A0A087X0Z1_HUMAN Loading...

ArfGAP with GTPase domain, ankyrin repeat and PH domain 4

Putative GTPase-activating protein.

AlphaFold DB , UniProt , Accession A0A087X0Z1, Species HUMAN (Homo sapiens, Human), Gene AGAP4, Length 686 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	35.8	Very low	29.7	Very low	244 Å²	244	150.3 Å²	150.3	100%	1.202	83%	0.826	S	S	*	*				0	111.2	0	-73.2	168.9	169.5	0	0	107
2	G	31.2	Very low	29.5	Very low	72 Å²	72	146.8 Å²	146.8	74%	0.742	82%	0.82	S	S	*	*			trans	-107.6	134.6	171.6	0	0	0	0	0	108.9
3	N	32.3	Very low	29.6	Very low	160 Å²	160	145.1 Å²	145.1	86%	0.856	82%	0.816	S	S	*	*			trans	-89	111.7	-179.7	-68.1	-13	0	0	0	109.4
4	I	29.7	Very low	29.5	Very low	153 Å²	153	142.1 Å²	142.1	79%	0.785	81%	0.809	S	S	*	*			trans	-82.1	120.2	172.7	-59.5	175.6	0	0	0	108.5	T6	I4-T6 HydrophobicContact CG2-CG2 3.96Å
5	L	27.2	Very low	29.6	Very low	163 Å²	163	143.3 Å²	143.3	85%	0.853	81%	0.811	S	S	*	*			trans	-97.8	92.7	171.8	-91.9	163.9	0	0	0	109.9	C7	L5-C7 PolarHBondContact O-N 3.47Å
6	T	29.8	Very low	29.5	Very low	120 Å²	120	145.8 Å²	145.8	74%	0.736	81%	0.814	S	S	*	*			trans	-82.9	99.9	170.6	50.2	0	0	0	0	111	I4 R8	I4-T6 HydrophobicContact CG2-CG2 3.96Å; T6-R8 PolarHBondContact O-N 3.36Å
7	C	26.4	Very low	29.6	Very low	121 Å²	121	148.2 Å²	148.2	82%	0.818	81%	0.814	S	S	*	*			trans	-74.1	116	164.5	-72.2	0	0	0	0	110	L5	L5-C7 PolarHBondContact O-N 3.47Å
8	R	28.2	Very low	29.5	Very low	217 Å²	217	149.1 Å²	149.1	82%	0.819	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-93.2	125.4	162.9	-80	-174.7	173.4	175.6	-1.8	109.2	T6	T6-R8 PolarHBondContact O-N 3.36Å
9	V	29.6	Very low	29.6	Very low	138 Å²	138	148.8 Å²	148.8	84%	0.836	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-90.2	119.2	165.7	-179.2	0	0	0	0	107.8
10	H	27.3	Very low	29.6	Very low	149 Å²	149	149 Å²	149	69%	0.69	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-94.1	130	167.6	-89.2	-96.1	0	0	0	109.2	S12	H10-S12 PolarHBondContact O-N 3.13Å
11	P	29.4	Very low	29.6	Very low	116 Å²	116	149.9 Å²	149.9	75%	0.753	80%	0.804	S	S	*	*			trans	-68.4	108.7	164.6	-14.5	29.6	0	0	0	109.2	V13	P11-V13 PolarHBondContact O-N 3.02Å
12	S	27.2	Very low	29.1	Very low	108 Å²	108	142 Å²	142	76%	0.755	79%	0.785	S	S	*	*			trans	-80.1	94.4	171.9	54.1	0	0	0	0	109.8	H10 S14	H10-S12 PolarHBondContact O-N 3.13Å; S12-S14 PolarHBondContact O-N 3.35Å
13	V	30.9	Very low	28.9	Very low	125 Å²	125	144 Å²	144	76%	0.758	79%	0.788	S	S	*	*			trans	-83.2	98.1	170.5	-177.8	0	0	0	0	108.6	P11	P11-V13 PolarHBondContact O-N 3.02Å
14	S	27.5	Very low	28.6	Very low	103 Å²	103	142.6 Å²	142.6	72%	0.72	78%	0.784	S	S	*	*			trans	-73.3	126	168.4	-59.6	0	0	0	0	109.9	S12	S12-S14 PolarHBondContact O-N 3.35Å
15	L	31.8	Very low	28.5	Very low	161 Å²	161	140.8 Å²	140.8	84%	0.843	78%	0.784	S	S	*	*			trans	-115.1	89.2	163.3	-85	167.2	0	0	0	107.8
16	E	28.5	Very low	29.7	Very low	182 Å²	182	138.6 Å²	138.6	85%	0.85	78%	0.78	S	S	*	*			trans	-90.1	149.7	163	-70.7	-167.9	124.1	0	0	109.7
17	F	30.8	Very low	29.6	Very low	188 Å²	188	137 Å²	137	83%	0.825	77%	0.774	S	S	*	*			trans	-73.6	151.1	-179.4	-84.8	-120.2	0	0	0	111.2
18	D	28	Very low	29.7	Very low	163 Å²	163	140 Å²	140	87%	0.872	78%	0.775	S	S	*	*			trans	-127.4	158	140.7	-148.6	-17.8	0	0	0	109
19	Q	30.5	Very low	29.9	Very low	145 Å²	145	134.5 Å²	134.5	68%	0.678	77%	0.77	S	S	*	*			trans	-139.1	168.7	-157.5	-162.7	178.5	72.4	0	0	112.7
20	Q	30.1	Very low	30	Very low	151 Å²	151	136 Å²	136	71%	0.706	77%	0.768	S	S	*	*			trans	89.1	146.6	171.7	-49.8	-175.9	23.1	0	0	114.3
21	Q	28.7	Very low	30.2	Very low	169 Å²	169	135.5 Å²	135.5	79%	0.79	77%	0.769	S	S	*	*			cis	-156.5	136.2	4.2	-136.3	168.8	45.6	0	0	113.8
22	G	26.1	Very low	30.1	Very low	77 Å²	77	140 Å²	140	79%	0.794	77%	0.773	S	S	*	*			trans	69	174.6	155.4	0	0	0	0	0	119.5
23	S	27.5	Very low	30.4	Very low	115 Å²	115	143 Å²	143	80%	0.804	78%	0.775	S	S	*	*			cis	-171.9	168.3	-27.2	-164.6	0	0	0	0	110.5
24	V	25.7	Very low	30.3	Very low	130 Å²	130	141.2 Å²	141.2	79%	0.788	77%	0.773	S	S	*	*			trans	77.2	117.2	162.8	-170.7	0	0	0	0	119.4
25	C	27.8	Very low	30.5	Very low	115 Å²	115	139.6 Å²	139.6	78%	0.777	77%	0.773	S	S	*	*			trans	-105.9	176.6	149.7	-54.1	0	0	0	0	107.7
26	P	52.5	Low	30.8	Very low	118 Å²	118	137.3 Å²	137.3	77%	0.766	78%	0.777	S	S	*	*			cis	-150	-137.8	25.2	45.2	-21.1	0	0	0	114.7
27	S	27.7	Very low	30.8	Very low	87 Å²	87	132.7 Å²	132.7	61%	0.608	78%	0.778	S	S	*	*			trans	84.8	141.6	168.5	-66.3	0	0	0	0	116.9
28	E	27.6	Very low	31.1	Very low	182 Å²	182	131.3 Å²	131.3	85%	0.85	78%	0.779	S	S	*	*			cis	-153.2	-173	-2.8	-137.1	139.3	-117.5	0	0	112.3
29	S	33.3	Very low	31.5	Very low	102 Å²	102	133.8 Å²	133.8	71%	0.713	78%	0.777	S	S	*	*			trans	-124.4	-169.3	-177.5	56.1	0	0	0	0	113.1
30	E	31.3	Very low	31.6	Very low	169 Å²	169	135 Å²	135	79%	0.79	78%	0.784	S	S	*	*			trans	87.6	149	174.7	-54.3	-167.6	167	0	0	116.5
31	I	30.6	Very low	31.7	Very low	139 Å²	139	132.2 Å²	132.2	71%	0.713	79%	0.788	S	S	*	*			cis	-154.7	177.1	-11.9	-115.3	167.6	0	0	0	110.9
32	Y	28.1	Very low	31.7	Very low	212 Å²	212	128.2 Å²	128.2	83%	0.831	79%	0.791	S	S	*	*			trans	-59.4	178.1	171.9	-80.6	-105.8	0	0	0	114.3
33	E	33.3	Very low	31.9	Very low	170 Å²	170	129.1 Å²	129.1	79%	0.794	79%	0.792	S	S	*	*			cis	-144.1	-156.6	16.4	-141.7	-151.1	-71.8	0	0	109.1
34	A	29.7	Very low	33.3	Very low	88 Å²	88	128.7 Å²	128.7	73%	0.727	79%	0.786	S	S	*	*			cis	-155.1	178.8	10.2	0	0	0	0	0	111.5
35	G	32.1	Very low	33.5	Very low	69 Å²	69	131.1 Å²	131.1	71%	0.711	79%	0.791	S	S	*	*			trans	-166.6	170	169.1	0	0	0	0	0	114.8
36	A	36.6	Very low	33.7	Very low	113 Å²	113	130.1 Å²	130.1	93%	0.934	79%	0.791	S	S	*	*			trans	-167	147.9	171.5	0	0	0	0	0	113.2
37	G	29.1	Very low	32.8	Very low	85 Å²	85	129.5 Å²	129.5	88%	0.876	80%	0.796	S	S	*	*			trans	159.2	74.9	170.6	0	0	0	0	0	116.9
38	D	38	Very low	32.9	Very low	158 Å²	158	129.7 Å²	129.7	85%	0.845	80%	0.802	S	S	*	*			trans	-84.3	151	-175.9	-122	-31.6	0	0	0	115.1
39	R	34.5	Very low	33	Very low	216 Å²	216	127.9 Å²	127.9	82%	0.815	80%	0.804	S	S	*	*				168	136.7	114.8	-94.5	-179.1	177.7	164.4	1.6	117.8
40	M	33.6	Very low	33.2	Very low	169 Å²	169	131.3 Å²	131.3	83%	0.833	81%	0.808	S	S	*	*			trans	68.2	156.1	147.5	-59.8	-101.7	-163.9	0	0	119.7
41	A	32.1	Very low	33.8	Very low	94 Å²	94	129.4 Å²	129.4	78%	0.777	81%	0.811	S	S	*	*			cis	-172	149.2	-37.7	0	0	0	0	0	109.3
42	G	28	Very low	33.7	Very low	84 Å²	84	127.1 Å²	127.1	87%	0.866	81%	0.812	S	S	*	*			trans	131.3	142.4	165.6	0	0	0	0	0	116
43	A	31.8	Very low	33.7	Very low	97 Å²	97	125.5 Å²	125.5	80%	0.802	81%	0.812	S	S	*	*			trans	-139.6	-164.5	-175.6	0	0	0	0	0	108.5
44	P	56.7	Low	33.3	Very low	106 Å²	106	124 Å²	124	69%	0.688	82%	0.815	S	S	*	*			cis	-144.9	-174.8	2	44.3	-25	0	0	0	117.6
45	M	30.4	Very low	33.1	Very low	181 Å²	181	125.1 Å²	125.1	89%	0.892	81%	0.812	S	S	*	*			trans	69.8	157.1	155.7	-66	-144.1	-142.8	0	0	119.7
46	A	31.8	Very low	32.9	Very low	93 Å²	93	128.7 Å²	128.7	77%	0.769	82%	0.82	S	S	*	*			cis	-163.9	171.4	-25.8	0	0	0	0	0	110.4
47	A	31.8	Very low	32.4	Very low	106 Å²	106	131.5 Å²	131.5	88%	0.876	81%	0.814	S	S	*	*			trans	-84.7	153.7	-161.9	0	0	0	0	0	118.7
48	A	30.6	Very low	32.3	Very low	90 Å²	90	133.2 Å²	133.2	74%	0.744	81%	0.807	S	S	*	*			trans	-163.4	115.9	147.7	0	0	0	0	0	109.1
49	V	30.7	Very low	31.6	Very low	145 Å²	145	129.4 Å²	129.4	88%	0.879	81%	0.805	S	S	*	*				71	121.9	92.2	175.7	0	0	0	0	115.1
50	Q	37.6	Very low	31.4	Very low	174 Å²	174	127.4 Å²	127.4	81%	0.813	81%	0.805	S	S	*	*			trans	-85.2	164	168.7	-67.6	-174.5	-9.5	0	0	111.8
51	P	42	Very low	31	Very low	129 Å²	129	125.7 Å²	125.7	84%	0.838	80%	0.799	S	S	*	*				-138.5	-170.5	108.5	40.2	-29.3	0	0	0	113.5
52	A	29.6	Very low	30.9	Very low	90 Å²	90	129.1 Å²	129.1	74%	0.744	80%	0.803	S	S	*	*			trans	-118.5	178.8	-174	0	0	0	0	0	113.2
53	E	27.4	Very low	30.9	Very low	178 Å²	178	132.3 Å²	132.3	83%	0.832	80%	0.795	S	S	*	*			trans	71.8	129.5	156	-159.6	164.6	-124.2	0	0	119
54	V	26.4	Very low	30.7	Very low	140 Å²	140	133.5 Å²	133.5	85%	0.848	79%	0.786	S	S	*	*			trans	-141.9	125.6	162.9	174.7	0	0	0	0	108.1
55	T	25.5	Very low	29.3	Very low	111 Å²	111	137.7 Å²	137.7	68%	0.681	80%	0.796	S	S	*	*			trans	-98.2	162.9	173.6	48.2	0	0	0	0	111.5
56	V	26.2	Very low	29.2	Very low	144 Å²	144	136.7 Å²	136.7	87%	0.873	79%	0.789	S	S	*	*			trans	-140.2	132.4	162.5	-178	0	0	0	0	108.3
57	E	26	Very low	28.9	Very low	172 Å²	172	137.8 Å²	137.8	80%	0.804	79%	0.786	S	S	*	*			trans	-127.2	147.4	180	-88.2	-164.9	152.3	0	0	112.4
58	V	27.4	Very low	28.6	Very low	121 Å²	121	143 Å²	143	73%	0.733	78%	0.783	S	S	*	*			trans	54.8	134.7	143.1	-178.6	0	0	0	0	121.1	E60	V58-E60 HydrophobicContact CG1-CG 4.08Å
59	G	24.2	Very low	28.5	Very low	77 Å²	77	145.1 Å²	145.1	79%	0.794	78%	0.781	S	S	*	*			trans	-156.8	140.7	156.4	0	0	0	0	0	109.6
60	E	29.4	Very low	28.3	Very low	174 Å²	174	148.1 Å²	148.1	81%	0.813	78%	0.777	S	S	*	*			trans	-112.7	161.6	-160.4	-61.4	176.5	120.5	0	0	115.5	V58	V58-E60 HydrophobicContact CG1-CG 4.08Å
61	D	26.5	Very low	27.7	Very low	134 Å²	134	146.6 Å²	146.6	72%	0.717	77%	0.77	S	S	*	*			trans	49.2	131.8	148	-88.1	17.8	0	0	0	123.8
62	L	28.9	Very low	27.2	Very low	165 Å²	165	149 Å²	149	86%	0.864	77%	0.772	S	S	*	*				-170.2	106.8	114.6	-102.4	165.3	0	0	0	115.3
63	H	28.7	Very low	27.4	Very low	151 Å²	151	150.2 Å²	150.2	70%	0.699	77%	0.772	S	S	*	*			trans	30.8	123.9	140.8	-89.6	58.7	0	0	0	124.3
64	M	27.9	Very low	27.4	Very low	123 Å²	123	150.8 Å²	150.8	61%	0.606	78%	0.775	S	S	*	*				52.3	126.8	125.7	-78.2	-65.8	-62.7	0	0	123	H66	M64-H66 HydrophobicContact CE-CB 4.16Å
65	H	27.3	Very low	27.5	Very low	193 Å²	193	148.6 Å²	148.6	89%	0.894	77%	0.772	S	S	*	*				-154.1	-179.5	118.9	-105.8	-68.9	0	0	0	111.2
66	H	26.8	Very low	27.5	Very low	160 Å²	160	151.1 Å²	151.1	74%	0.741	78%	0.78	S	S	*	*			trans	-146.5	176.1	-155	-156.4	81	0	0	0	112.5	M64	M64-H66 HydrophobicContact CE-CB 4.16Å
67	V	25.4	Very low	27.6	Very low	117 Å²	117	152 Å²	152	71%	0.709	78%	0.775	S	S	*	*			trans	97.2	99.7	164.6	-170.4	0	0	0	0	119.3
68	R	25.7	Very low	27.6	Very low	216 Å²	216	152.3 Å²	152.3	82%	0.815	77%	0.774	S	S	*	*				40.3	133.5	127.6	-72.1	-175.5	-176.4	144.6	3.9	124.9
69	D	28.1	Very low	27.7	Very low	133 Å²	133	153.5 Å²	153.5	71%	0.711	78%	0.776	S	S	*	*				64.3	156.5	126.9	-50.5	-25.3	0	0	0	122.5
70	R	26.6	Very low	27.9	Very low	209 Å²	209	157.7 Å²	157.7	79%	0.789	78%	0.779	S	S	*	*			trans	88	143.7	179.7	-52.6	178.9	92.8	142.2	15.5	114.8
71	E	25.9	Very low	27.8	Very low	141 Å²	141	154.8 Å²	154.8	66%	0.659	78%	0.778	S	S	*	*			cis	-155.7	157.6	-11.3	-119.4	155	-177.9	0	0	109.2
72	M	31.5	Very low	27.8	Very low	179 Å²	179	153.3 Å²	153.3	88%	0.882	78%	0.784	S	S	*	*			trans	-85.1	144.8	165.7	-85.7	-75.5	-171.2	0	0	110.3
73	P	32.6	Very low	27.8	Very low	117 Å²	117	152.8 Å²	152.8	76%	0.76	78%	0.783	S	S	*	*			trans	-114.3	147.6	148.7	35.3	-27.3	0	0	0	111.8
74	E	28	Very low	28.7	Very low	190 Å²	190	150.5 Å²	150.5	89%	0.888	78%	0.781	S	S	*	*			trans	-87.9	172.5	-179	-63.4	178.1	119.9	0	0	113.3
75	A	28	Very low	28.7	Very low	94 Å²	94	154.2 Å²	154.2	78%	0.777	80%	0.797	S	S	*	*			trans	-2.3	135.9	161.4	0	0	0	0	0	120.3
76	L	26.7	Very low	28.6	Very low	164 Å²	164	149.6 Å²	149.6	86%	0.859	79%	0.792	S	S	*	*			trans	-133.1	113.5	145.8	-106.6	170.7	0	0	0	109.7
77	E	28.6	Very low	28.6	Very low	162 Å²	162	147.2 Å²	147.2	76%	0.757	79%	0.794	S	S	*	*			trans	-73.4	145.3	164.4	-60.5	-175.2	128.7	0	0	109.8
78	F	26	Very low	28.6	Very low	178 Å²	178	147.4 Å²	147.4	78%	0.781	80%	0.795	S	S	*	*			trans	-147.2	102.2	151.8	-109.2	-75.9	0	0	0	111.1
79	N	29.3	Very low	28.6	Very low	147 Å²	147	144.1 Å²	144.1	79%	0.786	79%	0.792	S	S	*	*			trans	-81.1	135.4	159.1	-82	-75.1	0	0	0	109
80	L	27	Very low	28.4	Very low	164 Å²	164	147.5 Å²	147.5	86%	0.859	80%	0.801	S	S	*	*			trans	-145.5	127.7	160.1	-106.6	175	0	0	0	110.9
81	S	27.7	Very low	28.5	Very low	114 Å²	114	145.2 Å²	145.2	80%	0.797	80%	0.799	S	S	*	*			trans	-115.4	125.6	-176.2	56.7	0	0	0	0	111.2
82	A	26.6	Very low	28.4	Very low	102 Å²	102	149.8 Å²	149.8	84%	0.843	81%	0.811	S	S	*	*			trans	-161.8	87.1	162.4	0	0	0	0	0	113.6
83	N	30.2	Very low	28.2	Very low	155 Å²	155	147.9 Å²	147.9	83%	0.829	80%	0.804	S	S	*	*				-11.5	166.1	128.5	-133.1	37	0	0	0	117.3
84	P	46.1	Very low	28	Very low	102 Å²	102	148.1 Å²	148.1	66%	0.662	81%	0.808	S	S	*	*				-135.1	-176.5	-52.7	39.9	-24.8	0	0	0	112.6
85	E	28	Very low	28	Very low	202 Å²	202	148.1 Å²	148.1	94%	0.944	81%	0.808	S	S	*	*			trans	-153.4	157.8	147.8	-129.7	169.1	-139.9	0	0	112
86	A	26	Very low	28	Very low	96 Å²	96	149.4 Å²	149.4	79%	0.793	81%	0.807	S	S	*	*			trans	-155.5	147.3	-166.6	0	0	0	0	0	114.6
87	S	26	Very low	28	Very low	110 Å²	110	148.6 Å²	148.6	77%	0.769	80%	0.803	S	S	*	*			trans	-145.4	115.3	174.3	-69.3	0	0	0	0	113.9
88	T	26.9	Very low	27.8	Very low	120 Å²	120	145.4 Å²	145.4	74%	0.736	81%	0.805	S	S	*	*			trans	39.8	113	144.1	56.9	0	0	0	0	120.4
89	I	25.6	Very low	27.9	Very low	147 Å²	147	145.4 Å²	145.4	75%	0.754	81%	0.812	S	S	*	*				75.2	116.1	64.7	-64.5	165.1	0	0	0	114.7
90	F	24.2	Very low	27.7	Very low	205 Å²	205	147 Å²	147	90%	0.899	82%	0.815	S	S	*	*				-155.6	133.7	124.2	-123.2	-77.2	0	0	0	111.6
91	Q	26.8	Very low	27.6	Very low	161 Å²	161	148.7 Å²	148.7	75%	0.752	82%	0.816	S	S	*	*			trans	-96.5	158.7	173.1	-69.3	174.6	-62.6	0	0	111.2
92	R	24.3	Very low	27.7	Very low	237 Å²	237	150.5 Å²	150.5	89%	0.894	82%	0.816	S	S	*	*			trans	-140.7	119.7	149.3	179.9	170.2	-76.2	118.7	-2.6	109.8
93	N	27.7	Very low	28	Very low	138 Å²	138	151 Å²	151	74%	0.738	81%	0.811	S	S	*	*			trans	-81.7	149.2	170.7	-65.2	-11.3	0	0	0	110.4
94	S	27.6	Very low	27.8	Very low	123 Å²	123	149.3 Å²	149.3	86%	0.86	81%	0.811	S	S	*	*			trans	-154	126.9	153.3	52.3	0	0	0	0	108.3
95	Q	28.4	Very low	26.9	Very low	189 Å²	189	149.3 Å²	149.3	88%	0.883	82%	0.82	S	S	*	*			trans	-138.4	121.8	-170.4	174.1	-176.8	-0.4	0	0	108.5
96	T	28	Very low	26.9	Very low	121 Å²	121	147 Å²	147	74%	0.742	81%	0.814	S	S	*	*			trans	-149.8	121.7	171.1	48.1	0	0	0	0	109.5
97	D	26.4	Very low	27.3	Very low	147 Å²	147	147.2 Å²	147.2	79%	0.786	81%	0.807	S	S	*	*			trans	31.9	109.5	140.8	-43.4	-32.1	0	0	0	117.7
98	A	25.4	Very low	27.3	Very low	96 Å²	96	151.1 Å²	151.1	79%	0.793	81%	0.813	S	S	*	*				69.1	107.6	64	0	0	0	0	0	114.3
99	L	26.9	Very low	27.2	Very low	178 Å²	178	150.2 Å²	150.2	93%	0.932	82%	0.818	S	S	*	*			trans	-155.5	131.6	145	-106.9	175.4	0	0	0	108.6
100	E	26.2	Very low	27.1	Very low	180 Å²	180	148.4 Å²	148.4	84%	0.841	82%	0.819	S	S	*	*			trans	-81.9	146.4	174.6	-59.2	175.9	108.7	0	0	110.6
101	F	24.5	Very low	27.1	Very low	200 Å²	200	144.4 Å²	144.4	88%	0.877	81%	0.811	S	S	*	*			trans	-156.9	106.3	146	-124.4	-78.6	0	0	0	111.9
102	N	29.5	Very low	26.9	Very low	152 Å²	152	143.6 Å²	143.6	81%	0.813	81%	0.81	S	S	*	*			trans	-88.5	146.5	152.8	-91.2	-60.1	0	0	0	107.6
103	P	33.2	Very low	26.8	Very low	113 Å²	113	140.9 Å²	140.9	73%	0.734	81%	0.805	S	S	*	*				-142	151.7	102	36.7	-23.5	0	0	0	114.4
104	S	25.6	Very low	26.7	Very low	118 Å²	118	141.2 Å²	141.2	83%	0.825	80%	0.803	S	S	*	*			trans	-76.9	129.6	167.6	55.3	0	0	0	0	111.8
105	A	26.8	Very low	26.5	Very low	102 Å²	102	146.4 Å²	146.4	84%	0.843	80%	0.803	S	S	*	*			trans	-154.3	129.2	153.7	0	0	0	0	0	110.7
106	N	29.4	Very low	26.5	Very low	153 Å²	153	144.4 Å²	144.4	82%	0.818	80%	0.799	S	S	*	*			trans	-120.2	131.4	161.3	-170.2	8.5	0	0	0	105.5
107	P	33.3	Very low	26.5	Very low	102 Å²	102	144.4 Å²	144.4	66%	0.662	80%	0.804	S	S	*	*				-145.9	145.7	125.8	36.7	-22.2	0	0	0	115.3
108	E	27	Very low	26.5	Very low	191 Å²	191	146.5 Å²	146.5	89%	0.893	81%	0.809	S	S	*	*			trans	49	147.9	136.7	-56.7	-167.1	134.9	0	0	122.4
109	A	24	Very low	26.5	Very low	101 Å²	101	147.8 Å²	147.8	84%	0.835	81%	0.807	S	S	*	*			trans	-84.9	150.1	-170.8	0	0	0	0	0	114.5
110	S	23.7	Very low	26.4	Very low	110 Å²	110	146.1 Å²	146.1	77%	0.769	80%	0.799	S	S	*	*			trans	-162.9	127.4	145.2	50.6	0	0	0	0	114.7
111	T	24.1	Very low	26.4	Very low	121 Å²	121	144.1 Å²	144.1	74%	0.742	80%	0.799	S	S	*	*			trans	25.9	118.9	145.8	56.2	0	0	0	0	122.7
112	I	22.7	Very low	26.5	Very low	143 Å²	143	140.4 Å²	140.4	73%	0.733	79%	0.792	S	S	*	*				38	115.2	119.1	-49.4	166.9	0	0	0	118.2
113	F	23.4	Very low	26.3	Very low	180 Å²	180	138.9 Å²	138.9	79%	0.789	78%	0.78	S	S	*	*				-166.2	166.3	110.5	-118.3	-81.5	0	0	0	113.8
114	Q	23.7	Very low	26.1	Very low	146 Å²	146	141.1 Å²	141.1	68%	0.682	78%	0.784	S	S	*	*			trans	-71.1	160.3	-171.3	-55.6	158.4	-59.2	0	0	115
115	R	25	Very low	26	Very low	231 Å²	231	143.4 Å²	143.4	87%	0.872	78%	0.775	S	S	*	*			trans	-152.4	129.3	135.2	-168.6	166.8	-80.3	101.9	-3.9	111.1
116	N	26.8	Very low	26	Very low	147 Å²	147	149.4 Å²	149.4	79%	0.786	78%	0.776	S	S	*	*			trans	-85.9	149.4	172	-65.2	2.5	0	0	0	110.6
117	S	28.1	Very low	25.8	Very low	122 Å²	122	147.1 Å²	147.1	85%	0.853	77%	0.772	S	S	*	*			trans	-156.2	123.4	158.9	54	0	0	0	0	109.5
118	Q	26.2	Very low	25.5	Very low	190 Å²	190	149.4 Å²	149.4	89%	0.888	78%	0.778	S	S	*	*			trans	-136.7	107.6	-175.5	177.4	-179.8	-0.6	0	0	110.5
119	T	27.2	Very low	25.5	Very low	124 Å²	124	145.6 Å²	145.6	76%	0.761	77%	0.772	S	S	*	*			trans	-174.6	145.4	167.2	28.2	0	0	0	0	105
120	D	24.8	Very low	25.6	Very low	143 Å²	143	146.3 Å²	146.3	77%	0.765	77%	0.766	S	S	*	*			cis	-140.1	164.1	18.1	-85.6	-54.6	0	0	0	112.8
121	V	24.8	Very low	25.7	Very low	137 Å²	137	147.1 Å²	147.1	83%	0.83	76%	0.762	S	S	*	*			trans	-105.7	129.8	167.7	174.6	0	0	0	0	109.4
122	V	27.5	Very low	25.8	Very low	122 Å²	122	148.8 Å²	148.8	74%	0.739	76%	0.761	S	S	*	*			trans	-121.9	104.1	168.7	179	0	0	0	0	109.3	I124	V122-I124 HydrophobicContact CG1-CG1 4.33Å
123	E	26	Very low	25.9	Very low	121 Å²	121	148.9 Å²	148.9	57%	0.565	77%	0.768	S	S	*	*			trans	-80.4	120.4	172.5	-174.2	-162.1	-167.1	0	0	109.9	R125	E123-R125 VanDerWaalsContact CD-CZ 3.4Å; E123-R125 VanDerWaalsContact CD-NH2 3.33Å; E123-R125 HydrophobicContact CG-CG 4.34Å; E123-R125 IonicContact OE1-CZ 3.05Å; E123-R125 IonicContact OE1-NE 2.84Å; E123-R125 PolarHBondContact OE1-NE 3.13Å; E123-R125 IonicContact OE1-NH1 3.11Å; E123-R125 IonicContact OE1-NH2 3.29Å; E123-R125 PolarHBondContact OE1-NH2 3.17Å; E123-R125 IonicContact OE2-CZ 3.82Å; E123-R125 IonicContact OE2-NH1 3.14Å; E123-R125 PolarHBondContact OE2-NH1 3.34Å; E123-R125 IonicContact OE2-NH2 3.7Å; E123-R125 PolarHBondContact OE2-NH2 3.29Å
124	I	27.1	Very low	25.9	Very low	160 Å²	160	145.8 Å²	145.8	82%	0.821	77%	0.768	S	S	*	*			trans	-120.1	135.4	161.6	-65	-176.4	0	0	0	109	V122	V122-I124 HydrophobicContact CG1-CG1 4.33Å
125	R	25.3	Very low	25.9	Very low	166 Å²	166	145.3 Å²	145.3	63%	0.626	78%	0.775	S	S	*	*			trans	-105.1	159.3	-161.7	-82.8	-176	162.4	91	13.3	114.3	E123	E123-R125 VanDerWaalsContact CD-CZ 3.4Å; E123-R125 VanDerWaalsContact CD-NH2 3.33Å; E123-R125 HydrophobicContact CG-CG 4.34Å; E123-R125 IonicContact OE1-CZ 3.05Å; E123-R125 IonicContact OE1-NE 2.84Å; E123-R125 PolarHBondContact OE1-NE 3.13Å; E123-R125 IonicContact OE1-NH1 3.11Å; E123-R125 IonicContact OE1-NH2 3.29Å; E123-R125 PolarHBondContact OE1-NH2 3.17Å; E123-R125 IonicContact OE2-CZ 3.82Å; E123-R125 IonicContact OE2-NH1 3.14Å; E123-R125 PolarHBondContact OE2-NH1 3.34Å; E123-R125 IonicContact OE2-NH2 3.7Å; E123-R125 PolarHBondContact OE2-NH2 3.29Å
126	R	26.4	Very low	25.9	Very low	227 Å²	227	141 Å²	141	86%	0.857	77%	0.774	S	S	*	*			trans	73.3	152.6	159	-70.9	160.5	178.5	174.8	-1.6	115.5
127	S	25.6	Very low	25.8	Very low	106 Å²	106	145 Å²	145	74%	0.741	78%	0.778	S	S	*	*			cis	-144.1	128.2	4.2	30	0	0	0	0	110
128	N	26.9	Very low	25.6	Very low	149 Å²	149	149.3 Å²	149.3	80%	0.797	78%	0.782	S	S	*	*				66.5	114.1	83.4	-85.1	25	0	0	0	116
129	C	27.1	Very low	25.5	Very low	112 Å²	112	145.4 Å²	145.4	76%	0.757	78%	0.776	S	S	*	*			trans	160.2	100.4	135.9	-87.2	0	0	0	0	109
130	T	25.1	Very low	25.6	Very low	116 Å²	116	147.4 Å²	147.4	71%	0.712	78%	0.777	S	S	*	*				61.3	132.3	93.2	59.8	0	0	0	0	114.4
131	N	26.3	Very low	25.6	Very low	127 Å²	127	149.9 Å²	149.9	68%	0.679	78%	0.784	S	S	*	*			cis	-162.4	164.4	25.9	-130.5	-4.4	0	0	0	115.7
132	H	26.6	Very low	25.7	Very low	156 Å²	156	152.8 Å²	152.8	72%	0.722	78%	0.781	S	S	*	*			trans	55.3	114.8	158.7	-65.3	-59.2	0	0	0	122.6
133	V	23.4	Very low	25.7	Very low	145 Å²	145	152.5 Å²	152.5	88%	0.879	78%	0.784	S	S	*	*			trans	-114.5	141.6	144	171.8	0	0	0	0	107.7
134	S	24.1	Very low	25.7	Very low	114 Å²	114	154.2 Å²	154.2	80%	0.797	80%	0.797	S	S	*	*			trans	-99.2	145.6	-178.9	-68.1	0	0	0	0	112.8
135	T	23.9	Very low	25.8	Very low	136 Å²	136	151.9 Å²	151.9	83%	0.834	79%	0.793	S	S	*	*			trans	-93	129.8	-169.5	-8.7	0	0	0	0	113.7
136	V	24.9	Very low	26	Very low	141 Å²	141	149.2 Å²	149.2	86%	0.855	80%	0.8	S	S	*	*			trans	-131.6	143.5	153.8	-177.8	0	0	0	0	108.2
137	R	24.1	Very low	26.2	Very low	230 Å²	230	143.7 Å²	143.7	87%	0.868	79%	0.792	S	S	*	*			trans	-94.9	144.7	-171.2	-60.4	171.1	177.5	146.1	-3.1	111.7
138	F	24.6	Very low	26.7	Very low	213 Å²	213	144.9 Å²	144.9	93%	0.934	79%	0.788	S	S	*	*			trans	-136.3	147.2	144.5	-104.5	-82.9	0	0	0	110.1
139	S	24.9	Very low	26.8	Very low	109 Å²	109	146.6 Å²	146.6	76%	0.762	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-96.6	125.2	-170.7	51.5	0	0	0	0	112.2
140	Q	27.4	Very low	27.3	Very low	165 Å²	165	147.7 Å²	147.7	77%	0.771	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-102.4	128.7	164	-75	-178.3	-21.8	0	0	110.3
141	Q	25.9	Very low	27.6	Very low	195 Å²	195	147.6 Å²	147.6	91%	0.911	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-85	121	172.4	-68.8	173	-41.9	0	0	109
142	Y	27.5	Very low	28.2	Very low	199 Å²	199	148.7 Å²	148.7	78%	0.78	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-84.5	118.8	176.1	-76.3	-91.4	0	0	0	110.9
143	S	26.5	Very low	28.8	Very low	115 Å²	115	146.3 Å²	146.3	80%	0.804	79%	0.789	S	S	*	*			trans	-86.3	107.3	169.6	-173.9	0	0	0	0	109.6
144	L	27.3	Very low	30	Very low	158 Å²	158	143 Å²	143	83%	0.827	77%	0.769	S	S	*	*			trans	-86.2	109.7	176.5	-82.9	162.5	0	0	0	110.8
145	C	27.4	Very low	30.7	Very low	110 Å²	110	141.3 Å²	141.3	74%	0.743	76%	0.762	S	S	*	*			trans	-118.4	91.2	167	-78.8	0	0	0	0	110.8	T147	C145-T147 PolarHBondContact O-N 2.81Å
146	S	29.9	Very low	32	Very low	111 Å²	111	142.8 Å²	142.8	78%	0.776	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-68.6	118.3	171.3	-56.8	0	0	0	0	110.6
147	T	31.6	Very low	32.7	Very low	111 Å²	111	143.2 Å²	143.2	68%	0.681	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-99.8	123.5	173.9	-59.1	0	0	0	0	109.5	C145 F149	C145-T147 PolarHBondContact O-N 2.81Å; T147-F149 HydrophobicContact CG2-CD2 4.3Å; T147-F149 HydrophobicContact CG2-CE2 3.99Å
148	I	35	Very low	33.8	Very low	130 Å²	130	141.1 Å²	141.1	67%	0.667	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-101.3	123	174.6	-56.8	175.7	0	0	0	108.1
149	F	30.4	Very low	35	Very low	185 Å²	185	138.9 Å²	138.9	81%	0.811	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-87.4	135.5	168.5	-78.4	-95.3	0	0	0	110	T147	T147-F149 HydrophobicContact CG2-CD2 4.3Å; T147-F149 HydrophobicContact CG2-CE2 3.99Å
150	L	35.9	Very low	36.2	Very low	135 Å²	135	137.5 Å²	137.5	71%	0.707	73%	0.726	S	S	*	*			trans	-117.7	133.7	167.3	-66	175.7	0	0	0	107.7
151	D	32.5	Very low	37.3	Very low	114 Å²	114	134 Å²	134	61%	0.61	72%	0.716	S	S	*	*			trans	-80.9	144.2	178.6	-178.9	46.5	0	0	0	111.6	S153 T154	D151-S153 PolarHBondContact O-N 3.31Å; D151-S153 WeakPolarHBondContact OD2-CB 3.45Å; D151-S153 PolarHBondContact OD2-OG 3.07Å; D151-T154 PolarHBondContact O-N 2.7Å; D151-T154 PolarHBondContact O-OG1 2.66Å; D151-T154 VanDerWaalsContact O-OG1 3.07Å
152	D	37.8	Very low	38.3	Very low	150 Å²	150	130 Å²	130	80%	0.802	70%	0.698	S	S	*	*	G	3₁₀ helix	trans	-60.2	-18.3	-171.5	-91.4	-34	0	0	0	113.1	T154	D152-T154 PolarHBondContact O-N 3.41Å
153	S	40.8	Very low	39.3	Very low	106 Å²	106	124.5 Å²	124.5	74%	0.741	69%	0.686	S	S	*	*	G	3₁₀ helix	trans	-60.1	-10.6	177.8	-55.3	0	0	0	0	115.4	D151	D151-S153 PolarHBondContact O-N 3.31Å; D151-S153 WeakPolarHBondContact OD2-CB 3.45Å; D151-S153 PolarHBondContact OD2-OG 3.07Å
154	T	47	Very low	40.7	Very low	77 Å²	77	123.4 Å²	123.4	47%	0.472	67%	0.67	S	S	.	*	G	3₁₀ helix	trans	-109.6	-0.4	-173	56.2	0	0	0	0	115.7	D151 D152 I156	D151-T154 PolarHBondContact O-N 2.7Å; D151-T154 PolarHBondContact O-OG1 2.66Å; D151-T154 VanDerWaalsContact O-OG1 3.07Å; D152-T154 PolarHBondContact O-N 3.41Å; T154-I156 PolarHBondContact O-N 2.76Å
155	A	40	Very low	41.8	Very low	78 Å²	78	119.8 Å²	119.8	65%	0.645	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69	2.1	-169.9	0	0	0	0	0	117
156	I	50.3	Low	42.7	Very low	166 Å²	166	117.6 Å²	117.6	85%	0.851	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-131.7	40.1	-172.5	-33	-179.1	0	0	0	113	T154	T154-I156 PolarHBondContact O-N 2.76Å
157	Q	40.3	Very low	43.6	Very low	151 Å²	151	115.3 Å²	115.3	71%	0.706	62%	0.618	S	S	*	*			trans	-123.7	136.2	169	-73.5	-165.9	-8.3	0	0	113.3	Y159 L160	Q157-Y159 PolarHBondContact O-N 3.19Å; Q157-L160 PolarHBondContact O-N 2.74Å
158	H	47.9	Very low	44.6	Very low	186 Å²	186	114.2 Å²	114.2	86%	0.861	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.3	5.2	-170.9	-140.1	-59.4	0	0	0	114.8
159	Y	49.4	Very low	45.2	Very low	166 Å²	166	113.8 Å²	113.8	65%	0.651	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.8	-6.9	-175.9	-69.5	-78.3	0	0	0	114.2	Q157 T161 M162 T163	Q157-Y159 PolarHBondContact O-N 3.19Å; Y159-T161 PolarHBondContact O-N 3.45Å; Y159-T161 VanDerWaalsContact O-N 3.09Å; Y159-M162 WeakPolarHBondContact O-CA 3.34Å; Y159-M162 WeakPolarHBondContact O-CB 3.47Å; Y159-M162 PolarHBondContact O-N 2.88Å; Y159-T163 PolarHBondContact O-N 3.18Å; Y159-T163 PolarHBondContact O-OG1 3.39Å
160	L	48.4	Very low	45.9	Very low	80 Å²	80	110.8 Å²	110.8	42%	0.419	60%	0.598	S	S	.	*	H	α-helix	trans	-50.6	-40.2	-177.7	-166.7	74.7	0	0	0	112.6	Q157 M162 T163 I164	Q157-L160 PolarHBondContact O-N 2.74Å; L160-M162 VanDerWaalsContact C-N 3.32Å; L160-M162 PolarHBondContact O-N 3.19Å; L160-T163 PolarHBondContact O-N 3.39Å; L160-I164 HydrophobicContact CD2-CD1 4.44Å; L160-I164 HydrophobicContact CG-CD1 4.04Å; L160-I164 VanDerWaalsContact O-CG1 3.3Å; L160-I164 WeakPolarHBondContact O-CG1 3.45Å; L160-I164 PolarHBondContact O-N 2.94Å
161	T	50.6	Low	46.5	Very low	92 Å²	92	108.7 Å²	108.7	56%	0.564	59%	0.586	S	S	*	*	H	α-helix	trans	-63.3	-33.3	177.4	-28.6	0	0	0	0	113.4	Y159 I165	Y159-T161 PolarHBondContact O-N 3.45Å; Y159-T161 VanDerWaalsContact O-N 3.09Å; T161-I165 HydrophobicContact CG2-CD1 4.42Å; T161-I165 WeakPolarHBondContact O-CB 3.3Å; T161-I165 WeakPolarHBondContact O-CD1 3.4Å; T161-I165 VanDerWaalsContact O-CG1 3.25Å; T161-I165 WeakPolarHBondContact O-CG1 3.38Å; T161-I165 PolarHBondContact O-N 3.33Å; T161-I165 VanDerWaalsContact O-N 3.13Å
162	M	47.5	Very low	47.1	Very low	109 Å²	109	106.7 Å²	106.7	54%	0.537	58%	0.58	S	S	.	*	H	α-helix	trans	-74.2	-44.6	176.4	-64.9	-68.9	95.2	0	0	110.7	Y159 L160 I164 I165 S166	Y159-M162 WeakPolarHBondContact O-CA 3.34Å; Y159-M162 WeakPolarHBondContact O-CB 3.47Å; Y159-M162 PolarHBondContact O-N 2.88Å; L160-M162 VanDerWaalsContact C-N 3.32Å; L160-M162 PolarHBondContact O-N 3.19Å; M162-I164 VanDerWaalsContact C-N 3.32Å; M162-I164 PolarHBondContact O-N 3.21Å; M162-I165 HydrophobicContact CE-CD1 3.94Å; M162-I165 PolarHBondContact O-N 3.28Å; M162-I165 VanDerWaalsContact O-N 3.14Å; M162-S166 PolarHBondContact O-N 3.36Å; M162-S166 PolarHBondContact O-OG 3.42Å
163	T	49.3	Very low	47.4	Very low	85 Å²	85	105 Å²	105	52%	0.521	57%	0.566	S	S	.	*	H	α-helix	trans	-59	-43.2	175.9	-48.8	0	0	0	0	111.6	Y159 L160 V167	Y159-T163 PolarHBondContact O-N 3.18Å; Y159-T163 PolarHBondContact O-OG1 3.39Å; L160-T163 PolarHBondContact O-N 3.39Å; T163-V167 WeakPolarHBondContact O-CG2 3.44Å; T163-V167 PolarHBondContact O-N 2.93Å; T163-V167 VanDerWaalsContact O-N 3.13Å
164	I	54.5	Low	47.6	Very low	91 Å²	91	105.3 Å²	105.3	47%	0.467	56%	0.556	S	S	.	*	H	α-helix	trans	-61.5	-45.8	174.6	-69.7	166.2	0	0	0	110.9	L160 M162 V167 T168	L160-I164 HydrophobicContact CD2-CD1 4.44Å; L160-I164 HydrophobicContact CG-CD1 4.04Å; L160-I164 VanDerWaalsContact O-CG1 3.3Å; L160-I164 WeakPolarHBondContact O-CG1 3.45Å; L160-I164 PolarHBondContact O-N 2.94Å; M162-I164 VanDerWaalsContact C-N 3.32Å; M162-I164 PolarHBondContact O-N 3.21Å; I164-V167 PolarHBondContact O-N 3.14Å; I164-T168 VanDerWaalsContact O-CB 3.32Å; I164-T168 WeakPolarHBondContact O-CB 3.38Å; I164-T168 PolarHBondContact O-N 3.33Å; I164-T168 PolarHBondContact O-OG1 3.32Å
165	I	50.4	Low	47.7	Very low	82 Å²	82	106 Å²	106	42%	0.421	56%	0.556	S	S	.	*	H	α-helix	trans	-64.7	-42.6	-179.2	-74.7	168.9	0	0	0	111.8	T161 M162 T168 L169	T161-I165 HydrophobicContact CG2-CD1 4.42Å; T161-I165 WeakPolarHBondContact O-CB 3.3Å; T161-I165 WeakPolarHBondContact O-CD1 3.4Å; T161-I165 VanDerWaalsContact O-CG1 3.25Å; T161-I165 WeakPolarHBondContact O-CG1 3.38Å; T161-I165 PolarHBondContact O-N 3.33Å; T161-I165 VanDerWaalsContact O-N 3.13Å; M162-I165 HydrophobicContact CE-CD1 3.94Å; M162-I165 PolarHBondContact O-N 3.28Å; M162-I165 VanDerWaalsContact O-N 3.14Å; I165-T168 PolarHBondContact O-N 3.45Å; I165-L169 HydrophobicContact CG2-CD1 3.85Å; I165-L169 VanDerWaalsContact O-CG 3.29Å; I165-L169 WeakPolarHBondContact O-CG 3.42Å; I165-L169 PolarHBondContact O-N 3.16Å; I165-L169 VanDerWaalsContact O-N 3.14Å
166	S	46.8	Very low	47.8	Very low	65 Å²	65	107 Å²	107	46%	0.455	55%	0.554	S	S	.	*	H	α-helix	trans	-58	-54.4	174.5	-68.4	0	0	0	0	111.9	M162 T168 L169 E170	M162-S166 PolarHBondContact O-N 3.36Å; M162-S166 PolarHBondContact O-OG 3.42Å; S166-T168 VanDerWaalsContact C-N 3.27Å; S166-T168 PolarHBondContact O-N 3.31Å; S166-L169 PolarHBondContact O-N 2.89Å; S166-E170 PolarHBondContact O-N 3.41Å
167	V	49.2	Very low	47.6	Very low	63 Å²	63	103.9 Å²	103.9	38%	0.382	54%	0.536	S	S	.	.	H	α-helix	trans	-61.3	-36.6	-179.2	173.4	0	0	0	0	111.8	T163 I164 L169 I171	T163-V167 WeakPolarHBondContact O-CG2 3.44Å; T163-V167 PolarHBondContact O-N 2.93Å; T163-V167 VanDerWaalsContact O-N 3.13Å; I164-V167 PolarHBondContact O-N 3.14Å; V167-L169 VanDerWaalsContact C-N 3.26Å; V167-L169 PolarHBondContact O-N 2.83Å; V167-I171 HydrophobicContact CG1-CD1 3.98Å; V167-I171 WeakPolarHBondContact O-CD1 3.35Å; V167-I171 WeakPolarHBondContact O-CG1 3.47Å; V167-I171 PolarHBondContact O-N 3.11Å
168	T	52.1	Low	47.9	Very low	87 Å²	87	105.2 Å²	105.2	53%	0.534	53%	0.534	S	S	.	.	H	α-helix	trans	-69.3	-22.3	177.5	-50.3	0	0	0	0	112.8	I164 I165 S166 P172	I164-T168 VanDerWaalsContact O-CB 3.32Å; I164-T168 WeakPolarHBondContact O-CB 3.38Å; I164-T168 PolarHBondContact O-N 3.33Å; I164-T168 PolarHBondContact O-OG1 3.32Å; I165-T168 PolarHBondContact O-N 3.45Å; S166-T168 VanDerWaalsContact C-N 3.27Å; S166-T168 PolarHBondContact O-N 3.31Å; T168-P172 WeakPolarHBondContact O-CD 3.22Å
169	L	48.6	Very low	47.7	Very low	121 Å²	121	103.3 Å²	103.3	63%	0.634	53%	0.531	S	S	*	.	H	α-helix	trans	-93.4	-27.1	177.9	-69.6	170.9	0	0	0	113.5	I165 S166 V167	I165-L169 HydrophobicContact CG2-CD1 3.85Å; I165-L169 VanDerWaalsContact O-CG 3.29Å; I165-L169 WeakPolarHBondContact O-CG 3.42Å; I165-L169 PolarHBondContact O-N 3.16Å; I165-L169 VanDerWaalsContact O-N 3.14Å; S166-L169 PolarHBondContact O-N 2.89Å; V167-L169 VanDerWaalsContact C-N 3.26Å; V167-L169 PolarHBondContact O-N 2.83Å
170	E	44.8	Very low	47.5	Very low	123 Å²	123	98.9 Å²	98.9	58%	0.575	53%	0.529	S	S	*	.	H	α-helix	trans	-76.5	-33.5	177.3	-71.3	173.1	134.2	0	0	112.7	S166 H173 H174	S166-E170 PolarHBondContact O-N 3.41Å; E170-H173 PolarHBondContact O-N 3.04Å; E170-H173 VanDerWaalsContact O-N 3.14Å; E170-H174 PolarHBondContact O-N 3.38Å
171	I	48.2	Very low	47	Very low	91 Å²	91	102 Å²	102	47%	0.467	55%	0.545	S	S	.	.	H	α-helix	trans	-57.5	-49.6	178.6	-70.9	164.8	0	0	0	112.5	V167 H173 H174 I175	V167-I171 HydrophobicContact CG1-CD1 3.98Å; V167-I171 WeakPolarHBondContact O-CD1 3.35Å; V167-I171 WeakPolarHBondContact O-CG1 3.47Å; V167-I171 PolarHBondContact O-N 3.11Å; I171-H173 VanDerWaalsContact C-N 3.29Å; I171-H173 PolarHBondContact O-N 3.32Å; I171-H174 PolarHBondContact O-N 2.78Å; I171-I175 HydrophobicContact CG2-CD1 3.83Å; I171-I175 WeakPolarHBondContact O-CG1 3.49Å; I171-I175 PolarHBondContact O-N 3.39Å; I171-I175 VanDerWaalsContact O-N 3.13Å
172	P	45	Very low	46.8	Very low	72 Å²	72	109.8 Å²	109.8	47%	0.468	57%	0.565	S	S	.	*	H	α-helix	trans	-58.3	-36.3	173.7	-26.5	34.7	0	0	0	114.2	T168 I175 T176	T168-P172 WeakPolarHBondContact O-CD 3.22Å; P172-I175 PolarHBondContact O-N 2.87Å; P172-T176 PolarHBondContact O-N 2.87Å; P172-T176 PolarHBondContact O-OG1 2.99Å
173	H	45.1	Very low	46.1	Very low	114 Å²	114	109.3 Å²	109.3	53%	0.528	57%	0.572	S	S	.	*	H	α-helix	trans	-69.5	-43.2	-178.5	-164.7	45	0	0	0	111.3	E170 I171 I175 T176 Q177	E170-H173 PolarHBondContact O-N 3.04Å; E170-H173 VanDerWaalsContact O-N 3.14Å; I171-H173 VanDerWaalsContact C-N 3.29Å; I171-H173 PolarHBondContact O-N 3.32Å; H173-I175 VanDerWaalsContact C-N 3.28Å; H173-I175 PolarHBondContact O-N 2.88Å; H173-T176 PolarHBondContact O-N 3.34Å; H173-T176 PolarHBondContact O-OG1 3.41Å; H173-Q177 PolarHBondContact NE2-NE2 2.8Å; H173-Q177 PolarHBondContact O-N 3.42Å; H173-Q177 VanDerWaalsContact O-N 3.15Å
174	H	45	Very low	45.4	Very low	112 Å²	112	113.6 Å²	113.6	52%	0.519	59%	0.591	S	S	.	*	H	α-helix	trans	-73.6	-13.8	176.2	-109.9	-50.9	0	0	0	114.8	E170 I171 R178	E170-H174 PolarHBondContact O-N 3.38Å; I171-H174 PolarHBondContact O-N 2.78Å; H174-R178 WeakPolarHBondContact O-CG 3.36Å; H174-R178 PolarHBondContact O-NH1 2.87Å
175	I	47.5	Very low	44.1	Very low	93 Å²	93	114.1 Å²	114.1	48%	0.477	60%	0.602	S	S	.	*	H	α-helix	trans	-84	-49.5	170.1	-69.6	167.1	0	0	0	109.6	I171 P172 H173 Q177 R178	I171-I175 HydrophobicContact CG2-CD1 3.83Å; I171-I175 WeakPolarHBondContact O-CG1 3.49Å; I171-I175 PolarHBondContact O-N 3.39Å; I171-I175 VanDerWaalsContact O-N 3.13Å; P172-I175 PolarHBondContact O-N 2.87Å; H173-I175 VanDerWaalsContact C-N 3.28Å; H173-I175 PolarHBondContact O-N 2.88Å; I175-Q177 PolarHBondContact O-N 3.42Å; I175-R178 PolarHBondContact O-N 3.21Å
176	T	44.1	Very low	43.5	Very low	98 Å²	98	118.2 Å²	118.2	60%	0.601	62%	0.623	S	S	*	*	H	α-helix	trans	-63.2	-22.8	179.4	41.7	0	0	0	0	114.6	P172 H173	P172-T176 PolarHBondContact O-N 2.87Å; P172-T176 PolarHBondContact O-OG1 2.99Å; H173-T176 PolarHBondContact O-N 3.34Å; H173-T176 PolarHBondContact O-OG1 3.41Å
177	Q	44.6	Very low	42.7	Very low	101 Å²	101	120.4 Å²	120.4	47%	0.472	64%	0.636	S	S	.	*	T	Hydrogen-bonded Turn	trans	-80.3	-23.4	169.7	-73.4	179.7	-8.8	0	0	114.4	H173 I175 A180	H173-Q177 PolarHBondContact NE2-NE2 2.8Å; H173-Q177 PolarHBondContact O-N 3.42Å; H173-Q177 VanDerWaalsContact O-N 3.15Å; I175-Q177 PolarHBondContact O-N 3.42Å; Q177-A180 PolarHBondContact O-N 3.03Å
178	R	47	Very low	41.5	Very low	178 Å²	178	124.7 Å²	124.7	67%	0.672	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.1	-29.5	-178.5	-86	-173.5	180	90.7	-6.4	113.8	H174 I175 A180	H174-R178 WeakPolarHBondContact O-CG 3.36Å; H174-R178 PolarHBondContact O-NH1 2.87Å; I175-R178 PolarHBondContact O-N 3.21Å; R178-A180 PolarHBondContact O-N 2.99Å
179	D	44.4	Very low	40.9	Very low	147 Å²	147	129.8 Å²	129.8	79%	0.786	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.1	-2.6	178.8	-67.5	-40	0	0	0	113.4
180	A	44.1	Very low	39.9	Very low	73 Å²	73	131.9 Å²	131.9	60%	0.603	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.7	-45.8	-178	0	0	0	0	0	113.8	Q177 R178 R182	Q177-A180 PolarHBondContact O-N 3.03Å; R178-A180 PolarHBondContact O-N 2.99Å; A180-R182 PolarHBondContact O-N 3.3Å
181	D	38.5	Very low	39.2	Very low	144 Å²	144	134.5 Å²	134.5	77%	0.77	70%	0.698	S	S	*	*			trans	-93.8	84.6	-172.1	-91.5	-44.6	0	0	0	113.2	S183	D181-S183 PolarHBondContact O-N 3.2Å
182	R	46.5	Very low	38.1	Very low	257 Å²	257	137.2 Å²	137.2	97%	0.97	71%	0.708	S	S	*	*			trans	-79.3	64.2	174.8	-162.2	-173.2	-165.2	177.7	7.3	112.2	A180	A180-R182 PolarHBondContact O-N 3.3Å
183	S	33.5	Very low	37.1	Very low	99 Å²	99	139.3 Å²	139.3	69%	0.692	73%	0.725	S	S	*	*			trans	-129.5	133.2	179.9	-167.8	0	0	0	0	112.6	D181	D181-S183 PolarHBondContact O-N 3.2Å
184	L	32.7	Very low	36.2	Very low	175 Å²	175	143 Å²	143	92%	0.916	74%	0.74	S	S	*	*			trans	-91.2	110.1	179.3	-98.1	162.2	0	0	0	111
185	S	27.6	Very low	35.2	Very low	101 Å²	101	142.5 Å²	142.5	71%	0.706	76%	0.755	S	S	*	*			trans	-150.8	147.5	155.1	58.1	0	0	0	0	110.5
186	I	39.4	Very low	34.2	Very low	169 Å²	169	144.7 Å²	144.7	87%	0.867	77%	0.772	S	S	*	*			trans	-108.1	122.1	171.6	-61.3	170.9	0	0	0	107.1
187	P	29	Very low	33.2	Very low	110 Å²	110	145.6 Å²	145.6	71%	0.714	78%	0.783	S	S	*	*			trans	-116.9	159.5	163	35.4	-24.5	0	0	0	113.2
188	D	25	Very low	32.3	Very low	154 Å²	154	146.2 Å²	146.2	82%	0.824	79%	0.794	S	S	*	*			trans	-59.3	168.8	-171.3	-73.7	-72.4	0	0	0	118.1	Q190	D188-Q190 PolarHBondContact O-N 3.24Å
189	E	37.9	Very low	31.2	Very low	194 Å²	194	144.2 Å²	144.2	91%	0.907	80%	0.801	S	S	*	*			trans	-55.1	124.5	154.4	-67.7	-172.6	97.9	0	0	111.2
190	Q	28	Very low	30.4	Very low	164 Å²	164	144.8 Å²	144.8	77%	0.766	80%	0.799	S	S	*	*			trans	-131.5	123.9	156.2	-77	-161.5	-9.9	0	0	112	D188	D188-Q190 PolarHBondContact O-N 3.24Å
191	L	29.4	Very low	29.5	Very low	178 Å²	178	149.5 Å²	149.5	93%	0.932	81%	0.812	S	S	*	*			trans	-69.8	129.1	169.1	-78.6	152.6	0	0	0	110.2
192	H	26.9	Very low	28.9	Very low	148 Å²	148	151.3 Å²	151.3	69%	0.685	82%	0.818	S	S	*	*			trans	-121	118.1	165	-77	-8.4	0	0	0	110.1	F194	H192-F194 HydrophobicContact CB-CE2 4.2Å
193	S	23.2	Very low	27.8	Very low	117 Å²	117	149.3 Å²	149.3	82%	0.818	82%	0.816	S	S	*	*			trans	-104	135.4	174.7	54.2	0	0	0	0	110
194	F	25.9	Very low	27.4	Very low	190 Å²	190	154.1 Å²	154.1	83%	0.833	83%	0.825	S	S	*	*			trans	-127.8	130.5	173.1	-75	-77.5	0	0	0	110.4	H192	H192-F194 HydrophobicContact CB-CE2 4.2Å
195	A	24.4	Very low	27	Very low	102 Å²	102	156.4 Å²	156.4	84%	0.843	82%	0.821	S	S	*	*			trans	-101.5	147.9	176.6	0	0	0	0	0	110.6
196	V	25.6	Very low	27	Very low	139 Å²	139	158.2 Å²	158.2	84%	0.842	82%	0.823	S	S	*	*			trans	-115.3	118.4	-179.1	-178.6	0	0	0	0	110.3
197	S	24.3	Very low	26.3	Very low	117 Å²	117	154.1 Å²	154.1	82%	0.818	82%	0.823	S	S	*	*			trans	-82.9	138.2	177.3	-64.5	0	0	0	0	112
198	T	24.7	Very low	26	Very low	115 Å²	115	153 Å²	153	71%	0.706	83%	0.831	S	S	*	*			trans	-97	135.6	177.7	-65.1	0	0	0	0	111.7
199	V	25	Very low	26	Very low	136 Å²	136	149.7 Å²	149.7	82%	0.824	83%	0.833	S	S	*	*			trans	-135.8	138.7	166.7	-178.5	0	0	0	0	109.4
200	H	27.3	Very low	25.5	Very low	158 Å²	158	145.5 Å²	145.5	73%	0.731	83%	0.825	S	S	*	*			trans	-101.2	163.1	175.5	-68.3	4.3	0	0	0	111.6
201	I	25.6	Very low	25.4	Very low	173 Å²	173	145.1 Å²	145.1	89%	0.887	83%	0.828	S	S	*	*				-178.3	150	129.9	-95.8	154.8	0	0	0	111.7
202	M	24.3	Very low	25.4	Very low	181 Å²	181	142.5 Å²	142.5	89%	0.892	81%	0.814	S	S	*	*			trans	-88.6	158.1	179.4	-73.4	-172.6	164.4	0	0	114.6
203	K	24.7	Very low	25.4	Very low	216 Å²	216	142.1 Å²	142.1	94%	0.939	82%	0.817	S	S	*	*			trans	-149	167.5	145.5	-147	160.9	-177.4	175.9	0	113.8
204	K	24.2	Very low	25.6	Very low	199 Å²	199	147.1 Å²	147.1	87%	0.865	82%	0.82	S	S	*	*			trans	-111.1	136	-164.4	-66.6	174.3	177.8	174	0	114.4
205	R	24.9	Very low	25.9	Very low	223 Å²	223	143 Å²	143	84%	0.842	82%	0.815	S	S	*	*				29.4	118.5	125.5	-173.9	-147.7	174	140.7	3	120.2
206	N	26.8	Very low	26.3	Very low	140 Å²	140	143.2 Å²	143.2	75%	0.749	81%	0.81	S	S	*	*				167.7	147.9	121.1	-101.6	-10.3	0	0	0	113.9
207	G	24.3	Very low	26.4	Very low	83 Å²	83	141.8 Å²	141.8	86%	0.856	81%	0.807	S	S	*	*			trans	73.6	156.3	161.9	0	0	0	0	0	117.1
208	G	24.7	Very low	26.9	Very low	87 Å²	87	143.5 Å²	143.5	90%	0.897	81%	0.805	S	S	*	*			cis	133.9	103.8	-8	0	0	0	0	0	113.4
209	G	24.9	Very low	27.6	Very low	84 Å²	84	143.7 Å²	143.7	87%	0.866	81%	0.808	S	S	*	*			trans	176.5	161.9	178.4	0	0	0	0	0	114.2
210	S	27.6	Very low	27.8	Very low	106 Å²	106	141.3 Å²	141.3	74%	0.741	80%	0.797	S	S	*	*			trans	-154.2	145.2	-179	174.9	0	0	0	0	109.8
211	L	25.6	Very low	28	Very low	155 Å²	155	140.2 Å²	140.2	81%	0.812	80%	0.802	S	S	*	*			trans	169.2	109.5	145	-93.7	161.9	0	0	0	114.5
212	N	27.8	Very low	28.9	Very low	123 Å²	123	137 Å²	137	66%	0.658	79%	0.793	S	S	*	*				38	131	124.4	-66.4	10	0	0	0	125.4
213	N	28.3	Very low	29	Very low	140 Å²	140	133.6 Å²	133.6	75%	0.749	79%	0.786	S	S	*	*				79.9	114.8	128.4	-62.4	-0.3	0	0	0	124.2
214	Y	26.9	Very low	29	Very low	222 Å²	222	129.1 Å²	129.1	87%	0.871	78%	0.778	S	S	*	*				-166.5	130.8	114.3	-122.2	-109.2	0	0	0	107.1
215	S	31.6	Very low	29.1	Very low	103 Å²	103	124 Å²	124	72%	0.72	77%	0.766	S	S	*	*				61.5	131.9	64.2	-70.8	0	0	0	0	113.7
216	S	32.4	Very low	29.2	Very low	108 Å²	108	121.4 Å²	121.4	76%	0.755	76%	0.764	S	S	*	*			cis	-149.4	-176.1	5.5	56.8	0	0	0	0	110
217	S	29.5	Very low	29.3	Very low	109 Å²	109	122 Å²	122	76%	0.762	76%	0.762	S	S	*	*			cis	-163.3	173.1	37.5	-54.1	0	0	0	0	112.5
218	I	33.4	Very low	29.3	Very low	152 Å²	152	125.3 Å²	125.3	78%	0.779	76%	0.76	S	S	*	*			trans	-131.4	162.2	174.9	-27.9	177.8	0	0	0	110
219	P	40.5	Very low	30	Very low	119 Å²	119	125.9 Å²	125.9	77%	0.773	75%	0.748	S	S	*	*				-149.5	175.5	107.6	38.2	-22.2	0	0	0	115.8
220	S	28.7	Very low	30	Very low	86 Å²	86	130.1 Å²	130.1	60%	0.601	75%	0.746	S	S	*	*			cis	-174.9	117.9	-42	-91.6	0	0	0	0	112.5
221	T	31.5	Very low	29.9	Very low	135 Å²	135	134.2 Å²	134.2	83%	0.828	75%	0.75	S	S	*	*			trans	67.4	173.1	140.9	63.9	0	0	0	0	119.2
222	P	44.3	Very low	29.7	Very low	107 Å²	107	131.6 Å²	131.6	70%	0.695	75%	0.745	S	S	*	*			cis	-131.5	148.2	6.9	46.4	-30.5	0	0	0	116.9
223	S	26.5	Very low	29.7	Very low	108 Å²	108	132.3 Å²	132.3	76%	0.755	75%	0.754	S	S	*	*				77.4	152.4	101.7	83	0	0	0	0	116
224	T	24.9	Very low	30.5	Very low	123 Å²	123	131.1 Å²	131.1	76%	0.755	75%	0.754	S	S	*	*			cis	-147.9	141.2	12.2	28.3	0	0	0	0	108.1
225	S	26.6	Very low	31.5	Very low	90 Å²	90	125.9 Å²	125.9	63%	0.629	75%	0.747	S	S	*	*				83.2	114.8	58.8	78	0	0	0	0	118
226	Q	27.1	Very low	31.2	Very low	169 Å²	169	127.4 Å²	127.4	79%	0.79	75%	0.752	S	S	*	*			trans	48.9	160.8	135.7	-73.6	179	-83.6	0	0	122.3
227	E	29.1	Very low	30.9	Very low	152 Å²	152	126 Å²	126	71%	0.71	75%	0.746	S	S	*	*			cis	-170.7	144.5	-27.1	-114.9	177.4	160.9	0	0	109.7
228	D	23.8	Very low	30.8	Very low	154 Å²	154	128.6 Å²	128.6	82%	0.824	75%	0.752	S	S	*	*			trans	53.9	179.5	150.3	-106.4	22.8	0	0	0	121.3
229	P	39	Very low	30.5	Very low	99 Å²	99	127.9 Å²	127.9	64%	0.643	76%	0.755	S	S	*	*			cis	-136.5	-178.4	-22.2	39.1	-20.7	0	0	0	116.6
230	Q	25.1	Very low	30.3	Very low	173 Å²	173	127.6 Å²	127.6	81%	0.808	75%	0.753	S	S	*	*			trans	73.6	119.2	140.8	-157.5	174.2	31.2	0	0	123.7
231	F	24.4	Very low	30.6	Very low	191 Å²	191	129.6 Å²	129.6	84%	0.838	76%	0.762	S	S	*	*				-169.8	152	128.4	-127.5	-111.9	0	0	0	117.2
232	S	23.1	Very low	31	Very low	100 Å²	100	128.7 Å²	128.7	70%	0.699	76%	0.758	S	S	*	*			trans	12.2	150.8	164.7	66.2	0	0	0	0	126.8
233	V	26.5	Very low	30.1	Very low	139 Å²	139	130 Å²	130	84%	0.842	76%	0.763	S	S	*	*			trans	-147.5	150.3	173	161.6	0	0	0	0	106.3
234	P	45.5	Very low	30.1	Very low	115 Å²	115	130.1 Å²	130.1	75%	0.747	76%	0.763	S	S	*	*			cis	-124.3	-143.2	29.9	44.9	-26.1	0	0	0	111.5
235	P	47.1	Very low	30.3	Very low	112 Å²	112	133.9 Å²	133.9	73%	0.727	77%	0.769	S	S	*	*			cis	-122.8	-156.7	-8.1	30.6	-3.7	0	0	0	112.5
236	T	25	Very low	30.2	Very low	135 Å²	135	140.7 Å²	140.7	83%	0.828	78%	0.781	S	S	*	*			cis	-148.1	-143.3	11.9	-32.2	0	0	0	0	111.9
237	A	26.3	Very low	30.3	Very low	77 Å²	77	138 Å²	138	64%	0.636	78%	0.781	S	S	*	*			trans	-148	164.2	-173.6	0	0	0	0	0	113.8
238	N	29	Very low	30.3	Very low	165 Å²	165	139.6 Å²	139.6	88%	0.882	79%	0.79	S	S	*	*				177.5	146.5	124.9	-87.1	-25.9	0	0	0	115.2
239	T	26.1	Very low	30.6	Very low	136 Å²	136	142.2 Å²	142.2	83%	0.834	79%	0.789	S	S	*	*			trans	-98.6	-173.2	173.5	6.2	0	0	0	0	110.4
240	P	37.2	Very low	29.9	Very low	114 Å²	114	147.7 Å²	147.7	74%	0.74	80%	0.797	S	S	*	*			cis	-134.8	-172.9	-6	39	-18.7	0	0	0	115.9
241	T	34	Very low	30.3	Very low	128 Å²	128	143.7 Å²	143.7	79%	0.785	79%	0.788	S	S	*	*			trans	-71.5	159.6	156.3	31.5	0	0	0	0	111.8
242	P	39.9	Very low	30.8	Very low	115 Å²	115	141.1 Å²	141.1	75%	0.747	78%	0.783	S	S	*	*				-161.1	169.4	67.4	43.7	-21.1	0	0	0	121.6
243	V	25.7	Very low	31	Very low	134 Å²	134	144.2 Å²	144.2	81%	0.812	79%	0.791	S	S	*	*			trans	69.4	108.6	141.8	167.5	0	0	0	0	122.4
244	C	26.4	Very low	31.2	Very low	111 Å²	111	146.2 Å²	146.2	75%	0.75	79%	0.788	S	S	*	*			trans	61	127.6	132.1	-164.5	0	0	0	0	123.1
245	K	28.9	Very low	30.5	Very low	202 Å²	202	147.3 Å²	147.3	88%	0.878	79%	0.793	S	S	*	*				-157.4	160.4	128.2	-109.2	157.5	-170.3	173.4	0	113.9
246	R	25.2	Very low	29.5	Very low	234 Å²	234	147.3 Å²	147.3	88%	0.883	80%	0.796	S	S	*	*			trans	-47.6	137.8	178.7	-70.9	164.8	179.7	161.6	-2.2	112.7
247	S	29.1	Very low	29.7	Very low	111 Å²	111	150.3 Å²	150.3	78%	0.776	80%	0.801	S	S	*	*				71.3	118.1	65.8	-178.8	0	0	0	0	115
248	M	28.1	Very low	29.9	Very low	186 Å²	186	156.2 Å²	156.2	92%	0.916	81%	0.812	S	S	*	*			trans	-151.4	171.7	152.7	-83.5	-137.8	71.6	0	0	110.5
249	R	30.3	Very low	29.8	Very low	210 Å²	210	151.9 Å²	151.9	79%	0.792	81%	0.806	S	S	*	*			trans	-128.8	-172.4	-167.8	-171.9	-179.1	173.4	-163.7	-1	109.5
250	W	25.6	Very low	30	Very low	213 Å²	213	150.5 Å²	150.5	81%	0.807	80%	0.802	S	S	*	*			trans	85.2	136.3	172.7	-114.5	-110.4	0	0	0	114
251	S	33.3	Very low	29.6	Very low	90 Å²	90	152.9 Å²	152.9	63%	0.629	81%	0.809	S	S	*	*			cis	-162.5	167.2	-11.6	43.9	0	0	0	0	112.9
252	N	34	Very low	30.1	Very low	136 Å²	136	151.9 Å²	151.9	73%	0.727	80%	0.804	S	S	*	*			trans	-59.9	155.2	162.7	-52.5	-14.5	0	0	0	111.4
253	L	28.2	Very low	29.6	Very low	165 Å²	165	154.1 Å²	154.1	86%	0.864	81%	0.81	S	S	*	*			trans	-131.6	126.6	153.6	-153.1	80.1	0	0	0	108.3
254	F	29.8	Very low	29.9	Very low	181 Å²	181	155.7 Å²	155.7	79%	0.794	81%	0.806	S	S	*	*			trans	-109.4	138.7	167.5	-91.1	-86.4	0	0	0	107.9
255	T	30.9	Very low	30.2	Very low	138 Å²	138	157.8 Å²	157.8	85%	0.847	81%	0.805	S	S	*	*			trans	-124	136.1	152.9	46.3	0	0	0	0	107.6
256	S	27.6	Very low	30.5	Very low	113 Å²	113	160.4 Å²	160.4	79%	0.79	81%	0.809	S	S	*	*			trans	-130.9	136.3	178.5	170.9	0	0	0	0	107.3
257	E	29	Very low	30.8	Very low	197 Å²	197	159 Å²	159	92%	0.921	81%	0.809	S	S	*	*			trans	-143.2	174.4	156.2	-130.6	175.3	150.3	0	0	110.7
258	K	29.9	Very low	30.7	Very low	201 Å²	201	158.5 Å²	158.5	87%	0.874	81%	0.812	S	S	*	*			trans	-148.6	131.1	-146.1	178.8	-176.5	176.4	-173.8	0	110.9
259	G	26.5	Very low	30.9	Very low	74 Å²	74	154.7 Å²	154.7	76%	0.763	80%	0.802	S	S	*	*			trans	-158.5	152	173.4	0	0	0	0	0	110.1
260	S	30	Very low	30.9	Very low	108 Å²	108	153.6 Å²	153.6	76%	0.755	81%	0.805	S	S	*	*			trans	-157.3	125.7	-168.1	53.9	0	0	0	0	112.8
261	D	28.8	Very low	31	Very low	163 Å²	163	150.4 Å²	150.4	87%	0.872	80%	0.804	S	S	*	*			trans	-163.3	163	133.7	-117.7	-3.7	0	0	0	110.3
262	P	44.3	Very low	31	Very low	107 Å²	107	154.5 Å²	154.5	70%	0.695	81%	0.813	S	S	*	*			trans	-105.4	137.9	-173.1	36.9	-29.9	0	0	0	113.8
263	D	30.4	Very low	30.8	Very low	162 Å²	162	152.2 Å²	152.2	87%	0.866	81%	0.813	S	S	*	*				-171.7	127.4	121	-126	-26.7	0	0	0	113.1
264	K	32.7	Very low	31.1	Very low	168 Å²	168	151.5 Å²	151.5	73%	0.73	81%	0.81	S	S	*	*			trans	158.5	133	135.3	-91.5	-167.2	162.6	-136.7	0	115.6
265	E	31.9	Very low	31	Very low	155 Å²	155	148.8 Å²	148.8	72%	0.724	81%	0.808	S	S	*	*			trans	42.3	117.5	138.5	-57.1	-175.5	104.6	0	0	120.4	K267	E265-K267 PolarHBondContact O-N 3.26Å
266	R	34.6	Very low	31.4	Very low	256 Å²	256	150.5 Å²	150.5	97%	0.966	81%	0.811	S	S	*	*			trans	-74.1	116.3	170.4	-62.9	176.9	-179	172.8	0.3	111.8
267	K	31.2	Very low	31.5	Very low	204 Å²	204	148.5 Å²	148.5	89%	0.887	81%	0.807	S	S	*	*			trans	-131.7	133.8	148.2	-72.1	-170.9	178.4	179.7	0	109.3	E265	E265-K267 PolarHBondContact O-N 3.26Å
268	A	28	Very low	31.9	Very low	101 Å²	101	143.1 Å²	143.1	84%	0.835	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-80.9	133.2	177.9	0	0	0	0	0	109.8
269	P	31.8	Very low	32.6	Very low	107 Å²	107	137.6 Å²	137.6	70%	0.695	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-82.5	143.7	-178.1	32.3	-34.7	0	0	0	112.5
270	E	31.1	Very low	34.3	Very low	186 Å²	186	138.2 Å²	138.2	87%	0.869	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-70.4	134.5	165.3	-61.5	175.5	127.2	0	0	109.7	H272	E270-H272 PolarHBondContact O-N 3.44Å
271	N	27.8	Very low	35.9	Very low	146 Å²	146	136.3 Å²	136.3	78%	0.781	76%	0.762	S	S	*	*			trans	-98.4	86.3	177.9	-84.8	-79.5	0	0	0	111.3	A273	N271-A273 PolarHBondContact O-N 3.44Å
272	H	33.3	Very low	38.2	Very low	177 Å²	177	135.8 Å²	135.8	82%	0.819	76%	0.757	S	S	*	*			trans	-70.1	118	156.3	-103.5	-80.5	0	0	0	109	E270	E270-H272 PolarHBondContact O-N 3.44Å
273	A	29.7	Very low	40.1	Very low	88 Å²	88	131.4 Å²	131.4	73%	0.727	73%	0.729	S	S	*	*			trans	-142.1	53.1	-174.6	0	0	0	0	0	113	N271 T275	N271-A273 PolarHBondContact O-N 3.44Å; A273-T275 PolarHBondContact O-N 3.21Å
274	D	33.2	Very low	42.7	Very low	150 Å²	150	128.4 Å²	128.4	80%	0.802	71%	0.712	S	S	*	*			trans	-84.4	102.4	169.7	-87.1	-56	0	0	0	111.3
275	T	29.4	Very low	45.4	Very low	123 Å²	123	123 Å²	123	76%	0.755	69%	0.689	S	S	*	*	S	Bend	trans	-163	107.3	149.6	-77.2	0	0	0	0	110.7	A273	A273-T275 PolarHBondContact O-N 3.21Å
276	I	38.5	Very low	48.3	Very low	175 Å²	175	120.2 Å²	120.2	90%	0.897	68%	0.676	S	S	*	*	S	Bend	trans	53.1	64.9	154.7	-46.3	172.7	0	0	0	115.6
277	G	30.3	Very low	50.9	Low	70 Å²	70	108.8 Å²	108.8	72%	0.722	64%	0.638	S	S	*	*			trans	-146.1	111.8	160.4	0	0	0	0	0	109.7	G279	G277-G279 PolarHBondContact O-N 3.43Å
278	S	37	Very low	53.8	Low	84 Å²	84	101.8 Å²	101.8	59%	0.587	61%	0.609	S	S	*	*			trans	-70.4	105.6	-170.4	-167.2	0	0	0	0	111.4	R280	S278-R280 WeakPolarHBondContact O-CG 3.37Å; S278-R280 PolarHBondContact O-N 2.91Å; S278-R280 PolarHBondContact OG-NE 2.97Å; S278-R280 PolarHBondContact OG-NH2 3.28Å
279	G	44.1	Very low	56.7	Low	85 Å²	85	97.1 Å²	97.1	88%	0.876	57%	0.569	S	S	*	*			trans	-60.2	89.9	-175.1	0	0	0	0	0	113.8	G277	G277-G279 PolarHBondContact O-N 3.43Å
280	R	62.1	Low	59.5	Low	87 Å²	87	95 Å²	95	33%	0.328	55%	0.552	S	S	.	*			trans	-130.1	142.4	-178.9	-62.3	169.5	-158.1	-149.8	-1.3	109	S278 I282 Y322 M323	S278-R280 WeakPolarHBondContact O-CG 3.37Å; S278-R280 PolarHBondContact O-N 2.91Å; S278-R280 PolarHBondContact OG-NE 2.97Å; S278-R280 PolarHBondContact OG-NH2 3.28Å; R280-I282 PolarHBondContact O-N 2.79Å; R280-Y322 PolarHBondContact NH1-O 3.44Å; R280-M323 PolarHBondContact NH1-O 2.87Å; R280-M323 PolarHBondContact NH2-O 3.24Å
281	A	63.1	Low	62.3	Low	69 Å²	69	87.7 Å²	87.7	57%	0.57	52%	0.517	S	S	*	.	P	Polyproline II helix	trans	-56	126.4	167.2	0	0	0	0	0	109.6	P283	A281-P283 WeakPolarHBondContact O-CD 3.32Å
282	I	78	Confident	65	Low	151 Å²	151	84.2 Å²	84.2	77%	0.774	49%	0.493	S	S	*	.	P	Polyproline II helix	trans	-66.5	120.5	178.2	-62.5	168.9	0	0	0	107.7	R280	R280-I282 PolarHBondContact O-N 2.79Å
283	P	83.3	Confident	67	Low	16 Å²	16	77.6 Å²	77.6	10%	0.104	47%	0.467	C	S	.	.	P	Polyproline II helix	trans	-73.7	133.2	-178.9	29.1	-33.2	0	0	0	110.6	A281 K285 Q286 T306 L307	A281-P283 WeakPolarHBondContact O-CD 3.32Å; P283-K285 PolarHBondContact O-N 3.4Å; P283-Q286 HydrophobicContact CB-CB 4.46Å; P283-Q286 HydrophobicContact CG-CB 4Å; P283-Q286 HydrophobicContact CG-CG 4.14Å; P283-T306 HydrophobicContact CB-CG2 4.36Å; P283-T306 HydrophobicContact CG-CG2 4.3Å; P283-L307 CarbonylContact C-O 3.53Å; P283-L307 VanDerWaalsContact CA-O 3.27Å; P283-L307 WeakPolarHBondContact CA-O 3.44Å; P283-L307 WeakPolarHBondContact CB-O 3.33Å
284	I	86.5	Confident	68.5	Low	99 Å²	99	77.1 Å²	77.1	51%	0.508	47%	0.471	S	S	.	.	S	Bend	trans	-56.5	-36.2	175.2	-67.4	176	0	0	0	110.9	L307	I284-L307 PolarHBondContact N-O 3.49Å
285	K	89.4	Confident	69.7	Low	55 Å²	55	78.6 Å²	78.6	24%	0.239	47%	0.47	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	135.9	174.3	-166	174.9	179.2	73.5	0	110.6	P283 T306 L307 A433 W434 A437	P283-K285 PolarHBondContact O-N 3.4Å; K285-T306 CarbonylContact O-C 3.51Å; K285-T306 WeakPolarHBondContact O-CA 3.49Å; K285-L307 HydrophobicContact CB-CB 4.28Å; K285-L307 HydrophobicContact CB-CD2 4.5Å; K285-L307 PolarHBondContact N-O 3.36Å; K285-L307 PolarHBondContact O-N 2.76Å; K285-A433 WeakPolarHBondContact CE-O 3.27Å; K285-W434 HydrophobicContact CB-CH2 4.27Å; K285-W434 HydrophobicContact CB-CZ3 4.08Å; K285-W434 HydrophobicContact CD-CD2 3.67Å; K285-W434 HydrophobicContact CD-CE3 3.67Å; K285-W434 HydrophobicContact CD-CG 4.15Å; K285-W434 HydrophobicContact CD-CH2 4.37Å; K285-W434 HydrophobicContact CD-CZ2 4.37Å; K285-W434 HydrophobicContact CD-CZ3 4.03Å; K285-W434 VanDerWaalsContact CE-CD2 3.46Å; K285-W434 HydrophobicContact CG-CD2 4.27Å; K285-W434 HydrophobicContact CG-CE3 4.13Å; K285-W434 HydrophobicContact CG-CH2 3.93Å; K285-W434 HydrophobicContact CG-CZ2 4.07Å; K285-W434 HydrophobicContact CG-CZ3 3.95Å; K285-A437 HydrophobicContact CB-CB 4.39Å; K285-A437 HydrophobicContact CD-CB 3.68Å
286	Q	91.5	Very high	70.8	Confident	96 Å²	96	85 Å²	85	45%	0.449	48%	0.481	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	152.1	175.6	60.2	-175.5	-5.2	0	0	111.6	P283 Y304 V305 T306	P283-Q286 HydrophobicContact CB-CB 4.46Å; P283-Q286 HydrophobicContact CG-CB 4Å; P283-Q286 HydrophobicContact CG-CG 4.14Å; Q286-Y304 HydrophobicContact CB-CE1 4.39Å; Q286-Y304 PolarHBondContact OE1-OH 3Å; Q286-V305 VanDerWaalsContact CA-O 3.26Å; Q286-V305 WeakPolarHBondContact CA-O 3.16Å; Q286-T306 HydrophobicContact CB-CG2 3.93Å
287	G	90.8	Very high	71.5	Confident	16 Å²	16	83 Å²	83	17%	0.165	47%	0.471	C	S	.	.	E	Extended strand (participates in β ladder)	trans	168.7	-175.4	-176.8	0	0	0	0	0	113.9	V305	G287-V305 PolarHBondContact N-O 3.19Å; G287-V305 PolarHBondContact O-N 3.28Å
288	M	90.1	Very high	73.3	Confident	57 Å²	57	87.5 Å²	87.5	28%	0.281	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	120.9	-179.6	-66.7	-66.3	-68.9	0	0	111.2	K302 K303 Y304	M288-K302 HydrophobicContact CE-CB 4.08Å; M288-K302 HydrophobicContact CE-CD 3.64Å; M288-K302 HydrophobicContact CE-CG 3.68Å; M288-K303 CarbonylContact C-O 3.55Å; M288-K303 WeakPolarHBondContact CA-O 3.33Å; M288-Y304 HydrophobicContact CG-CD2 4.34Å; M288-Y304 HydrophobicContact SD-CD2 3.6Å; M288-Y304 VanDerWaalsContact SD-CD2 3.6Å; M288-Y304 HydrophobicContact SD-CG 4.19Å
289	L	90.8	Very high	75.3	Confident	2 Å²	2	86.5 Å²	86.5	1%	0.01	46%	0.461	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	152.8	174.5	-68	175	0	0	0	111.4	K302 K303 V305 F411 F423 A425 W434	L289-K302 CarbonylContact O-C 3.54Å; L289-K303 PolarHBondContact N-O 2.85Å; L289-K303 PolarHBondContact O-N 3.44Å; L289-V305 HydrophobicContact CB-CG2 3.98Å; L289-V305 HydrophobicContact CD1-CB 4.31Å; L289-V305 HydrophobicContact CD1-CG1 4.41Å; L289-V305 HydrophobicContact CD1-CG2 4.11Å; L289-V305 HydrophobicContact CG-CG2 4.3Å; L289-F411 HydrophobicContact CD1-CE1 4.07Å; L289-F411 HydrophobicContact CD1-CZ 3.76Å; L289-F411 HydrophobicContact CD2-CE1 4.43Å; L289-F423 HydrophobicContact CB-CD1 4.1Å; L289-F423 HydrophobicContact CD1-CB 4.39Å; L289-F423 HydrophobicContact CD1-CD1 4.15Å; L289-F423 HydrophobicContact CD1-CG 4.44Å; L289-A425 HydrophobicContact CD2-CB 3.86Å; L289-W434 HydrophobicContact CD1-CD2 4.01Å; L289-W434 HydrophobicContact CD1-CE3 4.49Å; L289-W434 HydrophobicContact CD1-CG 4.23Å; L289-W434 HydrophobicContact CD1-CZ2 4.41Å; L289-W434 HydrophobicContact CD2-CG 4.46Å
290	L	88.9	Confident	77.1	Confident	62 Å²	62	86.8 Å²	86.8	33%	0.325	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	121.6	168.2	-67.9	170.4	0	0	0	108.6	W300 K302 F423 E424	L290-W300 HydrophobicContact CB-CB 4.49Å; L290-W300 HydrophobicContact CB-CE3 4.08Å; L290-W300 WeakPolarHBondContact O-CZ3 3.43Å; L290-K302 HydrophobicContact CD2-CB 4.29Å; L290-K302 HydrophobicContact CD2-CG 4.17Å; L290-F423 CarbonylContact O-C 3.38Å; L290-F423 VanDerWaalsContact O-CA 3.27Å; L290-F423 WeakPolarHBondContact O-CA 3.24Å; L290-E424 HydrophobicContact CB-CB 4.1Å; L290-E424 HydrophobicContact CD1-CG 4.5Å; L290-E424 PolarHBondContact N-O 2.83Å; L290-E424 PolarHBondContact O-N 3.06Å
291	K	90.4	Very high	78.3	Confident	33 Å²	33	88.4 Å²	88.4	14%	0.143	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	128.7	-179.3	-163	-85.1	167	-162.5	0	109.8	K301 K303 Y315 F423	K291-K301 PolarHBondContact N-O 2.72Å; K291-K301 PolarHBondContact O-N 3.44Å; K291-K303 HydrophobicContact CB-CB 4.46Å; K291-K303 HydrophobicContact CB-CG 3.84Å; K291-Y315 HydrophobicContact CD-CE2 4.4Å; K291-F423 HydrophobicContact CB-CD1 4.02Å; K291-F423 HydrophobicContact CB-CE1 3.94Å; K291-F423 HydrophobicContact CG-CD1 3.85Å; K291-F423 HydrophobicContact CG-CE1 3.45Å; K291-F423 VanDerWaalsContact CG-CE1 3.45Å; K291-F423 HydrophobicContact CG-CZ 3.98Å
292	R	85.4	Confident	79.6	Confident	74 Å²	74	91.3 Å²	91.3	28%	0.279	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	131.2	-179.4	-152.4	176.2	75.5	-159.9	0.2	112	W300 H422	R292-W300 HydrophobicContact CB-CD2 4.13Å; R292-W300 HydrophobicContact CB-CE3 3.77Å; R292-W300 HydrophobicContact CB-CH2 4.03Å; R292-W300 HydrophobicContact CB-CZ2 4.35Å; R292-W300 HydrophobicContact CB-CZ3 3.72Å; R292-W300 HydrophobicContact CG-CD2 4.14Å; R292-W300 HydrophobicContact CG-CE3 4.3Å; R292-W300 HydrophobicContact CG-CH2 4.48Å; R292-W300 HydrophobicContact CG-CZ2 4.3Å; R292-W300 HydrophobicContact CG-CZ3 4.47Å; R292-H422 HydrophobicContact CB-CB 3.88Å; R292-H422 VanDerWaalsContact CZ-CD2 3.42Å; R292-H422 PolarHBondContact N-O 3.36Å; R292-H422 PolarHBondContact NH2-CD2 3.4Å; R292-H422 PolarHBondContact NH2-NE2 3.36Å
293	S	75.4	Confident	80.3	Confident	37 Å²	37	85.8 Å²	85.8	26%	0.259	42%	0.415	S	S	.	.			trans	-59.2	146.5	172.1	-176.7	0	0	0	0	111.5	K295 L297 T299	S293-K295 PolarHBondContact OG-N 3.16Å; S293-L297 WeakPolarHBondContact CB-O 3.37Å; S293-L297 PolarHBondContact OG-O 3.07Å; S293-T299 VanDerWaalsContact CB-O 3.31Å; S293-T299 WeakPolarHBondContact CB-O 3.25Å; S293-T299 PolarHBondContact N-O 3.36Å
294	G	61.4	Low	80.6	Confident	79 Å²	79	86.2 Å²	86.2	81%	0.814	42%	0.415	S	S	*	.			trans	-104.7	-6.2	177.5	0	0	0	0	0	114.7
295	K	57.9	Low	80.8	Confident	181 Å²	181	81.6 Å²	81.6	79%	0.787	39%	0.391	S	S	*	.	S	Bend	trans	-85.2	164	169.7	-65.8	-166.7	175.2	-168.6	0	109.9	S293 L297	S293-K295 PolarHBondContact OG-N 3.16Å; K295-L297 CarbonylContact O-C 3.5Å; K295-L297 VanDerWaalsContact O-C 3.3Å; K295-L297 PolarHBondContact O-N 3.34Å
296	W	52.3	Low	80.9	Confident	258 Å²	258	79.1 Å²	79.1	98%	0.977	38%	0.381	S	S	*	.	S	Bend	trans	-34.6	-45	-171.4	-161.6	-106.3	0	0	0	115.7	K298	W296-K298 PolarHBondContact O-N 3.24Å
297	L	53.5	Low	80.8	Confident	133 Å²	133	74.5 Å²	74.5	70%	0.696	36%	0.359	S	S	*	.	S	Bend	trans	-79.2	103.3	172	-72.3	159.1	0	0	0	111.9	S293 K295 T299	S293-L297 WeakPolarHBondContact CB-O 3.37Å; S293-L297 PolarHBondContact OG-O 3.07Å; K295-L297 CarbonylContact O-C 3.5Å; K295-L297 VanDerWaalsContact O-C 3.3Å; K295-L297 PolarHBondContact O-N 3.34Å; L297-T299 HydrophobicContact CB-CG2 4.48Å; L297-T299 PolarHBondContact O-N 2.9Å; L297-T299 PolarHBondContact O-OG1 2.98Å
298	K	67.5	Low	80.7	Confident	163 Å²	163	74.7 Å²	74.7	71%	0.709	36%	0.358	S	S	*	.			trans	-68.9	50.1	178.4	-64.1	176.6	-178.1	167.4	0	114.1	W296	W296-K298 PolarHBondContact O-N 3.24Å
299	T	78.9	Confident	80.2	Confident	63 Å²	63	75.6 Å²	75.6	39%	0.387	37%	0.37	S	S	.	.			trans	-77	143.5	178.3	48.5	0	0	0	0	112.2	S293 L297	S293-T299 VanDerWaalsContact CB-O 3.31Å; S293-T299 WeakPolarHBondContact CB-O 3.25Å; S293-T299 PolarHBondContact N-O 3.36Å; L297-T299 HydrophobicContact CB-CG2 4.48Å; L297-T299 PolarHBondContact O-N 2.9Å; L297-T299 PolarHBondContact O-OG1 2.98Å
300	W	82.3	Confident	79.7	Confident	91 Å²	91	80 Å²	80	35%	0.345	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	136.8	167.4	-66.6	101.9	0	0	0	109.8	L290 R292 N410 H422 E424	L290-W300 HydrophobicContact CB-CB 4.49Å; L290-W300 HydrophobicContact CB-CE3 4.08Å; L290-W300 WeakPolarHBondContact O-CZ3 3.43Å; R292-W300 HydrophobicContact CB-CD2 4.13Å; R292-W300 HydrophobicContact CB-CE3 3.77Å; R292-W300 HydrophobicContact CB-CH2 4.03Å; R292-W300 HydrophobicContact CB-CZ2 4.35Å; R292-W300 HydrophobicContact CB-CZ3 3.72Å; R292-W300 HydrophobicContact CG-CD2 4.14Å; R292-W300 HydrophobicContact CG-CE3 4.3Å; R292-W300 HydrophobicContact CG-CH2 4.48Å; R292-W300 HydrophobicContact CG-CZ2 4.3Å; R292-W300 HydrophobicContact CG-CZ3 4.47Å; W300-N410 HydrophobicContact CH2-CB 4.49Å; W300-H422 HydrophobicContact CH2-CB 4.1Å; W300-H422 HydrophobicContact CZ3-CB 4.35Å; W300-E424 HydrophobicContact CE3-CB 4.18Å; W300-E424 HydrophobicContact CH2-CB 3.93Å; W300-E424 HydrophobicContact CZ3-CB 3.73Å
301	K	87.8	Confident	79.4	Confident	122 Å²	122	77 Å²	77	53%	0.53	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	132.8	176.1	-61.8	-166.1	176.6	-165.7	0	110.1	K291	K291-K301 PolarHBondContact N-O 2.72Å; K291-K301 PolarHBondContact O-N 3.44Å
302	K	90.1	Very high	79.3	Confident	129 Å²	129	76.8 Å²	76.8	56%	0.561	38%	0.379	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-60.1	138.6	173.6	-133.3	-174.9	173.7	177.6	0	109.5	M288 L289 L290	M288-K302 HydrophobicContact CE-CB 4.08Å; M288-K302 HydrophobicContact CE-CD 3.64Å; M288-K302 HydrophobicContact CE-CG 3.68Å; L289-K302 CarbonylContact O-C 3.54Å; L290-K302 HydrophobicContact CD2-CB 4.29Å; L290-K302 HydrophobicContact CD2-CG 4.17Å
303	K	91.4	Very high	79.5	Confident	35 Å²	35	73.4 Å²	73.4	15%	0.152	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	145	177.1	-64.5	-62.9	158.1	-157.3	0	109.7	M288 L289 K291 V305 Y315 Y316 S317	M288-K303 CarbonylContact C-O 3.55Å; M288-K303 WeakPolarHBondContact CA-O 3.33Å; L289-K303 PolarHBondContact N-O 2.85Å; L289-K303 PolarHBondContact O-N 3.44Å; K291-K303 HydrophobicContact CB-CB 4.46Å; K291-K303 HydrophobicContact CB-CG 3.84Å; K303-V305 HydrophobicContact CB-CG2 4.43Å; K303-Y315 HydrophobicContact CG-CD2 4.28Å; K303-Y316 WeakPolarHBondContact CA-O 3.38Å; K303-Y316 WeakPolarHBondContact CB-O 3.14Å; K303-Y316 WeakPolarHBondContact CD-O 3.47Å; K303-S317 VanDerWaalsContact NZ-CA 3.31Å; K303-S317 PolarHBondContact NZ-O 2.81Å; K303-S317 PolarHBondContact NZ-OG 3.22Å
304	Y	90.2	Very high	80.3	Confident	26 Å²	26	71.9 Å²	71.9	10%	0.102	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	134.2	166.5	-167.3	-103.9	0	0	0	107.9	Q286 M288 T306 Y315 Y316 L319 Y322	Q286-Y304 HydrophobicContact CB-CE1 4.39Å; Q286-Y304 PolarHBondContact OE1-OH 3Å; M288-Y304 HydrophobicContact CG-CD2 4.34Å; M288-Y304 HydrophobicContact SD-CD2 3.6Å; M288-Y304 VanDerWaalsContact SD-CD2 3.6Å; M288-Y304 HydrophobicContact SD-CG 4.19Å; Y304-T306 HydrophobicContact CD1-CG2 3.95Å; Y304-T306 HydrophobicContact CE1-CG2 3.53Å; Y304-Y315 CarbonylContact O-C 3.53Å; Y304-Y315 VanDerWaalsContact O-CA 3.28Å; Y304-Y315 WeakPolarHBondContact O-CA 3.36Å; Y304-Y316 PolarHBondContact N-O 2.87Å; Y304-Y316 PolarHBondContact O-N 3.22Å; Y304-L319 HydrophobicContact CD1-CD1 4.34Å; Y304-L319 HydrophobicContact CD2-CD1 3.87Å; Y304-L319 HydrophobicContact CE1-CD1 4.07Å; Y304-L319 HydrophobicContact CE2-CD1 3.6Å; Y304-L319 HydrophobicContact CG-CD1 4.22Å; Y304-Y322 AromaticContact CD1-CD1 3.94Å; Y304-Y322 HydrophobicContact CD1-CD1 3.94Å; Y304-Y322 HydrophobicContact CD1-CD2 4.1Å; Y304-Y322 AromaticContact CD1-CG 3.62Å; Y304-Y322 HydrophobicContact CD1-CG 3.62Å; Y304-Y322 AromaticContact CE1-CD1 3.45Å; Y304-Y322 HydrophobicContact CE1-CD1 3.45Å; Y304-Y322 VanDerWaalsContact CE1-CD1 3.45Å; Y304-Y322 HydrophobicContact CE1-CD2 4Å; Y304-Y322 AromaticContact CE1-CE1 3.77Å; Y304-Y322 HydrophobicContact CE1-CE1 3.77Å; Y304-Y322 HydrophobicContact CE1-CE2 4.29Å; Y304-Y322 AromaticContact CE1-CG 3.57Å; Y304-Y322 HydrophobicContact CE1-CG 3.57Å
305	V	91.8	Very high	81.7	Confident	1 Å²	1	69.4 Å²	69.4	1%	0.006	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	138.2	-174.1	-174.1	0	0	0	0	109.1	Q286 G287 L289 K303 L313 T314 F423 W434	Q286-V305 VanDerWaalsContact CA-O 3.26Å; Q286-V305 WeakPolarHBondContact CA-O 3.16Å; G287-V305 PolarHBondContact N-O 3.19Å; G287-V305 PolarHBondContact O-N 3.28Å; L289-V305 HydrophobicContact CB-CG2 3.98Å; L289-V305 HydrophobicContact CD1-CB 4.31Å; L289-V305 HydrophobicContact CD1-CG1 4.41Å; L289-V305 HydrophobicContact CD1-CG2 4.11Å; L289-V305 HydrophobicContact CG-CG2 4.3Å; K303-V305 HydrophobicContact CB-CG2 4.43Å; V305-L313 HydrophobicContact CG1-CD1 3.66Å; V305-L313 HydrophobicContact CG1-CD2 4.44Å; V305-L313 HydrophobicContact CG1-CG 4.02Å; V305-T314 CarbonylContact C-O 3.57Å; V305-T314 WeakPolarHBondContact CA-O 3.2Å; V305-F423 HydrophobicContact CG2-CE1 4.23Å; V305-W434 HydrophobicContact CB-CH2 4.12Å; V305-W434 HydrophobicContact CB-CZ2 4.49Å; V305-W434 HydrophobicContact CG1-CH2 4.06Å; V305-W434 HydrophobicContact CG1-CZ3 4.17Å; V305-W434 WeakPolarHBondContact O-CH2 3.32Å
306	T	91.3	Very high	83.2	Confident	3 Å²	3	61.4 Å²	61.4	2%	0.018	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	125.6	-178.4	54.2	0	0	0	0	110.3	P283 K285 Q286 Y304 T314 Y322	P283-T306 HydrophobicContact CB-CG2 4.36Å; P283-T306 HydrophobicContact CG-CG2 4.3Å; K285-T306 CarbonylContact O-C 3.51Å; K285-T306 WeakPolarHBondContact O-CA 3.49Å; Q286-T306 HydrophobicContact CB-CG2 3.93Å; Y304-T306 HydrophobicContact CD1-CG2 3.95Å; Y304-T306 HydrophobicContact CE1-CG2 3.53Å; T306-T314 PolarHBondContact N-O 2.8Å; T306-T314 PolarHBondContact O-N 2.86Å; T306-T314 PolarHBondContact OG1-O 3.39Å; T306-Y322 HydrophobicContact CG2-CD2 4.1Å; T306-Y322 HydrophobicContact CG2-CE2 3.74Å
307	L	89.8	Confident	84.9	Confident	0 Å²	0	52 Å²	52	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	122.1	173	175.5	62.9	0	0	0	109.3	P283 I284 K285 L313 L333 W434 A437 I438 Q441	P283-L307 CarbonylContact C-O 3.53Å; P283-L307 VanDerWaalsContact CA-O 3.27Å; P283-L307 WeakPolarHBondContact CA-O 3.44Å; P283-L307 WeakPolarHBondContact CB-O 3.33Å; I284-L307 PolarHBondContact N-O 3.49Å; K285-L307 HydrophobicContact CB-CB 4.28Å; K285-L307 HydrophobicContact CB-CD2 4.5Å; K285-L307 PolarHBondContact N-O 3.36Å; K285-L307 PolarHBondContact O-N 2.76Å; L307-L313 HydrophobicContact CB-CD1 3.82Å; L307-L313 HydrophobicContact CD1-CB 4.48Å; L307-L313 HydrophobicContact CD1-CD1 4.12Å; L307-L333 HydrophobicContact CD1-CD1 3.38Å; L307-W434 HydrophobicContact CB-CZ3 4.21Å; L307-A437 HydrophobicContact CD2-CB 3.85Å; L307-I438 HydrophobicContact CD2-CG1 4.25Å; L307-Q441 HydrophobicContact CD1-CB 4.34Å; L307-Q441 HydrophobicContact CD1-CG 4.19Å; L307-Q441 HydrophobicContact CD2-CB 4.39Å
308	C	87.1	Confident	86.4	Confident	19 Å²	19	47.9 Å²	47.9	13%	0.128	24%	0.243	C	C	.	.			trans	-105.7	154.4	-178.5	-66.6	0	0	0	0	112.2	N310 G311 V312	C308-N310 WeakPolarHBondContact CB-OD1 3.08Å; C308-N310 PolarHBondContact O-N 3.28Å; C308-G311 PolarHBondContact O-N 3.39Å; C308-G311 VanDerWaalsContact O-N 3.09Å; C308-V312 PolarHBondContact N-O 2.9Å
309	S	81.2	Confident	87.1	Confident	77 Å²	77	44.1 Å²	44.1	54%	0.538	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-16.4	-177.2	50.7	0	0	0	0	115.1	G311 Q441	S309-G311 PolarHBondContact O-N 3.29Å; S309-Q441 PolarHBondContact O-NE2 3.45Å
310	N	79.4	Confident	87.3	Confident	93 Å²	93	42.9 Å²	42.9	50%	0.497	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.1	2.5	173.1	66.4	-13.8	0	0	0	113.9	C308 V312 Q334	C308-N310 WeakPolarHBondContact CB-OD1 3.08Å; C308-N310 PolarHBondContact O-N 3.28Å; N310-V312 PolarHBondContact OD1-N 2.96Å; N310-V312 VanDerWaalsContact OD1-N 3.17Å; N310-Q334 PolarHBondContact O-NE2 2.97Å
311	G	82.4	Confident	87.5	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	22%	0.22	C	C	.	.	S	Bend	trans	84	10.1	-177.9	0	0	0	0	0	114.9	C308 S309 L333	C308-G311 PolarHBondContact O-N 3.39Å; C308-G311 VanDerWaalsContact O-N 3.09Å; S309-G311 PolarHBondContact O-N 3.29Å; G311-L333 WeakPolarHBondContact O-CB 3.38Å; G311-L333 VanDerWaalsContact O-CG 3.3Å; G311-L333 WeakPolarHBondContact O-CG 3.3Å; G311-L333 PolarHBondContact O-N 3.4Å
312	V	87.8	Confident	87.2	Confident	29 Å²	29	35.7 Å²	35.7	18%	0.176	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	131.2	176.1	-176.8	0	0	0	0	110.7	C308 N310 E330	C308-V312 PolarHBondContact N-O 2.9Å; N310-V312 PolarHBondContact OD1-N 2.96Å; N310-V312 VanDerWaalsContact OD1-N 3.17Å; V312-E330 HydrophobicContact CG1-CB 3.89Å; V312-E330 HydrophobicContact CG1-CG 4.06Å
313	L	90.9	Very high	86.9	Confident	2 Å²	2	35.5 Å²	35.5	1%	0.01	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	110.1	168.9	-174.8	76	0	0	0	109.7	V305 L307 I331 L333 I413 W434 I438	V305-L313 HydrophobicContact CG1-CD1 3.66Å; V305-L313 HydrophobicContact CG1-CD2 4.44Å; V305-L313 HydrophobicContact CG1-CG 4.02Å; L307-L313 HydrophobicContact CB-CD1 3.82Å; L307-L313 HydrophobicContact CD1-CB 4.48Å; L307-L313 HydrophobicContact CD1-CD1 4.12Å; L313-I331 HydrophobicContact CB-CB 4.41Å; L313-I331 HydrophobicContact CD2-CD1 4.47Å; L313-I331 PolarHBondContact N-O 3.34Å; L313-I331 PolarHBondContact O-N 3.24Å; L313-L333 HydrophobicContact CB-CD1 4.1Å; L313-L333 HydrophobicContact CB-CD2 4.13Å; L313-L333 HydrophobicContact CB-CG 4.14Å; L313-I413 HydrophobicContact CD2-CD1 3.27Å; L313-W434 HydrophobicContact CD1-CZ3 4.12Å; L313-I438 HydrophobicContact CD2-CD1 4.12Å
314	T	91.1	Very high	86.3	Confident	5 Å²	5	41.3 Å²	41.3	3%	0.031	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	141.5	-178.1	-46.1	0	0	0	0	110.7	V305 T306 Y316 K328 K329 E330	V305-T314 CarbonylContact C-O 3.57Å; V305-T314 WeakPolarHBondContact CA-O 3.2Å; T306-T314 PolarHBondContact N-O 2.8Å; T306-T314 PolarHBondContact O-N 2.86Å; T306-T314 PolarHBondContact OG1-O 3.39Å; T314-Y316 HydrophobicContact CG2-CD2 4.18Å; T314-Y316 HydrophobicContact CG2-CE2 3.4Å; T314-K328 HydrophobicContact CG2-CB 3.83Å; T314-K328 HydrophobicContact CG2-CD 4.33Å; T314-K328 HydrophobicContact CG2-CG 4.48Å; T314-K329 CarbonylContact C-O 3.3Å; T314-K329 WeakPolarHBondContact CA-O 3.2Å; T314-E330 HydrophobicContact CG2-CG 3.65Å; T314-E330 PolarHBondContact OG1-OE1 3.47Å
315	Y	91.1	Very high	85.7	Confident	28 Å²	28	43.9 Å²	43.9	11%	0.11	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	143.5	172.5	69.4	-86.8	0	0	0	113.4	K291 K303 Y304 K329 I331 F423	K291-Y315 HydrophobicContact CD-CE2 4.4Å; K303-Y315 HydrophobicContact CG-CD2 4.28Å; Y304-Y315 CarbonylContact O-C 3.53Å; Y304-Y315 VanDerWaalsContact O-CA 3.28Å; Y304-Y315 WeakPolarHBondContact O-CA 3.36Å; Y315-K329 HydrophobicContact CD1-CB 4.09Å; Y315-K329 WeakPolarHBondContact CD1-O 3.28Å; Y315-K329 HydrophobicContact CD2-CB 4.31Å; Y315-K329 HydrophobicContact CE1-CB 3.67Å; Y315-K329 HydrophobicContact CE2-CB 3.91Å; Y315-K329 HydrophobicContact CE2-CD 4.19Å; Y315-K329 HydrophobicContact CE2-CG 4.43Å; Y315-K329 HydrophobicContact CG-CB 4.4Å; Y315-K329 PolarHBondContact N-O 2.94Å; Y315-K329 PolarHBondContact O-N 3.46Å; Y315-I331 HydrophobicContact CD1-CD1 4.14Å; Y315-I331 HydrophobicContact CD1-CG1 4.48Å; Y315-I331 HydrophobicContact CE1-CD1 3.93Å; Y315-I331 HydrophobicContact CE1-CG1 4.17Å; Y315-F423 HydrophobicContact CD1-CZ 4.35Å
316	Y	90.1	Very high	84.8	Confident	13 Å²	13	47.2 Å²	47.2	5%	0.051	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	156.3	-170.7	-63.5	-98.3	0	0	0	110.9	K303 Y304 T314 S318 D321 Y322 N325 K328	K303-Y316 WeakPolarHBondContact CA-O 3.38Å; K303-Y316 WeakPolarHBondContact CB-O 3.14Å; K303-Y316 WeakPolarHBondContact CD-O 3.47Å; Y304-Y316 PolarHBondContact N-O 2.87Å; Y304-Y316 PolarHBondContact O-N 3.22Å; T314-Y316 HydrophobicContact CG2-CD2 4.18Å; T314-Y316 HydrophobicContact CG2-CE2 3.4Å; Y316-S318 PolarHBondContact O-N 2.87Å; Y316-D321 HydrophobicContact CD1-CB 4.4Å; Y316-Y322 VanDerWaalsContact CD1-CA 3.48Å; Y316-Y322 AromaticContact CD2-CD2 3.95Å; Y316-Y322 HydrophobicContact CD2-CD2 3.95Å; Y316-Y322 HydrophobicContact CD2-CG 4.44Å; Y316-Y322 HydrophobicContact CE1-CD2 4.31Å; Y316-Y322 AromaticContact CE2-CD2 3.55Å; Y316-Y322 HydrophobicContact CE2-CD2 3.55Å; Y316-Y322 HydrophobicContact CE2-CE2 4.36Å; Y316-Y322 HydrophobicContact CE2-CG 4.44Å; Y316-Y322 AromaticContact CZ-CD2 3.75Å; Y316-N325 PolarHBondContact OH-OD1 3.38Å; Y316-N325 VanDerWaalsContact OH-OD1 3.11Å; Y316-K328 HydrophobicContact CD1-CB 3.92Å; Y316-K328 HydrophobicContact CE1-CB 3.38Å
317	S	86.7	Confident	84.1	Confident	61 Å²	61	53.9 Å²	53.9	43%	0.427	29%	0.293	S	S	.	.	S	Bend	trans	-69.9	-31.7	-177.1	-88.7	0	0	0	0	114.5	K303 D321	K303-S317 VanDerWaalsContact NZ-CA 3.31Å; K303-S317 PolarHBondContact NZ-O 2.81Å; K303-S317 PolarHBondContact NZ-OG 3.22Å; S317-D321 WeakPolarHBondContact CA-OD2 3.44Å; S317-D321 WeakPolarHBondContact CB-OD2 3.43Å
318	S	85.3	Confident	83.9	Confident	45 Å²	45	58.1 Å²	58.1	32%	0.315	31%	0.311	S	S	.	.	S	Bend	trans	-150	172.8	176.6	67.6	0	0	0	0	110.1	Y316 G320 D321 Y322	Y316-S318 PolarHBondContact O-N 2.87Å; S318-G320 PolarHBondContact O-N 3.37Å; S318-G320 PolarHBondContact OG-N 2.93Å; S318-D321 WeakPolarHBondContact CB-OD2 3.19Å; S318-D321 PolarHBondContact N-OD2 3.39Å; S318-D321 PolarHBondContact O-N 3.41Å; S318-D321 VanDerWaalsContact OG-CG 3.29Å; S318-D321 PolarHBondContact OG-N 2.87Å; S318-D321 PolarHBondContact OG-OD2 2.81Å; S318-Y322 PolarHBondContact O-N 3.32Å
319	L	83.3	Confident	84	Confident	85 Å²	85	63.2 Å²	63.2	45%	0.445	33%	0.331	S	S	.	.	H	α-helix	trans	-64.2	-31.8	168.7	-179.2	64.2	0	0	0	111.7	Y304 Y322 M323	Y304-L319 HydrophobicContact CD1-CD1 4.34Å; Y304-L319 HydrophobicContact CD2-CD1 3.87Å; Y304-L319 HydrophobicContact CE1-CD1 4.07Å; Y304-L319 HydrophobicContact CE2-CD1 3.6Å; Y304-L319 HydrophobicContact CG-CD1 4.22Å; L319-Y322 HydrophobicContact CD1-CD1 3.97Å; L319-Y322 WeakPolarHBondContact O-CB 3.39Å; L319-Y322 PolarHBondContact O-N 3.29Å; L319-M323 HydrophobicContact CG-SD 4.34Å; L319-M323 WeakPolarHBondContact O-CG 3.29Å; L319-M323 PolarHBondContact O-N 2.77Å
320	G	83.2	Confident	84.3	Confident	37 Å²	37	64.4 Å²	64.4	38%	0.381	33%	0.328	S	S	.	.	H	α-helix	trans	-66.6	-39	175.5	0	0	0	0	0	112.9	S318 Y322 M323 K324	S318-G320 PolarHBondContact O-N 3.37Å; S318-G320 PolarHBondContact OG-N 2.93Å; G320-Y322 VanDerWaalsContact C-N 3.34Å; G320-M323 PolarHBondContact O-N 2.96Å; G320-K324 WeakPolarHBondContact O-CB 3.43Å; G320-K324 WeakPolarHBondContact O-CG 3.44Å; G320-K324 PolarHBondContact O-N 2.8Å
321	D	84.9	Confident	84.7	Confident	26 Å²	26	60.1 Å²	60.1	14%	0.139	31%	0.305	C	S	.	.	H	α-helix	trans	-63	-41.2	172.9	-64	-67.8	0	0	0	111.2	Y316 S317 S318 K324 N325 I326 H327	Y316-D321 HydrophobicContact CD1-CB 4.4Å; S317-D321 WeakPolarHBondContact CA-OD2 3.44Å; S317-D321 WeakPolarHBondContact CB-OD2 3.43Å; S318-D321 WeakPolarHBondContact CB-OD2 3.19Å; S318-D321 PolarHBondContact N-OD2 3.39Å; S318-D321 PolarHBondContact O-N 3.41Å; S318-D321 VanDerWaalsContact OG-CG 3.29Å; S318-D321 PolarHBondContact OG-N 2.87Å; S318-D321 PolarHBondContact OG-OD2 2.81Å; D321-K324 CarbonylContact O-C 3.55Å; D321-K324 PolarHBondContact O-N 2.69Å; D321-N325 WeakPolarHBondContact O-CA 3.43Å; D321-N325 PolarHBondContact O-N 2.99Å; D321-I326 HydrophobicContact CB-CG1 4.18Å; D321-I326 PolarHBondContact O-N 3.3Å; D321-H327 IonicContact OD1-ND1 3.21Å
322	Y	82.6	Confident	84.9	Confident	36 Å²	36	62.8 Å²	62.8	14%	0.141	32%	0.319	C	S	.	.	H	α-helix	trans	-60.1	-53.1	171.1	169.7	-108.5	0	0	0	111.1	R280 Y304 T306 Y316 S318 L319 G320 K324 N325	R280-Y322 PolarHBondContact NH1-O 3.44Å; Y304-Y322 AromaticContact CD1-CD1 3.94Å; Y304-Y322 HydrophobicContact CD1-CD1 3.94Å; Y304-Y322 HydrophobicContact CD1-CD2 4.1Å; Y304-Y322 AromaticContact CD1-CG 3.62Å; Y304-Y322 HydrophobicContact CD1-CG 3.62Å; Y304-Y322 AromaticContact CE1-CD1 3.45Å; Y304-Y322 HydrophobicContact CE1-CD1 3.45Å; Y304-Y322 VanDerWaalsContact CE1-CD1 3.45Å; Y304-Y322 HydrophobicContact CE1-CD2 4Å; Y304-Y322 AromaticContact CE1-CE1 3.77Å; Y304-Y322 HydrophobicContact CE1-CE1 3.77Å; Y304-Y322 HydrophobicContact CE1-CE2 4.29Å; Y304-Y322 AromaticContact CE1-CG 3.57Å; Y304-Y322 HydrophobicContact CE1-CG 3.57Å; T306-Y322 HydrophobicContact CG2-CD2 4.1Å; T306-Y322 HydrophobicContact CG2-CE2 3.74Å; Y316-Y322 VanDerWaalsContact CD1-CA 3.48Å; Y316-Y322 AromaticContact CD2-CD2 3.95Å; Y316-Y322 HydrophobicContact CD2-CD2 3.95Å; Y316-Y322 HydrophobicContact CD2-CG 4.44Å; Y316-Y322 HydrophobicContact CE1-CD2 4.31Å; Y316-Y322 AromaticContact CE2-CD2 3.55Å; Y316-Y322 HydrophobicContact CE2-CD2 3.55Å; Y316-Y322 HydrophobicContact CE2-CE2 4.36Å; Y316-Y322 HydrophobicContact CE2-CG 4.44Å; Y316-Y322 AromaticContact CZ-CD2 3.75Å; S318-Y322 PolarHBondContact O-N 3.32Å; L319-Y322 HydrophobicContact CD1-CD1 3.97Å; L319-Y322 WeakPolarHBondContact O-CB 3.39Å; L319-Y322 PolarHBondContact O-N 3.29Å; G320-Y322 VanDerWaalsContact C-N 3.34Å; Y322-K324 PolarHBondContact O-N 3.36Å; Y322-K324 VanDerWaalsContact O-N 3.13Å; Y322-N325 PolarHBondContact O-N 3.3Å
323	M	82.5	Confident	84.8	Confident	124 Å²	124	61.5 Å²	61.5	61%	0.611	31%	0.311	S	S	*	.	H	α-helix	trans	-59.4	-26.5	179.8	-71.9	-178.3	75.3	0	0	113.4	R280 L319 G320	R280-M323 PolarHBondContact NH1-O 2.87Å; R280-M323 PolarHBondContact NH2-O 3.24Å; L319-M323 HydrophobicContact CG-SD 4.34Å; L319-M323 WeakPolarHBondContact O-CG 3.29Å; L319-M323 PolarHBondContact O-N 2.77Å; G320-M323 PolarHBondContact O-N 2.96Å
324	K	79.4	Confident	84.2	Confident	157 Å²	157	67 Å²	67	68%	0.683	34%	0.337	S	S	*	.	H	α-helix	trans	-95.8	-3.8	173.5	-65.3	-177.8	-179.8	-172.6	0	114.6	G320 D321 Y322 I326	G320-K324 WeakPolarHBondContact O-CB 3.43Å; G320-K324 WeakPolarHBondContact O-CG 3.44Å; G320-K324 PolarHBondContact O-N 2.8Å; D321-K324 CarbonylContact O-C 3.55Å; D321-K324 PolarHBondContact O-N 2.69Å; Y322-K324 PolarHBondContact O-N 3.36Å; Y322-K324 VanDerWaalsContact O-N 3.13Å; K324-I326 HydrophobicContact CB-CD1 4.05Å; K324-I326 HydrophobicContact CB-CG1 3.98Å; K324-I326 HydrophobicContact CB-CG2 4.29Å; K324-I326 HydrophobicContact CD-CD1 4.3Å; K324-I326 PolarHBondContact O-N 3.23Å
325	N	78	Confident	83.5	Confident	81 Å²	81	70.5 Å²	70.5	43%	0.433	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.2	28.8	-173.8	-162.1	33.8	0	0	0	115.1	Y316 D321 Y322	Y316-N325 PolarHBondContact OH-OD1 3.38Å; Y316-N325 VanDerWaalsContact OH-OD1 3.11Å; D321-N325 WeakPolarHBondContact O-CA 3.43Å; D321-N325 PolarHBondContact O-N 2.99Å; Y322-N325 PolarHBondContact O-N 3.3Å
326	I	72.1	Confident	83.1	Confident	71 Å²	71	69.5 Å²	69.5	36%	0.364	36%	0.356	S	S	.	.			trans	-99.4	155	-178.9	59.8	-179.6	0	0	0	111.6	D321 K324 K328	D321-I326 HydrophobicContact CB-CG1 4.18Å; D321-I326 PolarHBondContact O-N 3.3Å; K324-I326 HydrophobicContact CB-CD1 4.05Å; K324-I326 HydrophobicContact CB-CG1 3.98Å; K324-I326 HydrophobicContact CB-CG2 4.29Å; K324-I326 HydrophobicContact CD-CD1 4.3Å; K324-I326 PolarHBondContact O-N 3.23Å; I326-K328 PolarHBondContact O-N 3.43Å
327	H	77.9	Confident	82.9	Confident	143 Å²	143	72.5 Å²	72.5	66%	0.662	38%	0.375	S	S	*	.	S	Bend	trans	53.4	25.9	175.4	-54.1	118.8	0	0	0	115.7	D321	D321-H327 IonicContact OD1-ND1 3.21Å
328	K	84.9	Confident	82.9	Confident	88 Å²	88	70.8 Å²	70.8	38%	0.383	36%	0.361	S	S	.	.			trans	-62.9	149.2	178.4	74.6	172.8	-174.7	154.3	0	111.8	T314 Y316 I326 E330	T314-K328 HydrophobicContact CG2-CB 3.83Å; T314-K328 HydrophobicContact CG2-CD 4.33Å; T314-K328 HydrophobicContact CG2-CG 4.48Å; Y316-K328 HydrophobicContact CD1-CB 3.92Å; Y316-K328 HydrophobicContact CE1-CB 3.38Å; I326-K328 PolarHBondContact O-N 3.43Å; K328-E330 HydrophobicContact CD-CG 4.4Å; K328-E330 WeakPolarHBondContact CE-OE1 3.42Å; K328-E330 WeakPolarHBondContact CE-OE2 3.33Å; K328-E330 IonicContact NZ-OE1 2.78Å; K328-E330 PolarHBondContact NZ-OE1 3.4Å; K328-E330 IonicContact NZ-OE2 1.86Å; K328-E330 PolarHBondContact NZ-OE2 2.99Å
329	K	88.2	Confident	82.9	Confident	127 Å²	127	73.7 Å²	73.7	55%	0.552	37%	0.368	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-132.9	129.5	169.7	-65.9	-160.8	174	-149.5	0	110.2	T314 Y315	T314-K329 CarbonylContact C-O 3.3Å; T314-K329 WeakPolarHBondContact CA-O 3.2Å; Y315-K329 HydrophobicContact CD1-CB 4.09Å; Y315-K329 WeakPolarHBondContact CD1-O 3.28Å; Y315-K329 HydrophobicContact CD2-CB 4.31Å; Y315-K329 HydrophobicContact CE1-CB 3.67Å; Y315-K329 HydrophobicContact CE2-CB 3.91Å; Y315-K329 HydrophobicContact CE2-CD 4.19Å; Y315-K329 HydrophobicContact CE2-CG 4.43Å; Y315-K329 HydrophobicContact CG-CB 4.4Å; Y315-K329 PolarHBondContact N-O 2.94Å; Y315-K329 PolarHBondContact O-N 3.46Å
330	E	89.6	Confident	82.8	Confident	101 Å²	101	70.5 Å²	70.5	47%	0.472	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	146.3	-169.1	-66.4	-177.7	142.4	0	0	110.5	V312 T314 K328	V312-E330 HydrophobicContact CG1-CB 3.89Å; V312-E330 HydrophobicContact CG1-CG 4.06Å; T314-E330 HydrophobicContact CG2-CG 3.65Å; T314-E330 PolarHBondContact OG1-OE1 3.47Å; K328-E330 HydrophobicContact CD-CG 4.4Å; K328-E330 WeakPolarHBondContact CE-OE1 3.42Å; K328-E330 WeakPolarHBondContact CE-OE2 3.33Å; K328-E330 IonicContact NZ-OE1 2.78Å; K328-E330 PolarHBondContact NZ-OE1 3.4Å; K328-E330 IonicContact NZ-OE2 1.86Å; K328-E330 PolarHBondContact NZ-OE2 2.99Å
331	I	87.6	Confident	82.3	Confident	4 Å²	4	70.9 Å²	70.9	2%	0.021	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	116.4	176.1	-56.2	170.9	0	0	0	105.9	L313 Y315 L333 I413 W421 F423	L313-I331 HydrophobicContact CB-CB 4.41Å; L313-I331 HydrophobicContact CD2-CD1 4.47Å; L313-I331 PolarHBondContact N-O 3.34Å; L313-I331 PolarHBondContact O-N 3.24Å; Y315-I331 HydrophobicContact CD1-CD1 4.14Å; Y315-I331 HydrophobicContact CD1-CG1 4.48Å; Y315-I331 HydrophobicContact CE1-CD1 3.93Å; Y315-I331 HydrophobicContact CE1-CG1 4.17Å; I331-L333 HydrophobicContact CG2-CD2 4.41Å; I331-I413 HydrophobicContact CG2-CG2 4.16Å; I331-W421 HydrophobicContact CD1-CB 4.07Å; I331-W421 HydrophobicContact CD1-CD2 3.67Å; I331-W421 HydrophobicContact CD1-CE3 4.22Å; I331-W421 HydrophobicContact CD1-CG 3.57Å; I331-W421 HydrophobicContact CG1-CD2 4.06Å; I331-W421 HydrophobicContact CG1-CG 4.37Å; I331-W421 HydrophobicContact CG1-CZ2 4.21Å; I331-W421 HydrophobicContact CG2-CD2 4.39Å; I331-W421 HydrophobicContact CG2-CE3 4.01Å; I331-W421 HydrophobicContact CG2-CH2 4.06Å; I331-W421 HydrophobicContact CG2-CZ2 4.42Å; I331-W421 HydrophobicContact CG2-CZ3 3.83Å; I331-F423 HydrophobicContact CD1-CE2 4.15Å; I331-F423 HydrophobicContact CD1-CZ 4.14Å
332	D	85.5	Confident	81.2	Confident	56 Å²	56	72.6 Å²	72.6	30%	0.299	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	128.1	168	167.5	48.2	0	0	0	109.8	Q334 T335 S336	D332-Q334 VanDerWaalsContact OD1-CB 3.28Å; D332-Q334 WeakPolarHBondContact OD1-CB 3.41Å; D332-Q334 WeakPolarHBondContact OD1-CG 3.47Å; D332-Q334 PolarHBondContact OD1-N 3.26Å; D332-T335 WeakPolarHBondContact OD2-CB 3.31Å; D332-T335 WeakPolarHBondContact OD2-CG2 3.4Å; D332-T335 PolarHBondContact OD2-N 3.1Å; D332-T335 PolarHBondContact OD2-OG1 3.3Å; D332-S336 WeakPolarHBondContact O-CB 3.44Å; D332-S336 PolarHBondContact O-OG 3.37Å
333	L	85.4	Confident	80	Confident	1 Å²	1	76.4 Å²	76.4	1%	0.005	39%	0.389	C	S	.	.	S	Bend	trans	-92.8	-18.4	174.2	-57.4	177.6	0	0	0	113.5	L307 G311 L313 I331 T335 S336 I413 I438 I442	L307-L333 HydrophobicContact CD1-CD1 3.38Å; G311-L333 WeakPolarHBondContact O-CB 3.38Å; G311-L333 VanDerWaalsContact O-CG 3.3Å; G311-L333 WeakPolarHBondContact O-CG 3.3Å; G311-L333 PolarHBondContact O-N 3.4Å; L313-L333 HydrophobicContact CB-CD1 4.1Å; L313-L333 HydrophobicContact CB-CD2 4.13Å; L313-L333 HydrophobicContact CB-CG 4.14Å; I331-L333 HydrophobicContact CG2-CD2 4.41Å; L333-T335 PolarHBondContact O-N 3.3Å; L333-S336 PolarHBondContact O-N 3.47Å; L333-I413 HydrophobicContact CD2-CD1 4.28Å; L333-I413 HydrophobicContact CD2-CG2 4.25Å; L333-I438 HydrophobicContact CD1-CG1 4.48Å; L333-I438 HydrophobicContact CD1-CG2 4.07Å; L333-I438 HydrophobicContact CD2-CG2 4.15Å; L333-I442 HydrophobicContact CB-CG1 3.93Å
334	Q	78.6	Confident	77.7	Confident	119 Å²	119	81.9 Å²	81.9	56%	0.556	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-35.7	-179.4	-57.6	-178.8	20.8	0	0	111.2	N310 D332	N310-Q334 PolarHBondContact O-NE2 2.97Å; D332-Q334 VanDerWaalsContact OD1-CB 3.28Å; D332-Q334 WeakPolarHBondContact OD1-CB 3.41Å; D332-Q334 WeakPolarHBondContact OD1-CG 3.47Å; D332-Q334 PolarHBondContact OD1-N 3.26Å
335	T	76.5	Confident	75.6	Confident	78 Å²	78	80 Å²	80	48%	0.479	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103	14	175.9	64.1	0	0	0	0	114.4	D332 L333 A416	D332-T335 WeakPolarHBondContact OD2-CB 3.31Å; D332-T335 WeakPolarHBondContact OD2-CG2 3.4Å; D332-T335 PolarHBondContact OD2-N 3.1Å; D332-T335 PolarHBondContact OD2-OG1 3.3Å; L333-T335 PolarHBondContact O-N 3.3Å; T335-A416 WeakPolarHBondContact O-CB 3.46Å; T335-A416 PolarHBondContact O-N 3.05Å
336	S	83.1	Confident	73.5	Confident	7 Å²	7	81.6 Å²	81.6	5%	0.049	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	146.9	-175.6	-64.4	0	0	0	0	114.6	D332 L333 V414 S415 I442	D332-S336 WeakPolarHBondContact O-CB 3.44Å; D332-S336 PolarHBondContact O-OG 3.37Å; L333-S336 PolarHBondContact O-N 3.47Å; S336-V414 CarbonylContact C-O 3.58Å; S336-V414 WeakPolarHBondContact CA-O 3.04Å; S336-S415 WeakPolarHBondContact OG-CA 3.37Å; S336-I442 WeakPolarHBondContact O-CD1 3.25Å
337	T	84.8	Confident	71.5	Confident	75 Å²	75	86.1 Å²	86.1	46%	0.46	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	148.2	173.7	62.2	0	0	0	0	111.1	I413 V414	T337-I413 CarbonylContact O-C 3.6Å; T337-I413 WeakPolarHBondContact O-CA 3.29Å; T337-V414 PolarHBondContact N-O 2.72Å; T337-V414 PolarHBondContact O-N 3.01Å; T337-V414 PolarHBondContact OG1-O 3.3Å
338	I	87.3	Confident	69.2	Low	25 Å²	25	84 Å²	84	13%	0.128	46%	0.455	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	133	177.4	-173.1	162.9	0	0	0	111.1	F411 M412 V435 I438 Q439	I338-F411 HydrophobicContact CD1-CD2 3.61Å; I338-F411 HydrophobicContact CD1-CE2 4.01Å; I338-F411 HydrophobicContact CD1-CG 4.46Å; I338-F411 HydrophobicContact CG1-CD2 4.12Å; I338-M412 CarbonylContact C-O 3.58Å; I338-M412 WeakPolarHBondContact CA-O 3.47Å; I338-V435 HydrophobicContact CD1-CB 4.22Å; I338-V435 HydrophobicContact CD1-CG1 4.22Å; I338-V435 HydrophobicContact CD1-CG2 3.97Å; I338-I438 HydrophobicContact CB-CG2 4.3Å; I338-I438 HydrophobicContact CD1-CB 3.96Å; I338-I438 HydrophobicContact CD1-CD1 3.9Å; I338-I438 HydrophobicContact CD1-CG2 3.77Å; I338-I438 HydrophobicContact CG2-CG2 4.36Å; I338-Q439 HydrophobicContact CG2-CG 3.49Å; I338-Q439 VanDerWaalsContact CG2-CG 3.49Å
339	K	85.8	Confident	66.3	Low	106 Å²	106	85.8 Å²	85.8	46%	0.461	47%	0.474	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	124.5	-173.8	-60.4	-177.5	-175.3	177.5	0	110.1	M412 V414	K339-M412 HydrophobicContact CB-CE 4.17Å; K339-M412 PolarHBondContact N-O 3.2Å; K339-M412 PolarHBondContact O-N 2.83Å; K339-V414 HydrophobicContact CD-CG2 4.01Å; K339-V414 HydrophobicContact CG-CG2 4.49Å
340	V	82.1	Confident	63.5	Low	18 Å²	18	84.8 Å²	84.8	11%	0.109	48%	0.483	C	S	.	.			trans	-103.3	116.1	175.5	-179.7	0	0	0	0	108.9	G342 K343 F411 V435	V340-G342 PolarHBondContact O-N 2.78Å; V340-K343 HydrophobicContact CG1-CD 4.48Å; V340-K343 PolarHBondContact O-N 2.81Å; V340-F411 HydrophobicContact CG2-CB 4.25Å; V340-V435 HydrophobicContact CG2-CB 4.47Å; V340-V435 HydrophobicContact CG2-CG1 3.99Å; V340-V435 HydrophobicContact CG2-CG2 3.67Å
341	P	72.4	Confident	60.4	Low	46 Å²	46	84 Å²	84	30%	0.299	49%	0.494	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54	122.6	179.5	-28.7	37.8	0	0	0	112.5	N410 M412	P341-N410 WeakPolarHBondContact CD-O 3.48Å; P341-N410 WeakPolarHBondContact CG-OD1 3.39Å; P341-M412 HydrophobicContact CG-CE 4.21Å; P341-M412 HydrophobicContact CG-SD 4.32Å
342	G	61	Low	57.5	Low	62 Å²	62	89.5 Å²	89.5	64%	0.639	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	96.4	-13	177.8	0	0	0	0	0	116.4	V340	V340-G342 PolarHBondContact O-N 2.78Å
343	K	56.7	Low	54.7	Low	115 Å²	115	92.7 Å²	92.7	50%	0.5	55%	0.553	S	S	.	*	P	Polyproline II helix	trans	-90.7	129.1	163	-75.1	179.4	179.6	171.1	0	108.6	V340 D432	V340-K343 HydrophobicContact CG1-CD 4.48Å; V340-K343 PolarHBondContact O-N 2.81Å; K343-D432 IonicContact NZ-OD1 2.66Å; K343-D432 IonicContact NZ-OD2 3.26Å; K343-D432 PolarHBondContact NZ-OD2 3Å
344	W	34.6	Very low	52	Low	240 Å²	240	98.7 Å²	98.7	91%	0.909	59%	0.591	S	S	*	*	P	Polyproline II helix	trans	-76.4	152.8	164.3	-75.9	86.7	0	0	0	109.4	S346	W344-S346 PolarHBondContact O-N 3.48Å
345	P	34.8	Very low	49.6	Very low	116 Å²	116	100.4 Å²	100.4	75%	0.753	60%	0.603	S	S	*	*	P	Polyproline II helix	trans	-59.7	131.6	167.5	-19.4	32.5	0	0	0	110.1	L347	P345-L347 PolarHBondContact O-N 2.95Å
346	S	34.3	Very low	47.1	Very low	115 Å²	115	102.2 Å²	102.2	80%	0.804	62%	0.619	S	S	*	*			trans	-69.7	114.9	170.3	47.5	0	0	0	0	109.2	W344 A348	W344-S346 PolarHBondContact O-N 3.48Å; S346-A348 PolarHBondContact O-N 3.32Å
347	L	30.8	Very low	44.5	Very low	167 Å²	167	108 Å²	108	87%	0.874	65%	0.654	S	S	*	*			trans	-64.5	124.5	176.1	-152.6	77.4	0	0	0	109.1	P345 T349	P345-L347 PolarHBondContact O-N 2.95Å; L347-T349 PolarHBondContact O-N 3.46Å
348	A	29.1	Very low	41.9	Very low	97 Å²	97	110.1 Å²	110.1	80%	0.802	67%	0.672	S	S	*	*			trans	-79.1	98.7	178.9	0	0	0	0	0	109.9	S346 S350	S346-A348 PolarHBondContact O-N 3.32Å; A348-S350 PolarHBondContact O-N 2.7Å; A348-S350 VanDerWaalsContact O-N 3.13Å
349	T	25.2	Very low	39	Very low	127 Å²	127	118.3 Å²	118.3	78%	0.779	71%	0.707	S	S	*	*			trans	-66.6	107.9	168.1	-56.9	0	0	0	0	108.8	L347 A351	L347-T349 PolarHBondContact O-N 3.46Å; T349-A351 PolarHBondContact O-N 2.97Å; T349-A351 VanDerWaalsContact O-N 3.13Å
350	S	28.7	Very low	36.3	Very low	106 Å²	106	119 Å²	119	74%	0.741	73%	0.725	S	S	*	*			trans	-67.7	108.6	172.6	-169.9	0	0	0	0	109.6	A348	A348-S350 PolarHBondContact O-N 2.7Å; A348-S350 VanDerWaalsContact O-N 3.13Å
351	A	24.7	Very low	33.8	Very low	85 Å²	85	125.8 Å²	125.8	70%	0.702	76%	0.761	S	S	*	*			trans	-90.2	100.2	174.8	0	0	0	0	0	109.3	T349 T353	T349-A351 PolarHBondContact O-N 2.97Å; T349-A351 VanDerWaalsContact O-N 3.13Å; A351-T353 PolarHBondContact O-N 3.31Å
352	C	25.3	Very low	31.6	Very low	118 Å²	118	127.3 Å²	127.3	80%	0.797	78%	0.784	S	S	*	*			trans	-68.1	100.2	174.8	-63.3	0	0	0	0	110.4
353	T	27.2	Very low	30	Very low	124 Å²	124	132.6 Å²	132.6	76%	0.761	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-70.4	126.3	166.3	47.2	0	0	0	0	109.6	A351	A351-T353 PolarHBondContact O-N 3.31Å
354	P	28.6	Very low	28.6	Very low	126 Å²	126	132.3 Å²	132.3	82%	0.818	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-69.4	139.5	179.7	28.7	-34.3	0	0	0	111.2	S356	P354-S356 PolarHBondContact O-N 2.81Å
355	I	28.4	Very low	28.4	Very low	156 Å²	156	128.9 Å²	128.9	80%	0.8	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-74.7	123	174.6	-66.5	169.3	0	0	0	108.9	T357	I355-T357 PolarHBondContact O-N 3.29Å
356	S	25	Very low	28	Very low	115 Å²	115	128.8 Å²	128.8	80%	0.804	79%	0.794	S	S	*	*			trans	-77.6	107.4	173.1	55	0	0	0	0	110.8	P354	P354-S356 PolarHBondContact O-N 2.81Å
357	T	27.6	Very low	27.8	Very low	128 Å²	128	130.6 Å²	130.6	79%	0.785	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-84.1	120.3	170.9	44.3	0	0	0	0	110.7	I355	I355-T357 PolarHBondContact O-N 3.29Å
358	S	29.5	Very low	27.6	Very low	121 Å²	121	128.8 Å²	128.8	85%	0.846	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-76.9	131.8	175.7	42.8	0	0	0	0	111.1
359	K	28.1	Very low	27.6	Very low	196 Å²	196	130.3 Å²	130.3	85%	0.852	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-82.2	144.5	174.7	-68.6	-178.9	176.1	-177.7	0	111.8
360	S	28.6	Very low	27.6	Very low	120 Å²	120	127.7 Å²	127.7	84%	0.839	78%	0.781	S	S	*	*			trans	-135.1	166.6	145.9	57.4	0	0	0	0	108.6
361	N	29.4	Very low	27.5	Very low	162 Å²	162	131.2 Å²	131.2	87%	0.866	79%	0.79	S	S	*	*			trans	-110.8	154.3	-150.6	-61.8	-34.6	0	0	0	115.5
362	G	25.7	Very low	27.7	Very low	77 Å²	77	130.8 Å²	130.8	79%	0.794	79%	0.794	S	S	*	*			trans	145.9	144.6	159.4	0	0	0	0	0	114.8
363	L	27.1	Very low	27.8	Very low	174 Å²	174	132.5 Å²	132.5	91%	0.911	80%	0.795	S	S	*	*				-170.1	92.6	-59.1	169	60.4	0	0	0	109.7
364	S	28.1	Very low	27.8	Very low	108 Å²	108	132.4 Å²	132.4	76%	0.755	80%	0.8	S	S	*	*			trans	-175.9	139.6	160.5	49.1	0	0	0	0	107.6
365	K	30.4	Very low	27.7	Very low	169 Å²	169	133.9 Å²	133.9	74%	0.735	80%	0.799	S	S	*	*				61	125.8	58.2	-77.8	-166.7	138.7	-74.8	0	112.5
366	D	26.1	Very low	27.5	Very low	113 Å²	113	132.2 Å²	132.2	60%	0.604	80%	0.8	S	S	*	*			cis	-151.6	156.6	7.1	-94.2	-46.5	0	0	0	113.4
367	M	29.4	Very low	27.6	Very low	154 Å²	154	136.4 Å²	136.4	76%	0.759	80%	0.804	S	S	*	*			trans	57.2	157.1	146.5	-70	-136.5	61.7	0	0	125.1
368	D	28.1	Very low	27.7	Very low	128 Å²	128	135.4 Å²	135.4	68%	0.684	80%	0.802	S	S	*	*			trans	65	149.3	167.4	-74.4	-29.4	0	0	0	120.7
369	T	27.6	Very low	27.9	Very low	130 Å²	130	135.9 Å²	135.9	80%	0.798	80%	0.802	S	S	*	*			cis	145.8	127.6	-14.9	-81.3	0	0	0	0	105
370	G	26.2	Very low	27.9	Very low	72 Å²	72	132.2 Å²	132.2	74%	0.742	80%	0.801	S	S	*	*			trans	148.9	134	169.4	0	0	0	0	0	115.2
371	L	27.3	Very low	28.1	Very low	180 Å²	180	135 Å²	135	94%	0.942	81%	0.805	S	S	*	*			trans	-82.6	158.8	170	-75.6	63.8	0	0	0	110.2
372	G	28.9	Very low	28	Very low	76 Å²	76	132.8 Å²	132.8	78%	0.784	80%	0.802	S	S	*	*			trans	177.3	101.9	167.7	0	0	0	0	0	113.1
373	D	26.4	Very low	28.2	Very low	154 Å²	154	134.5 Å²	134.5	82%	0.824	80%	0.802	S	S	*	*			trans	-77.9	143.5	-179	-59.4	-79.2	0	0	0	113.7
374	S	27.2	Very low	28.2	Very low	122 Å²	122	132.2 Å²	132.2	85%	0.853	80%	0.795	S	S	*	*			trans	-170.5	138.4	131.9	-84.2	0	0	0	0	111.4
375	I	27	Very low	28.4	Very low	156 Å²	156	133.4 Å²	133.4	80%	0.8	80%	0.799	S	S	*	*			trans	-111.5	143.8	-177.3	-67.9	175.6	0	0	0	110.3
376	C	24.7	Very low	28.4	Very low	121 Å²	121	130.6 Å²	130.6	82%	0.818	80%	0.8	S	S	*	*			trans	-60.2	139	176.2	-52.8	0	0	0	0	112.6
377	F	26.3	Very low	29.4	Very low	203 Å²	203	130.5 Å²	130.5	89%	0.89	81%	0.805	S	S	*	*			trans	-93.8	135.2	164.5	-84.6	-83.4	0	0	0	111.7
378	S	29.2	Very low	29.3	Very low	108 Å²	108	131.8 Å²	131.8	76%	0.755	81%	0.807	S	S	*	*			trans	-139.9	127.4	158.9	-68.9	0	0	0	0	107
379	P	35.3	Very low	29.5	Very low	130 Å²	130	133.1 Å²	133.1	84%	0.844	81%	0.813	S	S	*	*			trans	-81.7	141.8	-169.2	30.5	-33.8	0	0	0	112.2
380	S	28.1	Very low	29.6	Very low	119 Å²	119	134.5 Å²	134.5	83%	0.832	82%	0.816	S	S	*	*			trans	-150.8	128.6	163.2	-78.3	0	0	0	0	111.1
381	I	31.2	Very low	30	Very low	180 Å²	180	137 Å²	137	92%	0.923	82%	0.819	S	S	*	*			trans	-37	147.2	178.5	47.2	176.5	0	0	0	116.8
382	S	27.1	Very low	30.4	Very low	114 Å²	114	133.8 Å²	133.8	80%	0.797	81%	0.809	S	S	*	*			trans	-96.7	144.2	-168.2	56.7	0	0	0	0	115.8
383	S	30.3	Very low	31.2	Very low	113 Å²	113	135.2 Å²	135.2	79%	0.79	80%	0.804	S	S	*	*			trans	-159.3	91.4	149.2	41.8	0	0	0	0	114.1
384	T	28.3	Very low	31.2	Very low	126 Å²	126	133 Å²	133	77%	0.773	80%	0.8	S	S	*	*			trans	31.9	143.3	142.7	43	0	0	0	0	124.2
385	T	31	Very low	31.8	Very low	134 Å²	134	131.5 Å²	131.5	82%	0.822	79%	0.788	S	S	*	*			trans	81.5	82.1	148.6	43.4	0	0	0	0	121.3
386	S	30.4	Very low	31.9	Very low	109 Å²	109	133 Å²	133	76%	0.762	79%	0.792	S	S	*	*			trans	-39.4	-177.8	145.3	-40.2	0	0	0	0	117
387	P	47.1	Very low	32.2	Very low	111 Å²	111	130.9 Å²	130.9	72%	0.721	78%	0.782	S	S	*	*			cis	-140.4	169.9	-42.5	33.3	-15.3	0	0	0	114.8
388	K	28.7	Very low	32.5	Very low	182 Å²	182	128.5 Å²	128.5	79%	0.791	78%	0.779	S	S	*	*				171.5	136.7	119.5	-97.4	176.4	175.5	177.6	0	115.9
389	L	30.8	Very low	33	Very low	156 Å²	156	133.2 Å²	133.2	82%	0.817	79%	0.786	S	S	*	*			trans	54.7	124.3	141.4	-61.3	167.3	0	0	0	121.6
390	N	29.9	Very low	32.9	Very low	158 Å²	158	136.4 Å²	136.4	85%	0.845	79%	0.786	S	S	*	*			trans	-77.5	161.1	166	-55.6	-48.2	0	0	0	111.8
391	P	34.2	Very low	33.2	Very low	124 Å²	124	140.3 Å²	140.3	81%	0.805	79%	0.788	S	S	*	*				-142	168.5	103.3	33.1	-16.4	0	0	0	115.8
392	P	37.1	Very low	33.8	Very low	114 Å²	114	140.5 Å²	140.5	74%	0.74	79%	0.785	S	S	*	*			trans	-101.7	-167.8	-178.4	41.7	-36	0	0	0	112.8
393	P	44.7	Very low	34.2	Very low	105 Å²	105	142.8 Å²	142.8	68%	0.682	79%	0.788	S	S	*	*			cis	-131.9	174.9	-44.4	33.1	-15.9	0	0	0	114.4
394	S	27.4	Very low	34.7	Very low	107 Å²	107	146.7 Å²	146.7	75%	0.748	79%	0.79	S	S	*	*			trans	69.8	178.3	152.8	84.8	0	0	0	0	117.9
395	P	39.6	Very low	35.3	Very low	92 Å²	92	148.8 Å²	148.8	60%	0.597	79%	0.789	S	S	*	*			cis	-130.2	168.4	-42.8	30.6	-12.7	0	0	0	114
396	H	29.2	Very low	35.8	Very low	188 Å²	188	152.3 Å²	152.3	87%	0.87	79%	0.793	S	S	*	*			trans	61.6	164.2	165.4	-58.8	-61.8	0	0	0	117.4
397	A	29.6	Very low	36.9	Very low	75 Å²	75	149.9 Å²	149.9	62%	0.62	78%	0.776	S	S	*	*			cis	-158.2	157.4	-39.3	0	0	0	0	0	110.6
398	N	33.9	Very low	37.8	Very low	153 Å²	153	147.7 Å²	147.7	82%	0.818	76%	0.76	S	S	*	*			trans	47.7	106	151.4	-64.2	-26.9	0	0	0	120.6
399	K	38.7	Very low	40.3	Very low	207 Å²	207	141.4 Å²	141.4	90%	0.9	74%	0.735	S	S	*	*			trans	-166.3	86.3	140.4	-109.7	157.6	-169.9	172.4	0	114.8
400	K	33.5	Very low	42.9	Very low	197 Å²	197	135.6 Å²	135.6	86%	0.857	71%	0.705	S	S	*	*			trans	176.1	96.9	142.8	-95.7	150.1	-171.7	175.3	0	108.8
401	K	35.4	Very low	45.8	Very low	201 Å²	201	128.1 Å²	128.1	87%	0.874	67%	0.665	S	S	*	*				81.3	110.9	92.5	-84.4	-171.1	173.6	-173.4	0	112.8	L403	K401-L403 PolarHBondContact O-N 3.03Å
402	H	42.5	Very low	48.4	Very low	184 Å²	184	124.6 Å²	124.6	85%	0.852	64%	0.638	S	S	*	*			trans	-51.8	126.7	166.6	-86	-101.5	0	0	0	111.3
403	L	35.5	Very low	50.9	Low	163 Å²	163	119.1 Å²	119.1	85%	0.853	60%	0.603	S	S	*	*			trans	-113.5	90.1	153.5	-169	69.5	0	0	0	107.5	K401 K405	K401-L403 PolarHBondContact O-N 3.03Å; L403-K405 VanDerWaalsContact C-N 3.27Å; L403-K405 PolarHBondContact O-N 2.81Å
404	K	40.8	Very low	52.9	Low	195 Å²	195	115.2 Å²	115.2	85%	0.848	58%	0.577	S	S	*	*			trans	-72.9	81.1	-173.6	-162.4	174.2	-175.3	178.7	0	110.2	K406	K404-K406 PolarHBondContact O-N 2.97Å
405	K	41.4	Very low	55.7	Low	170 Å²	170	110.8 Å²	110.8	74%	0.739	55%	0.546	S	S	*	.			trans	-53.8	122.7	-178	-152.7	172	-170.7	175	0	109.7	L403 S407	L403-K405 VanDerWaalsContact C-N 3.27Å; L403-K405 PolarHBondContact O-N 2.81Å; K405-S407 PolarHBondContact O-N 2.81Å; K405-S407 VanDerWaalsContact O-N 3.07Å
406	K	40.9	Very low	57.4	Low	208 Å²	208	110.7 Å²	110.7	90%	0.904	55%	0.553	S	S	*	*			trans	-59.3	112.8	180	-75.8	-175.6	175.5	-178.9	0	109.7	K404	K404-K406 PolarHBondContact O-N 2.97Å
407	S	53.4	Low	59.8	Low	58 Å²	58	106.5 Å²	106.5	41%	0.406	54%	0.541	S	S	.	.			trans	-79.8	126	171.5	55.8	0	0	0	0	110	K405 Y428	K405-S407 PolarHBondContact O-N 2.81Å; K405-S407 VanDerWaalsContact O-N 3.07Å; S407-Y428 WeakPolarHBondContact OG-CD2 3.32Å; S407-Y428 VanDerWaalsContact OG-CE2 3.3Å; S407-Y428 WeakPolarHBondContact OG-CE2 3.31Å
408	T	66.8	Low	62.1	Low	64 Å²	64	105.4 Å²	105.4	39%	0.393	54%	0.537	S	S	.	.			trans	-76.9	150.3	175.3	43.1	0	0	0	0	111.5	N410 R431	T408-N410 VanDerWaalsContact CB-OD1 3.29Å; T408-N410 WeakPolarHBondContact CB-OD1 3.43Å; T408-N410 PolarHBondContact O-N 3.46Å; T408-N410 PolarHBondContact OG1-OD1 3.03Å; T408-R431 PolarHBondContact O-NH1 3.32Å
409	N	80.9	Confident	64.5	Low	51 Å²	51	103.6 Å²	103.6	27%	0.273	52%	0.523	S	S	.	.	S	Bend	trans	-75.2	17.4	-178.7	-69.2	4.5	0	0	0	113.4	E424 A425 T426	N409-E424 HydrophobicContact CB-CG 4.34Å; N409-A425 PolarHBondContact O-N 2.68Å; N409-T426 PolarHBondContact ND2-O 2.96Å
410	N	86.1	Confident	66.8	Low	33 Å²	33	97.3 Å²	97.3	18%	0.176	50%	0.502	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	155.3	-172.2	59.5	29.2	0	0	0	113.3	W300 P341 T408 F423 E424 R431	W300-N410 HydrophobicContact CH2-CB 4.49Å; P341-N410 WeakPolarHBondContact CD-O 3.48Å; P341-N410 WeakPolarHBondContact CG-OD1 3.39Å; T408-N410 VanDerWaalsContact CB-OD1 3.29Å; T408-N410 WeakPolarHBondContact CB-OD1 3.43Å; T408-N410 PolarHBondContact O-N 3.46Å; T408-N410 PolarHBondContact OG1-OD1 3.03Å; N410-F423 CarbonylContact C-O 3.45Å; N410-F423 WeakPolarHBondContact CA-O 3.38Å; N410-F423 VanDerWaalsContact CB-O 3.26Å; N410-F423 WeakPolarHBondContact CB-O 3.26Å; N410-E424 HydrophobicContact CB-CB 3.98Å; N410-E424 HydrophobicContact CB-CG 4.26Å; N410-R431 WeakPolarHBondContact O-CD 3.26Å
411	F	89.9	Confident	69.5	Low	1 Å²	1	89.4 Å²	89.4	0%	0.004	47%	0.467	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	164.9	175.8	67.6	-85.6	0	0	0	109.8	L289 I338 V340 I413 F423 R431 W434 V435 I438	L289-F411 HydrophobicContact CD1-CE1 4.07Å; L289-F411 HydrophobicContact CD1-CZ 3.76Å; L289-F411 HydrophobicContact CD2-CE1 4.43Å; I338-F411 HydrophobicContact CD1-CD2 3.61Å; I338-F411 HydrophobicContact CD1-CE2 4.01Å; I338-F411 HydrophobicContact CD1-CG 4.46Å; I338-F411 HydrophobicContact CG1-CD2 4.12Å; V340-F411 HydrophobicContact CG2-CB 4.25Å; F411-I413 HydrophobicContact CD2-CG1 4.45Å; F411-I413 HydrophobicContact CE2-CD1 4.38Å; F411-I413 HydrophobicContact CE2-CG1 4.33Å; F411-F423 HydrophobicContact CD1-CB 4.05Å; F411-F423 HydrophobicContact CD2-CB 4.3Å; F411-F423 HydrophobicContact CE1-CB 3.62Å; F411-F423 HydrophobicContact CE2-CB 3.89Å; F411-F423 HydrophobicContact CE2-CD2 4.01Å; F411-F423 HydrophobicContact CE2-CG 4.24Å; F411-F423 HydrophobicContact CG-CB 4.4Å; F411-F423 HydrophobicContact CZ-CB 3.54Å; F411-F423 HydrophobicContact CZ-CD2 4.31Å; F411-F423 HydrophobicContact CZ-CG 4.08Å; F411-F423 PolarHBondContact N-O 3.4Å; F411-F423 PolarHBondContact O-N 3.38Å; F411-F423 VanDerWaalsContact O-O 3.06Å; F411-R431 HydrophobicContact CB-CG 4.49Å; F411-R431 HydrophobicContact CD1-CG 3.92Å; F411-W434 HydrophobicContact CE1-CB 4.19Å; F411-W434 HydrophobicContact CZ-CB 4.13Å; F411-V435 HydrophobicContact CB-CG2 3.89Å; F411-V435 HydrophobicContact CD1-CG2 4.42Å; F411-V435 HydrophobicContact CD2-CG2 4.46Å; F411-V435 HydrophobicContact CG-CG2 4.04Å; F411-I438 HydrophobicContact CE2-CD1 3.87Å; F411-I438 HydrophobicContact CZ-CD1 4.36Å
412	M	89.6	Confident	72.1	Confident	50 Å²	50	81.6 Å²	81.6	25%	0.246	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	132.8	-174.5	-48.7	-175.5	-60.1	0	0	109.5	I338 K339 P341 W421 H422	I338-M412 CarbonylContact C-O 3.58Å; I338-M412 WeakPolarHBondContact CA-O 3.47Å; K339-M412 HydrophobicContact CB-CE 4.17Å; K339-M412 PolarHBondContact N-O 3.2Å; K339-M412 PolarHBondContact O-N 2.83Å; P341-M412 HydrophobicContact CG-CE 4.21Å; P341-M412 HydrophobicContact CG-SD 4.32Å; M412-W421 CarbonylContact C-O 3.59Å; M412-W421 WeakPolarHBondContact CA-O 3.44Å; M412-H422 WeakPolarHBondContact CG-ND1 3.34Å; M412-H422 PolarHBondContact SD-CE1 3.23Å; M412-H422 PolarHBondContact SD-ND1 3.5Å
413	I	89.4	Confident	74.4	Confident	0 Å²	0	72.9 Å²	72.9	0%	0	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	137.1	169.7	-54.8	176.6	0	0	0	107.5	L313 I331 L333 T337 F411 T420 W421 F423 I438	L313-I413 HydrophobicContact CD2-CD1 3.27Å; I331-I413 HydrophobicContact CG2-CG2 4.16Å; L333-I413 HydrophobicContact CD2-CD1 4.28Å; L333-I413 HydrophobicContact CD2-CG2 4.25Å; T337-I413 CarbonylContact O-C 3.6Å; T337-I413 WeakPolarHBondContact O-CA 3.29Å; F411-I413 HydrophobicContact CD2-CG1 4.45Å; F411-I413 HydrophobicContact CE2-CD1 4.38Å; F411-I413 HydrophobicContact CE2-CG1 4.33Å; I413-T420 WeakPolarHBondContact O-CA 3.31Å; I413-W421 HydrophobicContact CB-CE3 4.22Å; I413-W421 HydrophobicContact CG2-CE3 4.18Å; I413-W421 PolarHBondContact N-O 2.96Å; I413-W421 PolarHBondContact O-N 2.67Å; I413-F423 HydrophobicContact CD1-CD2 4.33Å; I413-F423 HydrophobicContact CD1-CE2 4.03Å; I413-I438 HydrophobicContact CD1-CD1 4.13Å
414	V	87.1	Confident	77.1	Confident	23 Å²	23	67.2 Å²	67.2	14%	0.139	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	110.2	-176.4	-175.2	0	0	0	0	108.8	S336 T337 K339 Q419 T420	S336-V414 CarbonylContact C-O 3.58Å; S336-V414 WeakPolarHBondContact CA-O 3.04Å; T337-V414 PolarHBondContact N-O 2.72Å; T337-V414 PolarHBondContact O-N 3.01Å; T337-V414 PolarHBondContact OG1-O 3.3Å; K339-V414 HydrophobicContact CD-CG2 4.01Å; K339-V414 HydrophobicContact CG-CG2 4.49Å; V414-Q419 WeakPolarHBondContact CA-O 3.38Å; V414-T420 HydrophobicContact CB-CG2 4.35Å; V414-T420 HydrophobicContact CG1-CG2 4.05Å; V414-T420 HydrophobicContact CG2-CG2 3.92Å
415	S	84.4	Confident	79.4	Confident	14 Å²	14	58.2 Å²	58.2	10%	0.098	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	154.6	173.4	172.4	0	0	0	0	110.8	S336 T417 G418 Q419	S336-S415 WeakPolarHBondContact OG-CA 3.37Å; S415-T417 WeakPolarHBondContact CB-OG1 3.36Å; S415-T417 PolarHBondContact O-N 3.16Å; S415-T417 VanDerWaalsContact O-N 3.13Å; S415-T417 PolarHBondContact OG-N 2.93Å; S415-T417 PolarHBondContact OG-OG1 2.79Å; S415-G418 PolarHBondContact O-N 3.39Å; S415-Q419 PolarHBondContact N-O 3.08Å
416	A	75.9	Confident	81.5	Confident	90 Å²	90	55 Å²	55	74%	0.744	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.9	-28.3	167.6	0	0	0	0	0	113	T335 G418	T335-A416 WeakPolarHBondContact O-CB 3.46Å; T335-A416 PolarHBondContact O-N 3.05Å; A416-G418 PolarHBondContact O-N 2.91Å
417	T	79.1	Confident	83.7	Confident	100 Å²	100	47.7 Å²	47.7	61%	0.613	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.5	2.1	173.3	61.3	0	0	0	0	114.5	S415 Q419	S415-T417 WeakPolarHBondContact CB-OG1 3.36Å; S415-T417 PolarHBondContact O-N 3.16Å; S415-T417 VanDerWaalsContact O-N 3.13Å; S415-T417 PolarHBondContact OG-N 2.93Å; S415-T417 PolarHBondContact OG-OG1 2.79Å; T417-Q419 PolarHBondContact O-N 2.75Å
418	G	78.9	Confident	85.2	Confident	52 Å²	52	49.1 Å²	49.1	54%	0.536	29%	0.289	S	S	.	.	S	Bend	trans	78.3	-5.4	-176.8	0	0	0	0	0	114.9	S415 A416	S415-G418 PolarHBondContact O-N 3.39Å; A416-G418 PolarHBondContact O-N 2.91Å
419	Q	83.8	Confident	86.1	Confident	115 Å²	115	52.1 Å²	52.1	54%	0.537	30%	0.299	S	S	.	.			trans	-63.3	139.7	175	-65.3	-170.5	28.4	0	0	111.4	V414 S415 T417 W421	V414-Q419 WeakPolarHBondContact CA-O 3.38Å; S415-Q419 PolarHBondContact N-O 3.08Å; T417-Q419 PolarHBondContact O-N 2.75Å; Q419-W421 HydrophobicContact CB-CH2 3.59Å; Q419-W421 HydrophobicContact CB-CZ2 3.98Å; Q419-W421 HydrophobicContact CB-CZ3 4.08Å; Q419-W421 WeakPolarHBondContact O-CZ3 3.4Å
420	T	86.6	Confident	86.4	Confident	74 Å²	74	51.9 Å²	51.9	45%	0.454	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	137.7	-175.9	60.7	0	0	0	0	113.9	I413 V414	I413-T420 WeakPolarHBondContact O-CA 3.31Å; V414-T420 HydrophobicContact CB-CG2 4.35Å; V414-T420 HydrophobicContact CG1-CG2 4.05Å; V414-T420 HydrophobicContact CG2-CG2 3.92Å
421	W	90.3	Very high	86.5	Confident	32 Å²	32	50.3 Å²	50.3	12%	0.121	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	118.4	175.5	-56	-99.1	0	0	0	110	I331 M412 I413 Q419 F423	I331-W421 HydrophobicContact CD1-CB 4.07Å; I331-W421 HydrophobicContact CD1-CD2 3.67Å; I331-W421 HydrophobicContact CD1-CE3 4.22Å; I331-W421 HydrophobicContact CD1-CG 3.57Å; I331-W421 HydrophobicContact CG1-CD2 4.06Å; I331-W421 HydrophobicContact CG1-CG 4.37Å; I331-W421 HydrophobicContact CG1-CZ2 4.21Å; I331-W421 HydrophobicContact CG2-CD2 4.39Å; I331-W421 HydrophobicContact CG2-CE3 4.01Å; I331-W421 HydrophobicContact CG2-CH2 4.06Å; I331-W421 HydrophobicContact CG2-CZ2 4.42Å; I331-W421 HydrophobicContact CG2-CZ3 3.83Å; M412-W421 CarbonylContact C-O 3.59Å; M412-W421 WeakPolarHBondContact CA-O 3.44Å; I413-W421 HydrophobicContact CB-CE3 4.22Å; I413-W421 HydrophobicContact CG2-CE3 4.18Å; I413-W421 PolarHBondContact N-O 2.96Å; I413-W421 PolarHBondContact O-N 2.67Å; Q419-W421 HydrophobicContact CB-CH2 3.59Å; Q419-W421 HydrophobicContact CB-CZ2 3.98Å; Q419-W421 HydrophobicContact CB-CZ3 4.08Å; Q419-W421 WeakPolarHBondContact O-CZ3 3.4Å; W421-F423 HydrophobicContact CB-CD2 4.3Å; W421-F423 HydrophobicContact CB-CE2 3.63Å; W421-F423 HydrophobicContact CB-CZ 4.32Å
422	H	90.1	Very high	86.4	Confident	36 Å²	36	51.9 Å²	51.9	17%	0.167	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	128.2	175.5	-54.9	-91.2	0	0	0	110.5	R292 W300 M412	R292-H422 HydrophobicContact CB-CB 3.88Å; R292-H422 VanDerWaalsContact CZ-CD2 3.42Å; R292-H422 PolarHBondContact N-O 3.36Å; R292-H422 PolarHBondContact NH2-CD2 3.4Å; R292-H422 PolarHBondContact NH2-NE2 3.36Å; W300-H422 HydrophobicContact CH2-CB 4.1Å; W300-H422 HydrophobicContact CZ3-CB 4.35Å; M412-H422 WeakPolarHBondContact CG-ND1 3.34Å; M412-H422 PolarHBondContact SD-CE1 3.23Å; M412-H422 PolarHBondContact SD-ND1 3.5Å
423	F	91.8	Very high	86.3	Confident	1 Å²	1	51.3 Å²	51.3	0%	0.004	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	151.2	176.2	-67.4	-83	0	0	0	110.8	L289 L290 K291 V305 Y315 I331 N410 F411 I413 W421	L289-F423 HydrophobicContact CB-CD1 4.1Å; L289-F423 HydrophobicContact CD1-CB 4.39Å; L289-F423 HydrophobicContact CD1-CD1 4.15Å; L289-F423 HydrophobicContact CD1-CG 4.44Å; L290-F423 CarbonylContact O-C 3.38Å; L290-F423 VanDerWaalsContact O-CA 3.27Å; L290-F423 WeakPolarHBondContact O-CA 3.24Å; K291-F423 HydrophobicContact CB-CD1 4.02Å; K291-F423 HydrophobicContact CB-CE1 3.94Å; K291-F423 HydrophobicContact CG-CD1 3.85Å; K291-F423 HydrophobicContact CG-CE1 3.45Å; K291-F423 VanDerWaalsContact CG-CE1 3.45Å; K291-F423 HydrophobicContact CG-CZ 3.98Å; V305-F423 HydrophobicContact CG2-CE1 4.23Å; Y315-F423 HydrophobicContact CD1-CZ 4.35Å; I331-F423 HydrophobicContact CD1-CE2 4.15Å; I331-F423 HydrophobicContact CD1-CZ 4.14Å; N410-F423 CarbonylContact C-O 3.45Å; N410-F423 WeakPolarHBondContact CA-O 3.38Å; N410-F423 VanDerWaalsContact CB-O 3.26Å; N410-F423 WeakPolarHBondContact CB-O 3.26Å; F411-F423 HydrophobicContact CD1-CB 4.05Å; F411-F423 HydrophobicContact CD2-CB 4.3Å; F411-F423 HydrophobicContact CE1-CB 3.62Å; F411-F423 HydrophobicContact CE2-CB 3.89Å; F411-F423 HydrophobicContact CE2-CD2 4.01Å; F411-F423 HydrophobicContact CE2-CG 4.24Å; F411-F423 HydrophobicContact CG-CB 4.4Å; F411-F423 HydrophobicContact CZ-CB 3.54Å; F411-F423 HydrophobicContact CZ-CD2 4.31Å; F411-F423 HydrophobicContact CZ-CG 4.08Å; F411-F423 PolarHBondContact N-O 3.4Å; F411-F423 PolarHBondContact O-N 3.38Å; F411-F423 VanDerWaalsContact O-O 3.06Å; I413-F423 HydrophobicContact CD1-CD2 4.33Å; I413-F423 HydrophobicContact CD1-CE2 4.03Å; W421-F423 HydrophobicContact CB-CD2 4.3Å; W421-F423 HydrophobicContact CB-CE2 3.63Å; W421-F423 HydrophobicContact CB-CZ 4.32Å
424	E	91.3	Very high	86.4	Confident	45 Å²	45	51.4 Å²	51.4	21%	0.21	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	133.1	176.1	178.8	156.9	-121.3	0	0	109.5	L290 W300 N409 N410	L290-E424 HydrophobicContact CB-CB 4.1Å; L290-E424 HydrophobicContact CD1-CG 4.5Å; L290-E424 PolarHBondContact N-O 2.83Å; L290-E424 PolarHBondContact O-N 3.06Å; W300-E424 HydrophobicContact CE3-CB 4.18Å; W300-E424 HydrophobicContact CH2-CB 3.93Å; W300-E424 HydrophobicContact CZ3-CB 3.73Å; N409-E424 HydrophobicContact CB-CG 4.34Å; N410-E424 HydrophobicContact CB-CB 3.98Å; N410-E424 HydrophobicContact CB-CG 4.26Å
425	A	89.9	Confident	86.6	Confident	5 Å²	5	50.8 Å²	50.8	4%	0.041	30%	0.295	C	S	.	.			trans	-98.5	163.8	-179.7	0	0	0	0	0	110.8	L289 N409 T427 E430 R431	L289-A425 HydrophobicContact CD2-CB 3.86Å; N409-A425 PolarHBondContact O-N 2.68Å; A425-T427 VanDerWaalsContact C-N 3.34Å; A425-E430 HydrophobicContact CB-CB 4.06Å; A425-E430 HydrophobicContact CB-CG 3.88Å; A425-R431 HydrophobicContact CB-CB 3.92Å
426	T	85.6	Confident	86.8	Confident	102 Å²	102	56.2 Å²	56.2	63%	0.626	32%	0.319	S	S	*	.	S	Bend	trans	-69.6	-33.7	178.9	62.9	0	0	0	0	112.1	N409 E430	N409-T426 PolarHBondContact ND2-O 2.96Å; T426-E430 WeakPolarHBondContact CB-OE2 3.45Å; T426-E430 PolarHBondContact N-OE2 2.72Å; T426-E430 PolarHBondContact OG1-OE2 3.2Å
427	T	87.3	Confident	87.4	Confident	56 Å²	56	52.9 Å²	52.9	34%	0.344	29%	0.292	S	S	.	.	S	Bend	trans	-131.5	167.8	179.1	71.3	0	0	0	0	112.7	A425 E429 E430 R431	A425-T427 VanDerWaalsContact C-N 3.34Å; T427-E429 VanDerWaalsContact C-N 3.28Å; T427-E429 VanDerWaalsContact CB-OE2 3.31Å; T427-E429 WeakPolarHBondContact CB-OE2 3.28Å; T427-E429 PolarHBondContact OG1-OE2 2.99Å; T427-E430 WeakPolarHBondContact OG1-CB 3.23Å; T427-E430 PolarHBondContact OG1-N 3.39Å; T427-R431 PolarHBondContact O-N 2.79Å; T427-R431 VanDerWaalsContact O-N 3.08Å
428	Y	83.8	Confident	87.9	Confident	88 Å²	88	48.1 Å²	48.1	35%	0.345	26%	0.262	S	S	.	.	H	α-helix	trans	-64.9	-37.4	173.8	174	-73.5	0	0	0	110.8	S407 R431 D432	S407-Y428 WeakPolarHBondContact OG-CD2 3.32Å; S407-Y428 VanDerWaalsContact OG-CE2 3.3Å; S407-Y428 WeakPolarHBondContact OG-CE2 3.31Å; Y428-R431 VanDerWaalsContact CD2-NH2 3.26Å; Y428-R431 WeakPolarHBondContact O-CB 3.23Å; Y428-R431 PolarHBondContact O-N 3.2Å; Y428-D432 PolarHBondContact O-N 3.11Å
429	E	86.4	Confident	88.4	Confident	126 Å²	126	50 Å²	50	59%	0.589	26%	0.257	S	S	*	.	H	α-helix	trans	-71.6	-42.4	-176.1	-60.9	64.9	-141.2	0	0	110.1	T427 A433	T427-E429 VanDerWaalsContact C-N 3.28Å; T427-E429 VanDerWaalsContact CB-OE2 3.31Å; T427-E429 WeakPolarHBondContact CB-OE2 3.28Å; T427-E429 PolarHBondContact OG1-OE2 2.99Å; E429-A433 VanDerWaalsContact O-CB 3.25Å; E429-A433 WeakPolarHBondContact O-CB 3.37Å; E429-A433 PolarHBondContact O-N 2.99Å
430	E	87.4	Confident	88.5	Confident	46 Å²	46	47.6 Å²	47.6	22%	0.215	25%	0.254	C	S	.	.	H	α-helix	trans	-62.5	-43.3	170.5	-179.4	179.2	-145.8	0	0	110.8	A425 T426 T427 A433 W434	A425-E430 HydrophobicContact CB-CB 4.06Å; A425-E430 HydrophobicContact CB-CG 3.88Å; T426-E430 WeakPolarHBondContact CB-OE2 3.45Å; T426-E430 PolarHBondContact N-OE2 2.72Å; T426-E430 PolarHBondContact OG1-OE2 3.2Å; T427-E430 WeakPolarHBondContact OG1-CB 3.23Å; T427-E430 PolarHBondContact OG1-N 3.39Å; E430-A433 PolarHBondContact O-N 3.44Å; E430-W434 VanDerWaalsContact O-CD1 3.25Å; E430-W434 PolarHBondContact O-N 3.37Å
431	R	88.3	Confident	88.5	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-56.6	-54.4	176.1	-171.6	-154.8	64	-132.4	-12.5	111	T408 N410 F411 A425 T427 Y428 A433 W434 V435	T408-R431 PolarHBondContact O-NH1 3.32Å; N410-R431 WeakPolarHBondContact O-CD 3.26Å; F411-R431 HydrophobicContact CB-CG 4.49Å; F411-R431 HydrophobicContact CD1-CG 3.92Å; A425-R431 HydrophobicContact CB-CB 3.92Å; T427-R431 PolarHBondContact O-N 2.79Å; T427-R431 VanDerWaalsContact O-N 3.08Å; Y428-R431 VanDerWaalsContact CD2-NH2 3.26Å; Y428-R431 WeakPolarHBondContact O-CB 3.23Å; Y428-R431 PolarHBondContact O-N 3.2Å; R431-A433 VanDerWaalsContact C-N 3.34Å; R431-A433 PolarHBondContact O-N 3.28Å; R431-W434 PolarHBondContact O-N 2.97Å; R431-W434 VanDerWaalsContact O-N 3.15Å; R431-V435 HydrophobicContact CG-CG2 4.36Å; R431-V435 VanDerWaalsContact O-CG2 3.3Å; R431-V435 WeakPolarHBondContact O-CG2 3.36Å; R431-V435 PolarHBondContact O-N 3.27Å
432	D	86.9	Confident	88.2	Confident	35 Å²	35	44.6 Å²	44.6	19%	0.187	24%	0.236	C	C	.	.	H	α-helix	trans	-70.6	-30	-176.2	-84.5	13.4	0	0	0	112.1	K343 Y428 W434 V435 Q436	K343-D432 IonicContact NZ-OD1 2.66Å; K343-D432 IonicContact NZ-OD2 3.26Å; K343-D432 PolarHBondContact NZ-OD2 3Å; Y428-D432 PolarHBondContact O-N 3.11Å; D432-W434 VanDerWaalsContact C-N 3.33Å; D432-W434 PolarHBondContact O-N 3.34Å; D432-V435 PolarHBondContact O-N 2.61Å; D432-Q436 WeakPolarHBondContact O-CB 3.44Å; D432-Q436 PolarHBondContact O-N 3.26Å
433	A	88.9	Confident	87.8	Confident	37 Å²	37	47.6 Å²	47.6	31%	0.306	25%	0.253	S	S	.	.	H	α-helix	trans	-68.1	-27.5	170	0	0	0	0	0	113.8	K285 E429 E430 R431 A437	K285-A433 WeakPolarHBondContact CE-O 3.27Å; E429-A433 VanDerWaalsContact O-CB 3.25Å; E429-A433 WeakPolarHBondContact O-CB 3.37Å; E429-A433 PolarHBondContact O-N 2.99Å; E430-A433 PolarHBondContact O-N 3.44Å; R431-A433 VanDerWaalsContact C-N 3.34Å; R431-A433 PolarHBondContact O-N 3.28Å; A433-A437 WeakPolarHBondContact O-CB 3.32Å; A433-A437 PolarHBondContact O-N 2.94Å
434	W	91.4	Very high	87.1	Confident	3 Å²	3	49.9 Å²	49.9	1%	0.011	27%	0.272	C	S	.	.	H	α-helix	trans	-77.3	-43.7	169.6	-86.7	106.6	0	0	0	112.1	K285 L289 V305 L307 L313 F411 E430 R431 D432 A437 I438	K285-W434 HydrophobicContact CB-CH2 4.27Å; K285-W434 HydrophobicContact CB-CZ3 4.08Å; K285-W434 HydrophobicContact CD-CD2 3.67Å; K285-W434 HydrophobicContact CD-CE3 3.67Å; K285-W434 HydrophobicContact CD-CG 4.15Å; K285-W434 HydrophobicContact CD-CH2 4.37Å; K285-W434 HydrophobicContact CD-CZ2 4.37Å; K285-W434 HydrophobicContact CD-CZ3 4.03Å; K285-W434 VanDerWaalsContact CE-CD2 3.46Å; K285-W434 HydrophobicContact CG-CD2 4.27Å; K285-W434 HydrophobicContact CG-CE3 4.13Å; K285-W434 HydrophobicContact CG-CH2 3.93Å; K285-W434 HydrophobicContact CG-CZ2 4.07Å; K285-W434 HydrophobicContact CG-CZ3 3.95Å; L289-W434 HydrophobicContact CD1-CD2 4.01Å; L289-W434 HydrophobicContact CD1-CE3 4.49Å; L289-W434 HydrophobicContact CD1-CG 4.23Å; L289-W434 HydrophobicContact CD1-CZ2 4.41Å; L289-W434 HydrophobicContact CD2-CG 4.46Å; V305-W434 HydrophobicContact CB-CH2 4.12Å; V305-W434 HydrophobicContact CB-CZ2 4.49Å; V305-W434 HydrophobicContact CG1-CH2 4.06Å; V305-W434 HydrophobicContact CG1-CZ3 4.17Å; V305-W434 WeakPolarHBondContact O-CH2 3.32Å; L307-W434 HydrophobicContact CB-CZ3 4.21Å; L313-W434 HydrophobicContact CD1-CZ3 4.12Å; F411-W434 HydrophobicContact CE1-CB 4.19Å; F411-W434 HydrophobicContact CZ-CB 4.13Å; E430-W434 VanDerWaalsContact O-CD1 3.25Å; E430-W434 PolarHBondContact O-N 3.37Å; R431-W434 PolarHBondContact O-N 2.97Å; R431-W434 VanDerWaalsContact O-N 3.15Å; D432-W434 VanDerWaalsContact C-N 3.33Å; D432-W434 PolarHBondContact O-N 3.34Å; W434-A437 PolarHBondContact O-N 3.01Å; W434-I438 HydrophobicContact CE3-CD1 4.47Å; W434-I438 WeakPolarHBondContact O-CB 3.26Å; W434-I438 WeakPolarHBondContact O-CG1 3.43Å; W434-I438 PolarHBondContact O-N 2.87Å
435	V	89.9	Confident	86.3	Confident	9 Å²	9	48.5 Å²	48.5	6%	0.055	27%	0.267	C	S	.	.	H	α-helix	trans	-60.4	-47.3	177.3	172.1	0	0	0	0	110.3	I338 V340 F411 R431 D432 I438 Q439	I338-V435 HydrophobicContact CD1-CB 4.22Å; I338-V435 HydrophobicContact CD1-CG1 4.22Å; I338-V435 HydrophobicContact CD1-CG2 3.97Å; V340-V435 HydrophobicContact CG2-CB 4.47Å; V340-V435 HydrophobicContact CG2-CG1 3.99Å; V340-V435 HydrophobicContact CG2-CG2 3.67Å; F411-V435 HydrophobicContact CB-CG2 3.89Å; F411-V435 HydrophobicContact CD1-CG2 4.42Å; F411-V435 HydrophobicContact CD2-CG2 4.46Å; F411-V435 HydrophobicContact CG-CG2 4.04Å; R431-V435 HydrophobicContact CG-CG2 4.36Å; R431-V435 VanDerWaalsContact O-CG2 3.3Å; R431-V435 WeakPolarHBondContact O-CG2 3.36Å; R431-V435 PolarHBondContact O-N 3.27Å; D432-V435 PolarHBondContact O-N 2.61Å; V435-I438 PolarHBondContact O-N 3.15Å; V435-Q439 HydrophobicContact CG1-CG 4.34Å; V435-Q439 WeakPolarHBondContact O-CB 3.48Å; V435-Q439 VanDerWaalsContact O-CG 3.28Å; V435-Q439 WeakPolarHBondContact O-CG 3.41Å; V435-Q439 PolarHBondContact O-N 3.06Å
436	Q	89.5	Confident	85.3	Confident	128 Å²	128	53 Å²	53	60%	0.598	29%	0.29	S	S	*	.	H	α-helix	trans	-60.9	-47.9	177.5	-175	179.3	5.1	0	0	111.7	D432 I438 Q439 S440	D432-Q436 WeakPolarHBondContact O-CB 3.44Å; D432-Q436 PolarHBondContact O-N 3.26Å; Q436-I438 VanDerWaalsContact C-N 3.33Å; Q436-I438 PolarHBondContact O-N 3.36Å; Q436-Q439 PolarHBondContact O-N 3.24Å; Q436-S440 WeakPolarHBondContact O-CB 3.14Å; Q436-S440 PolarHBondContact O-N 3.08Å; Q436-S440 PolarHBondContact O-OG 2.81Å
437	A	88	Confident	84.5	Confident	20 Å²	20	54.6 Å²	54.6	17%	0.165	29%	0.291	C	S	.	.	H	α-helix	trans	-61.1	-40.7	179.2	0	0	0	0	0	112.5	K285 L307 A433 W434 Q441	K285-A437 HydrophobicContact CB-CB 4.39Å; K285-A437 HydrophobicContact CD-CB 3.68Å; L307-A437 HydrophobicContact CD2-CB 3.85Å; A433-A437 WeakPolarHBondContact O-CB 3.32Å; A433-A437 PolarHBondContact O-N 2.94Å; W434-A437 PolarHBondContact O-N 3.01Å; A437-Q441 WeakPolarHBondContact O-CB 3.44Å; A437-Q441 PolarHBondContact O-N 3.4Å
438	I	89.4	Confident	83.2	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-66.8	-43.4	175.5	-69.2	165.4	0	0	0	110.8	L307 L313 L333 I338 F411 I413 W434 V435 Q436 Q441 I442	L307-I438 HydrophobicContact CD2-CG1 4.25Å; L313-I438 HydrophobicContact CD2-CD1 4.12Å; L333-I438 HydrophobicContact CD1-CG1 4.48Å; L333-I438 HydrophobicContact CD1-CG2 4.07Å; L333-I438 HydrophobicContact CD2-CG2 4.15Å; I338-I438 HydrophobicContact CB-CG2 4.3Å; I338-I438 HydrophobicContact CD1-CB 3.96Å; I338-I438 HydrophobicContact CD1-CD1 3.9Å; I338-I438 HydrophobicContact CD1-CG2 3.77Å; I338-I438 HydrophobicContact CG2-CG2 4.36Å; F411-I438 HydrophobicContact CE2-CD1 3.87Å; F411-I438 HydrophobicContact CZ-CD1 4.36Å; I413-I438 HydrophobicContact CD1-CD1 4.13Å; W434-I438 HydrophobicContact CE3-CD1 4.47Å; W434-I438 WeakPolarHBondContact O-CB 3.26Å; W434-I438 WeakPolarHBondContact O-CG1 3.43Å; W434-I438 PolarHBondContact O-N 2.87Å; V435-I438 PolarHBondContact O-N 3.15Å; Q436-I438 VanDerWaalsContact C-N 3.33Å; Q436-I438 PolarHBondContact O-N 3.36Å; I438-Q441 PolarHBondContact O-N 2.7Å; I438-I442 HydrophobicContact CG2-CD1 3.79Å; I438-I442 WeakPolarHBondContact O-CD1 3.38Å; I438-I442 VanDerWaalsContact O-CG1 3.25Å; I438-I442 WeakPolarHBondContact O-CG1 3.44Å; I438-I442 PolarHBondContact O-N 2.86Å
439	Q	88.9	Confident	81.7	Confident	91 Å²	91	54.3 Å²	54.3	43%	0.425	30%	0.303	S	S	.	.	H	α-helix	trans	-63.3	-45.6	176.3	-74.1	179.7	-45.1	0	0	112.2	I338 V435 Q436 Q441 I442 L443	I338-Q439 HydrophobicContact CG2-CG 3.49Å; I338-Q439 VanDerWaalsContact CG2-CG 3.49Å; V435-Q439 HydrophobicContact CG1-CG 4.34Å; V435-Q439 WeakPolarHBondContact O-CB 3.48Å; V435-Q439 VanDerWaalsContact O-CG 3.28Å; V435-Q439 WeakPolarHBondContact O-CG 3.41Å; V435-Q439 PolarHBondContact O-N 3.06Å; Q436-Q439 PolarHBondContact O-N 3.24Å; Q439-Q441 VanDerWaalsContact C-N 3.32Å; Q439-Q441 PolarHBondContact O-N 2.95Å; Q439-I442 PolarHBondContact O-N 3.01Å; Q439-L443 WeakPolarHBondContact O-CB 3.34Å; Q439-L443 VanDerWaalsContact O-CG 3.29Å; Q439-L443 WeakPolarHBondContact O-CG 3.32Å; Q439-L443 PolarHBondContact O-N 2.92Å
440	S	86	Confident	80	Confident	66 Å²	66	53.3 Å²	53.3	46%	0.462	30%	0.298	S	S	.	.	H	α-helix	trans	-61.4	-39	176	-68.3	0	0	0	0	112	Q436 L443 A444	Q436-S440 WeakPolarHBondContact O-CB 3.14Å; Q436-S440 PolarHBondContact O-N 3.08Å; Q436-S440 PolarHBondContact O-OG 2.81Å; S440-L443 PolarHBondContact O-N 2.91Å; S440-A444 VanDerWaalsContact O-CB 3.26Å; S440-A444 WeakPolarHBondContact O-CB 3.47Å; S440-A444 PolarHBondContact O-N 2.96Å
441	Q	86.4	Confident	77.9	Confident	17 Å²	17	54.9 Å²	54.9	8%	0.079	31%	0.314	C	S	.	.	H	α-helix	trans	-67.4	-42.3	175.1	-177.6	60.9	52.2	0	0	112.3	L307 S309 A437 I438 Q439 L443 A444 S445	L307-Q441 HydrophobicContact CD1-CB 4.34Å; L307-Q441 HydrophobicContact CD1-CG 4.19Å; L307-Q441 HydrophobicContact CD2-CB 4.39Å; S309-Q441 PolarHBondContact O-NE2 3.45Å; A437-Q441 WeakPolarHBondContact O-CB 3.44Å; A437-Q441 PolarHBondContact O-N 3.4Å; I438-Q441 PolarHBondContact O-N 2.7Å; Q439-Q441 VanDerWaalsContact C-N 3.32Å; Q439-Q441 PolarHBondContact O-N 2.95Å; Q441-L443 VanDerWaalsContact C-N 3.35Å; Q441-A444 PolarHBondContact O-N 3.29Å; Q441-S445 PolarHBondContact NE2-OG 2.81Å; Q441-S445 PolarHBondContact O-N 2.83Å; Q441-S445 PolarHBondContact O-OG 2.96Å
442	I	84.1	Confident	76	Confident	26 Å²	26	57.8 Å²	57.8	13%	0.133	34%	0.335	C	S	.	.	H	α-helix	trans	-60.9	-45.6	175.3	-67.5	161.8	0	0	0	110.3	L333 S336 I438 Q439 S445 L446	L333-I442 HydrophobicContact CB-CG1 3.93Å; S336-I442 WeakPolarHBondContact O-CD1 3.25Å; I438-I442 HydrophobicContact CG2-CD1 3.79Å; I438-I442 WeakPolarHBondContact O-CD1 3.38Å; I438-I442 VanDerWaalsContact O-CG1 3.25Å; I438-I442 WeakPolarHBondContact O-CG1 3.44Å; I438-I442 PolarHBondContact O-N 2.86Å; Q439-I442 PolarHBondContact O-N 3.01Å; I442-S445 PolarHBondContact O-N 2.93Å; I442-L446 HydrophobicContact CG2-CD1 4.05Å; I442-L446 WeakPolarHBondContact O-CG 3.46Å; I442-L446 PolarHBondContact O-N 3.13Å
443	L	81.9	Confident	74	Confident	99 Å²	99	61.5 Å²	61.5	52%	0.518	35%	0.349	S	S	.	.	H	α-helix	trans	-65.2	-41.2	177.9	-70.7	168.5	0	0	0	112.4	Q439 S440 Q441 L446 Q447	Q439-L443 WeakPolarHBondContact O-CB 3.34Å; Q439-L443 VanDerWaalsContact O-CG 3.29Å; Q439-L443 WeakPolarHBondContact O-CG 3.32Å; Q439-L443 PolarHBondContact O-N 2.92Å; S440-L443 PolarHBondContact O-N 2.91Å; Q441-L443 VanDerWaalsContact C-N 3.35Å; L443-L446 PolarHBondContact O-N 2.9Å; L443-Q447 WeakPolarHBondContact O-CB 3.25Å; L443-Q447 WeakPolarHBondContact O-CG 3.28Å; L443-Q447 PolarHBondContact O-N 3.08Å
444	A	78.7	Confident	71.7	Confident	48 Å²	48	63.4 Å²	63.4	40%	0.397	36%	0.36	S	S	.	.	H	α-helix	trans	-63.7	-41.4	175.6	0	0	0	0	0	111.8	S440 Q441 Q447 S448	S440-A444 VanDerWaalsContact O-CB 3.26Å; S440-A444 WeakPolarHBondContact O-CB 3.47Å; S440-A444 PolarHBondContact O-N 2.96Å; Q441-A444 PolarHBondContact O-N 3.29Å; A444-Q447 PolarHBondContact O-N 3.12Å; A444-S448 WeakPolarHBondContact O-CB 3.48Å; A444-S448 PolarHBondContact O-N 3.34Å
445	S	72.6	Confident	69.6	Low	16 Å²	16	70.9 Å²	70.9	11%	0.112	39%	0.393	C	S	.	.	H	α-helix	trans	-61	-47.2	172.1	-70	0	0	0	0	111.4	Q441 I442 Q447 S448 C449	Q441-S445 PolarHBondContact NE2-OG 2.81Å; Q441-S445 PolarHBondContact O-N 2.83Å; Q441-S445 PolarHBondContact O-OG 2.96Å; I442-S445 PolarHBondContact O-N 2.93Å; S445-Q447 PolarHBondContact O-N 3.4Å; S445-S448 PolarHBondContact O-N 3Å; S445-S448 PolarHBondContact O-OG 3.24Å; S445-C449 PolarHBondContact O-N 3.21Å; S445-C449 PolarHBondContact O-SG 2.88Å; S445-C449 VanDerWaalsContact O-SG 3.39Å
446	L	70.7	Confident	67.6	Low	101 Å²	101	73.4 Å²	73.4	53%	0.529	41%	0.41	S	S	.	.	H	α-helix	trans	-60.7	-42.2	176.9	-71.2	168.3	0	0	0	113	I442 L443 C449	I442-L446 HydrophobicContact CG2-CD1 4.05Å; I442-L446 WeakPolarHBondContact O-CG 3.46Å; I442-L446 PolarHBondContact O-N 3.13Å; L443-L446 PolarHBondContact O-N 2.9Å; L446-C449 WeakPolarHBondContact O-CB 3.45Å; L446-C449 PolarHBondContact O-N 3.21Å
447	Q	68.4	Low	65.6	Low	135 Å²	135	73.8 Å²	73.8	63%	0.631	41%	0.412	S	S	*	.	H	α-helix	trans	-68.5	-34.7	176.5	-73.6	176.2	-27.4	0	0	112.4	L443 A444 S445 C449 E450 S451	L443-Q447 WeakPolarHBondContact O-CB 3.25Å; L443-Q447 WeakPolarHBondContact O-CG 3.28Å; L443-Q447 PolarHBondContact O-N 3.08Å; A444-Q447 PolarHBondContact O-N 3.12Å; S445-Q447 PolarHBondContact O-N 3.4Å; Q447-C449 PolarHBondContact O-N 3.04Å; Q447-E450 WeakPolarHBondContact O-CB 3.15Å; Q447-E450 PolarHBondContact O-N 3.36Å; Q447-S451 PolarHBondContact O-N 3.14Å
448	S	59.7	Low	63.5	Low	66 Å²	66	78.5 Å²	78.5	46%	0.462	43%	0.434	S	S	.	.	H	α-helix	trans	-60.8	-36.9	173.2	78.1	0	0	0	0	111.6	A444 S445 E450 S451	A444-S448 WeakPolarHBondContact O-CB 3.48Å; A444-S448 PolarHBondContact O-N 3.34Å; S445-S448 PolarHBondContact O-N 3Å; S445-S448 PolarHBondContact O-OG 3.24Å; S448-E450 PolarHBondContact O-N 2.86Å; S448-S451 PolarHBondContact O-N 2.67Å; S448-S451 PolarHBondContact O-OG 3.02Å
449	C	52.9	Low	62	Low	72 Å²	72	82.5 Å²	82.5	49%	0.486	46%	0.459	S	S	.	.	H	α-helix	trans	-71.3	-2.6	173	-62.3	0	0	0	0	114.8	S445 L446 Q447 S452	S445-C449 PolarHBondContact O-N 3.21Å; S445-C449 PolarHBondContact O-SG 2.88Å; S445-C449 VanDerWaalsContact O-SG 3.39Å; L446-C449 WeakPolarHBondContact O-CB 3.45Å; L446-C449 PolarHBondContact O-N 3.21Å; Q447-C449 PolarHBondContact O-N 3.04Å; C449-S452 VanDerWaalsContact C-OG 3.3Å; C449-S452 WeakPolarHBondContact CA-OG 3.42Å; C449-S452 PolarHBondContact O-OG 3.39Å
450	E	49.7	Very low	60.8	Low	105 Å²	105	81.4 Å²	81.4	49%	0.491	46%	0.461	S	S	.	.	H	α-helix	trans	-93.7	-32.3	168.4	-56.6	-143.4	100.9	0	0	111.9	Q447 S448 S452 K453	Q447-E450 WeakPolarHBondContact O-CB 3.15Å; Q447-E450 PolarHBondContact O-N 3.36Å; S448-E450 PolarHBondContact O-N 2.86Å; E450-S452 PolarHBondContact O-N 3.35Å; E450-K453 HydrophobicContact CB-CD 4.49Å; E450-K453 VanDerWaalsContact O-CB 3.24Å; E450-K453 WeakPolarHBondContact O-CB 3.38Å; E450-K453 PolarHBondContact O-N 3.49Å; E450-K453 IonicContact OE1-NZ 2.61Å; E450-K453 PolarHBondContact OE1-NZ 3.26Å
451	S	43.4	Very low	59.8	Low	79 Å²	79	83.5 Å²	83.5	55%	0.552	46%	0.464	S	S	*	.	H	α-helix	trans	-61.3	-30.1	173.5	74.1	0	0	0	0	113	Q447 S448 K453 S454 K455	Q447-S451 PolarHBondContact O-N 3.14Å; S448-S451 PolarHBondContact O-N 2.67Å; S448-S451 PolarHBondContact O-OG 3.02Å; S451-K453 VanDerWaalsContact C-N 3.27Å; S451-K453 PolarHBondContact O-N 3.02Å; S451-S454 PolarHBondContact O-N 3.25Å; S451-K455 PolarHBondContact O-N 3.13Å
452	S	47.7	Very low	59.1	Low	61 Å²	61	85.5 Å²	85.5	43%	0.427	48%	0.479	S	S	.	.	H	α-helix	trans	-68.7	-22	172.3	47.6	0	0	0	0	113	C449 E450 S456	C449-S452 VanDerWaalsContact C-OG 3.3Å; C449-S452 WeakPolarHBondContact CA-OG 3.42Å; C449-S452 PolarHBondContact O-OG 3.39Å; E450-S452 PolarHBondContact O-N 3.35Å; S452-S456 VanDerWaalsContact O-CB 3.25Å; S452-S456 WeakPolarHBondContact O-CB 3.44Å; S452-S456 PolarHBondContact O-N 2.82Å; S452-S456 PolarHBondContact O-OG 2.7Å
453	K	46.3	Very low	58.5	Low	112 Å²	112	86.8 Å²	86.8	49%	0.487	48%	0.484	S	S	.	.	H	α-helix	trans	-69.5	-43.1	173.7	-58.6	174.6	-175.2	173.4	0	111.5	E450 S451 K455 S456 Q457	E450-K453 HydrophobicContact CB-CD 4.49Å; E450-K453 VanDerWaalsContact O-CB 3.24Å; E450-K453 WeakPolarHBondContact O-CB 3.38Å; E450-K453 PolarHBondContact O-N 3.49Å; E450-K453 IonicContact OE1-NZ 2.61Å; E450-K453 PolarHBondContact OE1-NZ 3.26Å; S451-K453 VanDerWaalsContact C-N 3.27Å; S451-K453 PolarHBondContact O-N 3.02Å; K453-K455 VanDerWaalsContact C-N 3.31Å; K453-K455 PolarHBondContact O-N 2.79Å; K453-S456 WeakPolarHBondContact CA-OG 3.45Å; K453-S456 PolarHBondContact O-N 3.4Å; K453-S456 PolarHBondContact O-OG 3.43Å; K453-Q457 WeakPolarHBondContact O-CB 3.19Å; K453-Q457 PolarHBondContact O-N 2.87Å
454	S	40	Very low	58.5	Low	77 Å²	77	84.8 Å²	84.8	54%	0.538	48%	0.481	S	S	.	.	H	α-helix	trans	-62.5	-41	175.9	-47.2	0	0	0	0	111.2	S451 L458	S451-S454 PolarHBondContact O-N 3.25Å; S454-L458 PolarHBondContact O-N 3.15Å
455	K	46.6	Very low	58.7	Low	161 Å²	161	87.8 Å²	87.8	70%	0.7	49%	0.489	S	S	*	.	H	α-helix	trans	-67.5	-42.9	174.2	-135.3	175.2	-173.8	-179.5	0	111.4	S451 K453 Q457 L458 T459	S451-K455 PolarHBondContact O-N 3.13Å; K453-K455 VanDerWaalsContact C-N 3.31Å; K453-K455 PolarHBondContact O-N 2.79Å; K455-Q457 VanDerWaalsContact C-N 3.31Å; K455-Q457 PolarHBondContact O-N 3.4Å; K455-L458 PolarHBondContact O-N 3.47Å; K455-T459 PolarHBondContact O-N 3.29Å; K455-T459 PolarHBondContact O-OG1 2.85Å
456	S	48.2	Very low	59.1	Low	61 Å²	61	88 Å²	88	43%	0.427	49%	0.492	S	S	.	.	H	α-helix	trans	-66.4	-32	179.7	72.2	0	0	0	0	112.9	S452 K453 T459 S460	S452-S456 VanDerWaalsContact O-CB 3.25Å; S452-S456 WeakPolarHBondContact O-CB 3.44Å; S452-S456 PolarHBondContact O-N 2.82Å; S452-S456 PolarHBondContact O-OG 2.7Å; K453-S456 WeakPolarHBondContact CA-OG 3.45Å; K453-S456 PolarHBondContact O-N 3.4Å; K453-S456 PolarHBondContact O-OG 3.43Å; S456-T459 VanDerWaalsContact CA-OG1 3.23Å; S456-T459 WeakPolarHBondContact CA-OG1 3.26Å; S456-T459 CarbonylContact O-C 3.58Å; S456-T459 PolarHBondContact O-N 3.29Å; S456-T459 PolarHBondContact O-OG1 3.44Å; S456-S460 WeakPolarHBondContact O-CB 3.39Å; S456-S460 PolarHBondContact O-N 2.72Å; S456-S460 PolarHBondContact O-OG 3.15Å
457	Q	47	Very low	59.9	Low	136 Å²	136	84.2 Å²	84.2	64%	0.636	47%	0.472	S	S	*	.	H	α-helix	trans	-70.9	-40	177.5	-171.6	173.2	4.7	0	0	112.3	K453 K455 T459 S460 Q461	K453-Q457 WeakPolarHBondContact O-CB 3.19Å; K453-Q457 PolarHBondContact O-N 2.87Å; K455-Q457 VanDerWaalsContact C-N 3.31Å; K455-Q457 PolarHBondContact O-N 3.4Å; Q457-T459 VanDerWaalsContact C-N 3.35Å; Q457-S460 WeakPolarHBondContact CA-OG 3.32Å; Q457-S460 PolarHBondContact O-N 3.49Å; Q457-S460 PolarHBondContact O-OG 1.86Å; Q457-Q461 PolarHBondContact O-N 2.99Å
458	L	45.1	Very low	60.9	Low	120 Å²	120	82.9 Å²	82.9	63%	0.628	47%	0.466	S	S	*	.	H	α-helix	trans	-66.9	-36.3	171.3	-73.3	166.2	0	0	0	111.7	S454 K455 S462	S454-L458 PolarHBondContact O-N 3.15Å; K455-L458 PolarHBondContact O-N 3.47Å; L458-S462 PolarHBondContact O-N 2.97Å; L458-S462 PolarHBondContact O-OG 3.41Å
459	T	57.6	Low	62.4	Low	84 Å²	84	82.7 Å²	82.7	52%	0.515	47%	0.465	S	S	.	.	H	α-helix	trans	-72.7	-28.5	172.5	57.2	0	0	0	0	113.4	K455 S456 Q457 S462 K463	K455-T459 PolarHBondContact O-N 3.29Å; K455-T459 PolarHBondContact O-OG1 2.85Å; S456-T459 VanDerWaalsContact CA-OG1 3.23Å; S456-T459 WeakPolarHBondContact CA-OG1 3.26Å; S456-T459 CarbonylContact O-C 3.58Å; S456-T459 PolarHBondContact O-N 3.29Å; S456-T459 PolarHBondContact O-OG1 3.44Å; Q457-T459 VanDerWaalsContact C-N 3.35Å; T459-S462 WeakPolarHBondContact CA-OG 3.47Å; T459-S462 PolarHBondContact O-OG 3.33Å; T459-K463 VanDerWaalsContact O-CB 3.23Å; T459-K463 WeakPolarHBondContact O-CB 3.4Å; T459-K463 PolarHBondContact O-N 2.85Å
460	S	63.2	Low	64.4	Low	67 Å²	67	79.3 Å²	79.3	47%	0.469	44%	0.441	S	S	.	.	H	α-helix	trans	-77.3	-37.8	177.6	69.2	0	0	0	0	111.8	S456 Q457 K463 A464	S456-S460 WeakPolarHBondContact O-CB 3.39Å; S456-S460 PolarHBondContact O-N 2.72Å; S456-S460 PolarHBondContact O-OG 3.15Å; Q457-S460 WeakPolarHBondContact CA-OG 3.32Å; Q457-S460 PolarHBondContact O-N 3.49Å; Q457-S460 PolarHBondContact O-OG 1.86Å; S460-K463 PolarHBondContact O-N 2.91Å; S460-A464 WeakPolarHBondContact O-CB 3.34Å; S460-A464 PolarHBondContact O-N 3.05Å
461	Q	65.7	Low	66.5	Low	111 Å²	111	77.1 Å²	77.1	52%	0.519	43%	0.431	S	S	.	.	H	α-helix	trans	-62.6	-42.3	171.8	-169.3	172.9	17.3	0	0	111.6	Q457 A464 M465	Q457-Q461 PolarHBondContact O-N 2.99Å; Q461-A464 PolarHBondContact O-N 3.21Å; Q461-M465 HydrophobicContact CG-CE 4.01Å; Q461-M465 HydrophobicContact CG-SD 4.38Å; Q461-M465 WeakPolarHBondContact O-CG 3.43Å; Q461-M465 PolarHBondContact O-N 2.8Å
462	S	72.1	Confident	69	Low	59 Å²	59	79.1 Å²	79.1	41%	0.413	44%	0.436	S	S	.	.	H	α-helix	trans	-76.8	-23.9	175.2	53.7	0	0	0	0	114.4	L458 T459 A466 R529	L458-S462 PolarHBondContact O-N 2.97Å; L458-S462 PolarHBondContact O-OG 3.41Å; T459-S462 WeakPolarHBondContact CA-OG 3.47Å; T459-S462 PolarHBondContact O-OG 3.33Å; S462-A466 WeakPolarHBondContact O-CB 3.37Å; S462-A466 PolarHBondContact O-N 2.86Å; S462-R529 PolarHBondContact O-NH1 2.8Å
463	K	71.7	Confident	71.2	Confident	53 Å²	53	78.6 Å²	78.6	23%	0.23	43%	0.427	C	S	.	.	H	α-helix	trans	-64.8	-47.9	164.6	-173.6	177.7	177.6	-177	0	109.6	T459 S460 A466 L467 D522 D523	T459-K463 VanDerWaalsContact O-CB 3.23Å; T459-K463 WeakPolarHBondContact O-CB 3.4Å; T459-K463 PolarHBondContact O-N 2.85Å; S460-K463 PolarHBondContact O-N 2.91Å; K463-A466 PolarHBondContact O-N 3.02Å; K463-L467 HydrophobicContact CG-CD1 3.9Å; K463-L467 VanDerWaalsContact O-CG 3.31Å; K463-L467 WeakPolarHBondContact O-CG 3.3Å; K463-L467 PolarHBondContact O-N 3.42Å; K463-D522 PolarHBondContact NZ-O 3.38Å; K463-D523 IonicContact NZ-OD1 2.81Å; K463-D523 PolarHBondContact NZ-OD1 2.85Å
464	A	82.3	Confident	73.6	Confident	56 Å²	56	82.2 Å²	82.2	46%	0.463	44%	0.438	S	S	.	.	H	α-helix	trans	-62.1	-49.3	179.2	0	0	0	0	0	112.8	S460 Q461 A466 L467 Q468	S460-A464 WeakPolarHBondContact O-CB 3.34Å; S460-A464 PolarHBondContact O-N 3.05Å; Q461-A464 PolarHBondContact O-N 3.21Å; A464-A466 VanDerWaalsContact C-N 3.3Å; A464-A466 PolarHBondContact O-N 3.27Å; A464-L467 PolarHBondContact O-N 3.01Å; A464-Q468 WeakPolarHBondContact O-CB 3.33Å; A464-Q468 PolarHBondContact O-N 3.41Å
465	M	82.6	Confident	76.3	Confident	111 Å²	111	79.5 Å²	79.5	55%	0.547	42%	0.422	S	S	.	.	H	α-helix	trans	-58.1	-40	176.8	-73.1	169.6	170.2	0	0	112.5	Q461 Q468 S469	Q461-M465 HydrophobicContact CG-CE 4.01Å; Q461-M465 HydrophobicContact CG-SD 4.38Å; Q461-M465 WeakPolarHBondContact O-CG 3.43Å; Q461-M465 PolarHBondContact O-N 2.8Å; M465-Q468 PolarHBondContact O-N 3Å; M465-S469 PolarHBondContact O-N 3.37Å
466	A	80.4	Confident	78.7	Confident	22 Å²	22	72 Å²	72	18%	0.182	39%	0.389	C	S	.	.	H	α-helix	trans	-73	-35.2	178.2	0	0	0	0	0	113.1	S462 K463 A464 Q468 S469 I470	S462-A466 WeakPolarHBondContact O-CB 3.37Å; S462-A466 PolarHBondContact O-N 2.86Å; K463-A466 PolarHBondContact O-N 3.02Å; A464-A466 VanDerWaalsContact C-N 3.3Å; A464-A466 PolarHBondContact O-N 3.27Å; A466-Q468 VanDerWaalsContact C-N 3.33Å; A466-S469 WeakPolarHBondContact O-CB 3.24Å; A466-S469 PolarHBondContact O-N 2.86Å; A466-I470 WeakPolarHBondContact O-CG1 3.23Å; A466-I470 PolarHBondContact O-N 3.39Å; A466-I470 VanDerWaalsContact O-N 3.1Å
467	L	87.6	Confident	81	Confident	21 Å²	21	71.6 Å²	71.6	11%	0.11	39%	0.39	C	S	.	.	H	α-helix	trans	-67.2	-35.9	172.4	-71.2	166.4	0	0	0	111.6	K463 A464 I470 Q471 L519 W524	K463-L467 HydrophobicContact CG-CD1 3.9Å; K463-L467 VanDerWaalsContact O-CG 3.31Å; K463-L467 WeakPolarHBondContact O-CG 3.3Å; K463-L467 PolarHBondContact O-N 3.42Å; A464-L467 PolarHBondContact O-N 3.01Å; L467-I470 HydrophobicContact CD2-CD1 4.44Å; L467-I470 PolarHBondContact O-N 2.98Å; L467-Q471 WeakPolarHBondContact O-CG 3.23Å; L467-Q471 PolarHBondContact O-N 3Å; L467-L519 WeakPolarHBondContact CD1-O 3.47Å; L467-L519 HydrophobicContact CD2-CB 4.42Å; L467-L519 HydrophobicContact CD2-CD2 3.99Å; L467-W524 HydrophobicContact CD2-CB 4.49Å; L467-W524 HydrophobicContact CD2-CD2 4.09Å; L467-W524 HydrophobicContact CD2-CG 3.9Å
468	Q	89.4	Confident	83.5	Confident	106 Å²	106	69.5 Å²	69.5	50%	0.495	38%	0.38	S	S	.	.	H	α-helix	trans	-64.9	-39.6	170.7	-170.9	179.2	11.3	0	0	111.4	A464 M465 A466 I470 Q471 N472	A464-Q468 WeakPolarHBondContact O-CB 3.33Å; A464-Q468 PolarHBondContact O-N 3.41Å; M465-Q468 PolarHBondContact O-N 3Å; A466-Q468 VanDerWaalsContact C-N 3.33Å; Q468-I470 VanDerWaalsContact C-N 3.27Å; Q468-I470 PolarHBondContact O-N 3.22Å; Q468-Q471 PolarHBondContact O-N 3.14Å; Q468-Q471 VanDerWaalsContact O-N 3.16Å; Q468-N472 WeakPolarHBondContact O-CB 3.36Å; Q468-N472 PolarHBondContact O-N 2.66Å; Q468-N472 PolarHBondContact O-OD1 3.48Å
469	S	91.6	Very high	86	Confident	63 Å²	63	63.9 Å²	63.9	44%	0.441	35%	0.351	S	S	.	.	H	α-helix	trans	-59.2	-37.9	173.3	-163.8	0	0	0	0	112.4	M465 A466	M465-S469 PolarHBondContact O-N 3.37Å; A466-S469 WeakPolarHBondContact O-CB 3.24Å; A466-S469 PolarHBondContact O-N 2.86Å
470	I	94.5	Very high	87.9	Confident	0 Å²	0	60 Å²	60	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-67.9	-43.3	174.2	-67	162	0	0	0	110.8	A466 L467 Q468 N472 M473 N476 L497 R529 M532 S533	A466-I470 WeakPolarHBondContact O-CG1 3.23Å; A466-I470 PolarHBondContact O-N 3.39Å; A466-I470 VanDerWaalsContact O-N 3.1Å; L467-I470 HydrophobicContact CD2-CD1 4.44Å; L467-I470 PolarHBondContact O-N 2.98Å; Q468-I470 VanDerWaalsContact C-N 3.27Å; Q468-I470 PolarHBondContact O-N 3.22Å; I470-N472 VanDerWaalsContact C-N 3.28Å; I470-N472 PolarHBondContact O-N 3.25Å; I470-M473 WeakPolarHBondContact O-CB 3.39Å; I470-M473 WeakPolarHBondContact O-CG 3.13Å; I470-M473 PolarHBondContact O-N 2.96Å; I470-N476 PolarHBondContact O-ND2 2.64Å; I470-L497 HydrophobicContact CG2-CD1 4.33Å; I470-L497 HydrophobicContact CG2-CD2 4.11Å; I470-L497 HydrophobicContact CG2-CG 4.49Å; I470-R529 HydrophobicContact CD1-CB 4.24Å; I470-R529 HydrophobicContact CD1-CG 4.09Å; I470-M532 HydrophobicContact CD1-CB 3.71Å; I470-M532 HydrophobicContact CG1-CB 3.83Å; I470-M532 HydrophobicContact CG2-CB 3.86Å; I470-M532 HydrophobicContact CG2-CE 4.33Å; I470-S533 WeakPolarHBondContact CG1-OG 3.3Å
471	Q	94.2	Very high	89.6	Confident	60 Å²	60	56.8 Å²	56.8	28%	0.28	30%	0.304	S	S	.	.	H	α-helix	trans	-64.4	-32	177.6	-73.1	167.5	-7.7	0	0	112.7	L467 Q468 M473 N476 L497 L519	L467-Q471 WeakPolarHBondContact O-CG 3.23Å; L467-Q471 PolarHBondContact O-N 3Å; Q468-Q471 PolarHBondContact O-N 3.14Å; Q468-Q471 VanDerWaalsContact O-N 3.16Å; Q471-M473 VanDerWaalsContact C-N 3.3Å; Q471-M473 PolarHBondContact O-N 2.82Å; Q471-N476 WeakPolarHBondContact O-CB 3.48Å; Q471-L497 HydrophobicContact CG-CD1 4.31Å; Q471-L519 HydrophobicContact CG-CD1 3.9Å
472	N	94.6	Very high	91.1	Very high	121 Å²	121	51.5 Å²	51.5	65%	0.647	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.5	-0.6	179.1	-68.8	-2.5	0	0	0	114.4	Q468 I470	Q468-N472 WeakPolarHBondContact O-CB 3.36Å; Q468-N472 PolarHBondContact O-N 2.66Å; Q468-N472 PolarHBondContact O-OD1 3.48Å; I470-N472 VanDerWaalsContact C-N 3.28Å; I470-N472 PolarHBondContact O-N 3.25Å
473	M	95.3	Very high	92.3	Very high	50 Å²	50	53.9 Å²	53.9	25%	0.246	28%	0.284	C	S	.	.	S	Bend	trans	-64.7	156.5	175.3	-71.3	-68.8	-73.2	0	0	111.9	I470 Q471 G475 N476 S533	I470-M473 WeakPolarHBondContact O-CB 3.39Å; I470-M473 WeakPolarHBondContact O-CG 3.13Å; I470-M473 PolarHBondContact O-N 2.96Å; Q471-M473 VanDerWaalsContact C-N 3.3Å; Q471-M473 PolarHBondContact O-N 2.82Å; M473-G475 PolarHBondContact O-N 3.09Å; M473-N476 HydrophobicContact CB-CB 4.11Å; M473-N476 WeakPolarHBondContact O-CB 3.44Å; M473-N476 PolarHBondContact O-N 3.19Å; M473-S533 VanDerWaalsContact CE-O 3.23Å; M473-S533 WeakPolarHBondContact CE-O 3.29Å
474	R	95.8	Very high	93.6	Very high	188 Å²	188	52.5 Å²	52.5	71%	0.709	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	127.3	177.2	-62.2	-164.4	-61	164.2	1.8	111	N476 N537 D538	R474-N476 VanDerWaalsContact C-N 3.26Å; R474-N476 PolarHBondContact O-N 3.42Å; R474-N537 PolarHBondContact O-N 2.81Å; R474-D538 VanDerWaalsContact C-CG 3.46Å; R474-D538 VanDerWaalsContact C-OD2 3.23Å; R474-D538 HydrophobicContact CB-CB 4.03Å; R474-D538 VanDerWaalsContact CB-OD2 3.31Å; R474-D538 WeakPolarHBondContact CB-OD2 3.43Å; R474-D538 PolarHBondContact O-N 2.91Å
475	G	96.1	Very high	94.3	Very high	20 Å²	20	55.6 Å²	55.6	21%	0.206	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	79.2	-17.2	-174.5	0	0	0	0	0	116.5	M473 A477 H478 N537 D538	M473-G475 PolarHBondContact O-N 3.09Å; G475-A477 PolarHBondContact O-N 2.89Å; G475-A477 VanDerWaalsContact O-N 3.11Å; G475-H478 PolarHBondContact O-N 2.86Å; G475-H478 VanDerWaalsContact O-N 3.14Å; G475-N537 PolarHBondContact O-ND2 3.4Å; G475-D538 VanDerWaalsContact CA-CG 3.43Å; G475-D538 WeakPolarHBondContact CA-OD1 3.26Å; G475-D538 PolarHBondContact N-OD1 2.95Å; G475-D538 PolarHBondContact N-OD2 3.5Å
476	N	97.7	Very high	94.9	Very high	2 Å²	2	55.7 Å²	55.7	1%	0.011	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.2	-5.7	-170.2	-82	12.7	0	0	0	114.8	I470 Q471 M473 R474 H478 P487 L497 G536 N537	I470-N476 PolarHBondContact O-ND2 2.64Å; Q471-N476 WeakPolarHBondContact O-CB 3.48Å; M473-N476 HydrophobicContact CB-CB 4.11Å; M473-N476 WeakPolarHBondContact O-CB 3.44Å; M473-N476 PolarHBondContact O-N 3.19Å; R474-N476 VanDerWaalsContact C-N 3.26Å; R474-N476 PolarHBondContact O-N 3.42Å; N476-H478 PolarHBondContact O-N 2.92Å; N476-P487 WeakPolarHBondContact O-CD 3.28Å; N476-P487 VanDerWaalsContact O-CG 3.22Å; N476-P487 WeakPolarHBondContact O-CG 3.45Å; N476-L497 HydrophobicContact CB-CD1 3.77Å; N476-L497 HydrophobicContact CB-CG 4.28Å; N476-G536 WeakPolarHBondContact OD1-CA 3.35Å; N476-N537 WeakPolarHBondContact OD1-CB 3.26Å; N476-N537 PolarHBondContact OD1-N 2.8Å; N476-N537 PolarHBondContact OD1-OD1 2.63Å
477	A	97.1	Very high	95.7	Very high	53 Å²	53	54.8 Å²	54.8	44%	0.438	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-21.3	168.4	0	0	0	0	0	113.6	G475 Q485 N486 P487	G475-A477 PolarHBondContact O-N 2.89Å; G475-A477 VanDerWaalsContact O-N 3.11Å; A477-Q485 CarbonylContact O-C 3.59Å; A477-N486 PolarHBondContact O-N 3.22Å; A477-P487 WeakPolarHBondContact O-CD 3.49Å
478	H	98.1	Very high	96.1	Very high	93 Å²	93	57.5 Å²	57.5	43%	0.431	29%	0.291	S	S	.	.	B	Isolated β-bridge	trans	-127.2	149.4	-175.1	-60.2	109	0	0	0	111.2	G475 N476 V480 E483 N537	G475-H478 PolarHBondContact O-N 2.86Å; G475-H478 VanDerWaalsContact O-N 3.14Å; N476-H478 PolarHBondContact O-N 2.92Å; H478-V480 PolarHBondContact O-N 2.84Å; H478-E483 WeakPolarHBondContact CB-O 3.45Å; H478-E483 PolarHBondContact CD2-O 3.04Å; H478-N537 PolarHBondContact O-ND2 3.02Å
479	C	98.4	Very high	96.5	Very high	2 Å²	2	54.1 Å²	54.1	1%	0.014	27%	0.274	C	S	.	.			trans	-59.1	127.1	175.9	179.5	0	0	0	0	110.8	D481 C482 E483 T484 C499	C479-D481 PolarHBondContact O-N 3.33Å; C479-C482 PolarHBondContact O-N 3.46Å; C479-C482 PolarHBondContact SG-SG 2.71Å; C479-E483 WeakPolarHBondContact O-CA 3.25Å; C479-E483 PolarHBondContact O-N 3.38Å; C479-T484 WeakPolarHBondContact CB-O 3.48Å; C479-T484 PolarHBondContact N-O 3.18Å; C479-C499 HydrophobicContact CB-CB 4.08Å; C479-C499 PolarHBondContact SG-N 2.97Å
480	V	98.3	Very high	96.9	Very high	1 Å²	1	51.1 Å²	51.1	1%	0.006	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.5	-28	-177.3	69.2	0	0	0	0	114.2	H478 V496 L497 M498 N537 N541 K553 K570	H478-V480 PolarHBondContact O-N 2.84Å; V480-V496 HydrophobicContact CB-CB 4.03Å; V480-V496 HydrophobicContact CB-CG1 4.47Å; V480-V496 HydrophobicContact CG1-CB 3.93Å; V480-V496 HydrophobicContact CG1-CG2 3.9Å; V480-V496 HydrophobicContact CG2-CB 3.89Å; V480-V496 HydrophobicContact CG2-CG1 3.78Å; V480-L497 WeakPolarHBondContact CB-O 3.3Å; V480-L497 WeakPolarHBondContact CG1-O 3.39Å; V480-L497 PolarHBondContact N-O 3.34Å; V480-M498 HydrophobicContact CG1-CB 4.2Å; V480-N537 HydrophobicContact CB-CB 4.28Å; V480-N537 HydrophobicContact CG2-CB 4.12Å; V480-N537 PolarHBondContact N-ND2 3.45Å; V480-N541 VanDerWaalsContact CG2-OD1 3.23Å; V480-N541 WeakPolarHBondContact CG2-OD1 3.31Å; V480-N541 PolarHBondContact O-ND2 3.35Å; V480-N541 PolarHBondContact O-OD1 2.86Å; V480-K553 VanDerWaalsContact O-CE 3.26Å; V480-K553 WeakPolarHBondContact O-CE 3.35Å; V480-K553 PolarHBondContact O-NZ 2.88Å; V480-K570 PolarHBondContact O-NZ 2.97Å; V480-K570 VanDerWaalsContact O-NZ 3.15Å
481	D	98.4	Very high	97	Very high	1 Å²	1	51.1 Å²	51.1	1%	0.005	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.9	-27	-173.5	-56.2	-45.9	0	0	0	114.7	C479 H506 P554 I567 K570 Y571	C479-D481 PolarHBondContact O-N 3.33Å; D481-H506 IonicContact OD1-NE2 2.85Å; D481-H506 PolarHBondContact OD1-NE2 2.61Å; D481-H506 IonicContact OD2-CD2 2.68Å; D481-H506 IonicContact OD2-NE2 3.47Å; D481-H506 PolarHBondContact OD2-NE2 3.1Å; D481-P554 WeakPolarHBondContact O-CG 3.41Å; D481-I567 HydrophobicContact CB-CD1 3.94Å; D481-I567 HydrophobicContact CB-CG1 3.81Å; D481-K570 IonicContact OD1-NZ 2.7Å; D481-K570 PolarHBondContact OD1-NZ 3.5Å; D481-Y571 VanDerWaalsContact OD1-CE2 3.26Å; D481-Y571 WeakPolarHBondContact OD1-CE2 3.49Å; D481-Y571 PolarHBondContact OD1-OH 2.9Å
482	C	97.8	Very high	97.2	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-141.3	14.2	-173.7	71.8	0	0	0	0	115.5	C479 T484 C499 C502 P554 S555 E556 K563	C479-C482 PolarHBondContact O-N 3.46Å; C479-C482 PolarHBondContact SG-SG 2.71Å; C482-T484 PolarHBondContact O-N 2.68Å; C482-T484 PolarHBondContact SG-OG1 3.21Å; C482-T484 VanDerWaalsContact SG-OG1 3.36Å; C482-C499 VanDerWaalsContact SG-SG 3.64Å; C482-C502 PolarHBondContact SG-SG 2.86Å; C482-P554 CarbonylContact C-O 3.37Å; C482-P554 VanDerWaalsContact CA-O 3.27Å; C482-P554 WeakPolarHBondContact CA-O 3.4Å; C482-P554 HydrophobicContact CB-CG 4.24Å; C482-S555 CarbonylContact O-C 3.59Å; C482-S555 VanDerWaalsContact O-C 3.25Å; C482-E556 PolarHBondContact O-N 3.23Å; C482-K563 HydrophobicContact CB-CD 4.37Å; C482-K563 HydrophobicContact CB-CG 4.12Å
483	E	97.3	Very high	97.3	Very high	109 Å²	109	43 Å²	43	51%	0.509	21%	0.212	S	C	.	.			trans	64.1	-7.1	172.6	-52.9	-173.5	166.1	0	0	117.3	H478 C479 Q485 K553	H478-E483 WeakPolarHBondContact CB-O 3.45Å; H478-E483 PolarHBondContact CD2-O 3.04Å; C479-E483 WeakPolarHBondContact O-CA 3.25Å; C479-E483 PolarHBondContact O-N 3.38Å; E483-Q485 PolarHBondContact O-N 2.83Å; E483-K553 HydrophobicContact CG-CD 4.28Å
484	T	97.9	Very high	97.4	Very high	23 Å²	23	40.8 Å²	40.8	14%	0.141	20%	0.201	C	C	.	.			trans	-44	124.2	171.5	-57.7	0	0	0	0	111.9	C479 C482 C499 E556	C479-T484 WeakPolarHBondContact CB-O 3.48Å; C479-T484 PolarHBondContact N-O 3.18Å; C482-T484 PolarHBondContact O-N 2.68Å; C482-T484 PolarHBondContact SG-OG1 3.21Å; C482-T484 VanDerWaalsContact SG-OG1 3.36Å; T484-C499 HydrophobicContact CG2-CB 3.85Å; T484-E556 HydrophobicContact CG2-CG 4.19Å; T484-E556 WeakPolarHBondContact OG1-CG 3.45Å
485	Q	97.4	Very high	97.5	Very high	121 Å²	121	31.9 Å²	31.9	57%	0.565	17%	0.167	S	C	*	.	B	Isolated β-bridge	trans	-64.4	156.2	-173.8	-68.6	166.7	63.8	0	0	113.6	A477 E483	A477-Q485 CarbonylContact O-C 3.59Å; E483-Q485 PolarHBondContact O-N 2.83Å
486	N	95.1	Very high	97.6	Very high	114 Å²	114	30.9 Å²	30.9	61%	0.61	16%	0.157	S	C	*	.	S	Bend	trans	53	53.9	173.2	-62.6	-70.6	0	0	0	114.7	A477 K488	A477-N486 PolarHBondContact O-N 3.22Å; N486-K488 WeakPolarHBondContact O-CG 3.37Å; N486-K488 PolarHBondContact O-N 3.43Å
487	P	97.4	Very high	97.6	Very high	3 Å²	3	30.8 Å²	30.8	2%	0.019	16%	0.156	C	C	.	.			trans	-58	132.9	-178.7	26.5	-36.7	0	0	0	113	N476 A477 L497 M498	N476-P487 WeakPolarHBondContact O-CD 3.28Å; N476-P487 VanDerWaalsContact O-CG 3.22Å; N476-P487 WeakPolarHBondContact O-CG 3.45Å; A477-P487 WeakPolarHBondContact O-CD 3.49Å; P487-L497 HydrophobicContact CB-CB 3.86Å; P487-L497 HydrophobicContact CG-CB 3.6Å; P487-L497 HydrophobicContact CG-CD1 4.26Å; P487-M498 VanDerWaalsContact CB-O 3.26Å; P487-M498 WeakPolarHBondContact CB-O 3.37Å
488	K	96.5	Very high	97.7	Very high	78 Å²	78	28.3 Å²	28.3	34%	0.339	14%	0.136	S	C	.	.			trans	-109.4	-1.9	-174.9	-61	-56.6	-167.7	156.4	0	114.7	N486 M498 L519 E520	N486-K488 WeakPolarHBondContact O-CG 3.37Å; N486-K488 PolarHBondContact O-N 3.43Å; K488-M498 PolarHBondContact N-O 3.13Å; K488-L519 PolarHBondContact O-N 2.93Å; K488-E520 WeakPolarHBondContact CD-OE1 3.16Å; K488-E520 WeakPolarHBondContact CE-OE1 3.4Å; K488-E520 IonicContact NZ-OE1 2.7Å; K488-E520 PolarHBondContact NZ-OE1 3.01Å
489	W	98.3	Very high	97.7	Very high	34 Å²	34	24.3 Å²	24.3	13%	0.129	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	158.8	178.3	-62.9	84.3	0	0	0	109.6	L497 M498 I500 V516 R517 S518 L521	W489-L497 CarbonylContact O-C 3.25Å; W489-L497 VanDerWaalsContact O-CA 3.28Å; W489-L497 WeakPolarHBondContact O-CA 3.33Å; W489-M498 HydrophobicContact CB-CG 3.85Å; W489-M498 PolarHBondContact N-O 3.09Å; W489-M498 VanDerWaalsContact N-O 3.08Å; W489-M498 PolarHBondContact O-N 3.28Å; W489-I500 VanDerWaalsContact CD1-CA 3.49Å; W489-V516 HydrophobicContact CE3-CG1 4.07Å; W489-R517 CarbonylContact C-O 3.59Å; W489-R517 VanDerWaalsContact CA-O 3.32Å; W489-R517 WeakPolarHBondContact CA-O 3.22Å; W489-S518 VanDerWaalsContact CZ3-CB 3.47Å; W489-L521 HydrophobicContact CH2-CD1 4.18Å; W489-L521 HydrophobicContact CZ2-CD1 4.4Å
490	A	98.3	Very high	97.7	Very high	0 Å²	0	30 Å²	30	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	153.8	-177.9	0	0	0	0	0	110.9	V496 L497 V516 R517 L519 W524 M532	A490-V496 CarbonylContact C-O 3.52Å; A490-V496 WeakPolarHBondContact CA-O 3.46Å; A490-L497 HydrophobicContact CB-CD2 3.65Å; A490-V516 CarbonylContact O-C 3.52Å; A490-V516 VanDerWaalsContact O-CA 3.26Å; A490-V516 WeakPolarHBondContact O-CA 3.22Å; A490-R517 PolarHBondContact N-O 3.17Å; A490-R517 PolarHBondContact O-N 3.47Å; A490-L519 HydrophobicContact CB-CD2 4.48Å; A490-W524 HydrophobicContact CB-CH2 3.88Å; A490-W524 HydrophobicContact CB-CZ2 4.28Å; A490-M532 HydrophobicContact CB-CE 3.91Å; A490-M532 HydrophobicContact CB-SD 4.32Å
491	S	98.4	Very high	97.7	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	115	161.9	-176	0	0	0	0	109.8	N493 L494 G495 V496 S514 R515	S491-N493 PolarHBondContact O-N 3.45Å; S491-N493 PolarHBondContact OG-OD1 3.13Å; S491-L494 PolarHBondContact O-N 2.91Å; S491-G495 PolarHBondContact O-N 3.24Å; S491-V496 PolarHBondContact N-O 3.48Å; S491-V496 PolarHBondContact O-N 2.97Å; S491-S514 VanDerWaalsContact CB-OG 3.29Å; S491-S514 WeakPolarHBondContact CB-OG 3.37Å; S491-S514 WeakPolarHBondContact OG-CA 3.28Å; S491-S514 PolarHBondContact OG-OG 3.44Å; S491-R515 PolarHBondContact OG-N 3.32Å
492	L	97.3	Very high	97.7	Very high	7 Å²	7	32.7 Å²	32.7	4%	0.037	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-45.1	-168.4	-63.6	172.7	0	0	0	112.9	L494 G495 R515 R517 W524 L528 M532 W645	L492-L494 VanDerWaalsContact C-N 3.31Å; L492-L494 PolarHBondContact O-N 3.02Å; L492-G495 PolarHBondContact O-N 3.43Å; L492-R515 HydrophobicContact CB-CB 4.1Å; L492-R515 HydrophobicContact CD1-CB 4.45Å; L492-R515 WeakPolarHBondContact CG-O 3.37Å; L492-R515 PolarHBondContact N-O 3.38Å; L492-R517 HydrophobicContact CD1-CG 3.76Å; L492-R517 HydrophobicContact CD2-CG 4.22Å; L492-R517 HydrophobicContact CG-CG 3.97Å; L492-W524 HydrophobicContact CD2-CE3 4.48Å; L492-W524 HydrophobicContact CD2-CH2 3.54Å; L492-W524 HydrophobicContact CD2-CZ3 3.45Å; L492-W524 VanDerWaalsContact CD2-CZ3 3.45Å; L492-L528 HydrophobicContact CD1-CD1 3.9Å; L492-L528 HydrophobicContact CD1-CD2 4.23Å; L492-L528 HydrophobicContact CD2-CB 4.26Å; L492-L528 HydrophobicContact CD2-CD1 4.03Å; L492-L528 HydrophobicContact CD2-CD2 4.46Å; L492-L528 HydrophobicContact CD2-CG 4.49Å; L492-M532 HydrophobicContact CD2-CG 4.5Å; L492-M532 HydrophobicContact CD2-SD 4.49Å; L492-W645 VanDerWaalsContact C-CZ3 3.48Å; L492-W645 HydrophobicContact CB-CH2 3.66Å; L492-W645 HydrophobicContact CB-CZ2 4.18Å; L492-W645 HydrophobicContact CB-CZ3 3.9Å; L492-W645 HydrophobicContact CD1-CZ2 4.4Å; L492-W645 WeakPolarHBondContact O-CZ3 3.49Å
493	N	96.3	Very high	97.7	Very high	5 Å²	5	32.9 Å²	32.9	3%	0.027	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78	-15.4	-176.5	65	-75.3	0	0	0	114	S491 L513 R515 W645 Y646	S491-N493 PolarHBondContact O-N 3.45Å; S491-N493 PolarHBondContact OG-OD1 3.13Å; N493-L513 PolarHBondContact ND2-O 3.41Å; N493-R515 HydrophobicContact CB-CG 4.46Å; N493-R515 WeakPolarHBondContact OD1-CB 3.42Å; N493-R515 WeakPolarHBondContact OD1-CG 3.27Å; N493-R515 PolarHBondContact OD1-N 3.28Å; N493-W645 HydrophobicContact CB-CB 4.09Å; N493-W645 HydrophobicContact CB-CD2 4.24Å; N493-W645 HydrophobicContact CB-CE3 3.78Å; N493-W645 HydrophobicContact CB-CG 4.44Å; N493-Y646 HydrophobicContact CB-CE2 4.41Å; N493-Y646 PolarHBondContact O-OH 2.77Å
494	L	97.9	Very high	97.7	Very high	3 Å²	3	29.1 Å²	29.1	2%	0.016	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.1	-21.7	174	-60	175.4	0	0	0	111.5	S491 L492 V496 H506 W544 Y571	S491-L494 PolarHBondContact O-N 2.91Å; L492-L494 VanDerWaalsContact C-N 3.31Å; L492-L494 PolarHBondContact O-N 3.02Å; L494-V496 HydrophobicContact CB-CG1 4.15Å; L494-V496 HydrophobicContact CB-CG2 3.8Å; L494-V496 HydrophobicContact CD1-CG2 4.43Å; L494-H506 WeakPolarHBondContact CD1-CE1 3.33Å; L494-W544 HydrophobicContact CD2-CH2 4.46Å; L494-W544 HydrophobicContact CD2-CZ2 3.65Å; L494-Y571 HydrophobicContact CD1-CD1 3.85Å; L494-Y571 HydrophobicContact CD1-CE1 3.66Å; L494-Y571 HydrophobicContact CD1-CG 4.44Å; L494-Y571 HydrophobicContact CD2-CD1 4.16Å; L494-Y571 HydrophobicContact CD2-CE1 4.28Å
495	G	97.6	Very high	97.8	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	80	18.3	-179.9	0	0	0	0	0	115.2	S491 L492 M532 G536	S491-G495 PolarHBondContact O-N 3.24Å; L492-G495 PolarHBondContact O-N 3.43Å; G495-M532 VanDerWaalsContact C-CE 3.46Å; G495-M532 WeakPolarHBondContact O-CE 3.5Å; G495-G536 PolarHBondContact O-N 3.43Å; G495-G536 VanDerWaalsContact O-N 3.13Å
496	V	98.4	Very high	97.8	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	152.8	-163.6	-59.1	0	0	0	0	114.1	V480 A490 S491 L494 M498 N537 A540	V480-V496 HydrophobicContact CB-CB 4.03Å; V480-V496 HydrophobicContact CB-CG1 4.47Å; V480-V496 HydrophobicContact CG1-CB 3.93Å; V480-V496 HydrophobicContact CG1-CG2 3.9Å; V480-V496 HydrophobicContact CG2-CB 3.89Å; V480-V496 HydrophobicContact CG2-CG1 3.78Å; A490-V496 CarbonylContact C-O 3.52Å; A490-V496 WeakPolarHBondContact CA-O 3.46Å; S491-V496 PolarHBondContact N-O 3.48Å; S491-V496 PolarHBondContact O-N 2.97Å; L494-V496 HydrophobicContact CB-CG1 4.15Å; L494-V496 HydrophobicContact CB-CG2 3.8Å; L494-V496 HydrophobicContact CD1-CG2 4.43Å; V496-M498 HydrophobicContact CG2-CE 3.87Å; V496-N537 VanDerWaalsContact CA-OD1 3.24Å; V496-N537 WeakPolarHBondContact CA-OD1 3.19Å; V496-N537 WeakPolarHBondContact CB-OD1 3.38Å; V496-A540 HydrophobicContact CG1-CB 3.19Å
497	L	98.6	Very high	97.9	Very high	0 Å²	0	23 Å²	23	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	137.3	168.7	-59.1	-169.2	0	0	0	112.8	I470 Q471 N476 V480 P487 W489 A490 L519 M532 N537	I470-L497 HydrophobicContact CG2-CD1 4.33Å; I470-L497 HydrophobicContact CG2-CD2 4.11Å; I470-L497 HydrophobicContact CG2-CG 4.49Å; Q471-L497 HydrophobicContact CG-CD1 4.31Å; N476-L497 HydrophobicContact CB-CD1 3.77Å; N476-L497 HydrophobicContact CB-CG 4.28Å; V480-L497 WeakPolarHBondContact CB-O 3.3Å; V480-L497 WeakPolarHBondContact CG1-O 3.39Å; V480-L497 PolarHBondContact N-O 3.34Å; P487-L497 HydrophobicContact CB-CB 3.86Å; P487-L497 HydrophobicContact CG-CB 3.6Å; P487-L497 HydrophobicContact CG-CD1 4.26Å; W489-L497 CarbonylContact O-C 3.25Å; W489-L497 VanDerWaalsContact O-CA 3.28Å; W489-L497 WeakPolarHBondContact O-CA 3.33Å; A490-L497 HydrophobicContact CB-CD2 3.65Å; L497-L519 HydrophobicContact CD1-CD1 4.02Å; L497-L519 HydrophobicContact CD2-CD1 4.01Å; L497-L519 HydrophobicContact CD2-CD2 3.99Å; L497-L519 HydrophobicContact CD2-CG 4.31Å; L497-M532 HydrophobicContact CD2-CE 3.74Å; L497-M532 HydrophobicContact CG-CE 4.49Å; L497-N537 PolarHBondContact N-OD1 3.02Å; L497-N537 PolarHBondContact O-ND2 3.25Å
498	M	98.4	Very high	97.9	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	156.4	-176.3	59.7	-172.7	60.3	0	0	112.2	V480 P487 K488 W489 V496 C502 S503 H506	V480-M498 HydrophobicContact CG1-CB 4.2Å; P487-M498 VanDerWaalsContact CB-O 3.26Å; P487-M498 WeakPolarHBondContact CB-O 3.37Å; K488-M498 PolarHBondContact N-O 3.13Å; W489-M498 HydrophobicContact CB-CG 3.85Å; W489-M498 PolarHBondContact N-O 3.09Å; W489-M498 VanDerWaalsContact N-O 3.08Å; W489-M498 PolarHBondContact O-N 3.28Å; V496-M498 HydrophobicContact CG2-CE 3.87Å; M498-C502 HydrophobicContact CB-CB 4.19Å; M498-S503 VanDerWaalsContact SD-CA 3.56Å; M498-H506 HydrophobicContact CE-CB 4.35Å; M498-H506 VanDerWaalsContact CE-CD2 3.45Å; M498-H506 WeakPolarHBondContact CE-CD2 3.39Å; M498-H506 HydrophobicContact SD-CB 3.97Å; M498-H506 VanDerWaalsContact SD-CD2 3.6Å
499	C	98.4	Very high	97.9	Very high	10 Å²	10	23.2 Å²	23.2	7%	0.068	12%	0.122	C	C	.	.			trans	-73	169.8	173.2	75.2	0	0	0	0	111.2	C479 C482 T484 E501 C502 S503	C479-C499 HydrophobicContact CB-CB 4.08Å; C479-C499 PolarHBondContact SG-N 2.97Å; C482-C499 VanDerWaalsContact SG-SG 3.64Å; T484-C499 HydrophobicContact CG2-CB 3.85Å; C499-E501 VanDerWaalsContact C-N 3.32Å; C499-E501 PolarHBondContact O-N 3.46Å; C499-C502 VanDerWaalsContact SG-SG 3.64Å; C499-S503 WeakPolarHBondContact O-CB 3.3Å; C499-S503 PolarHBondContact O-N 2.85Å
500	I	97.2	Very high	97.7	Very high	122 Å²	122	23 Å²	23	63%	0.626	13%	0.131	S	C	*	.	H	α-helix	trans	-60.4	-39	-177.8	-171.8	165.2	0	0	0	113	W489 S503 G504	W489-I500 VanDerWaalsContact CD1-CA 3.49Å; I500-S503 PolarHBondContact O-N 3.32Å; I500-S503 PolarHBondContact O-OG 2.86Å; I500-G504 PolarHBondContact O-N 3.21Å; I500-G504 VanDerWaalsContact O-N 3.11Å
501	E	98.2	Very high	97.5	Very high	57 Å²	57	28 Å²	28	27%	0.266	16%	0.161	S	C	.	.	H	α-helix	trans	-66.1	-51	-179.2	-175.4	-178	-164.4	0	0	112.1	C499 S503 G504 I505 R560 K563	C499-E501 VanDerWaalsContact C-N 3.32Å; C499-E501 PolarHBondContact O-N 3.46Å; E501-S503 VanDerWaalsContact C-N 3.28Å; E501-S503 PolarHBondContact O-N 3.46Å; E501-G504 WeakPolarHBondContact O-CA 3.48Å; E501-G504 PolarHBondContact O-N 3.41Å; E501-I505 PolarHBondContact O-N 3.05Å; E501-R560 WeakPolarHBondContact OE1-CA 3.27Å; E501-R560 WeakPolarHBondContact OE1-CB 3.36Å; E501-K563 IonicContact OE1-NZ 2.76Å; E501-K563 WeakPolarHBondContact OE2-CD 3.39Å; E501-K563 WeakPolarHBondContact OE2-CE 3.19Å; E501-K563 IonicContact OE2-NZ 3.67Å; E501-K563 PolarHBondContact OE2-NZ 3.4Å
502	C	98.6	Very high	97.1	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-61	-37	174.5	-65.3	0	0	0	0	111.4	C482 M498 C499 G504 I505 H506 I567	C482-C502 PolarHBondContact SG-SG 2.86Å; M498-C502 HydrophobicContact CB-CB 4.19Å; C499-C502 VanDerWaalsContact SG-SG 3.64Å; C502-G504 PolarHBondContact O-N 3.37Å; C502-I505 WeakPolarHBondContact O-CB 3.41Å; C502-I505 PolarHBondContact O-N 3.09Å; C502-H506 PolarHBondContact O-CD2 2.96Å; C502-H506 PolarHBondContact O-N 3.22Å; C502-I567 HydrophobicContact CB-CD1 3.83Å
503	S	98.4	Very high	97	Very high	4 Å²	4	41 Å²	41	3%	0.028	21%	0.214	C	C	.	.	H	α-helix	trans	-60.4	-31.9	172.5	91	0	0	0	0	113	M498 C499 I500 E501 R507	M498-S503 VanDerWaalsContact SD-CA 3.56Å; C499-S503 WeakPolarHBondContact O-CB 3.3Å; C499-S503 PolarHBondContact O-N 2.85Å; I500-S503 PolarHBondContact O-N 3.32Å; I500-S503 PolarHBondContact O-OG 2.86Å; E501-S503 VanDerWaalsContact C-N 3.28Å; E501-S503 PolarHBondContact O-N 3.46Å; S503-R507 WeakPolarHBondContact O-CD 3.39Å; S503-R507 VanDerWaalsContact O-CG 3.22Å; S503-R507 WeakPolarHBondContact O-CG 3.46Å; S503-R507 PolarHBondContact O-N 2.97Å
504	G	97.9	Very high	97	Very high	30 Å²	30	40.9 Å²	40.9	31%	0.309	21%	0.213	S	C	.	.	H	α-helix	trans	-67.6	-38.5	172.7	0	0	0	0	0	112.7	I500 E501 C502	I500-G504 PolarHBondContact O-N 3.21Å; I500-G504 VanDerWaalsContact O-N 3.11Å; E501-G504 WeakPolarHBondContact O-CA 3.48Å; E501-G504 PolarHBondContact O-N 3.41Å; C502-G504 PolarHBondContact O-N 3.37Å
505	I	98.4	Very high	97	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-69.2	-48.8	175.2	-61.2	163.4	0	0	0	110.3	E501 C502 R507 S508 R560 K563 E564 I567	E501-I505 PolarHBondContact O-N 3.05Å; C502-I505 WeakPolarHBondContact O-CB 3.41Å; C502-I505 PolarHBondContact O-N 3.09Å; I505-R507 PolarHBondContact O-N 2.85Å; I505-R507 VanDerWaalsContact O-N 3.14Å; I505-S508 WeakPolarHBondContact O-CA 3.38Å; I505-S508 WeakPolarHBondContact O-CB 3.44Å; I505-S508 PolarHBondContact O-N 2.79Å; I505-S508 PolarHBondContact O-OG 2.76Å; I505-R560 VanDerWaalsContact CG1-NH2 3.29Å; I505-K563 HydrophobicContact CD1-CB 3.85Å; I505-E564 HydrophobicContact CD1-CB 3.88Å; I505-E564 HydrophobicContact CG1-CB 4.12Å; I505-E564 HydrophobicContact CG1-CG 4.44Å; I505-E564 HydrophobicContact CG2-CB 4.09Å; I505-E564 HydrophobicContact CG2-CG 3.84Å; I505-I567 HydrophobicContact CB-CD1 4.06Å; I505-I567 HydrophobicContact CD1-CD1 3.92Å; I505-I567 HydrophobicContact CG2-CB 3.97Å; I505-I567 HydrophobicContact CG2-CD1 4.01Å; I505-I567 HydrophobicContact CG2-CG2 3.64Å
506	H	98.4	Very high	97	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-57.2	-28.6	178.4	-89.7	-91.8	0	0	0	113.6	D481 L494 M498 C502 S508 L509 S514 V516 Y571	D481-H506 IonicContact OD1-NE2 2.85Å; D481-H506 PolarHBondContact OD1-NE2 2.61Å; D481-H506 IonicContact OD2-CD2 2.68Å; D481-H506 IonicContact OD2-NE2 3.47Å; D481-H506 PolarHBondContact OD2-NE2 3.1Å; L494-H506 WeakPolarHBondContact CD1-CE1 3.33Å; M498-H506 HydrophobicContact CE-CB 4.35Å; M498-H506 VanDerWaalsContact CE-CD2 3.45Å; M498-H506 WeakPolarHBondContact CE-CD2 3.39Å; M498-H506 HydrophobicContact SD-CB 3.97Å; M498-H506 VanDerWaalsContact SD-CD2 3.6Å; C502-H506 PolarHBondContact O-CD2 2.96Å; C502-H506 PolarHBondContact O-N 3.22Å; H506-S508 VanDerWaalsContact C-N 3.31Å; H506-S508 PolarHBondContact O-N 3.14Å; H506-L509 PolarHBondContact O-N 3.35Å; H506-S514 WeakPolarHBondContact CB-OG 3.41Å; H506-S514 VanDerWaalsContact ND1-CB 3.33Å; H506-S514 WeakPolarHBondContact ND1-CB 3.49Å; H506-S514 PolarHBondContact ND1-OG 3.43Å; H506-V516 HydrophobicContact CB-CG2 3.69Å; H506-Y571 AromaticContact CE1-CD1 3.78Å; H506-Y571 AromaticContact CE1-CD2 2.95Å; H506-Y571 WeakPolarHBondContact CE1-CD2 3.33Å; H506-Y571 AromaticContact CE1-CE1 3.52Å; H506-Y571 AromaticContact CE1-CE2 2.62Å; H506-Y571 WeakPolarHBondContact CE1-CE2 3.44Å; H506-Y571 AromaticContact CE1-CG 3.52Å; H506-Y571 AromaticContact CE1-CZ 2.93Å; H506-Y571 PolarHBondContact CE1-OH 3.19Å; H506-Y571 AromaticContact NE2-CE2 3.16Å; H506-Y571 WeakPolarHBondContact NE2-CE2 3.37Å; H506-Y571 AromaticContact NE2-CZ 3.81Å
507	R	97.6	Very high	97	Very high	130 Å²	130	48.9 Å²	48.9	49%	0.491	24%	0.244	S	C	.	.	H	α-helix	trans	-65.4	-31.3	172.1	-73.9	164	-170.9	-75.3	-0.1	113.2	S503 I505 G510 V516	S503-R507 WeakPolarHBondContact O-CD 3.39Å; S503-R507 VanDerWaalsContact O-CG 3.22Å; S503-R507 WeakPolarHBondContact O-CG 3.46Å; S503-R507 PolarHBondContact O-N 2.97Å; I505-R507 PolarHBondContact O-N 2.85Å; I505-R507 VanDerWaalsContact O-N 3.14Å; R507-G510 PolarHBondContact O-N 3.46Å; R507-V516 HydrophobicContact CG-CB 4.25Å; R507-V516 HydrophobicContact CG-CG1 4.42Å; R507-V516 HydrophobicContact CG-CG2 4.12Å
508	S	97.1	Very high	96.8	Very high	68 Å²	68	49.1 Å²	49.1	48%	0.476	25%	0.246	S	C	.	.	H	α-helix	trans	-71.5	-28.7	178.3	76.7	0	0	0	0	113	I505 H506 G510 R568	I505-S508 WeakPolarHBondContact O-CA 3.38Å; I505-S508 WeakPolarHBondContact O-CB 3.44Å; I505-S508 PolarHBondContact O-N 2.79Å; I505-S508 PolarHBondContact O-OG 2.76Å; H506-S508 VanDerWaalsContact C-N 3.31Å; H506-S508 PolarHBondContact O-N 3.14Å; S508-G510 PolarHBondContact O-N 3.25Å; S508-R568 PolarHBondContact OG-NH2 3.43Å
509	L	96.4	Very high	96.6	Very high	17 Å²	17	49.2 Å²	49.2	9%	0.089	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-17.4	176.7	-52.8	-177.7	0	0	0	113.3	H506 L513 I567 R568	H506-L509 PolarHBondContact O-N 3.35Å; L509-L513 HydrophobicContact CB-CB 4.06Å; L509-L513 HydrophobicContact CB-CD1 4.1Å; L509-I567 HydrophobicContact CD1-CG2 3.85Å; L509-R568 HydrophobicContact CD2-CG 3.98Å
510	G	94.4	Very high	96.1	Very high	31 Å²	31	54.5 Å²	54.5	32%	0.32	27%	0.27	S	S	.	.			trans	76.5	164.8	-178.1	0	0	0	0	0	114.8	R507 S508 R512 L513 S514	R507-G510 PolarHBondContact O-N 3.46Å; S508-G510 PolarHBondContact O-N 3.25Å; G510-R512 PolarHBondContact O-N 2.64Å; G510-R512 VanDerWaalsContact O-N 3.12Å; G510-L513 PolarHBondContact O-N 3.24Å; G510-L513 VanDerWaalsContact O-N 3.15Å; G510-S514 PolarHBondContact O-N 3.48Å
511	T	93.3	Very high	95.7	Very high	104 Å²	104	55.5 Å²	55.5	64%	0.638	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.8	-6.5	-168	51.9	0	0	0	0	115.8	R515	T511-R515 WeakPolarHBondContact O-CG 3.11Å; T511-R515 PolarHBondContact O-NE 2.81Å
512	R	89.9	Confident	95.5	Very high	227 Å²	227	55.3 Å²	55.3	86%	0.857	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.3	-38.4	170.4	-63.9	-167	-61.2	170.3	2.4	111.7	G510	G510-R512 PolarHBondContact O-N 2.64Å; G510-R512 VanDerWaalsContact O-N 3.12Å
513	L	94.6	Very high	95	Very high	53 Å²	53	61.4 Å²	61.4	28%	0.277	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.3	-41.9	179.1	-63.4	178.3	0	0	0	111.5	N493 L509 G510 E572	N493-L513 PolarHBondContact ND2-O 3.41Å; L509-L513 HydrophobicContact CB-CB 4.06Å; L509-L513 HydrophobicContact CB-CD1 4.1Å; G510-L513 PolarHBondContact O-N 3.24Å; G510-L513 VanDerWaalsContact O-N 3.15Å; L513-E572 HydrophobicContact CD1-CB 4.02Å; L513-E572 HydrophobicContact CD1-CG 4.1Å
514	S	97.8	Very high	94.5	Very high	3 Å²	3	61.7 Å²	61.7	2%	0.021	31%	0.31	C	S	.	.			trans	-141.9	119.9	-175	-162.1	0	0	0	0	114.3	S491 H506 G510 V516	S491-S514 VanDerWaalsContact CB-OG 3.29Å; S491-S514 WeakPolarHBondContact CB-OG 3.37Å; S491-S514 WeakPolarHBondContact OG-CA 3.28Å; S491-S514 PolarHBondContact OG-OG 3.44Å; H506-S514 WeakPolarHBondContact CB-OG 3.41Å; H506-S514 VanDerWaalsContact ND1-CB 3.33Å; H506-S514 WeakPolarHBondContact ND1-CB 3.49Å; H506-S514 PolarHBondContact ND1-OG 3.43Å; G510-S514 PolarHBondContact O-N 3.48Å; S514-V516 PolarHBondContact O-N 2.79Å
515	R	97.3	Very high	94.1	Very high	62 Å²	62	63 Å²	63	23%	0.234	31%	0.313	C	S	.	.			trans	-100.2	76	179.6	-64.7	-179.4	-171.6	-132.6	4.6	110.4	S491 L492 N493 T511 W645	S491-R515 PolarHBondContact OG-N 3.32Å; L492-R515 HydrophobicContact CB-CB 4.1Å; L492-R515 HydrophobicContact CD1-CB 4.45Å; L492-R515 WeakPolarHBondContact CG-O 3.37Å; L492-R515 PolarHBondContact N-O 3.38Å; N493-R515 HydrophobicContact CB-CG 4.46Å; N493-R515 WeakPolarHBondContact OD1-CB 3.42Å; N493-R515 WeakPolarHBondContact OD1-CG 3.27Å; N493-R515 PolarHBondContact OD1-N 3.28Å; T511-R515 WeakPolarHBondContact O-CG 3.11Å; T511-R515 PolarHBondContact O-NE 2.81Å; R515-W645 PolarHBondContact NH2-O 3.01Å
516	V	98	Very high	93.6	Very high	10 Å²	10	66 Å²	66	6%	0.061	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	135.8	-172.3	-176	0	0	0	0	113.6	W489 A490 H506 R507 S514	W489-V516 HydrophobicContact CE3-CG1 4.07Å; A490-V516 CarbonylContact O-C 3.52Å; A490-V516 VanDerWaalsContact O-CA 3.26Å; A490-V516 WeakPolarHBondContact O-CA 3.22Å; H506-V516 HydrophobicContact CB-CG2 3.69Å; R507-V516 HydrophobicContact CG-CB 4.25Å; R507-V516 HydrophobicContact CG-CG1 4.42Å; R507-V516 HydrophobicContact CG-CG2 4.12Å; S514-V516 PolarHBondContact O-N 2.79Å
517	R	97.2	Very high	93.2	Very high	99 Å²	99	67 Å²	67	37%	0.374	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	155.2	171.4	-71.2	-63.8	-179.1	-84.8	4.4	112.1	W489 A490 L492 D522 W524	W489-R517 CarbonylContact C-O 3.59Å; W489-R517 VanDerWaalsContact CA-O 3.32Å; W489-R517 WeakPolarHBondContact CA-O 3.22Å; A490-R517 PolarHBondContact N-O 3.17Å; A490-R517 PolarHBondContact O-N 3.47Å; L492-R517 HydrophobicContact CD1-CG 3.76Å; L492-R517 HydrophobicContact CD2-CG 4.22Å; L492-R517 HydrophobicContact CG-CG 3.97Å; R517-D522 WeakPolarHBondContact CA-OD2 3.09Å; R517-D522 HydrophobicContact CB-CB 4.49Å; R517-D522 VanDerWaalsContact CD-CG 3.46Å; R517-D522 VanDerWaalsContact CD-OD2 3.28Å; R517-D522 WeakPolarHBondContact CD-OD2 2.62Å; R517-W524 HydrophobicContact CB-CH2 4.13Å; R517-W524 HydrophobicContact CB-CZ2 3.72Å
518	S	96.1	Very high	92.9	Very high	4 Å²	4	61.9 Å²	61.9	3%	0.028	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	139.4	168.3	-176.9	0	0	0	0	110.5	W489 E520 L521 D522 W524	W489-S518 VanDerWaalsContact CZ3-CB 3.47Å; S518-E520 PolarHBondContact O-N 3.43Å; S518-E520 PolarHBondContact OG-N 2.87Å; S518-E520 VanDerWaalsContact OG-N 3.16Å; S518-L521 PolarHBondContact OG-N 2.86Å; S518-D522 PolarHBondContact N-OD2 3.05Å; S518-W524 PolarHBondContact O-NE1 3.17Å
519	L	92.9	Very high	92.7	Very high	2 Å²	2	61.1 Å²	61.1	1%	0.01	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-24.3	169.7	-64.7	179.4	0	0	0	112.7	L467 Q471 K488 A490 L497 W524	L467-L519 WeakPolarHBondContact CD1-O 3.47Å; L467-L519 HydrophobicContact CD2-CB 4.42Å; L467-L519 HydrophobicContact CD2-CD2 3.99Å; Q471-L519 HydrophobicContact CG-CD1 3.9Å; K488-L519 PolarHBondContact O-N 2.93Å; A490-L519 HydrophobicContact CB-CD2 4.48Å; L497-L519 HydrophobicContact CD1-CD1 4.02Å; L497-L519 HydrophobicContact CD2-CD1 4.01Å; L497-L519 HydrophobicContact CD2-CD2 3.99Å; L497-L519 HydrophobicContact CD2-CG 4.31Å; L519-W524 HydrophobicContact CD2-CH2 4.22Å; L519-W524 HydrophobicContact CD2-CZ2 3.79Å
520	E	88.6	Confident	92.6	Very high	122 Å²	122	63.8 Å²	63.8	57%	0.57	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.6	-31.9	-168.8	-65.8	175.3	-179.4	0	0	113.2	K488 S518	K488-E520 WeakPolarHBondContact CD-OE1 3.16Å; K488-E520 WeakPolarHBondContact CE-OE1 3.4Å; K488-E520 IonicContact NZ-OE1 2.7Å; K488-E520 PolarHBondContact NZ-OE1 3.01Å; S518-E520 PolarHBondContact O-N 3.43Å; S518-E520 PolarHBondContact OG-N 2.87Å; S518-E520 VanDerWaalsContact OG-N 3.16Å
521	L	89.4	Confident	92.7	Very high	142 Å²	142	62.4 Å²	62.4	74%	0.743	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.8	-22	-175.7	-54.9	175.3	0	0	0	114.5	W489 S518	W489-L521 HydrophobicContact CH2-CD1 4.18Å; W489-L521 HydrophobicContact CZ2-CD1 4.4Å; S518-L521 PolarHBondContact OG-N 2.86Å
522	D	92.3	Very high	92.8	Very high	54 Å²	54	57.4 Å²	57.4	29%	0.289	27%	0.27	S	S	.	.	S	Bend	trans	-99.4	168	-177.7	-74.9	-61.9	0	0	0	112.8	K463 R517 S518	K463-D522 PolarHBondContact NZ-O 3.38Å; R517-D522 WeakPolarHBondContact CA-OD2 3.09Å; R517-D522 HydrophobicContact CB-CB 4.49Å; R517-D522 VanDerWaalsContact CD-CG 3.46Å; R517-D522 VanDerWaalsContact CD-OD2 3.28Å; R517-D522 WeakPolarHBondContact CD-OD2 2.62Å; S518-D522 PolarHBondContact N-OD2 3.05Å
523	D	88	Confident	93.1	Very high	128 Å²	128	48.5 Å²	48.5	68%	0.684	24%	0.242	S	C	*	.			trans	-91.6	145.2	169	-93.3	-38.4	0	0	0	113.7	K463 P525	K463-D523 IonicContact NZ-OD1 2.81Å; K463-D523 PolarHBondContact NZ-OD1 2.85Å; D523-P525 WeakPolarHBondContact O-CD 2.95Å
524	W	89.7	Confident	93.1	Very high	10 Å²	10	48.4 Å²	48.4	4%	0.038	25%	0.246	C	C	.	.			trans	-128.9	83.3	-167.2	-76.1	92.5	0	0	0	110.9	L467 A490 L492 R517 S518 L519 L528 R529 M532	L467-W524 HydrophobicContact CD2-CB 4.49Å; L467-W524 HydrophobicContact CD2-CD2 4.09Å; L467-W524 HydrophobicContact CD2-CG 3.9Å; A490-W524 HydrophobicContact CB-CH2 3.88Å; A490-W524 HydrophobicContact CB-CZ2 4.28Å; L492-W524 HydrophobicContact CD2-CE3 4.48Å; L492-W524 HydrophobicContact CD2-CH2 3.54Å; L492-W524 HydrophobicContact CD2-CZ3 3.45Å; L492-W524 VanDerWaalsContact CD2-CZ3 3.45Å; R517-W524 HydrophobicContact CB-CH2 4.13Å; R517-W524 HydrophobicContact CB-CZ2 3.72Å; S518-W524 PolarHBondContact O-NE1 3.17Å; L519-W524 HydrophobicContact CD2-CH2 4.22Å; L519-W524 HydrophobicContact CD2-CZ2 3.79Å; W524-L528 HydrophobicContact CE3-CB 3.9Å; W524-L528 HydrophobicContact CZ3-CB 4.11Å; W524-R529 HydrophobicContact CB-CG 3.89Å; W524-R529 HydrophobicContact CE3-CG 4.23Å; W524-R529 PolarHBondContact O-NE 3.32Å; W524-M532 HydrophobicContact CH2-CG 4.06Å; W524-M532 HydrophobicContact CZ3-CG 3.6Å
525	P	89.1	Confident	93	Very high	57 Å²	57	48.7 Å²	48.7	37%	0.37	25%	0.247	S	C	.	.			trans	-51.4	163.6	169.4	-26.5	35.2	0	0	0	113.2	D523 E527 L528 R529	D523-P525 WeakPolarHBondContact O-CD 2.95Å; P525-E527 WeakPolarHBondContact CB-OE2 3.31Å; P525-E527 PolarHBondContact O-N 2.82Å; P525-L528 HydrophobicContact CB-CG 4.46Å; P525-L528 HydrophobicContact CG-CD1 4.45Å; P525-L528 HydrophobicContact CG-CG 4.37Å; P525-L528 PolarHBondContact O-N 2.8Å; P525-R529 WeakPolarHBondContact O-CG 3.16Å; P525-R529 PolarHBondContact O-N 2.99Å; P525-R529 VanDerWaalsContact O-N 3.14Å; P525-R529 PolarHBondContact O-NE 3.39Å
526	V	87.6	Confident	93	Very high	62 Å²	62	45.7 Å²	45.7	38%	0.376	24%	0.236	S	C	.	.	H	α-helix	trans	-61.2	-40.3	-179.5	176.1	0	0	0	0	110.3	R529 K530	V526-R529 PolarHBondContact O-N 3.04Å; V526-K530 HydrophobicContact CG1-CD 4.37Å; V526-K530 HydrophobicContact CG1-CG 4.44Å; V526-K530 WeakPolarHBondContact O-CG 3.43Å; V526-K530 PolarHBondContact O-N 2.79Å
527	E	89	Confident	93	Very high	23 Å²	23	45.3 Å²	45.3	11%	0.107	23%	0.234	C	C	.	.	H	α-helix	trans	-58.5	-51.6	-179	-58.2	75.8	-172.6	0	0	110.9	P525 R529 K530 V531 V637 E671 N674 V675	P525-E527 WeakPolarHBondContact CB-OE2 3.31Å; P525-E527 PolarHBondContact O-N 2.82Å; E527-R529 PolarHBondContact O-N 3.07Å; E527-K530 PolarHBondContact O-N 3.48Å; E527-V531 PolarHBondContact O-N 2.9Å; E527-V637 HydrophobicContact CG-CG2 4.36Å; E527-E671 HydrophobicContact CG-CB 4.44Å; E527-N674 PolarHBondContact OE1-ND2 2.81Å; E527-V675 HydrophobicContact CB-CG2 4.05Å; E527-V675 HydrophobicContact CG-CG2 3.68Å
528	L	92.4	Very high	93	Very high	21 Å²	21	44.5 Å²	44.5	11%	0.11	24%	0.237	C	C	.	.	H	α-helix	trans	-66	-39	176.8	-56.1	-166.1	0	0	0	112.1	L492 W524 P525 V531 M532 W645	L492-L528 HydrophobicContact CD1-CD1 3.9Å; L492-L528 HydrophobicContact CD1-CD2 4.23Å; L492-L528 HydrophobicContact CD2-CB 4.26Å; L492-L528 HydrophobicContact CD2-CD1 4.03Å; L492-L528 HydrophobicContact CD2-CD2 4.46Å; L492-L528 HydrophobicContact CD2-CG 4.49Å; W524-L528 HydrophobicContact CE3-CB 3.9Å; W524-L528 HydrophobicContact CZ3-CB 4.11Å; P525-L528 HydrophobicContact CB-CG 4.46Å; P525-L528 HydrophobicContact CG-CD1 4.45Å; P525-L528 HydrophobicContact CG-CG 4.37Å; P525-L528 PolarHBondContact O-N 2.8Å; L528-V531 PolarHBondContact O-N 3.48Å; L528-M532 WeakPolarHBondContact O-CG 3.34Å; L528-M532 PolarHBondContact O-N 2.96Å; L528-M532 VanDerWaalsContact O-N 3.15Å; L528-W645 HydrophobicContact CD2-CH2 3.7Å; L528-W645 HydrophobicContact CD2-CZ2 3.53Å
529	R	93.4	Very high	93.1	Very high	52 Å²	52	45.5 Å²	45.5	20%	0.196	24%	0.242	C	C	.	.	H	α-helix	trans	-67.2	-36.2	178.7	-71.4	-176.1	-69.2	153.8	1.3	112.1	S462 I470 W524 P525 V526 E527 S533	S462-R529 PolarHBondContact O-NH1 2.8Å; I470-R529 HydrophobicContact CD1-CB 4.24Å; I470-R529 HydrophobicContact CD1-CG 4.09Å; W524-R529 HydrophobicContact CB-CG 3.89Å; W524-R529 HydrophobicContact CE3-CG 4.23Å; W524-R529 PolarHBondContact O-NE 3.32Å; P525-R529 WeakPolarHBondContact O-CG 3.16Å; P525-R529 PolarHBondContact O-N 2.99Å; P525-R529 VanDerWaalsContact O-N 3.14Å; P525-R529 PolarHBondContact O-NE 3.39Å; V526-R529 PolarHBondContact O-N 3.04Å; E527-R529 PolarHBondContact O-N 3.07Å; R529-S533 VanDerWaalsContact O-CB 3.3Å; R529-S533 WeakPolarHBondContact O-CB 3.33Å; R529-S533 PolarHBondContact O-N 2.77Å; R529-S533 PolarHBondContact O-OG 3Å
530	K	93.7	Very high	93.4	Very high	74 Å²	74	45.4 Å²	45.4	32%	0.322	24%	0.241	S	C	.	.	H	α-helix	trans	-59.6	-53.5	172.8	-77.3	-177.3	-179.8	-172.4	0	110.8	V526 E527 M532 S533 S534 V637 V638 E671	V526-K530 HydrophobicContact CG1-CD 4.37Å; V526-K530 HydrophobicContact CG1-CG 4.44Å; V526-K530 WeakPolarHBondContact O-CG 3.43Å; V526-K530 PolarHBondContact O-N 2.79Å; E527-K530 PolarHBondContact O-N 3.48Å; K530-M532 PolarHBondContact O-N 2.91Å; K530-S533 CarbonylContact O-C 3.6Å; K530-S533 PolarHBondContact O-N 3.4Å; K530-S534 PolarHBondContact O-N 2.96Å; K530-S534 VanDerWaalsContact O-N 3.12Å; K530-S534 PolarHBondContact O-OG 2.59Å; K530-S534 VanDerWaalsContact O-OG 3.1Å; K530-V637 HydrophobicContact CD-CG1 3.52Å; K530-V638 HydrophobicContact CB-CG2 3.96Å; K530-E671 IonicContact NZ-OE1 2.66Å; K530-E671 PolarHBondContact NZ-OE1 2.82Å
531	V	95.9	Very high	93.8	Very high	1 Å²	1	40.8 Å²	40.8	1%	0.006	22%	0.22	C	C	.	.	H	α-helix	trans	-55.3	-49.7	179.3	-179.1	0	0	0	0	111.8	E527 L528 S533 S534 I535 V638 Q641 L642 W645	E527-V531 PolarHBondContact O-N 2.9Å; L528-V531 PolarHBondContact O-N 3.48Å; V531-S533 PolarHBondContact O-N 2.9Å; V531-S534 PolarHBondContact O-N 2.93Å; V531-S534 VanDerWaalsContact O-N 3.08Å; V531-I535 HydrophobicContact CG1-CD1 3.81Å; V531-I535 PolarHBondContact O-N 3.44Å; V531-V638 HydrophobicContact CG2-CG1 4.24Å; V531-V638 HydrophobicContact CG2-CG2 4.42Å; V531-Q641 HydrophobicContact CG2-CB 4.17Å; V531-Q641 HydrophobicContact CG2-CG 4.15Å; V531-L642 HydrophobicContact CG1-CD2 4.09Å; V531-L642 HydrophobicContact CG1-CG 4.39Å; V531-W645 HydrophobicContact CG1-CZ3 4.15Å; V531-W645 HydrophobicContact CG2-CH2 4.42Å; V531-W645 HydrophobicContact CG2-CZ3 4.33Å
532	M	96.6	Very high	94.1	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-65.5	-23.4	179.4	-66.7	-55.5	-51.7	0	0	114	I470 A490 L492 G495 L497 W524 L528 K530	I470-M532 HydrophobicContact CD1-CB 3.71Å; I470-M532 HydrophobicContact CG1-CB 3.83Å; I470-M532 HydrophobicContact CG2-CB 3.86Å; I470-M532 HydrophobicContact CG2-CE 4.33Å; A490-M532 HydrophobicContact CB-CE 3.91Å; A490-M532 HydrophobicContact CB-SD 4.32Å; L492-M532 HydrophobicContact CD2-CG 4.5Å; L492-M532 HydrophobicContact CD2-SD 4.49Å; G495-M532 VanDerWaalsContact C-CE 3.46Å; G495-M532 WeakPolarHBondContact O-CE 3.5Å; L497-M532 HydrophobicContact CD2-CE 3.74Å; L497-M532 HydrophobicContact CG-CE 4.49Å; W524-M532 HydrophobicContact CH2-CG 4.06Å; W524-M532 HydrophobicContact CZ3-CG 3.6Å; L528-M532 WeakPolarHBondContact O-CG 3.34Å; L528-M532 PolarHBondContact O-N 2.96Å; L528-M532 VanDerWaalsContact O-N 3.15Å; K530-M532 PolarHBondContact O-N 2.91Å
533	S	94.8	Very high	94.4	Very high	39 Å²	39	34.1 Å²	34.1	27%	0.273	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.4	-1	176.1	-50.3	0	0	0	0	113.2	I470 M473 R529 K530 V531	I470-S533 WeakPolarHBondContact CG1-OG 3.3Å; M473-S533 VanDerWaalsContact CE-O 3.23Å; M473-S533 WeakPolarHBondContact CE-O 3.29Å; R529-S533 VanDerWaalsContact O-CB 3.3Å; R529-S533 WeakPolarHBondContact O-CB 3.33Å; R529-S533 PolarHBondContact O-N 2.77Å; R529-S533 PolarHBondContact O-OG 3Å; K530-S533 CarbonylContact O-C 3.6Å; K530-S533 PolarHBondContact O-N 3.4Å; V531-S533 PolarHBondContact O-N 2.9Å
534	S	95.4	Very high	94.8	Very high	51 Å²	51	28.4 Å²	28.4	36%	0.357	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109.5	-13.9	179.1	-61.8	0	0	0	0	113.7	K530 V531 L600	K530-S534 PolarHBondContact O-N 2.96Å; K530-S534 VanDerWaalsContact O-N 3.12Å; K530-S534 PolarHBondContact O-OG 2.59Å; K530-S534 VanDerWaalsContact O-OG 3.1Å; V531-S534 PolarHBondContact O-N 2.93Å; V531-S534 VanDerWaalsContact O-N 3.08Å; S534-L600 WeakPolarHBondContact O-CD2 3.27Å
535	I	96.6	Very high	95.1	Very high	9 Å²	9	29.7 Å²	29.7	5%	0.046	17%	0.165	C	C	.	.	S	Bend	trans	-110.5	-88.8	-176.3	-54	172.2	0	0	0	110.5	V531 L539 A540 L600 I604 L642	V531-I535 HydrophobicContact CG1-CD1 3.81Å; V531-I535 PolarHBondContact O-N 3.44Å; I535-L539 HydrophobicContact CG2-CB 4.44Å; I535-L539 HydrophobicContact CG2-CD2 4.29Å; I535-A540 HydrophobicContact CG2-CB 4.24Å; I535-L600 HydrophobicContact CG1-CD2 4.32Å; I535-I604 HydrophobicContact CD1-CD1 3.58Å; I535-I604 HydrophobicContact CG1-CD1 3.68Å; I535-I604 HydrophobicContact CG2-CD1 4.28Å; I535-L642 HydrophobicContact CD1-CD1 4.3Å; I535-L642 HydrophobicContact CD1-CD2 4.27Å
536	G	97.1	Very high	95.2	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	17%	0.169	C	C	.	.			trans	78	161.5	-174.9	0	0	0	0	0	113.8	N476 G495 D538 L539 A540	N476-G536 WeakPolarHBondContact OD1-CA 3.35Å; G495-G536 PolarHBondContact O-N 3.43Å; G495-G536 VanDerWaalsContact O-N 3.13Å; G536-D538 VanDerWaalsContact C-N 3.35Å; G536-D538 PolarHBondContact O-N 3.03Å; G536-L539 PolarHBondContact O-N 3.35Å; G536-A540 WeakPolarHBondContact O-CB 3.33Å; G536-A540 PolarHBondContact O-N 2.83Å
537	N	98.3	Very high	95.3	Very high	2 Å²	2	28.7 Å²	28.7	1%	0.011	17%	0.169	C	C	.	.	H	α-helix	trans	-65.2	-32.8	-167.8	-71.6	-7.2	0	0	0	113.8	R474 G475 N476 H478 V480 V496 L497 N541	R474-N537 PolarHBondContact O-N 2.81Å; G475-N537 PolarHBondContact O-ND2 3.4Å; N476-N537 WeakPolarHBondContact OD1-CB 3.26Å; N476-N537 PolarHBondContact OD1-N 2.8Å; N476-N537 PolarHBondContact OD1-OD1 2.63Å; H478-N537 PolarHBondContact O-ND2 3.02Å; V480-N537 HydrophobicContact CB-CB 4.28Å; V480-N537 HydrophobicContact CG2-CB 4.12Å; V480-N537 PolarHBondContact N-ND2 3.45Å; V496-N537 VanDerWaalsContact CA-OD1 3.24Å; V496-N537 WeakPolarHBondContact CA-OD1 3.19Å; V496-N537 WeakPolarHBondContact CB-OD1 3.38Å; L497-N537 PolarHBondContact N-OD1 3.02Å; L497-N537 PolarHBondContact O-ND2 3.25Å; N537-N541 VanDerWaalsContact O-CB 3.3Å; N537-N541 WeakPolarHBondContact O-CB 3.47Å; N537-N541 VanDerWaalsContact O-CG 3.3Å; N537-N541 PolarHBondContact O-N 3Å; N537-N541 PolarHBondContact O-ND2 3.05Å
538	D	97.2	Very high	94.8	Very high	81 Å²	81	30.1 Å²	30.1	43%	0.433	18%	0.182	S	C	.	.	H	α-helix	trans	-69.9	-42.5	179.5	-72.5	-9.5	0	0	0	111.7	R474 G475 G536 S542	R474-D538 VanDerWaalsContact C-CG 3.46Å; R474-D538 VanDerWaalsContact C-OD2 3.23Å; R474-D538 HydrophobicContact CB-CB 4.03Å; R474-D538 VanDerWaalsContact CB-OD2 3.31Å; R474-D538 WeakPolarHBondContact CB-OD2 3.43Å; R474-D538 PolarHBondContact O-N 2.91Å; G475-D538 VanDerWaalsContact CA-CG 3.43Å; G475-D538 WeakPolarHBondContact CA-OD1 3.26Å; G475-D538 PolarHBondContact N-OD1 2.95Å; G475-D538 PolarHBondContact N-OD2 3.5Å; G536-D538 VanDerWaalsContact C-N 3.35Å; G536-D538 PolarHBondContact O-N 3.03Å; D538-S542 PolarHBondContact O-N 3.33Å
539	L	97.8	Very high	94.2	Very high	25 Å²	25	35.1 Å²	35.1	13%	0.131	21%	0.205	C	C	.	.	H	α-helix	trans	-65.3	-45.4	174.6	-179.1	60.4	0	0	0	110.4	I535 G536 N541 S542 I543 Q601	I535-L539 HydrophobicContact CG2-CB 4.44Å; I535-L539 HydrophobicContact CG2-CD2 4.29Å; G536-L539 PolarHBondContact O-N 3.35Å; L539-N541 PolarHBondContact O-N 3.37Å; L539-S542 PolarHBondContact O-N 2.99Å; L539-S542 PolarHBondContact O-OG 2.78Å; L539-I543 PolarHBondContact O-N 3.5Å; L539-Q601 HydrophobicContact CD1-CB 3.99Å; L539-Q601 VanDerWaalsContact CD1-CD 3.49Å; L539-Q601 HydrophobicContact CD1-CG 3.73Å
540	A	97.8	Very high	93.5	Very high	1 Å²	1	36 Å²	36	1%	0.008	23%	0.23	C	C	.	.	H	α-helix	trans	-62.7	-41.6	179.6	0	0	0	0	0	112.5	V496 I535 G536 I543 W544	V496-A540 HydrophobicContact CG1-CB 3.19Å; I535-A540 HydrophobicContact CG2-CB 4.24Å; G536-A540 WeakPolarHBondContact O-CB 3.33Å; G536-A540 PolarHBondContact O-N 2.83Å; A540-I543 PolarHBondContact O-N 3.32Å; A540-W544 WeakPolarHBondContact O-CB 3.14Å; A540-W544 VanDerWaalsContact O-CD1 3.28Å; A540-W544 PolarHBondContact O-N 3.24Å
541	N	97.2	Very high	93.2	Very high	24 Å²	24	36.1 Å²	36.1	13%	0.128	23%	0.232	C	C	.	.	H	α-helix	trans	-72.9	-27.7	176.9	-70.9	-26.3	0	0	0	112.5	V480 N537 L539 I543 E545 G546 K553 K570	V480-N541 VanDerWaalsContact CG2-OD1 3.23Å; V480-N541 WeakPolarHBondContact CG2-OD1 3.31Å; V480-N541 PolarHBondContact O-ND2 3.35Å; V480-N541 PolarHBondContact O-OD1 2.86Å; N537-N541 VanDerWaalsContact O-CB 3.3Å; N537-N541 WeakPolarHBondContact O-CB 3.47Å; N537-N541 VanDerWaalsContact O-CG 3.3Å; N537-N541 PolarHBondContact O-N 3Å; N537-N541 PolarHBondContact O-ND2 3.05Å; L539-N541 PolarHBondContact O-N 3.37Å; N541-I543 PolarHBondContact O-N 2.91Å; N541-E545 HydrophobicContact CB-CB 4.31Å; N541-E545 HydrophobicContact CB-CG 4.18Å; N541-E545 VanDerWaalsContact CG-OE2 3.31Å; N541-E545 CarbonylContact O-C 3.6Å; N541-E545 VanDerWaalsContact O-CA 3.3Å; N541-E545 WeakPolarHBondContact O-CA 3.3Å; N541-E545 WeakPolarHBondContact O-CB 3.2Å; N541-E545 PolarHBondContact O-N 2.88Å; N541-G546 PolarHBondContact O-N 3.08Å; N541-K553 PolarHBondContact ND2-NZ 3.17Å; N541-K570 PolarHBondContact OD1-NZ 3.19Å
542	S	96.8	Very high	92.9	Very high	53 Å²	53	42 Å²	42	37%	0.371	27%	0.268	S	S	.	.	H	α-helix	trans	-61	-23.8	170	79.6	0	0	0	0	113.3	D538 L539	D538-S542 PolarHBondContact O-N 3.33Å; L539-S542 PolarHBondContact O-N 2.99Å; L539-S542 PolarHBondContact O-OG 2.78Å
543	I	97.1	Very high	92.9	Very high	3 Å²	3	44.5 Å²	44.5	2%	0.015	28%	0.278	C	S	.	.	H	α-helix	trans	-93.2	-61.3	174.3	-67.2	166.4	0	0	0	110	L539 A540 N541 E545 L577 A578 Q601 I604 L605 A608	L539-I543 PolarHBondContact O-N 3.5Å; A540-I543 PolarHBondContact O-N 3.32Å; N541-I543 PolarHBondContact O-N 2.91Å; I543-E545 PolarHBondContact O-N 3.03Å; I543-L577 HydrophobicContact CG2-CD1 3.55Å; I543-L577 CarbonylContact O-C 3.45Å; I543-L577 WeakPolarHBondContact O-CA 3.4Å; I543-A578 PolarHBondContact O-N 3.34Å; I543-Q601 HydrophobicContact CD1-CG 4.37Å; I543-I604 HydrophobicContact CD1-CB 3.83Å; I543-I604 HydrophobicContact CD1-CG2 3.65Å; I543-L605 HydrophobicContact CD1-CB 4.5Å; I543-L605 HydrophobicContact CG1-CB 4.45Å; I543-L605 HydrophobicContact CG2-CB 4.48Å; I543-L605 HydrophobicContact CG2-CD1 4.02Å; I543-A608 HydrophobicContact CG2-CB 4.35Å
544	W	96.9	Very high	93	Very high	9 Å²	9	43.1 Å²	43.1	3%	0.034	27%	0.268	C	S	.	.	H	α-helix	trans	-80.7	-6	-170.9	-68.1	100.8	0	0	0	115.3	L494 A540 K570 Y571 K574 F576 L577 A608	L494-W544 HydrophobicContact CD2-CH2 4.46Å; L494-W544 HydrophobicContact CD2-CZ2 3.65Å; A540-W544 WeakPolarHBondContact O-CB 3.14Å; A540-W544 VanDerWaalsContact O-CD1 3.28Å; A540-W544 PolarHBondContact O-N 3.24Å; W544-K570 HydrophobicContact CB-CG 4.25Å; W544-K570 WeakPolarHBondContact O-CG 3.26Å; W544-Y571 HydrophobicContact CB-CE1 4.18Å; W544-Y571 AromaticContact CD2-CD1 3.74Å; W544-Y571 HydrophobicContact CD2-CD1 3.74Å; W544-Y571 AromaticContact CD2-CE1 3.87Å; W544-Y571 HydrophobicContact CD2-CE1 3.87Å; W544-Y571 AromaticContact CE3-CD1 3.64Å; W544-Y571 HydrophobicContact CE3-CD1 3.64Å; W544-Y571 HydrophobicContact CE3-CE1 4.19Å; W544-Y571 HydrophobicContact CG-CD1 4.24Å; W544-Y571 AromaticContact CG-CE1 3.87Å; W544-Y571 HydrophobicContact CG-CE1 3.87Å; W544-Y571 HydrophobicContact CH2-CD1 4.4Å; W544-Y571 HydrophobicContact CZ2-CD1 4.49Å; W544-Y571 AromaticContact CZ3-CD1 3.99Å; W544-Y571 HydrophobicContact CZ3-CD1 3.99Å; W544-K574 HydrophobicContact CZ3-CG 4.43Å; W544-F576 WeakPolarHBondContact O-CB 3.11Å; W544-L577 HydrophobicContact CD2-CD1 4.23Å; W544-L577 HydrophobicContact CE3-CD1 4.06Å; W544-L577 HydrophobicContact CZ3-CD1 4.4Å; W544-A608 HydrophobicContact CH2-CB 3.75Å; W544-A608 HydrophobicContact CZ2-CB 3.5Å; W544-A608 VanDerWaalsContact CZ2-CB 3.5Å; W544-A608 HydrophobicContact CZ3-CB 4.44Å
545	E	95.9	Very high	93	Very high	37 Å²	37	43.1 Å²	43.1	17%	0.173	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-130.3	13.7	173.4	-54.4	-176	160	0	0	111.7	N541 I543 S547 K553 W566 K570 F576	N541-E545 HydrophobicContact CB-CB 4.31Å; N541-E545 HydrophobicContact CB-CG 4.18Å; N541-E545 VanDerWaalsContact CG-OE2 3.31Å; N541-E545 CarbonylContact O-C 3.6Å; N541-E545 VanDerWaalsContact O-CA 3.3Å; N541-E545 WeakPolarHBondContact O-CA 3.3Å; N541-E545 WeakPolarHBondContact O-CB 3.2Å; N541-E545 PolarHBondContact O-N 2.88Å; I543-E545 PolarHBondContact O-N 3.03Å; E545-S547 PolarHBondContact O-N 3.43Å; E545-S547 VanDerWaalsContact O-N 3.13Å; E545-K553 WeakPolarHBondContact OE1-CE 3.39Å; E545-K553 IonicContact OE1-NZ 2.72Å; E545-K553 PolarHBondContact OE1-NZ 3.36Å; E545-K553 IonicContact OE2-NZ 3.83Å; E545-K553 PolarHBondContact OE2-NZ 2.98Å; E545-W566 HydrophobicContact CG-CZ2 4.33Å; E545-W566 PolarHBondContact OE1-NE1 3.37Å; E545-K570 HydrophobicContact CG-CD 4.07Å; E545-K570 VanDerWaalsContact CG-CE 3.49Å; E545-K570 WeakPolarHBondContact OE1-CE 3.34Å; E545-K570 IonicContact OE1-NZ 2.79Å; E545-K570 PolarHBondContact OE1-NZ 3.36Å; E545-F576 CarbonylContact C-O 3.6Å
546	G	91.9	Very high	93	Very high	44 Å²	44	47.6 Å²	47.6	45%	0.454	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-13.8	-174.6	0	0	0	0	0	115.2	N541 F576	N541-G546 PolarHBondContact O-N 3.08Å; G546-F576 PolarHBondContact N-O 2.87Å; G546-F576 VanDerWaalsContact N-O 3.09Å
547	S	88.9	Confident	92.9	Very high	54 Å²	54	57.2 Å²	57.2	38%	0.378	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-140.1	79.4	169.1	-172.9	0	0	0	0	110.7	E545 Q549 F576	E545-S547 PolarHBondContact O-N 3.43Å; E545-S547 VanDerWaalsContact O-N 3.13Å; S547-Q549 WeakPolarHBondContact O-CG 3.39Å; S547-Q549 PolarHBondContact O-N 2.93Å; S547-F576 PolarHBondContact N-O 3.14Å; S547-F576 VanDerWaalsContact O-CA 3.28Å; S547-F576 WeakPolarHBondContact O-CA 3.48Å
548	S	78.4	Confident	92.8	Very high	53 Å²	53	58.2 Å²	58.2	37%	0.371	34%	0.338	S	S	.	.			trans	-61.3	-6.7	-176.2	64.2	0	0	0	0	115.9	G550 Q551	S548-G550 PolarHBondContact O-N 2.79Å; S548-Q551 WeakPolarHBondContact O-CB 3.28Å; S548-Q551 PolarHBondContact O-N 3.26Å
549	Q	80.4	Confident	92.9	Very high	126 Å²	126	57.5 Å²	57.5	59%	0.589	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.5	25.3	-178	-50.6	-163.9	10.5	0	0	114.5	S547 Q551 L575	S547-Q549 WeakPolarHBondContact O-CG 3.39Å; S547-Q549 PolarHBondContact O-N 2.93Å; Q549-Q551 VanDerWaalsContact C-N 3.26Å; Q549-Q551 PolarHBondContact O-N 3.44Å; Q549-L575 PolarHBondContact NE2-O 3.21Å
550	G	79.9	Confident	92.8	Very high	71 Å²	71	60.6 Å²	60.6	73%	0.732	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.8	1.6	-174.8	0	0	0	0	0	115.1	S548	S548-G550 PolarHBondContact O-N 2.79Å
551	Q	87.2	Confident	92.8	Very high	76 Å²	76	66 Å²	66	36%	0.355	37%	0.372	S	S	.	.	P	Polyproline II helix	trans	-73.9	137.2	171	-60.1	-162.7	38.6	0	0	110.5	S548 Q549 W566 F576	S548-Q551 WeakPolarHBondContact O-CB 3.28Å; S548-Q551 PolarHBondContact O-N 3.26Å; Q549-Q551 VanDerWaalsContact C-N 3.26Å; Q549-Q551 PolarHBondContact O-N 3.44Å; Q551-W566 HydrophobicContact CB-CZ3 3.85Å; Q551-F576 HydrophobicContact CB-CE1 3.91Å; Q551-F576 HydrophobicContact CB-CZ 4.09Å; Q551-F576 HydrophobicContact CG-CE1 3.93Å; Q551-F576 HydrophobicContact CG-CZ 4.3Å
552	T	89.5	Confident	92.8	Very high	125 Å²	125	68.6 Å²	68.6	77%	0.767	38%	0.383	S	S	*	.	P	Polyproline II helix	trans	-89.9	129.6	179.2	52.9	0	0	0	0	111.4
553	K	95.1	Very high	92.9	Very high	51 Å²	51	66.3 Å²	66.3	22%	0.222	37%	0.367	C	S	.	.	P	Polyproline II helix	trans	-57	135.1	172.8	-168.6	168.8	-171.3	154.3	0	110.9	V480 E483 N541 E545 W566	V480-K553 VanDerWaalsContact O-CE 3.26Å; V480-K553 WeakPolarHBondContact O-CE 3.35Å; V480-K553 PolarHBondContact O-NZ 2.88Å; E483-K553 HydrophobicContact CG-CD 4.28Å; N541-K553 PolarHBondContact ND2-NZ 3.17Å; E545-K553 WeakPolarHBondContact OE1-CE 3.39Å; E545-K553 IonicContact OE1-NZ 2.72Å; E545-K553 PolarHBondContact OE1-NZ 3.36Å; E545-K553 IonicContact OE2-NZ 3.83Å; E545-K553 PolarHBondContact OE2-NZ 2.98Å; K553-W566 HydrophobicContact CB-CH2 3.99Å; K553-W566 HydrophobicContact CB-CZ2 3.8Å; K553-W566 HydrophobicContact CD-CZ2 4.38Å; K553-W566 HydrophobicContact CG-CZ2 3.84Å
554	P	97	Very high	93	Very high	10 Å²	10	68.2 Å²	68.2	7%	0.065	38%	0.376	C	S	.	.	P	Polyproline II helix	trans	-67.9	151.6	177.9	29	-35.4	0	0	0	110.7	D481 C482 K563 W566	D481-P554 WeakPolarHBondContact O-CG 3.41Å; C482-P554 CarbonylContact C-O 3.37Å; C482-P554 VanDerWaalsContact CA-O 3.27Å; C482-P554 WeakPolarHBondContact CA-O 3.4Å; C482-P554 HydrophobicContact CB-CG 4.24Å; P554-K563 HydrophobicContact CB-CG 3.98Å; P554-K563 HydrophobicContact CG-CG 4.16Å; P554-W566 VanDerWaalsContact CD-CD2 3.45Å; P554-W566 HydrophobicContact CG-CB 3.84Å; P554-W566 HydrophobicContact CG-CD2 4.45Å; P554-W566 HydrophobicContact CG-CG 3.82Å
555	S	96.4	Very high	93	Very high	52 Å²	52	74.8 Å²	74.8	36%	0.364	40%	0.401	S	S	.	.	P	Polyproline II helix	trans	-92.5	172.7	176.3	71.7	0	0	0	0	111.9	C482 K557 S558 K563	C482-S555 CarbonylContact O-C 3.59Å; C482-S555 VanDerWaalsContact O-C 3.25Å; S555-K557 PolarHBondContact O-N 3.4Å; S555-K557 VanDerWaalsContact O-N 3.16Å; S555-K557 PolarHBondContact OG-N 3.11Å; S555-S558 PolarHBondContact N-OG 3.15Å; S555-S558 WeakPolarHBondContact O-CB 3.31Å; S555-S558 PolarHBondContact O-N 3.12Å; S555-S558 PolarHBondContact OG-N 2.68Å; S555-S558 PolarHBondContact OG-OG 2.85Å; S555-K563 WeakPolarHBondContact O-CE 3.48Å
556	E	95.9	Very high	93.1	Very high	103 Å²	103	73.7 Å²	73.7	48%	0.481	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.6	-35.2	168.9	176.7	168.3	-169.8	0	0	112.1	C482 T484 K563	C482-E556 PolarHBondContact O-N 3.23Å; T484-E556 HydrophobicContact CG2-CG 4.19Å; T484-E556 WeakPolarHBondContact OG1-CG 3.45Å; E556-K563 PolarHBondContact O-NZ 2.99Å
557	K	95.1	Very high	93.4	Very high	201 Å²	201	71.6 Å²	71.6	87%	0.874	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.8	-10.7	-179	-63.2	179.7	-178	175.8	0	114.6	S555	S555-K557 PolarHBondContact O-N 3.4Å; S555-K557 VanDerWaalsContact O-N 3.16Å; S555-K557 PolarHBondContact OG-N 3.11Å
558	S	97.4	Very high	93.8	Very high	23 Å²	23	72.8 Å²	72.8	16%	0.161	37%	0.369	C	S	.	.	S	Bend	trans	-62.4	152.8	177.8	-73.8	0	0	0	0	111.4	S555 E562 K563	S555-S558 PolarHBondContact N-OG 3.15Å; S555-S558 WeakPolarHBondContact O-CB 3.31Å; S555-S558 PolarHBondContact O-N 3.12Å; S555-S558 PolarHBondContact OG-N 2.68Å; S555-S558 PolarHBondContact OG-OG 2.85Å; S558-E562 WeakPolarHBondContact CA-OE2 3.45Å; S558-E562 WeakPolarHBondContact CB-OE2 3.19Å; S558-E562 PolarHBondContact OG-OE2 3.48Å; S558-K563 WeakPolarHBondContact O-CE 3.5Å; S558-K563 PolarHBondContact O-NZ 3.42Å
559	T	97.8	Very high	94.6	Very high	66 Å²	66	70.7 Å²	70.7	41%	0.405	35%	0.354	S	S	.	.			trans	-69	163.4	-177.5	91.4	0	0	0	0	111.2	E561 E562 K563	T559-E561 WeakPolarHBondContact CB-OE2 3.49Å; T559-E561 PolarHBondContact O-N 2.95Å; T559-E561 PolarHBondContact OG1-N 3.49Å; T559-E561 PolarHBondContact OG1-OE2 2.92Å; T559-E562 HydrophobicContact CG2-CG 4.43Å; T559-E562 PolarHBondContact N-OE2 2.69Å; T559-E562 PolarHBondContact O-N 2.84Å; T559-E562 PolarHBondContact OG1-N 3.41Å; T559-K563 WeakPolarHBondContact O-CG 3.49Å; T559-K563 PolarHBondContact O-N 3.44Å
560	R	97.2	Very high	95.4	Very high	90 Å²	90	64.7 Å²	64.7	34%	0.34	33%	0.326	S	S	.	.	H	α-helix	trans	-58.6	-38.9	176.5	-177.8	-179.1	169.4	69.8	19.9	111.1	E501 I505 K563 E564	E501-R560 WeakPolarHBondContact OE1-CA 3.27Å; E501-R560 WeakPolarHBondContact OE1-CB 3.36Å; I505-R560 VanDerWaalsContact CG1-NH2 3.29Å; R560-K563 PolarHBondContact O-N 3.08Å; R560-E564 IonicContact CZ-OE2 3.76Å; R560-E564 IonicContact NE-OE2 2.69Å; R560-E564 IonicContact NH2-OE2 3.68Å; R560-E564 PolarHBondContact NH2-OE2 2.99Å; R560-E564 WeakPolarHBondContact O-CB 3.13Å; R560-E564 PolarHBondContact O-N 3.48Å
561	E	97.4	Very high	96.3	Very high	114 Å²	114	61.4 Å²	61.4	53%	0.533	29%	0.292	S	S	.	.	H	α-helix	trans	-70.4	-34.4	-177.4	-56.2	66.8	-141.5	0	0	111.6	T559 R565	T559-E561 WeakPolarHBondContact CB-OE2 3.49Å; T559-E561 PolarHBondContact O-N 2.95Å; T559-E561 PolarHBondContact OG1-N 3.49Å; T559-E561 PolarHBondContact OG1-OE2 2.92Å; E561-R565 WeakPolarHBondContact O-CB 3.48Å; E561-R565 PolarHBondContact O-N 2.86Å
562	E	97.6	Very high	96.7	Very high	79 Å²	79	62.5 Å²	62.5	37%	0.369	30%	0.297	S	S	.	.	H	α-helix	trans	-67	-48.1	171.7	-64.2	178.5	141.4	0	0	111.4	S558 T559 E564 R565 W566	S558-E562 WeakPolarHBondContact CA-OE2 3.45Å; S558-E562 WeakPolarHBondContact CB-OE2 3.19Å; S558-E562 PolarHBondContact OG-OE2 3.48Å; T559-E562 HydrophobicContact CG2-CG 4.43Å; T559-E562 PolarHBondContact N-OE2 2.69Å; T559-E562 PolarHBondContact O-N 2.84Å; T559-E562 PolarHBondContact OG1-N 3.41Å; E562-E564 VanDerWaalsContact C-N 3.29Å; E562-E564 PolarHBondContact O-N 2.95Å; E562-R565 PolarHBondContact O-N 2.73Å; E562-W566 PolarHBondContact O-N 2.93Å
563	K	98.3	Very high	96.9	Very high	6 Å²	6	61.8 Å²	61.8	3%	0.026	29%	0.285	C	S	.	.	H	α-helix	trans	-60.7	-39.2	175.1	-69.7	161.8	176.9	157.3	0	111.6	C482 E501 I505 P554 S555 E556 S558 T559 R560 I567	C482-K563 HydrophobicContact CB-CD 4.37Å; C482-K563 HydrophobicContact CB-CG 4.12Å; E501-K563 IonicContact OE1-NZ 2.76Å; E501-K563 WeakPolarHBondContact OE2-CD 3.39Å; E501-K563 WeakPolarHBondContact OE2-CE 3.19Å; E501-K563 IonicContact OE2-NZ 3.67Å; E501-K563 PolarHBondContact OE2-NZ 3.4Å; I505-K563 HydrophobicContact CD1-CB 3.85Å; P554-K563 HydrophobicContact CB-CG 3.98Å; P554-K563 HydrophobicContact CG-CG 4.16Å; S555-K563 WeakPolarHBondContact O-CE 3.48Å; E556-K563 PolarHBondContact O-NZ 2.99Å; S558-K563 WeakPolarHBondContact O-CE 3.5Å; S558-K563 PolarHBondContact O-NZ 3.42Å; T559-K563 WeakPolarHBondContact O-CG 3.49Å; T559-K563 PolarHBondContact O-N 3.44Å; R560-K563 PolarHBondContact O-N 3.08Å; K563-I567 WeakPolarHBondContact O-CB 3.49Å; K563-I567 WeakPolarHBondContact O-CD1 3.37Å; K563-I567 VanDerWaalsContact O-CG1 3.25Å; K563-I567 WeakPolarHBondContact O-CG1 3.49Å; K563-I567 PolarHBondContact O-N 3.11Å
564	E	98.3	Very high	97	Very high	43 Å²	43	63 Å²	63	20%	0.201	29%	0.29	C	S	.	.	H	α-helix	trans	-72.2	-37.4	-179.2	-177.8	157.2	154.4	0	0	112.4	I505 R560 E562 R568	I505-E564 HydrophobicContact CD1-CB 3.88Å; I505-E564 HydrophobicContact CG1-CB 4.12Å; I505-E564 HydrophobicContact CG1-CG 4.44Å; I505-E564 HydrophobicContact CG2-CB 4.09Å; I505-E564 HydrophobicContact CG2-CG 3.84Å; R560-E564 IonicContact CZ-OE2 3.76Å; R560-E564 IonicContact NE-OE2 2.69Å; R560-E564 IonicContact NH2-OE2 3.68Å; R560-E564 PolarHBondContact NH2-OE2 2.99Å; R560-E564 WeakPolarHBondContact O-CB 3.13Å; R560-E564 PolarHBondContact O-N 3.48Å; E562-E564 VanDerWaalsContact C-N 3.29Å; E562-E564 PolarHBondContact O-N 2.95Å; E564-R568 VanDerWaalsContact CG-NH1 3.3Å; E564-R568 PolarHBondContact O-N 2.92Å; E564-R568 VanDerWaalsContact O-N 3.14Å; E564-R568 IonicContact OE1-CZ 2.97Å; E564-R568 VanDerWaalsContact OE1-CZ 3.26Å; E564-R568 IonicContact OE1-NH1 2.7Å; E564-R568 PolarHBondContact OE1-NH1 3.04Å; E564-R568 IonicContact OE1-NH2 2.72Å; E564-R568 PolarHBondContact OE1-NH2 3.26Å
565	R	97.4	Very high	96.9	Very high	147 Å²	147	65.3 Å²	65.3	56%	0.555	30%	0.302	S	S	*	.	H	α-helix	trans	-62.5	-51	170.1	-168.4	-175	-54.1	106	6.4	111.5	E561 E562 I567 R568 S569	E561-R565 WeakPolarHBondContact O-CB 3.48Å; E561-R565 PolarHBondContact O-N 2.86Å; E562-R565 PolarHBondContact O-N 2.73Å; R565-I567 VanDerWaalsContact C-N 3.33Å; R565-I567 PolarHBondContact O-N 3.46Å; R565-R568 PolarHBondContact O-N 3.31Å; R565-S569 PolarHBondContact O-N 3.01Å; R565-S569 PolarHBondContact O-OG 3.4Å
566	W	97.7	Very high	96.8	Very high	13 Å²	13	62.9 Å²	62.9	5%	0.049	29%	0.285	C	S	.	.	H	α-helix	trans	-56	-46.7	178.1	179.3	-98.8	0	0	0	112.1	E545 Q551 K553 P554 E562 R568 S569 K570 F576	E545-W566 HydrophobicContact CG-CZ2 4.33Å; E545-W566 PolarHBondContact OE1-NE1 3.37Å; Q551-W566 HydrophobicContact CB-CZ3 3.85Å; K553-W566 HydrophobicContact CB-CH2 3.99Å; K553-W566 HydrophobicContact CB-CZ2 3.8Å; K553-W566 HydrophobicContact CD-CZ2 4.38Å; K553-W566 HydrophobicContact CG-CZ2 3.84Å; P554-W566 VanDerWaalsContact CD-CD2 3.45Å; P554-W566 HydrophobicContact CG-CB 3.84Å; P554-W566 HydrophobicContact CG-CD2 4.45Å; P554-W566 HydrophobicContact CG-CG 3.82Å; E562-W566 PolarHBondContact O-N 2.93Å; W566-R568 PolarHBondContact O-N 2.99Å; W566-S569 PolarHBondContact O-N 2.89Å; W566-K570 WeakPolarHBondContact O-CB 3.45Å; W566-K570 PolarHBondContact O-N 2.95Å; W566-F576 AromaticContact CD2-CE2 3.81Å; W566-F576 HydrophobicContact CD2-CE2 3.81Å; W566-F576 HydrophobicContact CD2-CZ 4.44Å; W566-F576 AromaticContact CE3-CE2 3.6Å; W566-F576 HydrophobicContact CE3-CE2 3.6Å; W566-F576 AromaticContact CE3-CZ 3.79Å; W566-F576 HydrophobicContact CE3-CZ 3.79Å; W566-F576 HydrophobicContact CH2-CD2 4.15Å; W566-F576 AromaticContact CH2-CE2 3.91Å; W566-F576 HydrophobicContact CH2-CE2 3.91Å; W566-F576 HydrophobicContact CH2-CZ 4.28Å; W566-F576 HydrophobicContact CZ2-CD2 4.19Å; W566-F576 HydrophobicContact CZ2-CE2 4.11Å; W566-F576 HydrophobicContact CZ3-CD2 4.34Å; W566-F576 HydrophobicContact CZ3-CE1 4.41Å; W566-F576 AromaticContact CZ3-CE2 3.66Å; W566-F576 HydrophobicContact CZ3-CE2 3.66Å; W566-F576 AromaticContact CZ3-CZ 3.7Å; W566-F576 HydrophobicContact CZ3-CZ 3.7Å
567	I	98.1	Very high	96.8	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-65.2	-37.4	-178.9	-74.5	169.2	0	0	0	112.1	D481 C502 I505 L509 K563 R565 Y571	D481-I567 HydrophobicContact CB-CD1 3.94Å; D481-I567 HydrophobicContact CB-CG1 3.81Å; C502-I567 HydrophobicContact CB-CD1 3.83Å; I505-I567 HydrophobicContact CB-CD1 4.06Å; I505-I567 HydrophobicContact CD1-CD1 3.92Å; I505-I567 HydrophobicContact CG2-CB 3.97Å; I505-I567 HydrophobicContact CG2-CD1 4.01Å; I505-I567 HydrophobicContact CG2-CG2 3.64Å; L509-I567 HydrophobicContact CD1-CG2 3.85Å; K563-I567 WeakPolarHBondContact O-CB 3.49Å; K563-I567 WeakPolarHBondContact O-CD1 3.37Å; K563-I567 VanDerWaalsContact O-CG1 3.25Å; K563-I567 WeakPolarHBondContact O-CG1 3.49Å; K563-I567 PolarHBondContact O-N 3.11Å; R565-I567 VanDerWaalsContact C-N 3.33Å; R565-I567 PolarHBondContact O-N 3.46Å; I567-Y571 HydrophobicContact CG2-CD2 4.06Å; I567-Y571 HydrophobicContact CG2-CE2 4.44Å; I567-Y571 VanDerWaalsContact O-CD2 3.31Å; I567-Y571 WeakPolarHBondContact O-CD2 3.44Å; I567-Y571 PolarHBondContact O-N 3.42Å; I567-Y571 VanDerWaalsContact O-N 3.09Å
568	R	97.5	Very high	96.9	Very high	80 Å²	80	49.7 Å²	49.7	30%	0.302	23%	0.229	S	C	.	.	H	α-helix	trans	-67.7	-48.7	172.5	-72.3	-164.5	178.1	95.7	18.3	111.9	S508 L509 E564 R565 W566 K570 Y571 E572 E573	S508-R568 PolarHBondContact OG-NH2 3.43Å; L509-R568 HydrophobicContact CD2-CG 3.98Å; E564-R568 VanDerWaalsContact CG-NH1 3.3Å; E564-R568 PolarHBondContact O-N 2.92Å; E564-R568 VanDerWaalsContact O-N 3.14Å; E564-R568 IonicContact OE1-CZ 2.97Å; E564-R568 VanDerWaalsContact OE1-CZ 3.26Å; E564-R568 IonicContact OE1-NH1 2.7Å; E564-R568 PolarHBondContact OE1-NH1 3.04Å; E564-R568 IonicContact OE1-NH2 2.72Å; E564-R568 PolarHBondContact OE1-NH2 3.26Å; R565-R568 PolarHBondContact O-N 3.31Å; W566-R568 PolarHBondContact O-N 2.99Å; R568-K570 PolarHBondContact O-N 3.01Å; R568-Y571 PolarHBondContact O-N 3.26Å; R568-E572 HydrophobicContact CB-CB 4.43Å; R568-E572 WeakPolarHBondContact CD-OE2 3.48Å; R568-E572 VanDerWaalsContact CG-OE2 3.31Å; R568-E572 WeakPolarHBondContact CG-OE2 3.31Å; R568-E572 IonicContact NE-OE2 2.91Å; R568-E572 PolarHBondContact NE-OE2 3.25Å; R568-E572 WeakPolarHBondContact O-CA 3.13Å; R568-E572 WeakPolarHBondContact O-CB 3.3Å; R568-E572 PolarHBondContact O-N 3.19Å; R568-E573 PolarHBondContact O-N 2.98Å
569	S	96.6	Very high	96.7	Very high	8 Å²	8	53.4 Å²	53.4	6%	0.056	25%	0.253	C	S	.	.	H	α-helix	trans	-60.4	-32.4	178.1	-65.1	0	0	0	0	113.4	R565 W566 E573 K574 L575	R565-S569 PolarHBondContact O-N 3.01Å; R565-S569 PolarHBondContact O-OG 3.4Å; W566-S569 PolarHBondContact O-N 2.89Å; S569-E573 WeakPolarHBondContact CA-OE2 3.25Å; S569-E573 VanDerWaalsContact CB-OE2 3.3Å; S569-E573 WeakPolarHBondContact CB-OE2 3.47Å; S569-E573 PolarHBondContact OG-OE2 2.94Å; S569-K574 PolarHBondContact O-N 3.1Å; S569-L575 PolarHBondContact O-N 2.69Å
570	K	96.9	Very high	96.3	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-71.7	-50.9	176.5	-173.3	169.6	176	-177.6	0	113.8	V480 D481 N541 W544 E545 W566 R568 F576	V480-K570 PolarHBondContact O-NZ 2.97Å; V480-K570 VanDerWaalsContact O-NZ 3.15Å; D481-K570 IonicContact OD1-NZ 2.7Å; D481-K570 PolarHBondContact OD1-NZ 3.5Å; N541-K570 PolarHBondContact OD1-NZ 3.19Å; W544-K570 HydrophobicContact CB-CG 4.25Å; W544-K570 WeakPolarHBondContact O-CG 3.26Å; E545-K570 HydrophobicContact CG-CD 4.07Å; E545-K570 VanDerWaalsContact CG-CE 3.49Å; E545-K570 WeakPolarHBondContact OE1-CE 3.34Å; E545-K570 IonicContact OE1-NZ 2.79Å; E545-K570 PolarHBondContact OE1-NZ 3.36Å; W566-K570 WeakPolarHBondContact O-CB 3.45Å; W566-K570 PolarHBondContact O-N 2.95Å; R568-K570 PolarHBondContact O-N 3.01Å; K570-F576 HydrophobicContact CB-CD2 3.82Å; K570-F576 HydrophobicContact CB-CE2 4.1Å; K570-F576 HydrophobicContact CG-CD2 4.23Å
571	Y	97.3	Very high	95.7	Very high	2 Å²	2	51.6 Å²	51.6	1%	0.008	25%	0.251	C	S	.	.	H	α-helix	trans	-112.5	-24.6	-168	-56.5	-72.9	0	0	0	115.8	D481 L494 H506 W544 I567 R568	D481-Y571 VanDerWaalsContact OD1-CE2 3.26Å; D481-Y571 WeakPolarHBondContact OD1-CE2 3.49Å; D481-Y571 PolarHBondContact OD1-OH 2.9Å; L494-Y571 HydrophobicContact CD1-CD1 3.85Å; L494-Y571 HydrophobicContact CD1-CE1 3.66Å; L494-Y571 HydrophobicContact CD1-CG 4.44Å; L494-Y571 HydrophobicContact CD2-CD1 4.16Å; L494-Y571 HydrophobicContact CD2-CE1 4.28Å; H506-Y571 AromaticContact CE1-CD1 3.78Å; H506-Y571 AromaticContact CE1-CD2 2.95Å; H506-Y571 WeakPolarHBondContact CE1-CD2 3.33Å; H506-Y571 AromaticContact CE1-CE1 3.52Å; H506-Y571 AromaticContact CE1-CE2 2.62Å; H506-Y571 WeakPolarHBondContact CE1-CE2 3.44Å; H506-Y571 AromaticContact CE1-CG 3.52Å; H506-Y571 AromaticContact CE1-CZ 2.93Å; H506-Y571 PolarHBondContact CE1-OH 3.19Å; H506-Y571 AromaticContact NE2-CE2 3.16Å; H506-Y571 WeakPolarHBondContact NE2-CE2 3.37Å; H506-Y571 AromaticContact NE2-CZ 3.81Å; W544-Y571 HydrophobicContact CB-CE1 4.18Å; W544-Y571 AromaticContact CD2-CD1 3.74Å; W544-Y571 HydrophobicContact CD2-CD1 3.74Å; W544-Y571 AromaticContact CD2-CE1 3.87Å; W544-Y571 HydrophobicContact CD2-CE1 3.87Å; W544-Y571 AromaticContact CE3-CD1 3.64Å; W544-Y571 HydrophobicContact CE3-CD1 3.64Å; W544-Y571 HydrophobicContact CE3-CE1 4.19Å; W544-Y571 HydrophobicContact CG-CD1 4.24Å; W544-Y571 AromaticContact CG-CE1 3.87Å; W544-Y571 HydrophobicContact CG-CE1 3.87Å; W544-Y571 HydrophobicContact CH2-CD1 4.4Å; W544-Y571 HydrophobicContact CZ2-CD1 4.49Å; W544-Y571 AromaticContact CZ3-CD1 3.99Å; W544-Y571 HydrophobicContact CZ3-CD1 3.99Å; I567-Y571 HydrophobicContact CG2-CD2 4.06Å; I567-Y571 HydrophobicContact CG2-CE2 4.44Å; I567-Y571 VanDerWaalsContact O-CD2 3.31Å; I567-Y571 WeakPolarHBondContact O-CD2 3.44Å; I567-Y571 PolarHBondContact O-N 3.42Å; I567-Y571 VanDerWaalsContact O-N 3.09Å; R568-Y571 PolarHBondContact O-N 3.26Å
572	E	95.6	Very high	94.7	Very high	99 Å²	99	52.7 Å²	52.7	46%	0.463	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97	-47.4	-178	-175	164	-146.9	0	0	110.8	L513 R568	L513-E572 HydrophobicContact CD1-CB 4.02Å; L513-E572 HydrophobicContact CD1-CG 4.1Å; R568-E572 HydrophobicContact CB-CB 4.43Å; R568-E572 WeakPolarHBondContact CD-OE2 3.48Å; R568-E572 VanDerWaalsContact CG-OE2 3.31Å; R568-E572 WeakPolarHBondContact CG-OE2 3.31Å; R568-E572 IonicContact NE-OE2 2.91Å; R568-E572 PolarHBondContact NE-OE2 3.25Å; R568-E572 WeakPolarHBondContact O-CA 3.13Å; R568-E572 WeakPolarHBondContact O-CB 3.3Å; R568-E572 PolarHBondContact O-N 3.19Å
573	E	95.3	Very high	94	Very high	110 Å²	110	52.3 Å²	52.3	51%	0.514	27%	0.272	S	S	.	.	S	Bend	trans	-86.8	-15	176.1	-51.4	173.1	163	0	0	112.6	R568 S569 L575	R568-E573 PolarHBondContact O-N 2.98Å; S569-E573 WeakPolarHBondContact CA-OE2 3.25Å; S569-E573 VanDerWaalsContact CB-OE2 3.3Å; S569-E573 WeakPolarHBondContact CB-OE2 3.47Å; S569-E573 PolarHBondContact OG-OE2 2.94Å; E573-L575 HydrophobicContact CB-CD2 4.13Å; E573-L575 HydrophobicContact CB-CG 3.85Å; E573-L575 PolarHBondContact O-N 3.47Å; E573-L575 WeakPolarHBondContact OE2-CD1 3.13Å
574	K	95.4	Very high	93.3	Very high	77 Å²	77	61.6 Å²	61.6	34%	0.335	32%	0.316	S	S	.	.			trans	55.4	22.2	-178.4	-49.4	-175.3	-173.6	-175.2	0	115.4	W544 S569 F576 L577 A608 H609	W544-K574 HydrophobicContact CZ3-CG 4.43Å; S569-K574 PolarHBondContact O-N 3.1Å; K574-F576 PolarHBondContact O-N 2.88Å; K574-F576 VanDerWaalsContact O-N 3.13Å; K574-L577 HydrophobicContact CB-CB 4.27Å; K574-L577 HydrophobicContact CB-CD2 4.23Å; K574-L577 HydrophobicContact CD-CD2 4.08Å; K574-L577 VanDerWaalsContact O-CB 3.25Å; K574-L577 WeakPolarHBondContact O-CB 3.2Å; K574-L577 PolarHBondContact O-N 3.29Å; K574-L577 VanDerWaalsContact O-N 3.14Å; K574-A608 WeakPolarHBondContact CD-O 3.5Å; K574-A608 VanDerWaalsContact CE-O 3.29Å; K574-A608 WeakPolarHBondContact CE-O 3.34Å; K574-A608 PolarHBondContact NZ-O 3.4Å; K574-H609 PolarHBondContact NZ-O 2.91Å
575	L	94.9	Very high	92.9	Very high	59 Å²	59	61.7 Å²	61.7	31%	0.309	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-33.6	-171.3	-60.9	-172.4	0	0	0	113.7	Q549 S569 E573	Q549-L575 PolarHBondContact NE2-O 3.21Å; S569-L575 PolarHBondContact O-N 2.69Å; E573-L575 HydrophobicContact CB-CD2 4.13Å; E573-L575 HydrophobicContact CB-CG 3.85Å; E573-L575 PolarHBondContact O-N 3.47Å; E573-L575 WeakPolarHBondContact OE2-CD1 3.13Å
576	F	95.8	Very high	92.6	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.1	2.1	-175.2	-41.7	-44.9	0	0	0	114.4	W544 E545 G546 S547 Q551 W566 K570 K574 A578	W544-F576 WeakPolarHBondContact O-CB 3.11Å; E545-F576 CarbonylContact C-O 3.6Å; G546-F576 PolarHBondContact N-O 2.87Å; G546-F576 VanDerWaalsContact N-O 3.09Å; S547-F576 PolarHBondContact N-O 3.14Å; S547-F576 VanDerWaalsContact O-CA 3.28Å; S547-F576 WeakPolarHBondContact O-CA 3.48Å; Q551-F576 HydrophobicContact CB-CE1 3.91Å; Q551-F576 HydrophobicContact CB-CZ 4.09Å; Q551-F576 HydrophobicContact CG-CE1 3.93Å; Q551-F576 HydrophobicContact CG-CZ 4.3Å; W566-F576 AromaticContact CD2-CE2 3.81Å; W566-F576 HydrophobicContact CD2-CE2 3.81Å; W566-F576 HydrophobicContact CD2-CZ 4.44Å; W566-F576 AromaticContact CE3-CE2 3.6Å; W566-F576 HydrophobicContact CE3-CE2 3.6Å; W566-F576 AromaticContact CE3-CZ 3.79Å; W566-F576 HydrophobicContact CE3-CZ 3.79Å; W566-F576 HydrophobicContact CH2-CD2 4.15Å; W566-F576 AromaticContact CH2-CE2 3.91Å; W566-F576 HydrophobicContact CH2-CE2 3.91Å; W566-F576 HydrophobicContact CH2-CZ 4.28Å; W566-F576 HydrophobicContact CZ2-CD2 4.19Å; W566-F576 HydrophobicContact CZ2-CE2 4.11Å; W566-F576 HydrophobicContact CZ3-CD2 4.34Å; W566-F576 HydrophobicContact CZ3-CE1 4.41Å; W566-F576 AromaticContact CZ3-CE2 3.66Å; W566-F576 HydrophobicContact CZ3-CE2 3.66Å; W566-F576 AromaticContact CZ3-CZ 3.7Å; W566-F576 HydrophobicContact CZ3-CZ 3.7Å; K570-F576 HydrophobicContact CB-CD2 3.82Å; K570-F576 HydrophobicContact CB-CE2 4.1Å; K570-F576 HydrophobicContact CG-CD2 4.23Å; K574-F576 PolarHBondContact O-N 2.88Å; K574-F576 VanDerWaalsContact O-N 3.13Å; F576-A578 PolarHBondContact O-N 3.11Å
577	L	96.1	Very high	92.4	Very high	13 Å²	13	56.8 Å²	56.8	7%	0.068	31%	0.306	C	S	.	.	P	Polyproline II helix	trans	-65.7	132.2	-175.8	-174.1	60.7	0	0	0	110.6	I543 W544 K574 L605 A608	I543-L577 HydrophobicContact CG2-CD1 3.55Å; I543-L577 CarbonylContact O-C 3.45Å; I543-L577 WeakPolarHBondContact O-CA 3.4Å; W544-L577 HydrophobicContact CD2-CD1 4.23Å; W544-L577 HydrophobicContact CE3-CD1 4.06Å; W544-L577 HydrophobicContact CZ3-CD1 4.4Å; K574-L577 HydrophobicContact CB-CB 4.27Å; K574-L577 HydrophobicContact CB-CD2 4.23Å; K574-L577 HydrophobicContact CD-CD2 4.08Å; K574-L577 VanDerWaalsContact O-CB 3.25Å; K574-L577 WeakPolarHBondContact O-CB 3.2Å; K574-L577 PolarHBondContact O-N 3.29Å; K574-L577 VanDerWaalsContact O-N 3.14Å; L577-L605 HydrophobicContact CD1-CD1 4.33Å; L577-A608 HydrophobicContact CD1-CB 3.67Å; L577-A608 HydrophobicContact CD2-CB 3.96Å; L577-A608 HydrophobicContact CG-CB 4.49Å
578	A	95.7	Very high	92.2	Very high	14 Å²	14	56.8 Å²	56.8	12%	0.116	31%	0.307	C	S	.	.	P	Polyproline II helix	trans	-56.6	143.1	178.8	0	0	0	0	0	111.3	I543 F576 L605 H609	I543-A578 PolarHBondContact O-N 3.34Å; F576-A578 PolarHBondContact O-N 3.11Å; A578-L605 HydrophobicContact CB-CD1 4.02Å; A578-L605 WeakPolarHBondContact O-CD1 3.47Å; A578-H609 PolarHBondContact O-NE2 3.02Å
579	P	93.1	Very high	91.9	Very high	101 Å²	101	56.5 Å²	56.5	66%	0.656	31%	0.309	S	S	*	.	P	Polyproline II helix	trans	-65.8	149.3	178.8	28.4	-35.1	0	0	0	111.6
580	L	90.9	Very high	91.8	Very high	55 Å²	55	57.3 Å²	57.3	29%	0.288	31%	0.312	S	S	.	.	P	Polyproline II helix	trans	-68.3	147.6	170.9	-69	177	0	0	0	111.1	C582 L587 L605 L606 H609	L580-C582 PolarHBondContact O-N 3.36Å; L580-L587 HydrophobicContact CD1-CD1 4.06Å; L580-L605 HydrophobicContact CD2-CD2 4.49Å; L580-L605 HydrophobicContact CD2-CG 4.13Å; L580-L606 HydrophobicContact CD2-CD2 3.73Å; L580-L606 HydrophobicContact CD2-CG 4.44Å; L580-H609 HydrophobicContact CD1-CB 4.17Å; L580-H609 HydrophobicContact CD2-CB 4.23Å; L580-H609 WeakPolarHBondContact CD2-CD2 3.29Å; L580-H609 HydrophobicContact CG-CB 4.39Å
581	P	84.2	Confident	91.8	Very high	64 Å²	64	57.3 Å²	57.3	42%	0.416	31%	0.312	S	S	.	.	P	Polyproline II helix	trans	-66.9	121.6	172.9	28.2	-33.5	0	0	0	110.4	T583	P581-T583 PolarHBondContact O-N 2.9Å; P581-T583 PolarHBondContact O-OG1 3.18Å
582	C	75.6	Confident	91.7	Very high	137 Å²	137	57.7 Å²	57.7	93%	0.926	31%	0.314	S	S	*	.			trans	-58.3	108.7	179.3	-61.3	0	0	0	0	111	L580	L580-C582 PolarHBondContact O-N 3.36Å
583	T	83.1	Confident	91.6	Very high	71 Å²	71	59.8 Å²	59.8	44%	0.436	32%	0.317	S	S	.	.			trans	-146.5	150.5	-179.6	47.8	0	0	0	0	110.1	P581 L585 Q590	P581-T583 PolarHBondContact O-N 2.9Å; P581-T583 PolarHBondContact O-OG1 3.18Å; T583-L585 PolarHBondContact O-N 3.46Å; T583-Q590 VanDerWaalsContact OG1-CD 3.28Å; T583-Q590 PolarHBondContact OG1-NE2 3.32Å
584	E	84.6	Confident	91.6	Very high	201 Å²	201	54.8 Å²	54.8	94%	0.939	30%	0.295	S	S	*	.	S	Bend	trans	-73.2	20.6	-179.1	-54.6	-60.2	146.4	0	0	114
585	L	88.7	Confident	91.7	Very high	45 Å²	45	51.2 Å²	51.2	24%	0.236	28%	0.28	C	S	.	.	S	Bend	trans	-117.6	143.1	-169.3	-61.5	172.4	0	0	0	110.5	T583 Q589 Q590 R593	T583-L585 PolarHBondContact O-N 3.46Å; L585-Q589 HydrophobicContact CB-CB 4.29Å; L585-Q590 HydrophobicContact CB-CG 3.86Å; L585-Q590 HydrophobicContact CD1-CG 4.48Å; L585-Q590 PolarHBondContact O-NE2 3.35Å; L585-R593 VanDerWaalsContact CD1-CZ 3.4Å
586	S	91.6	Very high	91.7	Very high	42 Å²	42	50.1 Å²	50.1	29%	0.294	28%	0.279	S	S	.	.			trans	-60	156.2	170.6	65.8	0	0	0	0	111.5	G588 Q589 Q590 E617	S586-G588 PolarHBondContact O-N 3.09Å; S586-Q589 PolarHBondContact O-N 3.4Å; S586-Q589 VanDerWaalsContact O-N 3.15Å; S586-Q589 VanDerWaalsContact OG-CB 3.31Å; S586-Q589 WeakPolarHBondContact OG-CB 3.4Å; S586-Q589 WeakPolarHBondContact OG-CG 3.48Å; S586-Q589 PolarHBondContact OG-N 2.88Å; S586-Q589 VanDerWaalsContact OG-N 3.12Å; S586-Q589 PolarHBondContact OG-NE2 2.92Å; S586-Q590 WeakPolarHBondContact O-CG 3.39Å; S586-Q590 PolarHBondContact O-N 3.46Å; S586-E617 VanDerWaalsContact CB-OE2 3.3Å; S586-E617 WeakPolarHBondContact CB-OE2 3.25Å; S586-E617 PolarHBondContact OG-OE1 3Å; S586-E617 PolarHBondContact OG-OE2 3.31Å
587	L	93.8	Very high	91.7	Very high	14 Å²	14	56.1 Å²	56.1	7%	0.073	31%	0.311	C	S	.	.	H	α-helix	trans	-58	-37.5	176.9	-175.2	148.8	0	0	0	111.9	L580 Q590 L591 L606 H609 E614 V615	L580-L587 HydrophobicContact CD1-CD1 4.06Å; L587-Q590 PolarHBondContact O-N 3.24Å; L587-L591 WeakPolarHBondContact O-CB 3.41Å; L587-L591 PolarHBondContact O-N 3.03Å; L587-L606 HydrophobicContact CG-CD2 3.97Å; L587-H609 HydrophobicContact CD1-CB 3.76Å; L587-E614 HydrophobicContact CB-CB 4.42Å; L587-E614 HydrophobicContact CD2-CB 3.93Å; L587-V615 HydrophobicContact CD2-CG1 4.4Å
588	G	92.8	Very high	91.7	Very high	1 Å²	1	58.9 Å²	58.9	1%	0.01	32%	0.324	C	S	.	.	H	α-helix	trans	-66.9	-41.5	175.7	0	0	0	0	0	113.1	S586 Q590 L591 L592 E614 E617	S586-G588 PolarHBondContact O-N 3.09Å; G588-Q590 PolarHBondContact O-N 3.16Å; G588-L591 PolarHBondContact O-N 3.06Å; G588-L592 WeakPolarHBondContact O-CB 3.36Å; G588-L592 WeakPolarHBondContact O-CD1 3.44Å; G588-L592 VanDerWaalsContact O-CG 3.25Å; G588-L592 WeakPolarHBondContact O-CG 3.25Å; G588-L592 PolarHBondContact O-N 2.95Å; G588-E614 WeakPolarHBondContact CA-O 3.36Å; G588-E617 VanDerWaalsContact CA-OE2 3.24Å; G588-E617 WeakPolarHBondContact CA-OE2 3.45Å; G588-E617 PolarHBondContact N-OE2 2.88Å
589	Q	92.4	Very high	91.7	Very high	74 Å²	74	61.3 Å²	61.3	35%	0.346	34%	0.335	S	S	.	.	H	α-helix	trans	-64.4	-38.6	173.4	-73.5	161.4	35.1	0	0	112.7	L585 S586 L591 R593 E617	L585-Q589 HydrophobicContact CB-CB 4.29Å; S586-Q589 PolarHBondContact O-N 3.4Å; S586-Q589 VanDerWaalsContact O-N 3.15Å; S586-Q589 VanDerWaalsContact OG-CB 3.31Å; S586-Q589 WeakPolarHBondContact OG-CB 3.4Å; S586-Q589 WeakPolarHBondContact OG-CG 3.48Å; S586-Q589 PolarHBondContact OG-N 2.88Å; S586-Q589 VanDerWaalsContact OG-N 3.12Å; S586-Q589 PolarHBondContact OG-NE2 2.92Å; Q589-L591 VanDerWaalsContact C-N 3.35Å; Q589-R593 WeakPolarHBondContact O-CG 3.4Å; Q589-R593 PolarHBondContact O-N 2.73Å; Q589-R593 VanDerWaalsContact O-N 3.14Å; Q589-E617 WeakPolarHBondContact CG-OE1 3.4Å; Q589-E617 PolarHBondContact N-OE2 2.92Å; Q589-E617 PolarHBondContact NE2-OE1 3.3Å
590	Q	94.6	Very high	91.9	Very high	24 Å²	24	58 Å²	58	11%	0.112	31%	0.312	C	S	.	.	H	α-helix	trans	-63.3	-41.6	171.9	-66.3	178.2	52.5	0	0	111	T583 L585 S586 L587 G588 R593 A594 L606	T583-Q590 VanDerWaalsContact OG1-CD 3.28Å; T583-Q590 PolarHBondContact OG1-NE2 3.32Å; L585-Q590 HydrophobicContact CB-CG 3.86Å; L585-Q590 HydrophobicContact CD1-CG 4.48Å; L585-Q590 PolarHBondContact O-NE2 3.35Å; S586-Q590 WeakPolarHBondContact O-CG 3.39Å; S586-Q590 PolarHBondContact O-N 3.46Å; L587-Q590 PolarHBondContact O-N 3.24Å; G588-Q590 PolarHBondContact O-N 3.16Å; Q590-R593 PolarHBondContact O-N 3.1Å; Q590-A594 WeakPolarHBondContact O-CB 3.24Å; Q590-A594 PolarHBondContact O-N 3.44Å; Q590-L606 HydrophobicContact CB-CD1 3.74Å; Q590-L606 HydrophobicContact CB-CD2 3.7Å; Q590-L606 HydrophobicContact CB-CG 4.41Å
591	L	96.2	Very high	92.2	Very high	1 Å²	1	60 Å²	60	1%	0.005	32%	0.32	C	S	.	.	H	α-helix	trans	-67.8	-38.7	179.6	-179.7	64.5	0	0	0	112	L587 G588 Q589 T595 A603 L606 L607 V615 A627 L643	L587-L591 WeakPolarHBondContact O-CB 3.41Å; L587-L591 PolarHBondContact O-N 3.03Å; G588-L591 PolarHBondContact O-N 3.06Å; Q589-L591 VanDerWaalsContact C-N 3.35Å; L591-T595 VanDerWaalsContact O-CB 3.27Å; L591-T595 WeakPolarHBondContact O-CB 3.33Å; L591-T595 PolarHBondContact O-N 2.91Å; L591-T595 PolarHBondContact O-OG1 2.96Å; L591-A603 HydrophobicContact CD1-CB 4.27Å; L591-L606 HydrophobicContact CB-CB 4.43Å; L591-L606 HydrophobicContact CB-CD1 4.28Å; L591-L606 HydrophobicContact CD1-CB 4.21Å; L591-L607 HydrophobicContact CD1-CD2 4.13Å; L591-L607 HydrophobicContact CD1-CG 4.05Å; L591-L607 HydrophobicContact CD2-CD2 3.78Å; L591-V615 HydrophobicContact CD2-CB 3.85Å; L591-V615 HydrophobicContact CD2-CG1 3.96Å; L591-A627 HydrophobicContact CD2-CB 4.38Å; L591-A627 HydrophobicContact CG-CB 4.2Å; L591-L643 HydrophobicContact CD1-CD2 4.36Å; L591-L643 HydrophobicContact CD2-CD2 4.04Å; L591-L643 HydrophobicContact CG-CD2 4.41Å
592	L	94.8	Very high	92.8	Very high	9 Å²	9	59 Å²	59	5%	0.047	31%	0.312	C	S	.	.	H	α-helix	trans	-59.9	-44.7	173.5	-74.2	161.9	0	0	0	111.2	G588 T595 A596 C619 C625 A627 L630	G588-L592 WeakPolarHBondContact O-CB 3.36Å; G588-L592 WeakPolarHBondContact O-CD1 3.44Å; G588-L592 VanDerWaalsContact O-CG 3.25Å; G588-L592 WeakPolarHBondContact O-CG 3.25Å; G588-L592 PolarHBondContact O-N 2.95Å; L592-T595 PolarHBondContact O-N 2.87Å; L592-A596 WeakPolarHBondContact O-CB 3.26Å; L592-A596 PolarHBondContact O-N 2.76Å; L592-C619 HydrophobicContact CD1-CB 4.28Å; L592-C619 HydrophobicContact CD2-CB 4.32Å; L592-C625 WeakPolarHBondContact CD2-O 3.45Å; L592-A627 HydrophobicContact CD2-CB 4.19Å; L592-A627 VanDerWaalsContact CD2-N 3.33Å; L592-L630 HydrophobicContact CB-CD1 4.24Å; L592-L630 HydrophobicContact CD2-CD1 3.69Å; L592-L630 WeakPolarHBondContact O-CD1 3.38Å
593	R	94.1	Very high	93.8	Very high	143 Å²	143	52.5 Å²	52.5	54%	0.54	27%	0.268	S	S	.	.	H	α-helix	trans	-64.7	-54.2	175.3	-69.2	179	-171.3	-152.1	4.8	112.1	L585 Q589 Q590 T595 A596 D597	L585-R593 VanDerWaalsContact CD1-CZ 3.4Å; Q589-R593 WeakPolarHBondContact O-CG 3.4Å; Q589-R593 PolarHBondContact O-N 2.73Å; Q589-R593 VanDerWaalsContact O-N 3.14Å; Q590-R593 PolarHBondContact O-N 3.1Å; R593-T595 PolarHBondContact O-N 2.99Å; R593-T595 VanDerWaalsContact O-N 3.11Å; R593-A596 WeakPolarHBondContact O-CA 3.42Å; R593-A596 WeakPolarHBondContact O-CB 3.36Å; R593-A596 PolarHBondContact O-N 2.91Å; R593-D597 PolarHBondContact O-N 2.94Å
594	A	96.1	Very high	94.5	Very high	6 Å²	6	49.3 Å²	49.3	5%	0.05	25%	0.248	C	C	.	.	H	α-helix	trans	-55.4	-33.8	177.4	0	0	0	0	0	112.6	Q590 E598 D599 T602 A603 L606	Q590-A594 WeakPolarHBondContact O-CB 3.24Å; Q590-A594 PolarHBondContact O-N 3.44Å; A594-E598 CarbonylContact O-C 3.56Å; A594-E598 WeakPolarHBondContact O-CA 3.19Å; A594-E598 PolarHBondContact O-N 3.13Å; A594-D599 PolarHBondContact O-N 3.32Å; A594-T602 HydrophobicContact CB-CG2 3.96Å; A594-A603 HydrophobicContact CB-CB 4.27Å; A594-L606 HydrophobicContact CB-CD1 4.18Å
595	T	96.7	Very high	95.1	Very high	1 Å²	1	40.7 Å²	40.7	1%	0.006	21%	0.209	C	C	.	.	H	α-helix	trans	-76.1	-32.6	175.1	-52.5	0	0	0	0	113.2	L591 L592 R593 A627 L630 A631 L639 L643	L591-T595 VanDerWaalsContact O-CB 3.27Å; L591-T595 WeakPolarHBondContact O-CB 3.33Å; L591-T595 PolarHBondContact O-N 2.91Å; L591-T595 PolarHBondContact O-OG1 2.96Å; L592-T595 PolarHBondContact O-N 2.87Å; R593-T595 PolarHBondContact O-N 2.99Å; R593-T595 VanDerWaalsContact O-N 3.11Å; T595-A627 HydrophobicContact CG2-CB 4.42Å; T595-A627 WeakPolarHBondContact CG2-O 3.39Å; T595-L630 HydrophobicContact CG2-CB 4Å; T595-A631 HydrophobicContact CG2-CB 3.74Å; T595-L639 HydrophobicContact CG2-CD1 4.29Å; T595-L643 HydrophobicContact CG2-CD1 4.24Å
596	A	94.7	Very high	95.5	Very high	37 Å²	37	38.5 Å²	38.5	31%	0.306	20%	0.197	S	C	.	.	H	α-helix	trans	-71.1	-39.4	174	0	0	0	0	0	112.2	L592 R593 E598 L630 K634	L592-A596 WeakPolarHBondContact O-CB 3.26Å; L592-A596 PolarHBondContact O-N 2.76Å; R593-A596 WeakPolarHBondContact O-CA 3.42Å; R593-A596 WeakPolarHBondContact O-CB 3.36Å; R593-A596 PolarHBondContact O-N 2.91Å; A596-E598 VanDerWaalsContact C-N 3.3Å; A596-L630 HydrophobicContact CB-CD1 4.39Å; A596-K634 WeakPolarHBondContact O-CE 3.27Å; A596-K634 PolarHBondContact O-NZ 3.23Å
597	D	95.6	Very high	95.7	Very high	125 Å²	125	36.7 Å²	36.7	67%	0.668	18%	0.184	S	C	*	.	H	α-helix	trans	-82.2	-10.5	178.3	-59.7	-35.5	0	0	0	112.6	R593 D599	R593-D597 PolarHBondContact O-N 2.94Å; D597-D599 VanDerWaalsContact C-N 3.27Å; D597-D599 PolarHBondContact O-N 3.39Å
598	E	96.4	Very high	95.8	Very high	71 Å²	71	36.1 Å²	36.1	33%	0.332	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.5	26	-177.3	-60.1	-177.6	75.4	0	0	115	A594 A596 L600 K634 N636 L639	A594-E598 CarbonylContact O-C 3.56Å; A594-E598 WeakPolarHBondContact O-CA 3.19Å; A594-E598 PolarHBondContact O-N 3.13Å; A596-E598 VanDerWaalsContact C-N 3.3Å; E598-L600 PolarHBondContact O-N 2.89Å; E598-K634 HydrophobicContact CG-CB 4.38Å; E598-K634 HydrophobicContact CG-CG 4.01Å; E598-K634 VanDerWaalsContact OE2-CD 3.29Å; E598-K634 WeakPolarHBondContact OE2-CD 3.49Å; E598-K634 WeakPolarHBondContact OE2-CG 3.31Å; E598-K634 IonicContact OE2-NZ 3.55Å; E598-K634 PolarHBondContact OE2-NZ 3.3Å; E598-N636 WeakPolarHBondContact OE1-CB 3.41Å; E598-N636 PolarHBondContact OE1-ND2 3.45Å; E598-L639 HydrophobicContact CB-CD1 4.38Å; E598-L639 HydrophobicContact CG-CD1 4.39Å
599	D	96.8	Very high	95.9	Very high	66 Å²	66	38.8 Å²	38.8	35%	0.353	19%	0.194	S	C	.	.			trans	-71.3	93.5	170.5	-176.8	-9.2	0	0	0	110.9	A594 D597 Q601 T602 A603	A594-D599 PolarHBondContact O-N 3.32Å; D597-D599 VanDerWaalsContact C-N 3.27Å; D597-D599 PolarHBondContact O-N 3.39Å; D599-Q601 VanDerWaalsContact C-N 3.3Å; D599-Q601 PolarHBondContact O-N 3.32Å; D599-Q601 WeakPolarHBondContact OD1-CA 3.34Å; D599-Q601 WeakPolarHBondContact OD1-CB 3.42Å; D599-Q601 PolarHBondContact OD1-N 3.02Å; D599-T602 VanDerWaalsContact CG-CB 3.48Å; D599-T602 PolarHBondContact OD1-N 3.27Å; D599-T602 WeakPolarHBondContact OD2-CB 3.16Å; D599-T602 PolarHBondContact OD2-OG1 2.91Å; D599-A603 WeakPolarHBondContact O-CB 3.21Å; D599-A603 PolarHBondContact O-N 2.86Å
600	L	96.6	Very high	95.9	Very high	31 Å²	31	36 Å²	36	16%	0.162	19%	0.185	C	C	.	.	H	α-helix	trans	-61.9	-32.2	176.1	-177	61.8	0	0	0	113.4	S534 I535 E598 I604 V638 L639 L642	S534-L600 WeakPolarHBondContact O-CD2 3.27Å; I535-L600 HydrophobicContact CG1-CD2 4.32Å; E598-L600 PolarHBondContact O-N 2.89Å; L600-I604 HydrophobicContact CD1-CD1 3.77Å; L600-I604 HydrophobicContact CD1-CG1 4.07Å; L600-I604 HydrophobicContact CG-CD1 3.79Å; L600-I604 HydrophobicContact CG-CG1 4.47Å; L600-I604 WeakPolarHBondContact O-CB 3.16Å; L600-I604 WeakPolarHBondContact O-CD1 3.44Å; L600-I604 WeakPolarHBondContact O-CG1 3.39Å; L600-I604 PolarHBondContact O-N 2.71Å; L600-V638 HydrophobicContact CD1-CG1 3.84Å; L600-V638 HydrophobicContact CD2-CG1 4.16Å; L600-L639 HydrophobicContact CD1-CD2 3.67Å; L600-L639 HydrophobicContact CD1-CG 4.43Å; L600-L642 HydrophobicContact CD1-CD1 3.64Å
601	Q	96.6	Very high	95.8	Very high	98 Å²	98	37.1 Å²	37.1	46%	0.458	20%	0.195	S	C	.	.	H	α-helix	trans	-72.2	-50.5	-177.8	176.9	162.7	-5.2	0	0	110.4	L539 I543 D599 A603 I604 L605	L539-Q601 HydrophobicContact CD1-CB 3.99Å; L539-Q601 VanDerWaalsContact CD1-CD 3.49Å; L539-Q601 HydrophobicContact CD1-CG 3.73Å; I543-Q601 HydrophobicContact CD1-CG 4.37Å; D599-Q601 VanDerWaalsContact C-N 3.3Å; D599-Q601 PolarHBondContact O-N 3.32Å; D599-Q601 WeakPolarHBondContact OD1-CA 3.34Å; D599-Q601 WeakPolarHBondContact OD1-CB 3.42Å; D599-Q601 PolarHBondContact OD1-N 3.02Å; Q601-A603 VanDerWaalsContact C-N 3.34Å; Q601-I604 PolarHBondContact O-N 3.03Å; Q601-L605 WeakPolarHBondContact O-CB 3.16Å; Q601-L605 PolarHBondContact O-N 3.4Å
602	T	96.5	Very high	95.5	Very high	41 Å²	41	44.2 Å²	44.2	25%	0.252	22%	0.222	S	C	.	.	H	α-helix	trans	-65.8	-37.8	176.9	-60.2	0	0	0	0	111.1	A594 D599 L605 L606	A594-T602 HydrophobicContact CB-CG2 3.96Å; D599-T602 VanDerWaalsContact CG-CB 3.48Å; D599-T602 PolarHBondContact OD1-N 3.27Å; D599-T602 WeakPolarHBondContact OD2-CB 3.16Å; D599-T602 PolarHBondContact OD2-OG1 2.91Å; T602-L605 PolarHBondContact O-N 3.35Å; T602-L606 HydrophobicContact CG2-CD1 3.7Å; T602-L606 HydrophobicContact CG2-CG 4.33Å; T602-L606 WeakPolarHBondContact O-CB 3.29Å; T602-L606 WeakPolarHBondContact O-CD1 3.48Å; T602-L606 VanDerWaalsContact O-CG 3.25Å; T602-L606 WeakPolarHBondContact O-CG 3.48Å; T602-L606 PolarHBondContact O-N 3.4Å
603	A	97.2	Very high	95.2	Very high	1 Å²	1	49.3 Å²	49.3	1%	0.008	25%	0.246	C	C	.	.	H	α-helix	trans	-61.4	-45.5	174.1	0	0	0	0	0	112.8	L591 A594 D599 Q601 L605 L606 L607 L639	L591-A603 HydrophobicContact CD1-CB 4.27Å; A594-A603 HydrophobicContact CB-CB 4.27Å; D599-A603 WeakPolarHBondContact O-CB 3.21Å; D599-A603 PolarHBondContact O-N 2.86Å; Q601-A603 VanDerWaalsContact C-N 3.34Å; A603-L605 PolarHBondContact O-N 2.97Å; A603-L606 PolarHBondContact O-N 3.13Å; A603-L607 WeakPolarHBondContact O-CB 3.32Å; A603-L607 VanDerWaalsContact O-CG 3.24Å; A603-L607 WeakPolarHBondContact O-CG 3.26Å; A603-L607 PolarHBondContact O-N 3.02Å; A603-L639 HydrophobicContact CB-CD2 3.68Å
604	I	97.4	Very high	95.2	Very high	4 Å²	4	46.3 Å²	46.3	2%	0.021	24%	0.238	C	C	.	.	H	α-helix	trans	-65.4	-39.4	177.2	-66.9	164	0	0	0	111.1	I535 I543 L600 Q601 L607 A608 L642	I535-I604 HydrophobicContact CD1-CD1 3.58Å; I535-I604 HydrophobicContact CG1-CD1 3.68Å; I535-I604 HydrophobicContact CG2-CD1 4.28Å; I543-I604 HydrophobicContact CD1-CB 3.83Å; I543-I604 HydrophobicContact CD1-CG2 3.65Å; L600-I604 HydrophobicContact CD1-CD1 3.77Å; L600-I604 HydrophobicContact CD1-CG1 4.07Å; L600-I604 HydrophobicContact CG-CD1 3.79Å; L600-I604 HydrophobicContact CG-CG1 4.47Å; L600-I604 WeakPolarHBondContact O-CB 3.16Å; L600-I604 WeakPolarHBondContact O-CD1 3.44Å; L600-I604 WeakPolarHBondContact O-CG1 3.39Å; L600-I604 PolarHBondContact O-N 2.71Å; Q601-I604 PolarHBondContact O-N 3.03Å; I604-L607 PolarHBondContact O-N 2.61Å; I604-A608 VanDerWaalsContact O-CB 3.31Å; I604-A608 WeakPolarHBondContact O-CB 3.41Å; I604-A608 PolarHBondContact O-N 3.39Å; I604-L642 HydrophobicContact CD1-CD1 4.33Å; I604-L642 HydrophobicContact CG1-CD1 4.03Å
605	L	97.2	Very high	95.1	Very high	20 Å²	20	46.1 Å²	46.1	11%	0.105	24%	0.236	C	C	.	.	H	α-helix	trans	-60.2	-47.8	175.8	176.6	61.5	0	0	0	111.6	I543 L577 A578 L580 Q601 T602 A603 A608 H609	I543-L605 HydrophobicContact CD1-CB 4.5Å; I543-L605 HydrophobicContact CG1-CB 4.45Å; I543-L605 HydrophobicContact CG2-CB 4.48Å; I543-L605 HydrophobicContact CG2-CD1 4.02Å; L577-L605 HydrophobicContact CD1-CD1 4.33Å; A578-L605 HydrophobicContact CB-CD1 4.02Å; A578-L605 WeakPolarHBondContact O-CD1 3.47Å; L580-L605 HydrophobicContact CD2-CD2 4.49Å; L580-L605 HydrophobicContact CD2-CG 4.13Å; Q601-L605 WeakPolarHBondContact O-CB 3.16Å; Q601-L605 PolarHBondContact O-N 3.4Å; T602-L605 PolarHBondContact O-N 3.35Å; A603-L605 PolarHBondContact O-N 2.97Å; L605-A608 WeakPolarHBondContact O-CB 3.47Å; L605-A608 PolarHBondContact O-N 3.48Å; L605-H609 PolarHBondContact O-CD2 2.96Å; L605-H609 PolarHBondContact O-N 3.31Å; L605-H609 VanDerWaalsContact O-N 3.11Å
606	L	96.9	Very high	94.9	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-64.8	-41.2	178.7	-70.3	162.3	0	0	0	112	L580 L587 Q590 L591 A594 T602 A603 A608 H609 G610	L580-L606 HydrophobicContact CD2-CD2 3.73Å; L580-L606 HydrophobicContact CD2-CG 4.44Å; L587-L606 HydrophobicContact CG-CD2 3.97Å; Q590-L606 HydrophobicContact CB-CD1 3.74Å; Q590-L606 HydrophobicContact CB-CD2 3.7Å; Q590-L606 HydrophobicContact CB-CG 4.41Å; L591-L606 HydrophobicContact CB-CB 4.43Å; L591-L606 HydrophobicContact CB-CD1 4.28Å; L591-L606 HydrophobicContact CD1-CB 4.21Å; A594-L606 HydrophobicContact CB-CD1 4.18Å; T602-L606 HydrophobicContact CG2-CD1 3.7Å; T602-L606 HydrophobicContact CG2-CG 4.33Å; T602-L606 WeakPolarHBondContact O-CB 3.29Å; T602-L606 WeakPolarHBondContact O-CD1 3.48Å; T602-L606 VanDerWaalsContact O-CG 3.25Å; T602-L606 WeakPolarHBondContact O-CG 3.48Å; T602-L606 PolarHBondContact O-N 3.4Å; A603-L606 PolarHBondContact O-N 3.13Å; L606-A608 VanDerWaalsContact C-N 3.32Å; L606-A608 PolarHBondContact O-N 3.17Å; L606-H609 PolarHBondContact O-N 2.85Å; L606-G610 PolarHBondContact O-N 3.09Å
607	L	96.6	Very high	94.8	Very high	3 Å²	3	48.7 Å²	48.7	2%	0.016	24%	0.243	C	C	.	.	H	α-helix	trans	-65.2	-32.8	173.5	-70.8	178.9	0	0	0	112.9	L591 A603 I604 V615 L642 L643 Y646	L591-L607 HydrophobicContact CD1-CD2 4.13Å; L591-L607 HydrophobicContact CD1-CG 4.05Å; L591-L607 HydrophobicContact CD2-CD2 3.78Å; A603-L607 WeakPolarHBondContact O-CB 3.32Å; A603-L607 VanDerWaalsContact O-CG 3.24Å; A603-L607 WeakPolarHBondContact O-CG 3.26Å; A603-L607 PolarHBondContact O-N 3.02Å; I604-L607 PolarHBondContact O-N 2.61Å; L607-V615 HydrophobicContact CD2-CB 4.17Å; L607-V615 HydrophobicContact CD2-CG1 3.66Å; L607-L642 HydrophobicContact CD1-CB 4.16Å; L607-L643 HydrophobicContact CD1-CD2 4.39Å; L607-L643 HydrophobicContact CD2-CD2 4.11Å; L607-Y646 HydrophobicContact CB-CD1 3.83Å; L607-Y646 HydrophobicContact CB-CD2 4.17Å; L607-Y646 HydrophobicContact CB-CE1 3.99Å; L607-Y646 HydrophobicContact CB-CE2 4.33Å; L607-Y646 HydrophobicContact CB-CG 3.93Å; L607-Y646 HydrophobicContact CD1-CD2 4.02Å; L607-Y646 HydrophobicContact CD1-CG 4.29Å; L607-Y646 HydrophobicContact CD2-CG 4.21Å; L607-Y646 HydrophobicContact CG-CG 4.37Å; L607-Y646 WeakPolarHBondContact O-CD1 3.36Å; L607-Y646 WeakPolarHBondContact O-CE1 3.41Å
608	A	95.8	Very high	94.5	Very high	2 Å²	2	45.5 Å²	45.5	2%	0.017	23%	0.228	C	C	.	.	H	α-helix	trans	-69.3	-33.1	175.2	0	0	0	0	0	112.4	I543 W544 K574 L577 I604 L605 L606	I543-A608 HydrophobicContact CG2-CB 4.35Å; W544-A608 HydrophobicContact CH2-CB 3.75Å; W544-A608 HydrophobicContact CZ2-CB 3.5Å; W544-A608 VanDerWaalsContact CZ2-CB 3.5Å; W544-A608 HydrophobicContact CZ3-CB 4.44Å; K574-A608 WeakPolarHBondContact CD-O 3.5Å; K574-A608 VanDerWaalsContact CE-O 3.29Å; K574-A608 WeakPolarHBondContact CE-O 3.34Å; K574-A608 PolarHBondContact NZ-O 3.4Å; L577-A608 HydrophobicContact CD1-CB 3.67Å; L577-A608 HydrophobicContact CD2-CB 3.96Å; L577-A608 HydrophobicContact CG-CB 4.49Å; I604-A608 VanDerWaalsContact O-CB 3.31Å; I604-A608 WeakPolarHBondContact O-CB 3.41Å; I604-A608 PolarHBondContact O-N 3.39Å; L605-A608 WeakPolarHBondContact O-CB 3.47Å; L605-A608 PolarHBondContact O-N 3.48Å; L606-A608 VanDerWaalsContact C-N 3.32Å; L606-A608 PolarHBondContact O-N 3.17Å
609	H	94.9	Very high	93.7	Very high	58 Å²	58	44.8 Å²	44.8	27%	0.269	23%	0.23	S	C	.	.	H	α-helix	trans	-78	-52.8	173.9	-82.1	-76.4	0	0	0	112.9	K574 A578 L580 L587 L605 L606	K574-H609 PolarHBondContact NZ-O 2.91Å; A578-H609 PolarHBondContact O-NE2 3.02Å; L580-H609 HydrophobicContact CD1-CB 4.17Å; L580-H609 HydrophobicContact CD2-CB 4.23Å; L580-H609 WeakPolarHBondContact CD2-CD2 3.29Å; L580-H609 HydrophobicContact CG-CB 4.39Å; L587-H609 HydrophobicContact CD1-CB 3.76Å; L605-H609 PolarHBondContact O-CD2 2.96Å; L605-H609 PolarHBondContact O-N 3.31Å; L605-H609 VanDerWaalsContact O-N 3.11Å; L606-H609 PolarHBondContact O-N 2.85Å
610	G	92.5	Very high	92.5	Very high	15 Å²	15	44 Å²	44	16%	0.155	24%	0.238	C	C	.	.			trans	-62.1	148.3	-160.4	0	0	0	0	0	117.1	L606	L606-G610 PolarHBondContact O-N 3.09Å
611	S	91.8	Very high	91	Very high	48 Å²	48	52.7 Å²	52.7	34%	0.336	28%	0.278	S	S	.	.			trans	-71.2	164	161.8	67	0	0	0	0	111.4	E613 E614 V615	S611-E613 PolarHBondContact O-N 2.91Å; S611-E614 WeakPolarHBondContact CB-OE2 3.38Å; S611-E614 PolarHBondContact N-OE2 3.2Å; S611-E614 PolarHBondContact O-N 3.14Å; S611-E614 WeakPolarHBondContact OG-CG 3.3Å; S611-E614 PolarHBondContact OG-N 3.31Å; S611-E614 PolarHBondContact OG-OE2 3.16Å; S611-V615 WeakPolarHBondContact O-CG1 3.43Å; S611-V615 PolarHBondContact O-N 2.98Å
612	R	89.9	Confident	89.6	Confident	150 Å²	150	50.8 Å²	50.8	57%	0.566	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-29.5	177.5	-168.5	-166.9	68.3	109.9	4.7	111.3	V615 N616 G647	R612-V615 WeakPolarHBondContact O-CG2 3.49Å; R612-N616 PolarHBondContact O-ND2 3.42Å; R612-G647 WeakPolarHBondContact CG-O 3.29Å
613	E	89.9	Confident	88.8	Confident	116 Å²	116	52.4 Å²	52.4	54%	0.542	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-41.1	-178.1	-70.2	57.8	-133.6	0	0	111	S611 N616	S611-E613 PolarHBondContact O-N 2.91Å; E613-N616 PolarHBondContact O-N 3.18Å
614	E	92.9	Very high	88.4	Confident	79 Å²	79	53.1 Å²	53.1	37%	0.369	30%	0.299	S	S	.	.	G	3₁₀ helix	trans	-68.7	-39.9	176.2	-68.3	160.7	112.8	0	0	113.2	L587 G588 S611 N616 E617	L587-E614 HydrophobicContact CB-CB 4.42Å; L587-E614 HydrophobicContact CD2-CB 3.93Å; G588-E614 WeakPolarHBondContact CA-O 3.36Å; S611-E614 WeakPolarHBondContact CB-OE2 3.38Å; S611-E614 PolarHBondContact N-OE2 3.2Å; S611-E614 PolarHBondContact O-N 3.14Å; S611-E614 WeakPolarHBondContact OG-CG 3.3Å; S611-E614 PolarHBondContact OG-N 3.31Å; S611-E614 PolarHBondContact OG-OE2 3.16Å; E614-N616 PolarHBondContact O-N 2.96Å; E614-N616 VanDerWaalsContact O-N 3.14Å; E614-E617 WeakPolarHBondContact O-CB 3.45Å; E614-E617 PolarHBondContact O-N 3.12Å; E614-E617 VanDerWaalsContact O-N 3.11Å
615	V	93.8	Very high	88.2	Confident	3 Å²	3	53 Å²	53	2%	0.018	30%	0.299	C	S	.	.	G	3₁₀ helix	trans	-68.9	-11.1	178.5	-56.4	0	0	0	0	113.2	L587 L591 L607 S611 R612 V648	L587-V615 HydrophobicContact CD2-CG1 4.4Å; L591-V615 HydrophobicContact CD2-CB 3.85Å; L591-V615 HydrophobicContact CD2-CG1 3.96Å; L607-V615 HydrophobicContact CD2-CB 4.17Å; L607-V615 HydrophobicContact CD2-CG1 3.66Å; S611-V615 WeakPolarHBondContact O-CG1 3.43Å; S611-V615 PolarHBondContact O-N 2.98Å; R612-V615 WeakPolarHBondContact O-CG2 3.49Å; V615-V648 HydrophobicContact CB-CG2 4.07Å; V615-V648 HydrophobicContact CG2-CG2 3.9Å; V615-V648 WeakPolarHBondContact O-CG2 3.31Å
616	N	93.2	Very high	88.1	Confident	36 Å²	36	52.3 Å²	52.3	19%	0.193	30%	0.295	C	S	.	.	G	3₁₀ helix	trans	-97.4	6.4	174.9	-83.2	-71.4	0	0	0	113.8	R612 E613 E614 G647 V648 D649	R612-N616 PolarHBondContact O-ND2 3.42Å; E613-N616 PolarHBondContact O-N 3.18Å; E614-N616 PolarHBondContact O-N 2.96Å; E614-N616 VanDerWaalsContact O-N 3.14Å; N616-G647 PolarHBondContact ND2-O 2.91Å; N616-G647 VanDerWaalsContact ND2-O 3.07Å; N616-V648 WeakPolarHBondContact OD1-CA 3.32Å; N616-D649 PolarHBondContact OD1-N 2.98Å
617	E	91.9	Very high	88	Confident	55 Å²	55	52.3 Å²	52.3	26%	0.257	30%	0.296	S	S	.	.			trans	-60	146.9	174.9	-160.2	178.7	163.1	0	0	112	S586 G588 Q589 E614	S586-E617 VanDerWaalsContact CB-OE2 3.3Å; S586-E617 WeakPolarHBondContact CB-OE2 3.25Å; S586-E617 PolarHBondContact OG-OE1 3Å; S586-E617 PolarHBondContact OG-OE2 3.31Å; G588-E617 VanDerWaalsContact CA-OE2 3.24Å; G588-E617 WeakPolarHBondContact CA-OE2 3.45Å; G588-E617 PolarHBondContact N-OE2 2.88Å; Q589-E617 WeakPolarHBondContact CG-OE1 3.4Å; Q589-E617 PolarHBondContact N-OE2 2.92Å; Q589-E617 PolarHBondContact NE2-OE1 3.3Å; E614-E617 WeakPolarHBondContact O-CB 3.45Å; E614-E617 PolarHBondContact O-N 3.12Å; E614-E617 VanDerWaalsContact O-N 3.11Å
618	T	90.8	Very high	88.1	Confident	58 Å²	58	52.2 Å²	52.2	36%	0.356	30%	0.295	S	S	.	.	B	Isolated β-bridge	trans	-105.4	150.7	-176.4	52	0	0	0	0	112	G620 G624 T626	T618-G620 PolarHBondContact O-N 3.31Å; T618-G624 WeakPolarHBondContact CG2-O 3.43Å; T618-T626 HydrophobicContact CG2-CG2 3.85Å
619	C	79	Confident	88.1	Confident	56 Å²	56	52.2 Å²	52.2	38%	0.378	29%	0.294	S	S	.	.	S	Bend	trans	-69.7	86.4	-179.6	-165.4	0	0	0	0	112.7	L592 C625	L592-C619 HydrophobicContact CD1-CB 4.28Å; L592-C619 HydrophobicContact CD2-CB 4.32Å; C619-C625 HydrophobicContact CB-CB 4.24Å; C619-C625 WeakPolarHBondContact CB-O 3.41Å; C619-C625 PolarHBondContact N-O 3.35Å
620	G	71.8	Confident	88.1	Confident	51 Å²	51	50.3 Å²	50.3	53%	0.526	29%	0.286	S	S	.	.	H	α-helix	trans	67.5	-177.4	177.5	0	0	0	0	0	114.2	T618 G622	T618-G620 PolarHBondContact O-N 3.31Å; G620-G622 VanDerWaalsContact C-N 3.3Å; G620-G622 PolarHBondContact O-N 3.14Å
621	E	63.6	Low	88.4	Confident	212 Å²	212	49.6 Å²	49.6	99%	0.991	28%	0.279	S	S	*	.	H	α-helix	trans	-76.2	-15.4	179.1	-60.7	-174.2	160.9	0	0	113.4
622	G	67.4	Low	88.6	Confident	58 Å²	58	47.3 Å²	47.3	60%	0.598	26%	0.263	S	S	*	.	H	α-helix	trans	-90.9	-50.6	-173.4	0	0	0	0	0	115.3	G620 A655	G620-G622 VanDerWaalsContact C-N 3.3Å; G620-G622 PolarHBondContact O-N 3.14Å; G622-A655 WeakPolarHBondContact O-CB 3.24Å
623	D	80.6	Confident	88.9	Confident	75 Å²	75	44.6 Å²	44.6	40%	0.401	25%	0.253	S	S	.	.	H	α-helix	trans	-91.5	-26.1	-167.2	-91	7.5	0	0	0	113.9	C625 D654 A655	D623-C625 HydrophobicContact CB-CB 4.4Å; D623-C625 PolarHBondContact O-N 2.88Å; D623-D654 WeakPolarHBondContact O-CB 3.48Å; D623-A655 WeakPolarHBondContact O-CB 3.44Å; D623-A655 PolarHBondContact O-N 3.41Å
624	G	88.8	Confident	89.2	Confident	17 Å²	17	44 Å²	44	18%	0.175	25%	0.248	C	C	.	.			trans	62.7	6.4	-175.3	0	0	0	0	0	115.3	T618 T626	T618-G624 WeakPolarHBondContact CG2-O 3.43Å; G624-T626 PolarHBondContact O-N 3.47Å
625	C	92.3	Very high	89.4	Confident	1 Å²	1	41 Å²	41	1%	0.007	24%	0.238	C	C	.	.			trans	-75.3	116.2	-173.3	-73.4	0	0	0	0	112.2	L592 C619 D623 H629 R633	L592-C625 WeakPolarHBondContact CD2-O 3.45Å; C619-C625 HydrophobicContact CB-CB 4.24Å; C619-C625 WeakPolarHBondContact CB-O 3.41Å; C619-C625 PolarHBondContact N-O 3.35Å; D623-C625 HydrophobicContact CB-CB 4.4Å; D623-C625 PolarHBondContact O-N 2.88Å; C625-H629 HydrophobicContact CB-CB 4.33Å; C625-R633 PolarHBondContact SG-NH2 2.81Å
626	T	94.9	Very high	89.5	Confident	5 Å²	5	42.5 Å²	42.5	3%	0.031	25%	0.246	C	C	.	.	B	Isolated β-bridge	trans	-74.8	164.8	168.7	70.2	0	0	0	0	111.8	T618 G624 L628 H629 L630 A652	T618-T626 HydrophobicContact CG2-CG2 3.85Å; G624-T626 PolarHBondContact O-N 3.47Å; T626-L628 PolarHBondContact O-N 3.07Å; T626-L628 VanDerWaalsContact O-N 3.14Å; T626-H629 PolarHBondContact N-ND1 3.41Å; T626-H629 WeakPolarHBondContact O-CB 3.36Å; T626-H629 PolarHBondContact O-N 2.94Å; T626-H629 PolarHBondContact OG1-ND1 3.38Å; T626-L630 PolarHBondContact O-N 3.44Å; T626-A652 HydrophobicContact CG2-CB 4.13Å
627	A	96.5	Very high	89.7	Confident	1 Å²	1	41.1 Å²	41.1	1%	0.008	24%	0.239	C	C	.	.	H	α-helix	trans	-54.8	-33.5	177.3	0	0	0	0	0	113.4	L591 L592 T595 H629 L630 A631 L643	L591-A627 HydrophobicContact CD2-CB 4.38Å; L591-A627 HydrophobicContact CG-CB 4.2Å; L592-A627 HydrophobicContact CD2-CB 4.19Å; L592-A627 VanDerWaalsContact CD2-N 3.33Å; T595-A627 HydrophobicContact CG2-CB 4.42Å; T595-A627 WeakPolarHBondContact CG2-O 3.39Å; A627-H629 VanDerWaalsContact C-N 3.31Å; A627-H629 PolarHBondContact O-N 3.13Å; A627-L630 WeakPolarHBondContact O-CB 3.4Å; A627-L630 PolarHBondContact O-N 3.5Å; A627-L630 VanDerWaalsContact O-N 3.13Å; A627-A631 PolarHBondContact O-N 2.95Å; A627-L643 HydrophobicContact CB-CD1 4.13Å; A627-L643 HydrophobicContact CB-CD2 3.81Å
628	L	97.1	Very high	90	Very high	1 Å²	1	39 Å²	39	1%	0.005	23%	0.231	C	C	.	.	H	α-helix	trans	-64.7	-33.6	176.7	-175.2	59.8	0	0	0	112.5	T626 C632 A640 L643 I644 V648 V650 A660 L676	T626-L628 PolarHBondContact O-N 3.07Å; T626-L628 VanDerWaalsContact O-N 3.14Å; L628-C632 WeakPolarHBondContact O-CB 3.48Å; L628-C632 PolarHBondContact O-N 2.89Å; L628-C632 PolarHBondContact O-SG 3.08Å; L628-A640 HydrophobicContact CD1-CB 3.88Å; L628-L643 HydrophobicContact CD1-CB 4.38Å; L628-I644 HydrophobicContact CD1-CD1 4.1Å; L628-I644 HydrophobicContact CD1-CG1 3.96Å; L628-I644 HydrophobicContact CD2-CD1 4.42Å; L628-I644 HydrophobicContact CD2-CG1 3.96Å; L628-V648 HydrophobicContact CB-CG1 3.75Å; L628-V648 HydrophobicContact CD2-CG1 4.42Å; L628-V650 HydrophobicContact CD2-CB 4.45Å; L628-V650 HydrophobicContact CD2-CG1 4.31Å; L628-V650 HydrophobicContact CD2-CG2 4.48Å; L628-A660 HydrophobicContact CD2-CB 4.19Å; L628-A660 HydrophobicContact CG-CB 3.8Å; L628-L676 HydrophobicContact CD1-CD2 4.4Å; L628-L676 HydrophobicContact CD2-CD2 4.11Å; L628-L676 HydrophobicContact CG-CD2 4.42Å
629	H	96.1	Very high	90.3	Very high	1 Å²	1	36.4 Å²	36.4	1%	0.005	21%	0.214	C	C	.	.	H	α-helix	trans	-64.4	-41.8	172.8	-64.1	81	0	0	0	111	C625 T626 A627 C632 R633 A652 N658 A660 Y663	C625-H629 HydrophobicContact CB-CB 4.33Å; T626-H629 PolarHBondContact N-ND1 3.41Å; T626-H629 WeakPolarHBondContact O-CB 3.36Å; T626-H629 PolarHBondContact O-N 2.94Å; T626-H629 PolarHBondContact OG1-ND1 3.38Å; A627-H629 VanDerWaalsContact C-N 3.31Å; A627-H629 PolarHBondContact O-N 3.13Å; H629-C632 PolarHBondContact O-N 3.49Å; H629-R633 VanDerWaalsContact O-CB 3.24Å; H629-R633 WeakPolarHBondContact O-CB 3.24Å; H629-R633 PolarHBondContact O-N 3.2Å; H629-A652 PolarHBondContact CE1-O 2.85Å; H629-A652 PolarHBondContact NE2-O 2.92Å; H629-N658 PolarHBondContact NE2-O 3.18Å; H629-A660 PolarHBondContact CD2-N 3.19Å; H629-A660 PolarHBondContact NE2-N 3.32Å; H629-Y663 HydrophobicContact CB-CD2 3.96Å; H629-Y663 HydrophobicContact CB-CE2 4.14Å; H629-Y663 AromaticContact CD2-CD2 3.75Å; H629-Y663 AromaticContact CD2-CE2 3.79Å
630	L	96.1	Very high	91.2	Very high	19 Å²	19	33.8 Å²	33.8	10%	0.099	20%	0.196	C	C	.	.	H	α-helix	trans	-65.9	-48.3	178.7	-57.7	179.8	0	0	0	111.8	L592 T595 A596 T626 A627 C632 R633 K634	L592-L630 HydrophobicContact CB-CD1 4.24Å; L592-L630 HydrophobicContact CD2-CD1 3.69Å; L592-L630 WeakPolarHBondContact O-CD1 3.38Å; T595-L630 HydrophobicContact CG2-CB 4Å; A596-L630 HydrophobicContact CB-CD1 4.39Å; T626-L630 PolarHBondContact O-N 3.44Å; A627-L630 WeakPolarHBondContact O-CB 3.4Å; A627-L630 PolarHBondContact O-N 3.5Å; A627-L630 VanDerWaalsContact O-N 3.13Å; L630-C632 VanDerWaalsContact C-N 3.3Å; L630-C632 PolarHBondContact O-N 3.01Å; L630-R633 WeakPolarHBondContact O-CB 3.34Å; L630-R633 PolarHBondContact O-N 2.59Å; L630-R633 VanDerWaalsContact O-N 3.14Å; L630-K634 PolarHBondContact O-N 2.66Å
631	A	97.6	Very high	92.4	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-58.1	-42.6	176.5	0	0	0	0	0	111.8	T595 A627 K634 G635 N636 L639 A640 L643	T595-A631 HydrophobicContact CG2-CB 3.74Å; A627-A631 PolarHBondContact O-N 2.95Å; A631-K634 PolarHBondContact O-N 3.38Å; A631-G635 PolarHBondContact O-N 2.77Å; A631-G635 VanDerWaalsContact O-N 3.1Å; A631-N636 PolarHBondContact O-N 3.35Å; A631-L639 HydrophobicContact CB-CB 3.93Å; A631-A640 HydrophobicContact CB-CB 4.09Å; A631-L643 HydrophobicContact CB-CD1 3.84Å
632	C	97.4	Very high	94	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-71.4	-32.6	177.2	-67.6	0	0	0	0	113.2	L628 H629 L630 K634 G635 A660 A664 A667	L628-C632 WeakPolarHBondContact O-CB 3.48Å; L628-C632 PolarHBondContact O-N 2.89Å; L628-C632 PolarHBondContact O-SG 3.08Å; H629-C632 PolarHBondContact O-N 3.49Å; L630-C632 VanDerWaalsContact C-N 3.3Å; L630-C632 PolarHBondContact O-N 3.01Å; C632-K634 VanDerWaalsContact C-N 3.34Å; C632-G635 PolarHBondContact O-N 3.35Å; C632-A660 HydrophobicContact CB-CB 4.28Å; C632-A660 VanDerWaalsContact CB-O 3.31Å; C632-A660 WeakPolarHBondContact CB-O 3.47Å; C632-A664 HydrophobicContact CB-CB 4.09Å; C632-A667 WeakPolarHBondContact O-CB 3.33Å
633	R	95.9	Very high	95.4	Very high	93 Å²	93	18.6 Å²	18.6	35%	0.351	10%	0.097	S	C	.	.	H	α-helix	trans	-66.6	-32.3	173.3	-170.6	-173	-64.5	166.7	-2.7	112.5	C625 H629 L630 G635 Y663	C625-R633 PolarHBondContact SG-NH2 2.81Å; H629-R633 VanDerWaalsContact O-CB 3.24Å; H629-R633 WeakPolarHBondContact O-CB 3.24Å; H629-R633 PolarHBondContact O-N 3.2Å; L630-R633 WeakPolarHBondContact O-CB 3.34Å; L630-R633 PolarHBondContact O-N 2.59Å; L630-R633 VanDerWaalsContact O-N 3.14Å; R633-G635 VanDerWaalsContact C-N 3.33Å; R633-Y663 HydrophobicContact CB-CD1 4Å; R633-Y663 HydrophobicContact CB-CG 4.16Å; R633-Y663 HydrophobicContact CG-CD1 3.89Å; R633-Y663 HydrophobicContact CG-CE1 4.42Å; R633-Y663 VanDerWaalsContact NE-CE1 3.31Å; R633-Y663 PolarHBondContact NH2-OH 3.44Å
634	K	96.4	Very high	96.1	Very high	102 Å²	102	15.7 Å²	15.7	44%	0.443	8%	0.081	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.1	-12.9	168.3	-65.7	-58.1	-159.6	82.7	0	113.8	A596 E598 L630 A631 C632 N636	A596-K634 WeakPolarHBondContact O-CE 3.27Å; A596-K634 PolarHBondContact O-NZ 3.23Å; E598-K634 HydrophobicContact CG-CB 4.38Å; E598-K634 HydrophobicContact CG-CG 4.01Å; E598-K634 VanDerWaalsContact OE2-CD 3.29Å; E598-K634 WeakPolarHBondContact OE2-CD 3.49Å; E598-K634 WeakPolarHBondContact OE2-CG 3.31Å; E598-K634 IonicContact OE2-NZ 3.55Å; E598-K634 PolarHBondContact OE2-NZ 3.3Å; L630-K634 PolarHBondContact O-N 2.66Å; A631-K634 PolarHBondContact O-N 3.38Å; C632-K634 VanDerWaalsContact C-N 3.34Å; K634-N636 HydrophobicContact CB-CB 4.24Å; K634-N636 PolarHBondContact O-N 2.78Å
635	G	96.1	Very high	96.4	Very high	16 Å²	16	15.4 Å²	15.4	17%	0.165	7%	0.074	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.6	11.8	-171.3	0	0	0	0	0	114.4	A631 C632 R633 V637 S669 C672	A631-G635 PolarHBondContact O-N 2.77Å; A631-G635 VanDerWaalsContact O-N 3.1Å; C632-G635 PolarHBondContact O-N 3.35Å; R633-G635 VanDerWaalsContact C-N 3.33Å; G635-V637 PolarHBondContact O-N 3.27Å; G635-S669 PolarHBondContact O-OG 3Å; G635-C672 VanDerWaalsContact C-SG 3.55Å; G635-C672 PolarHBondContact O-SG 3.07Å; G635-C672 VanDerWaalsContact O-SG 3.4Å
636	N	96.7	Very high	96.5	Very high	35 Å²	35	17.8 Å²	17.8	19%	0.187	8%	0.084	C	C	.	.			trans	-77.9	89.6	-174	-168.8	-42.6	0	0	0	111.6	E598 A631 K634 V638 L639 A640	E598-N636 WeakPolarHBondContact OE1-CB 3.41Å; E598-N636 PolarHBondContact OE1-ND2 3.45Å; A631-N636 PolarHBondContact O-N 3.35Å; K634-N636 HydrophobicContact CB-CB 4.24Å; K634-N636 PolarHBondContact O-N 2.78Å; N636-V638 PolarHBondContact O-N 3.25Å; N636-V638 PolarHBondContact OD1-N 3.29Å; N636-L639 HydrophobicContact CB-CB 4.48Å; N636-L639 HydrophobicContact CB-CD1 4.44Å; N636-L639 PolarHBondContact O-N 3.29Å; N636-L639 PolarHBondContact OD1-N 3.37Å; N636-A640 WeakPolarHBondContact O-CB 3.38Å; N636-A640 PolarHBondContact O-N 3.44Å
637	V	96.4	Very high	96.4	Very high	7 Å²	7	18.9 Å²	18.9	4%	0.042	10%	0.096	C	C	.	.	H	α-helix	trans	-64	-24.1	-178.6	65.9	0	0	0	0	113.7	E527 K530 G635 Q641 E671 C672 V675	E527-V637 HydrophobicContact CG-CG2 4.36Å; K530-V637 HydrophobicContact CD-CG1 3.52Å; G635-V637 PolarHBondContact O-N 3.27Å; V637-Q641 WeakPolarHBondContact O-CB 3.44Å; V637-Q641 PolarHBondContact O-N 2.78Å; V637-E671 HydrophobicContact CB-CB 4.09Å; V637-E671 HydrophobicContact CG1-CB 4.21Å; V637-E671 HydrophobicContact CG2-CB 3.9Å; V637-C672 VanDerWaalsContact CA-SG 3.57Å; V637-V675 HydrophobicContact CG2-CG2 3.74Å
638	V	97.4	Very high	96.3	Very high	12 Å²	12	19 Å²	19	7%	0.073	10%	0.097	C	C	.	.	H	α-helix	trans	-70.3	-52.5	178.8	174.7	0	0	0	0	110	K530 V531 L600 N636 Q641 L642	K530-V638 HydrophobicContact CB-CG2 3.96Å; V531-V638 HydrophobicContact CG2-CG1 4.24Å; V531-V638 HydrophobicContact CG2-CG2 4.42Å; L600-V638 HydrophobicContact CD1-CG1 3.84Å; L600-V638 HydrophobicContact CD2-CG1 4.16Å; N636-V638 PolarHBondContact O-N 3.25Å; N636-V638 PolarHBondContact OD1-N 3.29Å; V638-Q641 PolarHBondContact O-N 3.34Å; V638-L642 HydrophobicContact CG1-CD1 4.04Å; V638-L642 VanDerWaalsContact O-CG 3.3Å; V638-L642 WeakPolarHBondContact O-CG 3.28Å; V638-L642 PolarHBondContact O-N 3.13Å
639	L	97.9	Very high	96.1	Very high	2 Å²	2	22.5 Å²	22.5	1%	0.01	12%	0.115	C	C	.	.	H	α-helix	trans	-61.9	-46.2	175.2	-69.2	173.8	0	0	0	111.2	T595 E598 L600 A603 A631 N636 Q641 L642 L643	T595-L639 HydrophobicContact CG2-CD1 4.29Å; E598-L639 HydrophobicContact CB-CD1 4.38Å; E598-L639 HydrophobicContact CG-CD1 4.39Å; L600-L639 HydrophobicContact CD1-CD2 3.67Å; L600-L639 HydrophobicContact CD1-CG 4.43Å; A603-L639 HydrophobicContact CB-CD2 3.68Å; A631-L639 HydrophobicContact CB-CB 3.93Å; N636-L639 HydrophobicContact CB-CB 4.48Å; N636-L639 HydrophobicContact CB-CD1 4.44Å; N636-L639 PolarHBondContact O-N 3.29Å; N636-L639 PolarHBondContact OD1-N 3.37Å; L639-Q641 VanDerWaalsContact C-N 3.33Å; L639-Q641 PolarHBondContact O-N 3.05Å; L639-L642 PolarHBondContact O-N 3.14Å; L639-L643 WeakPolarHBondContact O-CB 3.49Å; L639-L643 WeakPolarHBondContact O-CD1 3.41Å; L639-L643 WeakPolarHBondContact O-CG 3.47Å; L639-L643 PolarHBondContact O-N 2.65Å
640	A	97.6	Very high	96	Very high	1 Å²	1	23.2 Å²	23.2	1%	0.008	12%	0.119	C	C	.	.	H	α-helix	trans	-58.1	-43.9	177.9	0	0	0	0	0	112.3	L628 A631 N636 I644	L628-A640 HydrophobicContact CD1-CB 3.88Å; A631-A640 HydrophobicContact CB-CB 4.09Å; N636-A640 WeakPolarHBondContact O-CB 3.38Å; N636-A640 PolarHBondContact O-N 3.44Å; A640-I644 WeakPolarHBondContact O-CD1 3.39Å; A640-I644 WeakPolarHBondContact O-CG1 3.39Å; A640-I644 PolarHBondContact O-N 3.41Å
641	Q	96.8	Very high	95.8	Very high	1 Å²	1	26.3 Å²	26.3	1%	0.005	13%	0.134	C	C	.	.	H	α-helix	trans	-69.2	-36.6	179.7	-177.8	61.1	107.2	0	0	112.6	V531 V637 V638 L639 W645 V675	V531-Q641 HydrophobicContact CG2-CB 4.17Å; V531-Q641 HydrophobicContact CG2-CG 4.15Å; V637-Q641 WeakPolarHBondContact O-CB 3.44Å; V637-Q641 PolarHBondContact O-N 2.78Å; V638-Q641 PolarHBondContact O-N 3.34Å; L639-Q641 VanDerWaalsContact C-N 3.33Å; L639-Q641 PolarHBondContact O-N 3.05Å; Q641-W645 VanDerWaalsContact CD-CE2 3.49Å; Q641-W645 VanDerWaalsContact CD-CZ2 3.41Å; Q641-W645 HydrophobicContact CG-CD2 4.12Å; Q641-W645 HydrophobicContact CG-CE3 4.15Å; Q641-W645 HydrophobicContact CG-CH2 3.48Å; Q641-W645 VanDerWaalsContact CG-CH2 3.48Å; Q641-W645 HydrophobicContact CG-CZ2 3.41Å; Q641-W645 VanDerWaalsContact CG-CZ2 3.41Å; Q641-W645 HydrophobicContact CG-CZ3 3.87Å; Q641-W645 VanDerWaalsContact NE2-CE2 3.34Å; Q641-W645 VanDerWaalsContact NE2-NE1 3.12Å; Q641-W645 PolarHBondContact O-N 2.84Å; Q641-V675 HydrophobicContact CB-CG1 4.47Å
642	L	97.1	Very high	95.5	Very high	1 Å²	1	27.1 Å²	27.1	1%	0.005	14%	0.141	C	C	.	.	H	α-helix	trans	-65	-51.6	173.9	-71.3	166	0	0	0	111.3	V531 I535 L600 I604 L607 V638 L639 I644 W645 Y646	V531-L642 HydrophobicContact CG1-CD2 4.09Å; V531-L642 HydrophobicContact CG1-CG 4.39Å; I535-L642 HydrophobicContact CD1-CD1 4.3Å; I535-L642 HydrophobicContact CD1-CD2 4.27Å; L600-L642 HydrophobicContact CD1-CD1 3.64Å; I604-L642 HydrophobicContact CD1-CD1 4.33Å; I604-L642 HydrophobicContact CG1-CD1 4.03Å; L607-L642 HydrophobicContact CD1-CB 4.16Å; V638-L642 HydrophobicContact CG1-CD1 4.04Å; V638-L642 VanDerWaalsContact O-CG 3.3Å; V638-L642 WeakPolarHBondContact O-CG 3.28Å; V638-L642 PolarHBondContact O-N 3.13Å; L639-L642 PolarHBondContact O-N 3.14Å; L642-I644 VanDerWaalsContact C-N 3.27Å; L642-I644 PolarHBondContact O-N 3.4Å; L642-W645 HydrophobicContact CD2-CE3 4.26Å; L642-W645 HydrophobicContact CD2-CZ3 4.47Å; L642-W645 WeakPolarHBondContact O-CA 3.48Å; L642-W645 WeakPolarHBondContact O-CB 3.37Å; L642-W645 PolarHBondContact O-N 3.48Å; L642-Y646 WeakPolarHBondContact O-CD2 3.42Å; L642-Y646 PolarHBondContact O-N 3.34Å
643	L	97.2	Very high	95.3	Very high	1 Å²	1	32.6 Å²	32.6	1%	0.005	16%	0.162	C	C	.	.	H	α-helix	trans	-52.2	-45	179	-71.5	162	0	0	0	111.9	L591 T595 L607 A627 L628 A631 L639 W645 Y646 G647 V648	L591-L643 HydrophobicContact CD1-CD2 4.36Å; L591-L643 HydrophobicContact CD2-CD2 4.04Å; L591-L643 HydrophobicContact CG-CD2 4.41Å; T595-L643 HydrophobicContact CG2-CD1 4.24Å; L607-L643 HydrophobicContact CD1-CD2 4.39Å; L607-L643 HydrophobicContact CD2-CD2 4.11Å; A627-L643 HydrophobicContact CB-CD1 4.13Å; A627-L643 HydrophobicContact CB-CD2 3.81Å; L628-L643 HydrophobicContact CD1-CB 4.38Å; A631-L643 HydrophobicContact CB-CD1 3.84Å; L639-L643 WeakPolarHBondContact O-CB 3.49Å; L639-L643 WeakPolarHBondContact O-CD1 3.41Å; L639-L643 WeakPolarHBondContact O-CG 3.47Å; L639-L643 PolarHBondContact O-N 2.65Å; L643-W645 VanDerWaalsContact C-N 3.32Å; L643-W645 PolarHBondContact O-N 3Å; L643-Y646 PolarHBondContact O-N 3.37Å; L643-G647 PolarHBondContact O-N 3.39Å; L643-G647 VanDerWaalsContact O-N 3.16Å; L643-V648 HydrophobicContact CB-CB 4.23Å; L643-V648 HydrophobicContact CB-CG2 3.9Å; L643-V648 HydrophobicContact CD2-CG2 3.83Å; L643-V648 WeakPolarHBondContact O-CB 3.21Å; L643-V648 WeakPolarHBondContact O-CG2 3.35Å; L643-V648 PolarHBondContact O-N 3.28Å
644	I	95.8	Very high	95.1	Very high	14 Å²	14	28.6 Å²	28.6	7%	0.072	15%	0.148	C	C	.	.	H	α-helix	trans	-63.6	-34.5	176	-67.1	166.3	0	0	0	112.2	L628 A640 L642 G647 V650 V675 L676 Y679	L628-I644 HydrophobicContact CD1-CD1 4.1Å; L628-I644 HydrophobicContact CD1-CG1 3.96Å; L628-I644 HydrophobicContact CD2-CD1 4.42Å; L628-I644 HydrophobicContact CD2-CG1 3.96Å; A640-I644 WeakPolarHBondContact O-CD1 3.39Å; A640-I644 WeakPolarHBondContact O-CG1 3.39Å; A640-I644 PolarHBondContact O-N 3.41Å; L642-I644 VanDerWaalsContact C-N 3.27Å; L642-I644 PolarHBondContact O-N 3.4Å; I644-G647 PolarHBondContact O-N 2.94Å; I644-V650 HydrophobicContact CG1-CG2 4.01Å; I644-V650 HydrophobicContact CG2-CG2 4.11Å; I644-V675 HydrophobicContact CD1-CG1 3.56Å; I644-L676 HydrophobicContact CD1-CD2 4.09Å; I644-Y679 HydrophobicContact CD1-CD2 4.4Å; I644-Y679 HydrophobicContact CG2-CD1 3.72Å; I644-Y679 HydrophobicContact CG2-CD2 3.73Å; I644-Y679 HydrophobicContact CG2-CE1 4.15Å; I644-Y679 HydrophobicContact CG2-CE2 4.2Å; I644-Y679 HydrophobicContact CG2-CG 3.52Å
645	W	95.1	Very high	94.9	Very high	11 Å²	11	26.9 Å²	26.9	4%	0.042	15%	0.152	C	C	.	.	H	α-helix	trans	-75.5	-29.5	178.6	-72.3	-17.1	0	0	0	114.2	L492 N493 R515 L528 V531 Q641 L642 L643 G647 Y679	L492-W645 VanDerWaalsContact C-CZ3 3.48Å; L492-W645 HydrophobicContact CB-CH2 3.66Å; L492-W645 HydrophobicContact CB-CZ2 4.18Å; L492-W645 HydrophobicContact CB-CZ3 3.9Å; L492-W645 HydrophobicContact CD1-CZ2 4.4Å; L492-W645 WeakPolarHBondContact O-CZ3 3.49Å; N493-W645 HydrophobicContact CB-CB 4.09Å; N493-W645 HydrophobicContact CB-CD2 4.24Å; N493-W645 HydrophobicContact CB-CE3 3.78Å; N493-W645 HydrophobicContact CB-CG 4.44Å; R515-W645 PolarHBondContact NH2-O 3.01Å; L528-W645 HydrophobicContact CD2-CH2 3.7Å; L528-W645 HydrophobicContact CD2-CZ2 3.53Å; V531-W645 HydrophobicContact CG1-CZ3 4.15Å; V531-W645 HydrophobicContact CG2-CH2 4.42Å; V531-W645 HydrophobicContact CG2-CZ3 4.33Å; Q641-W645 VanDerWaalsContact CD-CE2 3.49Å; Q641-W645 VanDerWaalsContact CD-CZ2 3.41Å; Q641-W645 HydrophobicContact CG-CD2 4.12Å; Q641-W645 HydrophobicContact CG-CE3 4.15Å; Q641-W645 HydrophobicContact CG-CH2 3.48Å; Q641-W645 VanDerWaalsContact CG-CH2 3.48Å; Q641-W645 HydrophobicContact CG-CZ2 3.41Å; Q641-W645 VanDerWaalsContact CG-CZ2 3.41Å; Q641-W645 HydrophobicContact CG-CZ3 3.87Å; Q641-W645 VanDerWaalsContact NE2-CE2 3.34Å; Q641-W645 VanDerWaalsContact NE2-NE1 3.12Å; Q641-W645 PolarHBondContact O-N 2.84Å; L642-W645 HydrophobicContact CD2-CE3 4.26Å; L642-W645 HydrophobicContact CD2-CZ3 4.47Å; L642-W645 WeakPolarHBondContact O-CA 3.48Å; L642-W645 WeakPolarHBondContact O-CB 3.37Å; L642-W645 PolarHBondContact O-N 3.48Å; L643-W645 VanDerWaalsContact C-N 3.32Å; L643-W645 PolarHBondContact O-N 3Å; W645-G647 VanDerWaalsContact C-N 3.32Å; W645-Y679 AromaticContact NE1-CZ 3.68Å; W645-Y679 PolarHBondContact NE1-OH 3.14Å
646	Y	95.2	Very high	94.6	Very high	51 Å²	51	32.6 Å²	32.6	20%	0.2	17%	0.174	C	C	.	.	H	α-helix	trans	-84.6	-2.7	173.7	-78.7	-97.1	0	0	0	113.5	N493 L607 L642 L643	N493-Y646 HydrophobicContact CB-CE2 4.41Å; N493-Y646 PolarHBondContact O-OH 2.77Å; L607-Y646 HydrophobicContact CB-CD1 3.83Å; L607-Y646 HydrophobicContact CB-CD2 4.17Å; L607-Y646 HydrophobicContact CB-CE1 3.99Å; L607-Y646 HydrophobicContact CB-CE2 4.33Å; L607-Y646 HydrophobicContact CB-CG 3.93Å; L607-Y646 HydrophobicContact CD1-CD2 4.02Å; L607-Y646 HydrophobicContact CD1-CG 4.29Å; L607-Y646 HydrophobicContact CD2-CG 4.21Å; L607-Y646 HydrophobicContact CG-CG 4.37Å; L607-Y646 WeakPolarHBondContact O-CD1 3.36Å; L607-Y646 WeakPolarHBondContact O-CE1 3.41Å; L642-Y646 WeakPolarHBondContact O-CD2 3.42Å; L642-Y646 PolarHBondContact O-N 3.34Å; L643-Y646 PolarHBondContact O-N 3.37Å
647	G	92.1	Very high	94.3	Very high	28 Å²	28	32.2 Å²	32.2	29%	0.289	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	96.9	24.1	167.5	0	0	0	0	0	115.6	R612 N616 L643 I644 W645	R612-G647 WeakPolarHBondContact CG-O 3.29Å; N616-G647 PolarHBondContact ND2-O 2.91Å; N616-G647 VanDerWaalsContact ND2-O 3.07Å; L643-G647 PolarHBondContact O-N 3.39Å; L643-G647 VanDerWaalsContact O-N 3.16Å; I644-G647 PolarHBondContact O-N 2.94Å; W645-G647 VanDerWaalsContact C-N 3.32Å
648	V	94.1	Very high	94.1	Very high	4 Å²	4	34 Å²	34	2%	0.024	19%	0.188	C	C	.	.			trans	-62.4	136.5	164.2	-177.4	0	0	0	0	109.7	V615 N616 L628 L643 V650	V615-V648 HydrophobicContact CB-CG2 4.07Å; V615-V648 HydrophobicContact CG2-CG2 3.9Å; V615-V648 WeakPolarHBondContact O-CG2 3.31Å; N616-V648 WeakPolarHBondContact OD1-CA 3.32Å; L628-V648 HydrophobicContact CB-CG1 3.75Å; L628-V648 HydrophobicContact CD2-CG1 4.42Å; L643-V648 HydrophobicContact CB-CB 4.23Å; L643-V648 HydrophobicContact CB-CG2 3.9Å; L643-V648 HydrophobicContact CD2-CG2 3.83Å; L643-V648 WeakPolarHBondContact O-CB 3.21Å; L643-V648 WeakPolarHBondContact O-CG2 3.35Å; L643-V648 PolarHBondContact O-N 3.28Å; V648-V650 PolarHBondContact O-N 3.19Å
649	D	92.5	Very high	94	Very high	74 Å²	74	33.6 Å²	33.6	40%	0.396	19%	0.186	S	C	.	.			trans	-69.5	119.3	-178.5	-177.2	19	0	0	0	111.1	N616 M651 A652	N616-D649 PolarHBondContact OD1-N 2.98Å; D649-M651 VanDerWaalsContact C-N 3.27Å; D649-M651 WeakPolarHBondContact OD1-CB 3.43Å; D649-M651 PolarHBondContact OD1-N 2.96Å; D649-A652 HydrophobicContact CB-CB 4.18Å; D649-A652 WeakPolarHBondContact O-CB 3.37Å; D649-A652 PolarHBondContact OD2-N 2.99Å
650	V	94.6	Very high	93.9	Very high	15 Å²	15	33.6 Å²	33.6	9%	0.091	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.6	-14	179.7	-159	0	0	0	0	111.3	L628 I644 V648 L676 C681	L628-V650 HydrophobicContact CD2-CB 4.45Å; L628-V650 HydrophobicContact CD2-CG1 4.31Å; L628-V650 HydrophobicContact CD2-CG2 4.48Å; I644-V650 HydrophobicContact CG1-CG2 4.01Å; I644-V650 HydrophobicContact CG2-CG2 4.11Å; V648-V650 PolarHBondContact O-N 3.19Å; V650-L676 HydrophobicContact CG1-CD2 3.67Å; V650-C681 HydrophobicContact CG1-CB 3.92Å; V650-C681 PolarHBondContact O-SG 3.18Å
651	M	91.8	Very high	93.8	Very high	84 Å²	84	33.6 Å²	33.6	41%	0.414	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.3	-9.6	176.8	-51.1	-59.3	111.8	0	0	113.3	D649	D649-M651 VanDerWaalsContact C-N 3.27Å; D649-M651 WeakPolarHBondContact OD1-CB 3.43Å; D649-M651 PolarHBondContact OD1-N 2.96Å
652	A	91.9	Very high	93.7	Very high	17 Å²	17	35.6 Å²	35.6	14%	0.14	20%	0.198	C	C	.	.			trans	-53.7	143.5	-177.4	0	0	0	0	0	111.5	T626 H629 D649	T626-A652 HydrophobicContact CG2-CB 4.13Å; H629-A652 PolarHBondContact CE1-O 2.85Å; H629-A652 PolarHBondContact NE2-O 2.92Å; D649-A652 HydrophobicContact CB-CB 4.18Å; D649-A652 WeakPolarHBondContact O-CB 3.37Å; D649-A652 PolarHBondContact OD2-N 2.99Å
653	R	92.4	Very high	93.7	Very high	116 Å²	116	36.5 Å²	36.5	44%	0.438	20%	0.201	S	C	.	.	B	Isolated β-bridge	trans	-118.1	143.1	174.2	-66.8	-176.1	-173.3	-160.8	7.3	110.3	G657 N658 T659 V686	R653-G657 WeakPolarHBondContact CD-O 3.16Å; R653-N658 CarbonylContact C-O 3.51Å; R653-N658 WeakPolarHBondContact CA-O 3.39Å; R653-T659 HydrophobicContact CG-CG2 3.93Å; R653-V686 VanDerWaalsContact CZ-O 3.24Å; R653-V686 PolarHBondContact NH1-O 3.29Å; R653-V686 PolarHBondContact NH2-O 3.31Å
654	D	92.3	Very high	93.6	Very high	9 Å²	9	36.5 Å²	36.5	5%	0.048	20%	0.201	C	C	.	.			trans	-72.2	178.7	170.2	81	-13.1	0	0	0	111.8	D623 H656 G657 N658 Y663	D623-D654 WeakPolarHBondContact O-CB 3.48Å; D654-H656 PolarHBondContact O-N 3.43Å; D654-H656 VanDerWaalsContact O-N 3.1Å; D654-H656 VanDerWaalsContact OD1-C 3.29Å; D654-H656 VanDerWaalsContact OD1-CA 3.31Å; D654-H656 WeakPolarHBondContact OD1-CA 3.25Å; D654-H656 WeakPolarHBondContact OD1-CB 3.3Å; D654-H656 PolarHBondContact OD1-N 3.14Å; D654-H656 IonicContact OD2-CG 3Å; D654-H656 IonicContact OD2-ND1 3.7Å; D654-H656 PolarHBondContact OD2-ND1 2.58Å; D654-H656 VanDerWaalsContact OD2-ND1 3.14Å; D654-G657 PolarHBondContact O-N 3.12Å; D654-G657 PolarHBondContact OD1-N 2.95Å; D654-N658 PolarHBondContact N-O 3.15Å; D654-N658 WeakPolarHBondContact OD1-CB 3.46Å; D654-N658 PolarHBondContact OD1-N 2.85Å; D654-N658 PolarHBondContact OD1-ND2 3.29Å; D654-N658 PolarHBondContact OD2-ND2 3.01Å; D654-Y663 PolarHBondContact OD2-OH 2.86Å
655	A	91.3	Very high	93.6	Very high	66 Å²	66	40.6 Å²	40.6	55%	0.545	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-16.2	177.9	0	0	0	0	0	114.2	G622 D623	G622-A655 WeakPolarHBondContact O-CB 3.24Å; D623-A655 WeakPolarHBondContact O-CB 3.44Å; D623-A655 PolarHBondContact O-N 3.41Å
656	H	90.6	Very high	93.6	Very high	136 Å²	136	46.9 Å²	46.9	63%	0.63	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.8	-1.6	176.8	-49.9	94.1	0	0	0	112.7	D654 N658	D654-H656 PolarHBondContact O-N 3.43Å; D654-H656 VanDerWaalsContact O-N 3.1Å; D654-H656 VanDerWaalsContact OD1-C 3.29Å; D654-H656 VanDerWaalsContact OD1-CA 3.31Å; D654-H656 WeakPolarHBondContact OD1-CA 3.25Å; D654-H656 WeakPolarHBondContact OD1-CB 3.3Å; D654-H656 PolarHBondContact OD1-N 3.14Å; D654-H656 IonicContact OD2-CG 3Å; D654-H656 IonicContact OD2-ND1 3.7Å; D654-H656 PolarHBondContact OD2-ND1 2.58Å; D654-H656 VanDerWaalsContact OD2-ND1 3.14Å; H656-N658 WeakPolarHBondContact CB-ND2 3.33Å
657	G	91	Very high	93.6	Very high	27 Å²	27	46.3 Å²	46.3	28%	0.278	25%	0.252	S	S	.	.	S	Bend	trans	81.6	6.8	-175.8	0	0	0	0	0	115.1	R653 D654	R653-G657 WeakPolarHBondContact CD-O 3.16Å; D654-G657 PolarHBondContact O-N 3.12Å; D654-G657 PolarHBondContact OD1-N 2.95Å
658	N	92.4	Very high	93.8	Very high	44 Å²	44	50 Å²	50	24%	0.235	27%	0.273	C	S	.	.			trans	-73.9	143.1	175	-59.4	-56.4	0	0	0	110.9	H629 R653 D654 H656 T662 Y663	H629-N658 PolarHBondContact NE2-O 3.18Å; R653-N658 CarbonylContact C-O 3.51Å; R653-N658 WeakPolarHBondContact CA-O 3.39Å; D654-N658 PolarHBondContact N-O 3.15Å; D654-N658 WeakPolarHBondContact OD1-CB 3.46Å; D654-N658 PolarHBondContact OD1-N 2.85Å; D654-N658 PolarHBondContact OD1-ND2 3.29Å; D654-N658 PolarHBondContact OD2-ND2 3.01Å; H656-N658 WeakPolarHBondContact CB-ND2 3.33Å; N658-T662 HydrophobicContact CB-CG2 4.32Å; N658-Y663 HydrophobicContact CB-CE2 4.1Å
659	T	94.4	Very high	93.9	Very high	4 Å²	4	50.5 Å²	50.5	3%	0.025	28%	0.277	C	S	.	.	B	Isolated β-bridge	trans	-95.6	169.6	166.4	62.1	0	0	0	0	110.7	R653 L661 T662	R653-T659 HydrophobicContact CG-CG2 3.93Å; T659-L661 PolarHBondContact O-N 3.39Å; T659-L661 VanDerWaalsContact O-N 3.08Å; T659-L661 PolarHBondContact OG1-N 3.28Å; T659-T662 WeakPolarHBondContact O-CB 3.4Å; T659-T662 PolarHBondContact O-N 3.26Å
660	A	95.9	Very high	93.9	Very high	1 Å²	1	52.1 Å²	52.1	1%	0.008	28%	0.282	C	S	.	.	H	α-helix	trans	-52.9	-27.8	168.9	0	0	0	0	0	113.5	L628 H629 C632 Y663 A664 L676	L628-A660 HydrophobicContact CD2-CB 4.19Å; L628-A660 HydrophobicContact CG-CB 3.8Å; H629-A660 PolarHBondContact CD2-N 3.19Å; H629-A660 PolarHBondContact NE2-N 3.32Å; C632-A660 HydrophobicContact CB-CB 4.28Å; C632-A660 VanDerWaalsContact CB-O 3.31Å; C632-A660 WeakPolarHBondContact CB-O 3.47Å; A660-Y663 PolarHBondContact O-N 3.38Å; A660-A664 PolarHBondContact O-N 3.41Å; A660-L676 HydrophobicContact CB-CD1 4.09Å; A660-L676 HydrophobicContact CB-CD2 4.02Å
661	L	95.8	Very high	93.9	Very high	1 Å²	1	54 Å²	54	1%	0.005	29%	0.29	C	S	.	.	H	α-helix	trans	-70.8	-32	177.5	-175.9	62.7	0	0	0	112.6	T659 Y663 R665 I673 L676 L677 P682	T659-L661 PolarHBondContact O-N 3.39Å; T659-L661 VanDerWaalsContact O-N 3.08Å; T659-L661 PolarHBondContact OG1-N 3.28Å; L661-Y663 VanDerWaalsContact C-N 3.34Å; L661-R665 WeakPolarHBondContact O-CD 3.38Å; L661-R665 VanDerWaalsContact O-CG 3.28Å; L661-R665 WeakPolarHBondContact O-CG 3.46Å; L661-R665 PolarHBondContact O-N 3.34Å; L661-R665 VanDerWaalsContact O-N 3.12Å; L661-I673 HydrophobicContact CD1-CB 4.28Å; L661-I673 HydrophobicContact CD1-CG1 4.13Å; L661-I673 HydrophobicContact CD1-CG2 4.12Å; L661-L676 HydrophobicContact CB-CD1 4Å; L661-L676 HydrophobicContact CD1-CB 4.16Å; L661-L676 HydrophobicContact CD1-CD1 4.1Å; L661-L677 HydrophobicContact CD1-CG 4.46Å; L661-L677 HydrophobicContact CD2-CD2 3.93Å; L661-P682 WeakPolarHBondContact CD2-O 3.39Å
662	T	94.9	Very high	94.1	Very high	43 Å²	43	50 Å²	50	26%	0.264	27%	0.27	S	S	.	.	H	α-helix	trans	-61.6	-45.5	171	-53.8	0	0	0	0	110.4	N658 T659 R665 Q666	N658-T662 HydrophobicContact CB-CG2 4.32Å; T659-T662 WeakPolarHBondContact O-CB 3.4Å; T659-T662 PolarHBondContact O-N 3.26Å; T662-R665 WeakPolarHBondContact O-CB 3.34Å; T662-R665 PolarHBondContact O-N 3.11Å; T662-Q666 PolarHBondContact O-N 3.3Å
663	Y	95.7	Very high	94.2	Very high	21 Å²	21	50.2 Å²	50.2	8%	0.082	27%	0.269	C	S	.	.	H	α-helix	trans	-68.7	-39.4	178.1	-72.8	-64.7	0	0	0	113.4	H629 R633 D654 N658 A660 L661 R665 Q666 A667	H629-Y663 HydrophobicContact CB-CD2 3.96Å; H629-Y663 HydrophobicContact CB-CE2 4.14Å; H629-Y663 AromaticContact CD2-CD2 3.75Å; H629-Y663 AromaticContact CD2-CE2 3.79Å; R633-Y663 HydrophobicContact CB-CD1 4Å; R633-Y663 HydrophobicContact CB-CG 4.16Å; R633-Y663 HydrophobicContact CG-CD1 3.89Å; R633-Y663 HydrophobicContact CG-CE1 4.42Å; R633-Y663 VanDerWaalsContact NE-CE1 3.31Å; R633-Y663 PolarHBondContact NH2-OH 3.44Å; D654-Y663 PolarHBondContact OD2-OH 2.86Å; N658-Y663 HydrophobicContact CB-CE2 4.1Å; A660-Y663 PolarHBondContact O-N 3.38Å; L661-Y663 VanDerWaalsContact C-N 3.34Å; Y663-R665 PolarHBondContact O-N 3.36Å; Y663-Q666 PolarHBondContact O-N 2.87Å; Y663-A667 WeakPolarHBondContact O-CB 3.33Å; Y663-A667 PolarHBondContact O-N 3.28Å
664	A	96.7	Very high	94.2	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-59.3	-35.1	174.2	0	0	0	0	0	112.3	C632 A660 S668 S669 C672 I673 L676	C632-A664 HydrophobicContact CB-CB 4.09Å; A660-A664 PolarHBondContact O-N 3.41Å; A664-S668 PolarHBondContact O-N 3.13Å; A664-S669 PolarHBondContact O-N 3.14Å; A664-C672 HydrophobicContact CB-CB 3.69Å; A664-I673 HydrophobicContact CB-CG1 3.87Å; A664-L676 HydrophobicContact CB-CD1 3.84Å
665	R	95.5	Very high	94.3	Very high	101 Å²	101	47.4 Å²	47.4	38%	0.381	26%	0.262	S	S	.	.	H	α-helix	trans	-71.5	-44.1	173.4	-72.3	166.6	173.4	168.5	-4.6	112.6	L661 T662 Y663 A667 S668 I673 D683	L661-R665 WeakPolarHBondContact O-CD 3.38Å; L661-R665 VanDerWaalsContact O-CG 3.28Å; L661-R665 WeakPolarHBondContact O-CG 3.46Å; L661-R665 PolarHBondContact O-N 3.34Å; L661-R665 VanDerWaalsContact O-N 3.12Å; T662-R665 WeakPolarHBondContact O-CB 3.34Å; T662-R665 PolarHBondContact O-N 3.11Å; Y663-R665 PolarHBondContact O-N 3.36Å; R665-A667 VanDerWaalsContact C-N 3.29Å; R665-A667 PolarHBondContact O-N 3.14Å; R665-S668 PolarHBondContact O-N 3.4Å; R665-I673 HydrophobicContact CG-CD1 3.75Å; R665-I673 HydrophobicContact CG-CG1 4.08Å; R665-D683 IonicContact CZ-OD1 3Å; R665-D683 PolarHBondContact NH1-O 3.18Å; R665-D683 PolarHBondContact NH2-O 3.07Å; R665-D683 IonicContact NH2-OD1 3.56Å; R665-D683 PolarHBondContact NH2-OD1 3.43Å
666	Q	95.1	Very high	94.5	Very high	142 Å²	142	44.3 Å²	44.3	66%	0.664	24%	0.236	S	C	*	.	H	α-helix	trans	-59.5	-41.5	175	-169.9	-178.8	14.4	0	0	111.6	T662 Y663 S668	T662-Q666 PolarHBondContact O-N 3.3Å; Y663-Q666 PolarHBondContact O-N 2.87Å; Q666-S668 PolarHBondContact O-N 2.75Å
667	A	95.6	Very high	94.6	Very high	40 Å²	40	41.3 Å²	41.3	33%	0.331	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74	-3.8	174.3	0	0	0	0	0	114.1	C632 Y663 R665 S669	C632-A667 WeakPolarHBondContact O-CB 3.33Å; Y663-A667 WeakPolarHBondContact O-CB 3.33Å; Y663-A667 PolarHBondContact O-N 3.28Å; R665-A667 VanDerWaalsContact C-N 3.29Å; R665-A667 PolarHBondContact O-N 3.14Å; A667-S669 PolarHBondContact O-N 3.34Å; A667-S669 VanDerWaalsContact O-N 3.08Å
668	S	95.7	Very high	94.6	Very high	105 Å²	105	46.4 Å²	46.4	73%	0.734	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.2	23.9	-174	-58.4	0	0	0	0	114.8	A664 R665 Q666 Q670	A664-S668 PolarHBondContact O-N 3.13Å; R665-S668 PolarHBondContact O-N 3.4Å; Q666-S668 PolarHBondContact O-N 2.75Å; S668-Q670 PolarHBondContact O-N 2.91Å
669	S	95.6	Very high	94.5	Very high	15 Å²	15	48 Å²	48	11%	0.105	25%	0.245	C	C	.	.			trans	-85	93.7	-176.6	180	0	0	0	0	110.6	G635 A664 A667 E671 C672 I673	G635-S669 PolarHBondContact O-OG 3Å; A664-S669 PolarHBondContact O-N 3.14Å; A667-S669 PolarHBondContact O-N 3.34Å; A667-S669 VanDerWaalsContact O-N 3.08Å; S669-E671 VanDerWaalsContact C-N 3.25Å; S669-E671 PolarHBondContact O-N 2.93Å; S669-C672 PolarHBondContact O-N 2.99Å; S669-C672 PolarHBondContact OG-N 3.02Å; S669-C672 PolarHBondContact OG-SG 3.47Å; S669-I673 WeakPolarHBondContact O-CG1 3.47Å; S669-I673 PolarHBondContact O-N 2.93Å
670	Q	93.7	Very high	94.2	Very high	107 Å²	107	50.2 Å²	50.2	50%	0.5	27%	0.268	S	S	.	.	H	α-helix	trans	-60	-35.4	-178.9	-173.7	59.7	65.8	0	0	112.1	S668 I673 N674	S668-Q670 PolarHBondContact O-N 2.91Å; Q670-I673 WeakPolarHBondContact O-CB 3.16Å; Q670-I673 PolarHBondContact O-N 3.14Å; Q670-N674 PolarHBondContact NE2-OD1 2.75Å; Q670-N674 WeakPolarHBondContact O-CB 3.45Å; Q670-N674 PolarHBondContact O-N 2.98Å; Q670-N674 PolarHBondContact O-OD1 2.91Å; Q670-N674 VanDerWaalsContact O-OD1 3.08Å
671	E	93	Very high	93.6	Very high	56 Å²	56	50.4 Å²	50.4	26%	0.262	27%	0.269	S	S	.	.	H	α-helix	trans	-69.4	-38.3	176.9	-59.5	98.1	124.5	0	0	112.3	E527 K530 V637 S669 N674 V675	E527-E671 HydrophobicContact CG-CB 4.44Å; K530-E671 IonicContact NZ-OE1 2.66Å; K530-E671 PolarHBondContact NZ-OE1 2.82Å; V637-E671 HydrophobicContact CB-CB 4.09Å; V637-E671 HydrophobicContact CG1-CB 4.21Å; V637-E671 HydrophobicContact CG2-CB 3.9Å; S669-E671 VanDerWaalsContact C-N 3.25Å; S669-E671 PolarHBondContact O-N 2.93Å; E671-N674 PolarHBondContact O-N 3.01Å; E671-V675 WeakPolarHBondContact O-CG2 3.37Å; E671-V675 PolarHBondContact O-N 2.85Å
672	C	95.6	Very high	92.7	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-63.4	-41.5	170.9	-76	0	0	0	0	111.7	G635 V637 A664 S669 N674 V675 L676	G635-C672 VanDerWaalsContact C-SG 3.55Å; G635-C672 PolarHBondContact O-SG 3.07Å; G635-C672 VanDerWaalsContact O-SG 3.4Å; V637-C672 VanDerWaalsContact CA-SG 3.57Å; A664-C672 HydrophobicContact CB-CB 3.69Å; S669-C672 PolarHBondContact O-N 2.99Å; S669-C672 PolarHBondContact OG-N 3.02Å; S669-C672 PolarHBondContact OG-SG 3.47Å; C672-N674 PolarHBondContact O-N 2.92Å; C672-V675 PolarHBondContact O-N 2.7Å; C672-L676 WeakPolarHBondContact O-CB 3.31Å; C672-L676 VanDerWaalsContact O-CG 3.26Å; C672-L676 WeakPolarHBondContact O-CG 3.37Å; C672-L676 PolarHBondContact O-N 2.83Å
673	I	94.8	Very high	91.7	Very high	21 Å²	21	54.8 Å²	54.8	11%	0.108	29%	0.294	C	S	.	.	H	α-helix	trans	-58.9	-46.9	174.1	-67.8	167.2	0	0	0	110.6	L661 A664 R665 S669 Q670 L676 L677	L661-I673 HydrophobicContact CD1-CB 4.28Å; L661-I673 HydrophobicContact CD1-CG1 4.13Å; L661-I673 HydrophobicContact CD1-CG2 4.12Å; A664-I673 HydrophobicContact CB-CG1 3.87Å; R665-I673 HydrophobicContact CG-CD1 3.75Å; R665-I673 HydrophobicContact CG-CG1 4.08Å; S669-I673 WeakPolarHBondContact O-CG1 3.47Å; S669-I673 PolarHBondContact O-N 2.93Å; Q670-I673 WeakPolarHBondContact O-CB 3.16Å; Q670-I673 PolarHBondContact O-N 3.14Å; I673-L676 PolarHBondContact O-N 3.37Å; I673-L677 HydrophobicContact CG2-CD1 3.73Å; I673-L677 HydrophobicContact CG2-CG 4.42Å; I673-L677 WeakPolarHBondContact O-CB 3.5Å; I673-L677 VanDerWaalsContact O-CG 3.27Å; I673-L677 WeakPolarHBondContact O-CG 3.18Å; I673-L677 PolarHBondContact O-N 3.16Å
674	N	92.2	Very high	90.1	Very high	65 Å²	65	61.2 Å²	61.2	35%	0.348	32%	0.322	S	S	.	.	H	α-helix	trans	-58.8	-49.2	178.4	-67.2	-9.5	0	0	0	111.8	E527 Q670 E671 C672 Q678	E527-N674 PolarHBondContact OE1-ND2 2.81Å; Q670-N674 PolarHBondContact NE2-OD1 2.75Å; Q670-N674 WeakPolarHBondContact O-CB 3.45Å; Q670-N674 PolarHBondContact O-N 2.98Å; Q670-N674 PolarHBondContact O-OD1 2.91Å; Q670-N674 VanDerWaalsContact O-OD1 3.08Å; E671-N674 PolarHBondContact O-N 3.01Å; C672-N674 PolarHBondContact O-N 2.92Å; N674-Q678 WeakPolarHBondContact O-CB 3.45Å; N674-Q678 PolarHBondContact O-N 3.44Å
675	V	94.3	Very high	87.9	Confident	0 Å²	0	65.1 Å²	65.1	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-61.2	-51.2	179.4	172.1	0	0	0	0	110.4	E527 V637 Q641 I644 E671 C672 L677 Q678 Y679	E527-V675 HydrophobicContact CB-CG2 4.05Å; E527-V675 HydrophobicContact CG-CG2 3.68Å; V637-V675 HydrophobicContact CG2-CG2 3.74Å; Q641-V675 HydrophobicContact CB-CG1 4.47Å; I644-V675 HydrophobicContact CD1-CG1 3.56Å; E671-V675 WeakPolarHBondContact O-CG2 3.37Å; E671-V675 PolarHBondContact O-N 2.85Å; C672-V675 PolarHBondContact O-N 2.7Å; V675-L677 VanDerWaalsContact C-N 3.34Å; V675-L677 PolarHBondContact O-N 3.49Å; V675-Q678 WeakPolarHBondContact O-CB 3.41Å; V675-Q678 PolarHBondContact O-N 3.01Å; V675-Q678 VanDerWaalsContact O-N 3.09Å; V675-Y679 HydrophobicContact CG1-CD2 3.89Å; V675-Y679 HydrophobicContact CG1-CE2 4.07Å; V675-Y679 VanDerWaalsContact O-CD2 3.26Å; V675-Y679 WeakPolarHBondContact O-CD2 3.21Å; V675-Y679 PolarHBondContact O-N 3.19Å
676	L	95.3	Very high	85.4	Confident	1 Å²	1	68.3 Å²	68.3	1%	0.005	38%	0.378	C	S	.	.	H	α-helix	trans	-59.6	-43.6	-178.2	-71.1	171.5	0	0	0	112.2	L628 I644 V650 A660 L661 A664 C672 I673 Y679 G680 C681	L628-L676 HydrophobicContact CD1-CD2 4.4Å; L628-L676 HydrophobicContact CD2-CD2 4.11Å; L628-L676 HydrophobicContact CG-CD2 4.42Å; I644-L676 HydrophobicContact CD1-CD2 4.09Å; V650-L676 HydrophobicContact CG1-CD2 3.67Å; A660-L676 HydrophobicContact CB-CD1 4.09Å; A660-L676 HydrophobicContact CB-CD2 4.02Å; L661-L676 HydrophobicContact CB-CD1 4Å; L661-L676 HydrophobicContact CD1-CB 4.16Å; L661-L676 HydrophobicContact CD1-CD1 4.1Å; A664-L676 HydrophobicContact CB-CD1 3.84Å; C672-L676 WeakPolarHBondContact O-CB 3.31Å; C672-L676 VanDerWaalsContact O-CG 3.26Å; C672-L676 WeakPolarHBondContact O-CG 3.37Å; C672-L676 PolarHBondContact O-N 2.83Å; I673-L676 PolarHBondContact O-N 3.37Å; L676-Y679 CarbonylContact O-C 3.52Å; L676-Y679 PolarHBondContact O-N 3.4Å; L676-G680 PolarHBondContact O-N 2.8Å; L676-C681 HydrophobicContact CB-CB 3.86Å; L676-C681 WeakPolarHBondContact O-CB 3.22Å; L676-C681 PolarHBondContact O-N 3.15Å
677	L	92.9	Very high	84.9	Confident	74 Å²	74	64.6 Å²	64.6	39%	0.387	36%	0.364	S	S	.	.	H	α-helix	trans	-65.8	-37.1	175.3	-68.2	172.5	0	0	0	112.1	L661 I673 V675 Y679 G680 D683	L661-L677 HydrophobicContact CD1-CG 4.46Å; L661-L677 HydrophobicContact CD2-CD2 3.93Å; I673-L677 HydrophobicContact CG2-CD1 3.73Å; I673-L677 HydrophobicContact CG2-CG 4.42Å; I673-L677 WeakPolarHBondContact O-CB 3.5Å; I673-L677 VanDerWaalsContact O-CG 3.27Å; I673-L677 WeakPolarHBondContact O-CG 3.18Å; I673-L677 PolarHBondContact O-N 3.16Å; V675-L677 VanDerWaalsContact C-N 3.34Å; V675-L677 PolarHBondContact O-N 3.49Å; L677-Y679 VanDerWaalsContact C-N 3.31Å; L677-Y679 PolarHBondContact O-N 3.49Å; L677-G680 PolarHBondContact O-N 3.1Å; L677-G680 VanDerWaalsContact O-N 3.1Å; L677-D683 HydrophobicContact CD2-CB 4.31Å
678	Q	91.7	Very high	84.3	Confident	133 Å²	133	65.9 Å²	65.9	62%	0.621	37%	0.366	S	S	*	.	H	α-helix	trans	-62.6	-36.2	175.1	-177.8	-178.4	7.4	0	0	112.4	N674 V675 G680	N674-Q678 WeakPolarHBondContact O-CB 3.45Å; N674-Q678 PolarHBondContact O-N 3.44Å; V675-Q678 WeakPolarHBondContact O-CB 3.41Å; V675-Q678 PolarHBondContact O-N 3.01Å; V675-Q678 VanDerWaalsContact O-N 3.09Å; Q678-G680 VanDerWaalsContact C-N 3.29Å
679	Y	90.7	Very high	83.7	Confident	79 Å²	79	63.7 Å²	63.7	31%	0.31	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.9	15.3	174.9	-67.4	-81.7	0	0	0	113.4	I644 W645 V675 L676 L677	I644-Y679 HydrophobicContact CD1-CD2 4.4Å; I644-Y679 HydrophobicContact CG2-CD1 3.72Å; I644-Y679 HydrophobicContact CG2-CD2 3.73Å; I644-Y679 HydrophobicContact CG2-CE1 4.15Å; I644-Y679 HydrophobicContact CG2-CE2 4.2Å; I644-Y679 HydrophobicContact CG2-CG 3.52Å; W645-Y679 AromaticContact NE1-CZ 3.68Å; W645-Y679 PolarHBondContact NE1-OH 3.14Å; V675-Y679 HydrophobicContact CG1-CD2 3.89Å; V675-Y679 HydrophobicContact CG1-CE2 4.07Å; V675-Y679 VanDerWaalsContact O-CD2 3.26Å; V675-Y679 WeakPolarHBondContact O-CD2 3.21Å; V675-Y679 PolarHBondContact O-N 3.19Å; L676-Y679 CarbonylContact O-C 3.52Å; L676-Y679 PolarHBondContact O-N 3.4Å; L677-Y679 VanDerWaalsContact C-N 3.31Å; L677-Y679 PolarHBondContact O-N 3.49Å
680	G	86.8	Confident	83	Confident	50 Å²	50	66.6 Å²	66.6	52%	0.515	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.7	11.2	166	0	0	0	0	0	116.2	L676 L677 Q678	L676-G680 PolarHBondContact O-N 2.8Å; L677-G680 PolarHBondContact O-N 3.1Å; L677-G680 VanDerWaalsContact O-N 3.1Å; Q678-G680 VanDerWaalsContact C-N 3.29Å
681	C	83.6	Confident	82.3	Confident	4 Å²	4	64.1 Å²	64.1	3%	0.027	35%	0.351	C	S	.	.			trans	-57.7	129.7	176.8	-160.8	0	0	0	0	110.2	V650 L676 D683	V650-C681 HydrophobicContact CG1-CB 3.92Å; V650-C681 PolarHBondContact O-SG 3.18Å; L676-C681 HydrophobicContact CB-CB 3.86Å; L676-C681 WeakPolarHBondContact O-CB 3.22Å; L676-C681 PolarHBondContact O-N 3.15Å; C681-D683 PolarHBondContact O-N 3.23Å
682	P	77.3	Confident	81.6	Confident	48 Å²	48	64.6 Å²	64.6	31%	0.312	36%	0.357	S	S	.	.			trans	-67.5	124	-172.6	25.7	-34.7	0	0	0	111.8	L661 K684	L661-P682 WeakPolarHBondContact CD2-O 3.39Å; P682-K684 PolarHBondContact O-N 3.49Å; P682-K684 VanDerWaalsContact O-N 3.07Å
683	D	73.2	Confident	80.6	Confident	89 Å²	89	69.2 Å²	69.2	48%	0.476	38%	0.382	S	S	.	.	S	Bend	trans	-53.4	-29	178.6	178	38.6	0	0	0	113.6	R665 L677 C681	R665-D683 IonicContact CZ-OD1 3Å; R665-D683 PolarHBondContact NH1-O 3.18Å; R665-D683 PolarHBondContact NH2-O 3.07Å; R665-D683 IonicContact NH2-OD1 3.56Å; R665-D683 PolarHBondContact NH2-OD1 3.43Å; L677-D683 HydrophobicContact CD2-CB 4.31Å; C681-D683 PolarHBondContact O-N 3.23Å
684	K	63.6	Low	79.5	Confident	156 Å²	156	72.9 Å²	72.9	68%	0.678	40%	0.403	S	S	*	.	S	Bend	trans	-124.7	139.9	-180	-60	-178.6	-178.5	-177.7	0	110.1	P682 V686	P682-K684 PolarHBondContact O-N 3.49Å; P682-K684 VanDerWaalsContact O-N 3.07Å; K684-V686 PolarHBondContact O-N 2.96Å
685	C	50.7	Low	78.5	Confident	81 Å²	81	73.6 Å²	73.6	55%	0.547	41%	0.408	S	S	.	.			trans	-62.7	116.6	162.6	-58	0	0	0	0	108.5
686	V	41.3	Very low	77	Confident	168 Å²	168	80.3 Å²	80.3	100%	1.018	45%	0.445	S	S	*	.			trans	-91.2	0	164.1	-173.2	0	0	0	0	108.4	R653 K684	R653-V686 VanDerWaalsContact CZ-O 3.24Å; R653-V686 PolarHBondContact NH1-O 3.29Å; R653-V686 PolarHBondContact NH2-O 3.31Å; K684-V686 PolarHBondContact O-N 2.96Å

Retrieved 686 of 686 residues in 100.8 ms (Link to these results)

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