A0A093JDC2_STRCA Loading...

Microprocessor complex subunit DGCR8

AlphaFold DB , UniProt , Accession A0A093JDC2, Species STRCA (Struthio camelus australis), Gene n/a, Length 775 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	32	Very low	38.8	Very low	217 Å²	217	150 Å²	150	100%	1.069	78%	0.775	S	S	*	*				0	79.6	0	-65	166.4	-179.5	0	0	107.9
2	E	33.5	Very low	38.1	Very low	146 Å²	146	154.6 Å²	154.6	68%	0.682	79%	0.785	S	S	*	*			cis	69	140	38.6	-59.7	165	104.8	0	0	113.4
3	K	35.1	Very low	37.7	Very low	158 Å²	158	155.3 Å²	155.3	69%	0.687	78%	0.784	S	S	*	*			cis	-152.5	148.7	-4.4	-108.9	157.4	179.4	156.9	0	107.2
4	Y	38.3	Very low	37.9	Very low	210 Å²	210	152.7 Å²	152.7	82%	0.824	78%	0.783	S	S	*	*				47.8	148.7	90.1	-70.9	-80.4	0	0	0	114.9
5	E	37.4	Very low	37.2	Very low	158 Å²	158	148.1 Å²	148.1	74%	0.738	78%	0.777	S	S	*	*			cis	-157.5	177.4	18.6	-133.9	176.8	81.7	0	0	108.6
6	N	30.1	Very low	36.7	Very low	130 Å²	130	153.5 Å²	153.5	70%	0.695	78%	0.784	S	S	*	*			cis	-151.5	-167.5	-2.6	-157.4	-38.5	0	0	0	108.2
7	V	33.2	Very low	36.1	Very low	127 Å²	127	155.8 Å²	155.8	77%	0.77	79%	0.791	S	S	*	*			trans	-125.8	-134.4	-175.2	-162.4	0	0	0	0	114.3
8	P	56.8	Low	35.9	Very low	109 Å²	109	156.4 Å²	156.4	71%	0.708	79%	0.792	S	S	*	*			trans	-104.3	-164.7	-133.5	41.6	-26.1	0	0	0	115.2
9	P	49.3	Very low	35.4	Very low	123 Å²	123	156.8 Å²	156.8	80%	0.799	80%	0.797	S	S	*	*				-151.9	177.5	86.7	40.7	-21.5	0	0	0	117.3
10	L	36.8	Very low	35.3	Very low	165 Å²	165	153.3 Å²	153.3	86%	0.864	78%	0.783	S	S	*	*			trans	-109.8	142.1	179.3	-120.8	174.4	0	0	0	113.2
11	P	44.4	Very low	35	Very low	107 Å²	107	155 Å²	155	70%	0.695	79%	0.788	S	S	*	*			trans	-136.7	153.8	152.8	32.7	-16.2	0	0	0	113.2
12	K	30.2	Very low	34.9	Very low	205 Å²	205	150 Å²	150	89%	0.891	77%	0.765	S	S	*	*			cis	-166.2	169.5	-17.4	-135.7	-174.2	-175.8	-176.3	0	109.3
13	E	33.3	Very low	34.6	Very low	164 Å²	164	151 Å²	151	77%	0.766	77%	0.77	S	S	*	*			trans	-110.5	157	168.4	-143.8	-168.5	-138	0	0	110.7
14	P	40.7	Very low	34.2	Very low	119 Å²	119	149.5 Å²	149.5	77%	0.773	77%	0.774	S	S	*	*				-139.6	-175	95.4	41.8	-26.3	0	0	0	111.8
15	A	27.5	Very low	34	Very low	84 Å²	84	145.2 Å²	145.2	69%	0.694	77%	0.774	S	S	*	*			cis	-155.5	-120.4	26.6	0	0	0	0	0	115.5
16	R	29.4	Very low	34.9	Very low	234 Å²	234	143.2 Å²	143.2	88%	0.883	77%	0.774	S	S	*	*			trans	-153.1	165.2	-165.9	-79.6	-173.3	178.1	178.3	-2.3	107.6
17	E	26.5	Very low	35.4	Very low	193 Å²	193	142.9 Å²	142.9	90%	0.902	78%	0.779	S	S	*	*			cis	-138.8	168.2	41.6	-66.4	-175.7	137.8	0	0	115.7
18	M	31.7	Very low	35.9	Very low	167 Å²	167	142.5 Å²	142.5	82%	0.823	78%	0.779	S	S	*	*			trans	-94.5	153.8	173.8	-60.1	159.8	59.4	0	0	109.9	V20	M18-V20 HydrophobicContact CE-CG2 4.39Å
19	N	26.4	Very low	35.3	Very low	163 Å²	163	145.2 Å²	145.2	87%	0.872	79%	0.787	S	S	*	*			trans	-143.7	155.7	141.5	-153.3	-1.2	0	0	0	110.8
20	V	33.5	Very low	35.1	Very low	87 Å²	87	144.8 Å²	144.8	53%	0.527	78%	0.784	S	S	.	*			trans	-140.6	115.1	-167.1	178.3	0	0	0	0	111	M18	M18-V20 HydrophobicContact CE-CG2 4.39Å
21	E	29.4	Very low	35.6	Very low	189 Å²	189	142.4 Å²	142.4	88%	0.883	78%	0.778	S	S	*	*			trans	-138.4	113.6	156.9	-77.3	179.7	154.3	0	0	107
22	N	28.9	Very low	35.1	Very low	112 Å²	112	144.3 Å²	144.3	60%	0.599	78%	0.783	S	S	*	*				83	104.5	56.6	-78.4	-13.9	0	0	0	114.8
23	H	28.5	Very low	35.3	Very low	166 Å²	166	143.4 Å²	143.4	77%	0.769	78%	0.782	S	S	*	*			trans	59.3	126.4	151.1	-42	-53.4	0	0	0	119.8
24	T	27.1	Very low	35.8	Very low	128 Å²	128	144.3 Å²	144.3	79%	0.785	79%	0.786	S	S	*	*				173.3	139.3	101.1	-70.6	0	0	0	0	112
25	C	33.7	Very low	35.9	Very low	120 Å²	120	144.4 Å²	144.4	81%	0.811	79%	0.787	S	S	*	*			trans	-139.5	164.7	159.2	-66.1	0	0	0	0	107.6
26	P	55	Low	36.8	Very low	115 Å²	115	145.9 Å²	145.9	75%	0.747	79%	0.789	S	S	*	*				-129	171.1	-63.4	38.4	-25	0	0	0	112.3
27	P	41	Very low	37.7	Very low	123 Å²	123	140.3 Å²	140.3	80%	0.799	78%	0.783	S	S	*	*			trans	-101.2	168.1	165.1	6.9	15	0	0	0	113.2
28	P	44.7	Very low	38.6	Very low	120 Å²	120	136.6 Å²	136.6	78%	0.779	78%	0.776	S	S	*	*			trans	-116.1	171	-140.7	42.2	-36.5	0	0	0	118
29	L	42.8	Very low	39.2	Very low	166 Å²	166	134.8 Å²	134.8	87%	0.869	78%	0.777	S	S	*	*			trans	-68.4	148.5	158.6	-62.8	170.1	0	0	0	110.4
30	P	46.1	Very low	39.5	Very low	114 Å²	114	135 Å²	135	74%	0.74	78%	0.777	S	S	*	*				-154.4	-165.7	85.7	39.7	-19	0	0	0	113.8
31	P	47.5	Very low	39.9	Very low	114 Å²	114	139.8 Å²	139.8	74%	0.74	79%	0.794	S	S	*	*			cis	-129.2	176.6	-47.8	35.3	-19.1	0	0	0	113.9
32	N	34.2	Very low	40	Very low	148 Å²	148	137.6 Å²	137.6	79%	0.791	79%	0.793	S	S	*	*			trans	63.9	108.9	147.1	-143.9	49.4	0	0	0	120.5
33	E	34	Very low	40.6	Very low	185 Å²	185	137.8 Å²	137.8	86%	0.864	80%	0.803	S	S	*	*				-172.3	166.4	116.6	-104.5	174.7	-167.5	0	0	111.8
34	Q	43.4	Very low	41	Very low	184 Å²	184	135.5 Å²	135.5	86%	0.86	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-89.8	150.9	-175.5	-72.3	-179.5	-46.4	0	0	112.6
35	P	41.9	Very low	41.5	Very low	121 Å²	121	136.8 Å²	136.8	79%	0.786	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-71.5	139.3	176.5	29.7	-34.8	0	0	0	112
36	P	47.8	Very low	41.7	Very low	115 Å²	115	134.4 Å²	134.4	75%	0.747	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-74.2	155.4	176.3	30.7	-35.1	0	0	0	112.6
37	P	46.6	Very low	40.9	Very low	117 Å²	117	138 Å²	138	76%	0.76	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-76.2	161.2	-179.2	32.4	-36.5	0	0	0	113.2
38	P	46.8	Very low	40.8	Very low	115 Å²	115	138.3 Å²	138.3	75%	0.747	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-72.5	143.1	178	30.3	-35.4	0	0	0	112.4
39	P	44.2	Very low	40.5	Very low	129 Å²	129	141.1 Å²	141.1	84%	0.838	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-70.6	152.7	169.5	30.4	-34.1	0	0	0	111.7
40	L	31.4	Very low	40.3	Very low	167 Å²	167	139.9 Å²	139.9	87%	0.874	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-82.5	168.6	-173.3	-73.3	164.1	0	0	0	113.7
41	Q	42.2	Very low	40.1	Very low	188 Å²	188	140.5 Å²	140.5	88%	0.879	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-61.2	142.8	174.1	-59.2	165.8	-99.8	0	0	112.7
42	T	32	Very low	39.4	Very low	142 Å²	142	139.8 Å²	139.8	87%	0.871	80%	0.801	S	S	*	*			trans	-132.6	139.5	149.9	52.6	0	0	0	0	109.7
43	S	41.4	Very low	39.8	Very low	116 Å²	116	138.9 Å²	138.9	81%	0.811	81%	0.807	S	S	*	*			trans	-94.3	-172.9	179.5	52.4	0	0	0	0	112.3
44	S	37.9	Very low	39.8	Very low	119 Å²	119	133.5 Å²	133.5	83%	0.832	80%	0.801	S	S	*	*			trans	81.9	146	172.1	-134.2	0	0	0	0	114.9
45	D	36.4	Very low	39.2	Very low	154 Å²	154	128 Å²	128	82%	0.824	79%	0.794	S	S	*	*			cis	-156.8	-177	-35.3	-167.3	17.5	0	0	0	108.3
46	A	38	Very low	39.2	Very low	71 Å²	71	129.7 Å²	129.7	59%	0.587	80%	0.796	S	S	*	*			trans	-42.4	153.3	-179.3	0	0	0	0	0	118.5
47	E	37.7	Very low	38.6	Very low	190 Å²	190	127.3 Å²	127.3	89%	0.888	79%	0.793	S	S	*	*				-136.4	153.4	122.6	-80.1	-148.4	136.7	0	0	110.3
48	V	39.3	Very low	38	Very low	129 Å²	129	130 Å²	130	78%	0.782	80%	0.795	S	S	*	*			trans	-129.1	139	178	173.5	0	0	0	0	107.9
49	M	38.9	Very low	37.5	Very low	179 Å²	179	129.5 Å²	129.5	88%	0.882	79%	0.794	S	S	*	*			trans	-120.1	129.5	172.5	-76.5	-73.2	-83	0	0	110.3
50	D	39.5	Very low	36.9	Very low	140 Å²	140	130.1 Å²	130.1	75%	0.749	79%	0.79	S	S	*	*			trans	-123.8	154	179.9	178.5	32.1	0	0	0	110
51	V	41	Very low	36.9	Very low	128 Å²	128	128.1 Å²	128.1	78%	0.776	79%	0.786	S	S	*	*			trans	-143.9	60.2	-179.6	-74.8	0	0	0	0	113
52	S	32.6	Very low	37.9	Very low	98 Å²	98	124.6 Å²	124.6	69%	0.685	78%	0.779	S	S	*	*				41.3	137.5	124.8	68.5	0	0	0	0	122.2
53	S	42.8	Very low	37.8	Very low	130 Å²	130	123 Å²	123	91%	0.909	78%	0.78	S	S	*	*			trans	125.1	131	137.9	-162.5	0	0	0	0	115.3
54	G	34.5	Very low	37.1	Very low	71 Å²	71	121.1 Å²	121.1	73%	0.732	78%	0.779	S	S	*	*			cis	179.6	157.9	-4.5	0	0	0	0	0	115.3
55	G	31.2	Very low	36.7	Very low	69 Å²	69	122.8 Å²	122.8	71%	0.711	78%	0.779	S	S	*	*			trans	74.2	171.4	-179.3	0	0	0	0	0	115
56	D	40.6	Very low	36.3	Very low	157 Å²	157	121.4 Å²	121.4	84%	0.84	78%	0.776	S	S	*	*			cis	-171.3	170.1	-27.1	-119.9	-73.7	0	0	0	106.5
57	G	35.1	Very low	35.8	Very low	65 Å²	65	126.2 Å²	126.2	67%	0.67	79%	0.786	S	S	*	*			cis	167.7	164.6	2.6	0	0	0	0	0	108.1
58	Q	33.6	Very low	35.4	Very low	172 Å²	172	122.3 Å²	122.3	80%	0.804	78%	0.78	S	S	*	*			cis	-155.2	140.8	-3.9	-54.6	177.9	-96.8	0	0	109.8
59	S	37.1	Very low	34.8	Very low	106 Å²	106	123.7 Å²	123.7	74%	0.741	78%	0.781	S	S	*	*			trans	48.6	166.1	147.3	97.1	0	0	0	0	121.9
60	D	30.7	Very low	34.1	Very low	141 Å²	141	120.6 Å²	120.6	75%	0.754	78%	0.776	S	S	*	*			cis	-148.3	-168.6	9.5	-128.6	-50.7	0	0	0	113.5
61	T	32.3	Very low	33.4	Very low	126 Å²	126	124.9 Å²	124.9	77%	0.773	78%	0.781	S	S	*	*			trans	-107.2	-150.6	-163	-29.7	0	0	0	0	115.5
62	P	64.1	Low	33	Very low	114 Å²	114	124 Å²	124	74%	0.74	78%	0.776	S	S	*	*				-121.6	-175.8	-129.5	44.7	-28.4	0	0	0	118.7
63	A	30.1	Very low	33	Very low	108 Å²	108	126.8 Å²	126.8	89%	0.893	78%	0.779	S	S	*	*			trans	85.4	152.6	158.4	0	0	0	0	0	120
64	G	26.3	Very low	32.2	Very low	77 Å²	77	128.1 Å²	128.1	79%	0.794	77%	0.774	S	S	*	*			trans	144	123.5	169.8	0	0	0	0	0	115.6
65	D	28.3	Very low	32.4	Very low	153 Å²	153	130.9 Å²	130.9	82%	0.818	77%	0.772	S	S	*	*			trans	-70.7	170.3	177.6	-52.6	-84	0	0	0	114.6
66	T	28.1	Very low	32.5	Very low	125 Å²	125	133.2 Å²	133.2	77%	0.767	77%	0.772	S	S	*	*				178.2	151.5	107.8	30.1	0	0	0	0	117.8
67	H	28.8	Very low	32.2	Very low	172 Å²	172	135.6 Å²	135.6	80%	0.796	78%	0.775	S	S	*	*			trans	63.7	104.1	148.8	-72.6	-57.8	0	0	0	123.8
68	S	28.2	Very low	31.9	Very low	108 Å²	108	136 Å²	136	76%	0.755	78%	0.78	S	S	*	*			trans	-85.3	151.5	145	168	0	0	0	0	111.6
69	I	26.2	Very low	31.6	Very low	159 Å²	159	134.3 Å²	134.3	82%	0.815	79%	0.787	S	S	*	*			trans	-173.7	160	140	-99.6	157.3	0	0	0	112.7
70	C	26.1	Very low	31.4	Very low	113 Å²	113	133.7 Å²	133.7	76%	0.764	79%	0.788	S	S	*	*			trans	-52.6	165.7	-176.1	-51.1	0	0	0	0	116.4
71	R	24.8	Very low	31.4	Very low	230 Å²	230	131.8 Å²	131.8	87%	0.868	79%	0.785	S	S	*	*				-171.2	125.9	59.3	-155.7	171.4	-169	165.4	2.5	111.2
72	T	31	Very low	31.1	Very low	109 Å²	109	136 Å²	136	67%	0.669	79%	0.788	S	S	*	*				49	136.5	101.4	-4	0	0	0	0	115.7
73	Q	33.7	Very low	29.4	Very low	158 Å²	158	139.6 Å²	139.6	74%	0.738	79%	0.792	S	S	*	*			cis	-169.2	168.7	14.4	-157.4	171.1	61.1	0	0	112.6
74	L	26.8	Very low	29.3	Very low	157 Å²	157	139.4 Å²	139.4	82%	0.822	78%	0.784	S	S	*	*			trans	143.9	128	154.7	-78.3	157	0	0	0	109.8
75	L	37.2	Very low	29.5	Very low	129 Å²	129	146.2 Å²	146.2	68%	0.675	79%	0.786	S	S	*	*			cis	85.3	134.7	40.3	-64.4	169.7	0	0	0	113.1
76	T	33.8	Very low	29.5	Very low	118 Å²	118	146.4 Å²	146.4	72%	0.724	79%	0.786	S	S	*	*			cis	-166.6	172.4	13.4	-12.7	0	0	0	0	114.5
77	K	34.2	Very low	30.1	Very low	208 Å²	208	148 Å²	148	90%	0.904	79%	0.788	S	S	*	*			trans	75.5	150.4	163.3	-62.2	165.6	-177.1	177.4	0	118.1
78	G	29.5	Very low	30.1	Very low	74 Å²	74	147.3 Å²	147.3	76%	0.763	79%	0.789	S	S	*	*			cis	164.4	159.3	-12.2	0	0	0	0	0	115.8
79	S	27.6	Very low	30.3	Very low	136 Å²	136	149 Å²	149	95%	0.951	79%	0.789	S	S	*	*			trans	97.7	160.4	171.9	-148.5	0	0	0	0	119.7
80	A	32.6	Very low	31.1	Very low	92 Å²	92	146.2 Å²	146.2	76%	0.76	78%	0.781	S	S	*	*			trans	-143.3	166.4	-166.9	0	0	0	0	0	113.5
81	C	29.1	Very low	31.2	Very low	102 Å²	102	147.2 Å²	147.2	69%	0.689	78%	0.779	S	S	*	*				174.9	149.6	86.2	-160.6	0	0	0	0	108.9
82	Y	27	Very low	31.3	Very low	214 Å²	214	143.9 Å²	143.9	84%	0.839	78%	0.779	S	S	*	*				-175.5	178.8	81.6	-115.8	-83.7	0	0	0	113.6
83	K	28.8	Very low	31.2	Very low	189 Å²	189	143.5 Å²	143.5	82%	0.822	78%	0.78	S	S	*	*			trans	-81.4	174.4	179.9	-47.1	172.1	-174.2	172.9	0	112.2
84	S	26.5	Very low	30.9	Very low	104 Å²	104	142.9 Å²	142.9	73%	0.727	78%	0.782	S	S	*	*			cis	-156.5	170	4.2	-145.3	0	0	0	0	107.4
85	R	31.1	Very low	31.1	Very low	220 Å²	220	143.9 Å²	143.9	83%	0.83	78%	0.782	S	S	*	*			cis	80.4	92.1	15.9	-136.2	-160.8	-161.1	-154.6	5.3	118.3
86	L	28.5	Very low	31.1	Very low	157 Å²	157	143.3 Å²	143.3	82%	0.822	79%	0.79	S	S	*	*				174	167.3	117.3	-94.8	173.3	0	0	0	115.4
87	I	41.2	Very low	31.4	Very low	159 Å²	159	143.5 Å²	143.5	82%	0.815	79%	0.793	S	S	*	*			trans	-122.4	137.5	176.8	-60.4	164.7	0	0	0	108.5
88	I	28.8	Very low	31.3	Very low	158 Å²	158	144.6 Å²	144.6	81%	0.81	79%	0.791	S	S	*	*			trans	-146.2	147.5	166.6	-59.5	-175.4	0	0	0	110
89	D	32.6	Very low	31.4	Very low	142 Å²	142	147.4 Å²	147.4	76%	0.759	79%	0.794	S	S	*	*			trans	-134.4	138.2	176.6	175.9	39.2	0	0	0	107.2
90	P	41.7	Very low	31.4	Very low	101 Å²	101	144.8 Å²	144.8	66%	0.656	78%	0.78	S	S	*	*				-160.8	167.5	101.4	41.8	-21.7	0	0	0	119
91	N	28.8	Very low	31.6	Very low	135 Å²	135	151.4 Å²	151.4	72%	0.722	79%	0.786	S	S	*	*			trans	8.9	126.7	147.1	-60.4	-35.3	0	0	0	121.4
92	N	27.3	Very low	31.9	Very low	160 Å²	160	155.7 Å²	155.7	86%	0.856	80%	0.795	S	S	*	*				177.3	169.2	101.2	-105.9	-66.1	0	0	0	116.3
93	S	28.3	Very low	32.4	Very low	100 Å²	100	149.5 Å²	149.5	70%	0.699	79%	0.788	S	S	*	*			trans	81	74.4	156.3	-167.6	0	0	0	0	120.6
94	D	28.2	Very low	32.9	Very low	145 Å²	145	146.7 Å²	146.7	78%	0.775	79%	0.789	S	S	*	*				62.3	153.4	116.5	-72.9	-6.3	0	0	0	125.1
95	Q	30.1	Very low	33.4	Very low	178 Å²	178	147.2 Å²	147.2	83%	0.832	79%	0.793	S	S	*	*			trans	74.7	100.2	160.7	-72.7	170.5	52.3	0	0	120
96	S	36.9	Very low	33.6	Very low	118 Å²	118	143 Å²	143	83%	0.825	79%	0.791	S	S	*	*			trans	-69.7	141.7	145	60	0	0	0	0	111
97	P	40.2	Very low	34	Very low	122 Å²	122	146.6 Å²	146.6	79%	0.792	79%	0.794	S	S	*	*				-141.5	173.2	115.4	37.6	-25.4	0	0	0	115.3
98	R	31.7	Very low	33.8	Very low	231 Å²	231	147.9 Å²	147.9	87%	0.872	79%	0.794	S	S	*	*			trans	-58.9	146.9	177	-57.5	160.4	167.8	154.5	-8.5	112.7
99	T	32.4	Very low	34.2	Very low	133 Å²	133	150.4 Å²	150.4	82%	0.816	80%	0.799	S	S	*	*				168.8	157.7	100.8	37.2	0	0	0	0	114.3
100	A	28.7	Very low	34.6	Very low	81 Å²	81	149 Å²	149	67%	0.669	80%	0.796	S	S	*	*			trans	63.3	118.8	149.8	0	0	0	0	0	121.7
101	R	35.4	Very low	34.6	Very low	230 Å²	230	149.4 Å²	149.4	87%	0.868	80%	0.798	S	S	*	*			trans	57.8	128.9	138.2	-57.8	173.3	-178.8	-178.9	-0.4	118.8
102	H	36	Very low	35.3	Very low	193 Å²	193	147.8 Å²	147.8	89%	0.894	79%	0.79	S	S	*	*				-164.9	138.6	116.7	-104.7	-71.9	0	0	0	110.9
103	A	36.6	Very low	36.3	Very low	83 Å²	83	147.1 Å²	147.1	69%	0.686	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-92.8	152.3	169.4	0	0	0	0	0	110.2
104	P	39.4	Very low	37.4	Very low	131 Å²	131	150.4 Å²	150.4	85%	0.851	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-57.6	144.5	171.2	-23.6	34.6	0	0	0	112.1
105	S	37	Very low	38.4	Very low	115 Å²	115	150.9 Å²	150.9	80%	0.804	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-80.4	130.1	-171.4	48.5	0	0	0	0	113.4	R107	S105-R107 PolarHBondContact O-N 2.74Å
106	V	35.6	Very low	39.2	Very low	131 Å²	131	149.9 Å²	149.9	79%	0.794	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-64.5	117.8	169.4	178	0	0	0	0	109.3	K108	V106-K108 PolarHBondContact O-N 3.21Å
107	R	36.5	Very low	39.4	Very low	232 Å²	232	152.4 Å²	152.4	88%	0.875	79%	0.785	S	S	*	*			trans	-70.3	111.9	166	-71.8	-171.4	179.7	-170.1	1.5	108.7	S105 F109	S105-R107 PolarHBondContact O-N 2.74Å; R107-F109 PolarHBondContact O-N 2.65Å
108	K	38.5	Very low	39.6	Very low	187 Å²	187	154 Å²	154	81%	0.813	79%	0.786	S	S	*	*			trans	-67.9	117.9	171.3	-65.9	-178	179.3	-178.7	0	109.2	V106 T110	V106-K108 PolarHBondContact O-N 3.21Å; K108-T110 PolarHBondContact O-N 3.32Å
109	F	35.5	Very low	39.8	Very low	210 Å²	210	149.2 Å²	149.2	92%	0.921	78%	0.782	S	S	*	*			trans	-77.6	116.1	161.2	-110.7	-88.8	0	0	0	108.6	R107	R107-F109 PolarHBondContact O-N 2.65Å
110	T	41.3	Very low	40	Very low	112 Å²	112	152.1 Å²	152.1	69%	0.687	78%	0.784	S	S	*	*			trans	-111.2	123.6	166.7	48.9	0	0	0	0	108.1	K108	K108-T110 PolarHBondContact O-N 3.32Å
111	P	43.1	Very low	40.4	Very low	110 Å²	110	155.1 Å²	155.1	71%	0.714	79%	0.787	S	S	*	*			trans	-67.8	140.5	178.2	28.6	-34.2	0	0	0	110.9	L113	P111-L113 PolarHBondContact O-N 2.64Å
112	D	42.6	Very low	40.2	Very low	102 Å²	102	149.1 Å²	149.1	55%	0.545	78%	0.781	S	S	.	*			trans	-76.6	112.7	175.4	-172.4	-4.8	0	0	0	110.4	K114	D112-K114 PolarHBondContact O-N 2.69Å; D112-K114 WeakPolarHBondContact OD1-CB 3.41Å; D112-K114 WeakPolarHBondContact OD1-CG 3.16Å; D112-K114 PolarHBondContact OD1-N 2.95Å; D112-K114 VanDerWaalsContact OD1-N 3.08Å
113	L	49.2	Very low	40	Very low	145 Å²	145	145 Å²	145	76%	0.759	77%	0.769	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.7	11.9	-178.8	-62.7	174.7	0	0	0	113.9	P111	P111-L113 PolarHBondContact O-N 2.64Å
114	K	49.8	Very low	39.7	Very low	169 Å²	169	146.1 Å²	146.1	74%	0.735	77%	0.771	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.6	-14.4	176.7	-66.8	175.5	-178	174.2	0	114.9	D112	D112-K114 PolarHBondContact O-N 2.69Å; D112-K114 WeakPolarHBondContact OD1-CB 3.41Å; D112-K114 WeakPolarHBondContact OD1-CG 3.16Å; D112-K114 PolarHBondContact OD1-N 2.95Å; D112-K114 VanDerWaalsContact OD1-N 3.08Å
115	L	50.2	Low	39.3	Very low	156 Å²	156	148.9 Å²	148.9	82%	0.817	77%	0.77	S	S	*	*	S	Bend	trans	-92.3	0.9	-179.9	-67.6	174.4	0	0	0	114.3
116	L	46.4	Very low	39.1	Very low	157 Å²	157	149.6 Å²	149.6	82%	0.822	77%	0.77	S	S	*	*			trans	-113.5	88	173.4	-77	169.6	0	0	0	110.7
117	K	41.5	Very low	39.1	Very low	171 Å²	171	152.7 Å²	152.7	74%	0.743	78%	0.776	S	S	*	*			trans	-133	145.6	162.6	-71.2	-167.4	174.1	-173	0	110.5
118	D	45	Very low	39.1	Very low	154 Å²	154	146.8 Å²	146.8	82%	0.824	77%	0.77	S	S	*	*			trans	65.3	49.8	162.4	-51	-33.6	0	0	0	118.5
119	V	35.8	Very low	38.8	Very low	131 Å²	131	143.9 Å²	143.9	79%	0.794	77%	0.772	S	S	*	*			trans	-113.3	94.7	144	-176.9	0	0	0	0	109.1	I121	V119-I121 HydrophobicContact CG1-CG1 4.22Å; V119-I121 PolarHBondContact O-N 3.18Å
120	K	35.3	Very low	39	Very low	195 Å²	195	143.9 Å²	143.9	85%	0.848	77%	0.772	S	S	*	*			trans	-90.3	87.9	-174.1	-174	-178.8	178.9	-179.1	0	111.4	S122	K120-S122 PolarHBondContact O-N 3.28Å
121	I	37.3	Very low	39	Very low	144 Å²	144	144.2 Å²	144.2	74%	0.738	78%	0.779	S	S	*	*			trans	-78.2	105.6	175	-52.3	-179.4	0	0	0	109.8	V119 V123	V119-I121 HydrophobicContact CG1-CG1 4.22Å; V119-I121 PolarHBondContact O-N 3.18Å; I121-V123 HydrophobicContact CG2-CG2 4.18Å
122	S	31.2	Very low	39	Very low	104 Å²	104	147.9 Å²	147.9	73%	0.727	78%	0.783	S	S	*	*			trans	-95.1	109.5	170.7	55.6	0	0	0	0	111	K120	K120-S122 PolarHBondContact O-N 3.28Å
123	V	31.4	Very low	39	Very low	106 Å²	106	150.5 Å²	150.5	64%	0.642	80%	0.797	S	S	*	*			trans	-92.9	109.5	171.6	-177.4	0	0	0	0	109.2	I121 F125	I121-V123 HydrophobicContact CG2-CG2 4.18Å; V123-F125 HydrophobicContact CG1-CD2 4.18Å; V123-F125 HydrophobicContact CG1-CE2 3.75Å; V123-F125 HydrophobicContact CG1-CZ 4.05Å
124	S	31.2	Very low	38.4	Very low	106 Å²	106	155.2 Å²	155.2	74%	0.741	81%	0.805	S	S	*	*			trans	-99.8	115.6	170.5	55.9	0	0	0	0	110.2
125	F	30	Very low	37.8	Very low	190 Å²	190	156.7 Å²	156.7	83%	0.833	81%	0.811	S	S	*	*			trans	-80.7	131.3	170.2	-69.2	-88.6	0	0	0	110.3	V123	V123-F125 HydrophobicContact CG1-CD2 4.18Å; V123-F125 HydrophobicContact CG1-CE2 3.75Å; V123-F125 HydrophobicContact CG1-CZ 4.05Å
126	T	33.4	Very low	37	Very low	130 Å²	130	155.8 Å²	155.8	80%	0.798	81%	0.812	S	S	*	*			trans	-125.1	115.8	161.5	53.7	0	0	0	0	107.6
127	E	36.1	Very low	36.2	Very low	195 Å²	195	155.7 Å²	155.7	91%	0.911	81%	0.811	S	S	*	*			trans	-63.3	148.7	167.5	-66.5	-177.9	105	0	0	110.3
128	S	36.5	Very low	35.6	Very low	109 Å²	109	158.4 Å²	158.4	76%	0.762	82%	0.819	S	S	*	*			trans	125.9	150.3	153.5	-160.9	0	0	0	0	116.3
129	C	31.8	Very low	35.1	Very low	126 Å²	126	157.6 Å²	157.6	85%	0.851	82%	0.82	S	S	*	*			trans	69.3	154	169.3	-74.4	0	0	0	0	119.7
130	K	40.8	Very low	34.9	Very low	210 Å²	210	154.9 Å²	154.9	91%	0.913	82%	0.818	S	S	*	*			trans	-123.5	126.8	-166.8	-51.1	166	-176.1	172.8	0	109.7
131	S	40.9	Very low	34.6	Very low	119 Å²	119	152 Å²	152	83%	0.832	82%	0.816	S	S	*	*			trans	-162.3	165.3	154.5	65.2	0	0	0	0	110.8
132	K	43.5	Very low	34.2	Very low	187 Å²	187	154.1 Å²	154.1	81%	0.813	82%	0.823	S	S	*	*			trans	-80.3	178.7	164.6	-67.3	178.9	179	178.2	0	109.8
133	D	42.7	Very low	34.1	Very low	156 Å²	156	156.8 Å²	156.8	83%	0.834	82%	0.824	S	S	*	*			trans	67.1	102.3	176	-55.4	-18.8	0	0	0	116.6
134	R	36.3	Very low	34.1	Very low	244 Å²	244	157.7 Å²	157.7	92%	0.921	83%	0.825	S	S	*	*			trans	-133.5	105.6	158.7	-66.1	-175.4	74.1	159.9	2.3	108.9
135	K	35.8	Very low	34	Very low	200 Å²	200	161.4 Å²	161.4	87%	0.87	82%	0.824	S	S	*	*			trans	-68.4	143.7	160.8	-72.2	-175.5	177.2	-178.9	0	108.6
136	V	33.2	Very low	34.2	Very low	138 Å²	138	160 Å²	160	84%	0.836	82%	0.818	S	S	*	*			trans	-89	125.9	163.4	-179.4	0	0	0	0	107.4
137	L	30	Very low	34.1	Very low	154 Å²	154	157.2 Å²	157.2	81%	0.806	81%	0.808	S	S	*	*			trans	-115.6	134.6	170	-88.6	160.4	0	0	0	107.8
138	Y	29.5	Very low	33.7	Very low	228 Å²	228	153.2 Å²	153.2	89%	0.894	79%	0.793	S	S	*	*			trans	-97.5	131.6	174.8	-130	-98.1	0	0	0	108.5
139	T	34.6	Very low	33.4	Very low	138 Å²	138	153.8 Å²	153.8	85%	0.847	79%	0.792	S	S	*	*			trans	-126.7	106.1	174.8	17.3	0	0	0	0	109.8
140	G	30.8	Very low	33.2	Very low	73 Å²	73	153.4 Å²	153.4	75%	0.753	78%	0.781	S	S	*	*			trans	-130.6	135.3	162.3	0	0	0	0	0	107.1
141	V	29.9	Very low	32.6	Very low	134 Å²	134	151.9 Å²	151.9	81%	0.812	78%	0.775	S	S	*	*			trans	-114.4	128.2	-170.7	173.6	0	0	0	0	109.3
142	E	28.3	Very low	31.9	Very low	189 Å²	189	149.3 Å²	149.3	88%	0.883	77%	0.767	S	S	*	*			trans	-77.3	146.6	168.5	-64.2	178.9	113.2	0	0	110.8
143	Q	29.2	Very low	31.4	Very low	161 Å²	161	147.6 Å²	147.6	75%	0.752	77%	0.765	S	S	*	*			trans	-163.1	140.5	161.9	-146.7	169.9	42.6	0	0	111.7	Y145	Q143-Y145 HydrophobicContact CG-CE1 4.49Å
144	D	31.5	Very low	30.7	Very low	125 Å²	125	146.5 Å²	146.5	67%	0.668	76%	0.76	S	S	*	*			cis	-167.2	-156.3	-37.5	-153.5	-30.7	0	0	0	107.7
145	Y	30.2	Very low	30.2	Very low	183 Å²	183	141.3 Å²	141.3	72%	0.718	75%	0.75	S	S	*	*			trans	80.7	120.3	166	-22.9	-59.1	0	0	0	114.8	Q143	Q143-Y145 HydrophobicContact CG-CE1 4.49Å
146	K	33.3	Very low	29.9	Very low	162 Å²	162	138 Å²	138	70%	0.704	75%	0.746	S	S	*	*			cis	-158.9	179.3	-5.5	-140.1	-146.3	147.3	-162.8	0	106.4	D148	K146-D148 VanDerWaalsContact CE-OD1 3.3Å; K146-D148 WeakPolarHBondContact CE-OD1 3.41Å; K146-D148 IonicContact NZ-OD1 2.68Å; K146-D148 PolarHBondContact NZ-OD1 2.83Å; K146-D148 IonicContact NZ-OD2 2.65Å; K146-D148 PolarHBondContact NZ-OD2 2.8Å
147	A	31.3	Very low	29.7	Very low	70 Å²	70	138.9 Å²	138.9	58%	0.579	75%	0.746	S	S	*	*			cis	-163.9	171.6	20.3	0	0	0	0	0	113.6
148	D	28.2	Very low	29.6	Very low	112 Å²	112	135.4 Å²	135.4	60%	0.599	75%	0.748	S	S	*	*			trans	34.6	129.1	138.2	-51.7	-21.4	0	0	0	120.1	K146	K146-D148 VanDerWaalsContact CE-OD1 3.3Å; K146-D148 WeakPolarHBondContact CE-OD1 3.41Å; K146-D148 IonicContact NZ-OD1 2.68Å; K146-D148 PolarHBondContact NZ-OD1 2.83Å; K146-D148 IonicContact NZ-OD2 2.65Å; K146-D148 PolarHBondContact NZ-OD2 2.8Å
149	T	29.6	Very low	29.4	Very low	121 Å²	121	131.5 Å²	131.5	74%	0.742	74%	0.743	S	S	*	*			cis	-172.3	163.3	3.5	13.6	0	0	0	0	108.3
150	D	28.2	Very low	29	Very low	117 Å²	117	131.1 Å²	131.1	63%	0.626	73%	0.734	S	S	*	*			cis	-164.9	177.7	-14.9	-152	-25.6	0	0	0	108.8
151	F	27.6	Very low	28.7	Very low	178 Å²	178	135.3 Å²	135.3	78%	0.781	73%	0.734	S	S	*	*			trans	53.3	127.2	163	-55.8	-61.5	0	0	0	120.6
152	G	27.1	Very low	28.4	Very low	65 Å²	65	134.9 Å²	134.9	67%	0.67	73%	0.732	S	S	*	*			cis	148.1	164.4	-10.1	0	0	0	0	0	114.5
153	I	32.1	Very low	28.2	Very low	151 Å²	151	131.3 Å²	131.3	77%	0.774	73%	0.726	S	S	*	*			trans	73.2	129.4	153.8	-62.7	169.6	0	0	0	115.9
154	N	28.3	Very low	28.6	Very low	134 Å²	134	128.9 Å²	128.9	72%	0.717	72%	0.724	S	S	*	*			cis	-158.7	153.1	4.9	-121.8	-5.9	0	0	0	113.3
155	N	26.5	Very low	28.3	Very low	135 Å²	135	132.5 Å²	132.5	72%	0.722	74%	0.735	S	S	*	*				24.4	151.6	128	-113.1	-23.8	0	0	0	121.5
156	V	29.6	Very low	28.2	Very low	129 Å²	129	128.5 Å²	128.5	78%	0.782	74%	0.739	S	S	*	*				-159.9	160.7	53.1	178.2	0	0	0	0	112.9
157	N	28.3	Very low	27.9	Very low	157 Å²	157	124.4 Å²	124.4	84%	0.84	74%	0.743	S	S	*	*			trans	-45.7	163.3	164.7	-67.8	-25.2	0	0	0	117.8
158	G	27.3	Very low	27.8	Very low	82 Å²	82	126 Å²	126	85%	0.845	75%	0.749	S	S	*	*			trans	178	137.8	153.6	0	0	0	0	0	113.6
159	D	25.2	Very low	27.8	Very low	146 Å²	146	128.5 Å²	128.5	78%	0.781	76%	0.763	S	S	*	*			trans	-132.7	156.9	-178.5	-172.7	25.8	0	0	0	112.2
160	L	25.8	Very low	27.6	Very low	129 Å²	129	126.3 Å²	126.3	68%	0.675	76%	0.764	S	S	*	*			trans	73.4	123.2	155.3	-129.6	72.4	0	0	0	122.7
161	H	25.8	Very low	27.6	Very low	162 Å²	162	130.8 Å²	130.8	75%	0.75	78%	0.779	S	S	*	*			trans	78.1	123.6	138.2	-97.3	-39	0	0	0	124.8
162	V	23.3	Very low	27.6	Very low	125 Å²	125	126.1 Å²	126.1	76%	0.758	77%	0.772	S	S	*	*			trans	86.4	145.3	143.7	-175.2	0	0	0	0	120.6
163	C	24.1	Very low	27.6	Very low	113 Å²	113	130 Å²	130	76%	0.764	78%	0.783	S	S	*	*			trans	-60.7	-176.8	176	-43.8	0	0	0	0	114.1
164	P	37.5	Very low	27.4	Very low	110 Å²	110	125.4 Å²	125.4	71%	0.714	77%	0.773	S	S	*	*			cis	-148.6	-177	14.7	44.7	-23.5	0	0	0	119.2
165	F	25.6	Very low	27.3	Very low	202 Å²	202	126.5 Å²	126.5	89%	0.886	79%	0.785	S	S	*	*			trans	36.2	125.4	147	-93.4	-92	0	0	0	122.2
166	A	27.5	Very low	27.2	Very low	98 Å²	98	123.7 Å²	123.7	81%	0.81	79%	0.788	S	S	*	*				158	143.2	99.9	0	0	0	0	0	116
167	G	26.1	Very low	27.1	Very low	76 Å²	76	121.2 Å²	121.2	78%	0.784	79%	0.789	S	S	*	*			trans	94	146.7	158.8	0	0	0	0	0	117.7
168	S	30.3	Very low	27.2	Very low	103 Å²	103	122.1 Å²	122.1	72%	0.72	79%	0.788	S	S	*	*			cis	-163.6	150.3	-6.4	-162.9	0	0	0	0	114.5
169	N	27	Very low	27.3	Very low	165 Å²	165	124.7 Å²	124.7	88%	0.882	78%	0.782	S	S	*	*			trans	64.6	139.6	159.3	-69.2	-24.3	0	0	0	121.7
170	G	27.1	Very low	27.4	Very low	75 Å²	75	125.4 Å²	125.4	77%	0.773	79%	0.786	S	S	*	*			trans	-151.1	-68.5	-176.7	0	0	0	0	0	117.3
171	K	28.3	Very low	27.6	Very low	212 Å²	212	124.4 Å²	124.4	92%	0.922	78%	0.781	S	S	*	*			trans	68.4	159.7	-166.5	-67.8	-177.2	174.8	179.7	0	115.4
172	A	27	Very low	28.1	Very low	79 Å²	79	124.3 Å²	124.3	65%	0.653	78%	0.779	S	S	*	*			cis	-174	158.5	-32.4	0	0	0	0	0	110.1
173	V	27.8	Very low	28.5	Very low	146 Å²	146	127.5 Å²	127.5	89%	0.885	78%	0.782	S	S	*	*			trans	69	139.2	169.6	-170.9	0	0	0	0	115.5
174	G	26.3	Very low	28.8	Very low	55 Å²	55	128.6 Å²	128.6	57%	0.567	78%	0.781	S	S	*	*			cis	146.7	149.6	-8.8	0	0	0	0	0	113.5
175	T	26.4	Very low	28.6	Very low	157 Å²	157	131.4 Å²	131.4	96%	0.963	79%	0.789	S	S	*	*			trans	62.4	147.6	179.9	21.3	0	0	0	0	115.7
176	G	24.8	Very low	28.9	Very low	77 Å²	77	130.4 Å²	130.4	79%	0.794	79%	0.787	S	S	*	*			cis	149.2	137.8	-6.7	0	0	0	0	0	112
177	G	27.5	Very low	29.1	Very low	77 Å²	77	133.5 Å²	133.5	79%	0.794	79%	0.791	S	S	*	*			trans	166	148.9	177.7	0	0	0	0	0	113.1
178	E	30	Very low	29.4	Very low	176 Å²	176	137 Å²	137	82%	0.822	79%	0.791	S	S	*	*			trans	-123.1	157.7	-170.1	-70.1	175	85.4	0	0	112.9
179	N	29	Very low	29.6	Very low	136 Å²	136	137.8 Å²	137.8	73%	0.727	79%	0.792	S	S	*	*			trans	37.2	132.1	149	-48.5	-25.9	0	0	0	120.9
180	D	29	Very low	29.8	Very low	160 Å²	160	137 Å²	137	86%	0.856	79%	0.787	S	S	*	*				-163.2	171.4	95	-131	-23.5	0	0	0	116.1
181	D	30.1	Very low	30	Very low	108 Å²	108	141.8 Å²	141.8	58%	0.578	79%	0.79	S	S	*	*			trans	-45.1	151	-167.6	-124.6	-9.7	0	0	0	124.2
182	K	34.7	Very low	30.2	Very low	161 Å²	161	140.6 Å²	140.6	70%	0.7	79%	0.788	S	S	*	*			trans	55.8	139.6	147.2	-73.9	161.8	-175	74.6	0	120
183	K	32.3	Very low	30.3	Very low	191 Å²	191	145.8 Å²	145.8	83%	0.83	80%	0.796	S	S	*	*			cis	-164.6	170.2	41.8	-146	177.1	-177	-170.9	0	112.9
184	D	31.1	Very low	30.4	Very low	137 Å²	137	150.8 Å²	150.8	73%	0.733	80%	0.799	S	S	*	*			trans	-77.9	146.1	-172	-34.2	-92.9	0	0	0	115.3
185	D	33.1	Very low	30.6	Very low	168 Å²	168	153 Å²	153	90%	0.898	80%	0.801	S	S	*	*				-173.3	152.6	106.3	-103.4	-28.8	0	0	0	111.3
186	E	32.2	Very low	30.6	Very low	181 Å²	181	154.9 Å²	154.9	85%	0.846	80%	0.798	S	S	*	*			trans	-89.1	153	-171.5	-62.5	-179.8	144.6	0	0	114.8
187	N	31.3	Very low	30.7	Very low	164 Å²	164	161 Å²	161	88%	0.877	80%	0.799	S	S	*	*			trans	-164.6	123.2	142.3	-109.2	-65.6	0	0	0	111.2
188	D	31.7	Very low	30.7	Very low	149 Å²	149	161.6 Å²	161.6	80%	0.797	80%	0.797	S	S	*	*			trans	-70.2	148.2	174.8	-94.2	-41	0	0	0	112.4
189	T	35.3	Very low	30.6	Very low	119 Å²	119	159 Å²	159	73%	0.73	79%	0.792	S	S	*	*			trans	-154	86.3	160.5	-40.6	0	0	0	0	111.1	Q191	T189-Q191 PolarHBondContact O-N 2.77Å
190	D	31.6	Very low	30.6	Very low	148 Å²	148	159.5 Å²	159.5	79%	0.791	79%	0.794	S	S	*	*			trans	-56.7	122	175.9	-87.1	-43.7	0	0	0	112.4
191	Q	30.9	Very low	30.6	Very low	176 Å²	176	159.6 Å²	159.6	82%	0.822	80%	0.795	S	S	*	*			trans	-110.3	73.9	171.4	-67.1	-169.5	12.1	0	0	110.7	T189 K193	T189-Q191 PolarHBondContact O-N 2.77Å; Q191-K193 PolarHBondContact O-N 2.95Å
192	E	31.6	Very low	30.9	Very low	188 Å²	188	162.4 Å²	162.4	88%	0.879	81%	0.805	S	S	*	*			trans	-67.4	103.3	174.4	-77.8	-128.6	122.5	0	0	111.9	R194	E192-R194 PolarHBondContact O-N 2.81Å; E192-R194 VanDerWaalsContact O-N 3.15Å
193	K	30.7	Very low	30.7	Very low	188 Å²	188	163.1 Å²	163.1	82%	0.817	82%	0.815	S	S	*	*			trans	-71.3	93.2	-174.4	178.3	-174.5	178.5	179.9	0	112.3	Q191 V195	Q191-K193 PolarHBondContact O-N 2.95Å; K193-V195 HydrophobicContact CG-CG2 4.37Å; K193-V195 PolarHBondContact O-N 2.83Å
194	R	29.5	Very low	30.8	Very low	251 Å²	251	161.8 Å²	161.8	95%	0.947	81%	0.812	S	S	*	*			trans	-81	106.2	174.1	-144.8	175.5	-158.2	-175	6	111.8	E192	E192-R194 PolarHBondContact O-N 2.81Å; E192-R194 VanDerWaalsContact O-N 3.15Å
195	V	28.9	Very low	30.7	Very low	102 Å²	102	163.4 Å²	163.4	62%	0.618	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-86.3	120.8	172.6	176.6	0	0	0	0	108.5	K193	K193-V195 HydrophobicContact CG-CG2 4.37Å; K193-V195 PolarHBondContact O-N 2.83Å
196	E	26.7	Very low	30.3	Very low	195 Å²	195	162.9 Å²	162.9	91%	0.911	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-95.7	121.2	174.9	-165.1	158.2	-119.8	0	0	109.6
197	Y	26.5	Very low	30.1	Very low	205 Å²	205	160.7 Å²	160.7	80%	0.804	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-86.3	119.6	-175.7	-121.6	-94.1	0	0	0	110
198	A	28.9	Very low	30	Very low	91 Å²	91	158.2 Å²	158.2	75%	0.752	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-74.8	127	165.8	0	0	0	0	0	109.4
199	V	28.1	Very low	29.8	Very low	120 Å²	120	158 Å²	158	73%	0.727	80%	0.795	S	S	*	*			trans	-111.7	120.5	164.7	-179.8	0	0	0	0	107
200	L	28.8	Very low	29.4	Very low	147 Å²	147	159.5 Å²	159.5	77%	0.77	80%	0.798	S	S	*	*			trans	-90.8	127.5	170.7	-66	166.2	0	0	0	107.7
201	D	29.6	Very low	29.3	Very low	162 Å²	162	159.4 Å²	159.4	87%	0.866	80%	0.795	S	S	*	*			trans	-108.9	96	159.8	-80.9	-29.9	0	0	0	107.8
202	E	34.5	Very low	29.3	Very low	167 Å²	167	158.2 Å²	158.2	78%	0.78	79%	0.789	S	S	*	*			trans	-95.1	122.3	160.3	-66.3	-177.9	144.8	0	0	107.9
203	L	30.9	Very low	29.2	Very low	177 Å²	177	156 Å²	156	93%	0.927	78%	0.782	S	S	*	*			trans	-159.5	151	137.7	-135.4	69.5	0	0	0	111.8
204	E	35.1	Very low	29.2	Very low	162 Å²	162	153.6 Å²	153.6	76%	0.757	78%	0.778	S	S	*	*			trans	-83.1	165.9	171.3	-59.1	170.1	116.8	0	0	110.2
205	D	27.8	Very low	29.3	Very low	171 Å²	171	150.8 Å²	150.8	91%	0.914	78%	0.776	S	S	*	*			trans	-150.1	149.2	141.6	-132.3	-23.7	0	0	0	111.5
206	F	26	Very low	29.4	Very low	157 Å²	157	154.4 Å²	154.4	69%	0.689	79%	0.786	S	S	*	*			trans	-122.3	139.2	-169.2	-122.3	-98.1	0	0	0	109.8
207	T	27.8	Very low	29.3	Very low	135 Å²	135	148 Å²	148	83%	0.828	77%	0.772	S	S	*	*			trans	171.3	113.6	132.3	29.7	0	0	0	0	115
208	D	29.9	Very low	29.2	Very low	113 Å²	113	142.3 Å²	142.3	60%	0.604	78%	0.776	S	S	*	*				43.3	105.5	122.6	-67.8	-74.9	0	0	0	125.5
209	N	27.3	Very low	29	Very low	143 Å²	143	142.1 Å²	142.1	77%	0.765	78%	0.783	S	S	*	*				79.6	166.2	107.2	-86.9	-53.1	0	0	0	125.1
210	L	25.3	Very low	28.8	Very low	152 Å²	152	145 Å²	145	80%	0.796	79%	0.786	S	S	*	*			trans	73.5	133.6	-176.5	-99.4	66.9	0	0	0	115.9
211	M	29.5	Very low	28.8	Very low	146 Å²	146	144.9 Å²	144.9	72%	0.719	79%	0.791	S	S	*	*			cis	-136.4	142.7	5.2	-83.5	-178.9	73.9	0	0	109.4
212	E	31	Very low	28.9	Very low	150 Å²	150	141.9 Å²	141.9	70%	0.701	78%	0.783	S	S	*	*				57.5	136.7	86	-67.9	-177.4	167.6	0	0	115.2
213	I	30.9	Very low	28.6	Very low	141 Å²	141	143.9 Å²	143.9	72%	0.723	79%	0.789	S	S	*	*			cis	-153.2	178.6	15.6	-122.5	157.3	0	0	0	112.7
214	D	29.2	Very low	28.4	Very low	139 Å²	139	140.1 Å²	140.1	74%	0.743	78%	0.784	S	S	*	*			trans	-60.5	-171.7	-175.8	-47.8	-81.8	0	0	0	117
215	E	31.8	Very low	28	Very low	192 Å²	192	140.5 Å²	140.5	90%	0.897	79%	0.789	S	S	*	*			cis	-147.5	-170.3	17.6	-73.8	-173.6	96.1	0	0	110.2
216	E	30.8	Very low	28	Very low	177 Å²	177	137.9 Å²	137.9	83%	0.827	78%	0.779	S	S	*	*				-162.4	156.2	-69	-144.7	-55.2	87	0	0	108.3
217	G	26.3	Very low	28.1	Very low	60 Å²	60	139.2 Å²	139.2	62%	0.619	79%	0.787	S	S	*	*			trans	83.9	146.5	161.1	0	0	0	0	0	117
218	G	24.6	Very low	28.2	Very low	86 Å²	86	143.4 Å²	143.4	89%	0.887	79%	0.788	S	S	*	*			cis	168.7	125.1	-7.6	0	0	0	0	0	111.1
219	G	24.7	Very low	28.1	Very low	87 Å²	87	145.3 Å²	145.3	90%	0.897	80%	0.798	S	S	*	*			trans	-177.3	133.6	-178.4	0	0	0	0	0	114.8
220	F	23.1	Very low	28.5	Very low	182 Å²	182	147.8 Å²	147.8	80%	0.798	80%	0.802	S	S	*	*			trans	-117.5	141.7	-167	-167.1	-92.9	0	0	0	112.4
221	T	28.4	Very low	28.6	Very low	143 Å²	143	146.8 Å²	146.8	88%	0.877	80%	0.802	S	S	*	*			trans	-178.1	146.4	140.7	20	0	0	0	0	112
222	S	31.8	Very low	28.9	Very low	99 Å²	99	147.5 Å²	147.5	69%	0.692	81%	0.809	S	S	*	*			trans	-112.6	142.2	-179.4	-44.8	0	0	0	0	111.9
223	K	29.3	Very low	29.3	Very low	210 Å²	210	147.6 Å²	147.6	91%	0.913	81%	0.809	S	S	*	*			trans	-154.6	135.5	165	-114.8	165.2	-172.3	173.5	0	114.5
224	A	26.9	Very low	29.4	Very low	98 Å²	98	150.2 Å²	150.2	81%	0.81	82%	0.818	S	S	*	*			trans	14.1	130	162.2	0	0	0	0	0	121.8
225	I	26.6	Very low	29.7	Very low	169 Å²	169	147.4 Å²	147.4	87%	0.867	81%	0.806	S	S	*	*			trans	-83	121.2	169	-60.8	163.9	0	0	0	110.8
226	V	27.5	Very low	29.8	Very low	116 Å²	116	146 Å²	146	70%	0.703	80%	0.804	S	S	*	*			trans	-148.9	101.9	154.5	-173.7	0	0	0	0	112.1
227	Q	27.3	Very low	29.8	Very low	185 Å²	185	144.8 Å²	144.8	86%	0.864	80%	0.803	S	S	*	*			trans	-138.5	134.2	152.8	-71.2	177.5	-20.8	0	0	105.2
228	R	29.1	Very low	30	Very low	224 Å²	224	149.2 Å²	149.2	85%	0.845	80%	0.802	S	S	*	*			cis	70.9	80.6	31.2	-77.9	-162.3	169.2	97.8	-0.8	116
229	D	27.9	Very low	30.5	Very low	153 Å²	153	149.2 Å²	149.2	82%	0.818	79%	0.789	S	S	*	*			trans	56.7	124.3	144.1	-87.8	-23.6	0	0	0	123.2
230	K	35.6	Very low	31.2	Very low	195 Å²	195	152.1 Å²	152.1	85%	0.848	77%	0.774	S	S	*	*			trans	72.2	167.6	142	-85.8	-173.7	173.1	-177.2	0	121.1
231	V	28.8	Very low	32.4	Very low	130 Å²	130	149.9 Å²	149.9	79%	0.788	77%	0.766	S	S	*	*			trans	76.7	99.9	-170	-169.7	0	0	0	0	110.8
232	D	36.1	Very low	33.1	Very low	162 Å²	162	145.7 Å²	145.7	87%	0.866	74%	0.738	S	S	*	*				75.8	80.8	55.3	-155.8	26.9	0	0	0	111.4
233	E	38.1	Very low	33.6	Very low	152 Å²	152	142.9 Å²	142.9	71%	0.71	72%	0.715	S	S	*	*			trans	-158.5	94.1	-171.7	-128.4	-68.1	116.9	0	0	108.8
234	E	33.1	Very low	34.4	Very low	195 Å²	195	136.7 Å²	136.7	91%	0.911	69%	0.688	S	S	*	*			trans	-151.6	48.6	165.8	-143.8	172.8	-129.8	0	0	110.6	L236	E234-L236 VanDerWaalsContact C-N 3.32Å; E234-L236 PolarHBondContact O-N 2.91Å
235	T	35.9	Very low	35.6	Very low	81 Å²	81	132.8 Å²	132.8	50%	0.497	65%	0.654	S	S	.	*			trans	-93.1	26.4	-165.1	-47.8	0	0	0	0	113	Y238	T235-Y238 HydrophobicContact CG2-CE2 3.92Å
236	L	33.3	Very low	36.7	Very low	161 Å²	161	129 Å²	129	84%	0.843	64%	0.635	S	S	*	*			trans	-128.3	67.2	-173.3	-80.7	175.4	0	0	0	114.3	E234	E234-L236 VanDerWaalsContact C-N 3.32Å; E234-L236 PolarHBondContact O-N 2.91Å
237	N	31.2	Very low	37.9	Very low	153 Å²	153	128.5 Å²	128.5	82%	0.818	63%	0.629	S	S	*	*			trans	-151.7	62	147.6	-162.3	94.8	0	0	0	110
238	Y	30.7	Very low	39.3	Very low	152 Å²	152	120.1 Å²	120.1	60%	0.596	59%	0.59	S	S	*	*			trans	-67.8	129.3	-179.1	-99.1	-84.1	0	0	0	112.2	T235 Y240	T235-Y238 HydrophobicContact CG2-CE2 3.92Å; Y238-Y240 VanDerWaalsContact C-N 3.32Å; Y238-Y240 PolarHBondContact O-N 3.36Å
239	S	34.9	Very low	40.6	Very low	86 Å²	86	112.5 Å²	112.5	60%	0.601	57%	0.567	S	S	*	*			trans	-84.7	84.5	157.2	-171.2	0	0	0	0	106.9	E241	S239-E241 VanDerWaalsContact C-N 3.3Å; S239-E241 PolarHBondContact O-N 2.96Å
240	Y	40.7	Very low	42	Very low	149 Å²	149	108 Å²	108	58%	0.584	55%	0.551	S	S	*	*	H	α-helix	trans	-60.3	-35.7	-162.5	-167.8	-103.2	0	0	0	113.8	Y238 F244	Y238-Y240 VanDerWaalsContact C-N 3.32Å; Y238-Y240 PolarHBondContact O-N 3.36Å; Y240-F244 WeakPolarHBondContact O-CB 3.47Å; Y240-F244 PolarHBondContact O-N 3.08Å
241	E	46.5	Very low	43.2	Very low	134 Å²	134	102.8 Å²	102.8	63%	0.626	53%	0.532	S	S	*	.	H	α-helix	trans	-66.5	-49.8	-173.2	-58.1	-63.5	119.4	0	0	114.5	S239 D245	S239-E241 VanDerWaalsContact C-N 3.3Å; S239-E241 PolarHBondContact O-N 2.96Å; E241-D245 PolarHBondContact O-N 3.05Å
242	D	43.9	Very low	44.5	Very low	56 Å²	56	98.1 Å²	98.1	30%	0.299	50%	0.502	S	S	.	.	H	α-helix	trans	-88.2	-17.3	-164.2	-167.6	65.3	0	0	0	113.8	N246 R466	D242-N246 PolarHBondContact O-ND2 3.2Å; D242-R466 IonicContact OD2-CZ 3.25Å; D242-R466 IonicContact OD2-NH1 3.82Å; D242-R466 PolarHBondContact OD2-NH1 3.32Å; D242-R466 IonicContact OD2-NH2 2.81Å; D242-R466 PolarHBondContact OD2-NH2 3.32Å
243	D	42.9	Very low	45.4	Very low	39 Å²	39	97.4 Å²	97.4	21%	0.209	49%	0.493	C	S	.	.	H	α-helix	trans	-86.7	-39.8	169.4	-71.6	-24.4	0	0	0	110.8	D245 N246 D247 R466	D243-D245 PolarHBondContact O-N 3.13Å; D243-N246 PolarHBondContact O-N 3.04Å; D243-D247 PolarHBondContact O-N 3.1Å; D243-D247 VanDerWaalsContact O-N 3.15Å; D243-R466 IonicContact OD1-CZ 2.71Å; D243-R466 IonicContact OD1-NE 2.67Å; D243-R466 PolarHBondContact OD1-NE 3.32Å; D243-R466 IonicContact OD1-NH2 2.97Å; D243-R466 PolarHBondContact OD1-NH2 3.39Å
244	F	46.3	Very low	46.1	Very low	80 Å²	80	98 Å²	98	35%	0.351	50%	0.496	S	S	.	.	H	α-helix	trans	-59.1	-42.2	177	-178	-91.9	0	0	0	112.9	Y240 N246 D247 V248 I310	Y240-F244 WeakPolarHBondContact O-CB 3.47Å; Y240-F244 PolarHBondContact O-N 3.08Å; F244-N246 PolarHBondContact O-N 3.43Å; F244-D247 PolarHBondContact O-N 3.03Å; F244-V248 HydrophobicContact CD1-CG2 4.15Å; F244-V248 HydrophobicContact CE1-CG2 3.87Å; F244-V248 HydrophobicContact CZ-CG2 4.3Å; F244-V248 WeakPolarHBondContact O-CG2 3.42Å; F244-V248 PolarHBondContact O-N 2.82Å; F244-I310 HydrophobicContact CZ-CG2 4.41Å
245	D	52	Low	46.5	Very low	17 Å²	17	91.9 Å²	91.9	9%	0.091	49%	0.486	C	S	.	.	H	α-helix	trans	-63.5	-22.8	179	-145.5	17.8	0	0	0	111.8	E241 D243 K291 T312 R343	E241-D245 PolarHBondContact O-N 3.05Å; D243-D245 PolarHBondContact O-N 3.13Å; D245-K291 IonicContact OD2-NZ 3.15Å; D245-T312 PolarHBondContact OD1-OG1 3.47Å; D245-R343 PolarHBondContact O-NH2 3Å; D245-R343 IonicContact OD1-CZ 3.08Å; D245-R343 VanDerWaalsContact OD1-CZ 3.32Å; D245-R343 IonicContact OD1-NH1 3.32Å; D245-R343 PolarHBondContact OD1-NH1 3.08Å; D245-R343 IonicContact OD1-NH2 3.66Å; D245-R343 PolarHBondContact OD1-NH2 2.84Å; D245-R343 IonicContact OD2-CZ 2.69Å; D245-R343 IonicContact OD2-NH1 3.86Å; D245-R343 PolarHBondContact OD2-NH1 3.07Å; D245-R343 IonicContact OD2-NH2 2.65Å
246	N	49.1	Very low	46.8	Very low	88 Å²	88	91.9 Å²	91.9	47%	0.471	48%	0.482	S	S	.	.	H	α-helix	trans	-87.1	-38.4	175.6	-74.8	-85.4	0	0	0	113.2	D242 D243 F244 V248 D249 A250	D242-N246 PolarHBondContact O-ND2 3.2Å; D243-N246 PolarHBondContact O-N 3.04Å; F244-N246 PolarHBondContact O-N 3.43Å; N246-V248 PolarHBondContact O-N 2.96Å; N246-D249 PolarHBondContact O-N 3.15Å; N246-D249 VanDerWaalsContact O-N 3.13Å; N246-A250 PolarHBondContact O-N 2.99Å; N246-A250 VanDerWaalsContact O-N 3.17Å
247	D	52.3	Low	46.9	Very low	106 Å²	106	96.1 Å²	96.1	57%	0.567	49%	0.487	S	S	*	.	H	α-helix	trans	-63.5	-33.9	173.6	-73.7	-23.9	0	0	0	111.1	D243 F244 A250 L251	D243-D247 PolarHBondContact O-N 3.1Å; D243-D247 VanDerWaalsContact O-N 3.15Å; F244-D247 PolarHBondContact O-N 3.03Å; D247-A250 PolarHBondContact O-N 3.45Å; D247-L251 WeakPolarHBondContact O-CB 3.49Å; D247-L251 WeakPolarHBondContact O-CG 3.43Å; D247-L251 PolarHBondContact O-N 2.74Å
248	V	56.7	Low	46.9	Very low	9 Å²	9	92.8 Å²	92.8	6%	0.055	48%	0.48	C	S	.	.	H	α-helix	trans	-57.9	-50	168.1	163.2	0	0	0	0	111.8	F244 N246 A250 L251 L252 I310	F244-V248 HydrophobicContact CD1-CG2 4.15Å; F244-V248 HydrophobicContact CE1-CG2 3.87Å; F244-V248 HydrophobicContact CZ-CG2 4.3Å; F244-V248 WeakPolarHBondContact O-CG2 3.42Å; F244-V248 PolarHBondContact O-N 2.82Å; N246-V248 PolarHBondContact O-N 2.96Å; V248-A250 VanDerWaalsContact C-N 3.3Å; V248-A250 PolarHBondContact O-N 3.1Å; V248-L251 PolarHBondContact O-N 2.71Å; V248-L252 HydrophobicContact CG1-CD1 3.81Å; V248-L252 HydrophobicContact CG1-CG 4.32Å; V248-L252 WeakPolarHBondContact O-CB 3.36Å; V248-L252 VanDerWaalsContact O-CG 3.26Å; V248-L252 WeakPolarHBondContact O-CG 3.5Å; V248-L252 PolarHBondContact O-N 3.19Å; V248-I310 HydrophobicContact CB-CD1 4.37Å; V248-I310 HydrophobicContact CG1-CD1 3.59Å; V248-I310 HydrophobicContact CG2-CD1 3.86Å
249	D	56.3	Low	47	Very low	65 Å²	65	91.1 Å²	91.1	35%	0.348	49%	0.488	S	S	.	.	H	α-helix	trans	-60.7	-39.7	-178.3	-85.1	8.6	0	0	0	111.6	N246 L252 E253 R343	N246-D249 PolarHBondContact O-N 3.15Å; N246-D249 VanDerWaalsContact O-N 3.13Å; D249-L252 PolarHBondContact O-N 3.37Å; D249-E253 PolarHBondContact O-N 3.26Å; D249-E253 VanDerWaalsContact O-N 3.1Å; D249-R343 IonicContact OD1-CZ 3.57Å; D249-R343 VanDerWaalsContact OD1-CZ 3.25Å; D249-R343 IonicContact OD1-NE 2.77Å; D249-R343 PolarHBondContact OD1-NE 2.8Å; D249-R343 IonicContact OD1-NH2 3.79Å; D249-R343 PolarHBondContact OD1-NH2 3.06Å; D249-R343 IonicContact OD2-CZ 3.34Å; D249-R343 IonicContact OD2-NE 3.22Å; D249-R343 PolarHBondContact OD2-NE 2.68Å; D249-R343 VanDerWaalsContact OD2-NE 3.15Å; D249-R343 IonicContact OD2-NH2 2.64Å
250	A	58.2	Low	46.9	Very low	59 Å²	59	97 Å²	97	49%	0.488	50%	0.503	S	S	.	.	H	α-helix	trans	-64.6	-47.3	175.7	0	0	0	0	0	112.8	N246 D247 V248 L252 E253 E254	N246-A250 PolarHBondContact O-N 2.99Å; N246-A250 VanDerWaalsContact O-N 3.17Å; D247-A250 PolarHBondContact O-N 3.45Å; V248-A250 VanDerWaalsContact C-N 3.3Å; V248-A250 PolarHBondContact O-N 3.1Å; A250-L252 PolarHBondContact O-N 2.82Å; A250-E253 PolarHBondContact O-N 3.18Å; A250-E253 VanDerWaalsContact O-N 3.16Å; A250-E254 PolarHBondContact O-N 3.34Å; A250-E254 VanDerWaalsContact O-N 3.1Å
251	L	59.8	Low	46.6	Very low	85 Å²	85	96.4 Å²	96.4	45%	0.445	52%	0.515	S	S	.	.	H	α-helix	trans	-66.3	-19.2	177.9	-72.7	168	0	0	0	113.6	D247 V248	D247-L251 WeakPolarHBondContact O-CB 3.49Å; D247-L251 WeakPolarHBondContact O-CG 3.43Å; D247-L251 PolarHBondContact O-N 2.74Å; V248-L251 PolarHBondContact O-N 2.71Å
252	L	57.3	Low	45.8	Very low	31 Å²	31	101.6 Å²	101.6	16%	0.162	53%	0.529	C	S	.	.	H	α-helix	trans	-89.3	-25.1	173.8	-67	-178.6	0	0	0	113.1	V248 D249 A250 L322 I342	V248-L252 HydrophobicContact CG1-CD1 3.81Å; V248-L252 HydrophobicContact CG1-CG 4.32Å; V248-L252 WeakPolarHBondContact O-CB 3.36Å; V248-L252 VanDerWaalsContact O-CG 3.26Å; V248-L252 WeakPolarHBondContact O-CG 3.5Å; V248-L252 PolarHBondContact O-N 3.19Å; D249-L252 PolarHBondContact O-N 3.37Å; A250-L252 PolarHBondContact O-N 2.82Å; L252-L322 HydrophobicContact CD1-CD2 3.74Å; L252-L322 HydrophobicContact CD2-CD2 3.85Å; L252-L322 HydrophobicContact CG-CD2 4.46Å; L252-I342 HydrophobicContact CD1-CG2 3.97Å
253	E	55.4	Low	45.2	Very low	147 Å²	147	110.7 Å²	110.7	69%	0.687	56%	0.559	S	S	*	*	H	α-helix	trans	-79.5	-33.6	174.6	-168.4	155.5	-129.5	0	0	112	D249 A250 G255 L256	D249-E253 PolarHBondContact O-N 3.26Å; D249-E253 VanDerWaalsContact O-N 3.1Å; A250-E253 PolarHBondContact O-N 3.18Å; A250-E253 VanDerWaalsContact O-N 3.16Å; E253-G255 PolarHBondContact O-N 2.85Å; E253-L256 WeakPolarHBondContact O-CB 3.34Å; E253-L256 PolarHBondContact O-N 2.85Å
254	E	51.5	Low	44.6	Very low	165 Å²	165	117.1 Å²	117.1	77%	0.771	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.7	-23.9	175.3	-171.8	164	-156.6	0	0	113.4	A250 L256	A250-E254 PolarHBondContact O-N 3.34Å; A250-E254 VanDerWaalsContact O-N 3.1Å; E254-L256 PolarHBondContact O-N 3.35Å
255	G	41.1	Very low	43.9	Very low	67 Å²	67	121.6 Å²	121.6	69%	0.691	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.6	-10.8	171.8	0	0	0	0	0	114.9	E253	E253-G255 PolarHBondContact O-N 2.85Å
256	L	43.5	Very low	42.8	Very low	81 Å²	81	128.2 Å²	128.2	42%	0.424	65%	0.65	S	S	.	*	S	Bend	trans	-98.9	107.1	-176	-62.2	174.9	0	0	0	111.3	E253 E254 A258 T339	E253-L256 WeakPolarHBondContact O-CB 3.34Å; E253-L256 PolarHBondContact O-N 2.85Å; E254-L256 PolarHBondContact O-N 3.35Å; L256-A258 PolarHBondContact O-N 2.89Å; L256-T339 HydrophobicContact CD2-CG2 4.27Å
257	R	34.3	Very low	42.1	Very low	250 Å²	250	131 Å²	131	94%	0.943	66%	0.66	S	S	*	*			trans	-64.4	99.8	167.3	-74.8	-172.8	176.5	-174.8	0	110.1
258	A	32.2	Very low	41.4	Very low	82 Å²	82	134 Å²	134	68%	0.678	67%	0.668	S	S	*	*			trans	-53.5	132.1	-179.2	0	0	0	0	0	112.7	L256 K260	L256-A258 PolarHBondContact O-N 2.89Å; A258-K260 PolarHBondContact O-N 3.07Å
259	P	32.3	Very low	40.1	Very low	118 Å²	118	145.3 Å²	145.3	77%	0.766	71%	0.712	S	S	*	*			trans	-61.3	125.2	172.3	-22.5	33.8	0	0	0	111.1	T261	P259-T261 PolarHBondContact O-N 3.27Å
260	K	33.3	Very low	38.9	Very low	208 Å²	208	145.8 Å²	145.8	90%	0.904	73%	0.732	S	S	*	*			trans	-72.3	89.4	-179.3	-67.9	-177.9	178.7	-179.7	0	111.5	A258	A258-K260 PolarHBondContact O-N 3.07Å
261	T	33.2	Very low	37.4	Very low	137 Å²	137	146.9 Å²	146.9	84%	0.84	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-69	136.4	162	47.9	0	0	0	0	109.7	P259	P259-T261 PolarHBondContact O-N 3.27Å
262	R	29.7	Very low	36.4	Very low	243 Å²	243	152.5 Å²	152.5	92%	0.917	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-76.1	138.1	-179	-73	178.8	169.9	176.5	-4.6	110.3
263	R	32.2	Very low	35.2	Very low	247 Å²	247	156.1 Å²	156.1	93%	0.932	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-67.7	149.8	157.9	-73.7	179.8	172.8	166.3	-3.4	109.4
264	L	30.7	Very low	34.5	Very low	175 Å²	175	156.6 Å²	156.6	92%	0.916	81%	0.808	S	S	*	*			trans	-129.5	152.6	157	-146.9	75.7	0	0	0	107.8
265	E	31.5	Very low	33.7	Very low	174 Å²	174	156.5 Å²	156.5	81%	0.813	81%	0.807	S	S	*	*			trans	-89.5	159.3	-172.9	-69.6	168	104	0	0	112.7
266	N	28.6	Very low	33.9	Very low	156 Å²	156	162.7 Å²	162.7	83%	0.834	82%	0.818	S	S	*	*				-164.8	138.6	116.3	-101.1	1.6	0	0	0	113.8
267	E	34.4	Very low	33.3	Very low	145 Å²	145	163.8 Å²	163.8	68%	0.678	83%	0.832	S	S	*	*			trans	8.8	121.5	152.3	-57.5	-136.5	103.1	0	0	119.7
268	K	36.2	Very low	33.6	Very low	170 Å²	170	160.1 Å²	160.1	74%	0.739	83%	0.832	S	S	*	*				68.2	107.2	77.6	-71.9	-175.3	-162.6	144	0	115.4
269	Y	30.9	Very low	33.5	Very low	247 Å²	247	159.2 Å²	159.2	97%	0.969	83%	0.83	S	S	*	*			trans	-179.9	148	135.4	-96.1	-75.3	0	0	0	104.5
270	G	30.2	Very low	33.8	Very low	75 Å²	75	162.1 Å²	162.1	77%	0.773	83%	0.833	S	S	*	*			cis	139.4	84.9	0.8	0	0	0	0	0	110.2
271	G	28.1	Very low	34	Very low	82 Å²	82	158 Å²	158	85%	0.845	83%	0.826	S	S	*	*			trans	171	128.6	178.6	0	0	0	0	0	113.4
272	E	37.6	Very low	34.1	Very low	203 Å²	203	156.5 Å²	156.5	95%	0.949	82%	0.821	S	S	*	*			trans	-86.3	141.4	169.1	-61.6	172.6	140.6	0	0	109.3
273	S	33	Very low	34.7	Very low	106 Å²	106	150.2 Å²	150.2	74%	0.741	81%	0.809	S	S	*	*			trans	-160.8	121.1	165.8	-169.7	0	0	0	0	110.9
274	D	39.9	Very low	35.3	Very low	157 Å²	157	144.5 Å²	144.5	84%	0.84	79%	0.793	S	S	*	*			trans	-84.3	107.7	173.7	-115.2	-34.8	0	0	0	109.7
275	H	35.6	Very low	36.1	Very low	163 Å²	163	141.9 Å²	141.9	76%	0.755	79%	0.787	S	S	*	*			trans	-141.9	113.9	160.3	-84.7	-50.6	0	0	0	111.8
276	Q	43.5	Very low	37.3	Very low	197 Å²	197	136.3 Å²	136.3	92%	0.921	76%	0.761	S	S	*	*			trans	-70.4	122.3	157.2	-65.5	174.6	-5.3	0	0	108.2
277	S	31.6	Very low	38.8	Very low	104 Å²	104	134.4 Å²	134.4	73%	0.727	75%	0.749	S	S	*	*			trans	-136.6	132.9	170.3	61.5	0	0	0	0	109.1	G279	S277-G279 PolarHBondContact O-N 3.16Å
278	D	40.7	Very low	40.6	Very low	174 Å²	174	131.7 Å²	131.7	93%	0.93	74%	0.742	S	S	*	*			trans	-59.2	100.5	-179.6	-80.2	-63.7	0	0	0	112	E280	D278-E280 VanDerWaalsContact C-N 3.26Å; D278-E280 PolarHBondContact O-N 3.25Å
279	G	30.1	Very low	42.4	Very low	62 Å²	62	129.4 Å²	129.4	64%	0.639	73%	0.732	S	S	*	*			trans	-78.1	75.4	170.3	0	0	0	0	0	110.4	S277 T281	S277-G279 PolarHBondContact O-N 3.16Å; G279-T281 PolarHBondContact O-N 3.37Å; G279-T281 PolarHBondContact O-OG1 3.35Å
280	E	39.1	Very low	44.7	Very low	179 Å²	179	122.8 Å²	122.8	84%	0.836	71%	0.713	S	S	*	*			trans	-47.1	111.8	169.2	-177.5	179.9	-164.8	0	0	108.4	D278 S282	D278-E280 VanDerWaalsContact C-N 3.26Å; D278-E280 PolarHBondContact O-N 3.25Å; E280-S282 VanDerWaalsContact C-N 3.26Å; E280-S282 PolarHBondContact O-N 3Å
281	T	36.1	Very low	47.1	Very low	123 Å²	123	122.5 Å²	122.5	76%	0.755	69%	0.69	S	S	*	*			trans	-78.1	85.2	-168.8	-50.6	0	0	0	0	108.7	G279 V283	G279-T281 PolarHBondContact O-N 3.37Å; G279-T281 PolarHBondContact O-OG1 3.35Å; T281-V283 PolarHBondContact O-N 2.95Å
282	S	37.1	Very low	49.7	Very low	105 Å²	105	121.3 Å²	121.3	73%	0.734	67%	0.666	S	S	*	*			trans	-65.4	79.1	177.5	44.8	0	0	0	0	110.6	E280 Q284	E280-S282 VanDerWaalsContact C-N 3.26Å; E280-S282 PolarHBondContact O-N 3Å; S282-Q284 PolarHBondContact O-N 2.84Å
283	V	40.9	Very low	51.9	Low	111 Å²	111	112.9 Å²	112.9	67%	0.673	63%	0.629	S	S	*	*			trans	-58.9	101.6	172.9	-179.4	0	0	0	0	107.7	T281	T281-V283 PolarHBondContact O-N 2.95Å
284	Q	45.1	Very low	54.5	Low	126 Å²	126	110.4 Å²	110.4	59%	0.589	61%	0.607	S	S	*	*			trans	-54.5	139.6	178.4	-73.7	-168.6	-21.5	0	0	110.1	S282 M286	S282-Q284 PolarHBondContact O-N 2.84Å; Q284-M286 PolarHBondContact O-N 3.44Å
285	P	47.9	Very low	56.8	Low	120 Å²	120	107.7 Å²	107.7	78%	0.779	59%	0.588	S	S	*	*			trans	-58.1	118.7	-170.9	20.2	-31.9	0	0	0	111.9	M287	P285-M287 PolarHBondContact O-N 2.8Å; P285-M287 VanDerWaalsContact O-N 3.15Å
286	M	56.9	Low	58.9	Low	57 Å²	57	105.2 Å²	105.2	28%	0.281	59%	0.589	S	S	.	*			trans	-39.1	109.1	170.8	178.2	174.6	166.8	0	0	112	Q284 T288 K458 F460 F469	Q284-M286 PolarHBondContact O-N 3.44Å; M286-T288 PolarHBondContact O-N 3.17Å; M286-T288 VanDerWaalsContact O-N 3.15Å; M286-K458 HydrophobicContact CE-CB 3.56Å; M286-K458 HydrophobicContact CE-CD 3.54Å; M286-K458 HydrophobicContact CE-CG 3.71Å; M286-F460 HydrophobicContact CE-CE1 3.6Å; M286-F460 HydrophobicContact CE-CE2 4.22Å; M286-F460 HydrophobicContact CE-CZ 3.37Å; M286-F460 HydrophobicContact CG-CD1 4.28Å; M286-F460 HydrophobicContact CG-CE1 4.02Å; M286-F460 HydrophobicContact SD-CD1 4.44Å; M286-F460 HydrophobicContact SD-CE1 3.65Å; M286-F460 HydrophobicContact SD-CZ 4.09Å; M286-F469 HydrophobicContact CE-CD1 4.07Å; M286-F469 HydrophobicContact CE-CD2 3.96Å; M286-F469 HydrophobicContact CE-CE1 3.89Å; M286-F469 HydrophobicContact CE-CE2 3.78Å; M286-F469 HydrophobicContact CE-CG 4.12Å; M286-F469 HydrophobicContact CE-CZ 3.76Å; M286-F469 HydrophobicContact SD-CD2 3.72Å; M286-F469 HydrophobicContact SD-CE2 3.77Å; M286-F469 HydrophobicContact SD-CG 4.27Å; M286-F469 HydrophobicContact SD-CZ 4.37Å
287	M	60.1	Low	60.6	Low	116 Å²	116	105.1 Å²	105.1	57%	0.571	58%	0.58	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-74.6	107	-169.7	-64.7	-169.6	81.9	0	0	111.7	P285 K459	P285-M287 PolarHBondContact O-N 2.8Å; P285-M287 VanDerWaalsContact O-N 3.15Å; M287-K459 PolarHBondContact N-O 2.82Å; M287-K459 VanDerWaalsContact N-O 3.12Å; M287-K459 WeakPolarHBondContact O-CA 3.36Å; M287-K459 PolarHBondContact O-N 3.41Å
288	T	71.9	Confident	62.8	Low	88 Å²	88	104 Å²	104	54%	0.54	59%	0.585	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-67.8	130.3	163.4	41.2	0	0	0	0	110	M286 T456 K458	M286-T288 PolarHBondContact O-N 3.17Å; M286-T288 VanDerWaalsContact O-N 3.15Å; T288-T456 HydrophobicContact CG2-CG2 3.7Å; T288-K458 HydrophobicContact CG2-CG 4.06Å
289	K	75.1	Confident	64.3	Low	122 Å²	122	107 Å²	107	53%	0.53	58%	0.583	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-127	126.2	169.3	-71.7	-155.8	172.1	-155.1	0	109.4	K291 V457	K289-K291 PolarHBondContact O-N 2.63Å; K289-V457 PolarHBondContact N-O 3.2Å; K289-V457 PolarHBondContact O-N 2.81Å
290	I	78.9	Confident	66.4	Low	108 Å²	108	109 Å²	109	55%	0.554	59%	0.585	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-72.8	124.2	170.9	-55.1	175.9	0	0	0	107.6	Q454	I290-Q454 HydrophobicContact CG2-CB 3.66Å; I290-Q454 HydrophobicContact CG2-CG 3.99Å
291	K	80.9	Confident	68.2	Low	69 Å²	69	105.7 Å²	105.7	30%	0.3	58%	0.579	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-114.6	117.7	174.4	-174.2	-173.5	177.7	-174.4	0	107.7	D245 K289 V293 V455 V457	D245-K291 IonicContact OD2-NZ 3.15Å; K289-K291 PolarHBondContact O-N 2.63Å; K291-V293 HydrophobicContact CD-CG1 3.89Å; K291-V293 HydrophobicContact CG-CG1 3.9Å; K291-V293 PolarHBondContact O-N 3.22Å; K291-V455 PolarHBondContact N-O 2.64Å; K291-V455 PolarHBondContact O-N 2.89Å; K291-V457 HydrophobicContact CB-CG2 3.77Å; K291-V457 HydrophobicContact CD-CG2 4.19Å
292	T	81.8	Confident	70.1	Confident	57 Å²	57	106.7 Å²	106.7	35%	0.35	59%	0.585	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-68.8	123.1	168.7	-47.6	0	0	0	0	108.8	G317 F452 E453	T292-G317 VanDerWaalsContact O-CA 3.28Å; T292-G317 WeakPolarHBondContact O-CA 3.44Å; T292-F452 HydrophobicContact CG2-CB 3.64Å; T292-F452 HydrophobicContact CG2-CD1 3.78Å; T292-F452 HydrophobicContact CG2-CG 3.88Å; T292-E453 WeakPolarHBondContact CA-O 3.45Å
293	V	84.6	Confident	72.3	Confident	27 Å²	27	109.7 Å²	109.7	16%	0.164	59%	0.587	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-131.3	149.2	179.3	-65	0	0	0	0	110.6	K291 K295 F452 E453 V455	K291-V293 HydrophobicContact CD-CG1 3.89Å; K291-V293 HydrophobicContact CG-CG1 3.9Å; K291-V293 PolarHBondContact O-N 3.22Å; V293-K295 PolarHBondContact O-N 3.38Å; V293-F452 WeakPolarHBondContact O-CA 2.73Å; V293-E453 PolarHBondContact N-O 2.86Å; V293-E453 PolarHBondContact O-N 3.01Å; V293-V455 HydrophobicContact CG2-CB 4.3Å; V293-V455 HydrophobicContact CG2-CG2 3.58Å
294	L	87.6	Confident	74.4	Confident	54 Å²	54	109.7 Å²	109.7	28%	0.283	59%	0.59	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-59.5	128.1	173.9	178.5	61.1	0	0	0	110.5	S296 G317 I318 P319 F450	L294-S296 PolarHBondContact O-N 3.2Å; L294-G317 PolarHBondContact N-O 2.83Å; L294-I318 HydrophobicContact CB-CD1 4.26Å; L294-I318 HydrophobicContact CD1-CD1 4.01Å; L294-I318 HydrophobicContact CD2-CD1 4.15Å; L294-I318 HydrophobicContact CG-CD1 4.38Å; L294-P319 HydrophobicContact CD2-CG 4.34Å; L294-F450 HydrophobicContact CD1-CB 3.72Å; L294-F450 HydrophobicContact CD1-CD1 3.72Å; L294-F450 HydrophobicContact CD1-CG 3.98Å
295	K	86.8	Confident	76.5	Confident	99 Å²	99	107.1 Å²	107.1	43%	0.43	58%	0.58	S	S	.	*	P	Polyproline II helix	trans	-69.6	123.9	178	-172.1	174.4	-174.4	173.2	0	110.7	V293 R297 D451	V293-K295 PolarHBondContact O-N 3.38Å; K295-R297 PolarHBondContact O-N 3.15Å; K295-D451 HydrophobicContact CB-CB 3.95Å; K295-D451 WeakPolarHBondContact CB-O 3.49Å; K295-D451 HydrophobicContact CD-CB 4.22Å; K295-D451 PolarHBondContact N-O 3.14Å
296	S	80.8	Confident	78.6	Confident	111 Å²	111	105.6 Å²	105.6	78%	0.776	57%	0.57	S	S	*	*	P	Polyproline II helix	trans	-63.5	132.8	178.2	53.8	0	0	0	0	111.7	L294	L294-S296 PolarHBondContact O-N 3.2Å
297	R	79	Confident	80.2	Confident	195 Å²	195	110.4 Å²	110.4	74%	0.736	60%	0.597	S	S	*	*			trans	-134.9	131.2	175.8	-72.4	177.4	165.9	-136.6	6	109.1	K295 D451	K295-R297 PolarHBondContact O-N 3.15Å; R297-D451 IonicContact CZ-OD2 3.57Å; R297-D451 IonicContact NE-OD2 2.81Å; R297-D451 PolarHBondContact NE-OD2 3.01Å; R297-D451 IonicContact NH2-OD1 2.75Å; R297-D451 IonicContact NH2-OD2 3.2Å; R297-D451 PolarHBondContact NH2-OD2 3.26Å
298	G	76.8	Confident	81.6	Confident	80 Å²	80	106.2 Å²	106.2	83%	0.825	58%	0.583	S	S	*	*	S	Bend	trans	76	-167.9	-177.3	0	0	0	0	0	113.9
299	R	73.4	Confident	82.7	Confident	238 Å²	238	105.7 Å²	105.7	90%	0.898	57%	0.571	S	S	*	*	S	Bend	trans	-81.6	145.9	170.5	-62.6	-175	-173.9	-128.6	1.3	109.3
300	P	73.6	Confident	83.5	Confident	104 Å²	104	100.7 Å²	100.7	68%	0.675	55%	0.55	S	S	*	.	P	Polyproline II helix	trans	-63.4	155.4	173.2	28.7	-35.4	0	0	0	110.9	T302	P300-T302 PolarHBondContact O-N 3.34Å
301	P	76.3	Confident	84	Confident	110 Å²	110	99 Å²	99	71%	0.714	54%	0.541	S	S	*	.	P	Polyproline II helix	trans	-55.6	128.4	171.6	-23.2	34	0	0	0	111.1
302	T	75.8	Confident	84.4	Confident	143 Å²	143	95.8 Å²	95.8	88%	0.877	53%	0.527	S	S	*	.			trans	-91	-8	179.4	52.9	0	0	0	0	113.3	P300	P300-T302 PolarHBondContact O-N 3.34Å
303	E	83.3	Confident	84.8	Confident	168 Å²	168	95.6 Å²	95.6	79%	0.785	52%	0.521	S	S	*	.	S	Bend	trans	-83.1	126.1	178	-169.9	168.3	-152.6	0	0	109.6
304	P	86.3	Confident	85.1	Confident	112 Å²	112	94.4 Å²	94.4	73%	0.727	51%	0.514	S	S	*	.	P	Polyproline II helix	trans	-68.7	150.5	179.5	29.6	-34.9	0	0	0	111
305	L	89.3	Confident	85.1	Confident	72 Å²	72	95.3 Å²	95.3	38%	0.377	52%	0.519	S	S	.	.	P	Polyproline II helix	trans	-65.9	147.5	171.3	-68.2	179.8	0	0	0	110.8	W309 M311 Y321	L305-W309 HydrophobicContact CB-CB 4.13Å; L305-W309 HydrophobicContact CD1-CB 4.42Å; L305-M311 HydrophobicContact CD1-CB 4.14Å; L305-Y321 HydrophobicContact CD1-CD1 3.92Å; L305-Y321 HydrophobicContact CD1-CE1 4.15Å; L305-Y321 HydrophobicContact CD2-CD1 3.92Å; L305-Y321 HydrophobicContact CD2-CE1 3.79Å
306	P	92.5	Very high	85	Confident	88 Å²	88	90.7 Å²	90.7	57%	0.571	50%	0.499	S	S	*	.	P	Polyproline II helix	trans	-59.6	154.8	173	-21.1	32.6	0	0	0	112	G308 W309	P306-G308 PolarHBondContact O-N 3.25Å; P306-W309 WeakPolarHBondContact O-CB 3.32Å; P306-W309 PolarHBondContact O-N 3.14Å
307	D	89.5	Confident	85.3	Confident	158 Å²	158	85.4 Å²	85.4	85%	0.845	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.1	141.3	-179.4	-68.2	-44.3	0	0	0	112.7	W309	D307-W309 PolarHBondContact O-N 3.16Å
308	G	90.5	Very high	85.8	Confident	27 Å²	27	76.8 Å²	76.8	28%	0.278	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.5	-14.6	-176.6	0	0	0	0	0	115.4	P306 R324	P306-G308 PolarHBondContact O-N 3.25Å; G308-R324 WeakPolarHBondContact O-CG 3.27Å; G308-R324 PolarHBondContact O-N 2.88Å
309	W	93.9	Very high	86.4	Confident	77 Å²	77	74.2 Å²	74.2	29%	0.292	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	141.8	176.3	-68.8	83.9	0	0	0	113	L305 P306 D307 L322 H323 V328 T330	L305-W309 HydrophobicContact CB-CB 4.13Å; L305-W309 HydrophobicContact CD1-CB 4.42Å; P306-W309 WeakPolarHBondContact O-CB 3.32Å; P306-W309 PolarHBondContact O-N 3.14Å; D307-W309 PolarHBondContact O-N 3.16Å; W309-L322 CarbonylContact C-O 3.57Å; W309-L322 WeakPolarHBondContact CA-O 3.42Å; W309-L322 VanDerWaalsContact CE3-C 3.48Å; W309-H323 AromaticContact CD1-CD2 3.6Å; W309-H323 HydrophobicContact CD2-CB 3.88Å; W309-H323 AromaticContact CE2-CD2 3.99Å; W309-H323 HydrophobicContact CE3-CB 4.09Å; W309-H323 HydrophobicContact CG-CB 4.47Å; W309-H323 HydrophobicContact CH2-CB 4.07Å; W309-H323 HydrophobicContact CZ2-CB 3.85Å; W309-H323 HydrophobicContact CZ3-CB 4.17Å; W309-H323 AromaticContact NE1-CD2 3.54Å; W309-V328 HydrophobicContact CH2-CG1 4.41Å; W309-T330 HydrophobicContact CH2-CG2 4.33Å; W309-T330 HydrophobicContact CZ3-CG2 4.04Å
310	I	91.7	Very high	87.3	Confident	17 Å²	17	62.9 Å²	62.9	9%	0.087	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	148.2	172.2	56	173.1	0	0	0	110.9	F244 V248 Y321 L322 R324	F244-I310 HydrophobicContact CZ-CG2 4.41Å; V248-I310 HydrophobicContact CB-CD1 4.37Å; V248-I310 HydrophobicContact CG1-CD1 3.59Å; V248-I310 HydrophobicContact CG2-CD1 3.86Å; I310-Y321 WeakPolarHBondContact O-CA 3.46Å; I310-L322 HydrophobicContact CD1-CD2 4.21Å; I310-L322 HydrophobicContact CG1-CB 4.14Å; I310-L322 HydrophobicContact CG1-CD2 4.46Å; I310-L322 HydrophobicContact CG1-CG 4.34Å; I310-L322 WeakPolarHBondContact CG1-O 3.37Å; I310-L322 PolarHBondContact N-O 2.91Å; I310-L322 PolarHBondContact O-N 3.48Å; I310-R324 HydrophobicContact CD1-CG 3.91Å; I310-R324 HydrophobicContact CG1-CG 4.05Å; I310-R324 HydrophobicContact CG2-CG 4.29Å
311	M	89.8	Confident	88.3	Confident	73 Å²	73	61.5 Å²	61.5	36%	0.36	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	142.6	165.8	-160.5	-166.3	-45.3	0	0	108.9	L305 P319 Y321	L305-M311 HydrophobicContact CD1-CB 4.14Å; M311-P319 HydrophobicContact CG-CB 3.91Å; M311-P319 HydrophobicContact SD-CB 3.71Å; M311-Y321 HydrophobicContact CB-CD1 4.08Å; M311-Y321 HydrophobicContact CB-CE1 3.94Å; M311-Y321 HydrophobicContact CE-CE1 3.95Å; M311-Y321 HydrophobicContact CG-CD1 4.04Å; M311-Y321 HydrophobicContact CG-CE1 3.63Å; M311-Y321 HydrophobicContact SD-CE1 4.31Å
312	T	89.1	Confident	89.2	Confident	2 Å²	2	56.2 Å²	56.2	1%	0.012	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	167	171.8	-177	0	0	0	0	110	D245 P319 V320 I342 R343	D245-T312 PolarHBondContact OD1-OG1 3.47Å; T312-P319 CarbonylContact O-C 3.52Å; T312-P319 WeakPolarHBondContact O-CA 3.26Å; T312-V320 HydrophobicContact CG2-CG1 3.86Å; T312-V320 PolarHBondContact N-O 3.45Å; T312-V320 WeakPolarHBondContact O-CG1 3.36Å; T312-V320 PolarHBondContact O-N 3.06Å; T312-I342 HydrophobicContact CG2-CD1 3.68Å; T312-I342 HydrophobicContact CG2-CG1 3.95Å; T312-I342 HydrophobicContact CG2-CG2 4.01Å; T312-R343 VanDerWaalsContact OG1-CZ 3.25Å; T312-R343 PolarHBondContact OG1-NH1 2.45Å; T312-R343 PolarHBondContact OG1-NH2 3.3Å
313	F	89.7	Confident	90	Very high	52 Å²	52	51 Å²	51	23%	0.228	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	123.9	-179.6	-72.9	-88	0	0	0	112.8	P319 R343	F313-P319 HydrophobicContact CD1-CB 4.49Å; F313-P319 HydrophobicContact CE1-CB 4.18Å; F313-R343 PolarHBondContact O-NH1 2.96Å
314	H	91	Very high	90.3	Very high	2 Å²	2	48.3 Å²	48.3	1%	0.009	25%	0.253	C	S	.	.			trans	-74.2	158.3	168.5	-177.2	-121.4	0	0	0	111.5	S316 G317 I318 V320 W331 I342 R343 H345 L439 F442	H314-S316 PolarHBondContact ND1-N 3.04Å; H314-S316 PolarHBondContact ND1-OG 3.28Å; H314-S316 PolarHBondContact O-N 3.45Å; H314-G317 PolarHBondContact O-N 2.41Å; H314-I318 PolarHBondContact N-O 3.27Å; H314-V320 HydrophobicContact CB-CG1 4.15Å; H314-W331 HydrophobicContact CB-CZ2 3.99Å; H314-I342 PolarHBondContact CD2-O 3.21Å; H314-I342 VanDerWaalsContact CD2-O 3.28Å; H314-R343 VanDerWaalsContact CD2-C 3.46Å; H314-R343 PolarHBondContact CD2-O 3.04Å; H314-R343 VanDerWaalsContact CD2-O 3.25Å; H314-R343 PolarHBondContact NE2-O 3.41Å; H314-H345 AromaticContact CD2-NE2 3.94Å; H314-H345 PolarHBondContact NE2-O 3.13Å; H314-L439 VanDerWaalsContact CE1-CD1 3.49Å; H314-L439 WeakPolarHBondContact CE1-CD1 3.5Å; H314-F442 AromaticContact ND1-CE1 3.9Å
315	N	87.6	Confident	90.5	Very high	73 Å²	73	50.9 Å²	50.9	39%	0.39	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-10.2	177	-82	-6.5	0	0	0	114.8	R343 L439 R443	N315-R343 WeakPolarHBondContact CB-O 3.41Å; N315-R343 PolarHBondContact N-O 3.49Å; N315-R343 VanDerWaalsContact N-O 3.16Å; N315-R343 PolarHBondContact ND2-O 2.92Å; N315-R343 VanDerWaalsContact ND2-O 3.14Å; N315-R343 PolarHBondContact OD1-O 2.89Å; N315-L439 HydrophobicContact CB-CD1 4.19Å; N315-L439 HydrophobicContact CB-CD2 4.22Å; N315-R443 PolarHBondContact O-NH2 3.28Å
316	S	86.4	Confident	90.6	Very high	2 Å²	2	50 Å²	50	1%	0.014	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-1	168.3	62.1	0	0	0	0	113.7	H314 I318 F442 F452	H314-S316 PolarHBondContact ND1-N 3.04Å; H314-S316 PolarHBondContact ND1-OG 3.28Å; H314-S316 PolarHBondContact O-N 3.45Å; S316-I318 VanDerWaalsContact C-N 3.3Å; S316-I318 PolarHBondContact O-N 2.94Å; S316-F442 VanDerWaalsContact OG-CE1 3.29Å; S316-F442 WeakPolarHBondContact OG-CE1 3.45Å; S316-F452 WeakPolarHBondContact O-CE1 3.26Å
317	G	86.5	Confident	90.5	Very high	1 Å²	1	48 Å²	48	1%	0.01	24%	0.236	C	C	.	.	S	Bend	trans	85	-4.5	177.8	0	0	0	0	0	115	T292 L294 H314	T292-G317 VanDerWaalsContact O-CA 3.28Å; T292-G317 WeakPolarHBondContact O-CA 3.44Å; L294-G317 PolarHBondContact N-O 2.83Å; H314-G317 PolarHBondContact O-N 2.41Å
318	I	89.3	Confident	90.6	Very high	13 Å²	13	42.3 Å²	42.3	7%	0.067	21%	0.207	C	C	.	.	S	Bend	trans	-94.2	139	-179	-61.5	-65	0	0	0	110.4	L294 H314 S316 L446 F450 F452	L294-I318 HydrophobicContact CB-CD1 4.26Å; L294-I318 HydrophobicContact CD1-CD1 4.01Å; L294-I318 HydrophobicContact CD2-CD1 4.15Å; L294-I318 HydrophobicContact CG-CD1 4.38Å; H314-I318 PolarHBondContact N-O 3.27Å; S316-I318 VanDerWaalsContact C-N 3.3Å; S316-I318 PolarHBondContact O-N 2.94Å; I318-L446 HydrophobicContact CD1-CD2 4.26Å; I318-L446 HydrophobicContact CG1-CD1 3.59Å; I318-L446 HydrophobicContact CG1-CD2 3.88Å; I318-L446 HydrophobicContact CG1-CG 4.23Å; I318-F450 HydrophobicContact CD1-CB 4.42Å; I318-F450 HydrophobicContact CD1-CD2 3.93Å; I318-F450 HydrophobicContact CD1-CE2 4.31Å; I318-F450 HydrophobicContact CD1-CG 4.04Å; I318-F452 HydrophobicContact CD1-CE1 3.79Å; I318-F452 HydrophobicContact CD1-CZ 3.65Å; I318-F452 HydrophobicContact CG1-CE1 4.17Å; I318-F452 HydrophobicContact CG1-CZ 4.03Å
319	P	90.3	Very high	90.8	Very high	26 Å²	26	41 Å²	41	17%	0.169	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	140.7	172.1	27.3	-35.1	0	0	0	111.4	L294 M311 T312 F313 W331	L294-P319 HydrophobicContact CD2-CG 4.34Å; M311-P319 HydrophobicContact CG-CB 3.91Å; M311-P319 HydrophobicContact SD-CB 3.71Å; T312-P319 CarbonylContact O-C 3.52Å; T312-P319 WeakPolarHBondContact O-CA 3.26Å; F313-P319 HydrophobicContact CD1-CB 4.49Å; F313-P319 HydrophobicContact CE1-CB 4.18Å; P319-W331 PolarHBondContact O-NE1 3.23Å; P319-W331 VanDerWaalsContact O-NE1 3.1Å
320	V	92.1	Very high	90.7	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	145	-179.8	64.2	0	0	0	0	109.7	T312 H314 V329 W331 I342	T312-V320 HydrophobicContact CG2-CG1 3.86Å; T312-V320 PolarHBondContact N-O 3.45Å; T312-V320 WeakPolarHBondContact O-CG1 3.36Å; T312-V320 PolarHBondContact O-N 3.06Å; H314-V320 HydrophobicContact CB-CG1 4.15Å; V320-V329 HydrophobicContact CG2-CG1 3.36Å; V320-W331 HydrophobicContact CB-CD2 4.44Å; V320-W331 HydrophobicContact CB-CZ2 3.74Å; V320-W331 HydrophobicContact CG2-CD2 3.89Å; V320-W331 VanDerWaalsContact CG2-CE2 3.42Å; V320-W331 HydrophobicContact CG2-CE3 4.38Å; V320-W331 HydrophobicContact CG2-CG 4.4Å; V320-W331 HydrophobicContact CG2-CH2 4.04Å; V320-W331 HydrophobicContact CG2-CZ2 3.52Å; V320-W331 HydrophobicContact CG2-CZ3 4.44Å; V320-I342 HydrophobicContact CG1-CD1 3.85Å; V320-I342 HydrophobicContact CG1-CG1 3.73Å
321	Y	94.2	Very high	90.6	Very high	75 Å²	75	39.8 Å²	39.8	29%	0.294	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	138.8	-178.6	-58.4	-78.9	0	0	0	111.4	L305 I310 M311 V329 T330	L305-Y321 HydrophobicContact CD1-CD1 3.92Å; L305-Y321 HydrophobicContact CD1-CE1 4.15Å; L305-Y321 HydrophobicContact CD2-CD1 3.92Å; L305-Y321 HydrophobicContact CD2-CE1 3.79Å; I310-Y321 WeakPolarHBondContact O-CA 3.46Å; M311-Y321 HydrophobicContact CB-CD1 4.08Å; M311-Y321 HydrophobicContact CB-CE1 3.94Å; M311-Y321 HydrophobicContact CE-CE1 3.95Å; M311-Y321 HydrophobicContact CG-CD1 4.04Å; M311-Y321 HydrophobicContact CG-CE1 3.63Å; M311-Y321 HydrophobicContact SD-CE1 4.31Å; Y321-V329 CarbonylContact O-C 3.59Å; Y321-V329 VanDerWaalsContact O-CA 3.26Å; Y321-V329 WeakPolarHBondContact O-CA 3.27Å; Y321-V329 WeakPolarHBondContact O-CG1 3.34Å; Y321-T330 PolarHBondContact N-O 3.37Å; Y321-T330 PolarHBondContact O-N 2.95Å
322	L	94	Very high	90.6	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	127.3	-179.7	162.2	63.4	0	0	0	111.1	L252 W309 I310 V328 V329 I342	L252-L322 HydrophobicContact CD1-CD2 3.74Å; L252-L322 HydrophobicContact CD2-CD2 3.85Å; L252-L322 HydrophobicContact CG-CD2 4.46Å; W309-L322 CarbonylContact C-O 3.57Å; W309-L322 WeakPolarHBondContact CA-O 3.42Å; W309-L322 VanDerWaalsContact CE3-C 3.48Å; I310-L322 HydrophobicContact CD1-CD2 4.21Å; I310-L322 HydrophobicContact CG1-CB 4.14Å; I310-L322 HydrophobicContact CG1-CD2 4.46Å; I310-L322 HydrophobicContact CG1-CG 4.34Å; I310-L322 WeakPolarHBondContact CG1-O 3.37Å; I310-L322 PolarHBondContact N-O 2.91Å; I310-L322 PolarHBondContact O-N 3.48Å; L322-V328 WeakPolarHBondContact CA-O 2.96Å; L322-V329 HydrophobicContact CB-CG2 4.24Å; L322-V329 HydrophobicContact CD1-CG2 3.69Å; L322-V329 HydrophobicContact CG-CG2 4.47Å; L322-I342 HydrophobicContact CB-CD1 3.42Å; L322-I342 VanDerWaalsContact CB-CD1 3.42Å; L322-I342 HydrophobicContact CD2-CD1 3.69Å; L322-I342 HydrophobicContact CG-CD1 4.09Å
323	H	94.3	Very high	90.7	Very high	33 Å²	33	46.9 Å²	46.9	15%	0.153	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	112.7	163.3	-169.9	-112.1	0	0	0	109.5	W309 E325 S326 R327 V328	W309-H323 AromaticContact CD1-CD2 3.6Å; W309-H323 HydrophobicContact CD2-CB 3.88Å; W309-H323 AromaticContact CE2-CD2 3.99Å; W309-H323 HydrophobicContact CE3-CB 4.09Å; W309-H323 HydrophobicContact CG-CB 4.47Å; W309-H323 HydrophobicContact CH2-CB 4.07Å; W309-H323 HydrophobicContact CZ2-CB 3.85Å; W309-H323 HydrophobicContact CZ3-CB 4.17Å; W309-H323 AromaticContact NE1-CD2 3.54Å; H323-E325 IonicContact CE1-OE2 2.66Å; H323-E325 PolarHBondContact O-N 3.21Å; H323-S326 PolarHBondContact ND1-N 2.87Å; H323-S326 PolarHBondContact ND1-OG 3.33Å; H323-R327 PolarHBondContact O-N 2.87Å; H323-V328 PolarHBondContact N-O 3.2Å
324	R	89.7	Confident	90.8	Very high	111 Å²	111	48 Å²	48	42%	0.419	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-46.4	-170	-70.5	174.8	63.8	-160.5	-1.6	112.6	G308 I310	G308-R324 WeakPolarHBondContact O-CG 3.27Å; G308-R324 PolarHBondContact O-N 2.88Å; I310-R324 HydrophobicContact CD1-CG 3.91Å; I310-R324 HydrophobicContact CG1-CG 4.05Å; I310-R324 HydrophobicContact CG2-CG 4.29Å
325	E	89.1	Confident	90.8	Very high	167 Å²	167	49.1 Å²	49.1	78%	0.78	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.2	-46.6	-172	-52.3	-175.6	155.9	0	0	112.9	H323	H323-E325 IonicContact CE1-OE2 2.66Å; H323-E325 PolarHBondContact O-N 3.21Å
326	S	90.8	Very high	91	Very high	53 Å²	53	49.8 Å²	49.8	37%	0.371	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.9	-5.4	-175.9	66.4	0	0	0	0	113.8	H323 V328 F336	H323-S326 PolarHBondContact ND1-N 2.87Å; H323-S326 PolarHBondContact ND1-OG 3.33Å; S326-V328 PolarHBondContact O-N 3.08Å; S326-V328 VanDerWaalsContact O-N 3.15Å; S326-V328 WeakPolarHBondContact OG-CG2 3.42Å; S326-F336 WeakPolarHBondContact O-CE2 2.9Å
327	R	91.3	Very high	91	Very high	46 Å²	46	50.6 Å²	50.6	17%	0.174	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.5	28.1	-178.6	-59.6	-73.4	-63.7	152.2	4.3	113.2	H323 F336 L337 G338 G340	H323-R327 PolarHBondContact O-N 2.87Å; R327-F336 HydrophobicContact CB-CD2 4.34Å; R327-F336 HydrophobicContact CB-CE2 3.91Å; R327-L337 PolarHBondContact O-N 2.94Å; R327-G338 PolarHBondContact NE-O 2.86Å; R327-G338 PolarHBondContact NH2-O 3.09Å; R327-G340 PolarHBondContact NH2-O 3.27Å
328	V	92.4	Very high	91	Very high	38 Å²	38	51.3 Å²	51.3	23%	0.23	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	132.3	174.6	172.4	0	0	0	0	109.4	W309 L322 H323 S326 P334 Y335	W309-V328 HydrophobicContact CH2-CG1 4.41Å; L322-V328 WeakPolarHBondContact CA-O 2.96Å; H323-V328 PolarHBondContact N-O 3.2Å; S326-V328 PolarHBondContact O-N 3.08Å; S326-V328 VanDerWaalsContact O-N 3.15Å; S326-V328 WeakPolarHBondContact OG-CG2 3.42Å; V328-P334 HydrophobicContact CG1-CB 3.57Å; V328-Y335 CarbonylContact C-O 3.45Å; V328-Y335 WeakPolarHBondContact CA-O 3.16Å
329	V	93.4	Very high	90.7	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	147.3	-175.8	-177	0	0	0	0	109.6	V320 Y321 L322 P334 Y335 L337 I342	V320-V329 HydrophobicContact CG2-CG1 3.36Å; Y321-V329 CarbonylContact O-C 3.59Å; Y321-V329 VanDerWaalsContact O-CA 3.26Å; Y321-V329 WeakPolarHBondContact O-CA 3.27Å; Y321-V329 WeakPolarHBondContact O-CG1 3.34Å; L322-V329 HydrophobicContact CB-CG2 4.24Å; L322-V329 HydrophobicContact CD1-CG2 3.69Å; L322-V329 HydrophobicContact CG-CG2 4.47Å; V329-P334 WeakPolarHBondContact O-CA 3.27Å; V329-Y335 HydrophobicContact CB-CE1 4.43Å; V329-Y335 HydrophobicContact CB-CE2 3.99Å; V329-Y335 HydrophobicContact CG1-CE1 4.45Å; V329-Y335 HydrophobicContact CG1-CE2 4.34Å; V329-Y335 WeakPolarHBondContact CG1-OH 3.4Å; V329-Y335 PolarHBondContact N-O 2.96Å; V329-Y335 WeakPolarHBondContact O-CD1 3.44Å; V329-Y335 WeakPolarHBondContact O-CE1 3.12Å; V329-Y335 PolarHBondContact O-N 3.39Å; V329-L337 HydrophobicContact CB-CB 4.47Å; V329-L337 HydrophobicContact CG2-CB 3.6Å; V329-L337 HydrophobicContact CG2-CD2 3.74Å; V329-L337 HydrophobicContact CG2-CG 4.26Å; V329-I342 HydrophobicContact CG1-CD1 3.97Å; V329-I342 HydrophobicContact CG1-CG1 4.42Å; V329-I342 HydrophobicContact CG2-CD1 4Å
330	T	93.1	Very high	90.1	Very high	18 Å²	18	56.6 Å²	56.6	11%	0.11	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	147.6	176.4	-163	0	0	0	0	114.6	W309 Y321 S332 R333	W309-T330 HydrophobicContact CH2-CG2 4.33Å; W309-T330 HydrophobicContact CZ3-CG2 4.04Å; Y321-T330 PolarHBondContact N-O 3.37Å; Y321-T330 PolarHBondContact O-N 2.95Å; T330-S332 PolarHBondContact OG1-N 2.77Å; T330-S332 PolarHBondContact OG1-O 3.37Å; T330-R333 VanDerWaalsContact OG1-C 3.31Å; T330-R333 PolarHBondContact OG1-O 3.39Å
331	W	89.3	Confident	89.9	Confident	51 Å²	51	59.5 Å²	59.5	19%	0.193	31%	0.308	C	S	.	.	S	Bend	trans	-108.5	-23.2	150	-63.5	-85	0	0	0	112.4	H314 P319 V320 Y335 H345 P347 F442	H314-W331 HydrophobicContact CB-CZ2 3.99Å; P319-W331 PolarHBondContact O-NE1 3.23Å; P319-W331 VanDerWaalsContact O-NE1 3.1Å; V320-W331 HydrophobicContact CB-CD2 4.44Å; V320-W331 HydrophobicContact CB-CZ2 3.74Å; V320-W331 HydrophobicContact CG2-CD2 3.89Å; V320-W331 VanDerWaalsContact CG2-CE2 3.42Å; V320-W331 HydrophobicContact CG2-CE3 4.38Å; V320-W331 HydrophobicContact CG2-CG 4.4Å; V320-W331 HydrophobicContact CG2-CH2 4.04Å; V320-W331 HydrophobicContact CG2-CZ2 3.52Å; V320-W331 HydrophobicContact CG2-CZ3 4.44Å; W331-Y335 HydrophobicContact CE3-CE1 4.15Å; W331-Y335 WeakPolarHBondContact CH2-OH 3.29Å; W331-Y335 AromaticContact CZ3-CE1 3.95Å; W331-Y335 HydrophobicContact CZ3-CE1 3.95Å; W331-Y335 AromaticContact CZ3-CZ 3.8Å; W331-Y335 WeakPolarHBondContact CZ3-OH 3.44Å; W331-H345 AromaticContact CH2-NE2 3.85Å; W331-P347 HydrophobicContact CE3-CB 4.46Å; W331-P347 HydrophobicContact CH2-CB 3.85Å; W331-P347 HydrophobicContact CH2-CG 4.45Å; W331-P347 HydrophobicContact CZ3-CB 3.45Å; W331-P347 VanDerWaalsContact CZ3-CB 3.45Å; W331-P347 HydrophobicContact CZ3-CG 4.38Å; W331-F442 HydrophobicContact CH2-CE1 4.24Å; W331-F442 HydrophobicContact CZ2-CE1 4.13Å; W331-F442 HydrophobicContact CZ2-CZ 4.38Å
332	S	89.8	Confident	89.6	Confident	69 Å²	69	56 Å²	56	48%	0.483	30%	0.295	S	S	.	.	S	Bend	trans	-154.9	-74.3	174.9	63.8	0	0	0	0	111.2	T330 P334 S351 P353	T330-S332 PolarHBondContact OG1-N 2.77Å; T330-S332 PolarHBondContact OG1-O 3.37Å; S332-P334 WeakPolarHBondContact O-CD 3.38Å; S332-S351 PolarHBondContact OG-O 3Å; S332-P353 WeakPolarHBondContact OG-CD 3.34Å
333	R	89.8	Confident	89.3	Confident	155 Å²	155	57.3 Å²	57.3	59%	0.585	30%	0.3	S	S	*	.	S	Bend	trans	-80.1	121.4	168.3	178.1	-176.2	177	90.5	-2.6	109.6	T330 S350	T330-R333 VanDerWaalsContact OG1-C 3.31Å; T330-R333 PolarHBondContact OG1-O 3.39Å; R333-S350 VanDerWaalsContact CD-O 3.27Å; R333-S350 WeakPolarHBondContact CD-O 3.45Å
334	P	92.3	Very high	88.9	Confident	74 Å²	74	63.3 Å²	63.3	48%	0.481	33%	0.326	S	S	.	.			trans	-69.9	149	178	-17.6	31.5	0	0	0	113.5	V328 V329 S332	V328-P334 HydrophobicContact CG1-CB 3.57Å; V329-P334 WeakPolarHBondContact O-CA 3.27Å; S332-P334 WeakPolarHBondContact O-CD 3.38Å
335	Y	91.3	Very high	88.8	Confident	27 Å²	27	59 Å²	59	11%	0.106	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	164.8	175.9	59.4	-83.8	0	0	0	110.4	V328 V329 W331 P348 S351	V328-Y335 CarbonylContact C-O 3.45Å; V328-Y335 WeakPolarHBondContact CA-O 3.16Å; V329-Y335 HydrophobicContact CB-CE1 4.43Å; V329-Y335 HydrophobicContact CB-CE2 3.99Å; V329-Y335 HydrophobicContact CG1-CE1 4.45Å; V329-Y335 HydrophobicContact CG1-CE2 4.34Å; V329-Y335 WeakPolarHBondContact CG1-OH 3.4Å; V329-Y335 PolarHBondContact N-O 2.96Å; V329-Y335 WeakPolarHBondContact O-CD1 3.44Å; V329-Y335 WeakPolarHBondContact O-CE1 3.12Å; V329-Y335 PolarHBondContact O-N 3.39Å; W331-Y335 HydrophobicContact CE3-CE1 4.15Å; W331-Y335 WeakPolarHBondContact CH2-OH 3.29Å; W331-Y335 AromaticContact CZ3-CE1 3.95Å; W331-Y335 HydrophobicContact CZ3-CE1 3.95Å; W331-Y335 AromaticContact CZ3-CZ 3.8Å; W331-Y335 WeakPolarHBondContact CZ3-OH 3.44Å; Y335-P348 HydrophobicContact CD1-CG 4.43Å; Y335-P348 HydrophobicContact CD2-CG 3.88Å; Y335-P348 HydrophobicContact CE2-CG 4.48Å; Y335-P348 HydrophobicContact CG-CG 3.89Å; Y335-S351 VanDerWaalsContact CD1-CB 3.43Å
336	F	90.9	Very high	88.8	Confident	87 Å²	87	54.7 Å²	54.7	38%	0.382	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	126.5	-179.2	-177.3	-114.1	0	0	0	111	S326 R327 V429	S326-F336 WeakPolarHBondContact O-CE2 2.9Å; R327-F336 HydrophobicContact CB-CD2 4.34Å; R327-F336 HydrophobicContact CB-CE2 3.91Å; F336-V429 HydrophobicContact CD1-CB 4.46Å
337	L	87.5	Confident	88.8	Confident	18 Å²	18	52.2 Å²	52.2	9%	0.094	28%	0.275	C	S	.	.			trans	-86.9	-21	177.8	175.2	63.4	0	0	0	112.8	R327 V329 T339 G340 I342 H345	R327-L337 PolarHBondContact O-N 2.94Å; V329-L337 HydrophobicContact CB-CB 4.47Å; V329-L337 HydrophobicContact CG2-CB 3.6Å; V329-L337 HydrophobicContact CG2-CD2 3.74Å; V329-L337 HydrophobicContact CG2-CG 4.26Å; L337-T339 PolarHBondContact O-N 3.3Å; L337-G340 WeakPolarHBondContact CD2-O 3.45Å; L337-G340 WeakPolarHBondContact CG-O 3.44Å; L337-G340 PolarHBondContact O-N 3.38Å; L337-I342 HydrophobicContact CD2-CB 3.71Å; L337-I342 HydrophobicContact CD2-CG1 4.36Å; L337-H345 HydrophobicContact CD1-CB 3.75Å; L337-H345 VanDerWaalsContact CD1-CG 3.43Å
338	G	86.8	Confident	88.7	Confident	16 Å²	16	50.5 Å²	50.5	17%	0.165	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	55.6	-131.6	-175	0	0	0	0	0	112.6	R327 G340	R327-G338 PolarHBondContact NE-O 2.86Å; R327-G338 PolarHBondContact NH2-O 3.09Å; G338-G340 VanDerWaalsContact C-N 3.27Å; G338-G340 PolarHBondContact O-N 3.1Å
339	T	82.6	Confident	88.6	Confident	123 Å²	123	50.2 Å²	50.2	76%	0.755	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.1	5	177.8	52.9	0	0	0	0	113.8	L256 L337	L256-T339 HydrophobicContact CD2-CG2 4.27Å; L337-T339 PolarHBondContact O-N 3.3Å
340	G	78.3	Confident	88.3	Confident	27 Å²	27	52.2 Å²	52.2	28%	0.278	28%	0.281	S	S	.	.	S	Bend	trans	-68.4	154.3	179.7	0	0	0	0	0	113.8	R327 L337 G338	R327-G340 PolarHBondContact NH2-O 3.27Å; L337-G340 WeakPolarHBondContact CD2-O 3.45Å; L337-G340 WeakPolarHBondContact CG-O 3.44Å; L337-G340 PolarHBondContact O-N 3.38Å; G338-G340 VanDerWaalsContact C-N 3.27Å; G338-G340 PolarHBondContact O-N 3.1Å
341	S	86.7	Confident	88.1	Confident	61 Å²	61	51.4 Å²	51.4	43%	0.427	28%	0.276	S	S	.	.			trans	-79.6	124.7	170.1	177.3	0	0	0	0	109.9	R343 K344 H345	S341-R343 PolarHBondContact O-N 3.05Å; S341-K344 PolarHBondContact O-N 3.15Å; S341-H345 PolarHBondContact O-CE1 3.5Å; S341-H345 PolarHBondContact O-N 2.72Å; S341-H345 PolarHBondContact O-ND1 2.89Å
342	I	87.6	Confident	88.3	Confident	3 Å²	3	49.6 Å²	49.6	2%	0.015	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59	-24.2	-179.1	-175.7	153.8	0	0	0	113.3	L252 T312 H314 V320 L322 V329 L337 H345	L252-I342 HydrophobicContact CD1-CG2 3.97Å; T312-I342 HydrophobicContact CG2-CD1 3.68Å; T312-I342 HydrophobicContact CG2-CG1 3.95Å; T312-I342 HydrophobicContact CG2-CG2 4.01Å; H314-I342 PolarHBondContact CD2-O 3.21Å; H314-I342 VanDerWaalsContact CD2-O 3.28Å; V320-I342 HydrophobicContact CG1-CD1 3.85Å; V320-I342 HydrophobicContact CG1-CG1 3.73Å; L322-I342 HydrophobicContact CB-CD1 3.42Å; L322-I342 VanDerWaalsContact CB-CD1 3.42Å; L322-I342 HydrophobicContact CD2-CD1 3.69Å; L322-I342 HydrophobicContact CG-CD1 4.09Å; V329-I342 HydrophobicContact CG1-CD1 3.97Å; V329-I342 HydrophobicContact CG1-CG1 4.42Å; V329-I342 HydrophobicContact CG2-CD1 4Å; L337-I342 HydrophobicContact CD2-CB 3.71Å; L337-I342 HydrophobicContact CD2-CG1 4.36Å; I342-H345 WeakPolarHBondContact CA-CE1 3.22Å; I342-H345 PolarHBondContact O-CE1 3.07Å; I342-H345 PolarHBondContact O-ND1 3.19Å; I342-H345 PolarHBondContact O-NE2 2.78Å
343	R	88.3	Confident	88.3	Confident	26 Å²	26	49.6 Å²	49.6	10%	0.098	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86	-15.1	178.9	-53.5	-172.9	-169.7	-89.9	1.1	114.2	D245 D249 T312 F313 H314 N315 S341 H345	D245-R343 PolarHBondContact O-NH2 3Å; D245-R343 IonicContact OD1-CZ 3.08Å; D245-R343 VanDerWaalsContact OD1-CZ 3.32Å; D245-R343 IonicContact OD1-NH1 3.32Å; D245-R343 PolarHBondContact OD1-NH1 3.08Å; D245-R343 IonicContact OD1-NH2 3.66Å; D245-R343 PolarHBondContact OD1-NH2 2.84Å; D245-R343 IonicContact OD2-CZ 2.69Å; D245-R343 IonicContact OD2-NH1 3.86Å; D245-R343 PolarHBondContact OD2-NH1 3.07Å; D245-R343 IonicContact OD2-NH2 2.65Å; D249-R343 IonicContact OD1-CZ 3.57Å; D249-R343 VanDerWaalsContact OD1-CZ 3.25Å; D249-R343 IonicContact OD1-NE 2.77Å; D249-R343 PolarHBondContact OD1-NE 2.8Å; D249-R343 IonicContact OD1-NH2 3.79Å; D249-R343 PolarHBondContact OD1-NH2 3.06Å; D249-R343 IonicContact OD2-CZ 3.34Å; D249-R343 IonicContact OD2-NE 3.22Å; D249-R343 PolarHBondContact OD2-NE 2.68Å; D249-R343 VanDerWaalsContact OD2-NE 3.15Å; D249-R343 IonicContact OD2-NH2 2.64Å; T312-R343 VanDerWaalsContact OG1-CZ 3.25Å; T312-R343 PolarHBondContact OG1-NH1 2.45Å; T312-R343 PolarHBondContact OG1-NH2 3.3Å; F313-R343 PolarHBondContact O-NH1 2.96Å; H314-R343 VanDerWaalsContact CD2-C 3.46Å; H314-R343 PolarHBondContact CD2-O 3.04Å; H314-R343 VanDerWaalsContact CD2-O 3.25Å; H314-R343 PolarHBondContact NE2-O 3.41Å; N315-R343 WeakPolarHBondContact CB-O 3.41Å; N315-R343 PolarHBondContact N-O 3.49Å; N315-R343 VanDerWaalsContact N-O 3.16Å; N315-R343 PolarHBondContact ND2-O 2.92Å; N315-R343 VanDerWaalsContact ND2-O 3.14Å; N315-R343 PolarHBondContact OD1-O 2.89Å; S341-R343 PolarHBondContact O-N 3.05Å; R343-H345 PolarHBondContact N-CE1 2.9Å
344	K	86.1	Confident	88.3	Confident	159 Å²	159	45.9 Å²	45.9	69%	0.691	27%	0.265	S	S	*	.	S	Bend	trans	-138.1	37.4	-166.2	-58.5	177.5	177.4	175.4	0	113.4	S341	S341-K344 PolarHBondContact O-N 3.15Å
345	H	87.9	Confident	88.2	Confident	21 Å²	21	42.8 Å²	42.8	10%	0.097	25%	0.245	C	C	.	.			trans	-119.1	146.1	179.7	70.1	-78.1	0	0	0	110	H314 W331 L337 S341 I342 R343 P347	H314-H345 AromaticContact CD2-NE2 3.94Å; H314-H345 PolarHBondContact NE2-O 3.13Å; W331-H345 AromaticContact CH2-NE2 3.85Å; L337-H345 HydrophobicContact CD1-CB 3.75Å; L337-H345 VanDerWaalsContact CD1-CG 3.43Å; S341-H345 PolarHBondContact O-CE1 3.5Å; S341-H345 PolarHBondContact O-N 2.72Å; S341-H345 PolarHBondContact O-ND1 2.89Å; I342-H345 WeakPolarHBondContact CA-CE1 3.22Å; I342-H345 PolarHBondContact O-CE1 3.07Å; I342-H345 PolarHBondContact O-ND1 3.19Å; I342-H345 PolarHBondContact O-NE2 2.78Å; R343-H345 PolarHBondContact N-CE1 2.9Å; H345-P347 WeakPolarHBondContact O-CD 3.24Å
346	D	89.2	Confident	88.1	Confident	77 Å²	77	44.9 Å²	44.9	41%	0.412	26%	0.255	S	S	.	.	P	Polyproline II helix	trans	-80.9	116.6	179	-52.7	-58.4	0	0	0	108.5
347	P	89.9	Confident	88.1	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	27%	0.268	C	S	.	.	P	Polyproline II helix	trans	-72.2	140.5	-173.1	29.7	-38.1	0	0	0	111.5	W331 H345 I352 V437 F442	W331-P347 HydrophobicContact CE3-CB 4.46Å; W331-P347 HydrophobicContact CH2-CB 3.85Å; W331-P347 HydrophobicContact CH2-CG 4.45Å; W331-P347 HydrophobicContact CZ3-CB 3.45Å; W331-P347 VanDerWaalsContact CZ3-CB 3.45Å; W331-P347 HydrophobicContact CZ3-CG 4.38Å; H345-P347 WeakPolarHBondContact O-CD 3.24Å; P347-I352 HydrophobicContact CG-CD1 4.44Å; P347-V437 WeakPolarHBondContact CD-O 3.45Å; P347-V437 HydrophobicContact CG-CB 4.22Å; P347-V437 PolarHBondContact O-N 2.91Å; P347-F442 HydrophobicContact CG-CD1 3.73Å; P347-F442 HydrophobicContact CG-CE1 3.87Å; P347-F442 HydrophobicContact CG-CG 4.18Å; P347-F442 HydrophobicContact CG-CZ 4.43Å
348	P	90.4	Very high	88.2	Confident	11 Å²	11	52.2 Å²	52.2	7%	0.071	28%	0.283	C	S	.	.	B	Isolated β-bridge	trans	-59.8	139.3	174.5	-22.3	32.7	0	0	0	111.3	Y335 S350 S351 V431	Y335-P348 HydrophobicContact CD1-CG 4.43Å; Y335-P348 HydrophobicContact CD2-CG 3.88Å; Y335-P348 HydrophobicContact CE2-CG 4.48Å; Y335-P348 HydrophobicContact CG-CG 3.89Å; P348-S350 PolarHBondContact O-N 2.74Å; P348-S351 VanDerWaalsContact O-CB 3.27Å; P348-S351 WeakPolarHBondContact O-CB 3.34Å; P348-S351 PolarHBondContact O-N 3.01Å; P348-S351 PolarHBondContact O-OG 3.1Å; P348-V431 HydrophobicContact CG-CG1 4.04Å
349	L	88.8	Confident	88.4	Confident	32 Å²	32	55 Å²	55	17%	0.168	29%	0.29	C	S	.	.	G	3₁₀ helix	trans	-52.4	-42.6	176.2	-88.3	163.9	0	0	0	112	S351 I352 L355 K359 E435 V437	L349-S351 PolarHBondContact O-N 2.96Å; L349-I352 PolarHBondContact O-N 3.22Å; L349-I352 VanDerWaalsContact O-N 3.14Å; L349-L355 HydrophobicContact CD2-CD2 4.28Å; L349-L355 HydrophobicContact CD2-CG 4.11Å; L349-K359 HydrophobicContact CD1-CD 4.35Å; L349-K359 HydrophobicContact CD2-CD 3.73Å; L349-K359 HydrophobicContact CD2-CG 4.3Å; L349-E435 WeakPolarHBondContact CB-O 3.49Å; L349-E435 WeakPolarHBondContact CG-O 3.49Å; L349-E435 PolarHBondContact N-O 2.76Å; L349-V437 HydrophobicContact CB-CG2 4.4Å; L349-V437 HydrophobicContact CD2-CG2 3.51Å; L349-V437 HydrophobicContact CG-CG2 3.67Å
350	S	87.3	Confident	88.7	Confident	41 Å²	41	53.6 Å²	53.6	29%	0.287	28%	0.276	S	S	.	.	G	3₁₀ helix	trans	-65	-16.5	178.1	58.5	0	0	0	0	114.2	R333 P348 I352	R333-S350 VanDerWaalsContact CD-O 3.27Å; R333-S350 WeakPolarHBondContact CD-O 3.45Å; P348-S350 PolarHBondContact O-N 2.74Å; S350-I352 PolarHBondContact O-N 2.64Å
351	S	90.1	Very high	89.3	Confident	1 Å²	1	56.5 Å²	56.5	1%	0.007	28%	0.281	C	S	.	.	G	3₁₀ helix	trans	-72.8	-12.3	173.8	76.4	0	0	0	0	113.8	S332 Y335 P348 L349	S332-S351 PolarHBondContact OG-O 3Å; Y335-S351 VanDerWaalsContact CD1-CB 3.43Å; P348-S351 VanDerWaalsContact O-CB 3.27Å; P348-S351 WeakPolarHBondContact O-CB 3.34Å; P348-S351 PolarHBondContact O-N 3.01Å; P348-S351 PolarHBondContact O-OG 3.1Å; L349-S351 PolarHBondContact O-N 2.96Å
352	I	91.6	Very high	89.6	Confident	14 Å²	14	57.5 Å²	57.5	7%	0.072	28%	0.279	C	S	.	.	S	Bend	trans	-128.4	80.7	-179.4	-51.7	154.1	0	0	0	108.4	P347 L349 S350 C354 L355 H356 F442 Y445	P347-I352 HydrophobicContact CG-CD1 4.44Å; L349-I352 PolarHBondContact O-N 3.22Å; L349-I352 VanDerWaalsContact O-N 3.14Å; S350-I352 PolarHBondContact O-N 2.64Å; I352-C354 PolarHBondContact O-N 2.91Å; I352-C354 VanDerWaalsContact O-N 3.08Å; I352-L355 HydrophobicContact CB-CB 4.02Å; I352-L355 HydrophobicContact CD1-CD2 4.09Å; I352-L355 HydrophobicContact CG2-CB 3.59Å; I352-L355 PolarHBondContact O-N 3.08Å; I352-H356 PolarHBondContact O-N 3.47Å; I352-F442 HydrophobicContact CD1-CD2 3.8Å; I352-F442 HydrophobicContact CD1-CE2 3.36Å; I352-F442 HydrophobicContact CD1-CZ 3.94Å; I352-F442 HydrophobicContact CG1-CE2 4.33Å; I352-Y445 HydrophobicContact CG2-CE1 4.02Å
353	P	90.4	Very high	89.6	Confident	68 Å²	68	59.7 Å²	59.7	44%	0.442	29%	0.291	S	S	.	.	H	α-helix	trans	-55.1	-34.8	-170.7	-29.3	36.1	0	0	0	114.8	S332 H356 Y357	S332-P353 WeakPolarHBondContact OG-CD 3.34Å; P353-H356 PolarHBondContact O-N 2.91Å; P353-Y357 WeakPolarHBondContact O-CB 3.35Å; P353-Y357 PolarHBondContact O-N 2.96Å
354	C	90.3	Very high	89.9	Confident	78 Å²	78	63.4 Å²	63.4	53%	0.527	31%	0.309	S	S	.	.	H	α-helix	trans	-75.8	-16.9	178.1	49.6	0	0	0	0	114.6	I352 Y445	I352-C354 PolarHBondContact O-N 2.91Å; I352-C354 VanDerWaalsContact O-N 3.08Å; C354-Y445 PolarHBondContact SG-OH 3.07Å
355	L	89.4	Confident	90.1	Very high	8 Å²	8	59.8 Å²	59.8	4%	0.042	30%	0.295	C	S	.	.	H	α-helix	trans	-88.6	-41.8	167.3	173	57.4	0	0	0	110.4	L349 I352 K358 K359 V437 Y445	L349-L355 HydrophobicContact CD2-CD2 4.28Å; L349-L355 HydrophobicContact CD2-CG 4.11Å; I352-L355 HydrophobicContact CB-CB 4.02Å; I352-L355 HydrophobicContact CD1-CD2 4.09Å; I352-L355 HydrophobicContact CG2-CB 3.59Å; I352-L355 PolarHBondContact O-N 3.08Å; L355-K358 WeakPolarHBondContact O-CB 3.49Å; L355-K358 PolarHBondContact O-N 3.46Å; L355-K359 HydrophobicContact CD1-CG 4.22Å; L355-K359 PolarHBondContact O-N 3.31Å; L355-V437 HydrophobicContact CD2-CG1 4.12Å; L355-V437 HydrophobicContact CD2-CG2 3.87Å; L355-Y445 HydrophobicContact CB-CD1 4.43Å; L355-Y445 HydrophobicContact CB-CD2 4.34Å; L355-Y445 HydrophobicContact CB-CE1 4.12Å; L355-Y445 HydrophobicContact CB-CE2 3.99Å; L355-Y445 HydrophobicContact CD1-CD2 3.68Å; L355-Y445 HydrophobicContact CD1-CE2 4.01Å; L355-Y445 HydrophobicContact CD1-CG 4.08Å; L355-Y445 HydrophobicContact CD2-CD1 4.32Å; L355-Y445 HydrophobicContact CD2-CG 4.23Å; L355-Y445 HydrophobicContact CG-CD2 4.41Å
356	H	90.1	Very high	90.2	Very high	71 Å²	71	64.7 Å²	64.7	33%	0.329	31%	0.313	S	S	.	.	H	α-helix	trans	-56.8	-52.6	175.6	-178.7	77.6	0	0	0	111.9	I352 P353 K358 K359 M360	I352-H356 PolarHBondContact O-N 3.47Å; P353-H356 PolarHBondContact O-N 2.91Å; H356-K358 PolarHBondContact O-N 2.81Å; H356-K359 PolarHBondContact O-N 3.2Å; H356-M360 VanDerWaalsContact CE1-CE 3.44Å; H356-M360 WeakPolarHBondContact CE1-CE 3.42Å; H356-M360 WeakPolarHBondContact O-CG 3.08Å; H356-M360 PolarHBondContact O-N 3.35Å
357	Y	91.4	Very high	90.1	Very high	168 Å²	168	66.3 Å²	66.3	66%	0.659	32%	0.318	S	S	*	.	H	α-helix	trans	-56.9	-38.3	175.4	179.5	-95.8	0	0	0	112.4	P353 K361	P353-Y357 WeakPolarHBondContact O-CB 3.35Å; P353-Y357 PolarHBondContact O-N 2.96Å; Y357-K361 WeakPolarHBondContact O-CB 3.4Å; Y357-K361 PolarHBondContact O-N 3.42Å
358	K	89.9	Confident	89.7	Confident	91 Å²	91	72.6 Å²	72.6	40%	0.396	35%	0.347	S	S	.	.	H	α-helix	trans	-65.2	-48.3	176.5	-174.9	-179.3	175.5	-73.3	0	111.7	L355 H356 M360 K361 E362	L355-K358 WeakPolarHBondContact O-CB 3.49Å; L355-K358 PolarHBondContact O-N 3.46Å; H356-K358 PolarHBondContact O-N 2.81Å; K358-M360 VanDerWaalsContact C-N 3.32Å; K358-M360 PolarHBondContact O-N 2.9Å; K358-K361 PolarHBondContact O-N 3.17Å; K358-E362 WeakPolarHBondContact CE-OE1 3.46Å; K358-E362 HydrophobicContact CG-CG 4.5Å; K358-E362 IonicContact NZ-OE1 3.19Å; K358-E362 PolarHBondContact NZ-OE1 3.41Å; K358-E362 IonicContact NZ-OE2 2.79Å; K358-E362 PolarHBondContact NZ-OE2 2.63Å; K358-E362 WeakPolarHBondContact O-CB 3.29Å; K358-E362 WeakPolarHBondContact O-CG 3.49Å; K358-E362 PolarHBondContact O-N 3.21Å
359	K	89.2	Confident	89	Confident	75 Å²	75	78 Å²	78	33%	0.326	38%	0.376	S	S	.	.	H	α-helix	trans	-64.7	-34.8	178.1	-71.1	-151.7	-177.9	-170.8	0	112.2	L349 L355 H356 N363 D441	L349-K359 HydrophobicContact CD1-CD 4.35Å; L349-K359 HydrophobicContact CD2-CD 3.73Å; L349-K359 HydrophobicContact CD2-CG 4.3Å; L355-K359 HydrophobicContact CD1-CG 4.22Å; L355-K359 PolarHBondContact O-N 3.31Å; H356-K359 PolarHBondContact O-N 3.2Å; K359-N363 PolarHBondContact O-N 2.9Å; K359-N363 VanDerWaalsContact O-N 3.08Å; K359-D441 IonicContact NZ-OD2 3.84Å; K359-D441 PolarHBondContact NZ-OD2 2.88Å
360	M	89.6	Confident	88	Confident	94 Å²	94	82.2 Å²	82.2	46%	0.463	40%	0.398	S	S	.	.	H	α-helix	trans	-67.2	-48.6	174.6	-70.4	-59.6	-177.8	0	0	112	H356 K358 E362 N363 E364	H356-M360 VanDerWaalsContact CE1-CE 3.44Å; H356-M360 WeakPolarHBondContact CE1-CE 3.42Å; H356-M360 WeakPolarHBondContact O-CG 3.08Å; H356-M360 PolarHBondContact O-N 3.35Å; K358-M360 VanDerWaalsContact C-N 3.32Å; K358-M360 PolarHBondContact O-N 2.9Å; M360-E362 VanDerWaalsContact C-N 3.31Å; M360-E362 PolarHBondContact O-N 3.06Å; M360-N363 WeakPolarHBondContact O-CA 3.38Å; M360-N363 VanDerWaalsContact O-CB 3.27Å; M360-N363 WeakPolarHBondContact O-CB 3.43Å; M360-N363 PolarHBondContact O-N 2.92Å; M360-E364 PolarHBondContact O-N 3.17Å
361	K	91.9	Very high	86.4	Confident	87 Å²	87	87.4 Å²	87.4	38%	0.378	42%	0.423	S	S	.	.	H	α-helix	trans	-58.8	-42.3	174	175.4	171.6	171.9	175.2	0	112.1	Y357 K358 N363 E364 E365	Y357-K361 WeakPolarHBondContact O-CB 3.4Å; Y357-K361 PolarHBondContact O-N 3.42Å; K358-K361 PolarHBondContact O-N 3.17Å; K361-N363 PolarHBondContact O-N 3.07Å; K361-E364 PolarHBondContact O-N 2.84Å; K361-E365 WeakPolarHBondContact CE-OE1 3.43Å; K361-E365 WeakPolarHBondContact CE-OE2 3.45Å; K361-E365 HydrophobicContact CG-CG 4.41Å; K361-E365 IonicContact NZ-OE1 2.87Å; K361-E365 PolarHBondContact NZ-OE1 3.27Å; K361-E365 WeakPolarHBondContact O-CB 3.39Å; K361-E365 WeakPolarHBondContact O-CG 3.35Å; K361-E365 PolarHBondContact O-N 3.07Å
362	E	91.3	Very high	84.6	Confident	82 Å²	82	93.5 Å²	93.5	38%	0.383	45%	0.454	S	S	.	.	H	α-helix	trans	-69.6	-8.5	175	-71.8	175.5	147.7	0	0	113.3	K358 M360 R366	K358-E362 WeakPolarHBondContact CE-OE1 3.46Å; K358-E362 HydrophobicContact CG-CG 4.5Å; K358-E362 IonicContact NZ-OE1 3.19Å; K358-E362 PolarHBondContact NZ-OE1 3.41Å; K358-E362 IonicContact NZ-OE2 2.79Å; K358-E362 PolarHBondContact NZ-OE2 2.63Å; K358-E362 WeakPolarHBondContact O-CB 3.29Å; K358-E362 WeakPolarHBondContact O-CG 3.49Å; K358-E362 PolarHBondContact O-N 3.21Å; M360-E362 VanDerWaalsContact C-N 3.31Å; M360-E362 PolarHBondContact O-N 3.06Å; E362-R366 PolarHBondContact O-NH1 2.95Å
363	N	89.3	Confident	82	Confident	50 Å²	50	99.1 Å²	99.1	27%	0.267	49%	0.489	S	S	.	.	H	α-helix	trans	-89.3	-49.1	168.3	-169.1	76.8	0	0	0	111.1	K359 M360 K361 E365 R366 E367	K359-N363 PolarHBondContact O-N 2.9Å; K359-N363 VanDerWaalsContact O-N 3.08Å; M360-N363 WeakPolarHBondContact O-CA 3.38Å; M360-N363 VanDerWaalsContact O-CB 3.27Å; M360-N363 WeakPolarHBondContact O-CB 3.43Å; M360-N363 PolarHBondContact O-N 2.92Å; K361-N363 PolarHBondContact O-N 3.07Å; N363-E365 VanDerWaalsContact C-N 3.32Å; N363-E365 PolarHBondContact O-N 3.29Å; N363-R366 WeakPolarHBondContact O-CA 3.39Å; N363-R366 WeakPolarHBondContact O-CB 3.3Å; N363-R366 PolarHBondContact O-N 3.34Å; N363-R366 PolarHBondContact OD1-NH2 2.75Å; N363-E367 PolarHBondContact ND2-OE1 3.4Å; N363-E367 PolarHBondContact ND2-OE2 3.22Å; N363-E367 PolarHBondContact O-N 3.32Å
364	E	92.9	Very high	80.1	Confident	103 Å²	103	101.6 Å²	101.6	48%	0.481	51%	0.505	S	S	.	.	H	α-helix	trans	-54.1	-47	174.5	-66.7	167	-170.3	0	0	111.6	M360 K361 R366 E367 Q368	M360-E364 PolarHBondContact O-N 3.17Å; K361-E364 PolarHBondContact O-N 2.84Å; E364-R366 VanDerWaalsContact C-N 3.29Å; E364-R366 PolarHBondContact O-N 3.03Å; E364-E367 PolarHBondContact O-N 3.26Å; E364-Q368 WeakPolarHBondContact O-CB 3.42Å; E364-Q368 VanDerWaalsContact O-CG 3.22Å; E364-Q368 WeakPolarHBondContact O-CG 3.45Å; E364-Q368 PolarHBondContact O-N 3.17Å
365	E	91.7	Very high	77.4	Confident	84 Å²	84	106.1 Å²	106.1	39%	0.393	52%	0.524	S	S	.	.	H	α-helix	trans	-65.2	-30	176.2	-72.7	179.6	154.8	0	0	112.2	K361 N363 N369	K361-E365 WeakPolarHBondContact CE-OE1 3.43Å; K361-E365 WeakPolarHBondContact CE-OE2 3.45Å; K361-E365 HydrophobicContact CG-CG 4.41Å; K361-E365 IonicContact NZ-OE1 2.87Å; K361-E365 PolarHBondContact NZ-OE1 3.27Å; K361-E365 WeakPolarHBondContact O-CB 3.39Å; K361-E365 WeakPolarHBondContact O-CG 3.35Å; K361-E365 PolarHBondContact O-N 3.07Å; N363-E365 VanDerWaalsContact C-N 3.32Å; N363-E365 PolarHBondContact O-N 3.29Å; E365-N369 WeakPolarHBondContact O-CB 3.47Å; E365-N369 PolarHBondContact O-N 2.71Å; E365-N369 PolarHBondContact O-ND2 3.26Å
366	R	89.7	Confident	74.7	Confident	123 Å²	123	109.6 Å²	109.6	46%	0.464	56%	0.562	S	S	.	*	H	α-helix	trans	-75.3	-41.5	176.2	170	172.6	54.6	-95.4	-1.3	111.8	E362 N363 E364 N369 N370	E362-R366 PolarHBondContact O-NH1 2.95Å; N363-R366 WeakPolarHBondContact O-CA 3.39Å; N363-R366 WeakPolarHBondContact O-CB 3.3Å; N363-R366 PolarHBondContact O-N 3.34Å; N363-R366 PolarHBondContact OD1-NH2 2.75Å; E364-R366 VanDerWaalsContact C-N 3.29Å; E364-R366 PolarHBondContact O-N 3.03Å; R366-N369 PolarHBondContact O-N 2.59Å; R366-N370 WeakPolarHBondContact O-CB 3.35Å; R366-N370 PolarHBondContact O-N 3.28Å; R366-N370 VanDerWaalsContact O-N 3.1Å; R366-N370 PolarHBondContact O-ND2 2.93Å
367	E	87.6	Confident	72	Confident	112 Å²	112	115.3 Å²	115.3	52%	0.523	59%	0.589	S	S	.	*	H	α-helix	trans	-64.4	-46.4	177.6	-72.7	167.4	170.3	0	0	110.5	N363 E364 N369 N370 D371	N363-E367 PolarHBondContact ND2-OE1 3.4Å; N363-E367 PolarHBondContact ND2-OE2 3.22Å; N363-E367 PolarHBondContact O-N 3.32Å; E364-E367 PolarHBondContact O-N 3.26Å; E367-N369 VanDerWaalsContact C-N 3.29Å; E367-N369 PolarHBondContact O-N 2.91Å; E367-N370 PolarHBondContact O-N 3.01Å; E367-N370 VanDerWaalsContact O-N 3.09Å; E367-D371 PolarHBondContact O-N 2.79Å
368	Q	81.8	Confident	69.2	Low	131 Å²	131	113.9 Å²	113.9	61%	0.612	60%	0.597	S	S	*	*	H	α-helix	trans	-61.8	-31.4	176.1	-69.8	166.5	27.4	0	0	113.7	E364	E364-Q368 WeakPolarHBondContact O-CB 3.42Å; E364-Q368 VanDerWaalsContact O-CG 3.22Å; E364-Q368 WeakPolarHBondContact O-CG 3.45Å; E364-Q368 PolarHBondContact O-N 3.17Å
369	N	74.8	Confident	66.5	Low	126 Å²	126	114.7 Å²	114.7	67%	0.674	61%	0.614	S	S	*	*	H	α-helix	trans	-81.5	-19.6	175.7	-80.8	-61.5	0	0	0	113.6	E365 R366 E367	E365-N369 WeakPolarHBondContact O-CB 3.47Å; E365-N369 PolarHBondContact O-N 2.71Å; E365-N369 PolarHBondContact O-ND2 3.26Å; R366-N369 PolarHBondContact O-N 2.59Å; E367-N369 VanDerWaalsContact C-N 3.29Å; E367-N369 PolarHBondContact O-N 2.91Å
370	N	67	Low	64.7	Low	120 Å²	120	116.5 Å²	116.5	64%	0.642	63%	0.633	S	S	*	*	H	α-helix	trans	-87.5	-18.7	-179.2	-76.5	-15.4	0	0	0	113.5	R366 E367 I372	R366-N370 WeakPolarHBondContact O-CB 3.35Å; R366-N370 PolarHBondContact O-N 3.28Å; R366-N370 VanDerWaalsContact O-N 3.1Å; R366-N370 PolarHBondContact O-ND2 2.93Å; E367-N370 PolarHBondContact O-N 3.01Å; E367-N370 VanDerWaalsContact O-N 3.09Å; N370-I372 VanDerWaalsContact C-N 3.27Å; N370-I372 PolarHBondContact O-N 3.02Å
371	D	54.1	Low	62.1	Low	149 Å²	149	118.5 Å²	118.5	80%	0.797	65%	0.645	S	S	*	*	S	Bend	trans	-87.5	20.2	-171.8	-146.7	19.3	0	0	0	114	E367	E367-D371 PolarHBondContact O-N 2.79Å
372	I	52.1	Low	59.2	Low	129 Å²	129	124 Å²	124	66%	0.662	67%	0.668	S	S	*	*			trans	-123.6	52.2	-171.8	-40.4	-177	0	0	0	112.9	N370	N370-I372 VanDerWaalsContact C-N 3.27Å; N370-I372 PolarHBondContact O-N 3.02Å
373	T	38.4	Very low	56.3	Low	133 Å²	133	127.2 Å²	127.2	82%	0.816	68%	0.683	S	S	*	*			trans	-150.5	108.8	158.3	33.5	0	0	0	0	112.6
374	P	50.3	Low	53.3	Low	120 Å²	120	132.8 Å²	132.8	78%	0.779	71%	0.711	S	S	*	*			trans	-93.2	142.5	172.1	34	-32.2	0	0	0	113.6
375	N	33.6	Very low	50.1	Low	173 Å²	173	133.5 Å²	133.5	93%	0.925	72%	0.719	S	S	*	*			trans	64.7	134.8	168.7	-66.3	-14.5	0	0	0	119.2
376	G	32.8	Very low	47.2	Very low	80 Å²	80	137.2 Å²	137.2	83%	0.825	73%	0.733	S	S	*	*			trans	160.3	85.1	171.6	0	0	0	0	0	112.9
377	E	32.4	Very low	44.5	Very low	192 Å²	192	135.3 Å²	135.3	90%	0.897	74%	0.739	S	S	*	*			trans	-50.6	134.4	-172.7	-55.9	171.2	119.3	0	0	115.8
378	V	32.4	Very low	41.5	Very low	137 Å²	137	135.9 Å²	135.9	83%	0.83	76%	0.755	S	S	*	*				172.3	143.9	111.8	155.2	0	0	0	0	111.1
379	S	33.9	Very low	39.1	Very low	108 Å²	108	135.7 Å²	135.7	76%	0.755	75%	0.754	S	S	*	*			trans	-155.9	174.4	172.5	-82.8	0	0	0	0	108.3
380	P	51.3	Low	37	Very low	113 Å²	113	136.7 Å²	136.7	73%	0.734	76%	0.759	S	S	*	*			cis	-110.7	-147.7	-3.7	28.4	-5.5	0	0	0	109.6
381	I	34	Very low	35	Very low	136 Å²	136	137.8 Å²	137.8	70%	0.697	77%	0.765	S	S	*	*			cis	-156.8	141.2	12.1	0.1	174.5	0	0	0	110.3
382	K	31.4	Very low	33.6	Very low	202 Å²	202	135 Å²	135	88%	0.878	76%	0.756	S	S	*	*				-171.4	141.5	109.2	-101.7	173.7	-177.4	-179.8	0	112
383	H	30.1	Very low	32.3	Very low	150 Å²	150	137.2 Å²	137.2	69%	0.694	76%	0.763	S	S	*	*			trans	-77.4	153.4	179.4	-83.8	-130.6	0	0	0	113	D385	H383-D385 IonicContact CE1-OD1 2.86Å; H383-D385 IonicContact CG-OD1 3.13Å; H383-D385 IonicContact ND1-OD1 2.82Å; H383-D385 PolarHBondContact ND1-OD1 2.77Å
384	I	27	Very low	31.7	Very low	168 Å²	168	135.8 Å²	135.8	86%	0.862	76%	0.755	S	S	*	*				-145.7	158.7	109.4	-128.8	168.9	0	0	0	109.7
385	D	26.5	Very low	30.5	Very low	118 Å²	118	138.3 Å²	138.3	63%	0.631	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-96	162.3	-133.1	-63.9	-77.3	0	0	0	119.1	H383	H383-D385 IonicContact CE1-OD1 2.86Å; H383-D385 IonicContact CG-OD1 3.13Å; H383-D385 IonicContact ND1-OD1 2.82Å; H383-D385 PolarHBondContact ND1-OD1 2.77Å
386	K	30.1	Very low	30.5	Very low	162 Å²	162	137.8 Å²	137.8	70%	0.704	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-87.7	169.8	174.8	-155.5	-163.8	177.4	-166.1	0	110.8	E389	K386-E389 IonicContact NZ-OE1 3.52Å; K386-E389 PolarHBondContact NZ-OE1 2.88Å
387	S	32	Very low	30.9	Very low	82 Å²	82	139.4 Å²	139.4	57%	0.573	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-49.9	152.5	165	53.5	0	0	0	0	114.9
388	S	26.2	Very low	30.5	Very low	124 Å²	124	137.2 Å²	137.2	87%	0.867	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-74.1	152.6	155	46.9	0	0	0	0	111.3
389	E	30.5	Very low	30.3	Very low	128 Å²	128	135.1 Å²	135.1	60%	0.598	73%	0.73	S	S	*	*			trans	-125.2	178.3	-168.9	-57.2	-178.8	150.9	0	0	112.5	K386	K386-E389 IonicContact NZ-OE1 3.52Å; K386-E389 PolarHBondContact NZ-OE1 2.88Å
390	L	31.2	Very low	30	Very low	147 Å²	147	136.1 Å²	136.1	77%	0.77	73%	0.732	S	S	*	*			trans	79.6	89.5	154.1	-68.3	152.9	0	0	0	121.1
391	D	25.3	Very low	28.9	Very low	143 Å²	143	135.3 Å²	135.3	77%	0.765	73%	0.734	S	S	*	*				67.5	156.8	98.3	-157.5	25.2	0	0	0	123.3
392	C	23.7	Very low	28.7	Very low	91 Å²	91	133.4 Å²	133.4	62%	0.615	74%	0.739	S	S	*	*			trans	76.9	89.2	160.8	-81.2	0	0	0	0	123
393	Q	25.7	Very low	28.5	Very low	174 Å²	174	130.8 Å²	130.8	81%	0.813	73%	0.734	S	S	*	*				68.5	124.7	122	-71.7	-168.3	15.7	0	0	124.7
394	T	25.3	Very low	28.5	Very low	103 Å²	103	128.8 Å²	128.8	63%	0.632	74%	0.737	S	S	*	*			trans	72.4	113.2	136.4	-48.2	0	0	0	0	120.9
395	E	25.1	Very low	28.4	Very low	173 Å²	173	124 Å²	124	81%	0.808	73%	0.729	S	S	*	*				-179.7	155.2	114	-88.8	-52.8	158.4	0	0	110.2
396	E	32.6	Very low	29.2	Very low	163 Å²	163	123.7 Å²	123.7	76%	0.762	73%	0.734	S	S	*	*			trans	-135.9	148.2	169.2	-83.3	-94.7	180	0	0	105.9
397	P	43	Very low	29.2	Very low	113 Å²	113	123.4 Å²	123.4	73%	0.734	74%	0.739	S	S	*	*			cis	-152.6	-165.9	37.1	39.5	-15.6	0	0	0	117
398	D	22.6	Very low	29.2	Very low	146 Å²	146	125.8 Å²	125.8	78%	0.781	75%	0.745	S	S	*	*			trans	90	167.4	140.5	-149.6	17.7	0	0	0	121.7
399	S	29.1	Very low	29.5	Very low	93 Å²	93	124.6 Å²	124.6	65%	0.65	73%	0.73	S	S	*	*			trans	-87.3	167.3	-145.3	-56.8	0	0	0	0	117.3
400	T	27.2	Very low	29.6	Very low	130 Å²	130	126.5 Å²	126.5	80%	0.798	74%	0.736	S	S	*	*				145.8	137.5	105.5	-44.9	0	0	0	0	113.5
401	A	27.7	Very low	29.6	Very low	95 Å²	95	126.4 Å²	126.4	79%	0.785	74%	0.736	S	S	*	*			trans	62	156	157	0	0	0	0	0	117.8
402	A	29.7	Very low	30.5	Very low	96 Å²	96	124.6 Å²	124.6	79%	0.793	73%	0.732	S	S	*	*			cis	168.6	167.8	-5.5	0	0	0	0	0	104.2
403	D	27.1	Very low	30.9	Very low	147 Å²	147	125.9 Å²	125.9	79%	0.786	74%	0.742	S	S	*	*			cis	-160.1	154.7	-13	160.1	53.6	0	0	0	107
404	S	30.6	Very low	31	Very low	108 Å²	108	121.5 Å²	121.5	76%	0.755	74%	0.744	S	S	*	*			trans	157.1	120.3	141.9	51.1	0	0	0	0	112.5
405	G	25.6	Very low	31.1	Very low	67 Å²	67	120.6 Å²	120.6	69%	0.691	75%	0.754	S	S	*	*			trans	-91.7	-149.9	165.1	0	0	0	0	0	112.1
406	P	42	Very low	31.4	Very low	113 Å²	113	119.8 Å²	119.8	73%	0.734	76%	0.756	S	S	*	*			cis	-143.7	166.6	10.8	43.5	-26.1	0	0	0	117.8
407	L	30.8	Very low	31.4	Very low	156 Å²	156	116.6 Å²	116.6	82%	0.817	76%	0.757	S	S	*	*			trans	61.3	151.3	150.4	-66.3	160.8	0	0	0	118.4
408	D	32.5	Very low	30.7	Very low	131 Å²	131	115.4 Å²	115.4	70%	0.701	76%	0.757	S	S	*	*			cis	-152.9	-174.6	-0	-143.9	10.9	0	0	0	107.3
409	D	32.5	Very low	31.4	Very low	100 Å²	100	118.3 Å²	118.3	54%	0.535	77%	0.766	S	S	.	*			cis	-157.3	165.6	6.4	-172.9	17.9	0	0	0	110.2
410	K	31.4	Very low	31.4	Very low	168 Å²	168	117.4 Å²	117.4	73%	0.73	77%	0.772	S	S	*	*			trans	31.6	119.1	158	-83.5	165	-150.8	71.6	0	123
411	D	31.6	Very low	31.9	Very low	144 Å²	144	116.4 Å²	116.4	77%	0.77	78%	0.776	S	S	*	*			trans	-103	163.6	135.7	-152.4	-10.3	0	0	0	107.4
412	P	44.2	Very low	32.2	Very low	105 Å²	105	119.7 Å²	119.7	68%	0.682	78%	0.78	S	S	*	*				-157.5	173	80.7	41.8	-21.7	0	0	0	118.6
413	S	32.5	Very low	32.4	Very low	119 Å²	119	118.2 Å²	118.2	83%	0.832	77%	0.774	S	S	*	*			trans	85.1	139.8	156.4	80.4	0	0	0	0	118.4
414	G	27.4	Very low	32.7	Very low	82 Å²	82	120.2 Å²	120.2	85%	0.845	78%	0.779	S	S	*	*			cis	166.7	135.3	-8	0	0	0	0	0	112.8
415	G	28.1	Very low	32.6	Very low	83 Å²	83	121.1 Å²	121.1	86%	0.856	78%	0.779	S	S	*	*			trans	164.7	84.3	179.5	0	0	0	0	0	113.4
416	D	32.1	Very low	33.1	Very low	157 Å²	157	127.2 Å²	127.2	84%	0.84	79%	0.787	S	S	*	*			trans	-82.3	143.8	175.3	-177.5	15.4	0	0	0	111.6	A418	D416-A418 PolarHBondContact OD1-N 3.07Å
417	A	31	Very low	32.9	Very low	95 Å²	95	124.7 Å²	124.7	79%	0.785	78%	0.776	S	S	*	*			trans	-152.1	51.4	178.2	0	0	0	0	0	113.2
418	A	30	Very low	33.3	Very low	89 Å²	89	124.6 Å²	124.6	74%	0.736	77%	0.769	S	S	*	*			trans	63	117.3	154.3	0	0	0	0	0	119.2	D416	D416-A418 PolarHBondContact OD1-N 3.07Å
419	Q	35.7	Very low	33.9	Very low	206 Å²	206	122.5 Å²	122.5	96%	0.963	76%	0.76	S	S	*	*			trans	-72.3	124.6	169.6	-65.4	172.2	-17.2	0	0	111.9
420	G	29.8	Very low	34.6	Very low	75 Å²	75	123.8 Å²	123.8	77%	0.773	76%	0.763	S	S	*	*			trans	-101.9	126	166	0	0	0	0	0	111	L422	G420-L422 PolarHBondContact O-N 3.05Å
421	A	37.2	Very low	35.6	Very low	108 Å²	108	118.8 Å²	118.8	89%	0.893	75%	0.747	S	S	*	*	S	Bend	trans	-83.2	96.4	-167.4	0	0	0	0	0	114.4
422	L	34.2	Very low	36.6	Very low	164 Å²	164	115.8 Å²	115.8	86%	0.859	74%	0.736	S	S	*	*			trans	-141.8	121.1	139.8	-152.8	79.5	0	0	0	108.8	G420 Q424	G420-L422 PolarHBondContact O-N 3.05Å; L422-Q424 PolarHBondContact O-N 2.89Å
423	G	33.3	Very low	37.1	Very low	66 Å²	66	119 Å²	119	68%	0.68	74%	0.739	S	S	*	*			trans	-65.1	123.7	-173.9	0	0	0	0	0	111.7	V425	G423-V425 PolarHBondContact O-N 3.24Å
424	Q	33.2	Very low	38.4	Very low	188 Å²	188	120.8 Å²	120.8	88%	0.879	74%	0.739	S	S	*	*			trans	-69.1	77.3	162.3	-75	-168.3	-3	0	0	109.2	L422 K426	L422-Q424 PolarHBondContact O-N 2.89Å; Q424-K426 PolarHBondContact O-N 3.26Å
425	V	30.5	Very low	40.6	Very low	127 Å²	127	122.7 Å²	122.7	77%	0.77	73%	0.726	S	S	*	*			trans	-64.4	93.6	162.4	-171.3	0	0	0	0	105.8	G423 A427	G423-V425 PolarHBondContact O-N 3.24Å; V425-A427 HydrophobicContact CG1-CB 4.22Å; V425-A427 PolarHBondContact O-N 3.5Å
426	K	35.3	Very low	43.3	Very low	196 Å²	196	120.2 Å²	120.2	85%	0.852	70%	0.696	S	S	*	*			trans	-75.3	53.4	178.6	-163.2	178.2	-178.7	179.5	0	109.9	Q424 K428	Q424-K426 PolarHBondContact O-N 3.26Å; K426-K428 PolarHBondContact O-N 2.7Å
427	A	37.8	Very low	45.9	Very low	60 Å²	60	112.8 Å²	112.8	50%	0.496	66%	0.656	S	S	.	*			trans	-60	103.7	174.1	0	0	0	0	0	107.4	V425 V429	V425-A427 HydrophobicContact CG1-CB 4.22Å; V425-A427 PolarHBondContact O-N 3.5Å; A427-V429 HydrophobicContact CB-CG2 3.89Å; A427-V429 PolarHBondContact O-N 3.04Å
428	K	39.8	Very low	48.6	Very low	154 Å²	154	112.7 Å²	112.7	67%	0.67	64%	0.643	S	S	*	*			trans	-73.2	71.1	170.7	-170.8	-173.4	179.4	-125.5	0	107.5	K426 E430	K426-K428 PolarHBondContact O-N 2.7Å; K428-E430 VanDerWaalsContact CE-CD 3.4Å; K428-E430 WeakPolarHBondContact CE-OE1 3.32Å; K428-E430 WeakPolarHBondContact CE-OE2 3.38Å; K428-E430 HydrophobicContact CG-CG 4.32Å; K428-E430 IonicContact NZ-OE1 3.74Å; K428-E430 PolarHBondContact NZ-OE1 3.29Å; K428-E430 IonicContact NZ-OE2 2.74Å; K428-E430 PolarHBondContact NZ-OE2 3.44Å; K428-E430 PolarHBondContact O-N 3.39Å
429	V	43.9	Very low	51.2	Low	86 Å²	86	110.2 Å²	110.2	52%	0.521	62%	0.617	S	S	.	*			trans	-72.3	75	172.1	-173.1	0	0	0	0	107.4	F336 A427 V431	F336-V429 HydrophobicContact CD1-CB 4.46Å; A427-V429 HydrophobicContact CB-CG2 3.89Å; A427-V429 PolarHBondContact O-N 3.04Å; V429-V431 PolarHBondContact O-N 2.78Å
430	E	47.5	Very low	53.6	Low	128 Å²	128	104.2 Å²	104.2	60%	0.598	59%	0.589	S	S	*	*			trans	-63.2	117	154.2	-79.9	168.2	154.1	0	0	106.3	K428 C432	K428-E430 VanDerWaalsContact CE-CD 3.4Å; K428-E430 WeakPolarHBondContact CE-OE1 3.32Å; K428-E430 WeakPolarHBondContact CE-OE2 3.38Å; K428-E430 HydrophobicContact CG-CG 4.32Å; K428-E430 IonicContact NZ-OE1 3.74Å; K428-E430 PolarHBondContact NZ-OE1 3.29Å; K428-E430 IonicContact NZ-OE2 2.74Å; K428-E430 PolarHBondContact NZ-OE2 3.44Å; K428-E430 PolarHBondContact O-N 3.39Å; E430-C432 PolarHBondContact O-N 3.19Å; E430-C432 VanDerWaalsContact O-N 3.08Å
431	V	51.9	Low	56.4	Low	63 Å²	63	104 Å²	104	38%	0.382	57%	0.57	S	S	.	*			trans	-60.7	114.3	172.5	175.8	0	0	0	0	106.8	P348 V429 K433	P348-V431 HydrophobicContact CG-CG1 4.04Å; V429-V431 PolarHBondContact O-N 2.78Å; V431-K433 PolarHBondContact O-N 3.37Å
432	C	52.2	Low	58.8	Low	81 Å²	81	99.1 Å²	99.1	55%	0.547	53%	0.528	S	S	.	.			trans	-56.6	114.4	176.5	-61.8	0	0	0	0	108.6	E430 D434 E435	E430-C432 PolarHBondContact O-N 3.19Å; E430-C432 VanDerWaalsContact O-N 3.08Å; C432-D434 PolarHBondContact O-N 2.74Å; C432-D434 VanDerWaalsContact O-N 3.13Å; C432-E435 PolarHBondContact O-N 3.3Å; C432-E435 VanDerWaalsContact O-N 3.08Å
433	K	56.2	Low	61.4	Low	173 Å²	173	94.3 Å²	94.3	75%	0.752	50%	0.499	S	S	*	.	G	3₁₀ helix	trans	-57.7	-31.2	-177.2	-70.9	-173.1	173	-172.4	0	111.9	V431 E435 S436	V431-K433 PolarHBondContact O-N 3.37Å; K433-E435 PolarHBondContact O-N 2.7Å; K433-S436 WeakPolarHBondContact O-CB 3.48Å; K433-S436 PolarHBondContact O-N 3.46Å; K433-S436 PolarHBondContact O-OG 2.96Å
434	D	59	Low	64.1	Low	156 Å²	156	97.4 Å²	97.4	83%	0.834	49%	0.49	S	S	*	.	G	3₁₀ helix	trans	-65.9	-15.8	-177.9	-42.4	-49.8	0	0	0	113.1	C432	C432-D434 PolarHBondContact O-N 2.74Å; C432-D434 VanDerWaalsContact O-N 3.13Å
435	E	73.9	Confident	66.8	Low	122 Å²	122	89.9 Å²	89.9	57%	0.57	45%	0.454	S	S	*	.	G	3₁₀ helix	trans	-105.6	5.8	172.3	-62.9	-163.6	163.7	0	0	114.1	L349 C432 K433	L349-E435 WeakPolarHBondContact CB-O 3.49Å; L349-E435 WeakPolarHBondContact CG-O 3.49Å; L349-E435 PolarHBondContact N-O 2.76Å; C432-E435 PolarHBondContact O-N 3.3Å; C432-E435 VanDerWaalsContact O-N 3.08Å; K433-E435 PolarHBondContact O-N 2.7Å
436	S	84.3	Confident	69.6	Low	31 Å²	31	84.2 Å²	84.2	22%	0.217	42%	0.419	C	S	.	.	B	Isolated β-bridge	trans	-85.7	158.1	-179.4	69.5	0	0	0	0	113.2	K433	K433-S436 WeakPolarHBondContact O-CB 3.48Å; K433-S436 PolarHBondContact O-N 3.46Å; K433-S436 PolarHBondContact O-OG 2.96Å
437	V	86.4	Confident	72.2	Confident	1 Å²	1	80.3 Å²	80.3	1%	0.006	40%	0.404	C	S	.	.	P	Polyproline II helix	trans	-99.9	121.4	169.6	-165.9	0	0	0	0	108	P347 L349 L355 D441 F442	P347-V437 WeakPolarHBondContact CD-O 3.45Å; P347-V437 HydrophobicContact CG-CB 4.22Å; P347-V437 PolarHBondContact O-N 2.91Å; L349-V437 HydrophobicContact CB-CG2 4.4Å; L349-V437 HydrophobicContact CD2-CG2 3.51Å; L349-V437 HydrophobicContact CG-CG2 3.67Å; L355-V437 HydrophobicContact CD2-CG1 4.12Å; L355-V437 HydrophobicContact CD2-CG2 3.87Å; V437-D441 HydrophobicContact CG1-CB 4.05Å; V437-F442 HydrophobicContact CB-CB 4.5Å; V437-F442 HydrophobicContact CG1-CB 3.85Å
438	D	88	Confident	74.7	Confident	93 Å²	93	85.7 Å²	85.7	50%	0.497	42%	0.416	S	S	.	.	P	Polyproline II helix	trans	-59.4	148	170.3	170.7	73.2	0	0	0	111.5	E440 D441 F442	D438-E440 VanDerWaalsContact C-N 3.25Å; D438-E440 PolarHBondContact O-N 3.05Å; D438-E440 VanDerWaalsContact OD2-CB 3.24Å; D438-E440 WeakPolarHBondContact OD2-CB 3.29Å; D438-E440 PolarHBondContact OD2-N 2.81Å; D438-D441 HydrophobicContact CB-CB 4.4Å; D438-D441 PolarHBondContact O-N 3.48Å; D438-F442 WeakPolarHBondContact O-CB 3.45Å; D438-F442 PolarHBondContact O-N 2.97Å
439	L	85.4	Confident	77.1	Confident	37 Å²	37	86.8 Å²	86.8	19%	0.194	42%	0.416	C	S	.	.	H	α-helix	trans	-55.5	-35	-176.9	-176.5	64.4	0	0	0	113.9	H314 N315 R443	H314-L439 VanDerWaalsContact CE1-CD1 3.49Å; H314-L439 WeakPolarHBondContact CE1-CD1 3.5Å; N315-L439 HydrophobicContact CB-CD1 4.19Å; N315-L439 HydrophobicContact CB-CD2 4.22Å; L439-R443 WeakPolarHBondContact O-CG 3.49Å; L439-R443 PolarHBondContact O-N 2.83Å
440	E	86.4	Confident	79.3	Confident	79 Å²	79	86.9 Å²	86.9	37%	0.369	41%	0.41	S	S	.	.	H	α-helix	trans	-78	-41.7	180	179.8	60	-165.4	0	0	111.5	D438 F442 R443 R444	D438-E440 VanDerWaalsContact C-N 3.25Å; D438-E440 PolarHBondContact O-N 3.05Å; D438-E440 VanDerWaalsContact OD2-CB 3.24Å; D438-E440 WeakPolarHBondContact OD2-CB 3.29Å; D438-E440 PolarHBondContact OD2-N 2.81Å; E440-F442 VanDerWaalsContact C-N 3.26Å; E440-F442 PolarHBondContact O-N 3.12Å; E440-R443 PolarHBondContact O-N 2.84Å; E440-R443 IonicContact OE2-NH1 2.8Å; E440-R444 VanDerWaalsContact O-CG 3.29Å; E440-R444 WeakPolarHBondContact O-CG 3.18Å; E440-R444 PolarHBondContact O-N 2.84Å; E440-R444 IonicContact OE1-CZ 2.82Å; E440-R444 IonicContact OE1-NE 3.13Å; E440-R444 PolarHBondContact OE1-NE 2.94Å; E440-R444 IonicContact OE1-NH2 2.73Å; E440-R444 PolarHBondContact OE1-NH2 3.15Å
441	D	87.6	Confident	81.3	Confident	71 Å²	71	84.3 Å²	84.3	38%	0.38	40%	0.4	S	S	.	.	H	α-helix	trans	-60.8	-38.4	172.8	-132.9	36.8	0	0	0	110.7	K359 V437 D438 Y445	K359-D441 IonicContact NZ-OD2 3.84Å; K359-D441 PolarHBondContact NZ-OD2 2.88Å; V437-D441 HydrophobicContact CG1-CB 4.05Å; D438-D441 HydrophobicContact CB-CB 4.4Å; D438-D441 PolarHBondContact O-N 3.48Å; D441-Y445 PolarHBondContact O-N 3.46Å; D441-Y445 VanDerWaalsContact O-N 3.17Å
442	F	88.8	Confident	83	Confident	5 Å²	5	83.8 Å²	83.8	2%	0.022	39%	0.392	C	S	.	.	H	α-helix	trans	-67.6	-43.5	175	-173.7	-150.8	0	0	0	112.3	H314 S316 W331 P347 I352 V437 D438 E440 Y445 L446	H314-F442 AromaticContact ND1-CE1 3.9Å; S316-F442 VanDerWaalsContact OG-CE1 3.29Å; S316-F442 WeakPolarHBondContact OG-CE1 3.45Å; W331-F442 HydrophobicContact CH2-CE1 4.24Å; W331-F442 HydrophobicContact CZ2-CE1 4.13Å; W331-F442 HydrophobicContact CZ2-CZ 4.38Å; P347-F442 HydrophobicContact CG-CD1 3.73Å; P347-F442 HydrophobicContact CG-CE1 3.87Å; P347-F442 HydrophobicContact CG-CG 4.18Å; P347-F442 HydrophobicContact CG-CZ 4.43Å; I352-F442 HydrophobicContact CD1-CD2 3.8Å; I352-F442 HydrophobicContact CD1-CE2 3.36Å; I352-F442 HydrophobicContact CD1-CZ 3.94Å; I352-F442 HydrophobicContact CG1-CE2 4.33Å; V437-F442 HydrophobicContact CB-CB 4.5Å; V437-F442 HydrophobicContact CG1-CB 3.85Å; D438-F442 WeakPolarHBondContact O-CB 3.45Å; D438-F442 PolarHBondContact O-N 2.97Å; E440-F442 VanDerWaalsContact C-N 3.26Å; E440-F442 PolarHBondContact O-N 3.12Å; F442-Y445 WeakPolarHBondContact O-CB 3.4Å; F442-Y445 PolarHBondContact O-N 3.15Å; F442-L446 HydrophobicContact CD1-CD1 4.11Å; F442-L446 HydrophobicContact CD2-CD1 3.72Å; F442-L446 HydrophobicContact CD2-CD2 4.44Å; F442-L446 HydrophobicContact CD2-CG 3.87Å; F442-L446 HydrophobicContact CE1-CD1 4Å; F442-L446 HydrophobicContact CE2-CD1 3.56Å; F442-L446 HydrophobicContact CE2-CD2 3.83Å; F442-L446 HydrophobicContact CE2-CG 3.73Å; F442-L446 HydrophobicContact CG-CD1 3.99Å; F442-L446 HydrophobicContact CZ-CD1 3.73Å; F442-L446 HydrophobicContact CZ-CD2 4.35Å; F442-L446 HydrophobicContact CZ-CG 4.34Å; F442-L446 VanDerWaalsContact O-CG 3.24Å; F442-L446 WeakPolarHBondContact O-CG 3.39Å; F442-L446 PolarHBondContact O-N 3.45Å
443	R	87.6	Confident	84.7	Confident	64 Å²	64	84.7 Å²	84.7	24%	0.242	39%	0.389	C	S	.	.	H	α-helix	trans	-58.7	-48.9	173.6	-78.3	-170.4	-168.9	108.4	4.5	111.9	N315 L439 E440 Y445 L446 E447	N315-R443 PolarHBondContact O-NH2 3.28Å; L439-R443 WeakPolarHBondContact O-CG 3.49Å; L439-R443 PolarHBondContact O-N 2.83Å; E440-R443 PolarHBondContact O-N 2.84Å; E440-R443 IonicContact OE2-NH1 2.8Å; R443-Y445 PolarHBondContact O-N 3.43Å; R443-Y445 VanDerWaalsContact O-N 3.15Å; R443-L446 CarbonylContact O-C 3.58Å; R443-L446 WeakPolarHBondContact O-CA 3.24Å; R443-L446 PolarHBondContact O-N 2.85Å; R443-E447 WeakPolarHBondContact O-CG 3.47Å; R443-E447 PolarHBondContact O-N 2.85Å
444	R	89.2	Confident	86.1	Confident	131 Å²	131	83.1 Å²	83.1	49%	0.494	38%	0.384	S	S	.	.	H	α-helix	trans	-61.4	-24.3	179.1	-69	167.3	-178.5	-161.2	-0.3	113.9	E440 K448	E440-R444 VanDerWaalsContact O-CG 3.29Å; E440-R444 WeakPolarHBondContact O-CG 3.18Å; E440-R444 PolarHBondContact O-N 2.84Å; E440-R444 IonicContact OE1-CZ 2.82Å; E440-R444 IonicContact OE1-NE 3.13Å; E440-R444 PolarHBondContact OE1-NE 2.94Å; E440-R444 IonicContact OE1-NH2 2.73Å; E440-R444 PolarHBondContact OE1-NH2 3.15Å; R444-K448 WeakPolarHBondContact O-CD 3.28Å; R444-K448 WeakPolarHBondContact O-CE 3.45Å; R444-K448 WeakPolarHBondContact O-CG 3.47Å
445	Y	90.4	Very high	87.1	Confident	30 Å²	30	78.5 Å²	78.5	12%	0.118	36%	0.361	C	S	.	.	H	α-helix	trans	-76.5	-44.8	169.7	176	-101.8	0	0	0	111.9	I352 C354 L355 D441 F442 R443 K448	I352-Y445 HydrophobicContact CG2-CE1 4.02Å; C354-Y445 PolarHBondContact SG-OH 3.07Å; L355-Y445 HydrophobicContact CB-CD1 4.43Å; L355-Y445 HydrophobicContact CB-CD2 4.34Å; L355-Y445 HydrophobicContact CB-CE1 4.12Å; L355-Y445 HydrophobicContact CB-CE2 3.99Å; L355-Y445 HydrophobicContact CD1-CD2 3.68Å; L355-Y445 HydrophobicContact CD1-CE2 4.01Å; L355-Y445 HydrophobicContact CD1-CG 4.08Å; L355-Y445 HydrophobicContact CD2-CD1 4.32Å; L355-Y445 HydrophobicContact CD2-CG 4.23Å; L355-Y445 HydrophobicContact CG-CD2 4.41Å; D441-Y445 PolarHBondContact O-N 3.46Å; D441-Y445 VanDerWaalsContact O-N 3.17Å; F442-Y445 WeakPolarHBondContact O-CB 3.4Å; F442-Y445 PolarHBondContact O-N 3.15Å; R443-Y445 PolarHBondContact O-N 3.43Å; R443-Y445 VanDerWaalsContact O-N 3.15Å; Y445-K448 PolarHBondContact O-N 3.15Å
446	L	89.8	Confident	87.2	Confident	8 Å²	8	76.5 Å²	76.5	4%	0.042	36%	0.358	C	S	.	.	H	α-helix	trans	-70.1	-39.9	-177.5	-68	166.2	0	0	0	113.3	I318 F442 R443 K448 R449 F450 F452	I318-L446 HydrophobicContact CD1-CD2 4.26Å; I318-L446 HydrophobicContact CG1-CD1 3.59Å; I318-L446 HydrophobicContact CG1-CD2 3.88Å; I318-L446 HydrophobicContact CG1-CG 4.23Å; F442-L446 HydrophobicContact CD1-CD1 4.11Å; F442-L446 HydrophobicContact CD2-CD1 3.72Å; F442-L446 HydrophobicContact CD2-CD2 4.44Å; F442-L446 HydrophobicContact CD2-CG 3.87Å; F442-L446 HydrophobicContact CE1-CD1 4Å; F442-L446 HydrophobicContact CE2-CD1 3.56Å; F442-L446 HydrophobicContact CE2-CD2 3.83Å; F442-L446 HydrophobicContact CE2-CG 3.73Å; F442-L446 HydrophobicContact CG-CD1 3.99Å; F442-L446 HydrophobicContact CZ-CD1 3.73Å; F442-L446 HydrophobicContact CZ-CD2 4.35Å; F442-L446 HydrophobicContact CZ-CG 4.34Å; F442-L446 VanDerWaalsContact O-CG 3.24Å; F442-L446 WeakPolarHBondContact O-CG 3.39Å; F442-L446 PolarHBondContact O-N 3.45Å; R443-L446 CarbonylContact O-C 3.58Å; R443-L446 WeakPolarHBondContact O-CA 3.24Å; R443-L446 PolarHBondContact O-N 2.85Å; L446-K448 PolarHBondContact O-N 3.3Å; L446-K448 VanDerWaalsContact O-N 3.14Å; L446-R449 CarbonylContact O-C 3.58Å; L446-R449 WeakPolarHBondContact O-CA 3.36Å; L446-R449 PolarHBondContact O-N 3.49Å; L446-F450 HydrophobicContact CB-CD2 4.26Å; L446-F450 HydrophobicContact CD2-CD2 3.75Å; L446-F450 HydrophobicContact CD2-CE2 3.63Å; L446-F450 PolarHBondContact O-N 3.26Å; L446-F452 HydrophobicContact CB-CE2 4.06Å; L446-F452 HydrophobicContact CB-CZ 3.91Å
447	E	89.9	Confident	86.8	Confident	114 Å²	114	77 Å²	77	53%	0.533	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-21.9	177.6	-71.6	167.1	173.3	0	0	112.8	R443 R449 F452	R443-E447 WeakPolarHBondContact O-CG 3.47Å; R443-E447 PolarHBondContact O-N 2.85Å; E447-R449 VanDerWaalsContact C-N 3.27Å; E447-F452 HydrophobicContact CG-CD2 4.12Å; E447-F452 HydrophobicContact CG-CE2 4.08Å
448	K	91.4	Very high	86.3	Confident	173 Å²	173	82.1 Å²	82.1	75%	0.752	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.8	3.5	173.9	-63.7	172.8	-173.1	171.6	0	113.1	R444 Y445 L446	R444-K448 WeakPolarHBondContact O-CD 3.28Å; R444-K448 WeakPolarHBondContact O-CE 3.45Å; R444-K448 WeakPolarHBondContact O-CG 3.47Å; Y445-K448 PolarHBondContact O-N 3.15Å; L446-K448 PolarHBondContact O-N 3.3Å; L446-K448 VanDerWaalsContact O-N 3.14Å
449	R	88.8	Confident	85.4	Confident	177 Å²	177	84.2 Å²	84.2	67%	0.668	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-135.4	-23	-173.7	-66	-62.1	-170	173.2	0.9	114.1	L446 E447	L446-R449 CarbonylContact O-C 3.58Å; L446-R449 WeakPolarHBondContact O-CA 3.36Å; L446-R449 PolarHBondContact O-N 3.49Å; E447-R449 VanDerWaalsContact C-N 3.27Å
450	F	90.4	Very high	84.8	Confident	88 Å²	88	83.8 Å²	83.8	39%	0.386	38%	0.383	S	S	.	.			trans	-138.4	141.6	-171.5	-63.2	-75.9	0	0	0	111.9	L294 I318 L446 F452	L294-F450 HydrophobicContact CD1-CB 3.72Å; L294-F450 HydrophobicContact CD1-CD1 3.72Å; L294-F450 HydrophobicContact CD1-CG 3.98Å; I318-F450 HydrophobicContact CD1-CB 4.42Å; I318-F450 HydrophobicContact CD1-CD2 3.93Å; I318-F450 HydrophobicContact CD1-CE2 4.31Å; I318-F450 HydrophobicContact CD1-CG 4.04Å; L446-F450 HydrophobicContact CB-CD2 4.26Å; L446-F450 HydrophobicContact CD2-CD2 3.75Å; L446-F450 HydrophobicContact CD2-CE2 3.63Å; L446-F450 PolarHBondContact O-N 3.26Å; F450-F452 HydrophobicContact CB-CE2 3.97Å; F450-F452 HydrophobicContact CB-CZ 4.23Å; F450-F452 WeakPolarHBondContact O-CD2 3.49Å
451	D	89.2	Confident	84	Confident	74 Å²	74	88.9 Å²	88.9	40%	0.396	40%	0.399	S	S	.	.			trans	-77.6	134	167.7	-58.6	-19.7	0	0	0	109.8	K295 R297	K295-D451 HydrophobicContact CB-CB 3.95Å; K295-D451 WeakPolarHBondContact CB-O 3.49Å; K295-D451 HydrophobicContact CD-CB 4.22Å; K295-D451 PolarHBondContact N-O 3.14Å; R297-D451 IonicContact CZ-OD2 3.57Å; R297-D451 IonicContact NE-OD2 2.81Å; R297-D451 PolarHBondContact NE-OD2 3.01Å; R297-D451 IonicContact NH2-OD1 2.75Å; R297-D451 IonicContact NH2-OD2 3.2Å; R297-D451 PolarHBondContact NH2-OD2 3.26Å
452	F	88.9	Confident	83.2	Confident	51 Å²	51	88.8 Å²	88.8	22%	0.224	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	149.2	174.4	-70	-83.7	0	0	0	111.8	T292 V293 S316 I318 L446 E447 F450	T292-F452 HydrophobicContact CG2-CB 3.64Å; T292-F452 HydrophobicContact CG2-CD1 3.78Å; T292-F452 HydrophobicContact CG2-CG 3.88Å; V293-F452 WeakPolarHBondContact O-CA 2.73Å; S316-F452 WeakPolarHBondContact O-CE1 3.26Å; I318-F452 HydrophobicContact CD1-CE1 3.79Å; I318-F452 HydrophobicContact CD1-CZ 3.65Å; I318-F452 HydrophobicContact CG1-CE1 4.17Å; I318-F452 HydrophobicContact CG1-CZ 4.03Å; L446-F452 HydrophobicContact CB-CE2 4.06Å; L446-F452 HydrophobicContact CB-CZ 3.91Å; E447-F452 HydrophobicContact CG-CD2 4.12Å; E447-F452 HydrophobicContact CG-CE2 4.08Å; F450-F452 HydrophobicContact CB-CE2 3.97Å; F450-F452 HydrophobicContact CB-CZ 4.23Å; F450-F452 WeakPolarHBondContact O-CD2 3.49Å
453	E	87.6	Confident	81.7	Confident	101 Å²	101	94.7 Å²	94.7	47%	0.472	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	145.7	174.5	-167.1	167	145.4	0	0	110.6	T292 V293	T292-E453 WeakPolarHBondContact CA-O 3.45Å; V293-E453 PolarHBondContact N-O 2.86Å; V293-E453 PolarHBondContact O-N 3.01Å
454	Q	84.3	Confident	80.5	Confident	139 Å²	139	94.1 Å²	94.1	65%	0.65	43%	0.432	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.8	89.4	-178.8	-76.8	-172.8	58.1	0	0	110.4	I290	I290-Q454 HydrophobicContact CG2-CB 3.66Å; I290-Q454 HydrophobicContact CG2-CG 3.99Å
455	V	79.9	Confident	79.7	Confident	59 Å²	59	90.3 Å²	90.3	36%	0.358	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	127.5	-179.6	176.4	0	0	0	0	110.2	K291 V293 V457	K291-V455 PolarHBondContact N-O 2.64Å; K291-V455 PolarHBondContact O-N 2.89Å; V293-V455 HydrophobicContact CG2-CB 4.3Å; V293-V455 HydrophobicContact CG2-CG2 3.58Å; V455-V457 HydrophobicContact CG1-CG2 4.08Å; V455-V457 PolarHBondContact O-N 3.31Å; V455-V457 VanDerWaalsContact O-N 3.09Å
456	T	77.9	Confident	78.7	Confident	81 Å²	81	90.7 Å²	90.7	50%	0.497	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	87.8	175.6	-62	0	0	0	0	110.3	T288	T288-T456 HydrophobicContact CG2-CG2 3.7Å
457	V	74.3	Confident	77.7	Confident	42 Å²	42	96.1 Å²	96.1	26%	0.255	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	127.2	177.9	-176.6	0	0	0	0	109.7	K289 K291 V455 K459	K289-V457 PolarHBondContact N-O 3.2Å; K289-V457 PolarHBondContact O-N 2.81Å; K291-V457 HydrophobicContact CB-CG2 3.77Å; K291-V457 HydrophobicContact CD-CG2 4.19Å; V455-V457 HydrophobicContact CG1-CG2 4.08Å; V455-V457 PolarHBondContact O-N 3.31Å; V455-V457 VanDerWaalsContact O-N 3.09Å; V457-K459 PolarHBondContact O-N 3.38Å
458	K	76.5	Confident	77	Confident	108 Å²	108	96.2 Å²	96.2	47%	0.47	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	101.2	-179.2	-80.2	165.4	159.5	-173.1	0	110.1	M286 T288	M286-K458 HydrophobicContact CE-CB 3.56Å; M286-K458 HydrophobicContact CE-CD 3.54Å; M286-K458 HydrophobicContact CE-CG 3.71Å; T288-K458 HydrophobicContact CG2-CG 4.06Å
459	K	68.3	Low	76.3	Confident	136 Å²	136	91 Å²	91	59%	0.591	42%	0.419	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.3	121.9	-179.6	-174.6	158.3	-173.6	160.9	0	111.8	M287 V457	M287-K459 PolarHBondContact N-O 2.82Å; M287-K459 VanDerWaalsContact N-O 3.12Å; M287-K459 WeakPolarHBondContact O-CA 3.36Å; M287-K459 PolarHBondContact O-N 3.41Å; V457-K459 PolarHBondContact O-N 3.38Å
460	F	73.5	Confident	75.7	Confident	29 Å²	29	86.2 Å²	86.2	13%	0.127	41%	0.407	C	S	.	.			trans	-88.1	157	169.5	-55.6	-88.8	0	0	0	110.2	M286 E465 R466 F469	M286-F460 HydrophobicContact CE-CE1 3.6Å; M286-F460 HydrophobicContact CE-CE2 4.22Å; M286-F460 HydrophobicContact CE-CZ 3.37Å; M286-F460 HydrophobicContact CG-CD1 4.28Å; M286-F460 HydrophobicContact CG-CE1 4.02Å; M286-F460 HydrophobicContact SD-CD1 4.44Å; M286-F460 HydrophobicContact SD-CE1 3.65Å; M286-F460 HydrophobicContact SD-CZ 4.09Å; F460-E465 HydrophobicContact CB-CB 4.17Å; F460-E465 HydrophobicContact CD1-CB 3.91Å; F460-E465 HydrophobicContact CG-CB 4.43Å; F460-R466 HydrophobicContact CB-CB 4.22Å; F460-R466 HydrophobicContact CD1-CB 4.29Å; F460-R466 HydrophobicContact CD2-CB 3.52Å; F460-R466 HydrophobicContact CD2-CG 3.71Å; F460-R466 HydrophobicContact CE2-CB 3.86Å; F460-R466 HydrophobicContact CE2-CG 3.66Å; F460-R466 HydrophobicContact CG-CB 3.74Å; F460-R466 HydrophobicContact CG-CG 4.43Å; F460-R466 HydrophobicContact CZ-CB 4.35Å; F460-R466 HydrophobicContact CZ-CG 4.34Å; F460-F469 HydrophobicContact CE1-CB 3.5Å; F460-F469 HydrophobicContact CE1-CD1 4.19Å; F460-F469 HydrophobicContact CE1-CD2 4.38Å; F460-F469 AromaticContact CE1-CG 3.76Å; F460-F469 HydrophobicContact CE1-CG 3.76Å; F460-F469 HydrophobicContact CZ-CB 3.79Å; F460-F469 AromaticContact CZ-CD1 3.69Å; F460-F469 HydrophobicContact CZ-CD1 3.69Å; F460-F469 HydrophobicContact CZ-CE1 4.49Å; F460-F469 AromaticContact CZ-CG 3.77Å; F460-F469 HydrophobicContact CZ-CG 3.77Å
461	R	70.6	Confident	75	Confident	185 Å²	185	89.7 Å²	89.7	70%	0.698	42%	0.417	S	S	*	.	S	Bend	trans	-80.7	-32	172.8	-63.7	-173.1	63.6	144.8	4	111.3	E465	R461-E465 WeakPolarHBondContact CA-OE2 3.33Å; R461-E465 WeakPolarHBondContact CB-OE2 3.43Å; R461-E465 PolarHBondContact N-OE2 2.86Å
462	T	70.5	Confident	74.5	Confident	69 Å²	69	88.9 Å²	88.9	42%	0.423	41%	0.411	S	S	.	.	S	Bend	trans	-133.4	157.5	177.3	69.9	0	0	0	0	113.9	A464 E465 R466	T462-A464 PolarHBondContact O-N 2.84Å; T462-A464 PolarHBondContact OG1-N 2.92Å; T462-E465 VanDerWaalsContact CB-OE1 3.3Å; T462-E465 WeakPolarHBondContact CB-OE1 3.42Å; T462-E465 VanDerWaalsContact CG2-OE1 3.29Å; T462-E465 WeakPolarHBondContact CG2-OE1 3.3Å; T462-E465 VanDerWaalsContact N-CD 3.35Å; T462-E465 PolarHBondContact N-OE1 2.86Å; T462-E465 PolarHBondContact N-OE2 2.84Å; T462-E465 PolarHBondContact O-N 3.03Å; T462-E465 WeakPolarHBondContact OG1-CG 3.32Å; T462-E465 PolarHBondContact OG1-N 2.85Å; T462-E465 PolarHBondContact OG1-OE1 3.14Å; T462-R466 PolarHBondContact O-N 3.15Å
463	W	55.9	Low	73.9	Confident	130 Å²	130	91.1 Å²	91.1	49%	0.492	42%	0.423	S	S	.	.	H	α-helix	trans	-67.7	-15.4	171.4	-170.9	-140.3	0	0	0	113	R466 R467	W463-R466 HydrophobicContact CE3-CB 4.15Å; W463-R466 HydrophobicContact CE3-CG 4.22Å; W463-R466 HydrophobicContact CZ3-CG 4.08Å; W463-R467 VanDerWaalsContact CD1-NH1 3.28Å; W463-R467 VanDerWaalsContact CD1-NH2 3.34Å; W463-R467 VanDerWaalsContact NE1-NH2 3.17Å; W463-R467 WeakPolarHBondContact O-CG 3.41Å; W463-R467 PolarHBondContact O-N 3.43Å; W463-R467 PolarHBondContact O-NH1 3.48Å; W463-R467 VanDerWaalsContact O-NH1 3.07Å
464	A	63.9	Low	73.2	Confident	52 Å²	52	93.8 Å²	93.8	43%	0.43	43%	0.433	S	S	.	.	H	α-helix	trans	-72.6	-48.9	171.8	0	0	0	0	0	110.9	T462 R466 R467 Q468	T462-A464 PolarHBondContact O-N 2.84Å; T462-A464 PolarHBondContact OG1-N 2.92Å; A464-R466 PolarHBondContact O-N 3.44Å; A464-R467 PolarHBondContact O-N 3.32Å; A464-Q468 WeakPolarHBondContact O-CG 3.43Å; A464-Q468 PolarHBondContact O-N 2.97Å
465	E	72.3	Confident	72.6	Confident	51 Å²	51	94 Å²	94	24%	0.238	43%	0.428	C	S	.	.	H	α-helix	trans	-57.7	-47.7	176.2	-67.4	146.1	-129.5	0	0	111.8	F460 R461 T462 R467 Q468 F469	F460-E465 HydrophobicContact CB-CB 4.17Å; F460-E465 HydrophobicContact CD1-CB 3.91Å; F460-E465 HydrophobicContact CG-CB 4.43Å; R461-E465 WeakPolarHBondContact CA-OE2 3.33Å; R461-E465 WeakPolarHBondContact CB-OE2 3.43Å; R461-E465 PolarHBondContact N-OE2 2.86Å; T462-E465 VanDerWaalsContact CB-OE1 3.3Å; T462-E465 WeakPolarHBondContact CB-OE1 3.42Å; T462-E465 VanDerWaalsContact CG2-OE1 3.29Å; T462-E465 WeakPolarHBondContact CG2-OE1 3.3Å; T462-E465 VanDerWaalsContact N-CD 3.35Å; T462-E465 PolarHBondContact N-OE1 2.86Å; T462-E465 PolarHBondContact N-OE2 2.84Å; T462-E465 PolarHBondContact O-N 3.03Å; T462-E465 WeakPolarHBondContact OG1-CG 3.32Å; T462-E465 PolarHBondContact OG1-N 2.85Å; T462-E465 PolarHBondContact OG1-OE1 3.14Å; E465-R467 VanDerWaalsContact C-N 3.34Å; E465-R467 PolarHBondContact O-N 3.11Å; E465-Q468 WeakPolarHBondContact O-CB 3.41Å; E465-Q468 PolarHBondContact O-N 3.39Å; E465-F469 PolarHBondContact O-N 2.84Å
466	R	69.5	Low	72.3	Confident	38 Å²	38	97 Å²	97	14%	0.143	44%	0.437	C	S	.	.	H	α-helix	trans	-58	-44.2	178.7	-177.1	161.3	163.2	131.3	-11.9	111.9	D242 D243 F460 T462 W463 A464 N470	D242-R466 IonicContact OD2-CZ 3.25Å; D242-R466 IonicContact OD2-NH1 3.82Å; D242-R466 PolarHBondContact OD2-NH1 3.32Å; D242-R466 IonicContact OD2-NH2 2.81Å; D242-R466 PolarHBondContact OD2-NH2 3.32Å; D243-R466 IonicContact OD1-CZ 2.71Å; D243-R466 IonicContact OD1-NE 2.67Å; D243-R466 PolarHBondContact OD1-NE 3.32Å; D243-R466 IonicContact OD1-NH2 2.97Å; D243-R466 PolarHBondContact OD1-NH2 3.39Å; F460-R466 HydrophobicContact CB-CB 4.22Å; F460-R466 HydrophobicContact CD1-CB 4.29Å; F460-R466 HydrophobicContact CD2-CB 3.52Å; F460-R466 HydrophobicContact CD2-CG 3.71Å; F460-R466 HydrophobicContact CE2-CB 3.86Å; F460-R466 HydrophobicContact CE2-CG 3.66Å; F460-R466 HydrophobicContact CG-CB 3.74Å; F460-R466 HydrophobicContact CG-CG 4.43Å; F460-R466 HydrophobicContact CZ-CB 4.35Å; F460-R466 HydrophobicContact CZ-CG 4.34Å; T462-R466 PolarHBondContact O-N 3.15Å; W463-R466 HydrophobicContact CE3-CB 4.15Å; W463-R466 HydrophobicContact CE3-CG 4.22Å; W463-R466 HydrophobicContact CZ3-CG 4.08Å; A464-R466 PolarHBondContact O-N 3.44Å; R466-N470 WeakPolarHBondContact O-CB 3.45Å; R466-N470 PolarHBondContact O-N 3.09Å
467	R	68.9	Low	71.9	Confident	122 Å²	122	98.4 Å²	98.4	46%	0.46	44%	0.437	S	S	.	.	H	α-helix	trans	-70.8	-27.3	175	-69.4	-160.6	-147.5	91.9	-31.2	113.6	W463 A464 E465 R471	W463-R467 VanDerWaalsContact CD1-NH1 3.28Å; W463-R467 VanDerWaalsContact CD1-NH2 3.34Å; W463-R467 VanDerWaalsContact NE1-NH2 3.17Å; W463-R467 WeakPolarHBondContact O-CG 3.41Å; W463-R467 PolarHBondContact O-N 3.43Å; W463-R467 PolarHBondContact O-NH1 3.48Å; W463-R467 VanDerWaalsContact O-NH1 3.07Å; A464-R467 PolarHBondContact O-N 3.32Å; E465-R467 VanDerWaalsContact C-N 3.34Å; E465-R467 PolarHBondContact O-N 3.11Å; R467-R471 WeakPolarHBondContact O-CB 3.41Å; R467-R471 WeakPolarHBondContact O-CG 3.47Å; R467-R471 PolarHBondContact O-N 2.88Å; R467-R471 PolarHBondContact O-NE 2.82Å
468	Q	75.1	Confident	71.3	Confident	116 Å²	116	98.6 Å²	98.6	54%	0.542	44%	0.444	S	S	.	.	H	α-helix	trans	-71.2	-49.6	171.9	-77.6	172.4	-36.1	0	0	110.5	A464 E465 N470 R471 E472	A464-Q468 WeakPolarHBondContact O-CG 3.43Å; A464-Q468 PolarHBondContact O-N 2.97Å; E465-Q468 WeakPolarHBondContact O-CB 3.41Å; E465-Q468 PolarHBondContact O-N 3.39Å; Q468-N470 PolarHBondContact O-N 3.39Å; Q468-R471 PolarHBondContact O-N 3.4Å; Q468-E472 WeakPolarHBondContact O-CB 3.48Å; Q468-E472 PolarHBondContact O-N 3.49Å
469	F	75.6	Confident	70.6	Confident	62 Å²	62	98 Å²	98	27%	0.272	44%	0.443	S	S	.	.	H	α-helix	trans	-58.2	-46.2	177.2	-178.9	-91.3	0	0	0	112.5	M286 F460 E465 R471 E472 M473	M286-F469 HydrophobicContact CE-CD1 4.07Å; M286-F469 HydrophobicContact CE-CD2 3.96Å; M286-F469 HydrophobicContact CE-CE1 3.89Å; M286-F469 HydrophobicContact CE-CE2 3.78Å; M286-F469 HydrophobicContact CE-CG 4.12Å; M286-F469 HydrophobicContact CE-CZ 3.76Å; M286-F469 HydrophobicContact SD-CD2 3.72Å; M286-F469 HydrophobicContact SD-CE2 3.77Å; M286-F469 HydrophobicContact SD-CG 4.27Å; M286-F469 HydrophobicContact SD-CZ 4.37Å; F460-F469 HydrophobicContact CE1-CB 3.5Å; F460-F469 HydrophobicContact CE1-CD1 4.19Å; F460-F469 HydrophobicContact CE1-CD2 4.38Å; F460-F469 AromaticContact CE1-CG 3.76Å; F460-F469 HydrophobicContact CE1-CG 3.76Å; F460-F469 HydrophobicContact CZ-CB 3.79Å; F460-F469 AromaticContact CZ-CD1 3.69Å; F460-F469 HydrophobicContact CZ-CD1 3.69Å; F460-F469 HydrophobicContact CZ-CE1 4.49Å; F460-F469 AromaticContact CZ-CG 3.77Å; F460-F469 HydrophobicContact CZ-CG 3.77Å; E465-F469 PolarHBondContact O-N 2.84Å; F469-R471 VanDerWaalsContact C-N 3.33Å; F469-R471 PolarHBondContact O-N 3.28Å; F469-E472 PolarHBondContact O-N 2.89Å; F469-E472 VanDerWaalsContact O-N 3.15Å; F469-M473 HydrophobicContact CD1-CG 4Å; F469-M473 HydrophobicContact CE1-CG 3.46Å; F469-M473 VanDerWaalsContact CE1-CG 3.46Å; F469-M473 HydrophobicContact CE1-SD 4.31Å; F469-M473 HydrophobicContact CE2-CG 4.13Å; F469-M473 HydrophobicContact CE2-SD 4.26Å; F469-M473 HydrophobicContact CZ-CG 3.52Å; F469-M473 HydrophobicContact CZ-SD 3.78Å; F469-M473 WeakPolarHBondContact O-CG 3.39Å; F469-M473 PolarHBondContact O-N 2.89Å
470	N	76.1	Confident	69.9	Low	78 Å²	78	96.1 Å²	96.1	42%	0.417	45%	0.447	S	S	.	.	H	α-helix	trans	-66.7	-33.3	178.9	-73.5	-3.6	0	0	0	112.6	R466 Q468 K474	R466-N470 WeakPolarHBondContact O-CB 3.45Å; R466-N470 PolarHBondContact O-N 3.09Å; Q468-N470 PolarHBondContact O-N 3.39Å; N470-K474 WeakPolarHBondContact O-CB 3.29Å; N470-K474 WeakPolarHBondContact O-CG 3.38Å; N470-K474 PolarHBondContact O-N 3.35Å; N470-K474 VanDerWaalsContact O-N 3.11Å
471	R	76.4	Confident	69.1	Low	160 Å²	160	100.8 Å²	100.8	60%	0.604	47%	0.469	S	S	*	.	H	α-helix	trans	-69.9	-37.2	171	-78.2	179.7	-69.1	177.8	0.9	111.9	R467 Q468 F469 K474 R475	R467-R471 WeakPolarHBondContact O-CB 3.41Å; R467-R471 WeakPolarHBondContact O-CG 3.47Å; R467-R471 PolarHBondContact O-N 2.88Å; R467-R471 PolarHBondContact O-NE 2.82Å; Q468-R471 PolarHBondContact O-N 3.4Å; F469-R471 VanDerWaalsContact C-N 3.33Å; F469-R471 PolarHBondContact O-N 3.28Å; R471-K474 PolarHBondContact O-N 3.02Å; R471-R475 VanDerWaalsContact O-CB 3.29Å; R471-R475 WeakPolarHBondContact O-CB 3.47Å; R471-R475 PolarHBondContact O-N 3.21Å
472	E	79.2	Confident	68.2	Low	57 Å²	57	99.1 Å²	99.1	27%	0.266	46%	0.462	S	S	.	.	H	α-helix	trans	-68.6	-41.6	178.1	-174.9	57.8	-162	0	0	112.3	Q468 F469 R475 K476	Q468-E472 WeakPolarHBondContact O-CB 3.48Å; Q468-E472 PolarHBondContact O-N 3.49Å; F469-E472 PolarHBondContact O-N 2.89Å; F469-E472 VanDerWaalsContact O-N 3.15Å; E472-R475 WeakPolarHBondContact O-CB 3.43Å; E472-R475 PolarHBondContact O-N 2.75Å; E472-R475 IonicContact OE1-CZ 3.52Å; E472-R475 IonicContact OE1-NE 2.74Å; E472-R475 IonicContact OE1-NH2 3.69Å; E472-R475 PolarHBondContact OE1-NH2 2.85Å; E472-R475 IonicContact OE2-CZ 3.13Å; E472-R475 IonicContact OE2-NE 2.68Å; E472-R475 PolarHBondContact OE2-NE 2.66Å; E472-R475 IonicContact OE2-NH2 2.83Å; E472-R475 PolarHBondContact OE2-NH2 2.77Å; E472-K476 WeakPolarHBondContact O-CG 3.48Å; E472-K476 PolarHBondContact O-N 2.96Å; E472-K476 WeakPolarHBondContact OE1-CE 3.17Å
473	M	75.4	Confident	67.1	Low	99 Å²	99	97.6 Å²	97.6	49%	0.488	45%	0.454	S	S	.	.	H	α-helix	trans	-63.1	-47	172.9	-71.9	-59.8	-59.1	0	0	111.4	F469 R475 K476 Q477	F469-M473 HydrophobicContact CD1-CG 4Å; F469-M473 HydrophobicContact CE1-CG 3.46Å; F469-M473 VanDerWaalsContact CE1-CG 3.46Å; F469-M473 HydrophobicContact CE1-SD 4.31Å; F469-M473 HydrophobicContact CE2-CG 4.13Å; F469-M473 HydrophobicContact CE2-SD 4.26Å; F469-M473 HydrophobicContact CZ-CG 3.52Å; F469-M473 HydrophobicContact CZ-SD 3.78Å; F469-M473 WeakPolarHBondContact O-CG 3.39Å; F469-M473 PolarHBondContact O-N 2.89Å; M473-R475 VanDerWaalsContact C-N 3.3Å; M473-R475 PolarHBondContact O-N 3.41Å; M473-K476 PolarHBondContact O-N 2.79Å; M473-Q477 WeakPolarHBondContact O-CB 3.47Å; M473-Q477 PolarHBondContact O-N 3.08Å
474	K	73.5	Confident	66.6	Low	156 Å²	156	98.4 Å²	98.4	68%	0.678	47%	0.466	S	S	*	.	H	α-helix	trans	-60.5	-38.1	173.2	-78.8	-170.4	173.3	-170.4	0	112.2	N470 R471 A478	N470-K474 WeakPolarHBondContact O-CB 3.29Å; N470-K474 WeakPolarHBondContact O-CG 3.38Å; N470-K474 PolarHBondContact O-N 3.35Å; N470-K474 VanDerWaalsContact O-N 3.11Å; R471-K474 PolarHBondContact O-N 3.02Å; K474-A478 VanDerWaalsContact O-CB 3.24Å; K474-A478 WeakPolarHBondContact O-CB 3.39Å; K474-A478 PolarHBondContact O-N 3.15Å
475	R	70.8	Confident	66	Low	143 Å²	143	98.9 Å²	98.9	54%	0.54	46%	0.461	S	S	.	.	H	α-helix	trans	-62	-53	175.3	-178	172.3	75.5	141.8	7	110.9	R471 E472 M473 Q477 A478 E479	R471-R475 VanDerWaalsContact O-CB 3.29Å; R471-R475 WeakPolarHBondContact O-CB 3.47Å; R471-R475 PolarHBondContact O-N 3.21Å; E472-R475 WeakPolarHBondContact O-CB 3.43Å; E472-R475 PolarHBondContact O-N 2.75Å; E472-R475 IonicContact OE1-CZ 3.52Å; E472-R475 IonicContact OE1-NE 2.74Å; E472-R475 IonicContact OE1-NH2 3.69Å; E472-R475 PolarHBondContact OE1-NH2 2.85Å; E472-R475 IonicContact OE2-CZ 3.13Å; E472-R475 IonicContact OE2-NE 2.68Å; E472-R475 PolarHBondContact OE2-NE 2.66Å; E472-R475 IonicContact OE2-NH2 2.83Å; E472-R475 PolarHBondContact OE2-NH2 2.77Å; M473-R475 VanDerWaalsContact C-N 3.3Å; M473-R475 PolarHBondContact O-N 3.41Å; R475-Q477 PolarHBondContact O-N 2.79Å; R475-A478 PolarHBondContact O-N 3.27Å; R475-E479 VanDerWaalsContact O-CB 3.22Å; R475-E479 WeakPolarHBondContact O-CB 3.4Å; R475-E479 PolarHBondContact O-N 2.86Å
476	K	74.3	Confident	65.1	Low	123 Å²	123	98.6 Å²	98.6	54%	0.535	46%	0.464	S	S	.	.	H	α-helix	trans	-62.9	-40.7	179.8	-74.5	-176.8	173.5	-179.5	0	112.6	E472 M473 E479 S480	E472-K476 WeakPolarHBondContact O-CG 3.48Å; E472-K476 PolarHBondContact O-N 2.96Å; E472-K476 WeakPolarHBondContact OE1-CE 3.17Å; M473-K476 PolarHBondContact O-N 2.79Å; K476-E479 PolarHBondContact O-N 3.35Å; K476-S480 PolarHBondContact O-N 3.22Å; K476-S480 PolarHBondContact O-OG 3.01Å
477	Q	69.2	Low	63.9	Low	110 Å²	110	102.3 Å²	102.3	51%	0.514	50%	0.502	S	S	.	.	H	α-helix	trans	-60.9	-54.6	173.7	179.8	176.4	-6.8	0	0	110.8	M473 R475 E479 S480 E481	M473-Q477 WeakPolarHBondContact O-CB 3.47Å; M473-Q477 PolarHBondContact O-N 3.08Å; R475-Q477 PolarHBondContact O-N 2.79Å; Q477-E479 PolarHBondContact O-N 3.49Å; Q477-E479 VanDerWaalsContact O-N 3.13Å; Q477-S480 PolarHBondContact O-N 3.31Å; Q477-S480 PolarHBondContact O-OG 2.9Å; Q477-E481 HydrophobicContact CG-CG 4.46Å; Q477-E481 WeakPolarHBondContact CG-OE1 3.28Å; Q477-E481 PolarHBondContact NE2-OE1 3.13Å; Q477-E481 WeakPolarHBondContact O-CG 3.33Å; Q477-E481 PolarHBondContact O-N 3.33Å
478	A	61.3	Low	63	Low	47 Å²	47	99.6 Å²	99.6	39%	0.388	50%	0.497	S	S	.	.	H	α-helix	trans	-61.7	-22.7	177.8	0	0	0	0	0	113.2	K474 R475 R482	K474-A478 VanDerWaalsContact O-CB 3.24Å; K474-A478 WeakPolarHBondContact O-CB 3.39Å; K474-A478 PolarHBondContact O-N 3.15Å; R475-A478 PolarHBondContact O-N 3.27Å; A478-R482 WeakPolarHBondContact O-CG 3.24Å; A478-R482 PolarHBondContact O-N 3.06Å
479	E	61.3	Low	62.2	Low	96 Å²	96	95.2 Å²	95.2	45%	0.449	48%	0.477	S	S	.	.	H	α-helix	trans	-80.7	-35.8	174.7	-166.8	144	-106.6	0	0	112.6	R475 K476 Q477 R482	R475-E479 VanDerWaalsContact O-CB 3.22Å; R475-E479 WeakPolarHBondContact O-CB 3.4Å; R475-E479 PolarHBondContact O-N 2.86Å; K476-E479 PolarHBondContact O-N 3.35Å; Q477-E479 PolarHBondContact O-N 3.49Å; Q477-E479 VanDerWaalsContact O-N 3.13Å; E479-R482 PolarHBondContact O-N 3.27Å; E479-R482 IonicContact OE1-CZ 2.71Å; E479-R482 IonicContact OE1-NH1 2.59Å; E479-R482 PolarHBondContact OE1-NH1 2.83Å
480	S	55.4	Low	61.4	Low	96 Å²	96	95.8 Å²	95.8	67%	0.671	48%	0.479	S	S	*	.	H	α-helix	trans	-71.5	-27.8	168.6	61.4	0	0	0	0	113.6	K476 Q477	K476-S480 PolarHBondContact O-N 3.22Å; K476-S480 PolarHBondContact O-OG 3.01Å; Q477-S480 PolarHBondContact O-N 3.31Å; Q477-S480 PolarHBondContact O-OG 2.9Å
481	E	55.5	Low	60.8	Low	127 Å²	127	95.1 Å²	95.1	59%	0.593	48%	0.475	S	S	*	.	S	Bend	trans	-81.8	-13.9	175.6	-71.6	175.4	-165.3	0	0	113.2	Q477 P483	Q477-E481 HydrophobicContact CG-CG 4.46Å; Q477-E481 WeakPolarHBondContact CG-OE1 3.28Å; Q477-E481 PolarHBondContact NE2-OE1 3.13Å; Q477-E481 WeakPolarHBondContact O-CG 3.33Å; Q477-E481 PolarHBondContact O-N 3.33Å; E481-P483 WeakPolarHBondContact O-CD 3.41Å
482	R	51.4	Low	60.3	Low	149 Å²	149	87.6 Å²	87.6	56%	0.562	45%	0.447	S	S	*	.	S	Bend	trans	-63.6	124.3	172.8	-84.7	167.3	-170	168.2	4.8	109.3	A478 E479 I484	A478-R482 WeakPolarHBondContact O-CG 3.24Å; A478-R482 PolarHBondContact O-N 3.06Å; E479-R482 PolarHBondContact O-N 3.27Å; E479-R482 IonicContact OE1-CZ 2.71Å; E479-R482 IonicContact OE1-NH1 2.59Å; E479-R482 PolarHBondContact OE1-NH1 2.83Å; R482-I484 PolarHBondContact O-N 3.25Å
483	P	48.7	Very low	59.5	Low	37 Å²	37	88.3 Å²	88.3	24%	0.24	46%	0.455	C	S	.	.			trans	-66	104.8	175.5	-18.4	30.6	0	0	0	109.9	E481 L485 L613 K616	E481-P483 WeakPolarHBondContact O-CD 3.41Å; P483-L485 PolarHBondContact O-N 3.03Å; P483-L613 HydrophobicContact CB-CD2 4.36Å; P483-K616 PolarHBondContact O-NZ 2.75Å; P483-K616 VanDerWaalsContact O-NZ 3.07Å
484	I	45.6	Very low	58.7	Low	148 Å²	148	84.2 Å²	84.2	76%	0.759	44%	0.435	S	S	*	.	P	Polyproline II helix	trans	-48.6	127.4	172.9	-59.6	174.9	0	0	0	107.7	R482	R482-I484 PolarHBondContact O-N 3.25Å
485	L	49.9	Very low	57.9	Low	61 Å²	61	80.8 Å²	80.8	32%	0.319	43%	0.431	S	S	.	.	P	Polyproline II helix	trans	-71	139.7	178.1	-64.7	175.3	0	0	0	109.3	P483 A487 L491 K616	P483-L485 PolarHBondContact O-N 3.03Å; L485-A487 PolarHBondContact O-N 2.92Å; L485-L491 HydrophobicContact CD1-CD1 3.76Å; L485-K616 HydrophobicContact CD2-CB 4.35Å; L485-K616 HydrophobicContact CD2-CD 3.49Å; L485-K616 VanDerWaalsContact CD2-CD 3.49Å; L485-K616 HydrophobicContact CD2-CG 4.02Å
486	P	53.3	Low	57.1	Low	45 Å²	45	75.9 Å²	75.9	29%	0.292	42%	0.417	S	S	.	.	P	Polyproline II helix	trans	-49.8	129.8	167.7	-28.5	37	0	0	0	110.6	N488 Q489 Y599	P486-N488 VanDerWaalsContact CB-OD1 3.27Å; P486-N488 WeakPolarHBondContact CB-OD1 3.22Å; P486-N488 PolarHBondContact O-N 2.9Å; P486-Q489 PolarHBondContact O-N 3.33Å; P486-Y599 HydrophobicContact CG-CD1 4.36Å; P486-Y599 HydrophobicContact CG-CE1 4.25Å
487	A	44.3	Very low	55.9	Low	116 Å²	116	78.2 Å²	78.2	96%	0.959	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-11.4	-167.8	0	0	0	0	0	114.5	L485	L485-A487 PolarHBondContact O-N 2.92Å
488	N	49.8	Very low	54.8	Low	66 Å²	66	80.7 Å²	80.7	35%	0.353	45%	0.446	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.6	-5	177	60.2	-6.9	0	0	0	114.2	P486 K490	P486-N488 VanDerWaalsContact CB-OD1 3.27Å; P486-N488 WeakPolarHBondContact CB-OD1 3.22Å; P486-N488 PolarHBondContact O-N 2.9Å; N488-K490 PolarHBondContact O-N 2.91Å; N488-K490 VanDerWaalsContact O-N 3.08Å
489	Q	59	Low	53.9	Low	23 Å²	23	80 Å²	80	11%	0.107	44%	0.441	C	S	.	.			trans	-73.7	101.5	179.8	176.6	139.1	86.1	0	0	111.7	P486 L491 N508 N510 K616	P486-Q489 PolarHBondContact O-N 3.33Å; Q489-L491 HydrophobicContact CG-CD2 4.08Å; Q489-L491 HydrophobicContact CG-CG 4.29Å; Q489-L491 PolarHBondContact O-N 3.49Å; Q489-N508 PolarHBondContact NE2-ND2 2.89Å; Q489-N510 PolarHBondContact NE2-ND2 2.93Å; Q489-K616 PolarHBondContact NE2-O 2.93Å; Q489-K616 PolarHBondContact OE1-O 2.96Å
490	K	60	Low	53.2	Low	75 Å²	75	82.2 Å²	82.2	33%	0.326	46%	0.463	S	S	.	.			trans	-63.3	99	174.5	-60.8	-171.8	-176.7	-176.1	0	111	N488 P509 Q585 E588	N488-K490 PolarHBondContact O-N 2.91Å; N488-K490 VanDerWaalsContact O-N 3.08Å; K490-P509 VanDerWaalsContact O-CD 3.23Å; K490-P509 WeakPolarHBondContact O-CD 3.38Å; K490-Q585 VanDerWaalsContact CD-O 3.29Å; K490-Q585 WeakPolarHBondContact CD-O 3.43Å; K490-E588 PolarHBondContact NZ-O 3.23Å
491	L	62.6	Low	52.7	Low	64 Å²	64	81.1 Å²	81.1	34%	0.335	45%	0.453	S	S	.	.			trans	-92.1	129.6	174.8	-68	174.9	0	0	0	110.4	L485 Q489 T493 V506 N508	L485-L491 HydrophobicContact CD1-CD1 3.76Å; Q489-L491 HydrophobicContact CG-CD2 4.08Å; Q489-L491 HydrophobicContact CG-CG 4.29Å; Q489-L491 PolarHBondContact O-N 3.49Å; L491-T493 PolarHBondContact O-N 3.14Å; L491-V506 HydrophobicContact CB-CG1 3.87Å; L491-V506 HydrophobicContact CD1-CG1 4.06Å; L491-V506 HydrophobicContact CD2-CG1 3.99Å; L491-V506 HydrophobicContact CG-CG1 4.2Å; L491-N508 HydrophobicContact CD2-CB 3.94Å
492	I	66.2	Low	52.4	Low	2 Å²	2	84.8 Å²	84.8	1%	0.01	47%	0.467	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	99.3	175.5	-56.1	171.4	0	0	0	108	L494 V506 I507 P509 I579 F582 T586	I492-L494 HydrophobicContact CG2-CD2 3.62Å; I492-L494 HydrophobicContact CG2-CG 4.12Å; I492-V506 WeakPolarHBondContact O-CA 3.41Å; I492-I507 HydrophobicContact CB-CB 4.5Å; I492-I507 WeakPolarHBondContact CB-O 3.3Å; I492-I507 PolarHBondContact N-O 2.96Å; I492-I507 PolarHBondContact O-N 2.86Å; I492-P509 HydrophobicContact CD1-CB 4Å; I492-P509 HydrophobicContact CD1-CG 4.11Å; I492-P509 HydrophobicContact CG1-CG 4.32Å; I492-I579 HydrophobicContact CG2-CG2 4.18Å; I492-F582 HydrophobicContact CD1-CD2 3.9Å; I492-F582 HydrophobicContact CD1-CE2 3.77Å; I492-T586 HydrophobicContact CD1-CG2 4.39Å
493	T	61	Low	52.7	Low	71 Å²	71	83.5 Å²	83.5	44%	0.436	47%	0.465	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	113.5	173.1	-60.5	0	0	0	0	109.8	L491 E504	L491-T493 PolarHBondContact O-N 3.14Å; T493-E504 HydrophobicContact CG2-CB 4.27Å
494	L	60.5	Low	53.3	Low	13 Å²	13	88.5 Å²	88.5	7%	0.068	49%	0.485	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	107.6	-179.1	-56.2	169.2	0	0	0	110.5	I492 E504 F505 I507 Y521 V525 I579	I492-L494 HydrophobicContact CG2-CD2 3.62Å; I492-L494 HydrophobicContact CG2-CG 4.12Å; L494-E504 WeakPolarHBondContact O-CA 3.28Å; L494-F505 HydrophobicContact CB-CB 4.24Å; L494-F505 VanDerWaalsContact CB-O 3.25Å; L494-F505 WeakPolarHBondContact CB-O 3.31Å; L494-F505 HydrophobicContact CD1-CB 4.34Å; L494-F505 WeakPolarHBondContact CG-O 3.34Å; L494-F505 PolarHBondContact N-O 3.32Å; L494-F505 PolarHBondContact O-N 3.02Å; L494-I507 HydrophobicContact CD1-CD1 3.59Å; L494-I507 HydrophobicContact CD1-CG1 3.86Å; L494-Y521 HydrophobicContact CD1-CD2 3.59Å; L494-Y521 HydrophobicContact CD1-CE2 4.04Å; L494-Y521 HydrophobicContact CD2-CD2 4.21Å; L494-Y521 HydrophobicContact CD2-CE2 4.11Å; L494-V525 HydrophobicContact CD1-CG2 4.08Å; L494-I579 HydrophobicContact CD2-CB 4.44Å; L494-I579 HydrophobicContact CD2-CD1 3.94Å; L494-I579 HydrophobicContact CD2-CG1 3.9Å; L494-I579 HydrophobicContact CD2-CG2 3.71Å
495	S	54.9	Low	54.3	Low	84 Å²	84	84.6 Å²	84.6	59%	0.587	46%	0.463	S	S	*	.			trans	-82.8	112.6	165.8	48.7	0	0	0	0	109.9	Q497	S495-Q497 PolarHBondContact O-N 2.82Å
496	V	55.1	Low	55.3	Low	41 Å²	41	85.4 Å²	85.4	25%	0.248	47%	0.47	C	S	.	.			trans	-82.1	109.8	174.9	-171.1	0	0	0	0	108.4	A499 F505 V525	V496-A499 HydrophobicContact CB-CB 4.09Å; V496-A499 HydrophobicContact CG1-CB 3.87Å; V496-F505 HydrophobicContact CG2-CD2 3.83Å; V496-F505 HydrophobicContact CG2-CE2 4.07Å; V496-V525 HydrophobicContact CG1-CG1 4.23Å; V496-V525 HydrophobicContact CG2-CG1 3.81Å; V496-V525 HydrophobicContact CG2-CG2 4.37Å
497	Q	48.4	Very low	56.2	Low	171 Å²	171	83.4 Å²	83.4	80%	0.799	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.3	-30.7	-171.7	-60.7	-171.6	8.1	0	0	112.9	S495	S495-Q497 PolarHBondContact O-N 2.82Å
498	D	45.8	Very low	57.5	Low	162 Å²	162	79.3 Å²	79.3	87%	0.866	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.6	24.8	-176.5	-65.2	-61.6	0	0	0	115.1
499	A	43	Very low	58.5	Low	34 Å²	34	76.9 Å²	76.9	28%	0.281	41%	0.407	S	S	.	.			trans	-101	123	176.6	0	0	0	0	0	111.9	V496 T501	V496-A499 HydrophobicContact CB-CB 4.09Å; V496-A499 HydrophobicContact CG1-CB 3.87Å; A499-T501 WeakPolarHBondContact CB-O 3.19Å; A499-T501 CarbonylContact O-C 3.57Å; A499-T501 PolarHBondContact O-N 2.73Å
500	P	46.1	Very low	58.9	Low	141 Å²	141	78.6 Å²	78.6	92%	0.916	42%	0.417	S	S	*	.	S	Bend	trans	-66.9	-7.6	178.7	27.6	-35.4	0	0	0	113.8
501	T	45.3	Very low	59.2	Low	73 Å²	73	77.6 Å²	77.6	45%	0.448	43%	0.428	S	S	.	.	S	Bend	trans	-114.9	116.5	158.9	63.4	0	0	0	0	108.5	A499 K503	A499-T501 WeakPolarHBondContact CB-O 3.19Å; A499-T501 CarbonylContact O-C 3.57Å; A499-T501 PolarHBondContact O-N 2.73Å; T501-K503 PolarHBondContact O-N 2.93Å; T501-K503 WeakPolarHBondContact OG1-CD 3.36Å; T501-K503 VanDerWaalsContact OG1-CE 3.3Å; T501-K503 WeakPolarHBondContact OG1-CE 3.35Å
502	K	49.8	Very low	60.2	Low	204 Å²	204	78 Å²	78	89%	0.887	43%	0.427	S	S	*	.			trans	-57.1	102.4	168	-73.6	-175.2	177	-178.4	0	109.1
503	K	56.4	Low	61.1	Low	123 Å²	123	80 Å²	80	54%	0.535	44%	0.441	S	S	.	.			trans	-125.8	103	176.6	-75.5	-180	-179.6	170.4	0	107.7	T501 F505	T501-K503 PolarHBondContact O-N 2.93Å; T501-K503 WeakPolarHBondContact OG1-CD 3.36Å; T501-K503 VanDerWaalsContact OG1-CE 3.3Å; T501-K503 WeakPolarHBondContact OG1-CE 3.35Å; K503-F505 HydrophobicContact CB-CE2 4.06Å; K503-F505 HydrophobicContact CB-CZ 4.33Å; K503-F505 VanDerWaalsContact O-CD2 3.28Å; K503-F505 WeakPolarHBondContact O-CD2 3.21Å
504	E	61.5	Low	62.4	Low	141 Å²	141	78.9 Å²	78.9	66%	0.659	43%	0.431	S	S	*	.			trans	-73.9	124.3	174.8	-68.4	168.6	-167.2	0	0	108.7	T493 L494	T493-E504 HydrophobicContact CG2-CB 4.27Å; L494-E504 WeakPolarHBondContact O-CA 3.28Å
505	F	68.2	Low	63.9	Low	67 Å²	67	79.8 Å²	79.8	29%	0.294	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	113.2	177.2	-69.7	-84.4	0	0	0	109.6	L494 V496 K503 R524 V525	L494-F505 HydrophobicContact CB-CB 4.24Å; L494-F505 VanDerWaalsContact CB-O 3.25Å; L494-F505 WeakPolarHBondContact CB-O 3.31Å; L494-F505 HydrophobicContact CD1-CB 4.34Å; L494-F505 WeakPolarHBondContact CG-O 3.34Å; L494-F505 PolarHBondContact N-O 3.32Å; L494-F505 PolarHBondContact O-N 3.02Å; V496-F505 HydrophobicContact CG2-CD2 3.83Å; V496-F505 HydrophobicContact CG2-CE2 4.07Å; K503-F505 HydrophobicContact CB-CE2 4.06Å; K503-F505 HydrophobicContact CB-CZ 4.33Å; K503-F505 VanDerWaalsContact O-CD2 3.28Å; K503-F505 WeakPolarHBondContact O-CD2 3.21Å; F505-R524 HydrophobicContact CD1-CB 4.38Å; F505-R524 HydrophobicContact CE1-CB 4.41Å; F505-V525 HydrophobicContact CD2-CG2 4.27Å
506	V	69.6	Low	65.6	Low	77 Å²	77	78.8 Å²	78.8	47%	0.467	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	120.9	177.1	-177.6	0	0	0	0	110	L491 I492	L491-V506 HydrophobicContact CB-CG1 3.87Å; L491-V506 HydrophobicContact CD1-CG1 4.06Å; L491-V506 HydrophobicContact CD2-CG1 3.99Å; L491-V506 HydrophobicContact CG-CG1 4.2Å; I492-V506 WeakPolarHBondContact O-CA 3.41Å
507	I	72.1	Confident	67.2	Low	4 Å²	4	77.2 Å²	77.2	2%	0.021	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	117.3	171.6	-57.4	-172.1	0	0	0	109.2	I492 L494 P509 I517 E520	I492-I507 HydrophobicContact CB-CB 4.5Å; I492-I507 WeakPolarHBondContact CB-O 3.3Å; I492-I507 PolarHBondContact N-O 2.96Å; I492-I507 PolarHBondContact O-N 2.86Å; L494-I507 HydrophobicContact CD1-CD1 3.59Å; L494-I507 HydrophobicContact CD1-CG1 3.86Å; I507-P509 WeakPolarHBondContact O-CD 3.42Å; I507-I517 HydrophobicContact CG2-CG2 4.43Å; I507-E520 HydrophobicContact CD1-CG 4.29Å
508	N	73.2	Confident	69.2	Low	30 Å²	30	69.1 Å²	69.1	16%	0.16	38%	0.382	C	S	.	.			trans	-74.9	122	163.4	-179.8	-1	0	0	0	109.1	Q489 L491 N510 K512 K616	Q489-N508 PolarHBondContact NE2-ND2 2.89Å; L491-N508 HydrophobicContact CD2-CB 3.94Å; N508-N510 WeakPolarHBondContact OD1-CB 3.42Å; N508-N510 PolarHBondContact OD1-N 3.25Å; N508-K512 WeakPolarHBondContact O-CD 3.25Å; N508-K512 WeakPolarHBondContact O-CE 3.45Å; N508-K512 PolarHBondContact O-NZ 2.75Å; N508-K616 PolarHBondContact ND2-O 3.12Å
509	P	70.9	Confident	71.4	Confident	15 Å²	15	65.3 Å²	65.3	10%	0.097	36%	0.359	C	S	.	.			trans	-82.4	-21.9	176	33.4	-34.2	0	0	0	113.5	K490 I492 I507 G511 K512 I517	K490-P509 VanDerWaalsContact O-CD 3.23Å; K490-P509 WeakPolarHBondContact O-CD 3.38Å; I492-P509 HydrophobicContact CD1-CB 4Å; I492-P509 HydrophobicContact CD1-CG 4.11Å; I492-P509 HydrophobicContact CG1-CG 4.32Å; I507-P509 WeakPolarHBondContact O-CD 3.42Å; P509-G511 PolarHBondContact O-N 2.87Å; P509-K512 PolarHBondContact O-N 3.49Å; P509-K512 VanDerWaalsContact O-N 3.13Å; P509-I517 HydrophobicContact CB-CD1 3.83Å
510	N	66.1	Low	73.5	Confident	58 Å²	58	65.1 Å²	65.1	31%	0.31	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	132.7	-172.7	-72.2	12	0	0	0	111.6	Q489 N508 K512	Q489-N510 PolarHBondContact NE2-ND2 2.93Å; N508-N510 WeakPolarHBondContact OD1-CB 3.42Å; N508-N510 PolarHBondContact OD1-N 3.25Å; N510-K512 PolarHBondContact O-N 2.88Å
511	G	67.4	Low	75.4	Confident	55 Å²	55	59.6 Å²	59.6	57%	0.567	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.7	-3.7	-179.5	0	0	0	0	0	115.9	P509	P509-G511 PolarHBondContact O-N 2.87Å
512	K	82.6	Confident	77.4	Confident	71 Å²	71	56.1 Å²	56.1	31%	0.309	29%	0.291	S	S	.	.			trans	-96.6	154.9	174.1	-59.8	179.1	-170.4	168	0	110.6	N508 P509 N510 C516 I517 E520	N508-K512 WeakPolarHBondContact O-CD 3.25Å; N508-K512 WeakPolarHBondContact O-CE 3.45Å; N508-K512 PolarHBondContact O-NZ 2.75Å; P509-K512 PolarHBondContact O-N 3.49Å; P509-K512 VanDerWaalsContact O-N 3.13Å; N510-K512 PolarHBondContact O-N 2.88Å; K512-C516 HydrophobicContact CB-CB 4.39Å; K512-I517 HydrophobicContact CB-CD1 4.2Å; K512-I517 HydrophobicContact CB-CG1 3.77Å; K512-I517 HydrophobicContact CD-CG1 4.24Å; K512-E520 WeakPolarHBondContact CD-OE2 3.23Å; K512-E520 VanDerWaalsContact CE-OE2 3.27Å; K512-E520 WeakPolarHBondContact CE-OE2 3.35Å; K512-E520 IonicContact NZ-OE1 2.66Å; K512-E520 PolarHBondContact NZ-OE1 3.26Å; K512-E520 IonicContact NZ-OE2 2.96Å; K512-E520 PolarHBondContact NZ-OE2 2.71Å
513	S	85.7	Confident	79.2	Confident	44 Å²	44	51.8 Å²	51.8	31%	0.308	28%	0.275	S	S	.	.			trans	-89.7	156.7	166.4	77.2	0	0	0	0	110.6	V515 C516 I517	S513-V515 PolarHBondContact O-N 3.06Å; S513-C516 CarbonylContact O-C 3.54Å; S513-C516 WeakPolarHBondContact O-CA 3.43Å; S513-C516 VanDerWaalsContact O-CB 3.28Å; S513-C516 WeakPolarHBondContact O-CB 3.37Å; S513-C516 PolarHBondContact O-N 3.11Å; S513-C516 PolarHBondContact OG-N 3.27Å; S513-C516 PolarHBondContact OG-SG 3.24Å; S513-I517 WeakPolarHBondContact O-CG1 3.35Å; S513-I517 PolarHBondContact O-N 2.99Å
514	E	88.7	Confident	80.4	Confident	49 Å²	49	51.1 Å²	51.1	23%	0.229	27%	0.269	C	S	.	.	H	α-helix	trans	-53.3	-37.8	175.8	-64.6	84.2	166.2	0	0	111.6	C516 I517 L518 N568 A571 R572 L575	E514-C516 VanDerWaalsContact C-N 3.32Å; E514-C516 PolarHBondContact O-N 3.13Å; E514-I517 PolarHBondContact O-N 2.87Å; E514-L518 WeakPolarHBondContact O-CB 3.25Å; E514-L518 PolarHBondContact O-N 3.07Å; E514-N568 PolarHBondContact OE2-ND2 2.82Å; E514-N568 PolarHBondContact OE2-OD1 3.22Å; E514-A571 HydrophobicContact CB-CB 4.38Å; E514-R572 HydrophobicContact CB-CB 4.33Å; E514-R572 HydrophobicContact CG-CB 4.1Å; E514-R572 HydrophobicContact CG-CG 4.32Å; E514-L575 HydrophobicContact CB-CD1 4.29Å; E514-L575 WeakPolarHBondContact O-CD1 3.2Å
515	V	91.8	Very high	81.3	Confident	32 Å²	32	45.5 Å²	45.5	19%	0.194	24%	0.244	C	C	.	.	H	α-helix	trans	-62.3	-37.5	172.9	177.5	0	0	0	0	112	S513 H519 K567 N568 A571	S513-V515 PolarHBondContact O-N 3.06Å; V515-H519 WeakPolarHBondContact O-CB 3.45Å; V515-H519 PolarHBondContact O-N 2.89Å; V515-H519 VanDerWaalsContact O-N 3.16Å; V515-K567 HydrophobicContact CG1-CD 4.36Å; V515-K567 HydrophobicContact CG2-CD 4.34Å; V515-K567 HydrophobicContact CG2-CG 4.07Å; V515-N568 HydrophobicContact CG2-CB 4.5Å; V515-A571 HydrophobicContact CB-CB 4.42Å; V515-A571 HydrophobicContact CG2-CB 3.86Å
516	C	90.4	Very high	81.9	Confident	63 Å²	63	45.9 Å²	45.9	43%	0.426	25%	0.249	S	C	.	.	H	α-helix	trans	-74.9	-42.8	176.4	-57.3	0	0	0	0	111.7	K512 S513 E514 L518 H519 E520	K512-C516 HydrophobicContact CB-CB 4.39Å; S513-C516 CarbonylContact O-C 3.54Å; S513-C516 WeakPolarHBondContact O-CA 3.43Å; S513-C516 VanDerWaalsContact O-CB 3.28Å; S513-C516 WeakPolarHBondContact O-CB 3.37Å; S513-C516 PolarHBondContact O-N 3.11Å; S513-C516 PolarHBondContact OG-N 3.27Å; S513-C516 PolarHBondContact OG-SG 3.24Å; E514-C516 VanDerWaalsContact C-N 3.32Å; E514-C516 PolarHBondContact O-N 3.13Å; C516-L518 VanDerWaalsContact C-N 3.33Å; C516-L518 PolarHBondContact O-N 3.23Å; C516-H519 PolarHBondContact O-N 3.46Å; C516-E520 VanDerWaalsContact O-CB 3.25Å; C516-E520 WeakPolarHBondContact O-CB 3.45Å; C516-E520 PolarHBondContact O-N 3.36Å
517	I	89	Confident	82.6	Confident	8 Å²	8	50.7 Å²	50.7	4%	0.041	26%	0.263	C	S	.	.	H	α-helix	trans	-61.5	-44	178.6	-63.4	167	0	0	0	109.8	I507 P509 K512 S513 E514 E520 Y521 L575 F582	I507-I517 HydrophobicContact CG2-CG2 4.43Å; P509-I517 HydrophobicContact CB-CD1 3.83Å; K512-I517 HydrophobicContact CB-CD1 4.2Å; K512-I517 HydrophobicContact CB-CG1 3.77Å; K512-I517 HydrophobicContact CD-CG1 4.24Å; S513-I517 WeakPolarHBondContact O-CG1 3.35Å; S513-I517 PolarHBondContact O-N 2.99Å; E514-I517 PolarHBondContact O-N 2.87Å; I517-E520 PolarHBondContact O-N 2.86Å; I517-Y521 WeakPolarHBondContact O-CB 3.37Å; I517-Y521 PolarHBondContact O-N 3.49Å; I517-L575 HydrophobicContact CB-CD1 3.99Å; I517-L575 HydrophobicContact CG2-CD1 3.87Å; I517-L575 HydrophobicContact CG2-CD2 3.88Å; I517-F582 HydrophobicContact CG2-CE2 4.28Å
518	L	90	Very high	83.3	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-64.5	-42.9	175	-178.4	59.6	0	0	0	112.6	E514 C516 E520 Y521 M522 V548 A571 T574 L575 L578	E514-L518 WeakPolarHBondContact O-CB 3.25Å; E514-L518 PolarHBondContact O-N 3.07Å; C516-L518 VanDerWaalsContact C-N 3.33Å; C516-L518 PolarHBondContact O-N 3.23Å; L518-E520 VanDerWaalsContact C-N 3.32Å; L518-E520 PolarHBondContact O-N 3.16Å; L518-Y521 PolarHBondContact O-N 2.97Å; L518-M522 HydrophobicContact CD1-CG 3.91Å; L518-M522 HydrophobicContact CD1-SD 3.78Å; L518-M522 HydrophobicContact CG-CG 4.41Å; L518-M522 HydrophobicContact CG-SD 3.94Å; L518-M522 WeakPolarHBondContact O-CB 3.27Å; L518-M522 VanDerWaalsContact O-CG 3.28Å; L518-M522 WeakPolarHBondContact O-CG 3.25Å; L518-M522 PolarHBondContact O-N 2.77Å; L518-V548 HydrophobicContact CD2-CG1 4.18Å; L518-V548 HydrophobicContact CD2-CG2 4Å; L518-A571 HydrophobicContact CB-CB 4.4Å; L518-A571 HydrophobicContact CD2-CB 3.85Å; L518-T574 HydrophobicContact CD1-CG2 3.73Å; L518-T574 HydrophobicContact CD2-CG2 3.84Å; L518-T574 HydrophobicContact CG-CG2 4.46Å; L518-L575 HydrophobicContact CB-CD1 4.15Å; L518-L575 HydrophobicContact CB-CD2 4.1Å; L518-L575 HydrophobicContact CB-CG 3.98Å; L518-L575 HydrophobicContact CD1-CD2 4.1Å; L518-L575 HydrophobicContact CD1-CG 4.2Å; L518-L578 HydrophobicContact CD1-CD1 3.91Å
519	H	91.1	Very high	83.9	Confident	83 Å²	83	60.6 Å²	60.6	38%	0.384	30%	0.302	S	S	.	.	H	α-helix	trans	-63	-40	176.2	-175.3	45.9	0	0	0	112.2	V515 C516 Q523 P530	V515-H519 WeakPolarHBondContact O-CB 3.45Å; V515-H519 PolarHBondContact O-N 2.89Å; V515-H519 VanDerWaalsContact O-N 3.16Å; C516-H519 PolarHBondContact O-N 3.46Å; H519-Q523 WeakPolarHBondContact O-CB 3.23Å; H519-Q523 PolarHBondContact O-N 3.08Å; H519-P530 HydrophobicContact CB-CG 4.45Å
520	E	88	Confident	84.8	Confident	30 Å²	30	60.4 Å²	60.4	14%	0.14	30%	0.301	C	S	.	.	H	α-helix	trans	-69.2	-42.2	178.6	-173	172.9	176.8	0	0	112.2	I507 K512 C516 I517 L518 R524	I507-E520 HydrophobicContact CD1-CG 4.29Å; K512-E520 WeakPolarHBondContact CD-OE2 3.23Å; K512-E520 VanDerWaalsContact CE-OE2 3.27Å; K512-E520 WeakPolarHBondContact CE-OE2 3.35Å; K512-E520 IonicContact NZ-OE1 2.66Å; K512-E520 PolarHBondContact NZ-OE1 3.26Å; K512-E520 IonicContact NZ-OE2 2.96Å; K512-E520 PolarHBondContact NZ-OE2 2.71Å; C516-E520 VanDerWaalsContact O-CB 3.25Å; C516-E520 WeakPolarHBondContact O-CB 3.45Å; C516-E520 PolarHBondContact O-N 3.36Å; I517-E520 PolarHBondContact O-N 2.86Å; L518-E520 VanDerWaalsContact C-N 3.32Å; L518-E520 PolarHBondContact O-N 3.16Å; E520-R524 VanDerWaalsContact CG-CZ 3.48Å; E520-R524 PolarHBondContact O-N 3.21Å; E520-R524 VanDerWaalsContact O-N 3.14Å; E520-R524 IonicContact OE1-CZ 3.81Å; E520-R524 IonicContact OE1-NH1 3.05Å; E520-R524 PolarHBondContact OE1-NH1 2.98Å; E520-R524 IonicContact OE1-NH2 3.4Å; E520-R524 PolarHBondContact OE1-NH2 3.01Å
521	Y	86.4	Confident	86.1	Confident	24 Å²	24	61.8 Å²	61.8	9%	0.094	31%	0.311	C	S	.	.	H	α-helix	trans	-58.4	-56.3	171.1	174.7	-84.9	0	0	0	110.6	L494 I517 L518 Q523 R524 V525 L526 L578 I579	L494-Y521 HydrophobicContact CD1-CD2 3.59Å; L494-Y521 HydrophobicContact CD1-CE2 4.04Å; L494-Y521 HydrophobicContact CD2-CD2 4.21Å; L494-Y521 HydrophobicContact CD2-CE2 4.11Å; I517-Y521 WeakPolarHBondContact O-CB 3.37Å; I517-Y521 PolarHBondContact O-N 3.49Å; L518-Y521 PolarHBondContact O-N 2.97Å; Y521-Q523 VanDerWaalsContact C-N 3.31Å; Y521-Q523 PolarHBondContact O-N 3.34Å; Y521-R524 PolarHBondContact O-N 2.97Å; Y521-V525 HydrophobicContact CD2-CG2 4.05Å; Y521-V525 HydrophobicContact CE1-CB 4.45Å; Y521-V525 HydrophobicContact CE2-CB 4.36Å; Y521-V525 HydrophobicContact CE2-CG1 4.38Å; Y521-V525 HydrophobicContact CE2-CG2 4.07Å; Y521-V525 HydrophobicContact CG-CG2 4.49Å; Y521-V525 WeakPolarHBondContact O-CB 3.33Å; Y521-V525 PolarHBondContact O-N 2.91Å; Y521-L526 HydrophobicContact CE1-CD1 3.81Å; Y521-L526 HydrophobicContact CE1-CG 3.94Å; Y521-L578 HydrophobicContact CD1-CD1 4.21Å; Y521-L578 HydrophobicContact CE1-CB 3.94Å; Y521-L578 HydrophobicContact CE1-CD1 3.86Å; Y521-L578 HydrophobicContact CE1-CG 4.41Å; Y521-L578 PolarHBondContact OH-O 3.43Å; Y521-I579 HydrophobicContact CD2-CD1 3.61Å; Y521-I579 HydrophobicContact CD2-CG1 3.75Å; Y521-I579 HydrophobicContact CE2-CD1 3.94Å; Y521-I579 HydrophobicContact CE2-CG1 3.5Å; Y521-I579 VanDerWaalsContact CE2-CG1 3.5Å; Y521-I579 HydrophobicContact CG-CD1 4.31Å
522	M	86.9	Confident	87.5	Confident	0 Å²	0	61 Å²	61	0%	0	29%	0.292	C	S	.	.	I	π-helix	trans	-64	-36.1	-175.9	-70.8	-178.3	65.3	0	0	112.2	L518 L526 K527 V528 P530 I550	L518-M522 HydrophobicContact CD1-CG 3.91Å; L518-M522 HydrophobicContact CD1-SD 3.78Å; L518-M522 HydrophobicContact CG-CG 4.41Å; L518-M522 HydrophobicContact CG-SD 3.94Å; L518-M522 WeakPolarHBondContact O-CB 3.27Å; L518-M522 VanDerWaalsContact O-CG 3.28Å; L518-M522 WeakPolarHBondContact O-CG 3.25Å; L518-M522 PolarHBondContact O-N 2.77Å; M522-L526 HydrophobicContact CG-CD1 4.5Å; M522-L526 CarbonylContact O-C 3.45Å; M522-L526 PolarHBondContact O-N 2.9Å; M522-K527 WeakPolarHBondContact O-CA 3.48Å; M522-K527 PolarHBondContact O-N 3.19Å; M522-V528 CarbonylContact C-O 3.55Å; M522-V528 HydrophobicContact CE-CG2 3.7Å; M522-V528 PolarHBondContact O-N 3.47Å; M522-P530 HydrophobicContact CE-CB 3.95Å; M522-P530 HydrophobicContact CE-CG 4.37Å; M522-P530 HydrophobicContact SD-CB 3.52Å; M522-P530 VanDerWaalsContact SD-CB 3.52Å; M522-P530 HydrophobicContact SD-CG 3.81Å; M522-I550 HydrophobicContact CE-CB 4.13Å; M522-I550 HydrophobicContact CE-CD1 3.64Å; M522-I550 HydrophobicContact CE-CG1 3.62Å; M522-I550 HydrophobicContact CE-CG2 3.53Å; M522-I550 HydrophobicContact SD-CD1 3.81Å; M522-I550 HydrophobicContact SD-CG1 4.23Å
523	Q	86.4	Confident	88	Confident	114 Å²	114	61.4 Å²	61.4	53%	0.533	30%	0.297	S	S	.	.	I	π-helix	trans	-68.3	-38.2	176.8	-176.9	178.4	58.2	0	0	113.2	H519 Y521	H519-Q523 WeakPolarHBondContact O-CB 3.23Å; H519-Q523 PolarHBondContact O-N 3.08Å; Y521-Q523 VanDerWaalsContact C-N 3.31Å; Y521-Q523 PolarHBondContact O-N 3.34Å
524	R	82.1	Confident	88.5	Confident	108 Å²	108	63.5 Å²	63.5	41%	0.408	30%	0.301	S	S	.	.	I	π-helix	trans	-93.6	-40	-174.5	-64.7	-163.9	-163.5	122.2	12.4	114.5	F505 E520 Y521	F505-R524 HydrophobicContact CD1-CB 4.38Å; F505-R524 HydrophobicContact CE1-CB 4.41Å; E520-R524 VanDerWaalsContact CG-CZ 3.48Å; E520-R524 PolarHBondContact O-N 3.21Å; E520-R524 VanDerWaalsContact O-N 3.14Å; E520-R524 IonicContact OE1-CZ 3.81Å; E520-R524 IonicContact OE1-NH1 3.05Å; E520-R524 PolarHBondContact OE1-NH1 2.98Å; E520-R524 IonicContact OE1-NH2 3.4Å; E520-R524 PolarHBondContact OE1-NH2 3.01Å; Y521-R524 PolarHBondContact O-N 2.97Å
525	V	81.1	Confident	88.7	Confident	24 Å²	24	64.8 Å²	64.8	15%	0.145	31%	0.306	C	S	.	.	I	π-helix	trans	-84.2	-63.6	-177.9	178.8	0	0	0	0	109.8	L494 V496 F505 Y521	L494-V525 HydrophobicContact CD1-CG2 4.08Å; V496-V525 HydrophobicContact CG1-CG1 4.23Å; V496-V525 HydrophobicContact CG2-CG1 3.81Å; V496-V525 HydrophobicContact CG2-CG2 4.37Å; F505-V525 HydrophobicContact CD2-CG2 4.27Å; Y521-V525 HydrophobicContact CD2-CG2 4.05Å; Y521-V525 HydrophobicContact CE1-CB 4.45Å; Y521-V525 HydrophobicContact CE2-CB 4.36Å; Y521-V525 HydrophobicContact CE2-CG1 4.38Å; Y521-V525 HydrophobicContact CE2-CG2 4.07Å; Y521-V525 HydrophobicContact CG-CG2 4.49Å; Y521-V525 WeakPolarHBondContact O-CB 3.33Å; Y521-V525 PolarHBondContact O-N 2.91Å
526	L	80.6	Confident	88.8	Confident	74 Å²	74	69.7 Å²	69.7	39%	0.387	33%	0.327	S	S	.	.	I	π-helix	trans	-87.6	-15.3	-172.6	-56	179.7	0	0	0	113.9	Y521 M522 V528	Y521-L526 HydrophobicContact CE1-CD1 3.81Å; Y521-L526 HydrophobicContact CE1-CG 3.94Å; M522-L526 HydrophobicContact CG-CD1 4.5Å; M522-L526 CarbonylContact O-C 3.45Å; M522-L526 PolarHBondContact O-N 2.9Å; L526-V528 HydrophobicContact CB-CG2 3.68Å; L526-V528 HydrophobicContact CD1-CG2 4.42Å; L526-V528 PolarHBondContact O-N 3.35Å; L526-V528 VanDerWaalsContact O-N 3.15Å
527	K	85.3	Confident	88.6	Confident	178 Å²	178	68.2 Å²	68.2	77%	0.774	32%	0.317	S	S	*	.			trans	58	13.9	-174.5	-57.7	175.4	-174.9	168.1	0	115.9	M522	M522-K527 WeakPolarHBondContact O-CA 3.48Å; M522-K527 PolarHBondContact O-N 3.19Å
528	V	86.2	Confident	88.6	Confident	39 Å²	39	77.8 Å²	77.8	24%	0.236	36%	0.362	C	S	.	.			trans	-102.4	168.6	177.7	-67.6	0	0	0	0	112	M522 L526 I550	M522-V528 CarbonylContact C-O 3.55Å; M522-V528 HydrophobicContact CE-CG2 3.7Å; M522-V528 PolarHBondContact O-N 3.47Å; L526-V528 HydrophobicContact CB-CG2 3.68Å; L526-V528 HydrophobicContact CD1-CG2 4.42Å; L526-V528 PolarHBondContact O-N 3.35Å; L526-V528 VanDerWaalsContact O-N 3.15Å; V528-I550 HydrophobicContact CG2-CG2 3.8Å
529	R	86	Confident	88.3	Confident	203 Å²	203	81.5 Å²	81.5	77%	0.766	38%	0.382	S	S	*	.			trans	-109.4	126.7	-177.9	179.8	177.7	177.9	167.8	-0.6	110.6	V531	R529-V531 PolarHBondContact O-N 3.32Å
530	P	89.8	Confident	88	Confident	12 Å²	12	83.6 Å²	83.6	8%	0.078	40%	0.402	C	S	.	.			trans	-63.2	123.4	172.4	20.2	-27.4	0	0	0	110.9	H519 M522 Y532 V548	H519-P530 HydrophobicContact CB-CG 4.45Å; M522-P530 HydrophobicContact CE-CB 3.95Å; M522-P530 HydrophobicContact CE-CG 4.37Å; M522-P530 HydrophobicContact SD-CB 3.52Å; M522-P530 VanDerWaalsContact SD-CB 3.52Å; M522-P530 HydrophobicContact SD-CG 3.81Å; P530-Y532 HydrophobicContact CB-CD2 4.39Å; P530-Y532 HydrophobicContact CB-CE2 3.8Å; P530-Y532 HydrophobicContact CG-CE2 4.17Å; P530-V548 HydrophobicContact CB-CG1 4.08Å
531	V	93.5	Very high	87.8	Confident	86 Å²	86	86.4 Å²	86.4	52%	0.521	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	141.8	163.1	179.5	0	0	0	0	107.5	R529 V548 I549	R529-V531 PolarHBondContact O-N 3.32Å; V531-V548 WeakPolarHBondContact O-CA 3.43Å; V531-I549 HydrophobicContact CB-CB 4.22Å; V531-I549 PolarHBondContact N-O 2.92Å; V531-I549 VanDerWaalsContact N-O 3.07Å; V531-I549 PolarHBondContact O-N 2.94Å
532	Y	95.1	Very high	88	Confident	38 Å²	38	87.7 Å²	87.7	15%	0.149	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	118.4	175.8	-73	-96.4	0	0	0	108.7	P530 S547 V548 K567 A571	P530-Y532 HydrophobicContact CB-CD2 4.39Å; P530-Y532 HydrophobicContact CB-CE2 3.8Å; P530-Y532 HydrophobicContact CG-CE2 4.17Å; Y532-S547 CarbonylContact C-O 3.59Å; Y532-S547 WeakPolarHBondContact CA-O 3.35Å; Y532-V548 HydrophobicContact CD1-CG2 3.98Å; Y532-V548 HydrophobicContact CE1-CG2 3.63Å; Y532-K567 HydrophobicContact CD1-CD 4.14Å; Y532-K567 VanDerWaalsContact CD1-CE 3.48Å; Y532-K567 HydrophobicContact CD1-CG 3.46Å; Y532-K567 VanDerWaalsContact CD1-CG 3.46Å; Y532-K567 HydrophobicContact CE1-CD 4.17Å; Y532-K567 HydrophobicContact CE1-CG 3.43Å; Y532-K567 VanDerWaalsContact CE1-CG 3.43Å; Y532-K567 VanDerWaalsContact CE2-CE 3.46Å; Y532-K567 HydrophobicContact CG-CD 4.41Å; Y532-K567 HydrophobicContact CG-CG 4.19Å; Y532-A571 HydrophobicContact CE1-CB 4.33Å
533	N	94.6	Very high	88.1	Confident	81 Å²	81	89.6 Å²	89.6	43%	0.433	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	147.5	166.7	-168.8	16.7	0	0	0	109.2	A546 S547 I549	N533-A546 VanDerWaalsContact O-CA 3.28Å; N533-A546 WeakPolarHBondContact O-CA 3.4Å; N533-S547 PolarHBondContact N-O 3.07Å; N533-S547 PolarHBondContact O-N 3.33Å; N533-I549 HydrophobicContact CB-CD1 3.99Å
534	F	95.4	Very high	88.5	Confident	87 Å²	87	87 Å²	87	38%	0.382	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	132.2	175.8	-68.3	-83.4	0	0	0	109	A546 K563 K567	F534-A546 HydrophobicContact CD1-CB 3.84Å; F534-A546 HydrophobicContact CE1-CB 3.9Å; F534-K563 HydrophobicContact CD1-CB 4.4Å; F534-K563 HydrophobicContact CE1-CB 4.34Å; F534-K567 HydrophobicContact CE1-CB 4.14Å; F534-K567 HydrophobicContact CE1-CG 4.46Å; F534-K567 HydrophobicContact CZ-CB 4.38Å; F534-K567 HydrophobicContact CZ-CD 4.05Å; F534-K567 HydrophobicContact CZ-CG 4.24Å
535	F	93.8	Very high	89.1	Confident	77 Å²	77	81.9 Å²	81.9	34%	0.338	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	169	178.9	55.6	-85.4	0	0	0	109	G545	F535-G545 PolarHBondContact N-O 2.89Å; F535-G545 VanDerWaalsContact N-O 3.08Å; F535-G545 CarbonylContact O-C 3.43Å; F535-G545 WeakPolarHBondContact O-CA 3.28Å; F535-G545 PolarHBondContact O-N 3.16Å; F535-G545 VanDerWaalsContact O-O 3.04Å
536	E	92.5	Very high	89.9	Confident	134 Å²	134	80.8 Å²	80.8	63%	0.626	41%	0.406	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.9	149.7	-179.3	-58.9	-170	164.7	0	0	108.7	P543 K563	E536-P543 CarbonylContact C-O 3.58Å; E536-P543 VanDerWaalsContact CA-O 3.31Å; E536-P543 WeakPolarHBondContact CA-O 3.43Å; E536-K563 WeakPolarHBondContact OE1-CE 3.41Å; E536-K563 IonicContact OE1-NZ 3.18Å; E536-K563 PolarHBondContact OE1-NZ 2.9Å
537	C	86.9	Confident	90.6	Very high	33 Å²	33	77.6 Å²	77.6	22%	0.223	39%	0.389	C	S	.	.			trans	-126.6	141.6	-166.5	-62.3	0	0	0	0	110.5	N539 P543	C537-N539 PolarHBondContact O-N 2.93Å; C537-P543 PolarHBondContact N-O 3.47Å; C537-P543 WeakPolarHBondContact O-CA 3.36Å
538	E	88.6	Confident	91.1	Very high	209 Å²	209	69.1 Å²	69.1	98%	0.977	35%	0.353	S	S	*	.	S	Bend	trans	-73.1	20.3	-178	-56.5	-177.6	159.3	0	0	114
539	N	84.5	Confident	91.3	Very high	78 Å²	78	69.1 Å²	69.1	42%	0.417	35%	0.351	S	S	.	.			trans	-107	109	179.2	-178.5	-17.1	0	0	0	109.8	C537 S541 E542 P543	C537-N539 PolarHBondContact O-N 2.93Å; N539-S541 PolarHBondContact O-N 3.19Å; N539-S541 WeakPolarHBondContact OD1-CB 3.23Å; N539-S541 PolarHBondContact OD1-N 2.98Å; N539-E542 CarbonylContact O-C 3.54Å; N539-E542 PolarHBondContact O-N 3.09Å; N539-E542 PolarHBondContact OD1-N 3.28Å; N539-P543 WeakPolarHBondContact O-CA 3.41Å; N539-P543 WeakPolarHBondContact O-CD 3.32Å
540	P	84.1	Confident	91.5	Very high	126 Å²	126	59.6 Å²	59.6	82%	0.818	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-22.7	-179.6	-27.6	36.1	0	0	0	115.4
541	S	85.1	Confident	91.2	Very high	90 Å²	90	65.2 Å²	65.2	63%	0.629	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.6	-28.8	177.9	-59.5	0	0	0	0	113.2	N539	N539-S541 PolarHBondContact O-N 3.19Å; N539-S541 WeakPolarHBondContact OD1-CB 3.23Å; N539-S541 PolarHBondContact OD1-N 2.98Å
542	E	88.8	Confident	90.6	Very high	50 Å²	50	64.3 Å²	64.3	23%	0.234	35%	0.352	C	S	.	.	S	Bend	trans	-135.8	61.3	177.7	-63.8	-151.4	144.9	0	0	112.6	N539 F544 T559 A560 K569	N539-E542 CarbonylContact O-C 3.54Å; N539-E542 PolarHBondContact O-N 3.09Å; N539-E542 PolarHBondContact OD1-N 3.28Å; E542-F544 PolarHBondContact O-N 3.31Å; E542-T559 VanDerWaalsContact OE2-C 3.26Å; E542-T559 WeakPolarHBondContact OE2-CB 3.44Å; E542-T559 PolarHBondContact OE2-OG1 3.41Å; E542-A560 CarbonylContact C-O 3.21Å; E542-A560 WeakPolarHBondContact CA-O 3.37Å; E542-K569 IonicContact OE1-NZ 2.74Å; E542-K569 PolarHBondContact OE1-NZ 2.89Å; E542-K569 IonicContact OE2-NZ 2.71Å; E542-K569 PolarHBondContact OE2-NZ 2.67Å
543	P	90.3	Very high	90.2	Very high	40 Å²	40	66.6 Å²	66.6	26%	0.26	37%	0.37	S	S	.	.			trans	-74.3	-6.8	-170.5	30.2	-37	0	0	0	114.2	E536 C537 N539	E536-P543 CarbonylContact C-O 3.58Å; E536-P543 VanDerWaalsContact CA-O 3.31Å; E536-P543 WeakPolarHBondContact CA-O 3.43Å; C537-P543 PolarHBondContact N-O 3.47Å; C537-P543 WeakPolarHBondContact O-CA 3.36Å; N539-P543 WeakPolarHBondContact O-CA 3.41Å; N539-P543 WeakPolarHBondContact O-CD 3.32Å
544	F	95.1	Very high	89.9	Confident	61 Å²	61	66.6 Å²	66.6	27%	0.268	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	117.8	-179	-55.6	-65.5	0	0	0	111.2	E542 T559 A560 S562 K563 A566	E542-F544 PolarHBondContact O-N 3.31Å; F544-T559 CarbonylContact O-C 3.48Å; F544-T559 VanDerWaalsContact O-CA 3.31Å; F544-T559 WeakPolarHBondContact O-CA 3.08Å; F544-A560 WeakPolarHBondContact CB-O 3.41Å; F544-A560 PolarHBondContact N-O 3.15Å; F544-A560 PolarHBondContact O-N 2.99Å; F544-S562 VanDerWaalsContact CD2-CA 3.41Å; F544-K563 HydrophobicContact CB-CG 3.85Å; F544-K563 HydrophobicContact CD1-CD 4.03Å; F544-K563 HydrophobicContact CD1-CG 3.5Å; F544-K563 VanDerWaalsContact CD1-CG 3.5Å; F544-K563 HydrophobicContact CE1-CD 4.4Å; F544-K563 VanDerWaalsContact CE1-CE 3.49Å; F544-K563 HydrophobicContact CE1-CG 4.14Å; F544-K563 HydrophobicContact CG-CG 3.69Å; F544-A566 HydrophobicContact CB-CB 4.42Å; F544-A566 WeakPolarHBondContact O-CB 3.35Å
545	G	94.7	Very high	89.7	Confident	0 Å²	0	66.5 Å²	66.5	0%	0	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	150.4	169.9	0	0	0	0	0	112.5	F535	F535-G545 PolarHBondContact N-O 2.89Å; F535-G545 VanDerWaalsContact N-O 3.08Å; F535-G545 CarbonylContact O-C 3.43Å; F535-G545 WeakPolarHBondContact O-CA 3.28Å; F535-G545 PolarHBondContact O-N 3.16Å; F535-G545 VanDerWaalsContact O-O 3.04Å
546	A	97.2	Very high	89.6	Confident	0 Å²	0	63 Å²	63	0%	0	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	151.9	164.6	0	0	0	0	0	110.1	N533 F534 A557 G558 A566 A570	N533-A546 VanDerWaalsContact O-CA 3.28Å; N533-A546 WeakPolarHBondContact O-CA 3.4Å; F534-A546 HydrophobicContact CD1-CB 3.84Å; F534-A546 HydrophobicContact CE1-CB 3.9Å; A546-A557 CarbonylContact O-C 3.45Å; A546-A557 VanDerWaalsContact O-CA 3.29Å; A546-A557 WeakPolarHBondContact O-CA 3.41Å; A546-G558 PolarHBondContact N-O 3.26Å; A546-G558 PolarHBondContact O-N 2.81Å; A546-A566 HydrophobicContact CB-CB 4.05Å; A546-A570 HydrophobicContact CB-CB 4.15Å; A546-A570 WeakPolarHBondContact O-CB 3.49Å
547	S	94.6	Very high	89.6	Confident	7 Å²	7	59.1 Å²	59.1	5%	0.049	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	152.6	168.2	64.1	0	0	0	0	111.4	Y532 N533 G556	Y532-S547 CarbonylContact C-O 3.59Å; Y532-S547 WeakPolarHBondContact CA-O 3.35Å; N533-S547 PolarHBondContact N-O 3.07Å; N533-S547 PolarHBondContact O-N 3.33Å; S547-G556 WeakPolarHBondContact CA-O 3.27Å
548	V	96	Very high	89.9	Confident	0 Å²	0	58 Å²	58	0%	0	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	130.1	174.7	-172.4	0	0	0	0	109.2	L518 P530 V531 Y532 I550 T554 Y555 G556 A570 T574	L518-V548 HydrophobicContact CD2-CG1 4.18Å; L518-V548 HydrophobicContact CD2-CG2 4Å; P530-V548 HydrophobicContact CB-CG1 4.08Å; V531-V548 WeakPolarHBondContact O-CA 3.43Å; Y532-V548 HydrophobicContact CD1-CG2 3.98Å; Y532-V548 HydrophobicContact CE1-CG2 3.63Å; V548-I550 HydrophobicContact CG1-CG1 4.1Å; V548-T554 WeakPolarHBondContact O-CA 3.36Å; V548-Y555 PolarHBondContact O-N 3.02Å; V548-G556 PolarHBondContact N-O 2.91Å; V548-A570 HydrophobicContact CG2-CB 4.26Å; V548-T574 HydrophobicContact CB-CG2 4.31Å; V548-T574 WeakPolarHBondContact CB-OG1 3.37Å; V548-T574 HydrophobicContact CG1-CG2 4.24Å; V548-T574 VanDerWaalsContact CG2-OG1 3.23Å; V548-T574 WeakPolarHBondContact CG2-OG1 3.42Å
549	I	90.9	Very high	90.2	Very high	39 Å²	39	50.5 Å²	50.5	20%	0.2	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	131.7	172.8	-58.4	177.4	0	0	0	108.2	V531 N533 V553	V531-I549 HydrophobicContact CB-CB 4.22Å; V531-I549 PolarHBondContact N-O 2.92Å; V531-I549 VanDerWaalsContact N-O 3.07Å; V531-I549 PolarHBondContact O-N 2.94Å; N533-I549 HydrophobicContact CB-CD1 3.99Å; I549-V553 CarbonylContact C-O 3.6Å; I549-V553 VanDerWaalsContact CA-O 3.3Å; I549-V553 WeakPolarHBondContact CA-O 3.06Å
550	I	89.7	Confident	90.6	Very high	3 Å²	3	46.8 Å²	46.8	2%	0.015	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	123.3	174.8	-41	179	0	0	0	106.4	M522 V528 V548 G552 V553 Y555 T574 L578	M522-I550 HydrophobicContact CE-CB 4.13Å; M522-I550 HydrophobicContact CE-CD1 3.64Å; M522-I550 HydrophobicContact CE-CG1 3.62Å; M522-I550 HydrophobicContact CE-CG2 3.53Å; M522-I550 HydrophobicContact SD-CD1 3.81Å; M522-I550 HydrophobicContact SD-CG1 4.23Å; V528-I550 HydrophobicContact CG2-CG2 3.8Å; V548-I550 HydrophobicContact CG1-CG1 4.1Å; I550-G552 PolarHBondContact O-N 2.99Å; I550-V553 PolarHBondContact N-O 2.92Å; I550-V553 PolarHBondContact O-N 3.3Å; I550-Y555 HydrophobicContact CB-CD2 3.91Å; I550-Y555 HydrophobicContact CB-CE2 3.56Å; I550-Y555 HydrophobicContact CD1-CD1 4.21Å; I550-Y555 HydrophobicContact CD1-CD2 3.79Å; I550-Y555 HydrophobicContact CD1-CE1 4.31Å; I550-Y555 HydrophobicContact CD1-CE2 3.92Å; I550-Y555 HydrophobicContact CD1-CG 3.96Å; I550-Y555 HydrophobicContact CG1-CD2 3.67Å; I550-Y555 HydrophobicContact CG1-CE2 3.82Å; I550-Y555 HydrophobicContact CG1-CG 4.28Å; I550-T574 HydrophobicContact CD1-CG2 4.14Å; I550-L578 HydrophobicContact CD1-CD1 3.9Å
551	D	84	Confident	91	Very high	131 Å²	131	44.4 Å²	44.4	70%	0.701	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.4	36.5	178	-52.1	-27.2	0	0	0	114.6
552	G	80.3	Confident	91.3	Very high	66 Å²	66	42.2 Å²	42.2	68%	0.68	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	90	-17.2	179.9	0	0	0	0	0	115.2	I550	I550-G552 PolarHBondContact O-N 2.99Å
553	V	87.1	Confident	91.4	Very high	87 Å²	87	44.2 Å²	44.2	53%	0.527	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	139	179.3	179.9	0	0	0	0	110.4	I549 I550 Y555	I549-V553 CarbonylContact C-O 3.6Å; I549-V553 VanDerWaalsContact CA-O 3.3Å; I549-V553 WeakPolarHBondContact CA-O 3.06Å; I550-V553 PolarHBondContact N-O 2.92Å; I550-V553 PolarHBondContact O-N 3.3Å; V553-Y555 HydrophobicContact CB-CD2 4.49Å; V553-Y555 HydrophobicContact CB-CE2 3.89Å; V553-Y555 HydrophobicContact CG1-CD2 4.32Å; V553-Y555 HydrophobicContact CG1-CE2 3.93Å; V553-Y555 WeakPolarHBondContact O-CD2 3.28Å
554	T	89.3	Confident	91.5	Very high	80 Å²	80	51 Å²	51	49%	0.491	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	130.2	173.7	-60	0	0	0	0	110.3	V548	V548-T554 WeakPolarHBondContact O-CA 3.36Å
555	Y	90.9	Very high	91.2	Very high	86 Å²	86	51.6 Å²	51.6	34%	0.337	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	-108.5	179.6	-72.3	-111.9	0	0	0	110.2	V548 I550 V553 T574 I577 L578	V548-Y555 PolarHBondContact O-N 3.02Å; I550-Y555 HydrophobicContact CB-CD2 3.91Å; I550-Y555 HydrophobicContact CB-CE2 3.56Å; I550-Y555 HydrophobicContact CD1-CD1 4.21Å; I550-Y555 HydrophobicContact CD1-CD2 3.79Å; I550-Y555 HydrophobicContact CD1-CE1 4.31Å; I550-Y555 HydrophobicContact CD1-CE2 3.92Å; I550-Y555 HydrophobicContact CD1-CG 3.96Å; I550-Y555 HydrophobicContact CG1-CD2 3.67Å; I550-Y555 HydrophobicContact CG1-CE2 3.82Å; I550-Y555 HydrophobicContact CG1-CG 4.28Å; V553-Y555 HydrophobicContact CB-CD2 4.49Å; V553-Y555 HydrophobicContact CB-CE2 3.89Å; V553-Y555 HydrophobicContact CG1-CD2 4.32Å; V553-Y555 HydrophobicContact CG1-CE2 3.93Å; V553-Y555 WeakPolarHBondContact O-CD2 3.28Å; Y555-T574 HydrophobicContact CG-CG2 4.42Å; Y555-I577 HydrophobicContact CD1-CG2 4.12Å; Y555-L578 HydrophobicContact CD1-CD2 4.09Å; Y555-L578 HydrophobicContact CD1-CG 4.46Å; Y555-L578 HydrophobicContact CE1-CD2 3.79Å
556	G	90.3	Very high	91.1	Very high	2 Å²	2	51.6 Å²	51.6	2%	0.021	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	141	179.2	0	0	0	0	0	112.7	S547 V548 T574	S547-G556 WeakPolarHBondContact CA-O 3.27Å; V548-G556 PolarHBondContact N-O 2.91Å; G556-T574 VanDerWaalsContact CA-OG1 3.23Å; G556-T574 WeakPolarHBondContact CA-OG1 3.37Å; G556-T574 PolarHBondContact N-OG1 3.27Å
557	A	93.2	Very high	91	Very high	54 Å²	54	54.6 Å²	54.6	45%	0.446	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	161.6	171.6	0	0	0	0	0	110.7	A546	A546-A557 CarbonylContact O-C 3.45Å; A546-A557 VanDerWaalsContact O-CA 3.29Å; A546-A557 WeakPolarHBondContact O-CA 3.41Å
558	G	93.8	Very high	91	Very high	10 Å²	10	55.9 Å²	55.9	10%	0.103	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-166.9	135.2	177.6	0	0	0	0	0	113.2	A546 A566	A546-G558 PolarHBondContact N-O 3.26Å; A546-G558 PolarHBondContact O-N 2.81Å; G558-A566 WeakPolarHBondContact O-CB 3.33Å
559	T	94.8	Very high	90.8	Very high	51 Å²	51	59.4 Å²	59.4	31%	0.313	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	151.8	173.9	52.6	0	0	0	0	111	E542 F544 K569	E542-T559 VanDerWaalsContact OE2-C 3.26Å; E542-T559 WeakPolarHBondContact OE2-CB 3.44Å; E542-T559 PolarHBondContact OE2-OG1 3.41Å; F544-T559 CarbonylContact O-C 3.48Å; F544-T559 VanDerWaalsContact O-CA 3.31Å; F544-T559 WeakPolarHBondContact O-CA 3.08Å; T559-K569 WeakPolarHBondContact O-CD 3.45Å; T559-K569 WeakPolarHBondContact O-CE 3.46Å; T559-K569 PolarHBondContact O-NZ 3.17Å
560	A	92.9	Very high	90.9	Very high	0 Å²	0	57.6 Å²	57.6	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.3	170.1	171.3	0	0	0	0	0	113.4	E542 F544 S562 L565 A566	E542-A560 CarbonylContact C-O 3.21Å; E542-A560 WeakPolarHBondContact CA-O 3.37Å; F544-A560 WeakPolarHBondContact CB-O 3.41Å; F544-A560 PolarHBondContact N-O 3.15Å; F544-A560 PolarHBondContact O-N 2.99Å; A560-S562 PolarHBondContact O-N 2.82Å; A560-S562 VanDerWaalsContact O-N 3.17Å; A560-L565 HydrophobicContact CB-CB 3.63Å; A560-L565 HydrophobicContact CB-CD2 4.01Å; A560-L565 HydrophobicContact CB-CG 3.67Å; A560-A566 HydrophobicContact CB-CB 3.97Å; A560-A566 VanDerWaalsContact CB-N 3.26Å
561	S	91.6	Very high	91.1	Very high	76 Å²	76	57.4 Å²	57.4	53%	0.531	32%	0.324	S	S	.	.	S	Bend	trans	-66.3	-2.4	168.1	58.6	0	0	0	0	115.1
562	S	91.9	Very high	91.4	Very high	44 Å²	44	54.5 Å²	54.5	31%	0.308	30%	0.303	S	S	.	.	S	Bend	trans	-152.5	147.2	170	66.2	0	0	0	0	112.6	F544 A560 K564 L565 A566	F544-S562 VanDerWaalsContact CD2-CA 3.41Å; A560-S562 PolarHBondContact O-N 2.82Å; A560-S562 VanDerWaalsContact O-N 3.17Å; S562-K564 PolarHBondContact O-N 3.02Å; S562-L565 PolarHBondContact O-N 2.78Å; S562-L565 WeakPolarHBondContact OG-CB 3.43Å; S562-L565 PolarHBondContact OG-N 2.92Å; S562-A566 WeakPolarHBondContact O-CB 3.28Å; S562-A566 PolarHBondContact O-N 2.87Å
563	K	90.1	Very high	91.8	Very high	91 Å²	91	52.6 Å²	52.6	40%	0.396	28%	0.282	S	S	.	.	H	α-helix	trans	-53.9	-28.8	174.8	-63.5	-172	179	-173.7	0	112.7	F534 E536 F544 K567	F534-K563 HydrophobicContact CD1-CB 4.4Å; F534-K563 HydrophobicContact CE1-CB 4.34Å; E536-K563 WeakPolarHBondContact OE1-CE 3.41Å; E536-K563 IonicContact OE1-NZ 3.18Å; E536-K563 PolarHBondContact OE1-NZ 2.9Å; F544-K563 HydrophobicContact CB-CG 3.85Å; F544-K563 HydrophobicContact CD1-CD 4.03Å; F544-K563 HydrophobicContact CD1-CG 3.5Å; F544-K563 VanDerWaalsContact CD1-CG 3.5Å; F544-K563 HydrophobicContact CE1-CD 4.4Å; F544-K563 VanDerWaalsContact CE1-CE 3.49Å; F544-K563 HydrophobicContact CE1-CG 4.14Å; F544-K563 HydrophobicContact CG-CG 3.69Å; K563-K567 VanDerWaalsContact O-CB 3.31Å; K563-K567 WeakPolarHBondContact O-CB 3.29Å; K563-K567 PolarHBondContact O-N 2.98Å; K563-K567 VanDerWaalsContact O-N 3.13Å
564	K	92.1	Very high	92	Very high	183 Å²	183	48.5 Å²	48.5	80%	0.796	26%	0.257	S	S	*	.	H	α-helix	trans	-69.8	-45.4	174.3	-176.3	-179	177.5	-176.7	0	113	S562 N568	S562-K564 PolarHBondContact O-N 3.02Å; K564-N568 PolarHBondContact O-N 3.41Å
565	L	89.8	Confident	92	Very high	73 Å²	73	44.7 Å²	44.7	38%	0.382	23%	0.233	S	C	.	.	H	α-helix	trans	-74.8	-34.3	-179.9	-176	58.6	0	0	0	111.3	A560 S562 N568 K569	A560-L565 HydrophobicContact CB-CB 3.63Å; A560-L565 HydrophobicContact CB-CD2 4.01Å; A560-L565 HydrophobicContact CB-CG 3.67Å; S562-L565 PolarHBondContact O-N 2.78Å; S562-L565 WeakPolarHBondContact OG-CB 3.43Å; S562-L565 PolarHBondContact OG-N 2.92Å; L565-N568 WeakPolarHBondContact O-CB 3.41Å; L565-N568 PolarHBondContact O-N 3.43Å; L565-N568 VanDerWaalsContact O-N 3.17Å; L565-K569 PolarHBondContact O-N 3.23Å
566	A	93.4	Very high	91.8	Very high	0 Å²	0	44 Å²	44	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-60.2	-49.7	172.6	0	0	0	0	0	110.9	F544 A546 G558 A560 S562 N568 K569 A570	F544-A566 HydrophobicContact CB-CB 4.42Å; F544-A566 WeakPolarHBondContact O-CB 3.35Å; A546-A566 HydrophobicContact CB-CB 4.05Å; G558-A566 WeakPolarHBondContact O-CB 3.33Å; A560-A566 HydrophobicContact CB-CB 3.97Å; A560-A566 VanDerWaalsContact CB-N 3.26Å; S562-A566 WeakPolarHBondContact O-CB 3.28Å; S562-A566 PolarHBondContact O-N 2.87Å; A566-N568 PolarHBondContact O-N 2.89Å; A566-K569 PolarHBondContact O-N 3.02Å; A566-A570 WeakPolarHBondContact O-CB 3.35Å; A566-A570 PolarHBondContact O-N 3.37Å
567	K	94.6	Very high	91.6	Very high	63 Å²	63	48.8 Å²	48.8	27%	0.274	26%	0.257	S	S	.	.	H	α-helix	trans	-55.5	-37.3	173.6	-165.2	-176.9	-170	165.7	0	112.7	V515 Y532 F534 K563 A571	V515-K567 HydrophobicContact CG1-CD 4.36Å; V515-K567 HydrophobicContact CG2-CD 4.34Å; V515-K567 HydrophobicContact CG2-CG 4.07Å; Y532-K567 HydrophobicContact CD1-CD 4.14Å; Y532-K567 VanDerWaalsContact CD1-CE 3.48Å; Y532-K567 HydrophobicContact CD1-CG 3.46Å; Y532-K567 VanDerWaalsContact CD1-CG 3.46Å; Y532-K567 HydrophobicContact CE1-CD 4.17Å; Y532-K567 HydrophobicContact CE1-CG 3.43Å; Y532-K567 VanDerWaalsContact CE1-CG 3.43Å; Y532-K567 VanDerWaalsContact CE2-CE 3.46Å; Y532-K567 HydrophobicContact CG-CD 4.41Å; Y532-K567 HydrophobicContact CG-CG 4.19Å; F534-K567 HydrophobicContact CE1-CB 4.14Å; F534-K567 HydrophobicContact CE1-CG 4.46Å; F534-K567 HydrophobicContact CZ-CB 4.38Å; F534-K567 HydrophobicContact CZ-CD 4.05Å; F534-K567 HydrophobicContact CZ-CG 4.24Å; K563-K567 VanDerWaalsContact O-CB 3.31Å; K563-K567 WeakPolarHBondContact O-CB 3.29Å; K563-K567 PolarHBondContact O-N 2.98Å; K563-K567 VanDerWaalsContact O-N 3.13Å; K567-A571 WeakPolarHBondContact O-CB 3.26Å; K567-A571 PolarHBondContact O-N 2.88Å
568	N	93.3	Very high	91.1	Very high	34 Å²	34	47.6 Å²	47.6	18%	0.182	24%	0.243	C	C	.	.	H	α-helix	trans	-70.4	-48.2	179.1	-176.1	-83.9	0	0	0	111.9	E514 V515 K564 L565 A566 A570 A571 R572	E514-N568 PolarHBondContact OE2-ND2 2.82Å; E514-N568 PolarHBondContact OE2-OD1 3.22Å; V515-N568 HydrophobicContact CG2-CB 4.5Å; K564-N568 PolarHBondContact O-N 3.41Å; L565-N568 WeakPolarHBondContact O-CB 3.41Å; L565-N568 PolarHBondContact O-N 3.43Å; L565-N568 VanDerWaalsContact O-N 3.17Å; A566-N568 PolarHBondContact O-N 2.89Å; N568-A570 PolarHBondContact O-N 3.45Å; N568-A571 PolarHBondContact O-N 2.9Å; N568-R572 PolarHBondContact O-N 3.26Å
569	K	91.9	Very high	90.5	Very high	75 Å²	75	47.6 Å²	47.6	33%	0.326	24%	0.241	S	C	.	.	H	α-helix	trans	-57.7	-45.2	172.5	-68.3	-162.3	-160.7	168.7	0	112	E542 T559 L565 A566 A571 R572 A573	E542-K569 IonicContact OE1-NZ 2.74Å; E542-K569 PolarHBondContact OE1-NZ 2.89Å; E542-K569 IonicContact OE2-NZ 2.71Å; E542-K569 PolarHBondContact OE2-NZ 2.67Å; T559-K569 WeakPolarHBondContact O-CD 3.45Å; T559-K569 WeakPolarHBondContact O-CE 3.46Å; T559-K569 PolarHBondContact O-NZ 3.17Å; L565-K569 PolarHBondContact O-N 3.23Å; A566-K569 PolarHBondContact O-N 3.02Å; K569-A571 PolarHBondContact O-N 2.69Å; K569-R572 WeakPolarHBondContact O-CB 3.43Å; K569-R572 PolarHBondContact O-N 3.14Å; K569-R572 VanDerWaalsContact O-N 3.17Å; K569-A573 PolarHBondContact O-N 3.18Å
570	A	94.7	Very high	89.6	Confident	0 Å²	0	50 Å²	50	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-61.7	-41.1	178	0	0	0	0	0	112.7	A546 V548 A566 N568 T574	A546-A570 HydrophobicContact CB-CB 4.15Å; A546-A570 WeakPolarHBondContact O-CB 3.49Å; V548-A570 HydrophobicContact CG2-CB 4.26Å; A566-A570 WeakPolarHBondContact O-CB 3.35Å; A566-A570 PolarHBondContact O-N 3.37Å; N568-A570 PolarHBondContact O-N 3.45Å; A570-T574 WeakPolarHBondContact O-CB 3.18Å; A570-T574 PolarHBondContact O-N 2.81Å; A570-T574 VanDerWaalsContact O-N 3.08Å; A570-T574 PolarHBondContact O-OG1 3.5Å
571	A	93.6	Very high	88.3	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-65.9	-39.2	173.9	0	0	0	0	0	112.1	E514 V515 L518 Y532 K567 N568 K569 T574 L575	E514-A571 HydrophobicContact CB-CB 4.38Å; V515-A571 HydrophobicContact CB-CB 4.42Å; V515-A571 HydrophobicContact CG2-CB 3.86Å; L518-A571 HydrophobicContact CB-CB 4.4Å; L518-A571 HydrophobicContact CD2-CB 3.85Å; Y532-A571 HydrophobicContact CE1-CB 4.33Å; K567-A571 WeakPolarHBondContact O-CB 3.26Å; K567-A571 PolarHBondContact O-N 2.88Å; N568-A571 PolarHBondContact O-N 2.9Å; K569-A571 PolarHBondContact O-N 2.69Å; A571-T574 PolarHBondContact O-N 3.42Å; A571-L575 WeakPolarHBondContact O-CG 3.36Å; A571-L575 PolarHBondContact O-N 2.94Å
572	R	90.2	Very high	87.5	Confident	69 Å²	69	50.4 Å²	50.4	26%	0.26	25%	0.253	S	S	.	.	H	α-helix	trans	-62	-52.7	175.4	-170.2	-177.8	171.9	88.9	23.5	111.8	E514 N568 K569 T574 L575 E576 F582 T586	E514-R572 HydrophobicContact CB-CB 4.33Å; E514-R572 HydrophobicContact CG-CB 4.1Å; E514-R572 HydrophobicContact CG-CG 4.32Å; N568-R572 PolarHBondContact O-N 3.26Å; K569-R572 WeakPolarHBondContact O-CB 3.43Å; K569-R572 PolarHBondContact O-N 3.14Å; K569-R572 VanDerWaalsContact O-N 3.17Å; R572-T574 PolarHBondContact O-N 2.87Å; R572-L575 WeakPolarHBondContact O-CB 3.28Å; R572-L575 PolarHBondContact O-N 2.83Å; R572-E576 HydrophobicContact CG-CG 4.49Å; R572-E576 IonicContact CZ-OE1 3.32Å; R572-E576 IonicContact NE-OE1 3.04Å; R572-E576 PolarHBondContact NE-OE1 3.13Å; R572-E576 IonicContact NH2-OE1 2.83Å; R572-E576 PolarHBondContact NH2-OE1 3.08Å; R572-E576 WeakPolarHBondContact O-CG 3.31Å; R572-E576 PolarHBondContact O-N 3.03Å; R572-F582 HydrophobicContact CG-CE1 4.4Å; R572-T586 PolarHBondContact NH2-OG1 3.38Å
573	A	89.1	Confident	86.3	Confident	27 Å²	27	51.4 Å²	51.4	22%	0.223	26%	0.257	C	S	.	.	H	α-helix	trans	-57.8	-34.2	176.9	0	0	0	0	0	112.1	K569 E576 I577	K569-A573 PolarHBondContact O-N 3.18Å; A573-E576 PolarHBondContact O-N 3.21Å; A573-I577 WeakPolarHBondContact O-CD1 3.34Å; A573-I577 VanDerWaalsContact O-CG1 3.28Å; A573-I577 WeakPolarHBondContact O-CG1 3.38Å; A573-I577 PolarHBondContact O-N 3.35Å
574	T	90.5	Very high	85.2	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-70.1	-38.5	175	-54.4	0	0	0	0	112.4	L518 V548 I550 Y555 G556 A570 A571 R572 E576 I577 L578	L518-T574 HydrophobicContact CD1-CG2 3.73Å; L518-T574 HydrophobicContact CD2-CG2 3.84Å; L518-T574 HydrophobicContact CG-CG2 4.46Å; V548-T574 HydrophobicContact CB-CG2 4.31Å; V548-T574 WeakPolarHBondContact CB-OG1 3.37Å; V548-T574 HydrophobicContact CG1-CG2 4.24Å; V548-T574 VanDerWaalsContact CG2-OG1 3.23Å; V548-T574 WeakPolarHBondContact CG2-OG1 3.42Å; I550-T574 HydrophobicContact CD1-CG2 4.14Å; Y555-T574 HydrophobicContact CG-CG2 4.42Å; G556-T574 VanDerWaalsContact CA-OG1 3.23Å; G556-T574 WeakPolarHBondContact CA-OG1 3.37Å; G556-T574 PolarHBondContact N-OG1 3.27Å; A570-T574 WeakPolarHBondContact O-CB 3.18Å; A570-T574 PolarHBondContact O-N 2.81Å; A570-T574 VanDerWaalsContact O-N 3.08Å; A570-T574 PolarHBondContact O-OG1 3.5Å; A571-T574 PolarHBondContact O-N 3.42Å; R572-T574 PolarHBondContact O-N 2.87Å; T574-E576 VanDerWaalsContact C-N 3.35Å; T574-I577 PolarHBondContact O-N 2.9Å; T574-L578 HydrophobicContact CG2-CD1 3.72Å; T574-L578 HydrophobicContact CG2-CG 4.25Å; T574-L578 WeakPolarHBondContact O-CB 3.23Å; T574-L578 VanDerWaalsContact O-CG 3.31Å; T574-L578 WeakPolarHBondContact O-CG 3.37Å; T574-L578 PolarHBondContact O-N 3.45Å
575	L	88.3	Confident	83.8	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-65.3	-38.5	173.4	-74.3	163.7	0	0	0	112	E514 I517 L518 A571 R572 I577 L578 I579 F582	E514-L575 HydrophobicContact CB-CD1 4.29Å; E514-L575 WeakPolarHBondContact O-CD1 3.2Å; I517-L575 HydrophobicContact CB-CD1 3.99Å; I517-L575 HydrophobicContact CG2-CD1 3.87Å; I517-L575 HydrophobicContact CG2-CD2 3.88Å; L518-L575 HydrophobicContact CB-CD1 4.15Å; L518-L575 HydrophobicContact CB-CD2 4.1Å; L518-L575 HydrophobicContact CB-CG 3.98Å; L518-L575 HydrophobicContact CD1-CD2 4.1Å; L518-L575 HydrophobicContact CD1-CG 4.2Å; A571-L575 WeakPolarHBondContact O-CG 3.36Å; A571-L575 PolarHBondContact O-N 2.94Å; R572-L575 WeakPolarHBondContact O-CB 3.28Å; R572-L575 PolarHBondContact O-N 2.83Å; L575-I577 PolarHBondContact O-N 2.85Å; L575-L578 PolarHBondContact O-N 2.83Å; L575-I579 HydrophobicContact CD2-CD1 3.55Å; L575-I579 WeakPolarHBondContact O-CB 3.4Å; L575-I579 PolarHBondContact O-N 3.42Å; L575-F582 HydrophobicContact CB-CD1 3.99Å; L575-F582 HydrophobicContact CB-CD2 4.23Å; L575-F582 HydrophobicContact CB-CE1 3.83Å; L575-F582 HydrophobicContact CB-CE2 4.09Å; L575-F582 HydrophobicContact CB-CG 4.19Å; L575-F582 HydrophobicContact CB-CZ 3.89Å; L575-F582 HydrophobicContact CD1-CE1 4.31Å; L575-F582 HydrophobicContact CD1-CE2 4.04Å; L575-F582 HydrophobicContact CD1-CZ 3.69Å; L575-F582 HydrophobicContact CD2-CE2 4.44Å; L575-F582 HydrophobicContact CG-CE2 4.43Å; L575-F582 HydrophobicContact CG-CZ 4.33Å
576	E	86.9	Confident	82.6	Confident	73 Å²	73	45.5 Å²	45.5	34%	0.341	23%	0.234	S	C	.	.	H	α-helix	trans	-67	-22.9	176.9	-68.3	171.4	166.6	0	0	112.6	R572 A573 T574 F582 V583	R572-E576 HydrophobicContact CG-CG 4.49Å; R572-E576 IonicContact CZ-OE1 3.32Å; R572-E576 IonicContact NE-OE1 3.04Å; R572-E576 PolarHBondContact NE-OE1 3.13Å; R572-E576 IonicContact NH2-OE1 2.83Å; R572-E576 PolarHBondContact NH2-OE1 3.08Å; R572-E576 WeakPolarHBondContact O-CG 3.31Å; R572-E576 PolarHBondContact O-N 3.03Å; A573-E576 PolarHBondContact O-N 3.21Å; T574-E576 VanDerWaalsContact C-N 3.35Å; E576-F582 HydrophobicContact CG-CD1 3.69Å; E576-F582 HydrophobicContact CG-CE1 4.28Å; E576-V583 HydrophobicContact CB-CG2 4.36Å; E576-V583 HydrophobicContact CG-CG2 3.68Å
577	I	86	Confident	80.8	Confident	101 Å²	101	49 Å²	49	52%	0.518	26%	0.258	S	S	.	.	H	α-helix	trans	-84.3	-43.5	170.8	-66	161.6	0	0	0	111.9	Y555 A573 T574 L575	Y555-I577 HydrophobicContact CD1-CG2 4.12Å; A573-I577 WeakPolarHBondContact O-CD1 3.34Å; A573-I577 VanDerWaalsContact O-CG1 3.28Å; A573-I577 WeakPolarHBondContact O-CG1 3.38Å; A573-I577 PolarHBondContact O-N 3.35Å; T574-I577 PolarHBondContact O-N 2.9Å; L575-I577 PolarHBondContact O-N 2.85Å
578	L	84.2	Confident	78.5	Confident	30 Å²	30	52 Å²	52	16%	0.157	27%	0.273	C	S	.	.	H	α-helix	trans	-84.8	-16.1	-171.8	-68.5	176.9	0	0	0	114.8	L518 Y521 I550 Y555 T574 L575	L518-L578 HydrophobicContact CD1-CD1 3.91Å; Y521-L578 HydrophobicContact CD1-CD1 4.21Å; Y521-L578 HydrophobicContact CE1-CB 3.94Å; Y521-L578 HydrophobicContact CE1-CD1 3.86Å; Y521-L578 HydrophobicContact CE1-CG 4.41Å; Y521-L578 PolarHBondContact OH-O 3.43Å; I550-L578 HydrophobicContact CD1-CD1 3.9Å; Y555-L578 HydrophobicContact CD1-CD2 4.09Å; Y555-L578 HydrophobicContact CD1-CG 4.46Å; Y555-L578 HydrophobicContact CE1-CD2 3.79Å; T574-L578 HydrophobicContact CG2-CD1 3.72Å; T574-L578 HydrophobicContact CG2-CG 4.25Å; T574-L578 WeakPolarHBondContact O-CB 3.23Å; T574-L578 VanDerWaalsContact O-CG 3.31Å; T574-L578 WeakPolarHBondContact O-CG 3.37Å; T574-L578 PolarHBondContact O-N 3.45Å; L575-L578 PolarHBondContact O-N 2.83Å
579	I	80.8	Confident	76.2	Confident	9 Å²	9	58.4 Å²	58.4	5%	0.046	30%	0.302	C	S	.	.	S	Bend	trans	-131.5	100.7	-176	-56.4	169.4	0	0	0	108.5	I492 L494 Y521 L575 D581 F582	I492-I579 HydrophobicContact CG2-CG2 4.18Å; L494-I579 HydrophobicContact CD2-CB 4.44Å; L494-I579 HydrophobicContact CD2-CD1 3.94Å; L494-I579 HydrophobicContact CD2-CG1 3.9Å; L494-I579 HydrophobicContact CD2-CG2 3.71Å; Y521-I579 HydrophobicContact CD2-CD1 3.61Å; Y521-I579 HydrophobicContact CD2-CG1 3.75Å; Y521-I579 HydrophobicContact CE2-CD1 3.94Å; Y521-I579 HydrophobicContact CE2-CG1 3.5Å; Y521-I579 VanDerWaalsContact CE2-CG1 3.5Å; Y521-I579 HydrophobicContact CG-CD1 4.31Å; L575-I579 HydrophobicContact CD2-CD1 3.55Å; L575-I579 WeakPolarHBondContact O-CB 3.4Å; L575-I579 PolarHBondContact O-N 3.42Å; I579-D581 PolarHBondContact O-N 2.68Å; I579-F582 HydrophobicContact CB-CB 3.89Å; I579-F582 HydrophobicContact CD1-CD2 4.09Å; I579-F582 HydrophobicContact CG2-CB 3.9Å; I579-F582 HydrophobicContact CG2-CD2 4.47Å; I579-F582 VanDerWaalsContact O-CB 3.23Å; I579-F582 WeakPolarHBondContact O-CB 3.18Å; I579-F582 PolarHBondContact O-N 3.13Å; I579-F582 VanDerWaalsContact O-N 3.16Å
580	P	75.5	Confident	74	Confident	103 Å²	103	63.1 Å²	63.1	67%	0.669	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51	140.3	169	-27.1	35.9	0	0	0	111.2	F582	P580-F582 PolarHBondContact O-N 2.83Å; P580-F582 VanDerWaalsContact O-N 3.11Å
581	D	65.8	Low	71.6	Confident	80 Å²	80	65.8 Å²	65.8	43%	0.428	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.4	10.5	-177.7	-65.1	-16.9	0	0	0	116.9	I579 V583 K584 Q585	I579-D581 PolarHBondContact O-N 2.68Å; D581-V583 PolarHBondContact O-N 3.44Å; D581-K584 HydrophobicContact CB-CB 4.41Å; D581-K584 HydrophobicContact CB-CD 4.13Å; D581-K584 HydrophobicContact CB-CG 4.47Å; D581-K584 PolarHBondContact O-N 2.73Å; D581-K584 VanDerWaalsContact O-N 3.09Å; D581-K584 WeakPolarHBondContact OD1-CD 3.46Å; D581-K584 WeakPolarHBondContact OD1-CE 3.46Å; D581-K584 IonicContact OD1-NZ 2.89Å; D581-K584 PolarHBondContact OD1-NZ 3.2Å; D581-K584 IonicContact OD2-NZ 2.71Å; D581-K584 PolarHBondContact OD2-NZ 2.71Å; D581-K584 VanDerWaalsContact OD2-NZ 3.13Å; D581-Q585 WeakPolarHBondContact O-CG 3.29Å; D581-Q585 PolarHBondContact O-N 3.36Å
582	F	74.4	Confident	69.3	Low	3 Å²	3	74 Å²	74	1%	0.013	38%	0.375	C	S	.	.	H	α-helix	trans	-53.3	-37	170.6	179.4	-95.2	0	0	0	112.9	I492 I517 R572 L575 E576 I579 P580 T586	I492-F582 HydrophobicContact CD1-CD2 3.9Å; I492-F582 HydrophobicContact CD1-CE2 3.77Å; I517-F582 HydrophobicContact CG2-CE2 4.28Å; R572-F582 HydrophobicContact CG-CE1 4.4Å; L575-F582 HydrophobicContact CB-CD1 3.99Å; L575-F582 HydrophobicContact CB-CD2 4.23Å; L575-F582 HydrophobicContact CB-CE1 3.83Å; L575-F582 HydrophobicContact CB-CE2 4.09Å; L575-F582 HydrophobicContact CB-CG 4.19Å; L575-F582 HydrophobicContact CB-CZ 3.89Å; L575-F582 HydrophobicContact CD1-CE1 4.31Å; L575-F582 HydrophobicContact CD1-CE2 4.04Å; L575-F582 HydrophobicContact CD1-CZ 3.69Å; L575-F582 HydrophobicContact CD2-CE2 4.44Å; L575-F582 HydrophobicContact CG-CE2 4.43Å; L575-F582 HydrophobicContact CG-CZ 4.33Å; E576-F582 HydrophobicContact CG-CD1 3.69Å; E576-F582 HydrophobicContact CG-CE1 4.28Å; I579-F582 HydrophobicContact CB-CB 3.89Å; I579-F582 HydrophobicContact CD1-CD2 4.09Å; I579-F582 HydrophobicContact CG2-CB 3.9Å; I579-F582 HydrophobicContact CG2-CD2 4.47Å; I579-F582 VanDerWaalsContact O-CB 3.23Å; I579-F582 WeakPolarHBondContact O-CB 3.18Å; I579-F582 PolarHBondContact O-N 3.13Å; I579-F582 VanDerWaalsContact O-N 3.16Å; P580-F582 PolarHBondContact O-N 2.83Å; P580-F582 VanDerWaalsContact O-N 3.11Å; F582-T586 HydrophobicContact CD2-CG2 4.36Å; F582-T586 HydrophobicContact CE1-CG2 4.43Å; F582-T586 HydrophobicContact CE2-CG2 4.04Å; F582-T586 HydrophobicContact CZ-CG2 4.07Å; F582-T586 WeakPolarHBondContact O-CB 3.3Å; F582-T586 WeakPolarHBondContact O-CG2 3.46Å; F582-T586 PolarHBondContact O-N 3.2Å; F582-T586 PolarHBondContact O-OG1 3.02Å
583	V	67.4	Low	67.6	Low	65 Å²	65	73.4 Å²	73.4	39%	0.394	38%	0.377	S	S	.	.	H	α-helix	trans	-59.9	-61.8	172.7	-176.6	0	0	0	0	109.5	E576 D581 Q585 T586 S587	E576-V583 HydrophobicContact CB-CG2 4.36Å; E576-V583 HydrophobicContact CG-CG2 3.68Å; D581-V583 PolarHBondContact O-N 3.44Å; V583-Q585 VanDerWaalsContact C-N 3.28Å; V583-Q585 PolarHBondContact O-N 3.24Å; V583-T586 CarbonylContact O-C 3.45Å; V583-T586 PolarHBondContact O-N 2.93Å; V583-T586 PolarHBondContact O-OG1 2.96Å; V583-S587 WeakPolarHBondContact O-CB 3.27Å; V583-S587 PolarHBondContact O-N 2.85Å; V583-S587 PolarHBondContact O-OG 2.86Å
584	K	66.6	Low	65.8	Low	115 Å²	115	76.2 Å²	76.2	50%	0.5	40%	0.395	S	S	.	.	H	α-helix	trans	-52.5	-45.1	-177.8	-55.9	179	-169.6	154.4	0	112.3	D581 T586	D581-K584 HydrophobicContact CB-CB 4.41Å; D581-K584 HydrophobicContact CB-CD 4.13Å; D581-K584 HydrophobicContact CB-CG 4.47Å; D581-K584 PolarHBondContact O-N 2.73Å; D581-K584 VanDerWaalsContact O-N 3.09Å; D581-K584 WeakPolarHBondContact OD1-CD 3.46Å; D581-K584 WeakPolarHBondContact OD1-CE 3.46Å; D581-K584 IonicContact OD1-NZ 2.89Å; D581-K584 PolarHBondContact OD1-NZ 3.2Å; D581-K584 IonicContact OD2-NZ 2.71Å; D581-K584 PolarHBondContact OD2-NZ 2.71Å; D581-K584 VanDerWaalsContact OD2-NZ 3.13Å; K584-T586 PolarHBondContact O-N 3.08Å
585	Q	62.8	Low	64.2	Low	62 Å²	62	82.2 Å²	82.2	29%	0.29	42%	0.423	S	S	.	.	H	α-helix	trans	-68.1	-14.8	179.1	-65.3	178.7	18.3	0	0	114	K490 D581 V583	K490-Q585 VanDerWaalsContact CD-O 3.29Å; K490-Q585 WeakPolarHBondContact CD-O 3.43Å; D581-Q585 WeakPolarHBondContact O-CG 3.29Å; D581-Q585 PolarHBondContact O-N 3.36Å; V583-Q585 VanDerWaalsContact C-N 3.28Å; V583-Q585 PolarHBondContact O-N 3.24Å
586	T	64.2	Low	62.8	Low	47 Å²	47	84.4 Å²	84.4	29%	0.288	43%	0.434	S	S	.	.	H	α-helix	trans	-124.3	-9.1	-178.8	66.1	0	0	0	0	115.6	I492 R572 F582 V583 K584	I492-T586 HydrophobicContact CD1-CG2 4.39Å; R572-T586 PolarHBondContact NH2-OG1 3.38Å; F582-T586 HydrophobicContact CD2-CG2 4.36Å; F582-T586 HydrophobicContact CE1-CG2 4.43Å; F582-T586 HydrophobicContact CE2-CG2 4.04Å; F582-T586 HydrophobicContact CZ-CG2 4.07Å; F582-T586 WeakPolarHBondContact O-CB 3.3Å; F582-T586 WeakPolarHBondContact O-CG2 3.46Å; F582-T586 PolarHBondContact O-N 3.2Å; F582-T586 PolarHBondContact O-OG1 3.02Å; V583-T586 CarbonylContact O-C 3.45Å; V583-T586 PolarHBondContact O-N 2.93Å; V583-T586 PolarHBondContact O-OG1 2.96Å; K584-T586 PolarHBondContact O-N 3.08Å
587	S	56.9	Low	61.9	Low	72 Å²	72	81.3 Å²	81.3	50%	0.503	42%	0.419	S	S	.	.	H	α-helix	trans	-107.5	-29.8	-171	70.8	0	0	0	0	115	V583	V583-S587 WeakPolarHBondContact O-CB 3.27Å; V583-S587 PolarHBondContact O-N 2.85Å; V583-S587 PolarHBondContact O-OG 2.86Å
588	E	44.8	Very low	61.3	Low	128 Å²	128	81.5 Å²	81.5	60%	0.598	42%	0.418	S	S	*	.	S	Bend	trans	-66.9	141.6	171.1	-73.1	176.1	-177.3	0	0	109.8	K490	K490-E588 PolarHBondContact NZ-O 3.23Å
589	E	44.9	Very low	61.2	Low	168 Å²	168	84.4 Å²	84.4	79%	0.785	43%	0.428	S	S	*	.			trans	-32.7	139.7	-159.6	-66.3	-168.6	115.7	0	0	115.7	P591	E589-P591 WeakPolarHBondContact O-CD 3.19Å
590	K	45.3	Very low	61.4	Low	174 Å²	174	84.1 Å²	84.1	76%	0.757	43%	0.426	S	S	*	.	P	Polyproline II helix	trans	-55.6	122.3	153.4	-69.7	174.7	-177.4	165.9	0	106.6	K592	K590-K592 PolarHBondContact O-N 3Å
591	P	45.8	Very low	61.7	Low	55 Å²	55	81.1 Å²	81.1	36%	0.357	40%	0.404	S	S	.	.	P	Polyproline II helix	trans	-54.5	141	167.3	26.2	-33.5	0	0	0	107.3	E589 D593	E589-P591 WeakPolarHBondContact O-CD 3.19Å; P591-D593 PolarHBondContact O-N 3.23Å
592	K	45.6	Very low	62.4	Low	173 Å²	173	84.7 Å²	84.7	75%	0.752	42%	0.418	S	S	*	.	P	Polyproline II helix	trans	-53.8	121	-175.7	-70.5	170.1	-179.3	166.7	0	108.3	K590 S594 E595	K590-K592 PolarHBondContact O-N 3Å; K592-S594 PolarHBondContact O-N 3.02Å; K592-E595 PolarHBondContact O-N 3.32Å
593	D	52.8	Low	63	Low	57 Å²	57	85 Å²	85	31%	0.305	42%	0.419	S	S	.	.	H	α-helix	trans	-44	-29.5	-173.1	-68	-0.6	0	0	0	112.5	P591 E595 L597 K706	P591-D593 PolarHBondContact O-N 3.23Å; D593-E595 PolarHBondContact O-N 2.89Å; D593-L597 PolarHBondContact O-N 3.47Å; D593-K706 IonicContact OD2-NZ 3.94Å; D593-K706 PolarHBondContact OD2-NZ 2.71Å
594	S	52.7	Low	64.1	Low	85 Å²	85	85.3 Å²	85.3	59%	0.594	43%	0.425	S	S	*	.	H	α-helix	trans	-47.1	-43.2	170.8	-167.7	0	0	0	0	116.6	K592 E598	K592-S594 PolarHBondContact O-N 3.02Å; S594-E598 PolarHBondContact O-N 3.08Å
595	E	57	Low	65.3	Low	126 Å²	126	79.8 Å²	79.8	59%	0.589	40%	0.401	S	S	*	.	H	α-helix	trans	-83.9	-34.3	-171.7	-168	172.8	-162.8	0	0	111.8	K592 D593 L597 E598	K592-E595 PolarHBondContact O-N 3.32Å; D593-E595 PolarHBondContact O-N 2.89Å; E595-L597 PolarHBondContact O-N 3.23Å; E595-E598 PolarHBondContact O-N 3.13Å; E595-E598 VanDerWaalsContact O-N 3.13Å
596	E	59.2	Low	66.7	Low	47 Å²	47	81.2 Å²	81.2	22%	0.22	41%	0.407	C	S	.	.	H	α-helix	trans	-64.8	-30.7	170.5	-170.4	172.5	-155.4	0	0	111.3	F600 A617	E596-F600 WeakPolarHBondContact O-CD2 3.3Å; E596-A617 WeakPolarHBondContact OE1-CB 3.37Å
597	L	66.3	Low	68	Low	8 Å²	8	80.5 Å²	80.5	4%	0.042	40%	0.402	C	S	.	.	H	α-helix	trans	-72.9	-25.2	172.7	-118.1	71.5	0	0	0	113.8	D593 E595 F600 N601 L697 R698	D593-L597 PolarHBondContact O-N 3.47Å; E595-L597 PolarHBondContact O-N 3.23Å; L597-F600 PolarHBondContact O-N 2.98Å; L597-F600 VanDerWaalsContact O-N 3.14Å; L597-N601 PolarHBondContact O-N 2.81Å; L597-L697 HydrophobicContact CD1-CB 4.18Å; L597-L697 HydrophobicContact CD1-CD1 4.22Å; L597-L697 HydrophobicContact CD2-CB 4.4Å; L597-L697 HydrophobicContact CG-CB 4.28Å; L597-R698 HydrophobicContact CD2-CB 4.33Å
598	E	74.3	Confident	69.5	Low	105 Å²	105	81.1 Å²	81.1	49%	0.491	41%	0.406	S	S	.	.	H	α-helix	trans	-70.3	-35.1	-174	-175	152.7	-146.3	0	0	113	S594 E595 F600 N601 H602	S594-E598 PolarHBondContact O-N 3.08Å; E595-E598 PolarHBondContact O-N 3.13Å; E595-E598 VanDerWaalsContact O-N 3.13Å; E598-F600 VanDerWaalsContact C-N 3.25Å; E598-F600 PolarHBondContact O-N 2.96Å; E598-N601 WeakPolarHBondContact O-CB 3.4Å; E598-N601 PolarHBondContact O-N 2.65Å; E598-N601 VanDerWaalsContact O-N 3.09Å; E598-H602 PolarHBondContact O-ND1 3.09Å; E598-H602 VanDerWaalsContact O-ND1 3.1Å
599	Y	82	Confident	71.6	Confident	91 Å²	91	80.8 Å²	80.8	36%	0.357	40%	0.399	S	S	.	.	H	α-helix	trans	-54.3	-42.3	168.6	177.1	-112.7	0	0	0	112	P486 N601 H602 I603 L613	P486-Y599 HydrophobicContact CG-CD1 4.36Å; P486-Y599 HydrophobicContact CG-CE1 4.25Å; Y599-N601 VanDerWaalsContact C-N 3.33Å; Y599-N601 PolarHBondContact O-N 3.36Å; Y599-H602 PolarHBondContact O-N 2.99Å; Y599-I603 HydrophobicContact CD1-CD1 3.81Å; Y599-I603 HydrophobicContact CE1-CD1 3.44Å; Y599-I603 VanDerWaalsContact CE1-CD1 3.44Å; Y599-I603 HydrophobicContact CE2-CD1 4.36Å; Y599-I603 HydrophobicContact CG-CD1 4.41Å; Y599-L613 HydrophobicContact CE1-CD1 4.12Å; Y599-L613 HydrophobicContact CE1-CD2 4.21Å
600	F	84.1	Confident	73.8	Confident	3 Å²	3	72.8 Å²	72.8	1%	0.013	36%	0.362	C	S	.	.	H	α-helix	trans	-76.3	-12.8	179.4	-66.9	-78.6	0	0	0	114.3	E596 L597 E598 H602 I603 L613 T614 A617 L619 W693 G694 L697	E596-F600 WeakPolarHBondContact O-CD2 3.3Å; L597-F600 PolarHBondContact O-N 2.98Å; L597-F600 VanDerWaalsContact O-N 3.14Å; E598-F600 VanDerWaalsContact C-N 3.25Å; E598-F600 PolarHBondContact O-N 2.96Å; F600-H602 PolarHBondContact O-N 3.12Å; F600-I603 HydrophobicContact CD1-CD1 3.89Å; F600-I603 HydrophobicContact CE1-CD1 4.27Å; F600-I603 PolarHBondContact O-N 3.5Å; F600-L613 HydrophobicContact CE1-CB 3.86Å; F600-L613 HydrophobicContact CZ-CB 4.15Å; F600-T614 HydrophobicContact CE1-CG2 4.25Å; F600-A617 HydrophobicContact CE2-CB 4.4Å; F600-A617 HydrophobicContact CZ-CB 4.34Å; F600-L619 HydrophobicContact CD2-CD1 4.16Å; F600-L619 HydrophobicContact CE2-CD1 3.55Å; F600-L619 HydrophobicContact CZ-CD1 3.99Å; F600-W693 HydrophobicContact CB-CB 4.45Å; F600-W693 HydrophobicContact CD1-CB 4.42Å; F600-W693 AromaticContact CD1-CD1 3.59Å; F600-W693 HydrophobicContact CD1-CG 4.32Å; F600-W693 PolarHBondContact O-N 2.99Å; F600-G694 PolarHBondContact O-N 3.33Å; F600-L697 HydrophobicContact CB-CD1 3.88Å; F600-L697 HydrophobicContact CD1-CD1 4.3Å; F600-L697 HydrophobicContact CD2-CD1 3.78Å; F600-L697 HydrophobicContact CE2-CD1 4.4Å; F600-L697 HydrophobicContact CG-CD1 3.73Å
601	N	83.3	Confident	76.1	Confident	40 Å²	40	66.2 Å²	66.2	21%	0.214	33%	0.333	C	S	.	.	H	α-helix	trans	-65.3	-22	171.5	-64.6	-25.1	0	0	0	112.1	L597 E598 Y599 N692	L597-N601 PolarHBondContact O-N 2.81Å; E598-N601 WeakPolarHBondContact O-CB 3.4Å; E598-N601 PolarHBondContact O-N 2.65Å; E598-N601 VanDerWaalsContact O-N 3.09Å; Y599-N601 VanDerWaalsContact C-N 3.33Å; Y599-N601 PolarHBondContact O-N 3.36Å; N601-N692 WeakPolarHBondContact O-CB 3.32Å; N601-N692 PolarHBondContact O-ND2 3.22Å
602	H	80.8	Confident	78.1	Confident	155 Å²	155	68.5 Å²	68.5	72%	0.718	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100	0.7	-176.9	-60.7	91.8	0	0	0	113.5	E598 Y599 F600	E598-H602 PolarHBondContact O-ND1 3.09Å; E598-H602 VanDerWaalsContact O-ND1 3.1Å; Y599-H602 PolarHBondContact O-N 2.99Å; F600-H602 PolarHBondContact O-N 3.12Å
603	I	87.2	Confident	80	Confident	8 Å²	8	60.5 Å²	60.5	4%	0.041	30%	0.304	C	S	.	.	S	Bend	trans	-108	122.9	-176.2	-63	170.9	0	0	0	109.8	Y599 F600 D607 V610 L613 N692 W693	Y599-I603 HydrophobicContact CD1-CD1 3.81Å; Y599-I603 HydrophobicContact CE1-CD1 3.44Å; Y599-I603 VanDerWaalsContact CE1-CD1 3.44Å; Y599-I603 HydrophobicContact CE2-CD1 4.36Å; Y599-I603 HydrophobicContact CG-CD1 4.41Å; F600-I603 HydrophobicContact CD1-CD1 3.89Å; F600-I603 HydrophobicContact CE1-CD1 4.27Å; F600-I603 PolarHBondContact O-N 3.5Å; I603-D607 HydrophobicContact CG2-CB 3.84Å; I603-V610 HydrophobicContact CG2-CG2 3.34Å; I603-L613 HydrophobicContact CD1-CD1 3.81Å; I603-N692 CarbonylContact O-C 3.54Å; I603-N692 VanDerWaalsContact O-CA 3.26Å; I603-N692 WeakPolarHBondContact O-CA 3.31Å; I603-W693 PolarHBondContact O-N 3.32Å
604	S	89.7	Confident	81.6	Confident	72 Å²	72	57.8 Å²	57.8	50%	0.503	29%	0.29	S	S	.	.	B	Isolated β-bridge	trans	-62.3	147.9	177.1	-57.6	0	0	0	0	112.3	E606 D607 K691	S604-E606 VanDerWaalsContact C-N 3.26Å; S604-E606 PolarHBondContact O-N 3.1Å; S604-D607 WeakPolarHBondContact O-CB 3.43Å; S604-D607 PolarHBondContact O-N 3.39Å; S604-D607 VanDerWaalsContact O-N 3.12Å; S604-K691 VanDerWaalsContact CA-O 3.31Å; S604-K691 WeakPolarHBondContact CA-O 3.41Å
605	I	92.1	Very high	83.2	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-38.2	-178.6	-68.1	169.9	0	0	0	112.4	Q680 L683 Q684 V690 K691 W693 L696	I605-Q680 HydrophobicContact CG2-CB 4.45Å; I605-Q680 WeakPolarHBondContact CG2-O 3.49Å; I605-Q680 WeakPolarHBondContact O-CB 3.36Å; I605-Q680 VanDerWaalsContact O-CG 3.28Å; I605-Q680 WeakPolarHBondContact O-CG 3.42Å; I605-L683 HydrophobicContact CG2-CB 4.28Å; I605-Q684 HydrophobicContact CG2-CB 4.06Å; I605-V690 HydrophobicContact CD1-CB 4.34Å; I605-V690 HydrophobicContact CD1-CG1 4.13Å; I605-V690 WeakPolarHBondContact CD1-O 3.35Å; I605-K691 PolarHBondContact N-O 3.24Å; I605-K691 VanDerWaalsContact N-O 3.07Å; I605-W693 HydrophobicContact CB-CE3 4.43Å; I605-W693 HydrophobicContact CG1-CE3 4.38Å; I605-W693 HydrophobicContact CG2-CE3 4.16Å; I605-W693 HydrophobicContact CG2-CZ3 4.1Å; I605-L696 HydrophobicContact CB-CD1 4.5Å; I605-L696 HydrophobicContact CD1-CD1 3.72Å; I605-L696 HydrophobicContact CD1-CD2 4.4Å; I605-L696 HydrophobicContact CD1-CG 3.98Å; I605-L696 HydrophobicContact CG1-CD1 3.76Å; I605-L696 HydrophobicContact CG1-CG 4.26Å; I605-L696 HydrophobicContact CG2-CD1 3.96Å
606	E	91.7	Very high	84.3	Confident	91 Å²	91	53.3 Å²	53.3	43%	0.425	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.8	9.1	-179.4	-54.1	-162.5	172.8	0	0	114.5	S604 S608 Q684	S604-E606 VanDerWaalsContact C-N 3.26Å; S604-E606 PolarHBondContact O-N 3.1Å; E606-S608 PolarHBondContact O-N 3.22Å; E606-Q684 HydrophobicContact CG-CB 4.11Å; E606-Q684 HydrophobicContact CG-CG 4.25Å; E606-Q684 WeakPolarHBondContact OE1-CB 3.38Å
607	D	90.6	Very high	85.2	Confident	32 Å²	32	51.7 Å²	51.7	17%	0.171	26%	0.259	C	S	.	.			trans	-64	121.5	174.1	-178.6	-32	0	0	0	109.9	I603 S604 R609 V610 Q680	I603-D607 HydrophobicContact CG2-CB 3.84Å; S604-D607 WeakPolarHBondContact O-CB 3.43Å; S604-D607 PolarHBondContact O-N 3.39Å; S604-D607 VanDerWaalsContact O-N 3.12Å; D607-R609 PolarHBondContact O-N 2.92Å; D607-R609 WeakPolarHBondContact OD1-CB 3.46Å; D607-R609 VanDerWaalsContact OD1-CG 3.31Å; D607-R609 WeakPolarHBondContact OD1-CG 3.47Å; D607-R609 PolarHBondContact OD1-N 3.25Å; D607-R609 IonicContact OD1-NE 2.68Å; D607-R609 PolarHBondContact OD1-NE 2.95Å; D607-R609 VanDerWaalsContact OD1-NE 3.08Å; D607-R609 IonicContact OD2-CZ 3.47Å; D607-R609 IonicContact OD2-NE 3.5Å; D607-R609 PolarHBondContact OD2-NE 3.23Å; D607-R609 VanDerWaalsContact OD2-NE 3.13Å; D607-R609 IonicContact OD2-NH2 2.7Å; D607-R609 PolarHBondContact OD2-NH2 3.19Å; D607-V610 HydrophobicContact CB-CG2 4.02Å; D607-V610 VanDerWaalsContact O-CB 3.29Å; D607-V610 WeakPolarHBondContact O-CB 3.21Å; D607-V610 WeakPolarHBondContact O-CG2 3.47Å; D607-V610 PolarHBondContact O-N 3.17Å; D607-Q680 PolarHBondContact O-NE2 3.47Å
608	S	88.6	Confident	85.6	Confident	85 Å²	85	51.6 Å²	51.6	59%	0.594	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-25.9	-176.6	-69.9	0	0	0	0	113.4	E606	E606-S608 PolarHBondContact O-N 3.22Å
609	R	90.4	Very high	86.1	Confident	122 Å²	122	48 Å²	48	46%	0.46	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-20.1	179.1	-54.9	173.1	-65.2	174.2	3.2	112.9	D607 Y611 E612 L613	D607-R609 PolarHBondContact O-N 2.92Å; D607-R609 WeakPolarHBondContact OD1-CB 3.46Å; D607-R609 VanDerWaalsContact OD1-CG 3.31Å; D607-R609 WeakPolarHBondContact OD1-CG 3.47Å; D607-R609 PolarHBondContact OD1-N 3.25Å; D607-R609 IonicContact OD1-NE 2.68Å; D607-R609 PolarHBondContact OD1-NE 2.95Å; D607-R609 VanDerWaalsContact OD1-NE 3.08Å; D607-R609 IonicContact OD2-CZ 3.47Å; D607-R609 IonicContact OD2-NE 3.5Å; D607-R609 PolarHBondContact OD2-NE 3.23Å; D607-R609 VanDerWaalsContact OD2-NE 3.13Å; D607-R609 IonicContact OD2-NH2 2.7Å; D607-R609 PolarHBondContact OD2-NH2 3.19Å; R609-Y611 PolarHBondContact O-N 3.26Å; R609-Y611 VanDerWaalsContact O-N 3.15Å; R609-E612 PolarHBondContact O-N 3.44Å; R609-L613 HydrophobicContact CB-CD1 3.76Å; R609-L613 HydrophobicContact CB-CG 4.17Å; R609-L613 WeakPolarHBondContact O-CG 3.42Å; R609-L613 PolarHBondContact O-N 2.71Å
610	V	91.2	Very high	86.4	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-53.6	-38.9	-175.7	160	0	0	0	0	112.5	I603 D607 E612 T614 P622 W693	I603-V610 HydrophobicContact CG2-CG2 3.34Å; D607-V610 HydrophobicContact CB-CG2 4.02Å; D607-V610 VanDerWaalsContact O-CB 3.29Å; D607-V610 WeakPolarHBondContact O-CB 3.21Å; D607-V610 WeakPolarHBondContact O-CG2 3.47Å; D607-V610 PolarHBondContact O-N 3.17Å; V610-E612 PolarHBondContact O-N 2.93Å; V610-T614 HydrophobicContact CG1-CG2 4.32Å; V610-T614 WeakPolarHBondContact O-CB 3.4Å; V610-T614 WeakPolarHBondContact O-CG2 3.35Å; V610-T614 PolarHBondContact O-N 2.89Å; V610-T614 PolarHBondContact O-OG1 2.99Å; V610-P622 HydrophobicContact CG1-CG 3.91Å; V610-W693 HydrophobicContact CG1-CD2 3.42Å; V610-W693 VanDerWaalsContact CG1-CD2 3.42Å; V610-W693 HydrophobicContact CG1-CE3 3.65Å; V610-W693 HydrophobicContact CG1-CG 3.9Å; V610-W693 HydrophobicContact CG1-CH2 4.29Å; V610-W693 HydrophobicContact CG1-CZ2 4.03Å; V610-W693 HydrophobicContact CG1-CZ3 4.08Å; V610-W693 HydrophobicContact CG2-CB 4.38Å; V610-W693 HydrophobicContact CG2-CD2 4.46Å; V610-W693 HydrophobicContact CG2-CG 4.3Å
611	Y	92.6	Very high	86.8	Confident	36 Å²	36	45.6 Å²	45.6	14%	0.141	24%	0.239	C	C	.	.	H	α-helix	trans	-64.7	-39.6	177.2	174.3	-130.8	0	0	0	112.5	R609 T614 S615 Q676	R609-Y611 PolarHBondContact O-N 3.26Å; R609-Y611 VanDerWaalsContact O-N 3.15Å; Y611-T614 PolarHBondContact O-OG1 3.15Å; Y611-S615 WeakPolarHBondContact CE2-OG 3.38Å; Y611-S615 VanDerWaalsContact O-CB 3.26Å; Y611-S615 WeakPolarHBondContact O-CB 3.36Å; Y611-S615 PolarHBondContact O-N 3.21Å; Y611-S615 VanDerWaalsContact O-N 3.14Å; Y611-S615 PolarHBondContact O-OG 3.49Å; Y611-Q676 HydrophobicContact CD1-CB 4.2Å; Y611-Q676 HydrophobicContact CD1-CG 3.92Å; Y611-Q676 HydrophobicContact CD2-CB 4.07Å; Y611-Q676 HydrophobicContact CD2-CG 3.56Å; Y611-Q676 HydrophobicContact CE1-CG 4.05Å; Y611-Q676 HydrophobicContact CE2-CG 3.73Å; Y611-Q676 HydrophobicContact CG-CB 3.82Å; Y611-Q676 HydrophobicContact CG-CG 3.68Å
612	E	87.4	Confident	87.3	Confident	103 Å²	103	43.7 Å²	43.7	48%	0.481	23%	0.229	S	C	.	.	H	α-helix	trans	-73.3	-43	177.6	-60.5	-168.8	179.2	0	0	111.7	R609 V610 S615 K616	R609-E612 PolarHBondContact O-N 3.44Å; V610-E612 PolarHBondContact O-N 2.93Å; E612-S615 PolarHBondContact O-N 3.45Å; E612-K616 WeakPolarHBondContact O-CB 3.44Å; E612-K616 VanDerWaalsContact O-CG 3.28Å; E612-K616 WeakPolarHBondContact O-CG 3.29Å; E612-K616 PolarHBondContact O-N 2.68Å
613	L	87.1	Confident	88	Confident	5 Å²	5	39 Å²	39	3%	0.026	21%	0.205	C	C	.	.	H	α-helix	trans	-65.4	-44.1	-180	-65	170.8	0	0	0	111.5	P483 Y599 F600 I603 R609 S615 K616 A617	P483-L613 HydrophobicContact CB-CD2 4.36Å; Y599-L613 HydrophobicContact CE1-CD1 4.12Å; Y599-L613 HydrophobicContact CE1-CD2 4.21Å; F600-L613 HydrophobicContact CE1-CB 3.86Å; F600-L613 HydrophobicContact CZ-CB 4.15Å; I603-L613 HydrophobicContact CD1-CD1 3.81Å; R609-L613 HydrophobicContact CB-CD1 3.76Å; R609-L613 HydrophobicContact CB-CG 4.17Å; R609-L613 WeakPolarHBondContact O-CG 3.42Å; R609-L613 PolarHBondContact O-N 2.71Å; L613-S615 PolarHBondContact O-N 3.08Å; L613-K616 PolarHBondContact O-N 2.9Å; L613-A617 WeakPolarHBondContact O-CB 3.2Å; L613-A617 PolarHBondContact O-N 2.9Å
614	T	86.3	Confident	88.2	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-63.7	-38.9	172.5	50.3	0	0	0	0	112.5	F600 V610 Y611 G618 L619 W693	F600-T614 HydrophobicContact CE1-CG2 4.25Å; V610-T614 HydrophobicContact CG1-CG2 4.32Å; V610-T614 WeakPolarHBondContact O-CB 3.4Å; V610-T614 WeakPolarHBondContact O-CG2 3.35Å; V610-T614 PolarHBondContact O-N 2.89Å; V610-T614 PolarHBondContact O-OG1 2.99Å; Y611-T614 PolarHBondContact O-OG1 3.15Å; T614-G618 PolarHBondContact O-N 3.41Å; T614-G618 VanDerWaalsContact O-N 3.08Å; T614-L619 HydrophobicContact CG2-CB 4.5Å; T614-L619 PolarHBondContact O-N 2.71Å; T614-W693 HydrophobicContact CG2-CZ2 4.36Å
615	S	85.3	Confident	88.3	Confident	60 Å²	60	39.4 Å²	39.4	42%	0.42	20%	0.199	S	C	.	.	H	α-helix	trans	-67.2	-37.5	176.3	-61.3	0	0	0	0	112.5	Y611 E612 L613 G618	Y611-S615 WeakPolarHBondContact CE2-OG 3.38Å; Y611-S615 VanDerWaalsContact O-CB 3.26Å; Y611-S615 WeakPolarHBondContact O-CB 3.36Å; Y611-S615 PolarHBondContact O-N 3.21Å; Y611-S615 VanDerWaalsContact O-N 3.14Å; Y611-S615 PolarHBondContact O-OG 3.49Å; E612-S615 PolarHBondContact O-N 3.45Å; L613-S615 PolarHBondContact O-N 3.08Å; S615-G618 PolarHBondContact O-N 3.22Å
616	K	79.5	Confident	88.3	Confident	57 Å²	57	39.4 Å²	39.4	25%	0.248	20%	0.199	C	C	.	.	H	α-helix	trans	-66.8	-47.4	174.5	-77.8	164.2	161.1	-172	0	111.5	P483 L485 Q489 N508 E612 L613 G618	P483-K616 PolarHBondContact O-NZ 2.75Å; P483-K616 VanDerWaalsContact O-NZ 3.07Å; L485-K616 HydrophobicContact CD2-CB 4.35Å; L485-K616 HydrophobicContact CD2-CD 3.49Å; L485-K616 VanDerWaalsContact CD2-CD 3.49Å; L485-K616 HydrophobicContact CD2-CG 4.02Å; Q489-K616 PolarHBondContact NE2-O 2.93Å; Q489-K616 PolarHBondContact OE1-O 2.96Å; N508-K616 PolarHBondContact ND2-O 3.12Å; E612-K616 WeakPolarHBondContact O-CB 3.44Å; E612-K616 VanDerWaalsContact O-CG 3.28Å; E612-K616 WeakPolarHBondContact O-CG 3.29Å; E612-K616 PolarHBondContact O-N 2.68Å; L613-K616 PolarHBondContact O-N 2.9Å; K616-G618 PolarHBondContact O-N 3.35Å
617	A	78	Confident	88.1	Confident	12 Å²	12	38 Å²	38	10%	0.099	19%	0.192	C	C	.	.	H	α-helix	trans	-66.3	-15.6	176	0	0	0	0	0	113.5	E596 F600 L613 L619	E596-A617 WeakPolarHBondContact OE1-CB 3.37Å; F600-A617 HydrophobicContact CE2-CB 4.4Å; F600-A617 HydrophobicContact CZ-CB 4.34Å; L613-A617 WeakPolarHBondContact O-CB 3.2Å; L613-A617 PolarHBondContact O-N 2.9Å; A617-L619 VanDerWaalsContact C-N 3.27Å; A617-L619 HydrophobicContact CB-CB 4.47Å; A617-L619 HydrophobicContact CB-CD1 3.74Å; A617-L619 HydrophobicContact CB-CG 3.71Å
618	G	76.5	Confident	88	Confident	7 Å²	7	38.9 Å²	38.9	7%	0.072	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	74.6	19.1	-176.1	0	0	0	0	0	113.5	T614 S615 K616 R702	T614-G618 PolarHBondContact O-N 3.41Å; T614-G618 VanDerWaalsContact O-N 3.08Å; S615-G618 PolarHBondContact O-N 3.22Å; K616-G618 PolarHBondContact O-N 3.35Å; G618-R702 PolarHBondContact O-NH1 2.97Å; G618-R702 PolarHBondContact O-NH2 2.98Å
619	L	83.9	Confident	87.9	Confident	29 Å²	29	34.8 Å²	34.8	15%	0.152	17%	0.167	C	C	.	.			trans	-79.3	-176.5	176.7	-63.3	175.2	0	0	0	111.2	F600 T614 A617 L697	F600-L619 HydrophobicContact CD2-CD1 4.16Å; F600-L619 HydrophobicContact CE2-CD1 3.55Å; F600-L619 HydrophobicContact CZ-CD1 3.99Å; T614-L619 HydrophobicContact CG2-CB 4.5Å; T614-L619 PolarHBondContact O-N 2.71Å; A617-L619 VanDerWaalsContact C-N 3.27Å; A617-L619 HydrophobicContact CB-CB 4.47Å; A617-L619 HydrophobicContact CB-CD1 3.74Å; A617-L619 HydrophobicContact CB-CG 3.71Å; L619-L697 HydrophobicContact CB-CD2 4.41Å; L619-L697 HydrophobicContact CD1-CD1 3.83Å; L619-L697 HydrophobicContact CD1-CD2 4.26Å
620	L	88.1	Confident	87.7	Confident	30 Å²	30	30 Å²	30	16%	0.157	15%	0.15	C	C	.	.			trans	-78.5	128.4	175.2	-73.4	152.3	0	0	0	109.8	Q624 I625 R702	L620-Q624 HydrophobicContact CB-CB 4.24Å; L620-Q624 HydrophobicContact CD2-CB 3.78Å; L620-Q624 HydrophobicContact CD2-CG 4.49Å; L620-I625 HydrophobicContact CB-CD1 3.7Å; L620-I625 HydrophobicContact CB-CG1 3.88Å; L620-I625 HydrophobicContact CD1-CD1 4.1Å; L620-R702 HydrophobicContact CD1-CG 4.09Å
621	S	92.5	Very high	87.3	Confident	13 Å²	13	34.8 Å²	34.8	9%	0.091	17%	0.171	C	C	.	.			trans	-68.8	161.7	175.9	69.3	0	0	0	0	112	Y623 Q624 I625 Q676	S621-Y623 VanDerWaalsContact C-N 3.35Å; S621-Y623 PolarHBondContact O-N 3.32Å; S621-Q624 WeakPolarHBondContact O-CA 3.33Å; S621-Q624 WeakPolarHBondContact O-CB 3.47Å; S621-Q624 PolarHBondContact O-N 3.23Å; S621-Q624 PolarHBondContact OG-OE1 3.27Å; S621-I625 PolarHBondContact O-N 3.27Å; S621-Q676 PolarHBondContact OG-NE2 2.97Å
622	P	94.8	Very high	86.7	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-53.8	-42.3	-176.6	-31.3	37	0	0	0	116	V610 Q624 I625 L626 Q680 W693	V610-P622 HydrophobicContact CG1-CG 3.91Å; P622-Q624 VanDerWaalsContact C-N 3.25Å; P622-Q624 PolarHBondContact O-N 2.9Å; P622-I625 PolarHBondContact O-N 2.87Å; P622-L626 PolarHBondContact O-N 3.06Å; P622-Q680 HydrophobicContact CB-CG 3.85Å; P622-Q680 HydrophobicContact CG-CG 3.94Å; P622-W693 HydrophobicContact CB-CH2 3.73Å; P622-W693 HydrophobicContact CB-CZ2 4.35Å; P622-W693 HydrophobicContact CB-CZ3 4.39Å; P622-W693 HydrophobicContact CG-CH2 3.79Å; P622-W693 HydrophobicContact CG-CZ2 4.03Å; P622-W693 HydrophobicContact CG-CZ3 4.41Å
623	Y	94.3	Very high	86	Confident	57 Å²	57	35.3 Å²	35.3	22%	0.224	17%	0.172	C	C	.	.	H	α-helix	trans	-63.8	-29.5	175.2	-175.1	-107.1	0	0	0	113	S621 H627 I641 M657 K675 S679	S621-Y623 VanDerWaalsContact C-N 3.35Å; S621-Y623 PolarHBondContact O-N 3.32Å; Y623-H627 AromaticContact CE1-CD2 3.82Å; Y623-H627 AromaticContact CE1-NE2 3.57Å; Y623-H627 AromaticContact CE2-NE2 3.82Å; Y623-H627 AromaticContact CZ-CD2 3.76Å; Y623-H627 AromaticContact CZ-NE2 3.26Å; Y623-H627 VanDerWaalsContact CZ-NE2 3.26Å; Y623-H627 PolarHBondContact O-CD2 3.4Å; Y623-H627 VanDerWaalsContact O-CD2 3.23Å; Y623-H627 PolarHBondContact O-N 2.88Å; Y623-H627 VanDerWaalsContact O-N 3.08Å; Y623-H627 PolarHBondContact OH-NE2 3.08Å; Y623-I641 HydrophobicContact CE2-CD1 4.38Å; Y623-I641 HydrophobicContact CE2-CG2 4.43Å; Y623-M657 HydrophobicContact CD2-CE 4.21Å; Y623-M657 HydrophobicContact CE2-CE 4.26Å; Y623-K675 HydrophobicContact CD1-CD 4.04Å; Y623-K675 HydrophobicContact CD2-CD 3.74Å; Y623-K675 HydrophobicContact CD2-CG 3.64Å; Y623-K675 HydrophobicContact CE1-CD 4.12Å; Y623-K675 HydrophobicContact CE2-CD 3.84Å; Y623-K675 HydrophobicContact CE2-CG 4.07Å; Y623-K675 HydrophobicContact CG-CD 3.84Å; Y623-K675 HydrophobicContact CG-CG 3.96Å; Y623-S679 VanDerWaalsContact CA-OG 3.31Å; Y623-S679 WeakPolarHBondContact CA-OG 3.45Å; Y623-S679 WeakPolarHBondContact CB-OG 3.43Å; Y623-S679 WeakPolarHBondContact CD2-OG 3.46Å
624	Q	92.3	Very high	84.7	Confident	89 Å²	89	41 Å²	41	42%	0.416	20%	0.199	S	C	.	.	H	α-helix	trans	-78.2	-37.3	175.9	-63.7	171.4	-58.8	0	0	112	L620 S621 P622 H627 E628	L620-Q624 HydrophobicContact CB-CB 4.24Å; L620-Q624 HydrophobicContact CD2-CB 3.78Å; L620-Q624 HydrophobicContact CD2-CG 4.49Å; S621-Q624 WeakPolarHBondContact O-CA 3.33Å; S621-Q624 WeakPolarHBondContact O-CB 3.47Å; S621-Q624 PolarHBondContact O-N 3.23Å; S621-Q624 PolarHBondContact OG-OE1 3.27Å; P622-Q624 VanDerWaalsContact C-N 3.25Å; P622-Q624 PolarHBondContact O-N 2.9Å; Q624-H627 PolarHBondContact O-N 2.96Å; Q624-E628 PolarHBondContact O-N 2.87Å
625	I	91.3	Very high	83.4	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-64.2	-40.8	171.8	-69.3	-65.7	0	0	0	110.7	L620 S621 P622 E628 C629 L683 W693 L696 L697 Y700	L620-I625 HydrophobicContact CB-CD1 3.7Å; L620-I625 HydrophobicContact CB-CG1 3.88Å; L620-I625 HydrophobicContact CD1-CD1 4.1Å; S621-I625 PolarHBondContact O-N 3.27Å; P622-I625 PolarHBondContact O-N 2.87Å; I625-E628 PolarHBondContact O-N 2.87Å; I625-C629 WeakPolarHBondContact O-CB 3.38Å; I625-C629 PolarHBondContact O-N 3.18Å; I625-L683 HydrophobicContact CB-CD1 4.16Å; I625-L683 HydrophobicContact CG2-CD1 3.75Å; I625-L683 HydrophobicContact CG2-CD2 3.99Å; I625-W693 HydrophobicContact CB-CH2 4.14Å; I625-W693 HydrophobicContact CB-CZ2 4.2Å; I625-W693 HydrophobicContact CG1-CH2 4.31Å; I625-W693 HydrophobicContact CG1-CZ2 3.85Å; I625-W693 HydrophobicContact CG2-CH2 4.17Å; I625-W693 HydrophobicContact CG2-CZ2 4.43Å; I625-L696 HydrophobicContact CG2-CB 4.22Å; I625-L697 HydrophobicContact CD1-CD2 4.35Å; I625-Y700 HydrophobicContact CG2-CD2 4.28Å
626	L	91.3	Very high	82	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-59.9	-45.4	172	177.4	56.9	0	0	0	111.8	P622 E628 C629 L630 I641 M657 I682 L683 L686	P622-L626 PolarHBondContact O-N 3.06Å; L626-E628 PolarHBondContact O-N 2.82Å; L626-C629 PolarHBondContact O-N 3.49Å; L626-L630 HydrophobicContact CD1-CD1 4.48Å; L626-L630 HydrophobicContact CD1-CG 4.28Å; L626-L630 WeakPolarHBondContact O-CG 3.45Å; L626-L630 PolarHBondContact O-N 2.91Å; L626-I641 HydrophobicContact CD2-CD1 4.07Å; L626-I641 HydrophobicContact CG-CD1 4.14Å; L626-M657 HydrophobicContact CD2-SD 4.01Å; L626-I682 HydrophobicContact CD1-CG2 3.6Å; L626-I682 HydrophobicContact CD2-CB 4.18Å; L626-I682 HydrophobicContact CD2-CG2 3.92Å; L626-I682 HydrophobicContact CG-CG2 4.44Å; L626-L683 HydrophobicContact CB-CD1 4.18Å; L626-L683 HydrophobicContact CB-CD2 4.36Å; L626-L683 HydrophobicContact CB-CG 4.11Å; L626-L683 HydrophobicContact CD1-CD2 4.34Å; L626-L683 HydrophobicContact CD1-CG 4.33Å; L626-L686 HydrophobicContact CD1-CD1 3.61Å
627	H	88.3	Confident	80.9	Confident	62 Å²	62	49.4 Å²	49.4	29%	0.287	27%	0.272	S	S	.	.	H	α-helix	trans	-60	-41.6	174.8	-94.4	-113	0	0	0	113	Y623 Q624 K631	Y623-H627 AromaticContact CE1-CD2 3.82Å; Y623-H627 AromaticContact CE1-NE2 3.57Å; Y623-H627 AromaticContact CE2-NE2 3.82Å; Y623-H627 AromaticContact CZ-CD2 3.76Å; Y623-H627 AromaticContact CZ-NE2 3.26Å; Y623-H627 VanDerWaalsContact CZ-NE2 3.26Å; Y623-H627 PolarHBondContact O-CD2 3.4Å; Y623-H627 VanDerWaalsContact O-CD2 3.23Å; Y623-H627 PolarHBondContact O-N 2.88Å; Y623-H627 VanDerWaalsContact O-N 3.08Å; Y623-H627 PolarHBondContact OH-NE2 3.08Å; Q624-H627 PolarHBondContact O-N 2.96Å; H627-K631 WeakPolarHBondContact O-CB 3.4Å; H627-K631 WeakPolarHBondContact O-CG 3.34Å; H627-K631 PolarHBondContact O-N 3.43Å
628	E	87.8	Confident	79.9	Confident	49 Å²	49	55 Å²	55	23%	0.229	30%	0.3	C	S	.	.	H	α-helix	trans	-73	-31	177	-69.8	-56.2	132.1	0	0	113.2	Q624 I625 L626 K631 R632	Q624-E628 PolarHBondContact O-N 2.87Å; I625-E628 PolarHBondContact O-N 2.87Å; L626-E628 PolarHBondContact O-N 2.82Å; E628-K631 WeakPolarHBondContact OE1-CD 3.36Å; E628-K631 IonicContact OE1-NZ 2.7Å; E628-K631 PolarHBondContact OE1-NZ 2.65Å; E628-R632 VanDerWaalsContact O-CG 3.32Å; E628-R632 WeakPolarHBondContact O-CG 3.31Å; E628-R632 PolarHBondContact O-N 2.96Å
629	C	87.1	Confident	79.5	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-61.2	-52.1	170.4	176.5	0	0	0	0	110.7	I625 L626 K631 R632 N633 L683 H687 Y700	I625-C629 WeakPolarHBondContact O-CB 3.38Å; I625-C629 PolarHBondContact O-N 3.18Å; L626-C629 PolarHBondContact O-N 3.49Å; C629-K631 PolarHBondContact O-N 2.84Å; C629-R632 PolarHBondContact O-N 2.74Å; C629-N633 WeakPolarHBondContact O-CB 3.42Å; C629-N633 PolarHBondContact O-N 3.19Å; C629-N633 PolarHBondContact O-ND2 2.91Å; C629-N633 PolarHBondContact SG-ND2 2.99Å; C629-L683 HydrophobicContact CB-CD2 4.24Å; C629-H687 PolarHBondContact SG-NE2 3.17Å; C629-Y700 HydrophobicContact CB-CD1 4.13Å; C629-Y700 HydrophobicContact CB-CD2 4.19Å; C629-Y700 HydrophobicContact CB-CE1 3.94Å; C629-Y700 HydrophobicContact CB-CE2 3.96Å; C629-Y700 HydrophobicContact CB-CG 4.28Å
630	L	85.4	Confident	79.3	Confident	22 Å²	22	59.3 Å²	59.3	12%	0.115	33%	0.328	C	S	.	.	H	α-helix	trans	-61.8	-40.1	177.6	-67.4	-177.2	0	0	0	113.2	L626 R632 N633 H634 T639 I641	L626-L630 HydrophobicContact CD1-CD1 4.48Å; L626-L630 HydrophobicContact CD1-CG 4.28Å; L626-L630 WeakPolarHBondContact O-CG 3.45Å; L626-L630 PolarHBondContact O-N 2.91Å; L630-R632 VanDerWaalsContact C-N 3.27Å; L630-R632 PolarHBondContact O-N 2.66Å; L630-N633 CarbonylContact O-C 3.55Å; L630-N633 PolarHBondContact O-N 3.24Å; L630-H634 PolarHBondContact O-CD2 2.84Å; L630-H634 PolarHBondContact O-N 2.98Å; L630-T639 HydrophobicContact CB-CG2 3.83Å; L630-T639 HydrophobicContact CD1-CG2 4.27Å; L630-T639 HydrophobicContact CG-CG2 4.45Å; L630-I641 HydrophobicContact CD1-CD1 3.6Å; L630-I641 HydrophobicContact CD1-CG1 3.63Å
631	K	83.1	Confident	79.4	Confident	100 Å²	100	59.7 Å²	59.7	44%	0.435	33%	0.331	S	S	.	.	H	α-helix	trans	-63.8	-29	178.3	-76.4	172.4	-157.1	170.8	0	114.2	H627 E628 C629 H634	H627-K631 WeakPolarHBondContact O-CB 3.4Å; H627-K631 WeakPolarHBondContact O-CG 3.34Å; H627-K631 PolarHBondContact O-N 3.43Å; E628-K631 WeakPolarHBondContact OE1-CD 3.36Å; E628-K631 IonicContact OE1-NZ 2.7Å; E628-K631 PolarHBondContact OE1-NZ 2.65Å; C629-K631 PolarHBondContact O-N 2.84Å; K631-H634 PolarHBondContact O-CE1 3.4Å; K631-H634 PolarHBondContact O-ND1 3.3Å
632	R	81	Confident	79.3	Confident	94 Å²	94	66 Å²	66	36%	0.355	36%	0.356	S	S	.	.	H	α-helix	trans	-86.5	-30.2	176.6	-64.3	176.1	-157.5	-163.6	5.3	111.2	E628 C629 L630 H634 M699 Y700 S704	E628-R632 VanDerWaalsContact O-CG 3.32Å; E628-R632 WeakPolarHBondContact O-CG 3.31Å; E628-R632 PolarHBondContact O-N 2.96Å; C629-R632 PolarHBondContact O-N 2.74Å; L630-R632 VanDerWaalsContact C-N 3.27Å; L630-R632 PolarHBondContact O-N 2.66Å; R632-H634 PolarHBondContact O-N 3.48Å; R632-M699 PolarHBondContact NH1-O 3.07Å; R632-Y700 PolarHBondContact NH2-O 3.25Å; R632-S704 PolarHBondContact NH1-OG 3.26Å; R632-S704 PolarHBondContact NH2-OG 2.84Å
633	N	71.7	Confident	79.3	Confident	55 Å²	55	67.9 Å²	67.9	29%	0.294	36%	0.364	S	S	.	.			trans	-95.1	29.2	179.7	-61.8	-24.1	0	0	0	113.4	C629 L630 G635 M636	C629-N633 WeakPolarHBondContact O-CB 3.42Å; C629-N633 PolarHBondContact O-N 3.19Å; C629-N633 PolarHBondContact O-ND2 2.91Å; C629-N633 PolarHBondContact SG-ND2 2.99Å; L630-N633 CarbonylContact O-C 3.55Å; L630-N633 PolarHBondContact O-N 3.24Å; N633-G635 PolarHBondContact O-N 3.06Å; N633-M636 HydrophobicContact CB-CB 4.32Å; N633-M636 HydrophobicContact CB-SD 4.39Å; N633-M636 VanDerWaalsContact O-CB 3.26Å; N633-M636 WeakPolarHBondContact O-CB 3.31Å; N633-M636 PolarHBondContact O-N 3.36Å
634	H	60	Low	79.2	Confident	125 Å²	125	70.5 Å²	70.5	58%	0.579	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-9.7	-177.9	-81.1	152.5	0	0	0	115.7	L630 K631 R632	L630-H634 PolarHBondContact O-CD2 2.84Å; L630-H634 PolarHBondContact O-N 2.98Å; K631-H634 PolarHBondContact O-CE1 3.4Å; K631-H634 PolarHBondContact O-ND1 3.3Å; R632-H634 PolarHBondContact O-N 3.48Å
635	G	58.8	Low	79.2	Confident	86 Å²	86	67.9 Å²	67.9	89%	0.887	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92	6.3	173.3	0	0	0	0	0	115.5	N633	N633-G635 PolarHBondContact O-N 3.06Å
636	M	56.2	Low	79.2	Confident	154 Å²	154	71.9 Å²	71.9	76%	0.759	39%	0.389	S	S	*	.	S	Bend	trans	-105.8	13.5	-163.7	-147.4	171	-169.4	0	0	115.7	N633	N633-M636 HydrophobicContact CB-CB 4.32Å; N633-M636 HydrophobicContact CB-SD 4.39Å; N633-M636 VanDerWaalsContact O-CB 3.26Å; N633-M636 WeakPolarHBondContact O-CB 3.31Å; N633-M636 PolarHBondContact O-N 3.36Å
637	G	56.4	Low	79.1	Confident	54 Å²	54	77.1 Å²	77.1	56%	0.557	42%	0.423	S	S	*	.	S	Bend	trans	96.8	-174.6	-177.9	0	0	0	0	0	113.8	T639	G637-T639 PolarHBondContact O-N 3.28Å
638	D	57.5	Low	78.8	Confident	130 Å²	130	75.4 Å²	75.4	70%	0.695	42%	0.423	S	S	*	.			trans	-43.9	99.4	-163.7	-79.5	-42.7	0	0	0	116	S640 G660	D638-S640 PolarHBondContact O-N 2.76Å; D638-G660 VanDerWaalsContact O-CA 3.28Å; D638-G660 WeakPolarHBondContact O-CA 3.42Å; D638-G660 PolarHBondContact O-N 2.9Å
639	T	67.9	Low	78.2	Confident	63 Å²	63	83.3 Å²	83.3	39%	0.387	46%	0.456	S	S	.	.			trans	-71.3	6.6	179.3	-24.4	0	0	0	0	114	L630 G637 I641	L630-T639 HydrophobicContact CB-CG2 3.83Å; L630-T639 HydrophobicContact CD1-CG2 4.27Å; L630-T639 HydrophobicContact CG-CG2 4.45Å; G637-T639 PolarHBondContact O-N 3.28Å; T639-I641 PolarHBondContact O-N 3.13Å
640	S	80.8	Confident	77.4	Confident	62 Å²	62	89.8 Å²	89.8	43%	0.434	49%	0.491	S	S	.	.			trans	-78.1	120.4	-176.8	82.8	0	0	0	0	111.2	D638	D638-S640 PolarHBondContact O-N 2.76Å
641	I	88.6	Confident	76.8	Confident	39 Å²	39	97.3 Å²	97.3	20%	0.2	53%	0.525	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	110.8	167.2	-57.9	168	0	0	0	108.2	Y623 L626 L630 T639 M657 T658	Y623-I641 HydrophobicContact CE2-CD1 4.38Å; Y623-I641 HydrophobicContact CE2-CG2 4.43Å; L626-I641 HydrophobicContact CD2-CD1 4.07Å; L626-I641 HydrophobicContact CG-CD1 4.14Å; L630-I641 HydrophobicContact CD1-CD1 3.6Å; L630-I641 HydrophobicContact CD1-CG1 3.63Å; T639-I641 PolarHBondContact O-N 3.13Å; I641-M657 HydrophobicContact CG2-CE 4.22Å; I641-M657 HydrophobicContact CG2-CG 3.93Å; I641-M657 HydrophobicContact CG2-SD 4.01Å; I641-T658 CarbonylContact C-O 3.59Å; I641-T658 WeakPolarHBondContact CA-O 3.31Å
642	K	91.1	Very high	76.5	Confident	146 Å²	146	99.1 Å²	99.1	64%	0.635	53%	0.533	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94	137	164.7	-64.1	179.6	-177.6	176.4	0	108.5	M657 T658	K642-M657 WeakPolarHBondContact O-CA 3.25Å; K642-M657 WeakPolarHBondContact O-CG 3.32Å; K642-T658 PolarHBondContact N-O 2.68Å; K642-T658 PolarHBondContact O-N 3.32Å
643	F	94.2	Very high	77	Confident	38 Å²	38	95.9 Å²	95.9	17%	0.167	53%	0.525	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	118.2	179.3	174	-104.4	0	0	0	111.3	V645 V656 M657 K671 K675 A678	F643-V645 HydrophobicContact CE1-CG2 3.82Å; F643-V645 HydrophobicContact CE2-CG2 4.21Å; F643-V645 HydrophobicContact CZ-CG2 3.47Å; F643-V645 VanDerWaalsContact CZ-CG2 3.47Å; F643-V656 WeakPolarHBondContact CA-O 3.39Å; F643-V656 WeakPolarHBondContact CD2-O 3.44Å; F643-M657 HydrophobicContact CB-CE 4.05Å; F643-M657 HydrophobicContact CD2-CB 4.07Å; F643-M657 HydrophobicContact CD2-CE 3.56Å; F643-M657 HydrophobicContact CD2-CG 4.43Å; F643-M657 HydrophobicContact CE2-CE 4.27Å; F643-M657 HydrophobicContact CG-CE 3.96Å; F643-K671 HydrophobicContact CE1-CG 3.89Å; F643-K671 HydrophobicContact CZ-CG 4.48Å; F643-K675 HydrophobicContact CD1-CB 4.33Å; F643-K675 VanDerWaalsContact CD1-CE 3.48Å; F643-K675 HydrophobicContact CE1-CB 3.74Å; F643-K675 HydrophobicContact CE1-CG 4.39Å; F643-K675 HydrophobicContact CE2-CB 4.08Å; F643-K675 VanDerWaalsContact CZ-CA 3.43Å; F643-K675 HydrophobicContact CZ-CB 3.61Å; F643-K675 VanDerWaalsContact CZ-N 3.3Å; F643-A678 HydrophobicContact CE2-CB 4.32Å
644	E	92.9	Very high	78	Confident	113 Å²	113	95.4 Å²	95.4	53%	0.528	52%	0.521	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	161.6	-178.7	62.7	-165.2	174.5	0	0	110.7	V656	E644-V656 HydrophobicContact CG-CB 3.74Å; E644-V656 HydrophobicContact CG-CG2 4.39Å; E644-V656 PolarHBondContact N-O 3.31Å; E644-V656 PolarHBondContact O-N 2.85Å
645	V	93.2	Very high	79.7	Confident	34 Å²	34	89.8 Å²	89.8	21%	0.206	50%	0.495	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	118.3	179.9	173.3	0	0	0	0	107.5	F643 S653 E654 K671	F643-V645 HydrophobicContact CE1-CG2 3.82Å; F643-V645 HydrophobicContact CE2-CG2 4.21Å; F643-V645 HydrophobicContact CZ-CG2 3.47Å; F643-V645 VanDerWaalsContact CZ-CG2 3.47Å; V645-S653 VanDerWaalsContact CG1-CB 3.5Å; V645-E654 CarbonylContact C-O 3.51Å; V645-E654 VanDerWaalsContact CA-O 3.27Å; V645-E654 WeakPolarHBondContact CA-O 3.47Å; V645-E654 WeakPolarHBondContact CG1-O 3.4Å; V645-K671 HydrophobicContact CB-CG 4.42Å; V645-K671 HydrophobicContact CG2-CB 4.17Å; V645-K671 HydrophobicContact CG2-CD 4.35Å; V645-K671 HydrophobicContact CG2-CG 3.81Å
646	I	90.6	Very high	81.4	Confident	84 Å²	84	86.2 Å²	86.2	43%	0.431	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	114.6	-177.4	-55.3	173.1	0	0	0	106.8	G648 S653 E654 V656	I646-G648 PolarHBondContact O-N 3.38Å; I646-S653 CarbonylContact O-C 3.42Å; I646-S653 WeakPolarHBondContact O-CA 3.31Å; I646-E654 HydrophobicContact CB-CB 4.41Å; I646-E654 PolarHBondContact N-O 3.39Å; I646-E654 PolarHBondContact O-N 3.14Å; I646-V656 HydrophobicContact CD1-CG2 4.26Å
647	P	87.8	Confident	83.3	Confident	109 Å²	109	78.9 Å²	78.9	71%	0.708	42%	0.419	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70	116.6	179.4	28.1	-32.7	0	0	0	110.2
648	G	82.5	Confident	85	Confident	27 Å²	27	78.1 Å²	78.1	28%	0.278	40%	0.404	S	S	.	.			trans	-87.2	155.4	177	0	0	0	0	0	112.7	I646 N650 K652	I646-G648 PolarHBondContact O-N 3.38Å; G648-N650 PolarHBondContact O-N 3.1Å; G648-K652 VanDerWaalsContact CA-O 3.25Å; G648-K652 WeakPolarHBondContact CA-O 3.48Å; G648-K652 PolarHBondContact N-O 3.32Å
649	K	76.1	Confident	86.6	Confident	214 Å²	214	72.1 Å²	72.1	93%	0.93	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-23.6	-173	-63.1	-178.5	179.9	179.2	0	114.6
650	N	69.9	Low	87.4	Confident	136 Å²	136	70.2 Å²	70.2	73%	0.727	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.9	39.9	-169.6	-58.7	18.4	0	0	0	112.6	G648 K652	G648-N650 PolarHBondContact O-N 3.1Å; N650-K652 PolarHBondContact O-N 3.09Å
651	Q	71.8	Confident	87.6	Confident	181 Å²	181	76.1 Å²	76.1	85%	0.846	38%	0.383	S	S	*	.	S	Bend	trans	56.6	0.7	-175.2	-64.1	-73.9	18.2	0	0	116.4
652	K	77.8	Confident	87.7	Confident	138 Å²	138	76 Å²	76	60%	0.6	38%	0.381	S	S	*	.	P	Polyproline II helix	trans	-91.7	119.1	169	-64.2	176.5	-176.6	176.3	0	107.9	G648 N650 W667	G648-K652 VanDerWaalsContact CA-O 3.25Å; G648-K652 WeakPolarHBondContact CA-O 3.48Å; G648-K652 PolarHBondContact N-O 3.32Å; N650-K652 PolarHBondContact O-N 3.09Å; K652-W667 HydrophobicContact CB-CE3 3.88Å; K652-W667 HydrophobicContact CB-CZ3 4.38Å
653	S	90.5	Very high	87.8	Confident	25 Å²	25	72.6 Å²	72.6	18%	0.175	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	130.7	174.2	-56.3	0	0	0	0	109.8	V645 I646 C668	V645-S653 VanDerWaalsContact CG1-CB 3.5Å; I646-S653 CarbonylContact O-C 3.42Å; I646-S653 WeakPolarHBondContact O-CA 3.31Å; S653-C668 PolarHBondContact N-O 3.47Å; S653-C668 PolarHBondContact O-N 3.3Å; S653-C668 PolarHBondContact O-SG 3.13Å; S653-C668 VanDerWaalsContact O-SG 3.41Å
654	E	93.8	Very high	87.9	Confident	45 Å²	45	71.3 Å²	71.3	21%	0.21	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	142.8	167.3	-166.1	-178.5	176.9	0	0	108.6	V645 I646 R665 G666 W667	V645-E654 CarbonylContact C-O 3.51Å; V645-E654 VanDerWaalsContact CA-O 3.27Å; V645-E654 WeakPolarHBondContact CA-O 3.47Å; V645-E654 WeakPolarHBondContact CG1-O 3.4Å; I646-E654 HydrophobicContact CB-CB 4.41Å; I646-E654 PolarHBondContact N-O 3.39Å; I646-E654 PolarHBondContact O-N 3.14Å; E654-R665 WeakPolarHBondContact OE1-CB 3.28Å; E654-R665 VanDerWaalsContact OE1-CD 3.3Å; E654-R665 WeakPolarHBondContact OE1-CD 3.34Å; E654-G666 CarbonylContact C-O 3.22Å; E654-G666 WeakPolarHBondContact CA-O 3.5Å; E654-W667 HydrophobicContact CB-CE3 4.11Å; E654-W667 HydrophobicContact CB-CH2 4.29Å; E654-W667 HydrophobicContact CB-CZ3 3.92Å
655	Y	95	Very high	88	Confident	8 Å²	8	73.6 Å²	73.6	3%	0.031	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	146	166.9	64.9	-102.9	0	0	0	109.9	R665 G666 C668 L677 A678	Y655-R665 VanDerWaalsContact O-CA 3.3Å; Y655-R665 WeakPolarHBondContact O-CA 3.44Å; Y655-G666 WeakPolarHBondContact CD1-O 3.43Å; Y655-G666 WeakPolarHBondContact CE1-O 3.35Å; Y655-G666 PolarHBondContact N-O 2.89Å; Y655-G666 PolarHBondContact O-N 3.43Å; Y655-C668 HydrophobicContact CD1-CB 3.83Å; Y655-C668 HydrophobicContact CE1-CB 4.31Å; Y655-L677 HydrophobicContact CE1-CB 4.04Å; Y655-L677 HydrophobicContact CE1-CD1 4.3Å; Y655-A678 HydrophobicContact CD2-CB 3.55Å; Y655-A678 HydrophobicContact CE2-CB 3.53Å; Y655-A678 HydrophobicContact CG-CB 4.46Å
656	V	95.6	Very high	87.9	Confident	10 Å²	10	72.6 Å²	72.6	6%	0.061	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	133.5	168.1	-174.4	0	0	0	0	108.1	F643 E644 I646 T663 V664 R665	F643-V656 WeakPolarHBondContact CA-O 3.39Å; F643-V656 WeakPolarHBondContact CD2-O 3.44Å; E644-V656 HydrophobicContact CG-CB 3.74Å; E644-V656 HydrophobicContact CG-CG2 4.39Å; E644-V656 PolarHBondContact N-O 3.31Å; E644-V656 PolarHBondContact O-N 2.85Å; I646-V656 HydrophobicContact CD1-CG2 4.26Å; V656-T663 HydrophobicContact CG1-CG2 3.89Å; V656-V664 WeakPolarHBondContact CA-O 3.45Å; V656-R665 HydrophobicContact CG1-CG 4.24Å; V656-R665 HydrophobicContact CG2-CG 4.04Å
657	M	95.3	Very high	88	Confident	0 Å²	0	76.2 Å²	76.2	0%	0	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	127.5	171.7	-172.9	176.9	-80.3	0	0	109.9	Y623 L626 I641 K642 F643 T663 V664 K675 A678 I682	Y623-M657 HydrophobicContact CD2-CE 4.21Å; Y623-M657 HydrophobicContact CE2-CE 4.26Å; L626-M657 HydrophobicContact CD2-SD 4.01Å; I641-M657 HydrophobicContact CG2-CE 4.22Å; I641-M657 HydrophobicContact CG2-CG 3.93Å; I641-M657 HydrophobicContact CG2-SD 4.01Å; K642-M657 WeakPolarHBondContact O-CA 3.25Å; K642-M657 WeakPolarHBondContact O-CG 3.32Å; F643-M657 HydrophobicContact CB-CE 4.05Å; F643-M657 HydrophobicContact CD2-CB 4.07Å; F643-M657 HydrophobicContact CD2-CE 3.56Å; F643-M657 HydrophobicContact CD2-CG 4.43Å; F643-M657 HydrophobicContact CE2-CE 4.27Å; F643-M657 HydrophobicContact CG-CE 3.96Å; M657-T663 CarbonylContact O-C 3.6Å; M657-T663 WeakPolarHBondContact O-CA 3.37Å; M657-V664 HydrophobicContact CB-CG2 3.96Å; M657-V664 PolarHBondContact N-O 3.23Å; M657-V664 PolarHBondContact O-N 2.81Å; M657-K675 HydrophobicContact CE-CG 4.14Å; M657-A678 HydrophobicContact CB-CB 3.65Å; M657-A678 HydrophobicContact CE-CB 3.82Å; M657-A678 HydrophobicContact CG-CB 4.36Å; M657-A678 HydrophobicContact SD-CB 3.89Å; M657-I682 HydrophobicContact CG-CG1 4.26Å; M657-I682 HydrophobicContact SD-CG1 4.04Å
658	T	92.8	Very high	88.1	Confident	39 Å²	39	71.4 Å²	71.4	24%	0.239	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	133	172.1	-59.4	0	0	0	0	109	I641 K642 G660 H662 T663	I641-T658 CarbonylContact C-O 3.59Å; I641-T658 WeakPolarHBondContact CA-O 3.31Å; K642-T658 PolarHBondContact N-O 2.68Å; K642-T658 PolarHBondContact O-N 3.32Å; T658-G660 WeakPolarHBondContact CG2-O 3.33Å; T658-H662 CarbonylContact C-O 3.38Å; T658-H662 WeakPolarHBondContact CA-O 3.08Å; T658-T663 WeakPolarHBondContact CG2-OG1 3.26Å; T658-T663 WeakPolarHBondContact OG1-CG2 3.34Å; T658-T663 PolarHBondContact OG1-OG1 3.45Å
659	C	90.2	Very high	88.4	Confident	4 Å²	4	78.8 Å²	78.8	3%	0.027	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	94.2	180	-176.1	0	0	0	0	108.5	K661 H662 I682	C659-K661 PolarHBondContact O-N 3.28Å; C659-H662 PolarHBondContact N-O 3.31Å; C659-H662 PolarHBondContact O-N 3.01Å; C659-H662 VanDerWaalsContact O-N 3.15Å; C659-I682 HydrophobicContact CB-CD1 4.01Å; C659-I682 HydrophobicContact CB-CG1 4.32Å; C659-I682 HydrophobicContact CB-CG2 3.66Å
660	G	85.2	Confident	89	Confident	22 Å²	22	73.4 Å²	73.4	23%	0.227	35%	0.352	C	S	.	.	T	Hydrogen-bonded Turn	trans	53.9	-127.4	-166.1	0	0	0	0	0	111	D638 T658 H662	D638-G660 VanDerWaalsContact O-CA 3.28Å; D638-G660 WeakPolarHBondContact O-CA 3.42Å; D638-G660 PolarHBondContact O-N 2.9Å; T658-G660 WeakPolarHBondContact CG2-O 3.33Å; G660-H662 VanDerWaalsContact C-N 3.27Å; G660-H662 PolarHBondContact O-N 2.94Å
661	K	85	Confident	90	Very high	186 Å²	186	73.2 Å²	73.2	81%	0.809	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	-13.6	179	68.6	175	-175.3	173.8	0	115.7	C659	C659-K661 PolarHBondContact O-N 3.28Å
662	H	89.9	Confident	90.9	Very high	38 Å²	38	73.8 Å²	73.8	18%	0.176	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	123	-176.2	-53.4	113.2	0	0	0	110.4	T658 C659 G660 I682 L685	T658-H662 CarbonylContact C-O 3.38Å; T658-H662 WeakPolarHBondContact CA-O 3.08Å; C659-H662 PolarHBondContact N-O 3.31Å; C659-H662 PolarHBondContact O-N 3.01Å; C659-H662 VanDerWaalsContact O-N 3.15Å; G660-H662 VanDerWaalsContact C-N 3.27Å; G660-H662 PolarHBondContact O-N 2.94Å; H662-I682 HydrophobicContact CB-CD1 3.74Å; H662-L685 HydrophobicContact CB-CD1 4.13Å
663	T	93.9	Very high	91.5	Very high	73 Å²	73	69.9 Å²	69.9	45%	0.448	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	131	170.2	-63.7	0	0	0	0	109.6	V656 M657 T658	V656-T663 HydrophobicContact CG1-CG2 3.89Å; M657-T663 CarbonylContact O-C 3.6Å; M657-T663 WeakPolarHBondContact O-CA 3.37Å; T658-T663 WeakPolarHBondContact CG2-OG1 3.26Å; T658-T663 WeakPolarHBondContact OG1-CG2 3.34Å; T658-T663 PolarHBondContact OG1-OG1 3.45Å
664	V	95.3	Very high	91.7	Very high	11 Å²	11	68.7 Å²	68.7	7%	0.067	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	147.2	178.4	-60.9	0	0	0	0	110.6	V656 M657 A678 K681 I682 L685	V656-V664 WeakPolarHBondContact CA-O 3.45Å; M657-V664 HydrophobicContact CB-CG2 3.96Å; M657-V664 PolarHBondContact N-O 3.23Å; M657-V664 PolarHBondContact O-N 2.81Å; V664-A678 HydrophobicContact CG2-CB 4.15Å; V664-K681 HydrophobicContact CB-CB 4.03Å; V664-K681 HydrophobicContact CB-CD 4.22Å; V664-K681 HydrophobicContact CG1-CB 3.75Å; V664-K681 HydrophobicContact CG2-CB 4.14Å; V664-I682 HydrophobicContact CB-CD1 4.31Å; V664-I682 HydrophobicContact CG1-CD1 3.66Å; V664-I682 HydrophobicContact CG1-CG1 4.15Å; V664-I682 HydrophobicContact CG2-CD1 3.84Å; V664-I682 HydrophobicContact CG2-CG1 3.72Å; V664-L685 HydrophobicContact CG1-CD1 3.51Å
665	R	95	Very high	91.7	Very high	161 Å²	161	69.4 Å²	69.4	61%	0.608	32%	0.32	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-127.2	165.2	174.9	-50.7	-166.7	-166.4	173.5	5.9	111.6	E654 Y655 V656 K681	E654-R665 WeakPolarHBondContact OE1-CB 3.28Å; E654-R665 VanDerWaalsContact OE1-CD 3.3Å; E654-R665 WeakPolarHBondContact OE1-CD 3.34Å; Y655-R665 VanDerWaalsContact O-CA 3.3Å; Y655-R665 WeakPolarHBondContact O-CA 3.44Å; V656-R665 HydrophobicContact CG1-CG 4.24Å; V656-R665 HydrophobicContact CG2-CG 4.04Å; R665-K681 PolarHBondContact O-NZ 3Å
666	G	92.9	Very high	91.8	Very high	13 Å²	13	69.7 Å²	69.7	13%	0.134	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	165.5	175	172.8	0	0	0	0	0	113.3	E654 Y655	E654-G666 CarbonylContact C-O 3.22Å; E654-G666 WeakPolarHBondContact CA-O 3.5Å; Y655-G666 WeakPolarHBondContact CD1-O 3.43Å; Y655-G666 WeakPolarHBondContact CE1-O 3.35Å; Y655-G666 PolarHBondContact N-O 2.89Å; Y655-G666 PolarHBondContact O-N 3.43Å
667	W	92.1	Very high	91.7	Very high	160 Å²	160	70.5 Å²	70.5	61%	0.606	33%	0.326	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.2	144.3	-176.5	-61.4	99.4	0	0	0	112.3	K652 E654	K652-W667 HydrophobicContact CB-CE3 3.88Å; K652-W667 HydrophobicContact CB-CZ3 4.38Å; E654-W667 HydrophobicContact CB-CE3 4.11Å; E654-W667 HydrophobicContact CB-CH2 4.29Å; E654-W667 HydrophobicContact CB-CZ3 3.92Å
668	C	90.4	Very high	91.8	Very high	9 Å²	9	70.5 Å²	70.5	6%	0.061	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	155.9	172.4	69.7	0	0	0	0	112.7	S653 Y655	S653-C668 PolarHBondContact N-O 3.47Å; S653-C668 PolarHBondContact O-N 3.3Å; S653-C668 PolarHBondContact O-SG 3.13Å; S653-C668 VanDerWaalsContact O-SG 3.41Å; Y655-C668 HydrophobicContact CD1-CB 3.83Å; Y655-C668 HydrophobicContact CE1-CB 4.31Å
669	K	87.7	Confident	91.9	Very high	181 Å²	181	68.6 Å²	68.6	79%	0.787	31%	0.314	S	S	*	.	S	Bend	trans	-75.1	-35.3	172.5	-60	-175	179.9	-174.7	0	112.1
670	N	88.8	Confident	92.1	Very high	102 Å²	102	68.6 Å²	68.6	55%	0.545	31%	0.314	S	S	.	.	S	Bend	trans	-147.8	146.6	-175.8	-48.8	85	0	0	0	111.5	R672 V673 G674	N670-R672 PolarHBondContact O-N 3.5Å; N670-V673 PolarHBondContact O-N 2.88Å; N670-G674 PolarHBondContact O-N 3.05Å
671	K	90.6	Very high	92.6	Very high	132 Å²	132	70.7 Å²	70.7	57%	0.574	32%	0.316	S	S	*	.	H	α-helix	trans	-49.8	-29.9	177.4	-174.5	164.9	-170.9	166.8	0	114.9	F643 V645 K675	F643-K671 HydrophobicContact CE1-CG 3.89Å; F643-K671 HydrophobicContact CZ-CG 4.48Å; V645-K671 HydrophobicContact CB-CG 4.42Å; V645-K671 HydrophobicContact CG2-CB 4.17Å; V645-K671 HydrophobicContact CG2-CD 4.35Å; V645-K671 HydrophobicContact CG2-CG 3.81Å; K671-K675 PolarHBondContact O-N 3.35Å
672	R	91.1	Very high	93	Very high	192 Å²	192	61.8 Å²	61.8	73%	0.725	28%	0.278	S	S	*	.	H	α-helix	trans	-70.3	-41.7	176.4	-162.1	-175.5	-155.2	-165.2	7	112.8	N670 Q676	N670-R672 PolarHBondContact O-N 3.5Å; R672-Q676 WeakPolarHBondContact O-CG 3.35Å
673	V	91.4	Very high	93.2	Very high	56 Å²	56	60 Å²	60	34%	0.339	27%	0.27	S	S	.	.	H	α-helix	trans	-77.3	-45	-179.6	-179.4	0	0	0	0	110	N670 K675 Q676 L677	N670-V673 PolarHBondContact O-N 2.88Å; V673-K675 PolarHBondContact O-N 3.23Å; V673-Q676 PolarHBondContact O-N 2.97Å; V673-L677 HydrophobicContact CG1-CD1 3.97Å; V673-L677 HydrophobicContact CG1-CG 4.17Å; V673-L677 PolarHBondContact O-N 3.23Å
674	G	93.3	Very high	93.2	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-54	-40.1	176.2	0	0	0	0	0	112.9	N670 Q676 L677 A678	N670-G674 PolarHBondContact O-N 3.05Å; G674-Q676 VanDerWaalsContact C-N 3.29Å; G674-Q676 PolarHBondContact O-N 3.05Å; G674-L677 PolarHBondContact O-N 3.22Å; G674-A678 WeakPolarHBondContact O-CB 3.35Å; G674-A678 PolarHBondContact O-N 3.01Å
675	K	94.8	Very high	93	Very high	60 Å²	60	61.8 Å²	61.8	26%	0.261	27%	0.274	S	S	.	.	H	α-helix	trans	-57.5	-39.8	174.1	179.3	171.4	-74.5	-157	0	112.9	Y623 F643 M657 K671 V673 S679	Y623-K675 HydrophobicContact CD1-CD 4.04Å; Y623-K675 HydrophobicContact CD2-CD 3.74Å; Y623-K675 HydrophobicContact CD2-CG 3.64Å; Y623-K675 HydrophobicContact CE1-CD 4.12Å; Y623-K675 HydrophobicContact CE2-CD 3.84Å; Y623-K675 HydrophobicContact CE2-CG 4.07Å; Y623-K675 HydrophobicContact CG-CD 3.84Å; Y623-K675 HydrophobicContact CG-CG 3.96Å; F643-K675 HydrophobicContact CD1-CB 4.33Å; F643-K675 VanDerWaalsContact CD1-CE 3.48Å; F643-K675 HydrophobicContact CE1-CB 3.74Å; F643-K675 HydrophobicContact CE1-CG 4.39Å; F643-K675 HydrophobicContact CE2-CB 4.08Å; F643-K675 VanDerWaalsContact CZ-CA 3.43Å; F643-K675 HydrophobicContact CZ-CB 3.61Å; F643-K675 VanDerWaalsContact CZ-N 3.3Å; M657-K675 HydrophobicContact CE-CG 4.14Å; K671-K675 PolarHBondContact O-N 3.35Å; V673-K675 PolarHBondContact O-N 3.23Å; K675-S679 WeakPolarHBondContact O-CB 3.42Å; K675-S679 PolarHBondContact O-N 3.25Å; K675-S679 VanDerWaalsContact O-N 3.09Å; K675-S679 PolarHBondContact O-OG 2.86Å
676	Q	95.8	Very high	92.6	Very high	15 Å²	15	56.1 Å²	56.1	7%	0.07	26%	0.256	C	S	.	.	H	α-helix	trans	-78.1	-43.2	-176	-57.1	-73	1.4	0	0	110.8	Y611 S621 R672 V673 G674 A678 S679 Q680	Y611-Q676 HydrophobicContact CD1-CB 4.2Å; Y611-Q676 HydrophobicContact CD1-CG 3.92Å; Y611-Q676 HydrophobicContact CD2-CB 4.07Å; Y611-Q676 HydrophobicContact CD2-CG 3.56Å; Y611-Q676 HydrophobicContact CE1-CG 4.05Å; Y611-Q676 HydrophobicContact CE2-CG 3.73Å; Y611-Q676 HydrophobicContact CG-CB 3.82Å; Y611-Q676 HydrophobicContact CG-CG 3.68Å; S621-Q676 PolarHBondContact OG-NE2 2.97Å; R672-Q676 WeakPolarHBondContact O-CG 3.35Å; V673-Q676 PolarHBondContact O-N 2.97Å; G674-Q676 VanDerWaalsContact C-N 3.29Å; G674-Q676 PolarHBondContact O-N 3.05Å; Q676-A678 PolarHBondContact O-N 3.37Å; Q676-S679 WeakPolarHBondContact O-CB 3.21Å; Q676-S679 PolarHBondContact O-N 3.49Å; Q676-S679 VanDerWaalsContact O-N 3.12Å; Q676-Q680 WeakPolarHBondContact O-CG 3.45Å; Q676-Q680 PolarHBondContact O-N 2.98Å
677	L	94.9	Very high	92.3	Very high	26 Å²	26	56.7 Å²	56.7	14%	0.136	26%	0.255	C	S	.	.	H	α-helix	trans	-60.6	-43.8	173.4	-62.6	175.5	0	0	0	111.7	Y655 V673 G674 S679 Q680 K681	Y655-L677 HydrophobicContact CE1-CB 4.04Å; Y655-L677 HydrophobicContact CE1-CD1 4.3Å; V673-L677 HydrophobicContact CG1-CD1 3.97Å; V673-L677 HydrophobicContact CG1-CG 4.17Å; V673-L677 PolarHBondContact O-N 3.23Å; G674-L677 PolarHBondContact O-N 3.22Å; L677-S679 VanDerWaalsContact C-N 3.29Å; L677-S679 PolarHBondContact O-N 3.14Å; L677-Q680 WeakPolarHBondContact O-CB 3.27Å; L677-Q680 PolarHBondContact O-N 3.46Å; L677-K681 PolarHBondContact O-N 3.36Å; L677-K681 VanDerWaalsContact O-N 3.1Å
678	A	95.8	Very high	92.1	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-60.3	-39.8	173.3	0	0	0	0	0	112.1	F643 Y655 M657 V664 G674 Q676 Q680 K681 I682	F643-A678 HydrophobicContact CE2-CB 4.32Å; Y655-A678 HydrophobicContact CD2-CB 3.55Å; Y655-A678 HydrophobicContact CE2-CB 3.53Å; Y655-A678 HydrophobicContact CG-CB 4.46Å; M657-A678 HydrophobicContact CB-CB 3.65Å; M657-A678 HydrophobicContact CE-CB 3.82Å; M657-A678 HydrophobicContact CG-CB 4.36Å; M657-A678 HydrophobicContact SD-CB 3.89Å; V664-A678 HydrophobicContact CG2-CB 4.15Å; G674-A678 WeakPolarHBondContact O-CB 3.35Å; G674-A678 PolarHBondContact O-N 3.01Å; Q676-A678 PolarHBondContact O-N 3.37Å; A678-Q680 VanDerWaalsContact C-N 3.34Å; A678-Q680 PolarHBondContact O-N 3.29Å; A678-K681 PolarHBondContact O-N 2.93Å; A678-I682 WeakPolarHBondContact O-CG1 3.45Å; A678-I682 PolarHBondContact O-N 3.08Å
679	S	95.6	Very high	91.9	Very high	0 Å²	0	61.5 Å²	61.5	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-65.8	-36.3	177.1	-55.4	0	0	0	0	112.5	Y623 K675 Q676 L677 L683	Y623-S679 VanDerWaalsContact CA-OG 3.31Å; Y623-S679 WeakPolarHBondContact CA-OG 3.45Å; Y623-S679 WeakPolarHBondContact CB-OG 3.43Å; Y623-S679 WeakPolarHBondContact CD2-OG 3.46Å; K675-S679 WeakPolarHBondContact O-CB 3.42Å; K675-S679 PolarHBondContact O-N 3.25Å; K675-S679 VanDerWaalsContact O-N 3.09Å; K675-S679 PolarHBondContact O-OG 2.86Å; Q676-S679 WeakPolarHBondContact O-CB 3.21Å; Q676-S679 PolarHBondContact O-N 3.49Å; Q676-S679 VanDerWaalsContact O-N 3.12Å; L677-S679 VanDerWaalsContact C-N 3.29Å; L677-S679 PolarHBondContact O-N 3.14Å; S679-L683 VanDerWaalsContact O-CB 3.32Å; S679-L683 WeakPolarHBondContact O-CB 3.43Å; S679-L683 WeakPolarHBondContact O-CD1 3.4Å; S679-L683 VanDerWaalsContact O-CG 3.25Å; S679-L683 WeakPolarHBondContact O-CG 3.41Å; S679-L683 PolarHBondContact O-N 2.67Å
680	Q	95.6	Very high	91.9	Very high	3 Å²	3	54.4 Å²	54.4	1%	0.014	26%	0.262	C	S	.	.	H	α-helix	trans	-62.1	-51	173.6	-68.9	166.4	-15.8	0	0	111.1	I605 D607 P622 Q676 L677 A678 I682 L683 Q684 W693	I605-Q680 HydrophobicContact CG2-CB 4.45Å; I605-Q680 WeakPolarHBondContact CG2-O 3.49Å; I605-Q680 WeakPolarHBondContact O-CB 3.36Å; I605-Q680 VanDerWaalsContact O-CG 3.28Å; I605-Q680 WeakPolarHBondContact O-CG 3.42Å; D607-Q680 PolarHBondContact O-NE2 3.47Å; P622-Q680 HydrophobicContact CB-CG 3.85Å; P622-Q680 HydrophobicContact CG-CG 3.94Å; Q676-Q680 WeakPolarHBondContact O-CG 3.45Å; Q676-Q680 PolarHBondContact O-N 2.98Å; L677-Q680 WeakPolarHBondContact O-CB 3.27Å; L677-Q680 PolarHBondContact O-N 3.46Å; A678-Q680 VanDerWaalsContact C-N 3.34Å; A678-Q680 PolarHBondContact O-N 3.29Å; Q680-I682 PolarHBondContact O-N 3.27Å; Q680-L683 CarbonylContact O-C 3.52Å; Q680-L683 WeakPolarHBondContact O-CB 3.46Å; Q680-L683 PolarHBondContact O-N 2.94Å; Q680-L683 VanDerWaalsContact O-N 3.13Å; Q680-Q684 PolarHBondContact O-N 2.78Å; Q680-W693 HydrophobicContact CG-CZ3 4.44Å
681	K	95.2	Very high	91.6	Very high	66 Å²	66	57.2 Å²	57.2	29%	0.287	27%	0.27	S	S	.	.	H	α-helix	trans	-59.4	-44.2	177.4	-67.9	-168.9	171	-167.6	0	112.4	V664 R665 L677 A678 L683 Q684 L685	V664-K681 HydrophobicContact CB-CB 4.03Å; V664-K681 HydrophobicContact CB-CD 4.22Å; V664-K681 HydrophobicContact CG1-CB 3.75Å; V664-K681 HydrophobicContact CG2-CB 4.14Å; R665-K681 PolarHBondContact O-NZ 3Å; L677-K681 PolarHBondContact O-N 3.36Å; L677-K681 VanDerWaalsContact O-N 3.1Å; A678-K681 PolarHBondContact O-N 2.93Å; K681-L683 VanDerWaalsContact C-N 3.35Å; K681-L683 PolarHBondContact O-N 2.68Å; K681-Q684 PolarHBondContact O-N 2.87Å; K681-L685 WeakPolarHBondContact O-CG 3.48Å; K681-L685 PolarHBondContact O-N 3.41Å
682	I	93.4	Very high	91.6	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-62.6	-40.8	174.9	-66.9	-67.4	0	0	0	111.2	L626 M657 C659 H662 V664 A678 Q680 Q684 L685 L686	L626-I682 HydrophobicContact CD1-CG2 3.6Å; L626-I682 HydrophobicContact CD2-CB 4.18Å; L626-I682 HydrophobicContact CD2-CG2 3.92Å; L626-I682 HydrophobicContact CG-CG2 4.44Å; M657-I682 HydrophobicContact CG-CG1 4.26Å; M657-I682 HydrophobicContact SD-CG1 4.04Å; C659-I682 HydrophobicContact CB-CD1 4.01Å; C659-I682 HydrophobicContact CB-CG1 4.32Å; C659-I682 HydrophobicContact CB-CG2 3.66Å; H662-I682 HydrophobicContact CB-CD1 3.74Å; V664-I682 HydrophobicContact CB-CD1 4.31Å; V664-I682 HydrophobicContact CG1-CD1 3.66Å; V664-I682 HydrophobicContact CG1-CG1 4.15Å; V664-I682 HydrophobicContact CG2-CD1 3.84Å; V664-I682 HydrophobicContact CG2-CG1 3.72Å; A678-I682 WeakPolarHBondContact O-CG1 3.45Å; A678-I682 PolarHBondContact O-N 3.08Å; Q680-I682 PolarHBondContact O-N 3.27Å; I682-Q684 VanDerWaalsContact C-N 3.34Å; I682-Q684 PolarHBondContact O-N 3.33Å; I682-L685 PolarHBondContact O-N 3.43Å; I682-L686 HydrophobicContact CG2-CD1 3.85Å; I682-L686 HydrophobicContact CG2-CG 4.3Å; I682-L686 WeakPolarHBondContact O-CB 3.05Å; I682-L686 VanDerWaalsContact O-CG 3.27Å; I682-L686 WeakPolarHBondContact O-CG 3.19Å; I682-L686 PolarHBondContact O-N 2.83Å
683	L	92.8	Very high	91.6	Very high	0 Å²	0	44 Å²	44	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-64	-37.5	174.5	-79.4	163.6	0	0	0	112.4	I605 I625 L626 C629 S679 Q680 K681 L686 H687 W693 L696	I605-L683 HydrophobicContact CG2-CB 4.28Å; I625-L683 HydrophobicContact CB-CD1 4.16Å; I625-L683 HydrophobicContact CG2-CD1 3.75Å; I625-L683 HydrophobicContact CG2-CD2 3.99Å; L626-L683 HydrophobicContact CB-CD1 4.18Å; L626-L683 HydrophobicContact CB-CD2 4.36Å; L626-L683 HydrophobicContact CB-CG 4.11Å; L626-L683 HydrophobicContact CD1-CD2 4.34Å; L626-L683 HydrophobicContact CD1-CG 4.33Å; C629-L683 HydrophobicContact CB-CD2 4.24Å; S679-L683 VanDerWaalsContact O-CB 3.32Å; S679-L683 WeakPolarHBondContact O-CB 3.43Å; S679-L683 WeakPolarHBondContact O-CD1 3.4Å; S679-L683 VanDerWaalsContact O-CG 3.25Å; S679-L683 WeakPolarHBondContact O-CG 3.41Å; S679-L683 PolarHBondContact O-N 2.67Å; Q680-L683 CarbonylContact O-C 3.52Å; Q680-L683 WeakPolarHBondContact O-CB 3.46Å; Q680-L683 PolarHBondContact O-N 2.94Å; Q680-L683 VanDerWaalsContact O-N 3.13Å; K681-L683 VanDerWaalsContact C-N 3.35Å; K681-L683 PolarHBondContact O-N 2.68Å; L683-L686 PolarHBondContact O-N 3.15Å; L683-H687 PolarHBondContact O-CD2 3.02Å; L683-H687 VanDerWaalsContact O-CD2 3.23Å; L683-H687 PolarHBondContact O-N 2.81Å; L683-W693 HydrophobicContact CD1-CH2 3.74Å; L683-W693 HydrophobicContact CD1-CZ3 3.94Å; L683-L696 HydrophobicContact CB-CD1 4.01Å; L683-L696 HydrophobicContact CD1-CD1 4.17Å; L683-L696 HydrophobicContact CD2-CD1 4.4Å; L683-L696 HydrophobicContact CG-CD1 4.43Å
684	Q	94	Very high	91.4	Very high	40 Å²	40	41.3 Å²	41.3	19%	0.187	20%	0.203	C	C	.	.	H	α-helix	trans	-67.3	-38.1	176.3	-172.9	59.2	92.3	0	0	111.8	I605 E606 Q680 K681 I682 H687 P688 V690	I605-Q684 HydrophobicContact CG2-CB 4.06Å; E606-Q684 HydrophobicContact CG-CB 4.11Å; E606-Q684 HydrophobicContact CG-CG 4.25Å; E606-Q684 WeakPolarHBondContact OE1-CB 3.38Å; Q680-Q684 PolarHBondContact O-N 2.78Å; K681-Q684 PolarHBondContact O-N 2.87Å; I682-Q684 VanDerWaalsContact C-N 3.34Å; I682-Q684 PolarHBondContact O-N 3.33Å; Q684-H687 PolarHBondContact NE2-O 3.3Å; Q684-H687 CarbonylContact O-C 3.52Å; Q684-H687 PolarHBondContact O-N 2.95Å; Q684-P688 WeakPolarHBondContact O-CA 3.33Å; Q684-V690 PolarHBondContact NE2-O 3.33Å
685	L	90.8	Very high	91	Very high	82 Å²	82	43.1 Å²	43.1	43%	0.429	22%	0.216	S	C	.	.	H	α-helix	trans	-70	-35.3	173.1	-69	176.1	0	0	0	113.3	H662 V664 K681 I682 H687 P688	H662-L685 HydrophobicContact CB-CD1 4.13Å; V664-L685 HydrophobicContact CG1-CD1 3.51Å; K681-L685 WeakPolarHBondContact O-CG 3.48Å; K681-L685 PolarHBondContact O-N 3.41Å; I682-L685 PolarHBondContact O-N 3.43Å; L685-H687 VanDerWaalsContact C-N 3.27Å; L685-H687 PolarHBondContact O-N 3.3Å; L685-P688 WeakPolarHBondContact O-CD 3.28Å; L685-P688 WeakPolarHBondContact O-CG 3.17Å
686	L	87.6	Confident	90.6	Very high	42 Å²	42	40.2 Å²	40.2	22%	0.22	20%	0.203	C	C	.	.	H	α-helix	trans	-70.7	-23.2	173.5	-73.2	170	0	0	0	112.5	L626 I682 L683	L626-L686 HydrophobicContact CD1-CD1 3.61Å; I682-L686 HydrophobicContact CG2-CD1 3.85Å; I682-L686 HydrophobicContact CG2-CG 4.3Å; I682-L686 WeakPolarHBondContact O-CB 3.05Å; I682-L686 VanDerWaalsContact O-CG 3.27Å; I682-L686 WeakPolarHBondContact O-CG 3.19Å; I682-L686 PolarHBondContact O-N 2.83Å; L683-L686 PolarHBondContact O-N 3.15Å
687	H	87.6	Confident	90.2	Very high	25 Å²	25	39.8 Å²	39.8	12%	0.116	20%	0.201	C	C	.	.			trans	-133.3	63.3	-178.1	-53.8	-61.8	0	0	0	113.1	C629 L683 Q684 L685 H689 V690 L696 Y700	C629-H687 PolarHBondContact SG-NE2 3.17Å; L683-H687 PolarHBondContact O-CD2 3.02Å; L683-H687 VanDerWaalsContact O-CD2 3.23Å; L683-H687 PolarHBondContact O-N 2.81Å; Q684-H687 PolarHBondContact NE2-O 3.3Å; Q684-H687 CarbonylContact O-C 3.52Å; Q684-H687 PolarHBondContact O-N 2.95Å; L685-H687 VanDerWaalsContact C-N 3.27Å; L685-H687 PolarHBondContact O-N 3.3Å; H687-H689 PolarHBondContact O-N 3.33Å; H687-V690 HydrophobicContact CB-CB 3.91Å; H687-V690 HydrophobicContact CB-CG2 3.9Å; H687-V690 PolarHBondContact O-N 3.26Å; H687-L696 HydrophobicContact CB-CD2 4.48Å; H687-L696 VanDerWaalsContact CD2-CD2 3.5Å; H687-L696 WeakPolarHBondContact CD2-CD2 3.45Å; H687-Y700 AromaticContact CE1-CE2 3.81Å; H687-Y700 AromaticContact CE1-CZ 3.91Å; H687-Y700 PolarHBondContact CE1-OH 2.85Å; H687-Y700 AromaticContact NE2-CE2 3.46Å; H687-Y700 WeakPolarHBondContact NE2-CE2 3.5Å; H687-Y700 AromaticContact NE2-CZ 3.92Å
688	P	87.7	Confident	89.7	Confident	86 Å²	86	45.5 Å²	45.5	56%	0.558	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59	-26.1	-171.3	-26.1	36.3	0	0	0	115.5	Q684 L685	Q684-P688 WeakPolarHBondContact O-CA 3.33Å; L685-P688 WeakPolarHBondContact O-CD 3.28Å; L685-P688 WeakPolarHBondContact O-CG 3.17Å
689	H	85.7	Confident	89	Confident	184 Å²	184	49 Å²	49	85%	0.852	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.9	-13.3	178.6	-53.4	-56.9	0	0	0	113.7	H687	H687-H689 PolarHBondContact O-N 3.33Å
690	V	86.9	Confident	88.5	Confident	31 Å²	31	50 Å²	50	19%	0.188	24%	0.242	C	C	.	.			trans	-92.7	119	176.6	-173.9	0	0	0	0	107.5	I605 Q684 H687 S695 L696 M699	I605-V690 HydrophobicContact CD1-CB 4.34Å; I605-V690 HydrophobicContact CD1-CG1 4.13Å; I605-V690 WeakPolarHBondContact CD1-O 3.35Å; Q684-V690 PolarHBondContact NE2-O 3.33Å; H687-V690 HydrophobicContact CB-CB 3.91Å; H687-V690 HydrophobicContact CB-CG2 3.9Å; H687-V690 PolarHBondContact O-N 3.26Å; V690-S695 VanDerWaalsContact CG1-CB 3.4Å; V690-L696 HydrophobicContact CG1-CD2 4.47Å; V690-M699 HydrophobicContact CG2-CE 4.1Å
691	K	83.9	Confident	87.7	Confident	162 Å²	162	50 Å²	50	70%	0.704	24%	0.243	S	C	*	.			trans	-98.4	-23.3	-178	-61.4	-170.9	177.9	-174	0	113.6	S604 I605	S604-K691 VanDerWaalsContact CA-O 3.31Å; S604-K691 WeakPolarHBondContact CA-O 3.41Å; I605-K691 PolarHBondContact N-O 3.24Å; I605-K691 VanDerWaalsContact N-O 3.07Å
692	N	90.4	Very high	86.2	Confident	45 Å²	45	52.8 Å²	52.8	24%	0.241	25%	0.252	C	S	.	.	B	Isolated β-bridge	trans	-119.2	146.7	-166.1	53.7	9.7	0	0	0	114.3	N601 I603 G694 S695	N601-N692 WeakPolarHBondContact O-CB 3.32Å; N601-N692 PolarHBondContact O-ND2 3.22Å; I603-N692 CarbonylContact O-C 3.54Å; I603-N692 VanDerWaalsContact O-CA 3.26Å; I603-N692 WeakPolarHBondContact O-CA 3.31Å; N692-G694 VanDerWaalsContact C-N 3.35Å; N692-G694 PolarHBondContact O-N 3.42Å; N692-S695 PolarHBondContact O-N 3.21Å; N692-S695 WeakPolarHBondContact OD1-CB 3.45Å; N692-S695 PolarHBondContact OD1-OG 3.4Å
693	W	91.3	Very high	84.5	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-67.7	-32.8	-174.6	-166.9	-100.9	0	0	0	113.1	F600 I603 I605 V610 T614 P622 I625 Q680 L683 S695 L696 L697	F600-W693 HydrophobicContact CB-CB 4.45Å; F600-W693 HydrophobicContact CD1-CB 4.42Å; F600-W693 AromaticContact CD1-CD1 3.59Å; F600-W693 HydrophobicContact CD1-CG 4.32Å; F600-W693 PolarHBondContact O-N 2.99Å; I603-W693 PolarHBondContact O-N 3.32Å; I605-W693 HydrophobicContact CB-CE3 4.43Å; I605-W693 HydrophobicContact CG1-CE3 4.38Å; I605-W693 HydrophobicContact CG2-CE3 4.16Å; I605-W693 HydrophobicContact CG2-CZ3 4.1Å; V610-W693 HydrophobicContact CG1-CD2 3.42Å; V610-W693 VanDerWaalsContact CG1-CD2 3.42Å; V610-W693 HydrophobicContact CG1-CE3 3.65Å; V610-W693 HydrophobicContact CG1-CG 3.9Å; V610-W693 HydrophobicContact CG1-CH2 4.29Å; V610-W693 HydrophobicContact CG1-CZ2 4.03Å; V610-W693 HydrophobicContact CG1-CZ3 4.08Å; V610-W693 HydrophobicContact CG2-CB 4.38Å; V610-W693 HydrophobicContact CG2-CD2 4.46Å; V610-W693 HydrophobicContact CG2-CG 4.3Å; T614-W693 HydrophobicContact CG2-CZ2 4.36Å; P622-W693 HydrophobicContact CB-CH2 3.73Å; P622-W693 HydrophobicContact CB-CZ2 4.35Å; P622-W693 HydrophobicContact CB-CZ3 4.39Å; P622-W693 HydrophobicContact CG-CH2 3.79Å; P622-W693 HydrophobicContact CG-CZ2 4.03Å; P622-W693 HydrophobicContact CG-CZ3 4.41Å; I625-W693 HydrophobicContact CB-CH2 4.14Å; I625-W693 HydrophobicContact CB-CZ2 4.2Å; I625-W693 HydrophobicContact CG1-CH2 4.31Å; I625-W693 HydrophobicContact CG1-CZ2 3.85Å; I625-W693 HydrophobicContact CG2-CH2 4.17Å; I625-W693 HydrophobicContact CG2-CZ2 4.43Å; Q680-W693 HydrophobicContact CG-CZ3 4.44Å; L683-W693 HydrophobicContact CD1-CH2 3.74Å; L683-W693 HydrophobicContact CD1-CZ3 3.94Å; W693-S695 PolarHBondContact O-N 2.87Å; W693-L696 HydrophobicContact CD2-CD1 4.47Å; W693-L696 HydrophobicContact CE3-CD1 3.67Å; W693-L696 HydrophobicContact CH2-CD1 4.12Å; W693-L696 HydrophobicContact CZ3-CD1 3.47Å; W693-L696 VanDerWaalsContact CZ3-CD1 3.47Å; W693-L696 PolarHBondContact O-N 3.49Å; W693-L696 VanDerWaalsContact O-N 3.08Å; W693-L697 PolarHBondContact O-N 2.81Å
694	G	86.3	Confident	82.6	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-58.5	-33.4	176.7	0	0	0	0	0	113.3	F600 N692 L697 R698	F600-G694 PolarHBondContact O-N 3.33Å; N692-G694 VanDerWaalsContact C-N 3.35Å; N692-G694 PolarHBondContact O-N 3.42Å; G694-L697 PolarHBondContact O-N 3.19Å; G694-R698 WeakPolarHBondContact O-CB 3.46Å; G694-R698 PolarHBondContact O-N 2.91Å
695	S	85.5	Confident	80.5	Confident	38 Å²	38	56.8 Å²	56.8	27%	0.266	28%	0.278	S	S	.	.	H	α-helix	trans	-70.5	-40.4	174.2	-64.3	0	0	0	0	112.3	V690 N692 W693 L697 R698 M699	V690-S695 VanDerWaalsContact CG1-CB 3.4Å; N692-S695 PolarHBondContact O-N 3.21Å; N692-S695 WeakPolarHBondContact OD1-CB 3.45Å; N692-S695 PolarHBondContact OD1-OG 3.4Å; W693-S695 PolarHBondContact O-N 2.87Å; S695-L697 VanDerWaalsContact C-N 3.34Å; S695-R698 PolarHBondContact O-N 3.34Å; S695-M699 WeakPolarHBondContact O-CG 3.49Å; S695-M699 PolarHBondContact O-N 3.06Å
696	L	86.6	Confident	78.5	Confident	0 Å²	0	57 Å²	57	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-64.7	-38.8	173.2	-65.8	-175.8	0	0	0	111.8	I605 I625 L683 H687 V690 W693 R698 M699 Y700	I605-L696 HydrophobicContact CB-CD1 4.5Å; I605-L696 HydrophobicContact CD1-CD1 3.72Å; I605-L696 HydrophobicContact CD1-CD2 4.4Å; I605-L696 HydrophobicContact CD1-CG 3.98Å; I605-L696 HydrophobicContact CG1-CD1 3.76Å; I605-L696 HydrophobicContact CG1-CG 4.26Å; I605-L696 HydrophobicContact CG2-CD1 3.96Å; I625-L696 HydrophobicContact CG2-CB 4.22Å; L683-L696 HydrophobicContact CB-CD1 4.01Å; L683-L696 HydrophobicContact CD1-CD1 4.17Å; L683-L696 HydrophobicContact CD2-CD1 4.4Å; L683-L696 HydrophobicContact CG-CD1 4.43Å; H687-L696 HydrophobicContact CB-CD2 4.48Å; H687-L696 VanDerWaalsContact CD2-CD2 3.5Å; H687-L696 WeakPolarHBondContact CD2-CD2 3.45Å; V690-L696 HydrophobicContact CG1-CD2 4.47Å; W693-L696 HydrophobicContact CD2-CD1 4.47Å; W693-L696 HydrophobicContact CE3-CD1 3.67Å; W693-L696 HydrophobicContact CH2-CD1 4.12Å; W693-L696 HydrophobicContact CZ3-CD1 3.47Å; W693-L696 VanDerWaalsContact CZ3-CD1 3.47Å; W693-L696 PolarHBondContact O-N 3.49Å; W693-L696 VanDerWaalsContact O-N 3.08Å; L696-R698 VanDerWaalsContact C-N 3.34Å; L696-M699 HydrophobicContact CD2-CE 3.72Å; L696-M699 PolarHBondContact O-N 3.02Å; L696-Y700 HydrophobicContact CD2-CD2 4.41Å; L696-Y700 HydrophobicContact CD2-CE2 4.36Å; L696-Y700 WeakPolarHBondContact O-CB 3.46Å; L696-Y700 PolarHBondContact O-N 2.83Å
697	L	86.2	Confident	76.5	Confident	5 Å²	5	62.4 Å²	62.4	3%	0.026	30%	0.301	C	S	.	.	H	α-helix	trans	-63.3	-38.7	172.8	-71.1	172.5	0	0	0	111.8	L597 F600 L619 I625 W693 G694 S695 G701	L597-L697 HydrophobicContact CD1-CB 4.18Å; L597-L697 HydrophobicContact CD1-CD1 4.22Å; L597-L697 HydrophobicContact CD2-CB 4.4Å; L597-L697 HydrophobicContact CG-CB 4.28Å; F600-L697 HydrophobicContact CB-CD1 3.88Å; F600-L697 HydrophobicContact CD1-CD1 4.3Å; F600-L697 HydrophobicContact CD2-CD1 3.78Å; F600-L697 HydrophobicContact CE2-CD1 4.4Å; F600-L697 HydrophobicContact CG-CD1 3.73Å; L619-L697 HydrophobicContact CB-CD2 4.41Å; L619-L697 HydrophobicContact CD1-CD1 3.83Å; L619-L697 HydrophobicContact CD1-CD2 4.26Å; I625-L697 HydrophobicContact CD1-CD2 4.35Å; W693-L697 PolarHBondContact O-N 2.81Å; G694-L697 PolarHBondContact O-N 3.19Å; S695-L697 VanDerWaalsContact C-N 3.34Å; L697-G701 WeakPolarHBondContact O-CA 3.1Å; L697-G701 PolarHBondContact O-N 2.97Å
698	R	84.9	Confident	74.5	Confident	147 Å²	147	66.5 Å²	66.5	56%	0.555	33%	0.328	S	S	*	.	H	α-helix	trans	-68.2	-39.3	176.5	-155.9	175.7	-57.3	-134.5	-0.2	112.4	L597 G694 S695 L696	L597-R698 HydrophobicContact CD2-CB 4.33Å; G694-R698 WeakPolarHBondContact O-CB 3.46Å; G694-R698 PolarHBondContact O-N 2.91Å; S695-R698 PolarHBondContact O-N 3.34Å; L696-R698 VanDerWaalsContact C-N 3.34Å
699	M	80.8	Confident	72.5	Confident	73 Å²	73	70.1 Å²	70.1	36%	0.36	34%	0.335	S	S	.	.	H	α-helix	trans	-75.5	-40.2	178.9	-69.6	-170.3	-63.5	0	0	113.8	R632 V690 S695 L696 S704	R632-M699 PolarHBondContact NH1-O 3.07Å; V690-M699 HydrophobicContact CG2-CE 4.1Å; S695-M699 WeakPolarHBondContact O-CG 3.49Å; S695-M699 PolarHBondContact O-N 3.06Å; L696-M699 HydrophobicContact CD2-CE 3.72Å; L696-M699 PolarHBondContact O-N 3.02Å; M699-S704 PolarHBondContact O-OG 3.03Å
700	Y	84.7	Confident	70.5	Confident	21 Å²	21	66.7 Å²	66.7	8%	0.082	32%	0.319	C	S	.	.	H	α-helix	trans	-123.9	-8.2	-168.1	-58.2	-62.2	0	0	0	114.8	I625 C629 R632 H687 L696	I625-Y700 HydrophobicContact CG2-CD2 4.28Å; C629-Y700 HydrophobicContact CB-CD1 4.13Å; C629-Y700 HydrophobicContact CB-CD2 4.19Å; C629-Y700 HydrophobicContact CB-CE1 3.94Å; C629-Y700 HydrophobicContact CB-CE2 3.96Å; C629-Y700 HydrophobicContact CB-CG 4.28Å; R632-Y700 PolarHBondContact NH2-O 3.25Å; H687-Y700 AromaticContact CE1-CE2 3.81Å; H687-Y700 AromaticContact CE1-CZ 3.91Å; H687-Y700 PolarHBondContact CE1-OH 2.85Å; H687-Y700 AromaticContact NE2-CE2 3.46Å; H687-Y700 WeakPolarHBondContact NE2-CE2 3.5Å; H687-Y700 AromaticContact NE2-CZ 3.92Å; L696-Y700 HydrophobicContact CD2-CD2 4.41Å; L696-Y700 HydrophobicContact CD2-CE2 4.36Å; L696-Y700 WeakPolarHBondContact O-CB 3.46Å; L696-Y700 PolarHBondContact O-N 2.83Å
701	G	78.4	Confident	68.7	Low	3 Å²	3	72.5 Å²	72.5	3%	0.031	34%	0.344	C	S	.	.	S	Bend	trans	-73.2	-176.6	-177.7	0	0	0	0	0	114.6	L697 E703 S704	L697-G701 WeakPolarHBondContact O-CA 3.1Å; L697-G701 PolarHBondContact O-N 2.97Å; G701-E703 PolarHBondContact O-N 3.25Å; G701-S704 PolarHBondContact O-N 3.16Å; G701-S704 PolarHBondContact O-OG 3.15Å
702	R	65.4	Low	67	Low	125 Å²	125	68.7 Å²	68.7	47%	0.472	34%	0.335	S	S	.	.	H	α-helix	trans	-62	-39.7	-169.6	-72.6	-173.3	-179.1	143.7	9.1	113.4	G618 L620 S704 S705 K706	G618-R702 PolarHBondContact O-NH1 2.97Å; G618-R702 PolarHBondContact O-NH2 2.98Å; L620-R702 HydrophobicContact CD1-CG 4.09Å; R702-S704 PolarHBondContact O-N 3.34Å; R702-S705 PolarHBondContact O-N 3.42Å; R702-S705 VanDerWaalsContact O-N 3.14Å; R702-K706 WeakPolarHBondContact O-CG 3.38Å; R702-K706 PolarHBondContact O-N 2.96Å
703	E	56.5	Low	65.2	Low	55 Å²	55	68.9 Å²	68.9	26%	0.257	34%	0.34	S	S	.	.	H	α-helix	trans	-59.1	-45.1	177.8	-66.2	119.1	-92.7	0	0	112.9	G701 S705 K706 M707	G701-E703 PolarHBondContact O-N 3.25Å; E703-S705 PolarHBondContact O-N 3.37Å; E703-S705 VanDerWaalsContact O-N 3.15Å; E703-K706 WeakPolarHBondContact O-CA 3.34Å; E703-K706 WeakPolarHBondContact O-CB 3.4Å; E703-K706 PolarHBondContact O-N 3.36Å; E703-M707 PolarHBondContact O-N 2.65Å
704	S	53	Low	63.4	Low	18 Å²	18	74.2 Å²	74.2	13%	0.126	37%	0.368	C	S	.	.	H	α-helix	trans	-57.3	-31.9	177.5	72.3	0	0	0	0	112.5	R632 M699 G701 R702 V708	R632-S704 PolarHBondContact NH1-OG 3.26Å; R632-S704 PolarHBondContact NH2-OG 2.84Å; M699-S704 PolarHBondContact O-OG 3.03Å; G701-S704 PolarHBondContact O-N 3.16Å; G701-S704 PolarHBondContact O-OG 3.15Å; R702-S704 PolarHBondContact O-N 3.34Å; S704-V708 WeakPolarHBondContact O-CG2 3.46Å; S704-V708 PolarHBondContact O-N 2.92Å
705	S	49.7	Very low	62	Low	50 Å²	50	79.7 Å²	79.7	35%	0.35	39%	0.392	S	S	.	.	H	α-helix	trans	-79	-34.6	174.2	-167.4	0	0	0	0	113	R702 E703 K709	R702-S705 PolarHBondContact O-N 3.42Å; R702-S705 VanDerWaalsContact O-N 3.14Å; E703-S705 PolarHBondContact O-N 3.37Å; E703-S705 VanDerWaalsContact O-N 3.15Å; S705-K709 WeakPolarHBondContact O-CB 3.3Å; S705-K709 PolarHBondContact O-N 2.97Å; S705-K709 VanDerWaalsContact O-N 3.16Å
706	K	49.5	Very low	60.9	Low	88 Å²	88	79 Å²	79	38%	0.383	39%	0.387	S	S	.	.	H	α-helix	trans	-58.7	-53.5	170.6	-61.8	172.9	-162	160	0	109.9	D593 R702 E703 V708 K709 Q710	D593-K706 IonicContact OD2-NZ 3.94Å; D593-K706 PolarHBondContact OD2-NZ 2.71Å; R702-K706 WeakPolarHBondContact O-CG 3.38Å; R702-K706 PolarHBondContact O-N 2.96Å; E703-K706 WeakPolarHBondContact O-CA 3.34Å; E703-K706 WeakPolarHBondContact O-CB 3.4Å; E703-K706 PolarHBondContact O-N 3.36Å; K706-V708 VanDerWaalsContact C-N 3.27Å; K706-V708 PolarHBondContact O-N 2.99Å; K706-K709 PolarHBondContact O-N 3.47Å; K706-Q710 WeakPolarHBondContact O-CB 3.26Å; K706-Q710 PolarHBondContact O-N 2.76Å
707	M	44.5	Very low	60	Low	155 Å²	155	81.8 Å²	81.8	76%	0.764	40%	0.404	S	S	*	.	H	α-helix	trans	-57.6	-38.3	-177	-68	-179.6	74.8	0	0	112.7	E703	E703-M707 PolarHBondContact O-N 2.65Å
708	V	46.6	Very low	59.2	Low	111 Å²	111	87.1 Å²	87.1	67%	0.673	43%	0.431	S	S	*	.	H	α-helix	trans	-76.1	-25.9	178.7	173.1	0	0	0	0	113.1	S704 K706	S704-V708 WeakPolarHBondContact O-CG2 3.46Å; S704-V708 PolarHBondContact O-N 2.92Å; K706-V708 VanDerWaalsContact C-N 3.27Å; K706-V708 PolarHBondContact O-N 2.99Å
709	K	45.7	Very low	58.6	Low	162 Å²	162	85 Å²	85	70%	0.704	43%	0.428	S	S	*	.	H	α-helix	trans	-105.3	-19.3	-176.7	-80.2	-161.7	168.2	-166.3	0	116.5	S705 K706	S705-K709 WeakPolarHBondContact O-CB 3.3Å; S705-K709 PolarHBondContact O-N 2.97Å; S705-K709 VanDerWaalsContact O-N 3.16Å; K706-K709 PolarHBondContact O-N 3.47Å
710	Q	43.8	Very low	58.2	Low	112 Å²	112	83 Å²	83	52%	0.523	42%	0.418	S	S	.	.	S	Bend	trans	-88.8	-20	-158.9	-169.4	159.9	-45.6	0	0	115.3	K706 K715	K706-Q710 WeakPolarHBondContact O-CB 3.26Å; K706-Q710 PolarHBondContact O-N 2.76Å; Q710-K715 WeakPolarHBondContact O-CE 3.44Å; Q710-K715 PolarHBondContact O-NZ 2.89Å
711	E	48.2	Very low	57.6	Low	152 Å²	152	87.1 Å²	87.1	71%	0.71	44%	0.438	S	S	*	.	S	Bend	trans	-131.6	-30.9	-163.3	-64	-169.1	134.7	0	0	118.5
712	T	49.7	Very low	57.4	Low	83 Å²	83	93.4 Å²	93.4	51%	0.509	47%	0.467	S	S	.	.	S	Bend	trans	-106.6	-35.4	-161.9	50.3	0	0	0	0	118.1	K736	T712-K736 WeakPolarHBondContact O-CE 3.38Å; T712-K736 PolarHBondContact O-NZ 3.25Å
713	S	52.5	Low	57.6	Low	49 Å²	49	93.9 Å²	93.9	34%	0.343	47%	0.469	S	S	.	.	S	Bend	trans	-95.7	-71.9	-174.3	56.7	0	0	0	0	113.8	S716 V717	S713-S716 WeakPolarHBondContact O-CB 3.46Å; S713-S716 PolarHBondContact O-N 3.2Å; S713-V717 PolarHBondContact O-N 3.35Å
714	D	52.6	Low	58.4	Low	111 Å²	111	94 Å²	94	59%	0.594	48%	0.48	S	S	*	.	H	α-helix	trans	-73.7	-43.8	-152.7	-60.1	4.3	0	0	0	112.6	S716 V717 I718	D714-S716 VanDerWaalsContact C-N 3.3Å; D714-S716 PolarHBondContact O-N 3.01Å; D714-V717 PolarHBondContact O-N 3.25Å; D714-I718 WeakPolarHBondContact O-CG1 3.33Å; D714-I718 PolarHBondContact O-N 3.2Å
715	K	56.4	Low	59.5	Low	116 Å²	116	100.8 Å²	100.8	50%	0.504	51%	0.507	S	S	.	.	H	α-helix	trans	-54.5	-48.8	171.4	-67	171.6	177	167.6	0	110.9	Q710 V717 I718 E719	Q710-K715 WeakPolarHBondContact O-CE 3.44Å; Q710-K715 PolarHBondContact O-NZ 2.89Å; K715-V717 PolarHBondContact O-N 3.43Å; K715-I718 PolarHBondContact O-N 3.31Å; K715-E719 WeakPolarHBondContact O-CB 3.42Å; K715-E719 WeakPolarHBondContact O-CG 3.42Å; K715-E719 PolarHBondContact O-N 3.18Å
716	S	63.6	Low	60.4	Low	24 Å²	24	108.1 Å²	108.1	17%	0.168	53%	0.532	C	S	.	.	H	α-helix	trans	-64.9	-36.4	-177.3	-176	0	0	0	0	112.1	S713 D714 L720 K736	S713-S716 WeakPolarHBondContact O-CB 3.46Å; S713-S716 PolarHBondContact O-N 3.2Å; D714-S716 VanDerWaalsContact C-N 3.3Å; D714-S716 PolarHBondContact O-N 3.01Å; S716-L720 WeakPolarHBondContact O-CB 3.15Å; S716-L720 WeakPolarHBondContact O-CG 3.5Å; S716-L720 PolarHBondContact O-N 2.84Å; S716-K736 WeakPolarHBondContact OG-CD 3.2Å; S716-K736 VanDerWaalsContact OG-CE 3.3Å; S716-K736 WeakPolarHBondContact OG-CE 3.3Å; S716-K736 PolarHBondContact OG-NZ 3.21Å
717	V	66.8	Low	61.5	Low	57 Å²	57	112 Å²	112	35%	0.345	56%	0.558	S	S	.	*	H	α-helix	trans	-66.1	-41.3	174.5	174.4	0	0	0	0	111.5	S713 D714 K715 L720 Q721	S713-V717 PolarHBondContact O-N 3.35Å; D714-V717 PolarHBondContact O-N 3.25Å; K715-V717 PolarHBondContact O-N 3.43Å; V717-L720 PolarHBondContact O-N 3.19Å; V717-Q721 WeakPolarHBondContact O-CB 3.34Å; V717-Q721 VanDerWaalsContact O-CG 3.27Å; V717-Q721 WeakPolarHBondContact O-CG 3.37Å; V717-Q721 PolarHBondContact O-N 3.21Å
718	I	70.4	Confident	63.1	Low	117 Å²	117	112.2 Å²	112.2	60%	0.6	55%	0.554	S	S	*	*	H	α-helix	trans	-67.4	-45.6	178.1	-64	166.3	0	0	0	110.8	D714 K715 L720 Q721 Q722	D714-I718 WeakPolarHBondContact O-CG1 3.33Å; D714-I718 PolarHBondContact O-N 3.2Å; K715-I718 PolarHBondContact O-N 3.31Å; I718-L720 VanDerWaalsContact C-N 3.32Å; I718-L720 PolarHBondContact O-N 2.98Å; I718-Q721 WeakPolarHBondContact O-CB 3.45Å; I718-Q721 PolarHBondContact O-N 3.42Å; I718-Q722 PolarHBondContact O-N 3.42Å
719	E	71.8	Confident	64.6	Low	104 Å²	104	111.5 Å²	111.5	49%	0.486	55%	0.552	S	S	.	*	H	α-helix	trans	-61.8	-37.5	173.8	-73.3	164	-166.7	0	0	112.1	K715 Q722 Y723	K715-E719 WeakPolarHBondContact O-CB 3.42Å; K715-E719 WeakPolarHBondContact O-CG 3.42Å; K715-E719 PolarHBondContact O-N 3.18Å; E719-Q722 WeakPolarHBondContact O-CG 3.42Å; E719-Q722 PolarHBondContact O-N 3Å; E719-Q722 PolarHBondContact O-NE2 3.4Å; E719-Y723 VanDerWaalsContact O-CD2 3.29Å; E719-Y723 WeakPolarHBondContact O-CD2 3.41Å; E719-Y723 WeakPolarHBondContact O-CE2 3.29Å
720	L	71.9	Confident	66.3	Low	29 Å²	29	105 Å²	105	15%	0.152	53%	0.525	C	S	.	.	H	α-helix	trans	-74.7	-29.9	177.2	-69.7	-176.2	0	0	0	112.5	S716 V717 I718 Q722 Y723 N730 H732 I733 K736	S716-L720 WeakPolarHBondContact O-CB 3.15Å; S716-L720 WeakPolarHBondContact O-CG 3.5Å; S716-L720 PolarHBondContact O-N 2.84Å; V717-L720 PolarHBondContact O-N 3.19Å; I718-L720 VanDerWaalsContact C-N 3.32Å; I718-L720 PolarHBondContact O-N 2.98Å; L720-Q722 PolarHBondContact O-N 3.36Å; L720-Y723 HydrophobicContact CD2-CD2 4.25Å; L720-Y723 PolarHBondContact O-N 2.84Å; L720-N730 PolarHBondContact O-ND2 3.19Å; L720-H732 HydrophobicContact CB-CB 4.46Å; L720-H732 HydrophobicContact CD1-CB 4.2Å; L720-H732 HydrophobicContact CD2-CB 3.61Å; L720-H732 HydrophobicContact CG-CB 4.29Å; L720-I733 HydrophobicContact CB-CD1 4.49Å; L720-I733 HydrophobicContact CB-CG1 3.71Å; L720-K736 HydrophobicContact CD1-CB 4.07Å; L720-K736 HydrophobicContact CD1-CD 3.86Å
721	Q	72.1	Confident	68.2	Low	109 Å²	109	104.8 Å²	104.8	51%	0.509	53%	0.527	S	S	.	.	H	α-helix	trans	-61	-30.9	171.2	-78.5	172.4	0.2	0	0	112.5	V717 I718 Y723 A724 I733	V717-Q721 WeakPolarHBondContact O-CB 3.34Å; V717-Q721 VanDerWaalsContact O-CG 3.27Å; V717-Q721 WeakPolarHBondContact O-CG 3.37Å; V717-Q721 PolarHBondContact O-N 3.21Å; I718-Q721 WeakPolarHBondContact O-CB 3.45Å; I718-Q721 PolarHBondContact O-N 3.42Å; Q721-Y723 PolarHBondContact O-N 3.36Å; Q721-A724 WeakPolarHBondContact O-CB 3.27Å; Q721-A724 PolarHBondContact O-N 3.19Å; Q721-I733 HydrophobicContact CG-CD1 3.83Å
722	Q	73.9	Confident	69.7	Low	134 Å²	134	102 Å²	102	63%	0.626	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-22.2	177.8	98.5	-160.9	-63.4	0	0	113.4	I718 E719 L720 A724	I718-Q722 PolarHBondContact O-N 3.42Å; E719-Q722 WeakPolarHBondContact O-CG 3.42Å; E719-Q722 PolarHBondContact O-N 3Å; E719-Q722 PolarHBondContact O-NE2 3.4Å; L720-Q722 PolarHBondContact O-N 3.36Å; Q722-A724 VanDerWaalsContact C-N 3.33Å
723	Y	70.1	Confident	71.3	Confident	136 Å²	136	100.6 Å²	100.6	53%	0.533	50%	0.502	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.7	3.6	175.3	-59.6	-75.6	0	0	0	113.6	E719 L720 Q721 K725	E719-Y723 VanDerWaalsContact O-CD2 3.29Å; E719-Y723 WeakPolarHBondContact O-CD2 3.41Å; E719-Y723 WeakPolarHBondContact O-CE2 3.29Å; L720-Y723 HydrophobicContact CD2-CD2 4.25Å; L720-Y723 PolarHBondContact O-N 2.84Å; Q721-Y723 PolarHBondContact O-N 3.36Å; Y723-K725 PolarHBondContact O-N 3Å
724	A	73.7	Confident	72.8	Confident	57 Å²	57	102.4 Å²	102.4	47%	0.471	51%	0.508	S	S	.	.			trans	-70.3	116	176.8	0	0	0	0	0	111.3	Q721 Q722	Q721-A724 WeakPolarHBondContact O-CB 3.27Å; Q721-A724 PolarHBondContact O-N 3.19Å; Q722-A724 VanDerWaalsContact C-N 3.33Å
725	K	75.8	Confident	74.3	Confident	160 Å²	160	101.4 Å²	101.4	70%	0.696	50%	0.502	S	S	*	.			trans	-92.5	133	173.5	-63.8	-178.5	-179.3	-179	0	109.2	Y723 N727 K728	Y723-K725 PolarHBondContact O-N 3Å; K725-N727 PolarHBondContact O-N 3.18Å; K725-K728 PolarHBondContact O-N 2.77Å; K725-K728 VanDerWaalsContact O-N 3.08Å
726	K	69.3	Low	75.6	Confident	204 Å²	204	98.1 Å²	98.1	89%	0.887	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.8	136.3	175.3	-72.7	-173.7	176.8	-178.5	0	109.9	K728	K726-K728 VanDerWaalsContact C-N 3.29Å; K726-K728 PolarHBondContact O-N 3.22Å
727	N	73.1	Confident	76.6	Confident	171 Å²	171	101.7 Å²	101.7	91%	0.914	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.2	23.5	-178.2	-54.1	-2.1	0	0	0	115.7	K725	K725-N727 PolarHBondContact O-N 3.18Å
728	K	77.6	Confident	77.5	Confident	158 Å²	158	104.2 Å²	104.2	69%	0.687	51%	0.513	S	S	*	.	S	Bend	trans	-135.1	145	167.2	-68.4	-166.5	176	-171	0	112	K725 K726	K725-K728 PolarHBondContact O-N 2.77Å; K725-K728 VanDerWaalsContact O-N 3.08Å; K726-K728 VanDerWaalsContact C-N 3.29Å; K726-K728 PolarHBondContact O-N 3.22Å
729	P	77	Confident	78.3	Confident	97 Å²	97	104.5 Å²	104.5	63%	0.63	51%	0.512	S	S	*	.			trans	-66.5	145	177.3	28.7	-35.3	0	0	0	111.2	L731 L734	P729-L731 HydrophobicContact CG-CD2 4.46Å; P729-L731 PolarHBondContact O-N 2.91Å; P729-L734 HydrophobicContact CB-CD1 4.31Å
730	N	82.9	Confident	78.9	Confident	26 Å²	26	102.7 Å²	102.7	14%	0.139	50%	0.503	C	S	.	.			trans	-81.2	88.1	177.9	-167	-26	0	0	0	111	L720 H732 I733 L734	L720-N730 PolarHBondContact O-ND2 3.19Å; N730-H732 PolarHBondContact O-N 2.83Å; N730-H732 PolarHBondContact OD1-N 2.92Å; N730-I733 HydrophobicContact CB-CB 4.34Å; N730-I733 HydrophobicContact CB-CD1 4.1Å; N730-I733 HydrophobicContact CB-CG1 4.26Å; N730-I733 VanDerWaalsContact ND2-CD1 3.34Å; N730-I733 WeakPolarHBondContact ND2-CD1 3.12Å; N730-I733 PolarHBondContact O-N 2.97Å; N730-I733 PolarHBondContact OD1-N 3.45Å; N730-L734 PolarHBondContact O-N 3.38Å; N730-L734 VanDerWaalsContact O-N 3.14Å
731	L	83.1	Confident	79.6	Confident	106 Å²	106	106.4 Å²	106.4	56%	0.555	52%	0.521	S	S	*	.	H	α-helix	trans	-57.5	-29.3	-179.7	-62.2	177.6	0	0	0	113.4	P729 L734 N735	P729-L731 HydrophobicContact CG-CD2 4.46Å; P729-L731 PolarHBondContact O-N 2.91Å; L731-L734 HydrophobicContact CD2-CD1 4.34Å; L731-L734 PolarHBondContact O-N 3.37Å; L731-N735 WeakPolarHBondContact O-CB 3.17Å; L731-N735 PolarHBondContact O-N 2.68Å; L731-N735 PolarHBondContact O-OD1 2.82Å
732	H	79.9	Confident	80.5	Confident	95 Å²	95	106.6 Å²	106.6	44%	0.44	52%	0.52	S	S	.	.	H	α-helix	trans	-70.8	-41.6	179.3	-53.3	92.3	0	0	0	111.8	L720 N730 L734 N735 K736	L720-H732 HydrophobicContact CB-CB 4.46Å; L720-H732 HydrophobicContact CD1-CB 4.2Å; L720-H732 HydrophobicContact CD2-CB 3.61Å; L720-H732 HydrophobicContact CG-CB 4.29Å; N730-H732 PolarHBondContact O-N 2.83Å; N730-H732 PolarHBondContact OD1-N 2.92Å; H732-L734 VanDerWaalsContact C-N 3.32Å; H732-N735 PolarHBondContact O-N 3.3Å; H732-K736 PolarHBondContact O-N 3.21Å
733	I	83.1	Confident	81	Confident	53 Å²	53	105.3 Å²	105.3	27%	0.272	51%	0.512	S	S	.	.	H	α-helix	trans	-63.8	-41	173.5	-63.8	177.7	0	0	0	110.2	L720 Q721 N730 K736 L737	L720-I733 HydrophobicContact CB-CD1 4.49Å; L720-I733 HydrophobicContact CB-CG1 3.71Å; Q721-I733 HydrophobicContact CG-CD1 3.83Å; N730-I733 HydrophobicContact CB-CB 4.34Å; N730-I733 HydrophobicContact CB-CD1 4.1Å; N730-I733 HydrophobicContact CB-CG1 4.26Å; N730-I733 VanDerWaalsContact ND2-CD1 3.34Å; N730-I733 WeakPolarHBondContact ND2-CD1 3.12Å; N730-I733 PolarHBondContact O-N 2.97Å; N730-I733 PolarHBondContact OD1-N 3.45Å; I733-K736 PolarHBondContact O-N 3.08Å; I733-L737 VanDerWaalsContact O-CB 3.32Å; I733-L737 WeakPolarHBondContact O-CB 3.46Å; I733-L737 PolarHBondContact O-N 3.14Å
734	L	83.4	Confident	81.4	Confident	86 Å²	86	102.1 Å²	102.1	45%	0.45	50%	0.504	S	S	.	.	H	α-helix	trans	-64.8	-40.1	177.2	-68.4	169.5	0	0	0	112.5	P729 N730 L731 H732 L737 Q738	P729-L734 HydrophobicContact CB-CD1 4.31Å; N730-L734 PolarHBondContact O-N 3.38Å; N730-L734 VanDerWaalsContact O-N 3.14Å; L731-L734 HydrophobicContact CD2-CD1 4.34Å; L731-L734 PolarHBondContact O-N 3.37Å; H732-L734 VanDerWaalsContact C-N 3.32Å; L734-L737 PolarHBondContact O-N 2.92Å; L734-Q738 PolarHBondContact O-N 3.48Å
735	N	84.3	Confident	82.1	Confident	90 Å²	90	102.2 Å²	102.2	48%	0.481	51%	0.505	S	S	.	.	H	α-helix	trans	-65.5	-47.3	175.7	-71.4	-4	0	0	0	111.5	L731 H732 L737 Q738 E739	L731-N735 WeakPolarHBondContact O-CB 3.17Å; L731-N735 PolarHBondContact O-N 2.68Å; L731-N735 PolarHBondContact O-OD1 2.82Å; H732-N735 PolarHBondContact O-N 3.3Å; N735-L737 VanDerWaalsContact C-N 3.3Å; N735-L737 PolarHBondContact O-N 3.45Å; N735-Q738 WeakPolarHBondContact O-CA 3.21Å; N735-Q738 WeakPolarHBondContact O-CB 3.32Å; N735-Q738 PolarHBondContact O-N 3.03Å; N735-E739 PolarHBondContact O-N 3.37Å
736	K	84.1	Confident	82.5	Confident	48 Å²	48	100.6 Å²	100.6	21%	0.209	50%	0.5	C	S	.	.	H	α-helix	trans	-61.2	-38.8	176.3	-171	-174.9	176.4	84.7	0	111.9	T712 S716 L720 H732 I733 Q738 E739 E740	T712-K736 WeakPolarHBondContact O-CE 3.38Å; T712-K736 PolarHBondContact O-NZ 3.25Å; S716-K736 WeakPolarHBondContact OG-CD 3.2Å; S716-K736 VanDerWaalsContact OG-CE 3.3Å; S716-K736 WeakPolarHBondContact OG-CE 3.3Å; S716-K736 PolarHBondContact OG-NZ 3.21Å; L720-K736 HydrophobicContact CD1-CB 4.07Å; L720-K736 HydrophobicContact CD1-CD 3.86Å; H732-K736 PolarHBondContact O-N 3.21Å; I733-K736 PolarHBondContact O-N 3.08Å; K736-Q738 VanDerWaalsContact C-N 3.34Å; K736-E739 PolarHBondContact O-N 3.21Å; K736-E740 PolarHBondContact O-N 3.03Å
737	L	84.9	Confident	82.9	Confident	99 Å²	99	96.1 Å²	96.1	52%	0.518	48%	0.482	S	S	.	.	H	α-helix	trans	-62.4	-40.8	172.4	178.5	62.3	0	0	0	111.5	I733 L734 N735 E739 M741	I733-L737 VanDerWaalsContact O-CB 3.32Å; I733-L737 WeakPolarHBondContact O-CB 3.46Å; I733-L737 PolarHBondContact O-N 3.14Å; L734-L737 PolarHBondContact O-N 2.92Å; N735-L737 VanDerWaalsContact C-N 3.3Å; N735-L737 PolarHBondContact O-N 3.45Å; L737-E739 VanDerWaalsContact C-N 3.33Å; L737-E739 PolarHBondContact O-N 3.38Å; L737-M741 HydrophobicContact CD1-CG 4.14Å; L737-M741 HydrophobicContact CG-CG 4.37Å; L737-M741 VanDerWaalsContact O-CB 3.29Å; L737-M741 WeakPolarHBondContact O-CB 3.11Å; L737-M741 WeakPolarHBondContact O-CG 3.31Å; L737-M741 PolarHBondContact O-N 3.41Å
738	Q	86.3	Confident	83.3	Confident	109 Å²	109	96.4 Å²	96.4	51%	0.509	47%	0.471	S	S	.	.	H	α-helix	trans	-64.4	-36.6	176.5	-159.1	-163.9	43.6	0	0	112.3	L734 N735 K736 K742	L734-Q738 PolarHBondContact O-N 3.48Å; N735-Q738 WeakPolarHBondContact O-CA 3.21Å; N735-Q738 WeakPolarHBondContact O-CB 3.32Å; N735-Q738 PolarHBondContact O-N 3.03Å; K736-Q738 VanDerWaalsContact C-N 3.34Å; Q738-K742 WeakPolarHBondContact O-CD 3.45Å; Q738-K742 VanDerWaalsContact O-CG 3.26Å; Q738-K742 WeakPolarHBondContact O-CG 3.29Å; Q738-K742 PolarHBondContact O-N 2.93Å
739	E	86.8	Confident	83.6	Confident	124 Å²	124	92.6 Å²	92.6	58%	0.579	46%	0.455	S	S	*	.	H	α-helix	trans	-68.1	-49.2	176.1	-71.1	173	168.4	0	0	112.1	N735 K736 L737 M741 K742 K743	N735-E739 PolarHBondContact O-N 3.37Å; K736-E739 PolarHBondContact O-N 3.21Å; L737-E739 VanDerWaalsContact C-N 3.33Å; L737-E739 PolarHBondContact O-N 3.38Å; E739-M741 VanDerWaalsContact C-N 3.31Å; E739-M741 PolarHBondContact O-N 3.4Å; E739-K742 WeakPolarHBondContact O-CB 3.39Å; E739-K742 PolarHBondContact O-N 2.89Å; E739-K742 VanDerWaalsContact O-N 3.15Å; E739-K743 WeakPolarHBondContact O-CB 3.42Å; E739-K743 PolarHBondContact O-N 2.93Å
740	E	83.8	Confident	83.8	Confident	66 Å²	66	94 Å²	94	31%	0.308	45%	0.453	S	S	.	.	H	α-helix	trans	-64.7	-33.6	176.1	-71.1	-65.5	164.2	0	0	112.1	K736 K743 L744	K736-E740 PolarHBondContact O-N 3.03Å; E740-K743 PolarHBondContact O-N 3.48Å; E740-K743 IonicContact OE1-NZ 3.98Å; E740-K743 PolarHBondContact OE1-NZ 3.33Å; E740-K743 IonicContact OE2-NZ 2.97Å; E740-K743 PolarHBondContact OE2-NZ 3.01Å; E740-L744 WeakPolarHBondContact O-CB 3.34Å; E740-L744 PolarHBondContact O-N 2.91Å
741	M	87.5	Confident	83.1	Confident	107 Å²	107	96.6 Å²	96.6	53%	0.527	47%	0.47	S	S	.	.	H	α-helix	trans	-65.9	-38	171.4	-72.4	-78.9	96.3	0	0	113	L737 E739 L744 A745	L737-M741 HydrophobicContact CD1-CG 4.14Å; L737-M741 HydrophobicContact CG-CG 4.37Å; L737-M741 VanDerWaalsContact O-CB 3.29Å; L737-M741 WeakPolarHBondContact O-CB 3.11Å; L737-M741 WeakPolarHBondContact O-CG 3.31Å; L737-M741 PolarHBondContact O-N 3.41Å; E739-M741 VanDerWaalsContact C-N 3.31Å; E739-M741 PolarHBondContact O-N 3.4Å; M741-L744 HydrophobicContact CE-CD1 3.61Å; M741-A745 WeakPolarHBondContact O-CB 3.48Å; M741-A745 PolarHBondContact O-N 3.42Å
742	K	89.6	Confident	82.5	Confident	113 Å²	113	101 Å²	101	49%	0.491	48%	0.479	S	S	.	.	H	α-helix	trans	-65.4	-42.7	173.5	-75	163.5	-177.8	164.9	0	111.5	Q738 E739 A745 Q746	Q738-K742 WeakPolarHBondContact O-CD 3.45Å; Q738-K742 VanDerWaalsContact O-CG 3.26Å; Q738-K742 WeakPolarHBondContact O-CG 3.29Å; Q738-K742 PolarHBondContact O-N 2.93Å; E739-K742 WeakPolarHBondContact O-CB 3.39Å; E739-K742 PolarHBondContact O-N 2.89Å; E739-K742 VanDerWaalsContact O-N 3.15Å; K742-A745 WeakPolarHBondContact O-CB 3.32Å; K742-A745 PolarHBondContact O-N 2.97Å; K742-Q746 WeakPolarHBondContact O-CG 3.4Å; K742-Q746 PolarHBondContact O-N 3.18Å
743	K	84.9	Confident	82.1	Confident	106 Å²	106	103.4 Å²	103.4	46%	0.461	49%	0.488	S	S	.	.	H	α-helix	trans	-63.7	-45.1	177	176.2	173.3	151.5	-137.5	0	112.2	E739 E740 A745 Q746 E747	E739-K743 WeakPolarHBondContact O-CB 3.42Å; E739-K743 PolarHBondContact O-N 2.93Å; E740-K743 PolarHBondContact O-N 3.48Å; E740-K743 IonicContact OE1-NZ 3.98Å; E740-K743 PolarHBondContact OE1-NZ 3.33Å; E740-K743 IonicContact OE2-NZ 2.97Å; E740-K743 PolarHBondContact OE2-NZ 3.01Å; K743-A745 VanDerWaalsContact C-N 3.27Å; K743-A745 PolarHBondContact O-N 3.36Å; K743-Q746 WeakPolarHBondContact O-CB 3.49Å; K743-Q746 PolarHBondContact O-N 3.08Å; K743-Q746 VanDerWaalsContact O-N 3.15Å; K743-E747 PolarHBondContact O-N 3.17Å
744	L	79.6	Confident	80.5	Confident	69 Å²	69	107.7 Å²	107.7	36%	0.361	51%	0.505	S	S	.	.	H	α-helix	trans	-63.1	-30.2	171.7	-82.8	161.8	0	0	0	113	E740 M741 R748	E740-L744 WeakPolarHBondContact O-CB 3.34Å; E740-L744 PolarHBondContact O-N 2.91Å; M741-L744 HydrophobicContact CE-CD1 3.61Å; L744-R748 WeakPolarHBondContact O-CB 3.48Å; L744-R748 WeakPolarHBondContact O-CG 3.49Å; L744-R748 PolarHBondContact O-N 3.15Å; L744-R748 VanDerWaalsContact O-N 3.08Å
745	A	87	Confident	78.7	Confident	59 Å²	59	109.3 Å²	109.3	49%	0.488	52%	0.521	S	S	.	.	H	α-helix	trans	-70.9	-39	172.3	0	0	0	0	0	112.2	M741 K742 K743 R748 E749	M741-A745 WeakPolarHBondContact O-CB 3.48Å; M741-A745 PolarHBondContact O-N 3.42Å; K742-A745 WeakPolarHBondContact O-CB 3.32Å; K742-A745 PolarHBondContact O-N 2.97Å; K743-A745 VanDerWaalsContact C-N 3.27Å; K743-A745 PolarHBondContact O-N 3.36Å; A745-R748 PolarHBondContact O-N 2.86Å; A745-E749 WeakPolarHBondContact O-CB 3.19Å; A745-E749 PolarHBondContact O-N 3.06Å
746	Q	85.1	Confident	76.9	Confident	127 Å²	127	114.4 Å²	114.4	59%	0.593	54%	0.539	S	S	*	.	H	α-helix	trans	-64.1	-46.6	173.4	-71.3	171.8	-42.5	0	0	111.7	K742 K743 R748 E749 E750	K742-Q746 WeakPolarHBondContact O-CG 3.4Å; K742-Q746 PolarHBondContact O-N 3.18Å; K743-Q746 WeakPolarHBondContact O-CB 3.49Å; K743-Q746 PolarHBondContact O-N 3.08Å; K743-Q746 VanDerWaalsContact O-N 3.15Å; Q746-R748 VanDerWaalsContact C-N 3.33Å; Q746-R748 PolarHBondContact O-N 3.43Å; Q746-E749 CarbonylContact O-C 3.6Å; Q746-E749 WeakPolarHBondContact O-CA 3.26Å; Q746-E749 WeakPolarHBondContact O-CB 3.35Å; Q746-E749 PolarHBondContact O-N 3.28Å; Q746-E750 PolarHBondContact O-N 2.98Å
747	E	77.9	Confident	74.7	Confident	109 Å²	109	120.7 Å²	120.7	51%	0.509	57%	0.571	S	S	.	*	H	α-helix	trans	-60.5	-39.7	176.6	-174.4	179	-169.5	0	0	112.4	K743 E749 T751	K743-E747 PolarHBondContact O-N 3.17Å; E747-E749 VanDerWaalsContact C-N 3.28Å; E747-E749 PolarHBondContact O-N 3.38Å; E747-T751 WeakPolarHBondContact O-CB 3.4Å; E747-T751 WeakPolarHBondContact O-CG2 3.46Å; E747-T751 PolarHBondContact O-N 2.74Å; E747-T751 PolarHBondContact O-OG1 3.09Å
748	R	79.9	Confident	72.4	Confident	178 Å²	178	122 Å²	122	67%	0.672	58%	0.583	S	S	*	*	H	α-helix	trans	-65.4	-28.9	172.4	-78.4	174.2	174.2	-163.9	-2.1	113.5	L744 A745 Q746 T751 R752	L744-R748 WeakPolarHBondContact O-CB 3.48Å; L744-R748 WeakPolarHBondContact O-CG 3.49Å; L744-R748 PolarHBondContact O-N 3.15Å; L744-R748 VanDerWaalsContact O-N 3.08Å; A745-R748 PolarHBondContact O-N 2.86Å; Q746-R748 VanDerWaalsContact C-N 3.33Å; Q746-R748 PolarHBondContact O-N 3.43Å; R748-T751 VanDerWaalsContact CA-OG1 3.31Å; R748-T751 WeakPolarHBondContact CA-OG1 3.49Å; R748-T751 PolarHBondContact O-OG1 3.47Å; R748-R752 WeakPolarHBondContact O-CD 3.5Å; R748-R752 WeakPolarHBondContact O-CG 3.24Å; R748-R752 PolarHBondContact O-N 3Å
749	E	85.2	Confident	70.1	Confident	77 Å²	77	124 Å²	124	36%	0.36	60%	0.596	S	S	.	*	H	α-helix	trans	-83.2	-37.5	178.9	-174.9	59.2	-163	0	0	111.6	A745 Q746 E747 R752 K753	A745-E749 WeakPolarHBondContact O-CB 3.19Å; A745-E749 PolarHBondContact O-N 3.06Å; Q746-E749 CarbonylContact O-C 3.6Å; Q746-E749 WeakPolarHBondContact O-CA 3.26Å; Q746-E749 WeakPolarHBondContact O-CB 3.35Å; Q746-E749 PolarHBondContact O-N 3.28Å; E747-E749 VanDerWaalsContact C-N 3.28Å; E747-E749 PolarHBondContact O-N 3.38Å; E749-R752 PolarHBondContact O-N 3.36Å; E749-R752 IonicContact OE2-NH1 2.88Å; E749-K753 HydrophobicContact CG-CD 4.37Å; E749-K753 WeakPolarHBondContact O-CG 3.47Å; E749-K753 PolarHBondContact O-N 3.4Å; E749-K753 VanDerWaalsContact O-N 3.09Å; E749-K753 VanDerWaalsContact OE1-CE 3.24Å; E749-K753 WeakPolarHBondContact OE1-CE 3.39Å; E749-K753 IonicContact OE1-NZ 2.71Å; E749-K753 PolarHBondContact OE1-NZ 3.48Å
750	E	79.6	Confident	67.7	Low	126 Å²	126	124.3 Å²	124.3	59%	0.589	61%	0.606	S	S	*	*	H	α-helix	trans	-64.6	-41.6	171	-72.7	-179.1	-168	0	0	112.3	Q746 R752 K753 K754	Q746-E750 PolarHBondContact O-N 2.98Å; E750-R752 VanDerWaalsContact C-N 3.31Å; E750-R752 PolarHBondContact O-N 3.36Å; E750-K753 PolarHBondContact O-N 3.01Å; E750-K754 PolarHBondContact O-N 3.19Å
751	T	69.6	Low	65.5	Low	81 Å²	81	129.7 Å²	129.7	50%	0.497	63%	0.631	S	S	.	*	H	α-helix	trans	-68.7	-27.5	175.9	48.2	0	0	0	0	112.9	E747 R748	E747-T751 WeakPolarHBondContact O-CB 3.4Å; E747-T751 WeakPolarHBondContact O-CG2 3.46Å; E747-T751 PolarHBondContact O-N 2.74Å; E747-T751 PolarHBondContact O-OG1 3.09Å; R748-T751 VanDerWaalsContact CA-OG1 3.31Å; R748-T751 WeakPolarHBondContact CA-OG1 3.49Å; R748-T751 PolarHBondContact O-OG1 3.47Å
752	R	70.3	Confident	63.1	Low	198 Å²	198	129.8 Å²	129.8	75%	0.747	64%	0.642	S	S	*	*	H	α-helix	trans	-72.6	-29.6	169.2	-79.2	168.7	170.7	-170.7	-5.5	113.8	R748 E749 E750	R748-R752 WeakPolarHBondContact O-CD 3.5Å; R748-R752 WeakPolarHBondContact O-CG 3.24Å; R748-R752 PolarHBondContact O-N 3Å; E749-R752 PolarHBondContact O-N 3.36Å; E749-R752 IonicContact OE2-NH1 2.88Å; E750-R752 VanDerWaalsContact C-N 3.31Å; E750-R752 PolarHBondContact O-N 3.36Å
753	K	70.4	Confident	60.5	Low	146 Å²	146	129 Å²	129	64%	0.635	66%	0.657	S	S	*	*	H	α-helix	trans	-82.3	-10.5	-178.2	-81	164.8	168	142.4	0	114.4	E749 E750	E749-K753 HydrophobicContact CG-CD 4.37Å; E749-K753 WeakPolarHBondContact O-CG 3.47Å; E749-K753 PolarHBondContact O-N 3.4Å; E749-K753 VanDerWaalsContact O-N 3.09Å; E749-K753 VanDerWaalsContact OE1-CE 3.24Å; E749-K753 WeakPolarHBondContact OE1-CE 3.39Å; E749-K753 IonicContact OE1-NZ 2.71Å; E749-K753 PolarHBondContact OE1-NZ 3.48Å; E750-K753 PolarHBondContact O-N 3.01Å
754	K	50.9	Low	58	Low	143 Å²	143	132.9 Å²	132.9	62%	0.622	68%	0.677	S	S	*	*	S	Bend	trans	-76.7	124.2	170.5	-67.8	173.8	-172.8	176.8	0	108.9	E750 K756	E750-K754 PolarHBondContact O-N 3.19Å; K754-K756 PolarHBondContact O-N 2.97Å
755	P	45	Very low	56.1	Low	121 Å²	121	135.8 Å²	135.8	79%	0.786	70%	0.7	S	S	*	*	P	Polyproline II helix	trans	-62.5	134.8	178.7	26.2	-33.6	0	0	0	109.8	M757	P755-M757 PolarHBondContact O-N 2.96Å
756	K	46	Very low	53.9	Low	197 Å²	197	136.9 Å²	136.9	86%	0.857	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-61.5	130.1	167.8	-66.8	-178.4	179.4	-179.5	0	107.9	K754 T758	K754-K756 PolarHBondContact O-N 2.97Å; K756-T758 PolarHBondContact O-N 3.04Å
757	M	37.8	Very low	51.4	Low	180 Å²	180	136.2 Å²	136.2	89%	0.887	73%	0.726	S	S	*	*			trans	-62.6	106.7	166	-80.5	169.8	55.6	0	0	108.5	P755 I759	P755-M757 PolarHBondContact O-N 2.96Å; M757-I759 PolarHBondContact O-N 3.34Å
758	T	36.2	Very low	49.6	Very low	125 Å²	125	140 Å²	140	77%	0.767	74%	0.743	S	S	*	*			trans	-63.9	115.2	164.1	-49.5	0	0	0	0	107.2	K756 V760	K756-T758 PolarHBondContact O-N 3.04Å; T758-V760 PolarHBondContact O-N 3.31Å
759	I	39.3	Very low	47.8	Very low	153 Å²	153	137.2 Å²	137.2	79%	0.785	75%	0.748	S	S	*	*			trans	-67.5	114.8	167.4	-63.2	175.1	0	0	0	105.8	M757 E761	M757-I759 PolarHBondContact O-N 3.34Å; I759-E761 PolarHBondContact O-N 2.87Å
760	V	36.2	Very low	45.4	Very low	130 Å²	130	141.1 Å²	141.1	79%	0.788	77%	0.771	S	S	*	*			trans	-73.2	107.1	169	175.4	0	0	0	0	106.6	T758 S762	T758-V760 PolarHBondContact O-N 3.31Å; V760-S762 PolarHBondContact O-N 3.4Å
761	E	37.3	Very low	43.4	Very low	178 Å²	178	140.3 Å²	140.3	83%	0.832	78%	0.778	S	S	*	*			trans	-68.1	112.7	175.5	-171.2	162.1	-151.7	0	0	109	I759 A763	I759-E761 PolarHBondContact O-N 2.87Å; E761-A763 PolarHBondContact O-N 3.03Å
762	S	36.7	Very low	42.2	Very low	109 Å²	109	143.2 Å²	143.2	76%	0.762	80%	0.796	S	S	*	*			trans	-77.8	87.5	-175.1	55.1	0	0	0	0	110.5	V760 Q764	V760-S762 PolarHBondContact O-N 3.4Å; S762-Q764 PolarHBondContact O-N 3.15Å
763	A	35.1	Very low	40.9	Very low	96 Å²	96	139.1 Å²	139.1	79%	0.793	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-60.7	116.4	177.5	0	0	0	0	0	111.7	E761	E761-A763 PolarHBondContact O-N 3.03Å
764	Q	33.3	Very low	39.3	Very low	188 Å²	188	139.4 Å²	139.4	88%	0.879	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-82.5	140	156.1	-74.2	-170	-62	0	0	109.1	S762	S762-Q764 PolarHBondContact O-N 3.15Å
765	P	40.3	Very low	38.6	Very low	131 Å²	131	143 Å²	143	85%	0.851	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-83.1	144.1	177.1	33.2	-33.7	0	0	0	111.7
766	G	39.1	Very low	38.3	Very low	81 Å²	81	144.1 Å²	144.1	84%	0.835	84%	0.837	S	S	*	*			trans	117.1	67.7	156.1	0	0	0	0	0	118
767	S	32.6	Very low	37.9	Very low	113 Å²	113	141.3 Å²	141.3	79%	0.79	84%	0.836	S	S	*	*			trans	-163.9	102.6	145.3	59.3	0	0	0	0	111.5
768	E	41.1	Very low	37.9	Very low	188 Å²	188	139.2 Å²	139.2	88%	0.879	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-81.5	134.4	161.2	-66.4	-174.2	154.1	0	0	109.8
769	P	42.8	Very low	38	Very low	120 Å²	120	140 Å²	140	78%	0.779	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-101.9	135.3	151.2	33.4	-27.1	0	0	0	110.1
770	L	33.4	Very low	37.9	Very low	160 Å²	160	139.2 Å²	139.2	84%	0.838	84%	0.84	S	S	*	*	P	Polyproline II helix	trans	-68.2	153.3	-176.8	-78	86.7	0	0	0	113.2	T772	L770-T772 PolarHBondContact O-N 2.71Å
771	C	37.3	Very low	38	Very low	109 Å²	109	139.8 Å²	139.8	74%	0.736	84%	0.844	S	S	*	*	P	Polyproline II helix	trans	-51.1	130.7	163.8	178.8	0	0	0	0	112.2
772	T	45	Very low	38	Very low	142 Å²	142	137.1 Å²	137.1	87%	0.871	85%	0.845	S	S	*	*			trans	-133.5	155.4	147.9	33.8	0	0	0	0	108.8	L770	L770-T772 PolarHBondContact O-N 2.71Å
773	V	42.7	Very low	38.1	Very low	112 Å²	112	139.2 Å²	139.2	68%	0.679	85%	0.851	S	S	*	*			trans	-118	142.7	-168	-179	0	0	0	0	108.2
774	D	36.7	Very low	38.4	Very low	152 Å²	152	142.8 Å²	142.8	81%	0.813	86%	0.856	S	S	*	*				178.1	147.7	128.5	-94.2	-29	0	0	0	114.3
775	V	36.6	Very low	38.9	Very low	218 Å²	218	138.7 Å²	138.7	100%	1.321	85%	0.854	S	S	*	*			trans	62.3	0	175.5	-160.2	0	0	0	0	117.2

Retrieved 775 of 775 residues in 178.8 ms (Link to these results)

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