-N 3.49Å; Q533-K536 VanDerWaalsContact O-N 3.15Å; K536-L540 HydrophobicContact CG-CD1 4.1Å; K536-L540 WeakPolarHBondContact O-CB 3.26Å; K536-L540 VanDerWaalsContact O-CG 3.27Å; K536-L540 WeakPolarHBondContact O-CG 3.12Å; K536-L540 PolarHBondContact O-N 3.32Å
537	E	73.2	Confident	64.7	Low	109 Å²	109	127.6 Å²	127.6	51%	0.509	62%	0.615	S	S	.	*	H	α-helix	trans	-70.5	-38.8	179.4	-168.6	167.2	-121.4	0	0	111.6	Q533 I535 L541	Q533-E537 VanDerWaalsContact O-CB 3.25Å; Q533-E537 WeakPolarHBondContact O-CB 3.3Å; Q533-E537 PolarHBondContact O-N 2.79Å; I535-E537 VanDerWaalsContact C-N 3.31Å; E537-L541 HydrophobicContact CG-CD1 4.48Å; E537-L541 WeakPolarHBondContact O-CD1 3.25Å; E537-L541 VanDerWaalsContact O-CG 3.26Å; E537-L541 WeakPolarHBondContact O-CG 3.12Å; E537-L541 PolarHBondContact O-N 3.12Å; E537-L541 VanDerWaalsContact O-N 3.16Å
538	S	69	Low	64.9	Low	49 Å²	49	125.4 Å²	125.4	34%	0.343	61%	0.614	S	S	.	*	H	α-helix	trans	-66	-45.6	172	71.5	0	0	0	0	112.2	K534 I535 L540 L541 E542	K534-S538 PolarHBondContact O-N 3.23Å; I535-S538 PolarHBondContact O-OG 2.82Å; I535-S538 VanDerWaalsContact O-OG 3.11Å; S538-L540 VanDerWaalsContact C-N 3.29Å; S538-L540 PolarHBondContact O-N 2.84Å; S538-L541 CarbonylContact O-C 3.47Å; S538-L541 WeakPolarHBondContact O-CA 3.34Å; S538-L541 PolarHBondContact O-N 2.96Å; S538-E542 PolarHBondContact O-N 2.71Å
539	L	64.3	Low	64.9	Low	98 Å²	98	124.3 Å²	124.3	51%	0.513	62%	0.615	S	S	.	*	H	α-helix	trans	-62.8	-34.3	178.3	-70.7	169.8	0	0	0	112.7	I535 L541 E542 D543	I535-L539 HydrophobicContact CG2-CD1 4.06Å; I535-L539 WeakPolarHBondContact O-CB 3.49Å; I535-L539 VanDerWaalsContact O-CG 3.27Å; I535-L539 WeakPolarHBondContact O-CG 3.45Å; I535-L539 PolarHBondContact O-N 3.49Å; L539-L541 VanDerWaalsContact C-N 3.3Å; L539-E542 PolarHBondContact O-N 2.94Å; L539-D543 PolarHBondContact O-N 2.86Å
540	L	59	Low	65.4	Low	104 Å²	104	124.1 Å²	124.1	55%	0.545	61%	0.609	S	S	.	*	H	α-helix	trans	-75.5	-15.5	174.1	-72.5	171.5	0	0	0	113.9	K536 S538 S544	K536-L540 HydrophobicContact CG-CD1 4.1Å; K536-L540 WeakPolarHBondContact O-CB 3.26Å; K536-L540 VanDerWaalsContact O-CG 3.27Å; K536-L540 WeakPolarHBondContact O-CG 3.12Å; K536-L540 PolarHBondContact O-N 3.32Å; S538-L540 VanDerWaalsContact C-N 3.29Å; S538-L540 PolarHBondContact O-N 2.84Å; L540-S544 PolarHBondContact O-OG 3.41Å
541	L	58.6	Low	66.3	Low	123 Å²	123	119.5 Å²	119.5	64%	0.644	59%	0.589	S	S	*	*	H	α-helix	trans	-92.6	-21.8	172.6	-71.9	167.3	0	0	0	112.4	E537 S538 L539	E537-L541 HydrophobicContact CG-CD1 4.48Å; E537-L541 WeakPolarHBondContact O-CD1 3.25Å; E537-L541 VanDerWaalsContact O-CG 3.26Å; E537-L541 WeakPolarHBondContact O-CG 3.12Å; E537-L541 PolarHBondContact O-N 3.12Å; E537-L541 VanDerWaalsContact O-N 3.16Å; S538-L541 CarbonylContact O-C 3.47Å; S538-L541 WeakPolarHBondContact O-CA 3.34Å; S538-L541 PolarHBondContact O-N 2.96Å; L539-L541 VanDerWaalsContact C-N 3.3Å
542	E	55.1	Low	67.1	Low	141 Å²	141	111 Å²	111	66%	0.659	56%	0.556	S	S	*	*	H	α-helix	trans	-82.9	-27.7	173.1	-70.2	176.4	110.8	0	0	112.4	S538 L539 S544	S538-E542 PolarHBondContact O-N 2.71Å; L539-E542 PolarHBondContact O-N 2.94Å; E542-S544 PolarHBondContact O-N 3.04Å
543	D	47.6	Very low	68.1	Low	143 Å²	143	108.7 Å²	108.7	77%	0.765	54%	0.54	S	S	*	.	S	Bend	trans	-75.4	8.4	168.6	-81.4	-14.1	0	0	0	113.3	L539	L539-D543 PolarHBondContact O-N 2.86Å
544	S	49.6	Very low	68.9	Low	65 Å²	65	106.1 Å²	106.1	46%	0.455	53%	0.53	S	S	.	.	S	Bend	trans	-94.6	112.2	179.1	-65.3	0	0	0	0	111.5	L540 E542 E546	L540-S544 PolarHBondContact O-OG 3.41Å; E542-S544 PolarHBondContact O-N 3.04Å; S544-E546 PolarHBondContact O-N 2.9Å
545	E	53.2	Low	69.4	Low	185 Å²	185	101.3 Å²	101.3	86%	0.864	52%	0.515	S	S	*	.			trans	54.8	45.1	162.9	66.3	-177.3	-167.1	0	0	118	E547	E545-E547 PolarHBondContact O-N 3.38Å
546	E	51.9	Low	70	Confident	189 Å²	189	104.2 Å²	104.2	88%	0.883	53%	0.526	S	S	*	.			trans	-71.8	74.8	133.7	64.2	172.5	-161.8	0	0	109.2	S544 E548	S544-E546 PolarHBondContact O-N 2.9Å; E546-E548 PolarHBondContact O-N 3.28Å
547	E	57	Low	70.7	Confident	173 Å²	173	102.6 Å²	102.6	81%	0.808	52%	0.522	S	S	*	.			trans	-57.4	120.5	166.3	-174.5	168	-124.9	0	0	107.7	E545 G549	E545-E547 PolarHBondContact O-N 3.38Å; E547-G549 PolarHBondContact O-N 2.75Å
548	E	60.8	Low	71.1	Confident	165 Å²	165	100.1 Å²	100.1	77%	0.771	52%	0.52	S	S	*	.			trans	-68	72.8	171	177.9	88.5	-113.8	0	0	107.5	E546	E546-E548 PolarHBondContact O-N 3.28Å
549	G	66.6	Low	71.2	Confident	27 Å²	27	101 Å²	101	28%	0.278	53%	0.53	S	S	.	.			trans	-61.9	142.5	-163.9	0	0	0	0	0	111.7	E547 L551	E547-G549 PolarHBondContact O-N 2.75Å; G549-L551 WeakPolarHBondContact O-CD2 3.28Å; G549-L551 WeakPolarHBondContact O-CG 3.45Å; G549-L551 PolarHBondContact O-N 3.46Å
550	D	82.8	Confident	71.6	Confident	85 Å²	85	98.9 Å²	98.9	46%	0.455	53%	0.527	S	S	.	.			trans	-42.5	110.7	-163.9	-64.6	-40.8	0	0	0	113.4	L566 Y578	D550-L566 HydrophobicContact CB-CD2 3.34Å; D550-L566 WeakPolarHBondContact O-CD2 3.45Å; D550-Y578 HydrophobicContact CB-CD1 4.17Å; D550-Y578 HydrophobicContact CB-CD2 3.63Å; D550-Y578 HydrophobicContact CB-CE2 4.08Å; D550-Y578 HydrophobicContact CB-CG 3.72Å; D550-Y578 VanDerWaalsContact CG-CE2 3.41Å; D550-Y578 WeakPolarHBondContact OD1-CD2 3.42Å; D550-Y578 WeakPolarHBondContact OD1-CE2 3.41Å
551	L	89.9	Confident	72.3	Confident	52 Å²	52	96.5 Å²	96.5	27%	0.272	52%	0.519	S	S	.	.			trans	-89	127.8	179.9	-61.8	-177.3	0	0	0	109.9	G549 R553 A558	G549-L551 WeakPolarHBondContact O-CD2 3.28Å; G549-L551 WeakPolarHBondContact O-CG 3.45Å; G549-L551 PolarHBondContact O-N 3.46Å; L551-R553 PolarHBondContact O-N 3.44Å; L551-R553 VanDerWaalsContact O-N 3.09Å; L551-A558 HydrophobicContact CD2-CB 3.83Å
552	C	91.8	Very high	73	Confident	0 Å²	0	96.7 Å²	96.7	0%	0	53%	0.531	C	S	.	.			trans	-59	116.2	168.7	168.5	0	0	0	0	110.5	I554 C555 Q556 M557 L566 Y578 H580	C552-I554 PolarHBondContact O-N 3.16Å; C552-C555 PolarHBondContact O-N 3.23Å; C552-Q556 WeakPolarHBondContact O-CA 3.44Å; C552-Q556 PolarHBondContact O-N 3.48Å; C552-M557 PolarHBondContact N-O 2.92Å; C552-L566 HydrophobicContact CB-CD1 4.32Å; C552-Y578 WeakPolarHBondContact CA-O 3.5Å; C552-H580 HydrophobicContact CB-CB 4.43Å; C552-H580 WeakPolarHBondContact CB-ND1 3.27Å; C552-H580 PolarHBondContact SG-N 2.7Å
553	R	91.2	Very high	73.7	Confident	57 Å²	57	94.2 Å²	94.2	22%	0.215	53%	0.529	C	S	.	.	T	Hydrogen-bonded Turn	trans	-50.3	-28.4	179.5	172.2	163	61.3	102.3	-7.7	114.1	L551 L576 Y578 V579 E605	L551-R553 PolarHBondContact O-N 3.44Å; L551-R553 VanDerWaalsContact O-N 3.09Å; R553-L576 HydrophobicContact CG-CD2 4.28Å; R553-L576 PolarHBondContact NE-O 3.45Å; R553-L576 VanDerWaalsContact NE-O 3.14Å; R553-Y578 PolarHBondContact N-O 2.99Å; R553-V579 HydrophobicContact CB-CG2 4.44Å; R553-E605 IonicContact CZ-OE1 3.11Å; R553-E605 IonicContact NH1-OE1 2.75Å; R553-E605 PolarHBondContact NH1-OE1 2.83Å; R553-E605 IonicContact NH2-OE1 2.67Å
554	I	92.2	Very high	75.4	Confident	75 Å²	75	89.3 Å²	89.3	39%	0.385	50%	0.503	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-37.4	-175	-60.9	-175.1	0	0	0	112.9	C552 V579 C583 W587	C552-I554 PolarHBondContact O-N 3.16Å; I554-V579 HydrophobicContact CD1-CG1 3.58Å; I554-V579 HydrophobicContact CG1-CG1 3.93Å; I554-C583 HydrophobicContact CB-CB 3.93Å; I554-C583 HydrophobicContact CD1-CB 4.09Å; I554-C583 HydrophobicContact CG1-CB 4.5Å; I554-C583 HydrophobicContact CG2-CB 3.99Å; I554-W587 HydrophobicContact CD1-CB 3.95Å; I554-W587 HydrophobicContact CD1-CG 4.25Å
555	C	92.4	Very high	77.2	Confident	50 Å²	50	90.9 Å²	90.9	34%	0.338	51%	0.505	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.4	-4.5	-175.8	67.2	0	0	0	0	115.4	C552 M557 H580	C552-C555 PolarHBondContact O-N 3.23Å; C555-M557 VanDerWaalsContact C-N 3.26Å; C555-M557 PolarHBondContact O-N 3.43Å; C555-H580 PolarHBondContact SG-ND1 3.46Å
556	Q	90.3	Very high	79	Confident	158 Å²	158	83.9 Å²	83.9	74%	0.738	47%	0.474	S	S	*	.			trans	57.5	36.2	177.2	-57	175.1	3	0	0	113.3	C552	C552-Q556 WeakPolarHBondContact O-CA 3.44Å; C552-Q556 PolarHBondContact O-N 3.48Å
557	M	87.5	Confident	80.8	Confident	107 Å²	107	76.9 Å²	76.9	53%	0.527	44%	0.442	S	S	.	.			trans	-120.6	135.6	175.7	-63.6	174	66.2	0	0	109.7	C552 C555 A559 H580	C552-M557 PolarHBondContact N-O 2.92Å; C555-M557 VanDerWaalsContact C-N 3.26Å; C555-M557 PolarHBondContact O-N 3.43Å; M557-A559 VanDerWaalsContact C-N 3.26Å; M557-A559 HydrophobicContact CE-CB 4.26Å; M557-H580 PolarHBondContact O-CE1 3.16Å; M557-H580 VanDerWaalsContact O-CE1 3.28Å
558	A	82.3	Confident	82.5	Confident	57 Å²	57	73.2 Å²	73.2	47%	0.471	43%	0.425	S	S	.	.			trans	-79	-5.7	170.4	0	0	0	0	0	113.7	L551 A560	L551-A558 HydrophobicContact CD2-CB 3.83Å; A558-A560 VanDerWaalsContact C-N 3.26Å; A558-A560 PolarHBondContact O-N 3.14Å
559	A	70.6	Confident	83.9	Confident	66 Å²	66	65.4 Å²	65.4	55%	0.545	39%	0.388	S	S	.	.			trans	-79.8	64.2	-163.7	0	0	0	0	0	113.6	M557 S561 H580	M557-A559 VanDerWaalsContact C-N 3.26Å; M557-A559 HydrophobicContact CE-CB 4.26Å; A559-S561 PolarHBondContact O-N 3.14Å; A559-H580 PolarHBondContact O-NE2 3.4Å
560	A	73.6	Confident	85.2	Confident	55 Å²	55	64.4 Å²	64.4	46%	0.455	38%	0.377	S	S	.	.			trans	-56.5	131.2	167.7	0	0	0	0	0	110.1	A558 N564 L566	A558-A560 VanDerWaalsContact C-N 3.26Å; A558-A560 PolarHBondContact O-N 3.14Å; A560-N564 CarbonylContact C-O 3.58Å; A560-N564 VanDerWaalsContact CA-O 3.26Å; A560-N564 WeakPolarHBondContact CA-O 3.13Å; A560-L566 HydrophobicContact CB-CD1 4.29Å
561	S	74.3	Confident	85.6	Confident	53 Å²	53	66.5 Å²	66.5	37%	0.371	38%	0.382	S	S	.	.	B	Isolated β-bridge	trans	-113.5	166.8	173.3	87.7	0	0	0	0	110.3	A559 S563 N564 L565	A559-S561 PolarHBondContact O-N 3.14Å; S561-S563 PolarHBondContact O-N 2.7Å; S561-S563 PolarHBondContact OG-N 2.94Å; S561-S563 PolarHBondContact OG-OG 2.87Å; S561-N564 PolarHBondContact N-O 3.03Å; S561-N564 CarbonylContact O-C 3.14Å; S561-N564 PolarHBondContact O-N 3.2Å; S561-N564 VanDerWaalsContact OG-CB 3.32Å; S561-N564 WeakPolarHBondContact OG-CB 3.12Å; S561-N564 PolarHBondContact OG-N 3.09Å; S561-L565 PolarHBondContact O-N 3.44Å
562	S	71.8	Confident	85.8	Confident	127 Å²	127	64.5 Å²	64.5	89%	0.888	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-14.6	178.7	51.9	0	0	0	0	114.6
563	S	71.6	Confident	85.7	Confident	89 Å²	89	70.1 Å²	70.1	62%	0.622	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.6	12.5	171	60	0	0	0	0	112.9	S561	S561-S563 PolarHBondContact O-N 2.7Å; S561-S563 PolarHBondContact OG-N 2.94Å; S561-S563 PolarHBondContact OG-OG 2.87Å
564	N	82.3	Confident	85.5	Confident	41 Å²	41	69.5 Å²	69.5	22%	0.219	42%	0.418	C	S	.	.	B	Isolated β-bridge	trans	-150.9	65.7	-179	-125.4	-114.6	0	0	0	109.8	A560 S561 H580 E582	A560-N564 CarbonylContact C-O 3.58Å; A560-N564 VanDerWaalsContact CA-O 3.26Å; A560-N564 WeakPolarHBondContact CA-O 3.13Å; S561-N564 PolarHBondContact N-O 3.03Å; S561-N564 CarbonylContact O-C 3.14Å; S561-N564 PolarHBondContact O-N 3.2Å; S561-N564 VanDerWaalsContact OG-CB 3.32Å; S561-N564 WeakPolarHBondContact OG-CB 3.12Å; S561-N564 PolarHBondContact OG-N 3.09Å; N564-H580 PolarHBondContact O-CD2 3.06Å; N564-E582 WeakPolarHBondContact ND2-CB 3.46Å
565	L	87.3	Confident	85	Confident	97 Å²	97	70 Å²	70	51%	0.508	43%	0.428	S	S	.	.			trans	-68.8	149.7	176.2	-60.1	177.7	0	0	0	110.3	S561 H580 Q581	S561-L565 PolarHBondContact O-N 3.44Å; L565-H580 WeakPolarHBondContact O-CA 3.42Å; L565-Q581 PolarHBondContact O-N 3.42Å
566	L	90.8	Very high	84.8	Confident	39 Å²	39	71.4 Å²	71.4	20%	0.204	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	136.4	159.2	-110.1	65.8	0	0	0	108.9	D550 C552 A560 Y578 H580	D550-L566 HydrophobicContact CB-CD2 3.34Å; D550-L566 WeakPolarHBondContact O-CD2 3.45Å; C552-L566 HydrophobicContact CB-CD1 4.32Å; A560-L566 HydrophobicContact CB-CD1 4.29Å; L566-Y578 HydrophobicContact CD2-CD1 4.06Å; L566-Y578 HydrophobicContact CD2-CG 3.95Å; L566-H580 WeakPolarHBondContact CD1-CD2 3.03Å; L566-H580 WeakPolarHBondContact CD1-NE2 3.44Å
567	I	90.3	Very high	84.8	Confident	41 Å²	41	65.9 Å²	65.9	21%	0.21	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	156.4	173.6	57.6	163.9	0	0	0	109.7	P569 V579 M584 L615	I567-P569 WeakPolarHBondContact O-CD 3.15Å; I567-V579 WeakPolarHBondContact CG1-O 3.41Å; I567-V579 PolarHBondContact N-O 2.88Å; I567-V579 PolarHBondContact O-N 2.81Å; I567-M584 HydrophobicContact CD1-CB 4.19Å; I567-M584 HydrophobicContact CD1-CG 4.25Å; I567-L615 HydrophobicContact CD1-CD2 4.16Å
568	E	92.1	Very high	84.9	Confident	96 Å²	96	62.5 Å²	62.5	45%	0.449	39%	0.388	S	S	.	.			trans	-102.2	83.2	172.3	-61.6	-170	-159.4	0	0	109.1	C570 Q577 Y578	E568-C570 PolarHBondContact O-N 2.85Å; E568-C570 VanDerWaalsContact O-N 3.12Å; E568-Q577 HydrophobicContact CB-CG 4.47Å; E568-Q577 VanDerWaalsContact CD-NE2 3.28Å; E568-Q577 HydrophobicContact CG-CG 3.99Å; E568-Q577 PolarHBondContact OE1-NE2 3.47Å; E568-Q577 PolarHBondContact OE2-NE2 3.4Å; E568-Y578 HydrophobicContact CG-CD1 3.78Å; E568-Y578 HydrophobicContact CG-CE1 3.35Å; E568-Y578 WeakPolarHBondContact OE1-CE1 3.48Å; E568-Y578 VanDerWaalsContact OE1-CZ 3.3Å; E568-Y578 PolarHBondContact OE1-OH 2.94Å
569	P	90.7	Very high	85.5	Confident	1 Å²	1	59.9 Å²	59.9	1%	0.006	37%	0.366	C	S	.	.			trans	-70	-7.9	-173.1	32.3	-41.4	0	0	0	113.7	I567 Q577 V579 M584 L611 E612 L613	I567-P569 WeakPolarHBondContact O-CD 3.15Å; P569-Q577 WeakPolarHBondContact CD-O 3.43Å; P569-V579 HydrophobicContact CG-CB 4.24Å; P569-V579 HydrophobicContact CG-CG2 3.85Å; P569-M584 HydrophobicContact CB-CE 3.69Å; P569-M584 HydrophobicContact CB-SD 4.49Å; P569-M584 HydrophobicContact CG-CE 3.64Å; P569-L611 HydrophobicContact CB-CD2 4.47Å; P569-L611 CarbonylContact O-C 3.59Å; P569-L611 WeakPolarHBondContact O-CA 3.32Å; P569-L611 WeakPolarHBondContact O-CD2 3.4Å; P569-E612 PolarHBondContact O-N 3.25Å; P569-L613 HydrophobicContact CB-CD2 4.2Å
570	C	93.3	Very high	86.5	Confident	6 Å²	6	57.1 Å²	57.1	4%	0.041	34%	0.342	C	S	.	.	S	Bend	trans	-170	161.4	-179.2	58.2	0	0	0	0	111	E568 C572 C604 L611	E568-C570 PolarHBondContact O-N 2.85Å; E568-C570 VanDerWaalsContact O-N 3.12Å; C570-C572 PolarHBondContact O-N 3.23Å; C570-C572 VanDerWaalsContact SG-SG 3.63Å; C570-C604 HydrophobicContact CB-CB 3.95Å; C570-C604 PolarHBondContact SG-SG 2.83Å; C570-L611 HydrophobicContact CB-CD2 3.98Å
571	K	92.5	Very high	87.3	Confident	129 Å²	129	56.4 Å²	56.4	56%	0.561	33%	0.329	S	S	*	.	S	Bend	trans	-74.5	42.2	177.5	-47.9	-176.5	-153.8	83	0	114.6	E609	K571-E609 VanDerWaalsContact CB-OE2 3.25Å; K571-E609 WeakPolarHBondContact CB-OE2 3.24Å; K571-E609 VanDerWaalsContact CD-OE2 3.28Å; K571-E609 WeakPolarHBondContact CD-OE2 3.43Å; K571-E609 WeakPolarHBondContact CG-OE2 3.42Å; K571-E609 IonicContact NZ-OE1 3.86Å; K571-E609 PolarHBondContact NZ-OE1 2.94Å; K571-E609 IonicContact NZ-OE2 3.23Å; K571-E609 PolarHBondContact NZ-OE2 3.25Å
572	C	92.3	Very high	88.1	Confident	10 Å²	10	57.3 Å²	57.3	7%	0.068	33%	0.327	C	S	.	.			trans	-70.6	149.9	157	-73.2	0	0	0	0	108.4	C570 L576 Q577	C570-C572 PolarHBondContact O-N 3.23Å; C570-C572 VanDerWaalsContact SG-SG 3.63Å; C572-L576 HydrophobicContact CB-CB 4.16Å; C572-L576 WeakPolarHBondContact CB-O 3.1Å; C572-Q577 WeakPolarHBondContact O-CA 3.08Å; C572-Q577 WeakPolarHBondContact O-CB 3.35Å; C572-Q577 WeakPolarHBondContact O-CG 3.23Å; C572-Q577 PolarHBondContact O-OE1 3.44Å
573	T	90.9	Very high	89.1	Confident	118 Å²	118	52.3 Å²	52.3	72%	0.724	29%	0.293	S	S	*	.			trans	-114.3	143.5	-174.4	54.9	0	0	0	0	112.4
574	G	85.9	Confident	90.1	Very high	44 Å²	44	48.3 Å²	48.3	45%	0.454	26%	0.264	S	S	.	.	G	3₁₀ helix	trans	74.4	-147.7	178.5	0	0	0	0	0	112	L576 Q577	G574-L576 PolarHBondContact O-N 2.95Å; G574-Q577 VanDerWaalsContact N-OE1 3.12Å; G574-Q577 WeakPolarHBondContact O-CB 3.44Å; G574-Q577 PolarHBondContact O-N 3.33Å
575	S	82.4	Confident	90.5	Very high	85 Å²	85	48.1 Å²	48.1	59%	0.594	26%	0.261	S	S	*	.	G	3₁₀ helix	trans	-62.2	0.6	-176.1	60.3	0	0	0	0	116.2
576	L	87.5	Confident	90.8	Very high	81 Å²	81	49 Å²	49	42%	0.424	26%	0.261	S	S	.	.	G	3₁₀ helix	trans	-100.5	-10.4	173.1	-50.4	-179.7	0	0	0	113.9	R553 C572 G574 L606	R553-L576 HydrophobicContact CG-CD2 4.28Å; R553-L576 PolarHBondContact NE-O 3.45Å; R553-L576 VanDerWaalsContact NE-O 3.14Å; C572-L576 HydrophobicContact CB-CB 4.16Å; C572-L576 WeakPolarHBondContact CB-O 3.1Å; G574-L576 PolarHBondContact O-N 2.95Å; L576-L606 HydrophobicContact CD1-CD1 4.12Å
577	Q	90.4	Very high	90.9	Very high	41 Å²	41	49.9 Å²	49.9	19%	0.192	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-41.1	-178.4	-171.1	161.7	-12.1	0	0	111.6	E568 P569 C572 G574	E568-Q577 HydrophobicContact CB-CG 4.47Å; E568-Q577 VanDerWaalsContact CD-NE2 3.28Å; E568-Q577 HydrophobicContact CG-CG 3.99Å; E568-Q577 PolarHBondContact OE1-NE2 3.47Å; E568-Q577 PolarHBondContact OE2-NE2 3.4Å; P569-Q577 WeakPolarHBondContact CD-O 3.43Å; C572-Q577 WeakPolarHBondContact O-CA 3.08Å; C572-Q577 WeakPolarHBondContact O-CB 3.35Å; C572-Q577 WeakPolarHBondContact O-CG 3.23Å; C572-Q577 PolarHBondContact O-OE1 3.44Å; G574-Q577 VanDerWaalsContact N-OE1 3.12Å; G574-Q577 WeakPolarHBondContact O-CB 3.44Å; G574-Q577 PolarHBondContact O-N 3.33Å
578	Y	91.3	Very high	91	Very high	37 Å²	37	48 Å²	48	15%	0.145	25%	0.252	C	S	.	.			trans	-96.2	138.1	-168.8	-62.2	-74.3	0	0	0	114.4	D550 C552 R553 L566 E568	D550-Y578 HydrophobicContact CB-CD1 4.17Å; D550-Y578 HydrophobicContact CB-CD2 3.63Å; D550-Y578 HydrophobicContact CB-CE2 4.08Å; D550-Y578 HydrophobicContact CB-CG 3.72Å; D550-Y578 VanDerWaalsContact CG-CE2 3.41Å; D550-Y578 WeakPolarHBondContact OD1-CD2 3.42Å; D550-Y578 WeakPolarHBondContact OD1-CE2 3.41Å; C552-Y578 WeakPolarHBondContact CA-O 3.5Å; R553-Y578 PolarHBondContact N-O 2.99Å; L566-Y578 HydrophobicContact CD2-CD1 4.06Å; L566-Y578 HydrophobicContact CD2-CG 3.95Å; E568-Y578 HydrophobicContact CG-CD1 3.78Å; E568-Y578 HydrophobicContact CG-CE1 3.35Å; E568-Y578 WeakPolarHBondContact OE1-CE1 3.48Å; E568-Y578 VanDerWaalsContact OE1-CZ 3.3Å; E568-Y578 PolarHBondContact OE1-OH 2.94Å
579	V	93	Very high	90.9	Very high	1 Å²	1	47.8 Å²	47.8	1%	0.006	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	138.7	174.1	-172.4	0	0	0	0	109.9	R553 I554 I567 P569 C583 M584	R553-V579 HydrophobicContact CB-CG2 4.44Å; I554-V579 HydrophobicContact CD1-CG1 3.58Å; I554-V579 HydrophobicContact CG1-CG1 3.93Å; I567-V579 WeakPolarHBondContact CG1-O 3.41Å; I567-V579 PolarHBondContact N-O 2.88Å; I567-V579 PolarHBondContact O-N 2.81Å; P569-V579 HydrophobicContact CG-CB 4.24Å; P569-V579 HydrophobicContact CG-CG2 3.85Å; V579-C583 HydrophobicContact CG1-CB 3.89Å; V579-M584 HydrophobicContact CB-CE 4.25Å; V579-M584 HydrophobicContact CG1-CB 4.18Å; V579-M584 HydrophobicContact CG1-CE 4.05Å; V579-M584 HydrophobicContact CG2-CE 4.19Å
580	H	92.3	Very high	91	Very high	8 Å²	8	50.8 Å²	50.8	4%	0.037	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.4	139.8	169.1	-76.2	117.3	0	0	0	111.4	C552 C555 M557 A559 N564 L565 L566 E582 C583 M584	C552-H580 HydrophobicContact CB-CB 4.43Å; C552-H580 WeakPolarHBondContact CB-ND1 3.27Å; C552-H580 PolarHBondContact SG-N 2.7Å; C555-H580 PolarHBondContact SG-ND1 3.46Å; M557-H580 PolarHBondContact O-CE1 3.16Å; M557-H580 VanDerWaalsContact O-CE1 3.28Å; A559-H580 PolarHBondContact O-NE2 3.4Å; N564-H580 PolarHBondContact O-CD2 3.06Å; L565-H580 WeakPolarHBondContact O-CA 3.42Å; L566-H580 WeakPolarHBondContact CD1-CD2 3.03Å; L566-H580 WeakPolarHBondContact CD1-NE2 3.44Å; H580-E582 VanDerWaalsContact C-N 3.27Å; H580-E582 PolarHBondContact O-N 3.22Å; H580-E582 VanDerWaalsContact O-N 3.16Å; H580-C583 HydrophobicContact CB-CB 4Å; H580-C583 WeakPolarHBondContact O-CB 3.44Å; H580-C583 PolarHBondContact O-N 2.84Å; H580-M584 PolarHBondContact O-N 2.65Å
581	Q	91.1	Very high	91	Very high	40 Å²	40	52 Å²	52	19%	0.187	28%	0.28	C	S	.	.	H	α-helix	trans	-46.2	-46.6	176.3	-167.9	178.1	13.7	0	0	113.6	L565 M584 K585 L615	L565-Q581 PolarHBondContact O-N 3.42Å; Q581-M584 PolarHBondContact O-N 3.2Å; Q581-K585 PolarHBondContact O-N 2.9Å; Q581-L615 HydrophobicContact CG-CD2 3.51Å
582	E	91	Very high	90.9	Very high	72 Å²	72	46 Å²	46	34%	0.336	25%	0.254	S	S	.	.	H	α-helix	trans	-75.7	-31.6	-179.7	179.1	65.2	-175	0	0	113.3	N564 H580 M584 K585 K586	N564-E582 WeakPolarHBondContact ND2-CB 3.46Å; H580-E582 VanDerWaalsContact C-N 3.27Å; H580-E582 PolarHBondContact O-N 3.22Å; H580-E582 VanDerWaalsContact O-N 3.16Å; E582-M584 VanDerWaalsContact C-N 3.27Å; E582-M584 PolarHBondContact O-N 2.75Å; E582-K585 PolarHBondContact O-N 2.95Å; E582-K586 HydrophobicContact CG-CD 4.5Å; E582-K586 WeakPolarHBondContact O-CB 3.46Å; E582-K586 WeakPolarHBondContact O-CG 3.05Å; E582-K586 PolarHBondContact O-N 3.39Å; E582-K586 IonicContact OE1-NZ 2.59Å; E582-K586 PolarHBondContact OE1-NZ 3.34Å
583	C	92.6	Very high	90.8	Very high	23 Å²	23	49.7 Å²	49.7	16%	0.155	27%	0.274	C	S	.	.	H	α-helix	trans	-64.5	-36.6	171.3	-69.9	0	0	0	0	110.9	I554 V579 H580 W587	I554-C583 HydrophobicContact CB-CB 3.93Å; I554-C583 HydrophobicContact CD1-CB 4.09Å; I554-C583 HydrophobicContact CG1-CB 4.5Å; I554-C583 HydrophobicContact CG2-CB 3.99Å; V579-C583 HydrophobicContact CG1-CB 3.89Å; H580-C583 HydrophobicContact CB-CB 4Å; H580-C583 WeakPolarHBondContact O-CB 3.44Å; H580-C583 PolarHBondContact O-N 2.84Å; C583-W587 WeakPolarHBondContact O-CB 3.49Å; C583-W587 PolarHBondContact O-N 3.45Å
584	M	92.2	Very high	90.7	Very high	4 Å²	4	48.1 Å²	48.1	2%	0.02	27%	0.267	C	S	.	.	H	α-helix	trans	-67.9	-49.8	173.7	-177.4	51.9	54.9	0	0	111.8	I567 P569 V579 H580 Q581 E582 K586 W587 L588 L613 L615	I567-M584 HydrophobicContact CD1-CB 4.19Å; I567-M584 HydrophobicContact CD1-CG 4.25Å; P569-M584 HydrophobicContact CB-CE 3.69Å; P569-M584 HydrophobicContact CB-SD 4.49Å; P569-M584 HydrophobicContact CG-CE 3.64Å; V579-M584 HydrophobicContact CB-CE 4.25Å; V579-M584 HydrophobicContact CG1-CB 4.18Å; V579-M584 HydrophobicContact CG1-CE 4.05Å; V579-M584 HydrophobicContact CG2-CE 4.19Å; H580-M584 PolarHBondContact O-N 2.65Å; Q581-M584 PolarHBondContact O-N 3.2Å; E582-M584 VanDerWaalsContact C-N 3.27Å; E582-M584 PolarHBondContact O-N 2.75Å; M584-K586 VanDerWaalsContact C-N 3.32Å; M584-K586 PolarHBondContact O-N 3.08Å; M584-W587 HydrophobicContact CE-CE3 4.48Å; M584-W587 PolarHBondContact O-N 3.46Å; M584-W587 VanDerWaalsContact O-N 3.16Å; M584-W587 HydrophobicContact SD-CE3 3.85Å; M584-W587 HydrophobicContact SD-CZ3 4.19Å; M584-L588 HydrophobicContact CG-CD1 3.8Å; M584-L588 HydrophobicContact CG-CG 4.36Å; M584-L588 WeakPolarHBondContact O-CB 3.5Å; M584-L588 VanDerWaalsContact O-CG 3.32Å; M584-L588 WeakPolarHBondContact O-CG 3.39Å; M584-L588 PolarHBondContact O-N 3.22Å; M584-L588 HydrophobicContact SD-CD1 3.82Å; M584-L588 HydrophobicContact SD-CD2 4.28Å; M584-L588 HydrophobicContact SD-CG 3.8Å; M584-L613 HydrophobicContact CG-CD2 3.54Å; M584-L613 HydrophobicContact SD-CD2 3.82Å; M584-L615 HydrophobicContact CG-CD1 4.47Å
585	K	91.4	Very high	90.7	Very high	38 Å²	38	49 Å²	49	17%	0.165	28%	0.277	C	S	.	.	H	α-helix	trans	-53.5	-47.4	175	-73.6	-170.2	179.1	-164.7	0	111.7	Q581 E582 L588 Q589 L615 E616 F618	Q581-K585 PolarHBondContact O-N 2.9Å; E582-K585 PolarHBondContact O-N 2.95Å; K585-L588 PolarHBondContact O-N 3.19Å; K585-Q589 WeakPolarHBondContact O-CB 3.31Å; K585-Q589 PolarHBondContact O-N 3.23Å; K585-L615 HydrophobicContact CG-CD1 4.08Å; K585-E616 PolarHBondContact NZ-O 3.28Å; K585-F618 HydrophobicContact CB-CD2 4.46Å; K585-F618 HydrophobicContact CB-CE2 4.16Å; K585-F618 HydrophobicContact CB-CZ 4.34Å; K585-F618 HydrophobicContact CD-CB 4.27Å; K585-F618 HydrophobicContact CD-CD2 3.9Å; K585-F618 HydrophobicContact CD-CE2 4.43Å; K585-F618 HydrophobicContact CD-CG 4.11Å; K585-F618 HydrophobicContact CG-CD1 4.3Å; K585-F618 HydrophobicContact CG-CD2 3.98Å; K585-F618 HydrophobicContact CG-CE1 4.48Å; K585-F618 HydrophobicContact CG-CE2 4.16Å; K585-F618 HydrophobicContact CG-CG 4.05Å; K585-F618 HydrophobicContact CG-CZ 4.4Å
586	K	92.7	Very high	91	Very high	116 Å²	116	46.5 Å²	46.5	50%	0.504	26%	0.259	S	S	.	.	H	α-helix	trans	-63.3	-41	176.7	-76.6	-177.6	163.4	84.1	0	113.8	E582 M584 A590	E582-K586 HydrophobicContact CG-CD 4.5Å; E582-K586 WeakPolarHBondContact O-CB 3.46Å; E582-K586 WeakPolarHBondContact O-CG 3.05Å; E582-K586 PolarHBondContact O-N 3.39Å; E582-K586 IonicContact OE1-NZ 2.59Å; E582-K586 PolarHBondContact OE1-NZ 3.34Å; M584-K586 VanDerWaalsContact C-N 3.32Å; M584-K586 PolarHBondContact O-N 3.08Å; K586-A590 WeakPolarHBondContact O-CB 3.4Å; K586-A590 PolarHBondContact O-N 3.14Å
587	W	92.9	Very high	91.2	Very high	57 Å²	57	45.9 Å²	45.9	22%	0.216	26%	0.261	C	S	.	.	H	α-helix	trans	-67.8	-41.9	177.7	177.5	92.3	0	0	0	111.8	I554 C583 M584 A590 K591 L611	I554-W587 HydrophobicContact CD1-CB 3.95Å; I554-W587 HydrophobicContact CD1-CG 4.25Å; C583-W587 WeakPolarHBondContact O-CB 3.49Å; C583-W587 PolarHBondContact O-N 3.45Å; M584-W587 HydrophobicContact CE-CE3 4.48Å; M584-W587 PolarHBondContact O-N 3.46Å; M584-W587 VanDerWaalsContact O-N 3.16Å; M584-W587 HydrophobicContact SD-CE3 3.85Å; M584-W587 HydrophobicContact SD-CZ3 4.19Å; W587-A590 PolarHBondContact O-N 2.8Å; W587-K591 HydrophobicContact CD2-CD 4.44Å; W587-K591 HydrophobicContact CE3-CD 4.32Å; W587-K591 HydrophobicContact CH2-CD 3.76Å; W587-K591 HydrophobicContact CZ2-CD 3.81Å; W587-K591 HydrophobicContact CZ3-CD 3.97Å; W587-K591 VanDerWaalsContact O-CB 3.24Å; W587-K591 WeakPolarHBondContact O-CB 3.31Å; W587-K591 PolarHBondContact O-N 3.37Å; W587-L611 HydrophobicContact CH2-CD1 4.02Å; W587-L611 HydrophobicContact CZ3-CD1 3.59Å
588	L	92.4	Very high	91.1	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-60.6	-47	174.8	-69.6	164.7	0	0	0	111.2	M584 K585 K591 I592 V601 L611 L613 L615 F618 I620	M584-L588 HydrophobicContact CG-CD1 3.8Å; M584-L588 HydrophobicContact CG-CG 4.36Å; M584-L588 WeakPolarHBondContact O-CB 3.5Å; M584-L588 VanDerWaalsContact O-CG 3.32Å; M584-L588 WeakPolarHBondContact O-CG 3.39Å; M584-L588 PolarHBondContact O-N 3.22Å; M584-L588 HydrophobicContact SD-CD1 3.82Å; M584-L588 HydrophobicContact SD-CD2 4.28Å; M584-L588 HydrophobicContact SD-CG 3.8Å; K585-L588 PolarHBondContact O-N 3.19Å; L588-K591 PolarHBondContact O-N 2.96Å; L588-I592 WeakPolarHBondContact O-CG1 3.17Å; L588-I592 PolarHBondContact O-N 2.99Å; L588-V601 HydrophobicContact CD2-CG1 3.92Å; L588-L611 HydrophobicContact CD2-CD1 4.13Å; L588-L613 HydrophobicContact CD1-CD1 3.69Å; L588-L613 HydrophobicContact CD1-CD2 4.1Å; L588-L613 HydrophobicContact CD1-CG 4.47Å; L588-L613 HydrophobicContact CD2-CD1 3.88Å; L588-L613 HydrophobicContact CG-CD1 4.44Å; L588-L615 HydrophobicContact CD1-CD1 4.07Å; L588-F618 HydrophobicContact CB-CE1 4.11Å; L588-F618 HydrophobicContact CB-CZ 4.17Å; L588-F618 HydrophobicContact CD1-CE1 3.76Å; L588-I620 HydrophobicContact CD1-CG1 4.34Å
589	Q	91	Very high	91	Very high	92 Å²	92	51.8 Å²	51.8	43%	0.43	29%	0.292	S	S	.	.	H	α-helix	trans	-60.6	-48.6	175.9	-171.6	178	24.2	0	0	111.7	K585 K591 I592 N593 L623	K585-Q589 WeakPolarHBondContact O-CB 3.31Å; K585-Q589 PolarHBondContact O-N 3.23Å; Q589-K591 PolarHBondContact O-N 3Å; Q589-I592 PolarHBondContact O-N 3.16Å; Q589-N593 WeakPolarHBondContact O-CB 3.26Å; Q589-N593 PolarHBondContact O-N 2.95Å; Q589-N593 PolarHBondContact O-OD1 3.31Å; Q589-L623 HydrophobicContact CB-CD2 4.28Å; Q589-L623 HydrophobicContact CG-CD2 4.36Å
590	A	92	Very high	91	Very high	64 Å²	64	53.8 Å²	53.8	53%	0.529	31%	0.309	S	S	.	.	H	α-helix	trans	-60.2	-31.2	177.9	0	0	0	0	0	113.3	K586 W587 S594	K586-A590 WeakPolarHBondContact O-CB 3.4Å; K586-A590 PolarHBondContact O-N 3.14Å; W587-A590 PolarHBondContact O-N 2.8Å; A590-S594 PolarHBondContact O-N 2.9Å
591	K	92.4	Very high	90.9	Very high	32 Å²	32	53.4 Å²	53.4	14%	0.139	31%	0.307	C	S	.	.	H	α-helix	trans	-81.6	-31.8	180	-165.9	174	175.6	-167	0	113.1	W587 L588 Q589 S594 S596 A600 V601 T603	W587-K591 HydrophobicContact CD2-CD 4.44Å; W587-K591 HydrophobicContact CE3-CD 4.32Å; W587-K591 HydrophobicContact CH2-CD 3.76Å; W587-K591 HydrophobicContact CZ2-CD 3.81Å; W587-K591 HydrophobicContact CZ3-CD 3.97Å; W587-K591 VanDerWaalsContact O-CB 3.24Å; W587-K591 WeakPolarHBondContact O-CB 3.31Å; W587-K591 PolarHBondContact O-N 3.37Å; L588-K591 PolarHBondContact O-N 2.96Å; Q589-K591 PolarHBondContact O-N 3Å; K591-S594 PolarHBondContact O-OG 2.99Å; K591-S596 WeakPolarHBondContact O-CB 3.49Å; K591-S596 PolarHBondContact O-N 2.96Å; K591-S596 PolarHBondContact O-OG 3.16Å; K591-A600 WeakPolarHBondContact CE-O 3.32Å; K591-A600 PolarHBondContact NZ-O 3.09Å; K591-V601 HydrophobicContact CG-CG2 4.18Å; K591-V601 PolarHBondContact NZ-O 3.48Å; K591-T603 PolarHBondContact NZ-O 3.49Å; K591-T603 VanDerWaalsContact NZ-O 3.16Å
592	I	91.4	Very high	91	Very high	2 Å²	2	52.8 Å²	52.8	1%	0.01	31%	0.306	C	S	.	.	H	α-helix	trans	-66.9	-48	167.6	-70.2	165.3	0	0	0	109.3	L588 Q589 S594 G595 V601 I620 L623 H624 H627	L588-I592 WeakPolarHBondContact O-CG1 3.17Å; L588-I592 PolarHBondContact O-N 2.99Å; Q589-I592 PolarHBondContact O-N 3.16Å; I592-S594 PolarHBondContact O-N 3.34Å; I592-S594 VanDerWaalsContact O-N 3.07Å; I592-G595 PolarHBondContact O-N 3.49Å; I592-V601 HydrophobicContact CD1-CG1 4.2Å; I592-V601 HydrophobicContact CG1-CB 4.46Å; I592-V601 HydrophobicContact CG1-CG1 3.83Å; I592-V601 HydrophobicContact CG1-CG2 3.81Å; I592-I620 HydrophobicContact CD1-CG2 4.36Å; I592-L623 HydrophobicContact CD1-CB 4.09Å; I592-L623 HydrophobicContact CD1-CD2 3.78Å; I592-L623 HydrophobicContact CD1-CG 3.78Å; I592-H624 HydrophobicContact CD1-CB 4.39Å; I592-H627 HydrophobicContact CG2-CB 3.52Å; I592-H627 PolarHBondContact O-ND1 3.37Å
593	N	89.3	Confident	91.1	Very high	89 Å²	89	50.7 Å²	50.7	48%	0.476	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-13.7	179.6	-68.6	25.5	0	0	0	114.3	Q589 G595	Q589-N593 WeakPolarHBondContact O-CB 3.26Å; Q589-N593 PolarHBondContact O-N 2.95Å; Q589-N593 PolarHBondContact O-OD1 3.31Å; N593-G595 VanDerWaalsContact C-N 3.32Å
594	S	88.8	Confident	91.2	Very high	85 Å²	85	49.6 Å²	49.6	59%	0.594	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.2	7.4	172	75	0	0	0	0	113.8	A590 K591 I592 S596	A590-S594 PolarHBondContact O-N 2.9Å; K591-S594 PolarHBondContact O-OG 2.99Å; I592-S594 PolarHBondContact O-N 3.34Å; I592-S594 VanDerWaalsContact O-N 3.07Å; S594-S596 VanDerWaalsContact C-N 3.32Å; S594-S596 PolarHBondContact O-N 2.99Å; S594-S596 PolarHBondContact OG-OG 3.43Å
595	G	86.1	Confident	91.2	Very high	63 Å²	63	53.4 Å²	53.4	65%	0.649	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.3	19.6	-177	0	0	0	0	0	114.1	I592 N593	I592-G595 PolarHBondContact O-N 3.49Å; N593-G595 VanDerWaalsContact C-N 3.32Å
596	S	90.2	Very high	91.2	Very high	32 Å²	32	55.8 Å²	55.8	22%	0.224	32%	0.322	C	S	.	.			trans	-70.3	138	177.4	-49.8	0	0	0	0	110.8	K591 S594	K591-S596 WeakPolarHBondContact O-CB 3.49Å; K591-S596 PolarHBondContact O-N 2.96Å; K591-S596 PolarHBondContact O-OG 3.16Å; S594-S596 VanDerWaalsContact C-N 3.32Å; S594-S596 PolarHBondContact O-N 2.99Å; S594-S596 PolarHBondContact OG-OG 3.43Å
597	S	89.9	Confident	91.2	Very high	68 Å²	68	52.3 Å²	52.3	48%	0.476	31%	0.312	S	S	.	.			trans	-61	149.9	175.8	67.5	0	0	0	0	112.2	E599 A600 V601	S597-E599 PolarHBondContact O-N 2.84Å; S597-E599 VanDerWaalsContact O-N 3.14Å; S597-A600 CarbonylContact O-C 3.57Å; S597-A600 WeakPolarHBondContact O-CA 3.43Å; S597-A600 WeakPolarHBondContact O-CB 3.19Å; S597-A600 PolarHBondContact O-N 3.37Å; S597-A600 WeakPolarHBondContact OG-CB 3.43Å; S597-A600 PolarHBondContact OG-N 2.96Å; S597-V601 WeakPolarHBondContact O-CG2 3.06Å; S597-V601 PolarHBondContact O-N 2.89Å
598	L	89.2	Confident	91.3	Very high	54 Å²	54	56.7 Å²	56.7	28%	0.283	33%	0.333	S	S	.	.	H	α-helix	trans	-48.7	-40.7	177.7	179.3	63.3	0	0	0	113.7	V601 T602 I620 H621 H624	L598-V601 PolarHBondContact O-N 3.48Å; L598-T602 HydrophobicContact CD1-CG2 4.02Å; L598-T602 WeakPolarHBondContact O-CB 3.44Å; L598-T602 WeakPolarHBondContact O-CG2 3.42Å; L598-T602 PolarHBondContact O-N 3.41Å; L598-T602 PolarHBondContact O-OG1 3.04Å; L598-I620 HydrophobicContact CD1-CG2 4.43Å; L598-H621 WeakPolarHBondContact CD2-ND1 3.33Å; L598-H624 HydrophobicContact CD1-CB 4.22Å; L598-H624 PolarHBondContact N-NE2 3.44Å
599	E	90	Very high	91.3	Very high	147 Å²	147	60 Å²	60	69%	0.687	35%	0.348	S	S	*	.	H	α-helix	trans	-63.7	-47.7	175.1	-178.6	-178.4	-159	0	0	111.4	S597 V601 T602 T603	S597-E599 PolarHBondContact O-N 2.84Å; S597-E599 VanDerWaalsContact O-N 3.14Å; E599-V601 VanDerWaalsContact C-N 3.34Å; E599-V601 PolarHBondContact O-N 3.37Å; E599-T602 PolarHBondContact O-N 2.75Å; E599-T602 PolarHBondContact O-OG1 3.49Å; E599-T603 VanDerWaalsContact O-CB 3.23Å; E599-T603 WeakPolarHBondContact O-CB 3.47Å; E599-T603 PolarHBondContact O-N 3.46Å; E599-T603 VanDerWaalsContact O-N 3.16Å; E599-T603 PolarHBondContact O-OG1 3.4Å
600	A	91.1	Very high	91.3	Very high	44 Å²	44	63.6 Å²	63.6	36%	0.364	36%	0.362	S	S	.	.	H	α-helix	trans	-62.7	-41	176.9	0	0	0	0	0	111.3	K591 S597	K591-A600 WeakPolarHBondContact CE-O 3.32Å; K591-A600 PolarHBondContact NZ-O 3.09Å; S597-A600 CarbonylContact O-C 3.57Å; S597-A600 WeakPolarHBondContact O-CA 3.43Å; S597-A600 WeakPolarHBondContact O-CB 3.19Å; S597-A600 PolarHBondContact O-N 3.37Å; S597-A600 WeakPolarHBondContact OG-CB 3.43Å; S597-A600 PolarHBondContact OG-N 2.96Å
601	V	91.9	Very high	91.3	Very high	0 Å²	0	61.5 Å²	61.5	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-58.2	-55	175.3	172.3	0	0	0	0	110.9	L588 K591 I592 S597 L598 E599 T603 L611 I620	L588-V601 HydrophobicContact CD2-CG1 3.92Å; K591-V601 HydrophobicContact CG-CG2 4.18Å; K591-V601 PolarHBondContact NZ-O 3.48Å; I592-V601 HydrophobicContact CD1-CG1 4.2Å; I592-V601 HydrophobicContact CG1-CB 4.46Å; I592-V601 HydrophobicContact CG1-CG1 3.83Å; I592-V601 HydrophobicContact CG1-CG2 3.81Å; S597-V601 WeakPolarHBondContact O-CG2 3.06Å; S597-V601 PolarHBondContact O-N 2.89Å; L598-V601 PolarHBondContact O-N 3.48Å; E599-V601 VanDerWaalsContact C-N 3.34Å; E599-V601 PolarHBondContact O-N 3.37Å; V601-T603 PolarHBondContact O-N 2.73Å; V601-L611 WeakPolarHBondContact O-CD1 3.32Å; V601-I620 HydrophobicContact CG1-CG2 4.05Å
602	T	91.9	Very high	90.9	Very high	26 Å²	26	65.6 Å²	65.6	16%	0.16	36%	0.362	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.4	6.2	-174.7	56.3	0	0	0	0	114.8	L598 E599 K610 L611 I620	L598-T602 HydrophobicContact CD1-CG2 4.02Å; L598-T602 WeakPolarHBondContact O-CB 3.44Å; L598-T602 WeakPolarHBondContact O-CG2 3.42Å; L598-T602 PolarHBondContact O-N 3.41Å; L598-T602 PolarHBondContact O-OG1 3.04Å; E599-T602 PolarHBondContact O-N 2.75Å; E599-T602 PolarHBondContact O-OG1 3.49Å; T602-K610 WeakPolarHBondContact O-CA 3.19Å; T602-L611 WeakPolarHBondContact O-CG 3.5Å; T602-L611 PolarHBondContact O-N 2.99Å; T602-I620 HydrophobicContact CG2-CG2 3.94Å
603	T	93.8	Very high	90.5	Very high	28 Å²	28	66.8 Å²	66.8	17%	0.172	37%	0.368	C	S	.	.	B	Isolated β-bridge	trans	-116.4	138.6	178.6	-56.7	0	0	0	0	111.3	K591 E599 V601 K608	K591-T603 PolarHBondContact NZ-O 3.49Å; K591-T603 VanDerWaalsContact NZ-O 3.16Å; E599-T603 VanDerWaalsContact O-CB 3.23Å; E599-T603 WeakPolarHBondContact O-CB 3.47Å; E599-T603 PolarHBondContact O-N 3.46Å; E599-T603 VanDerWaalsContact O-N 3.16Å; E599-T603 PolarHBondContact O-OG1 3.4Å; V601-T603 PolarHBondContact O-N 2.73Å; T603-K608 WeakPolarHBondContact CG2-O 3.36Å
604	C	93.6	Very high	89.7	Confident	1 Å²	1	69.8 Å²	69.8	1%	0.007	38%	0.384	C	S	.	.			trans	-67.6	130.6	176.3	-176.8	0	0	0	0	111.3	C570 L606 C607 K608 E609 L611	C570-C604 HydrophobicContact CB-CB 3.95Å; C570-C604 PolarHBondContact SG-SG 2.83Å; C604-L606 PolarHBondContact O-N 2.93Å; C604-L606 PolarHBondContact SG-N 2.99Å; C604-C607 VanDerWaalsContact CB-SG 3.53Å; C604-C607 VanDerWaalsContact SG-SG 3.61Å; C604-K608 VanDerWaalsContact O-CA 3.28Å; C604-K608 WeakPolarHBondContact O-CA 3.38Å; C604-K608 PolarHBondContact O-N 3.07Å; C604-E609 PolarHBondContact N-O 3.26Å; C604-L611 HydrophobicContact CB-CD2 3.71Å
605	E	92.6	Very high	89.2	Confident	84 Å²	84	66.5 Å²	66.5	39%	0.393	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-24.9	178.9	72.6	-150.3	155	0	0	113.4	R553 K608	R553-E605 IonicContact CZ-OE1 3.11Å; R553-E605 IonicContact NH1-OE1 2.75Å; R553-E605 PolarHBondContact NH1-OE1 2.83Å; R553-E605 IonicContact NH2-OE1 2.67Å; E605-K608 WeakPolarHBondContact O-CE 3.43Å; E605-K608 PolarHBondContact O-NZ 3.48Å
606	L	92.3	Very high	88.7	Confident	88 Å²	88	71.3 Å²	71.3	46%	0.461	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.8	-69.6	-175.6	-58.4	-178.3	0	0	0	111.9	L576 C604 K608	L576-L606 HydrophobicContact CD1-CD1 4.12Å; C604-L606 PolarHBondContact O-N 2.93Å; C604-L606 PolarHBondContact SG-N 2.99Å; L606-K608 VanDerWaalsContact C-N 3.3Å; L606-K608 PolarHBondContact O-N 2.93Å
607	C	93.4	Very high	88.1	Confident	43 Å²	43	77.6 Å²	77.6	29%	0.291	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-7.5	-176.6	64.9	0	0	0	0	114.6	C604 E609	C604-C607 VanDerWaalsContact CB-SG 3.53Å; C604-C607 VanDerWaalsContact SG-SG 3.61Å; C607-E609 PolarHBondContact O-N 2.89Å; C607-E609 VanDerWaalsContact O-N 3.11Å
608	K	93.2	Very high	87.6	Confident	148 Å²	148	76.4 Å²	76.4	64%	0.643	38%	0.383	S	S	*	.			trans	61	10.4	-178.4	-49.8	-52.8	-171.2	-172.7	0	115.9	T603 C604 E605 L606	T603-K608 WeakPolarHBondContact CG2-O 3.36Å; C604-K608 VanDerWaalsContact O-CA 3.28Å; C604-K608 WeakPolarHBondContact O-CA 3.38Å; C604-K608 PolarHBondContact O-N 3.07Å; E605-K608 WeakPolarHBondContact O-CE 3.43Å; E605-K608 PolarHBondContact O-NZ 3.48Å; L606-K608 VanDerWaalsContact C-N 3.3Å; L606-K608 PolarHBondContact O-N 2.93Å
609	E	92.9	Very high	87.5	Confident	71 Å²	71	77.1 Å²	77.1	33%	0.332	39%	0.387	S	S	.	.	P	Polyproline II helix	trans	-83.2	159.6	171.8	-60.7	-164.1	133.3	0	0	112.2	K571 C604 C607	K571-E609 VanDerWaalsContact CB-OE2 3.25Å; K571-E609 WeakPolarHBondContact CB-OE2 3.24Å; K571-E609 VanDerWaalsContact CD-OE2 3.28Å; K571-E609 WeakPolarHBondContact CD-OE2 3.43Å; K571-E609 WeakPolarHBondContact CG-OE2 3.42Å; K571-E609 IonicContact NZ-OE1 3.86Å; K571-E609 PolarHBondContact NZ-OE1 2.94Å; K571-E609 IonicContact NZ-OE2 3.23Å; K571-E609 PolarHBondContact NZ-OE2 3.25Å; C604-E609 PolarHBondContact N-O 3.26Å; C607-E609 PolarHBondContact O-N 2.89Å; C607-E609 VanDerWaalsContact O-N 3.11Å
610	K	91.9	Very high	87.3	Confident	166 Å²	166	70.9 Å²	70.9	72%	0.722	36%	0.358	S	S	*	.	B	Isolated β-bridge	trans	-63.3	148.7	171.1	-68.3	-171.2	176.1	-173.7	0	110.9	T602	T602-K610 WeakPolarHBondContact O-CA 3.19Å
611	L	90.6	Very high	87.1	Confident	21 Å²	21	73.1 Å²	73.1	11%	0.11	36%	0.361	C	S	.	.	P	Polyproline II helix	trans	-84.8	130.4	-179.2	-59.6	173.9	0	0	0	111.2	P569 C570 W587 L588 V601 T602 C604 L613	P569-L611 HydrophobicContact CB-CD2 4.47Å; P569-L611 CarbonylContact O-C 3.59Å; P569-L611 WeakPolarHBondContact O-CA 3.32Å; P569-L611 WeakPolarHBondContact O-CD2 3.4Å; C570-L611 HydrophobicContact CB-CD2 3.98Å; W587-L611 HydrophobicContact CH2-CD1 4.02Å; W587-L611 HydrophobicContact CZ3-CD1 3.59Å; L588-L611 HydrophobicContact CD2-CD1 4.13Å; V601-L611 WeakPolarHBondContact O-CD1 3.32Å; T602-L611 WeakPolarHBondContact O-CG 3.5Å; T602-L611 PolarHBondContact O-N 2.99Å; C604-L611 HydrophobicContact CB-CD2 3.71Å; L611-L613 HydrophobicContact CB-CD1 3.54Å; L611-L613 HydrophobicContact CB-CD2 4.07Å; L611-L613 HydrophobicContact CB-CG 3.59Å; L611-L613 HydrophobicContact CD1-CD1 4.05Å; L611-L613 HydrophobicContact CG-CD1 4.45Å; L611-L613 PolarHBondContact O-N 3.22Å
612	E	85.6	Confident	87	Confident	118 Å²	118	79 Å²	79	55%	0.551	39%	0.388	S	S	*	.			trans	-88.4	92.6	176	-67.8	-172.1	-152	0	0	109.5	P569	P569-E612 PolarHBondContact O-N 3.25Å
613	L	81.5	Confident	86.8	Confident	27 Å²	27	79.9 Å²	79.9	14%	0.141	39%	0.392	C	S	.	.			trans	-113.7	63.4	-165.6	-62.4	172.7	0	0	0	112	P569 M584 L588 L611 L615 I620	P569-L613 HydrophobicContact CB-CD2 4.2Å; M584-L613 HydrophobicContact CG-CD2 3.54Å; M584-L613 HydrophobicContact SD-CD2 3.82Å; L588-L613 HydrophobicContact CD1-CD1 3.69Å; L588-L613 HydrophobicContact CD1-CD2 4.1Å; L588-L613 HydrophobicContact CD1-CG 4.47Å; L588-L613 HydrophobicContact CD2-CD1 3.88Å; L588-L613 HydrophobicContact CG-CD1 4.44Å; L611-L613 HydrophobicContact CB-CD1 3.54Å; L611-L613 HydrophobicContact CB-CD2 4.07Å; L611-L613 HydrophobicContact CB-CG 3.59Å; L611-L613 HydrophobicContact CD1-CD1 4.05Å; L611-L613 HydrophobicContact CG-CD1 4.45Å; L611-L613 PolarHBondContact O-N 3.22Å; L613-L615 HydrophobicContact CB-CD1 4.19Å; L613-L615 HydrophobicContact CB-CG 4.38Å; L613-L615 HydrophobicContact CD2-CD1 4.25Å; L613-L615 PolarHBondContact O-N 3.38Å; L613-I620 HydrophobicContact CB-CD1 3.73Å; L613-I620 HydrophobicContact CD1-CD1 3.46Å; L613-I620 VanDerWaalsContact CD1-CD1 3.46Å; L613-I620 HydrophobicContact CD1-CG1 4.34Å; L613-I620 HydrophobicContact CG-CD1 4.24Å
614	N	72.9	Confident	86.6	Confident	151 Å²	151	80.7 Å²	80.7	81%	0.807	39%	0.394	S	S	*	.			trans	-73.8	78.8	171.1	-66.1	-59.4	0	0	0	109.9
615	L	79	Confident	86.5	Confident	17 Å²	17	87.3 Å²	87.3	9%	0.089	42%	0.418	C	S	.	.			trans	-114.2	105.2	-173.8	-64.8	174.8	0	0	0	110.2	I567 Q581 M584 K585 L588 L613 D617 F618	I567-L615 HydrophobicContact CD1-CD2 4.16Å; Q581-L615 HydrophobicContact CG-CD2 3.51Å; M584-L615 HydrophobicContact CG-CD1 4.47Å; K585-L615 HydrophobicContact CG-CD1 4.08Å; L588-L615 HydrophobicContact CD1-CD1 4.07Å; L613-L615 HydrophobicContact CB-CD1 4.19Å; L613-L615 HydrophobicContact CB-CG 4.38Å; L613-L615 HydrophobicContact CD2-CD1 4.25Å; L613-L615 PolarHBondContact O-N 3.38Å; L615-D617 PolarHBondContact O-N 3Å; L615-F618 HydrophobicContact CB-CB 3.93Å; L615-F618 HydrophobicContact CB-CD1 4.49Å; L615-F618 HydrophobicContact CD1-CD1 3.76Å; L615-F618 HydrophobicContact CD1-CE1 4.33Å; L615-F618 HydrophobicContact CD1-CG 4.46Å; L615-F618 PolarHBondContact O-N 3.45Å
616	E	74.8	Confident	86.3	Confident	163 Å²	163	85.8 Å²	85.8	76%	0.762	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.2	138.2	170.5	-64.2	179.8	164	0	0	110.2	K585 F618	K585-E616 PolarHBondContact NZ-O 3.28Å; E616-F618 PolarHBondContact O-N 3.21Å
617	D	77	Confident	86.2	Confident	165 Å²	165	83.4 Å²	83.4	88%	0.882	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.5	43.2	-175.5	-53.5	-28.9	0	0	0	115.1	L615	L615-D617 PolarHBondContact O-N 3Å
618	F	81.1	Confident	85.9	Confident	43 Å²	43	83.8 Å²	83.8	19%	0.189	41%	0.413	C	S	.	.			trans	-154.7	88	176.3	-164.5	-99.3	0	0	0	114.7	K585 L588 L615 E616 I620 L623	K585-F618 HydrophobicContact CB-CD2 4.46Å; K585-F618 HydrophobicContact CB-CE2 4.16Å; K585-F618 HydrophobicContact CB-CZ 4.34Å; K585-F618 HydrophobicContact CD-CB 4.27Å; K585-F618 HydrophobicContact CD-CD2 3.9Å; K585-F618 HydrophobicContact CD-CE2 4.43Å; K585-F618 HydrophobicContact CD-CG 4.11Å; K585-F618 HydrophobicContact CG-CD1 4.3Å; K585-F618 HydrophobicContact CG-CD2 3.98Å; K585-F618 HydrophobicContact CG-CE1 4.48Å; K585-F618 HydrophobicContact CG-CE2 4.16Å; K585-F618 HydrophobicContact CG-CG 4.05Å; K585-F618 HydrophobicContact CG-CZ 4.4Å; L588-F618 HydrophobicContact CB-CE1 4.11Å; L588-F618 HydrophobicContact CB-CZ 4.17Å; L588-F618 HydrophobicContact CD1-CE1 3.76Å; L615-F618 HydrophobicContact CB-CB 3.93Å; L615-F618 HydrophobicContact CB-CD1 4.49Å; L615-F618 HydrophobicContact CD1-CD1 3.76Å; L615-F618 HydrophobicContact CD1-CE1 4.33Å; L615-F618 HydrophobicContact CD1-CG 4.46Å; L615-F618 PolarHBondContact O-N 3.45Å; E616-F618 PolarHBondContact O-N 3.21Å; F618-I620 HydrophobicContact CD1-CG1 3.89Å; F618-I620 HydrophobicContact CE1-CG1 3.75Å; F618-I620 PolarHBondContact O-N 3.48Å; F618-L623 HydrophobicContact CE2-CD2 3.78Å; F618-L623 HydrophobicContact CZ-CD2 3.56Å
619	D	85.5	Confident	85.8	Confident	68 Å²	68	81 Å²	81	36%	0.364	41%	0.405	S	S	.	.			trans	-80.5	111.9	166.1	-179.3	17.7	0	0	0	111.1	H621 E622 L623 R625	D619-H621 VanDerWaalsContact C-N 3.27Å; D619-H621 PolarHBondContact O-N 3.41Å; D619-H621 WeakPolarHBondContact OD1-CA 3.09Å; D619-H621 VanDerWaalsContact OD1-CB 3.31Å; D619-H621 WeakPolarHBondContact OD1-CB 3.33Å; D619-H621 IonicContact OD1-CD2 2.73Å; D619-H621 IonicContact OD1-CG 3.79Å; D619-H621 PolarHBondContact OD1-N 3.05Å; D619-E622 HydrophobicContact CB-CB 3.81Å; D619-E622 VanDerWaalsContact CG-N 3.27Å; D619-E622 PolarHBondContact O-N 2.95Å; D619-E622 VanDerWaalsContact OD2-CB 3.31Å; D619-E622 WeakPolarHBondContact OD2-CB 3.48Å; D619-E622 PolarHBondContact OD2-N 3Å; D619-L623 PolarHBondContact O-N 2.9Å; D619-R625 IonicContact OD2-NH1 3.5Å; D619-R625 IonicContact OD2-NH2 3.95Å; D619-R625 PolarHBondContact OD2-NH2 2.7Å
620	I	87.2	Confident	85.6	Confident	16 Å²	16	83.9 Å²	83.9	8%	0.082	42%	0.419	C	S	.	.	H	α-helix	trans	-63.9	-34.3	175.5	-57.3	136.2	0	0	0	111.1	L588 I592 L598 V601 T602 L613 F618 H624	L588-I620 HydrophobicContact CD1-CG1 4.34Å; I592-I620 HydrophobicContact CD1-CG2 4.36Å; L598-I620 HydrophobicContact CD1-CG2 4.43Å; V601-I620 HydrophobicContact CG1-CG2 4.05Å; T602-I620 HydrophobicContact CG2-CG2 3.94Å; L613-I620 HydrophobicContact CB-CD1 3.73Å; L613-I620 HydrophobicContact CD1-CD1 3.46Å; L613-I620 VanDerWaalsContact CD1-CD1 3.46Å; L613-I620 HydrophobicContact CD1-CG1 4.34Å; L613-I620 HydrophobicContact CG-CD1 4.24Å; F618-I620 HydrophobicContact CD1-CG1 3.89Å; F618-I620 HydrophobicContact CE1-CG1 3.75Å; F618-I620 PolarHBondContact O-N 3.48Å; I620-H624 VanDerWaalsContact O-CB 3.32Å; I620-H624 WeakPolarHBondContact O-CB 3.36Å; I620-H624 PolarHBondContact O-N 2.59Å
621	H	86.8	Confident	85.4	Confident	92 Å²	92	80 Å²	80	43%	0.426	40%	0.403	S	S	.	.	H	α-helix	trans	-71.9	-38.8	179.2	-61	-84.9	0	0	0	111	L598 D619 R625	L598-H621 WeakPolarHBondContact CD2-ND1 3.33Å; D619-H621 VanDerWaalsContact C-N 3.27Å; D619-H621 PolarHBondContact O-N 3.41Å; D619-H621 WeakPolarHBondContact OD1-CA 3.09Å; D619-H621 VanDerWaalsContact OD1-CB 3.31Å; D619-H621 WeakPolarHBondContact OD1-CB 3.33Å; D619-H621 IonicContact OD1-CD2 2.73Å; D619-H621 IonicContact OD1-CG 3.79Å; D619-H621 PolarHBondContact OD1-N 3.05Å; H621-R625 VanDerWaalsContact C-NH1 3.35Å; H621-R625 VanDerWaalsContact CB-NH1 3.29Å; H621-R625 WeakPolarHBondContact O-CB 3.39Å; H621-R625 VanDerWaalsContact O-CG 3.24Å; H621-R625 WeakPolarHBondContact O-CG 3.29Å; H621-R625 PolarHBondContact O-N 3.39Å; H621-R625 PolarHBondContact O-NH1 3.01Å
622	E	90.3	Very high	85.2	Confident	123 Å²	123	81.4 Å²	81.4	58%	0.575	42%	0.418	S	S	*	.	H	α-helix	trans	-63	-48.4	171.8	-170.6	160.1	-135.4	0	0	111.8	D619 H624 R625 A626	D619-E622 HydrophobicContact CB-CB 3.81Å; D619-E622 VanDerWaalsContact CG-N 3.27Å; D619-E622 PolarHBondContact O-N 2.95Å; D619-E622 VanDerWaalsContact OD2-CB 3.31Å; D619-E622 WeakPolarHBondContact OD2-CB 3.48Å; D619-E622 PolarHBondContact OD2-N 3Å; E622-H624 VanDerWaalsContact C-N 3.32Å; E622-H624 PolarHBondContact O-N 3.28Å; E622-R625 VanDerWaalsContact CB-NH2 3.3Å; E622-R625 PolarHBondContact O-N 3.49Å; E622-R625 VanDerWaalsContact O-N 3.14Å; E622-A626 WeakPolarHBondContact O-CB 3.24Å; E622-A626 PolarHBondContact O-N 2.99Å
623	L	87.6	Confident	85.4	Confident	44 Å²	44	81 Å²	81	23%	0.23	42%	0.416	C	S	.	.	H	α-helix	trans	-60.6	-40.6	178	-174.8	59.5	0	0	0	112.2	Q589 I592 F618 D619 H627	Q589-L623 HydrophobicContact CB-CD2 4.28Å; Q589-L623 HydrophobicContact CG-CD2 4.36Å; I592-L623 HydrophobicContact CD1-CB 4.09Å; I592-L623 HydrophobicContact CD1-CD2 3.78Å; I592-L623 HydrophobicContact CD1-CG 3.78Å; F618-L623 HydrophobicContact CE2-CD2 3.78Å; F618-L623 HydrophobicContact CZ-CD2 3.56Å; D619-L623 PolarHBondContact O-N 2.9Å; L623-H627 WeakPolarHBondContact O-CB 3.5Å; L623-H627 PolarHBondContact O-N 3.43Å
624	H	89.2	Confident	85.8	Confident	46 Å²	46	87.2 Å²	87.2	21%	0.213	44%	0.439	C	S	.	.	H	α-helix	trans	-67.2	-40.6	173.8	-179.5	-68	0	0	0	112.3	I592 L598 I620 E622 A628	I592-H624 HydrophobicContact CD1-CB 4.39Å; L598-H624 HydrophobicContact CD1-CB 4.22Å; L598-H624 PolarHBondContact N-NE2 3.44Å; I620-H624 VanDerWaalsContact O-CB 3.32Å; I620-H624 WeakPolarHBondContact O-CB 3.36Å; I620-H624 PolarHBondContact O-N 2.59Å; E622-H624 VanDerWaalsContact C-N 3.32Å; E622-H624 PolarHBondContact O-N 3.28Å; H624-A628 VanDerWaalsContact O-CB 3.29Å; H624-A628 WeakPolarHBondContact O-CB 3.47Å; H624-A628 PolarHBondContact O-N 3.08Å
625	R	90.6	Very high	86.6	Confident	139 Å²	139	85.2 Å²	85.2	53%	0.525	43%	0.425	S	S	.	.	H	α-helix	trans	-61.5	-45.6	174.8	-76.2	-176.7	-53.8	-94.1	3.5	111.1	D619 H621 E622 A628 N629	D619-R625 IonicContact OD2-NH1 3.5Å; D619-R625 IonicContact OD2-NH2 3.95Å; D619-R625 PolarHBondContact OD2-NH2 2.7Å; H621-R625 VanDerWaalsContact C-NH1 3.35Å; H621-R625 VanDerWaalsContact CB-NH1 3.29Å; H621-R625 WeakPolarHBondContact O-CB 3.39Å; H621-R625 VanDerWaalsContact O-CG 3.24Å; H621-R625 WeakPolarHBondContact O-CG 3.29Å; H621-R625 PolarHBondContact O-N 3.39Å; H621-R625 PolarHBondContact O-NH1 3.01Å; E622-R625 VanDerWaalsContact CB-NH2 3.3Å; E622-R625 PolarHBondContact O-N 3.49Å; E622-R625 VanDerWaalsContact O-N 3.14Å; R625-A628 PolarHBondContact O-N 3.15Å; R625-N629 WeakPolarHBondContact O-CB 3.48Å; R625-N629 PolarHBondContact O-N 3.31Å
626	A	89.4	Confident	87.2	Confident	53 Å²	53	92 Å²	92	44%	0.438	45%	0.454	S	S	.	.	H	α-helix	trans	-61.9	-48.4	179.6	0	0	0	0	0	111.8	E622 A628 N629 E630	E622-A626 WeakPolarHBondContact O-CB 3.24Å; E622-A626 PolarHBondContact O-N 2.99Å; A626-A628 PolarHBondContact O-N 2.91Å; A626-N629 WeakPolarHBondContact O-CB 3.48Å; A626-N629 PolarHBondContact O-N 3.4Å; A626-E630 PolarHBondContact O-N 2.74Å
627	H	89.2	Confident	88	Confident	37 Å²	37	88.8 Å²	88.8	17%	0.171	44%	0.441	C	S	.	.	H	α-helix	trans	-65.6	-38.1	178	-173.6	-89.8	0	0	0	112.8	I592 L623 N629 E630 Q631	I592-H627 HydrophobicContact CG2-CB 3.52Å; I592-H627 PolarHBondContact O-ND1 3.37Å; L623-H627 WeakPolarHBondContact O-CB 3.5Å; L623-H627 PolarHBondContact O-N 3.43Å; H627-N629 VanDerWaalsContact C-N 3.29Å; H627-N629 PolarHBondContact O-N 2.94Å; H627-E630 PolarHBondContact O-N 2.82Å; H627-Q631 WeakPolarHBondContact O-CB 3.39Å; H627-Q631 PolarHBondContact O-N 3.4Å
628	A	88.3	Confident	88.7	Confident	51 Å²	51	83.8 Å²	83.8	42%	0.421	42%	0.419	S	S	.	.	H	α-helix	trans	-64	-35.5	174.4	0	0	0	0	0	112.2	H624 R625 A626 A632	H624-A628 VanDerWaalsContact O-CB 3.29Å; H624-A628 WeakPolarHBondContact O-CB 3.47Å; H624-A628 PolarHBondContact O-N 3.08Å; R625-A628 PolarHBondContact O-N 3.15Å; A626-A628 PolarHBondContact O-N 2.91Å; A628-A632 WeakPolarHBondContact O-CB 3.36Å; A628-A632 PolarHBondContact O-N 2.81Å; A628-A632 VanDerWaalsContact O-N 3.08Å
629	N	89.7	Confident	89.3	Confident	90 Å²	90	84.5 Å²	84.5	48%	0.481	43%	0.429	S	S	.	.	H	α-helix	trans	-69.5	-46.5	173.6	-175.4	92.5	0	0	0	111.9	R625 A626 H627 Q631 A632 E633	R625-N629 WeakPolarHBondContact O-CB 3.48Å; R625-N629 PolarHBondContact O-N 3.31Å; A626-N629 WeakPolarHBondContact O-CB 3.48Å; A626-N629 PolarHBondContact O-N 3.4Å; H627-N629 VanDerWaalsContact C-N 3.29Å; H627-N629 PolarHBondContact O-N 2.94Å; N629-Q631 VanDerWaalsContact C-N 3.32Å; N629-Q631 PolarHBondContact O-N 2.74Å; N629-A632 PolarHBondContact O-N 3.4Å; N629-A632 VanDerWaalsContact O-N 3.15Å; N629-E633 PolarHBondContact ND2-OE1 3.35Å; N629-E633 WeakPolarHBondContact O-CG 3.33Å; N629-E633 PolarHBondContact O-N 3.13Å
630	E	89.8	Confident	89.7	Confident	131 Å²	131	82.6 Å²	82.6	61%	0.612	43%	0.426	S	S	*	.	H	α-helix	trans	-59.3	-41.3	176.6	-175.1	176.1	-170	0	0	112	A626 H627 E633 Y634	A626-E630 PolarHBondContact O-N 2.74Å; H627-E630 PolarHBondContact O-N 2.82Å; E630-E633 PolarHBondContact O-N 3.06Å; E630-Y634 WeakPolarHBondContact O-CB 3.35Å; E630-Y634 PolarHBondContact O-N 2.92Å
631	Q	87.4	Confident	90	Very high	84 Å²	84	87.1 Å²	87.1	39%	0.393	45%	0.449	S	S	.	.	H	α-helix	trans	-62.9	-44.3	173.5	-177.6	63.7	29.5	0	0	111.8	H627 N629 Y634 E635	H627-Q631 WeakPolarHBondContact O-CB 3.39Å; H627-Q631 PolarHBondContact O-N 3.4Å; N629-Q631 VanDerWaalsContact C-N 3.32Å; N629-Q631 PolarHBondContact O-N 2.74Å; Q631-Y634 PolarHBondContact O-N 3.37Å; Q631-E635 PolarHBondContact NE2-OE1 3.16Å; Q631-E635 WeakPolarHBondContact O-CG 3.44Å; Q631-E635 PolarHBondContact O-N 3.35Å
632	A	87.1	Confident	90.4	Very high	52 Å²	52	89.6 Å²	89.6	43%	0.43	46%	0.456	S	S	.	.	H	α-helix	trans	-66.5	-37.6	177.4	0	0	0	0	0	112.6	A628 N629 E635 F636	A628-A632 WeakPolarHBondContact O-CB 3.36Å; A628-A632 PolarHBondContact O-N 2.81Å; A628-A632 VanDerWaalsContact O-N 3.08Å; N629-A632 PolarHBondContact O-N 3.4Å; N629-A632 VanDerWaalsContact O-N 3.15Å; A632-E635 PolarHBondContact O-N 3.35Å; A632-F636 VanDerWaalsContact O-CB 3.28Å; A632-F636 WeakPolarHBondContact O-CB 3.28Å; A632-F636 PolarHBondContact O-N 2.72Å
633	E	88.9	Confident	90.5	Very high	109 Å²	109	88.6 Å²	88.6	51%	0.509	45%	0.454	S	S	.	.	H	α-helix	trans	-63.9	-43	172	-76.3	-179.5	-163.8	0	0	111.3	N629 E630 F636 I637	N629-E633 PolarHBondContact ND2-OE1 3.35Å; N629-E633 WeakPolarHBondContact O-CG 3.33Å; N629-E633 PolarHBondContact O-N 3.13Å; E630-E633 PolarHBondContact O-N 3.06Å; E633-F636 PolarHBondContact O-N 2.84Å; E633-I637 WeakPolarHBondContact O-CB 3.47Å; E633-I637 WeakPolarHBondContact O-CD1 3.47Å; E633-I637 WeakPolarHBondContact O-CG1 3.49Å; E633-I637 PolarHBondContact O-N 3.46Å
634	Y	89.2	Confident	90.9	Very high	157 Å²	157	90.9 Å²	90.9	62%	0.616	47%	0.47	S	S	*	.	H	α-helix	trans	-63.7	-42	175.5	-174.5	-96.4	0	0	0	112.3	E630 Q631 I637 S638	E630-Y634 WeakPolarHBondContact O-CB 3.35Å; E630-Y634 PolarHBondContact O-N 2.92Å; Q631-Y634 PolarHBondContact O-N 3.37Å; Y634-I637 PolarHBondContact O-N 3.36Å; Y634-S638 WeakPolarHBondContact O-CB 3.48Å; Y634-S638 PolarHBondContact O-N 3.31Å
635	E	90.4	Very high	91.2	Very high	109 Å²	109	93.4 Å²	93.4	51%	0.509	49%	0.488	S	S	.	.	H	α-helix	trans	-66.6	-38.8	175.4	-74.7	176.6	-161.7	0	0	112.2	Q631 A632 S638 S639	Q631-E635 PolarHBondContact NE2-OE1 3.16Å; Q631-E635 WeakPolarHBondContact O-CG 3.44Å; Q631-E635 PolarHBondContact O-N 3.35Å; A632-E635 PolarHBondContact O-N 3.35Å; E635-S638 PolarHBondContact O-N 2.91Å; E635-S639 VanDerWaalsContact O-CB 3.31Å; E635-S639 WeakPolarHBondContact O-CB 3.38Å; E635-S639 PolarHBondContact O-N 3.45Å; E635-S639 PolarHBondContact O-OG 3.49Å
636	F	91.7	Very high	91.3	Very high	159 Å²	159	89.8 Å²	89.8	70%	0.697	48%	0.479	S	S	*	.	H	α-helix	trans	-65.4	-43.9	173.6	-178.2	-99.2	0	0	0	112.2	A632 E633 S639 G640	A632-F636 VanDerWaalsContact O-CB 3.28Å; A632-F636 WeakPolarHBondContact O-CB 3.28Å; A632-F636 PolarHBondContact O-N 2.72Å; E633-F636 PolarHBondContact O-N 2.84Å; F636-S639 WeakPolarHBondContact CA-OG 3.21Å; F636-S639 PolarHBondContact O-OG 2.76Å; F636-G640 PolarHBondContact O-N 3.41Å
637	I	91.9	Very high	91.5	Very high	97 Å²	97	93 Å²	93	50%	0.497	49%	0.488	S	S	.	.	H	α-helix	trans	-65	-43.7	175.5	-69.6	163.4	0	0	0	110.4	E633 Y634 G640 L641	E633-I637 WeakPolarHBondContact O-CB 3.47Å; E633-I637 WeakPolarHBondContact O-CD1 3.47Å; E633-I637 WeakPolarHBondContact O-CG1 3.49Å; E633-I637 PolarHBondContact O-N 3.46Å; Y634-I637 PolarHBondContact O-N 3.36Å; I637-G640 PolarHBondContact O-N 2.81Å; I637-L641 HydrophobicContact CG2-CD1 3.87Å; I637-L641 HydrophobicContact CG2-CG 4.4Å; I637-L641 WeakPolarHBondContact O-CB 3.46Å; I637-L641 VanDerWaalsContact O-CG 3.23Å; I637-L641 WeakPolarHBondContact O-CG 3.43Å; I637-L641 PolarHBondContact O-N 3.1Å
638	S	92.1	Very high	91.7	Very high	60 Å²	60	97.1 Å²	97.1	42%	0.42	51%	0.507	S	S	.	.	H	α-helix	trans	-63.1	-48.1	179.1	-174.8	0	0	0	0	112.1	Y634 E635 L641 Y642	Y634-S638 WeakPolarHBondContact O-CB 3.48Å; Y634-S638 PolarHBondContact O-N 3.31Å; E635-S638 PolarHBondContact O-N 2.91Å; S638-L641 PolarHBondContact O-N 2.86Å; S638-Y642 WeakPolarHBondContact O-CB 3.28Å; S638-Y642 PolarHBondContact O-N 3.47Å
639	S	92.3	Very high	91.9	Very high	57 Å²	57	100.2 Å²	100.2	40%	0.399	52%	0.516	S	S	.	.	H	α-helix	trans	-68	-38.4	176.8	55.8	0	0	0	0	112.6	E635 F636 Y642 L643	E635-S639 VanDerWaalsContact O-CB 3.31Å; E635-S639 WeakPolarHBondContact O-CB 3.38Å; E635-S639 PolarHBondContact O-N 3.45Å; E635-S639 PolarHBondContact O-OG 3.49Å; F636-S639 WeakPolarHBondContact CA-OG 3.21Å; F636-S639 PolarHBondContact O-OG 2.76Å; S639-Y642 PolarHBondContact O-N 2.83Å; S639-L643 WeakPolarHBondContact O-CG 3.47Å; S639-L643 PolarHBondContact O-N 3.35Å
640	G	94.5	Very high	91.9	Very high	29 Å²	29	98.7 Å²	98.7	30%	0.299	51%	0.512	S	S	.	.	H	α-helix	trans	-61.9	-45.1	172.4	0	0	0	0	0	112.8	F636 I637 Y642 L643 V644	F636-G640 PolarHBondContact O-N 3.41Å; I637-G640 PolarHBondContact O-N 2.81Å; G640-Y642 VanDerWaalsContact C-N 3.35Å; G640-L643 PolarHBondContact O-N 3.01Å; G640-V644 WeakPolarHBondContact O-CG2 3.36Å; G640-V644 PolarHBondContact O-N 2.75Å
641	L	94.1	Very high	91.9	Very high	110 Å²	110	97.8 Å²	97.8	58%	0.576	51%	0.508	S	S	*	.	H	α-helix	trans	-64.1	-39.1	174.2	-73.3	171.3	0	0	0	111.9	I637 S638 V644 V645	I637-L641 HydrophobicContact CG2-CD1 3.87Å; I637-L641 HydrophobicContact CG2-CG 4.4Å; I637-L641 WeakPolarHBondContact O-CB 3.46Å; I637-L641 VanDerWaalsContact O-CG 3.23Å; I637-L641 WeakPolarHBondContact O-CG 3.43Å; I637-L641 PolarHBondContact O-N 3.1Å; S638-L641 PolarHBondContact O-N 2.86Å; L641-V644 PolarHBondContact O-N 3.03Å; L641-V645 WeakPolarHBondContact O-CG2 3.44Å; L641-V645 PolarHBondContact O-N 3.4Å
642	Y	94.8	Very high	92	Very high	145 Å²	145	98.4 Å²	98.4	57%	0.569	51%	0.51	S	S	*	.	H	α-helix	trans	-62.2	-44.3	174.2	177.2	-111.9	0	0	0	112	S638 S639 G640 V644 V645 L646	S638-Y642 WeakPolarHBondContact O-CB 3.28Å; S638-Y642 PolarHBondContact O-N 3.47Å; S639-Y642 PolarHBondContact O-N 2.83Å; G640-Y642 VanDerWaalsContact C-N 3.35Å; Y642-V644 PolarHBondContact O-N 3.35Å; Y642-V645 PolarHBondContact O-N 3.19Å; Y642-L646 HydrophobicContact CD1-CD1 4.04Å; Y642-L646 HydrophobicContact CD1-CG 4.49Å; Y642-L646 HydrophobicContact CE1-CD1 3.47Å; Y642-L646 VanDerWaalsContact CE1-CD1 3.47Å; Y642-L646 HydrophobicContact CE1-CG 4.13Å; Y642-L646 HydrophobicContact CE2-CD1 4.37Å; Y642-L646 HydrophobicContact CE2-CD2 4.29Å; Y642-L646 HydrophobicContact CE2-CG 4.17Å; Y642-L646 WeakPolarHBondContact O-CG 3.46Å; Y642-L646 PolarHBondContact O-N 3.36Å
643	L	93.3	Very high	91.7	Very high	102 Å²	102	98.9 Å²	98.9	53%	0.534	51%	0.51	S	S	.	.	H	α-helix	trans	-61.9	-41.1	174.3	-73	170	0	0	0	112.1	S639 G640 V645 L646 L647	S639-L643 WeakPolarHBondContact O-CG 3.47Å; S639-L643 PolarHBondContact O-N 3.35Å; G640-L643 PolarHBondContact O-N 3.01Å; L643-V645 PolarHBondContact O-N 3.12Å; L643-L646 PolarHBondContact O-N 2.88Å; L643-L647 WeakPolarHBondContact O-CB 3.44Å; L643-L647 VanDerWaalsContact O-CG 3.27Å; L643-L647 WeakPolarHBondContact O-CG 3.31Å; L643-L647 PolarHBondContact O-N 2.88Å
644	V	95.3	Very high	91.2	Very high	92 Å²	92	99.3 Å²	99.3	56%	0.558	51%	0.511	S	S	*	.	H	α-helix	trans	-62.3	-41.8	174.3	169.8	0	0	0	0	111.5	G640 L641 Y642 L647 H648	G640-V644 WeakPolarHBondContact O-CG2 3.36Å; G640-V644 PolarHBondContact O-N 2.75Å; L641-V644 PolarHBondContact O-N 3.03Å; Y642-V644 PolarHBondContact O-N 3.35Å; V644-L647 PolarHBondContact O-N 2.91Å; V644-H648 WeakPolarHBondContact O-CB 3.39Å; V644-H648 PolarHBondContact O-N 3.44Å
645	V	95.5	Very high	90.7	Very high	98 Å²	98	95 Å²	95	59%	0.594	50%	0.503	S	S	*	.	H	α-helix	trans	-65.8	-41.1	175.8	170.1	0	0	0	0	111.7	L641 Y642 L643 L649	L641-V645 WeakPolarHBondContact O-CG2 3.44Å; L641-V645 PolarHBondContact O-N 3.4Å; Y642-V645 PolarHBondContact O-N 3.19Å; L643-V645 PolarHBondContact O-N 3.12Å; V645-L649 WeakPolarHBondContact O-CB 3.14Å; V645-L649 PolarHBondContact O-N 3.48Å
646	L	93.3	Very high	90.1	Very high	63 Å²	63	94.4 Å²	94.4	33%	0.33	50%	0.504	S	S	.	.	H	α-helix	trans	-62.7	-47.3	174	-74.9	-177.3	0	0	0	111.7	Y642 L643 H648 L649 C650	Y642-L646 HydrophobicContact CD1-CD1 4.04Å; Y642-L646 HydrophobicContact CD1-CG 4.49Å; Y642-L646 HydrophobicContact CE1-CD1 3.47Å; Y642-L646 VanDerWaalsContact CE1-CD1 3.47Å; Y642-L646 HydrophobicContact CE1-CG 4.13Å; Y642-L646 HydrophobicContact CE2-CD1 4.37Å; Y642-L646 HydrophobicContact CE2-CD2 4.29Å; Y642-L646 HydrophobicContact CE2-CG 4.17Å; Y642-L646 WeakPolarHBondContact O-CG 3.46Å; Y642-L646 PolarHBondContact O-N 3.36Å; L643-L646 PolarHBondContact O-N 2.88Å; L646-H648 VanDerWaalsContact C-N 3.33Å; L646-H648 PolarHBondContact O-N 3.31Å; L646-L649 PolarHBondContact O-N 2.86Å; L646-C650 WeakPolarHBondContact O-CB 3.23Å; L646-C650 PolarHBondContact O-N 2.88Å; L646-C650 PolarHBondContact O-SG 2.76Å
647	L	93.4	Very high	89.4	Confident	120 Å²	120	91.6 Å²	91.6	63%	0.628	49%	0.494	S	S	*	.	H	α-helix	trans	-59.8	-43	178.4	-75.7	168.5	0	0	0	111.7	L643 V644 C650 E651	L643-L647 WeakPolarHBondContact O-CB 3.44Å; L643-L647 VanDerWaalsContact O-CG 3.27Å; L643-L647 WeakPolarHBondContact O-CG 3.31Å; L643-L647 PolarHBondContact O-N 2.88Å; V644-L647 PolarHBondContact O-N 2.91Å; L647-C650 WeakPolarHBondContact O-CB 3.34Å; L647-C650 PolarHBondContact O-N 3.03Å; L647-E651 WeakPolarHBondContact O-CB 3.35Å; L647-E651 PolarHBondContact O-N 2.95Å
648	H	93.1	Very high	88.2	Confident	125 Å²	125	91.4 Å²	91.4	58%	0.579	49%	0.492	S	S	*	.	H	α-helix	trans	-73.3	-31.5	179.5	-156.6	47.3	0	0	0	112.5	V644 L646 E651 Q652	V644-H648 WeakPolarHBondContact O-CB 3.39Å; V644-H648 PolarHBondContact O-N 3.44Å; L646-H648 VanDerWaalsContact C-N 3.33Å; L646-H648 PolarHBondContact O-N 3.31Å; H648-E651 IonicContact CE1-OE2 3.5Å; H648-E651 IonicContact CG-OE2 3.98Å; H648-E651 IonicContact ND1-OE2 2.81Å; H648-E651 PolarHBondContact ND1-OE2 3.01Å; H648-E651 PolarHBondContact O-N 2.99Å; H648-Q652 WeakPolarHBondContact O-CB 3.43Å; H648-Q652 PolarHBondContact O-N 2.9Å
649	L	93	Very high	87	Confident	115 Å²	115	91.1 Å²	91.1	60%	0.602	50%	0.499	S	S	*	.	H	α-helix	trans	-67.1	-40.5	169.4	-179.1	61.9	0	0	0	111.6	V645 L646 Q652 S653	V645-L649 WeakPolarHBondContact O-CB 3.14Å; V645-L649 PolarHBondContact O-N 3.48Å; L646-L649 PolarHBondContact O-N 2.86Å; L649-Q652 PolarHBondContact O-N 2.94Å; L649-S653 WeakPolarHBondContact O-CB 3.29Å; L649-S653 PolarHBondContact O-N 3.44Å; L649-S653 PolarHBondContact O-OG 3.33Å
650	C	89.8	Confident	85.5	Confident	59 Å²	59	92.4 Å²	92.4	40%	0.399	50%	0.501	S	S	.	.	H	α-helix	trans	-60.5	-50.7	171.5	-72.8	0	0	0	0	110.7	L646 L647 Q652 S653 F654	L646-C650 WeakPolarHBondContact O-CB 3.23Å; L646-C650 PolarHBondContact O-N 2.88Å; L646-C650 PolarHBondContact O-SG 2.76Å; L647-C650 WeakPolarHBondContact O-CB 3.34Å; L647-C650 PolarHBondContact O-N 3.03Å; C650-Q652 VanDerWaalsContact C-N 3.35Å; C650-Q652 PolarHBondContact O-N 2.73Å; C650-S653 CarbonylContact O-C 3.59Å; C650-S653 PolarHBondContact O-N 3.45Å; C650-S653 VanDerWaalsContact O-N 3.08Å; C650-S653 PolarHBondContact O-OG 2.87Å; C650-F654 HydrophobicContact CB-CD2 4.35Å; C650-F654 HydrophobicContact CB-CE2 4.3Å; C650-F654 WeakPolarHBondContact O-CD2 3.46Å; C650-F654 PolarHBondContact O-N 3.24Å
651	E	89.3	Confident	83.7	Confident	112 Å²	112	91.8 Å²	91.8	52%	0.523	49%	0.491	S	S	.	.	H	α-helix	trans	-56.1	-44.1	177.2	-176.8	-179.6	-153.6	0	0	112.4	L647 H648 F654 S655	L647-E651 WeakPolarHBondContact O-CB 3.35Å; L647-E651 PolarHBondContact O-N 2.95Å; H648-E651 IonicContact CE1-OE2 3.5Å; H648-E651 IonicContact CG-OE2 3.98Å; H648-E651 IonicContact ND1-OE2 2.81Å; H648-E651 PolarHBondContact ND1-OE2 3.01Å; H648-E651 PolarHBondContact O-N 2.99Å; E651-F654 PolarHBondContact O-N 3.49Å; E651-S655 WeakPolarHBondContact O-CB 3.46Å; E651-S655 PolarHBondContact O-N 3.34Å; E651-S655 PolarHBondContact O-OG 3.18Å
652	Q	88.4	Confident	82.1	Confident	97 Å²	97	93.2 Å²	93.2	45%	0.453	50%	0.5	S	S	.	.	H	α-helix	trans	-63	-45.4	173.7	-175.3	62.4	55.6	0	0	111.3	H648 L649 C650 F654 S655 D656	H648-Q652 WeakPolarHBondContact O-CB 3.43Å; H648-Q652 PolarHBondContact O-N 2.9Å; L649-Q652 PolarHBondContact O-N 2.94Å; C650-Q652 VanDerWaalsContact C-N 3.35Å; C650-Q652 PolarHBondContact O-N 2.73Å; Q652-F654 PolarHBondContact O-N 3.5Å; Q652-S655 WeakPolarHBondContact O-CB 3.5Å; Q652-S655 PolarHBondContact O-N 2.96Å; Q652-S655 VanDerWaalsContact O-N 3.1Å; Q652-D656 PolarHBondContact NE2-OD1 3.13Å; Q652-D656 PolarHBondContact NE2-OD2 3.39Å; Q652-D656 VanDerWaalsContact O-CG 3.32Å; Q652-D656 PolarHBondContact O-N 3.23Å
653	S	80.8	Confident	80.8	Confident	61 Å²	61	91.1 Å²	91.1	43%	0.427	50%	0.495	S	S	.	.	H	α-helix	trans	-65.1	-36.5	178.9	76.9	0	0	0	0	112.9	L649 C650 M657	L649-S653 WeakPolarHBondContact O-CB 3.29Å; L649-S653 PolarHBondContact O-N 3.44Å; L649-S653 PolarHBondContact O-OG 3.33Å; C650-S653 CarbonylContact O-C 3.59Å; C650-S653 PolarHBondContact O-N 3.45Å; C650-S653 VanDerWaalsContact O-N 3.08Å; C650-S653 PolarHBondContact O-OG 2.87Å; S653-M657 WeakPolarHBondContact O-CB 3.38Å; S653-M657 PolarHBondContact O-N 3.21Å
654	F	79.3	Confident	79.5	Confident	119 Å²	119	90.7 Å²	90.7	52%	0.522	50%	0.498	S	S	.	.	H	α-helix	trans	-68.6	-36.2	171.7	-78.2	-62.2	0	0	0	111.2	C650 E651 Q652 M658	C650-F654 HydrophobicContact CB-CD2 4.35Å; C650-F654 HydrophobicContact CB-CE2 4.3Å; C650-F654 WeakPolarHBondContact O-CD2 3.46Å; C650-F654 PolarHBondContact O-N 3.24Å; E651-F654 PolarHBondContact O-N 3.49Å; Q652-F654 PolarHBondContact O-N 3.5Å; F654-M658 VanDerWaalsContact O-CB 3.22Å; F654-M658 WeakPolarHBondContact O-CB 3.39Å; F654-M658 WeakPolarHBondContact O-CG 3.38Å; F654-M658 PolarHBondContact O-N 3.14Å
655	S	78.4	Confident	78.2	Confident	65 Å²	65	88.4 Å²	88.4	46%	0.455	49%	0.487	S	S	.	.	H	α-helix	trans	-68.5	-41.8	176.3	-61.7	0	0	0	0	112.1	E651 Q652 M658 G659	E651-S655 WeakPolarHBondContact O-CB 3.46Å; E651-S655 PolarHBondContact O-N 3.34Å; E651-S655 PolarHBondContact O-OG 3.18Å; Q652-S655 WeakPolarHBondContact O-CB 3.5Å; Q652-S655 PolarHBondContact O-N 2.96Å; Q652-S655 VanDerWaalsContact O-N 3.1Å; S655-M658 PolarHBondContact O-N 3.44Å; S655-G659 PolarHBondContact O-N 2.96Å
656	D	78.3	Confident	76.9	Confident	98 Å²	98	85.1 Å²	85.1	52%	0.524	47%	0.467	S	S	.	.	H	α-helix	trans	-67.6	-38.9	175.5	-66.9	-21.5	0	0	0	111.2	Q652 N660	Q652-D656 PolarHBondContact NE2-OD1 3.13Å; Q652-D656 PolarHBondContact NE2-OD2 3.39Å; Q652-D656 VanDerWaalsContact O-CG 3.32Å; Q652-D656 PolarHBondContact O-N 3.23Å; D656-N660 PolarHBondContact O-N 3.42Å; D656-N660 PolarHBondContact O-ND2 2.83Å
657	M	77.4	Confident	75.8	Confident	100 Å²	100	88.2 Å²	88.2	49%	0.493	47%	0.474	S	S	.	.	H	α-helix	trans	-61.6	-54.7	172	-175	67	69.7	0	0	111.1	S653 G659 N660 T661	S653-M657 WeakPolarHBondContact O-CB 3.38Å; S653-M657 PolarHBondContact O-N 3.21Å; M657-G659 VanDerWaalsContact C-N 3.31Å; M657-G659 PolarHBondContact O-N 2.99Å; M657-N660 WeakPolarHBondContact CA-ND2 3.27Å; M657-N660 PolarHBondContact O-N 3.17Å; M657-N660 VanDerWaalsContact O-N 3.1Å; M657-N660 PolarHBondContact O-ND2 3.33Å; M657-N660 VanDerWaalsContact O-ND2 3.12Å; M657-N660 PolarHBondContact O-OD1 3.27Å; M657-T661 PolarHBondContact O-N 3.18Å
658	M	66.9	Low	75	Confident	92 Å²	92	86.6 Å²	86.6	45%	0.453	47%	0.469	S	S	.	.	H	α-helix	trans	-63.5	-36.1	-179.5	-73.4	-66.7	-70.9	0	0	112.1	F654 S655 N660 T661 F670	F654-M658 VanDerWaalsContact O-CB 3.22Å; F654-M658 WeakPolarHBondContact O-CB 3.39Å; F654-M658 WeakPolarHBondContact O-CG 3.38Å; F654-M658 PolarHBondContact O-N 3.14Å; S655-M658 PolarHBondContact O-N 3.44Å; M658-N660 PolarHBondContact O-N 2.87Å; M658-T661 WeakPolarHBondContact O-CB 3.46Å; M658-T661 PolarHBondContact O-N 2.95Å; M658-T661 PolarHBondContact O-OG1 2.85Å; M658-T661 HydrophobicContact SD-CG2 4.13Å; M658-F670 HydrophobicContact SD-CE2 4.41Å; M658-F670 HydrophobicContact SD-CZ 4.47Å
659	G	66.8	Low	74.1	Confident	54 Å²	54	88.7 Å²	88.7	56%	0.557	47%	0.472	S	S	*	.	H	α-helix	trans	-60.9	-21.4	174.8	0	0	0	0	0	114.3	S655 M657	S655-G659 PolarHBondContact O-N 2.96Å; M657-G659 VanDerWaalsContact C-N 3.31Å; M657-G659 PolarHBondContact O-N 2.99Å
660	N	60	Low	73.2	Confident	84 Å²	84	87 Å²	87	45%	0.449	46%	0.459	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.6	3.5	172.2	74	74.3	0	0	0	114.6	D656 M657 M658 N662	D656-N660 PolarHBondContact O-N 3.42Å; D656-N660 PolarHBondContact O-ND2 2.83Å; M657-N660 WeakPolarHBondContact CA-ND2 3.27Å; M657-N660 PolarHBondContact O-N 3.17Å; M657-N660 VanDerWaalsContact O-N 3.1Å; M657-N660 PolarHBondContact O-ND2 3.33Å; M657-N660 VanDerWaalsContact O-ND2 3.12Å; M657-N660 PolarHBondContact O-OD1 3.27Å; M658-N660 PolarHBondContact O-N 2.87Å; N660-N662 PolarHBondContact O-N 3.32Å
661	T	57.7	Low	72.7	Confident	16 Å²	16	88.2 Å²	88.2	10%	0.098	46%	0.461	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.4	17.3	175.3	66.8	0	0	0	0	115.5	M657 M658 E663 T666 R667	M657-T661 PolarHBondContact O-N 3.18Å; M658-T661 WeakPolarHBondContact O-CB 3.46Å; M658-T661 PolarHBondContact O-N 2.95Å; M658-T661 PolarHBondContact O-OG1 2.85Å; M658-T661 HydrophobicContact SD-CG2 4.13Å; T661-E663 PolarHBondContact O-N 3.45Å; T661-T666 WeakPolarHBondContact CA-OG1 3.34Å; T661-R667 VanDerWaalsContact O-CZ 3.29Å; T661-R667 PolarHBondContact O-NE 2.9Å; T661-R667 PolarHBondContact O-NH2 3.02Å
662	N	58.8	Low	72.3	Confident	141 Å²	141	86.5 Å²	86.5	75%	0.754	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-25.6	167.4	-69.8	-29.7	0	0	0	111.8	N660	N660-N662 PolarHBondContact O-N 3.32Å
663	E	68.1	Low	71.9	Confident	100 Å²	100	86.5 Å²	86.5	47%	0.467	46%	0.459	S	S	.	.	S	Bend	trans	-79.7	133.2	171.9	-140.4	-103.3	94.2	0	0	110.4	T661 S665 T666	T661-E663 PolarHBondContact O-N 3.45Å; E663-S665 VanDerWaalsContact C-N 3.29Å; E663-S665 VanDerWaalsContact CD-CB 3.5Å; E663-S665 PolarHBondContact O-N 3.42Å; E663-S665 WeakPolarHBondContact OE1-CB 3.44Å; E663-S665 PolarHBondContact OE1-N 3.33Å; E663-S665 VanDerWaalsContact OE1-N 3.1Å; E663-S665 VanDerWaalsContact OE2-CB 3.3Å; E663-S665 WeakPolarHBondContact OE2-CB 3.46Å; E663-T666 PolarHBondContact O-OG1 2.81Å; E663-T666 VanDerWaalsContact O-OG1 3.08Å
664	P	66.8	Low	72	Confident	93 Å²	93	85.8 Å²	85.8	60%	0.604	46%	0.456	S	S	*	.	H	α-helix	trans	-67.7	-27.9	-178.6	26.7	-34.4	0	0	0	113.1	R667 V668	P664-R667 PolarHBondContact O-N 3.32Å; P664-V668 PolarHBondContact O-N 3.41Å
665	S	67.1	Low	72.3	Confident	45 Å²	45	87 Å²	87	32%	0.315	46%	0.458	S	S	.	.	H	α-helix	trans	-62.9	-44.7	-179.2	-171.7	0	0	0	0	112.8	E663 R667 V668 R669	E663-S665 VanDerWaalsContact C-N 3.29Å; E663-S665 VanDerWaalsContact CD-CB 3.5Å; E663-S665 PolarHBondContact O-N 3.42Å; E663-S665 WeakPolarHBondContact OE1-CB 3.44Å; E663-S665 PolarHBondContact OE1-N 3.33Å; E663-S665 VanDerWaalsContact OE1-N 3.1Å; E663-S665 VanDerWaalsContact OE2-CB 3.3Å; E663-S665 WeakPolarHBondContact OE2-CB 3.46Å; S665-R667 VanDerWaalsContact C-N 3.33Å; S665-R667 PolarHBondContact O-N 2.99Å; S665-V668 PolarHBondContact O-N 3.31Å; S665-R669 WeakPolarHBondContact O-CG 3.36Å; S665-R669 PolarHBondContact O-N 3.47Å; S665-R669 VanDerWaalsContact O-N 3.15Å
666	T	68.8	Low	72.5	Confident	28 Å²	28	88.4 Å²	88.4	17%	0.172	46%	0.463	C	S	.	.	H	α-helix	trans	-67.6	-34.9	178.7	51.4	0	0	0	0	111.8	T661 E663 V668 R669 F670	T661-T666 WeakPolarHBondContact CA-OG1 3.34Å; E663-T666 PolarHBondContact O-OG1 2.81Å; E663-T666 VanDerWaalsContact O-OG1 3.08Å; T666-V668 PolarHBondContact O-N 3.35Å; T666-R669 PolarHBondContact O-N 2.94Å; T666-F670 PolarHBondContact O-N 3.46Å
667	R	70.4	Confident	72.6	Confident	129 Å²	129	88.8 Å²	88.8	49%	0.487	47%	0.465	S	S	.	.	H	α-helix	trans	-62.9	-40.4	175.6	-134.3	178.2	-65.5	169.8	1.4	112.5	T661 P664 S665 F670 I671	T661-R667 VanDerWaalsContact O-CZ 3.29Å; T661-R667 PolarHBondContact O-NE 2.9Å; T661-R667 PolarHBondContact O-NH2 3.02Å; P664-R667 PolarHBondContact O-N 3.32Å; S665-R667 VanDerWaalsContact C-N 3.33Å; S665-R667 PolarHBondContact O-N 2.99Å; R667-F670 PolarHBondContact O-N 2.74Å; R667-I671 WeakPolarHBondContact O-CD1 3.42Å; R667-I671 WeakPolarHBondContact O-CG1 3.38Å; R667-I671 PolarHBondContact O-N 3.45Å; R667-I671 VanDerWaalsContact O-N 3.14Å
668	V	75.9	Confident	72.9	Confident	85 Å²	85	89.3 Å²	89.3	52%	0.515	47%	0.466	S	S	.	.	H	α-helix	trans	-67.4	-40.6	174.3	175.4	0	0	0	0	111.7	P664 S665 T666 F670 I671 N672	P664-V668 PolarHBondContact O-N 3.41Å; S665-V668 PolarHBondContact O-N 3.31Å; T666-V668 PolarHBondContact O-N 3.35Å; V668-F670 VanDerWaalsContact C-N 3.34Å; V668-F670 PolarHBondContact O-N 3.14Å; V668-I671 PolarHBondContact O-N 2.8Å; V668-N672 PolarHBondContact O-N 3.46Å
669	R	73.9	Confident	73.8	Confident	170 Å²	170	86.8 Å²	86.8	64%	0.642	46%	0.46	S	S	*	.	H	α-helix	trans	-61.1	-42.1	174.9	-68	177	-168	177.4	3.5	112.1	S665 T666 N672 L673	S665-R669 WeakPolarHBondContact O-CG 3.36Å; S665-R669 PolarHBondContact O-N 3.47Å; S665-R669 VanDerWaalsContact O-N 3.15Å; T666-R669 PolarHBondContact O-N 2.94Å; R669-N672 PolarHBondContact O-N 3.44Å; R669-L673 WeakPolarHBondContact O-CB 3.14Å; R669-L673 PolarHBondContact O-N 2.93Å
670	F	74.3	Confident	74.4	Confident	78 Å²	78	89.7 Å²	89.7	34%	0.342	46%	0.459	S	S	.	.	H	α-helix	trans	-62.1	-45.1	176.7	-174.2	-91.3	0	0	0	112.1	M658 T666 R667 V668 N672 L673 A674	M658-F670 HydrophobicContact SD-CE2 4.41Å; M658-F670 HydrophobicContact SD-CZ 4.47Å; T666-F670 PolarHBondContact O-N 3.46Å; R667-F670 PolarHBondContact O-N 2.74Å; V668-F670 VanDerWaalsContact C-N 3.34Å; V668-F670 PolarHBondContact O-N 3.14Å; F670-N672 VanDerWaalsContact C-N 3.3Å; F670-N672 PolarHBondContact O-N 3.08Å; F670-L673 PolarHBondContact O-N 3.5Å; F670-A674 WeakPolarHBondContact O-CB 3.4Å; F670-A674 PolarHBondContact O-N 2.91Å
671	I	79.8	Confident	75.4	Confident	85 Å²	85	91 Å²	91	44%	0.436	46%	0.463	S	S	.	.	H	α-helix	trans	-63.7	-36.5	177.3	-66.1	162.8	0	0	0	111.5	R667 V668 R675	R667-I671 WeakPolarHBondContact O-CD1 3.42Å; R667-I671 WeakPolarHBondContact O-CG1 3.38Å; R667-I671 PolarHBondContact O-N 3.45Å; R667-I671 VanDerWaalsContact O-N 3.14Å; V668-I671 PolarHBondContact O-N 2.8Å; I671-R675 PolarHBondContact O-N 3.49Å; I671-R675 VanDerWaalsContact O-N 3.14Å
672	N	80.1	Confident	76.5	Confident	77 Å²	77	94.8 Å²	94.8	41%	0.412	48%	0.48	S	S	.	.	H	α-helix	trans	-68.7	-46.4	174.7	-73.8	-3.6	0	0	0	111.9	V668 R669 F670 A674 R675 T676	V668-N672 PolarHBondContact O-N 3.46Å; R669-N672 PolarHBondContact O-N 3.44Å; F670-N672 VanDerWaalsContact C-N 3.3Å; F670-N672 PolarHBondContact O-N 3.08Å; N672-A674 VanDerWaalsContact C-N 3.32Å; N672-A674 PolarHBondContact O-N 3.39Å; N672-R675 PolarHBondContact O-N 2.83Å; N672-R675 PolarHBondContact OD1-NH1 2.81Å; N672-T676 PolarHBondContact O-N 3.15Å; N672-T676 PolarHBondContact O-OG1 3.36Å
673	L	81.3	Confident	77.6	Confident	97 Å²	97	93.3 Å²	93.3	51%	0.508	47%	0.472	S	S	.	.	H	α-helix	trans	-57.7	-44.4	175	178.9	64	0	0	0	111.7	R669 F670 R675 T676 L677	R669-L673 WeakPolarHBondContact O-CB 3.14Å; R669-L673 PolarHBondContact O-N 2.93Å; F670-L673 PolarHBondContact O-N 3.5Å; L673-R675 VanDerWaalsContact C-N 3.35Å; L673-R675 PolarHBondContact O-N 2.77Å; L673-T676 PolarHBondContact O-N 3.27Å; L673-L677 HydrophobicContact CD1-CD1 4.34Å; L673-L677 HydrophobicContact CD1-CG 4.4Å; L673-L677 HydrophobicContact CG-CD1 4.15Å; L673-L677 WeakPolarHBondContact O-CG 3.32Å; L673-L677 PolarHBondContact O-N 3.2Å
674	A	82.2	Confident	77.8	Confident	46 Å²	46	93.1 Å²	93.1	38%	0.38	47%	0.474	S	S	.	.	H	α-helix	trans	-60.3	-41.6	176.9	0	0	0	0	0	112.1	F670 N672 L677 Q678	F670-A674 WeakPolarHBondContact O-CB 3.4Å; F670-A674 PolarHBondContact O-N 2.91Å; N672-A674 VanDerWaalsContact C-N 3.32Å; N672-A674 PolarHBondContact O-N 3.39Å; A674-L677 PolarHBondContact O-N 3.49Å; A674-Q678 VanDerWaalsContact O-CB 3.29Å; A674-Q678 WeakPolarHBondContact O-CB 3.46Å; A674-Q678 PolarHBondContact O-N 3.47Å
675	R	85.3	Confident	78.1	Confident	145 Å²	145	94.5 Å²	94.5	55%	0.547	47%	0.472	S	S	.	.	H	α-helix	trans	-67.4	-34.5	173.8	-73.6	-161.5	-123.3	79.3	-6.9	113.4	I671 N672 L673 A679	I671-R675 PolarHBondContact O-N 3.49Å; I671-R675 VanDerWaalsContact O-N 3.14Å; N672-R675 PolarHBondContact O-N 2.83Å; N672-R675 PolarHBondContact OD1-NH1 2.81Å; L673-R675 VanDerWaalsContact C-N 3.35Å; L673-R675 PolarHBondContact O-N 2.77Å; R675-A679 WeakPolarHBondContact O-CB 3.47Å; R675-A679 PolarHBondContact O-N 3.36Å
676	T	83.1	Confident	78.1	Confident	94 Å²	94	96.5 Å²	96.5	58%	0.577	48%	0.483	S	S	*	.	H	α-helix	trans	-68.2	-38.6	175.3	-57.8	0	0	0	0	111.8	N672 L673 H680	N672-T676 PolarHBondContact O-N 3.15Å; N672-T676 PolarHBondContact O-OG1 3.36Å; L673-T676 PolarHBondContact O-N 3.27Å; T676-H680 WeakPolarHBondContact O-CB 3.33Å; T676-H680 PolarHBondContact O-N 3.48Å; T676-H680 VanDerWaalsContact O-N 3.1Å
677	L	81	Confident	77.7	Confident	105 Å²	105	98.7 Å²	98.7	55%	0.55	50%	0.499	S	S	.	.	H	α-helix	trans	-69.8	-40	174.5	-68	171.2	0	0	0	112.1	L673 A674 H680 M681	L673-L677 HydrophobicContact CD1-CD1 4.34Å; L673-L677 HydrophobicContact CD1-CG 4.4Å; L673-L677 HydrophobicContact CG-CD1 4.15Å; L673-L677 WeakPolarHBondContact O-CG 3.32Å; L673-L677 PolarHBondContact O-N 3.2Å; A674-L677 PolarHBondContact O-N 3.49Å; L677-H680 PolarHBondContact O-N 3.1Å; L677-M681 WeakPolarHBondContact O-CG 3.42Å; L677-M681 PolarHBondContact O-N 2.94Å
678	Q	82.8	Confident	77.1	Confident	111 Å²	111	99.5 Å²	99.5	52%	0.519	51%	0.508	S	S	.	.	H	α-helix	trans	-56.1	-52.8	173	-177.1	77.8	40.6	0	0	111	A674 H680 M681 E682	A674-Q678 VanDerWaalsContact O-CB 3.29Å; A674-Q678 WeakPolarHBondContact O-CB 3.46Å; A674-Q678 PolarHBondContact O-N 3.47Å; Q678-H680 VanDerWaalsContact C-N 3.34Å; Q678-H680 PolarHBondContact O-N 3.38Å; Q678-M681 PolarHBondContact O-N 2.83Å; Q678-M681 VanDerWaalsContact O-N 3.12Å; Q678-E682 WeakPolarHBondContact CG-OE1 3.18Å; Q678-E682 PolarHBondContact NE2-OE1 3.1Å; Q678-E682 WeakPolarHBondContact O-CG 3.41Å; Q678-E682 PolarHBondContact O-N 2.81Å
679	A	85.1	Confident	76.2	Confident	39 Å²	39	102.4 Å²	102.4	32%	0.322	52%	0.521	S	S	.	.	H	α-helix	trans	-60.6	-41.2	178.5	0	0	0	0	0	112.3	R675 M681 E682 D683	R675-A679 WeakPolarHBondContact O-CB 3.47Å; R675-A679 PolarHBondContact O-N 3.36Å; A679-M681 VanDerWaalsContact C-N 3.28Å; A679-M681 PolarHBondContact O-N 3.49Å; A679-E682 PolarHBondContact O-N 2.8Å; A679-D683 WeakPolarHBondContact O-CB 3.22Å; A679-D683 VanDerWaalsContact O-CG 3.23Å; A679-D683 PolarHBondContact O-N 3.45Å
680	H	80.7	Confident	75.5	Confident	116 Å²	116	101.8 Å²	101.8	54%	0.537	53%	0.53	S	S	.	.	H	α-helix	trans	-69.1	-23.9	177.5	-164.5	-43.5	0	0	0	113	T676 L677 Q678 L684	T676-H680 WeakPolarHBondContact O-CB 3.33Å; T676-H680 PolarHBondContact O-N 3.48Å; T676-H680 VanDerWaalsContact O-N 3.1Å; L677-H680 PolarHBondContact O-N 3.1Å; Q678-H680 VanDerWaalsContact C-N 3.34Å; Q678-H680 PolarHBondContact O-N 3.38Å; H680-L684 WeakPolarHBondContact O-CD1 3.03Å; H680-L684 VanDerWaalsContact O-CG 3.28Å; H680-L684 WeakPolarHBondContact O-CG 3.44Å; H680-L684 PolarHBondContact O-N 2.87Å
681	M	81.4	Confident	74.6	Confident	110 Å²	110	102.6 Å²	102.6	54%	0.542	55%	0.545	S	S	.	.	H	α-helix	trans	-73.9	-43.5	169.1	-73.3	-176.4	61.3	0	0	111.2	L677 Q678 A679 L684 E685	L677-M681 WeakPolarHBondContact O-CG 3.42Å; L677-M681 PolarHBondContact O-N 2.94Å; Q678-M681 PolarHBondContact O-N 2.83Å; Q678-M681 VanDerWaalsContact O-N 3.12Å; A679-M681 VanDerWaalsContact C-N 3.28Å; A679-M681 PolarHBondContact O-N 3.49Å; M681-L684 PolarHBondContact O-N 3.1Å; M681-L684 VanDerWaalsContact O-N 3.13Å; M681-E685 WeakPolarHBondContact O-CG 3.3Å; M681-E685 PolarHBondContact O-N 3.38Å
682	E	79.9	Confident	73.5	Confident	96 Å²	96	106.9 Å²	106.9	45%	0.449	56%	0.564	S	S	.	*	H	α-helix	trans	-63.6	-40.2	177.2	-68.6	163.3	-175.4	0	0	111.7	Q678 A679 L684 T686	Q678-E682 WeakPolarHBondContact CG-OE1 3.18Å; Q678-E682 PolarHBondContact NE2-OE1 3.1Å; Q678-E682 WeakPolarHBondContact O-CG 3.41Å; Q678-E682 PolarHBondContact O-N 2.81Å; A679-E682 PolarHBondContact O-N 2.8Å; E682-L684 VanDerWaalsContact C-N 3.29Å; E682-L684 PolarHBondContact O-N 3.39Å; E682-T686 WeakPolarHBondContact O-CB 3.47Å; E682-T686 WeakPolarHBondContact O-CG2 3.2Å; E682-T686 PolarHBondContact O-N 2.85Å; E682-T686 PolarHBondContact O-OG1 3.12Å
683	D	81.3	Confident	72.3	Confident	110 Å²	110	112.8 Å²	112.8	59%	0.588	59%	0.589	S	S	*	*	H	α-helix	trans	-63.4	-30.3	172.5	-69.9	-23.6	0	0	0	112.8	A679 T686 S687	A679-D683 WeakPolarHBondContact O-CB 3.22Å; A679-D683 VanDerWaalsContact O-CG 3.23Å; A679-D683 PolarHBondContact O-N 3.45Å; D683-T686 PolarHBondContact O-OG1 2.83Å; D683-S687 WeakPolarHBondContact O-CB 3.44Å
684	L	73.8	Confident	71	Confident	96 Å²	96	116.4 Å²	116.4	50%	0.503	61%	0.609	S	S	.	*	H	α-helix	trans	-79.2	-48.8	176	-77.5	169.4	0	0	0	111.6	H680 M681 E682 T686 S687	H680-L684 WeakPolarHBondContact O-CD1 3.03Å; H680-L684 VanDerWaalsContact O-CG 3.28Å; H680-L684 WeakPolarHBondContact O-CG 3.44Å; H680-L684 PolarHBondContact O-N 2.87Å; M681-L684 PolarHBondContact O-N 3.1Å; M681-L684 VanDerWaalsContact O-N 3.13Å; E682-L684 VanDerWaalsContact C-N 3.29Å; E682-L684 PolarHBondContact O-N 3.39Å; L684-T686 VanDerWaalsContact C-N 3.28Å; L684-T686 PolarHBondContact O-N 3.08Å; L684-S687 PolarHBondContact O-N 3.02Å; L684-S687 PolarHBondContact O-OG 2.99Å
685	E	71.6	Confident	69.7	Low	123 Å²	123	117.6 Å²	117.6	58%	0.575	63%	0.626	S	S	*	*	H	α-helix	trans	-60.4	-38	-179.7	-71.9	174.9	-173.9	0	0	111.4	M681 S687	M681-E685 WeakPolarHBondContact O-CG 3.3Å; M681-E685 PolarHBondContact O-N 3.38Å; E685-S687 VanDerWaalsContact C-N 3.34Å; E685-S687 PolarHBondContact O-N 2.75Å
686	T	67.1	Low	68.2	Low	87 Å²	87	117.3 Å²	117.3	53%	0.534	64%	0.635	S	S	.	*	H	α-helix	trans	-71	-24	174	52.4	0	0	0	0	114.3	E682 D683 L684 E688	E682-T686 WeakPolarHBondContact O-CB 3.47Å; E682-T686 WeakPolarHBondContact O-CG2 3.2Å; E682-T686 PolarHBondContact O-N 2.85Å; E682-T686 PolarHBondContact O-OG1 3.12Å; D683-T686 PolarHBondContact O-OG1 2.83Å; L684-T686 VanDerWaalsContact C-N 3.28Å; L684-T686 PolarHBondContact O-N 3.08Å; T686-E688 VanDerWaalsContact C-N 3.27Å; T686-E688 PolarHBondContact O-N 2.69Å
687	S	60.2	Low	66.7	Low	74 Å²	74	122 Å²	122	52%	0.517	65%	0.65	S	S	.	*	H	α-helix	trans	-76.7	-10.8	-179.2	74	0	0	0	0	114.6	D683 L684 E685	D683-S687 WeakPolarHBondContact O-CB 3.44Å; L684-S687 PolarHBondContact O-N 3.02Å; L684-S687 PolarHBondContact O-OG 2.99Å; E685-S687 VanDerWaalsContact C-N 3.34Å; E685-S687 PolarHBondContact O-N 2.75Å
688	E	58.5	Low	65.1	Low	146 Å²	146	123.2 Å²	123.2	68%	0.682	66%	0.657	S	S	*	*	H	α-helix	trans	-93.9	-41.2	177.5	-61.2	-173.1	129.3	0	0	111.7	T686 D690 S691	T686-E688 VanDerWaalsContact C-N 3.27Å; T686-E688 PolarHBondContact O-N 2.69Å; E688-D690 PolarHBondContact O-N 2.96Å; E688-S691 PolarHBondContact O-N 3.19Å; E688-S691 PolarHBondContact O-OG 3.42Å
689	D	57.6	Low	63.4	Low	145 Å²	145	128.6 Å²	128.6	78%	0.775	67%	0.673	S	S	*	*	H	α-helix	trans	-64.3	-35.3	180	-98	-6.7	0	0	0	113.6	S691	D689-S691 PolarHBondContact O-N 3.46Å
690	D	58	Low	61.7	Low	158 Å²	158	131.9 Å²	131.9	85%	0.845	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.8	7	-178.8	-99.5	4.3	0	0	0	114.1	E688	E688-D690 PolarHBondContact O-N 2.96Å
691	S	56.3	Low	60	Low	94 Å²	94	134.9 Å²	134.9	66%	0.657	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.7	-6.5	-172.4	72.9	0	0	0	0	116.4	E688 D689	E688-S691 PolarHBondContact O-N 3.19Å; E688-S691 PolarHBondContact O-OG 3.42Å; D689-S691 PolarHBondContact O-N 3.46Å
692	E	57	Low	58.5	Low	176 Å²	176	137.1 Å²	137.1	82%	0.822	72%	0.715	S	S	*	*	S	Bend	trans	-100.9	-14	-175.8	-62.3	-155.8	156.8	0	0	115.9	D694	E692-D694 PolarHBondContact O-N 3.33Å
693	E	54	Low	56.9	Low	201 Å²	201	140 Å²	140	94%	0.939	73%	0.731	S	S	*	*	S	Bend	trans	-94.4	38.3	-171.1	-148.8	-172.6	-176.4	0	0	116.1
694	D	54.2	Low	55.6	Low	172 Å²	172	143.1 Å²	143.1	92%	0.92	77%	0.773	S	S	*	*	S	Bend	trans	-128.9	47.3	176	-142.7	-9	0	0	0	112	E692	E692-D694 PolarHBondContact O-N 3.33Å
695	G	55.4	Low	54.7	Low	72 Å²	72	145.5 Å²	145.5	74%	0.742	79%	0.787	S	S	*	*			trans	-123.1	-17.6	-159.1	0	0	0	0	0	119.6
696	D	52.8	Low	53.8	Low	139 Å²	139	146.7 Å²	146.7	74%	0.743	80%	0.798	S	S	*	*			trans	-145.3	78.1	-171.6	-157.1	-6.9	0	0	0	115.7
697	H	51.3	Low	53.1	Low	192 Å²	192	150 Å²	150	89%	0.889	81%	0.812	S	S	*	*			trans	-119.8	60.4	166.7	-85.7	22.1	0	0	0	112.1
698	N	48.3	Very low	52.7	Low	130 Å²	130	154.5 Å²	154.5	70%	0.695	83%	0.83	S	S	*	*			trans	37.3	92.1	134.3	-167.3	8.7	0	0	0	117.5
699	R	48.3	Very low	52.3	Low	225 Å²	225	155 Å²	155	85%	0.849	84%	0.839	S	S	*	*			trans	-96.1	92.4	167.1	-77.5	-170.9	177.5	174.3	2.6	112	F701	R699-F701 PolarHBondContact O-N 3.49Å
700	T	47.5	Very low	51.9	Low	107 Å²	107	155.7 Å²	155.7	66%	0.656	84%	0.843	S	S	*	*			trans	-59.2	121.1	162.1	-47.6	0	0	0	0	109.9
701	F	45.8	Very low	51.5	Low	179 Å²	179	155.5 Å²	155.5	79%	0.785	84%	0.843	S	S	*	*			trans	-87.7	101.9	169	-90	-95.2	0	0	0	109.8	R699	R699-F701 PolarHBondContact O-N 3.49Å
702	D	50.6	Low	51.1	Low	158 Å²	158	160.2 Å²	160.2	85%	0.845	86%	0.857	S	S	*	*			trans	-83.8	134.6	157.1	-84.6	-51.6	0	0	0	109.5
703	I	46.6	Very low	50.7	Low	155 Å²	155	158.9 Å²	158.9	80%	0.795	86%	0.86	S	S	*	*			trans	-124.4	125.9	175.1	-63.3	176.4	0	0	0	107.8
704	A	53.3	Low	50.3	Low	177 Å²	177	155.1 Å²	155.1	100%	1.463	85%	0.853	S	S	*	*			trans	-145.4	0	173.9	0	0	0	0	0	109.8

Retrieved 704 of 704 residues in 133.1 ms (Link to these results)

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