X2JGQ0_DROME Loading...

PH-sensitive chloride channel 1, isoform U

AlphaFold DB , UniProt , Accession X2JGQ0, Species DROME (Drosophila melanogaster, Fruit fly), Gene pHCl-1, Length 755 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	35.2	Very low	28	Very low	254 Å²	254	157.5 Å²	157.5	100%	1.251	87%	0.873	S	S	*	*				0	152.2	0	-63.4	171.2	-177.4	0	0	107.5
2	G	29.3	Very low	28	Very low	72 Å²	72	154.9 Å²	154.9	74%	0.742	87%	0.868	S	S	*	*			trans	-165.8	169.1	176.3	0	0	0	0	0	112.3
3	C	26.4	Very low	28.3	Very low	121 Å²	121	157.4 Å²	157.4	82%	0.818	87%	0.868	S	S	*	*			trans	-160.7	123.8	159	-94.4	0	0	0	0	105.7
4	V	27.9	Very low	28.1	Very low	118 Å²	118	160.6 Å²	160.6	72%	0.715	87%	0.869	S	S	*	*				69.4	112.2	77.7	172.5	0	0	0	0	111.8
5	F	23.6	Very low	28.7	Very low	214 Å²	214	157.8 Å²	157.8	94%	0.939	86%	0.862	S	S	*	*				-143	133.2	121.1	-115.7	-76.2	0	0	0	110.1
6	E	28	Very low	28.5	Very low	173 Å²	173	162.7 Å²	162.7	81%	0.808	86%	0.864	S	S	*	*			trans	-110	143.5	-178.1	-172.2	173.1	-168.3	0	0	108.7
7	A	28.8	Very low	28.4	Very low	99 Å²	99	159.2 Å²	159.2	82%	0.818	86%	0.856	S	S	*	*			trans	-70.4	136.6	-177.1	0	0	0	0	0	111.2
8	A	26.7	Very low	28.4	Very low	108 Å²	108	162.9 Å²	162.9	89%	0.893	86%	0.855	S	S	*	*			trans	-65.9	146.2	-173	0	0	0	0	0	113.3
9	K	25.7	Very low	28.4	Very low	206 Å²	206	162.5 Å²	162.5	90%	0.896	85%	0.849	S	S	*	*			trans	-128.9	129.8	161.8	-166.1	169.7	-172.9	172	0	108.9
10	E	27.8	Very low	28.3	Very low	188 Å²	188	162.4 Å²	162.4	88%	0.879	85%	0.848	S	S	*	*	P	Polyproline II helix	trans	-68.9	160.3	-171.5	-68	-176.5	108.4	0	0	114
11	Q	28.4	Very low	28.2	Very low	180 Å²	180	165.8 Å²	165.8	84%	0.841	85%	0.85	S	S	*	*	P	Polyproline II helix	trans	-80.5	139.7	-173	-56.9	-179.8	11.5	0	0	112.7
12	P	28	Very low	27.9	Very low	126 Å²	126	164 Å²	164	82%	0.818	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-80	131.2	160.1	31.9	-31.1	0	0	0	110.9
13	H	31.8	Very low	27.9	Very low	187 Å²	187	167.6 Å²	167.6	87%	0.866	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-64.2	147.6	-175.9	-87.6	-97.3	0	0	0	114.9
14	K	26.1	Very low	28.2	Very low	203 Å²	203	169.3 Å²	169.3	88%	0.883	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-78.2	155.9	157.9	-96.8	-169.9	172	174.8	0	111.4
15	P	36.1	Very low	28.3	Very low	118 Å²	118	168.8 Å²	168.8	77%	0.766	83%	0.828	S	S	*	*			trans	-125.2	176.5	-137	42.6	-31.9	0	0	0	115
16	R	26.4	Very low	28.5	Very low	236 Å²	236	170.4 Å²	170.4	89%	0.891	83%	0.828	S	S	*	*			trans	-142.7	120.7	156.3	-148	172.6	-171.6	-179.9	1.8	115
17	S	27.1	Very low	28.5	Very low	104 Å²	104	165.3 Å²	165.3	73%	0.727	82%	0.822	S	S	*	*			trans	86.4	126.3	155.7	80	0	0	0	0	121
18	R	28.2	Very low	28.5	Very low	225 Å²	225	170.8 Å²	170.8	85%	0.849	83%	0.827	S	S	*	*			trans	65.5	132.8	152.4	-66.1	-176	177.9	166.9	-0.8	118.8
19	Q	28.3	Very low	28.6	Very low	156 Å²	156	170.6 Å²	170.6	73%	0.729	83%	0.825	S	S	*	*			cis	-161.1	174.5	-11.2	-154.8	156.6	-39.6	0	0	111.2
20	L	26.4	Very low	28.8	Very low	159 Å²	159	168 Å²	168	83%	0.832	82%	0.816	S	S	*	*			trans	87.5	143.1	166.6	-69.7	145.1	0	0	0	119.6
21	R	26.4	Very low	28.9	Very low	234 Å²	234	167.7 Å²	167.7	88%	0.883	81%	0.812	S	S	*	*			trans	-65.5	142.3	-164.3	-60.9	158	171.8	176.7	-5	112.3
22	R	27.8	Very low	28.9	Very low	217 Å²	217	164.3 Å²	164.3	82%	0.819	82%	0.815	S	S	*	*			cis	86.9	103.1	31.6	-166.5	-169	-162.9	-175.5	7.3	115.5
23	N	29.8	Very low	29.1	Very low	148 Å²	148	163.3 Å²	163.3	79%	0.791	82%	0.818	S	S	*	*			trans	-155.3	117.8	141.6	-84.8	-24	0	0	0	105.3
24	Q	32.6	Very low	29	Very low	156 Å²	156	159.7 Å²	159.7	73%	0.729	82%	0.82	S	S	*	*				68.1	137.6	79.2	-78.3	-163.5	-8.4	0	0	115
25	C	29.4	Very low	29.1	Very low	108 Å²	108	153.3 Å²	153.3	73%	0.73	81%	0.812	S	S	*	*			cis	-174.9	154.9	-21.1	-129.6	0	0	0	0	112.4
26	R	28.1	Very low	29.2	Very low	247 Å²	247	153.5 Å²	153.5	93%	0.932	81%	0.811	S	S	*	*			trans	60.1	165.2	162.3	-70.2	178.4	165.9	178.1	-6.3	118.6
27	G	27.7	Very low	29.6	Very low	66 Å²	66	154.1 Å²	154.1	68%	0.68	81%	0.813	S	S	*	*			cis	138.3	120.4	-23.8	0	0	0	0	0	118.9
28	K	29.9	Very low	29.7	Very low	214 Å²	214	152.1 Å²	152.1	93%	0.93	81%	0.81	S	S	*	*			trans	64.6	140.1	156.6	-75.9	-167.1	171.9	-168.2	0	121.9
29	A	29.3	Very low	29.9	Very low	104 Å²	104	151.6 Å²	151.6	86%	0.86	81%	0.813	S	S	*	*				141.1	166.3	120.2	0	0	0	0	0	116.3
30	E	28.6	Very low	30	Very low	152 Å²	152	151.1 Å²	151.1	71%	0.71	82%	0.821	S	S	*	*			trans	-101.8	171	-160.7	-60.5	167	66.2	0	0	116.8
31	K	29.8	Very low	30	Very low	182 Å²	182	147.1 Å²	147.1	79%	0.791	81%	0.81	S	S	*	*			trans	63.7	118.2	143.4	-79.8	160.3	178.3	148.4	0	121.1
32	A	28.5	Very low	30.2	Very low	108 Å²	108	142.1 Å²	142.1	89%	0.893	81%	0.806	S	S	*	*				-175.9	172.4	122.1	0	0	0	0	0	110.4
33	A	32.6	Very low	30.2	Very low	106 Å²	106	143.4 Å²	143.4	88%	0.876	81%	0.811	S	S	*	*			trans	-142.8	149.7	-174.5	0	0	0	0	0	114.5
34	A	29.5	Very low	30.1	Very low	110 Å²	110	139.7 Å²	139.7	91%	0.909	81%	0.807	S	S	*	*			trans	-174.9	168.7	160.2	0	0	0	0	0	111
35	G	28.8	Very low	30.1	Very low	70 Å²	70	139.6 Å²	139.6	72%	0.722	81%	0.812	S	S	*	*			trans	137.9	-7.3	135.6	0	0	0	0	0	124.4
36	T	37.4	Very low	30.2	Very low	122 Å²	122	141.5 Å²	141.5	75%	0.748	82%	0.815	S	S	*	*			trans	38.1	123.6	153	-52.7	0	0	0	0	123.2
37	R	35.6	Very low	30.5	Very low	248 Å²	248	135.9 Å²	135.9	94%	0.936	80%	0.803	S	S	*	*			trans	78.4	147.1	154.5	-77.7	170.5	-179.1	173.9	-0.2	120.6
38	G	29.5	Very low	30.6	Very low	63 Å²	63	141.8 Å²	141.8	65%	0.649	81%	0.81	S	S	*	*			cis	163.8	-173.5	-8.1	0	0	0	0	0	117.1
39	K	31.5	Very low	31.7	Very low	213 Å²	213	137.1 Å²	137.1	93%	0.926	80%	0.802	S	S	*	*			trans	74.4	145	-171.7	-59.7	-179.3	177.1	-178.7	0	114.1
40	V	30.8	Very low	31.7	Very low	146 Å²	146	136.2 Å²	136.2	89%	0.885	79%	0.794	S	S	*	*			cis	-170.3	159.5	-24.3	85.9	0	0	0	0	105.6
41	A	26.8	Very low	31.8	Very low	75 Å²	75	137.7 Å²	137.7	62%	0.62	80%	0.801	S	S	*	*			cis	-145.1	-180	3.6	0	0	0	0	0	107.7
42	V	29.5	Very low	31.8	Very low	129 Å²	129	135.9 Å²	135.9	78%	0.782	80%	0.8	S	S	*	*			cis	77.7	125	17.5	175.3	0	0	0	0	113
43	R	29	Very low	32	Very low	245 Å²	245	136.9 Å²	136.9	93%	0.925	79%	0.789	S	S	*	*			cis	-162.2	170.9	19.1	-149.2	174.6	-166.4	161	1.7	112.2
44	G	28.1	Very low	31.7	Very low	70 Å²	70	140 Å²	140	72%	0.722	78%	0.783	S	S	*	*			trans	129.5	120	130.5	0	0	0	0	0	119.7
45	N	31.7	Very low	31.7	Very low	154 Å²	154	141.2 Å²	141.2	82%	0.824	77%	0.773	S	S	*	*			trans	-92.6	160.7	158.6	-65.3	-3.6	0	0	0	109.9
46	N	32.4	Very low	31.7	Very low	147 Å²	147	146.7 Å²	146.7	79%	0.786	78%	0.776	S	S	*	*				176.9	168.2	111.8	-92	9	0	0	0	114.6
47	D	32.8	Very low	31.6	Very low	129 Å²	129	146.8 Å²	146.8	69%	0.69	77%	0.773	S	S	*	*			trans	-31.1	146.8	-178.7	-58.5	-85.3	0	0	0	122.8
48	K	30.9	Very low	31.4	Very low	190 Å²	190	142.1 Å²	142.1	83%	0.826	77%	0.766	S	S	*	*			trans	26.1	158.9	130.1	-74.6	178.3	177.8	177.8	0	122
49	P	53.1	Low	31.4	Very low	117 Å²	117	148.1 Å²	148.1	76%	0.76	77%	0.77	S	S	*	*			cis	-138.5	-164.6	-13	36.4	-14.5	0	0	0	114.7
50	A	28.8	Very low	31.4	Very low	84 Å²	84	144.2 Å²	144.2	69%	0.694	76%	0.755	S	S	*	*			trans	94.4	140.2	144.6	0	0	0	0	0	122.5
51	E	31.1	Very low	31.5	Very low	184 Å²	184	143.9 Å²	143.9	86%	0.86	74%	0.744	S	S	*	*			trans	62.6	103.2	142.8	-73.1	168.7	-160.2	0	0	124.5
52	D	29.9	Very low	31.7	Very low	143 Å²	143	146.2 Å²	146.2	77%	0.765	75%	0.746	S	S	*	*				80.9	165.4	109.4	-152.7	19.1	0	0	0	122.1
53	I	31.2	Very low	32	Very low	129 Å²	129	147 Å²	147	66%	0.662	74%	0.741	S	S	*	*			trans	77.6	88.5	162.5	-53.8	-176.3	0	0	0	118.5
54	K	27.3	Very low	32.2	Very low	172 Å²	172	143.8 Å²	143.8	75%	0.748	73%	0.734	S	S	*	*				45.9	134.4	112.5	-76.9	174	170.5	173.5	0	122
55	I	30.1	Very low	32.3	Very low	136 Å²	136	146.9 Å²	146.9	70%	0.697	74%	0.739	S	S	*	*			trans	71	128.7	132.7	-62.6	170.6	0	0	0	115.2
56	K	28.5	Very low	32.3	Very low	184 Å²	184	148.4 Å²	148.4	80%	0.8	74%	0.741	S	S	*	*				-162.9	171	58.9	-150.8	150.6	-167.7	177.7	0	115.4
57	D	35.2	Very low	32.1	Very low	125 Å²	125	147.2 Å²	147.2	67%	0.668	74%	0.739	S	S	*	*			trans	-67.3	153.4	174.8	-31.9	-98.7	0	0	0	114.2
58	N	30.6	Very low	32.2	Very low	149 Å²	149	149.4 Å²	149.4	80%	0.797	75%	0.746	S	S	*	*			trans	-176.7	148.4	151.3	-99.2	-16	0	0	0	110.8
59	Y	29.3	Very low	32.1	Very low	190 Å²	190	145.5 Å²	145.5	75%	0.745	74%	0.738	S	S	*	*			cis	-158.5	-166.1	-27	-146.8	-118.9	0	0	0	109.4
60	Q	32.5	Very low	30.9	Very low	130 Å²	130	147.2 Å²	147.2	61%	0.607	74%	0.736	S	S	*	*			trans	-81.2	172.5	-163.5	-49.1	172.2	-78.2	0	0	117.4
61	Q	33.6	Very low	31	Very low	139 Å²	139	148.9 Å²	148.9	65%	0.65	74%	0.737	S	S	*	*			trans	94.7	113.1	135.4	-87.6	158.6	-27.6	0	0	123
62	N	30.6	Very low	31.1	Very low	124 Å²	124	148.3 Å²	148.3	66%	0.663	74%	0.735	S	S	*	*				45.9	143	113.1	-52.1	-1.2	0	0	0	120
63	H	35.8	Very low	31.2	Very low	147 Å²	147	147.7 Å²	147.7	68%	0.681	74%	0.735	S	S	*	*				-175.3	157	60.9	-113.2	-58.1	0	0	0	115.8
64	K	33.2	Very low	31.1	Very low	176 Å²	176	146.3 Å²	146.3	77%	0.765	74%	0.744	S	S	*	*			trans	71	159.4	149.7	-69.7	173.3	179.9	-179.6	0	117.4
65	T	28.8	Very low	31.2	Very low	136 Å²	136	143 Å²	143	83%	0.834	75%	0.748	S	S	*	*			cis	-145.7	172.4	18.4	-31.3	0	0	0	0	112.7
66	Q	32.6	Very low	31	Very low	185 Å²	185	143.4 Å²	143.4	86%	0.864	76%	0.756	S	S	*	*			trans	-122.6	154.4	175.4	-65.5	173.8	-70	0	0	113
67	T	29.1	Very low	31	Very low	122 Å²	122	141 Å²	141	75%	0.748	76%	0.757	S	S	*	*			trans	-169.4	124.8	145.8	23.8	0	0	0	0	108
68	E	33	Very low	30.7	Very low	176 Å²	176	139.5 Å²	139.5	82%	0.822	76%	0.762	S	S	*	*				69.3	131.6	84.7	-69	-175.6	139.3	0	0	114.7
69	T	29.3	Very low	30.7	Very low	108 Å²	108	140 Å²	140	66%	0.663	76%	0.763	S	S	*	*			cis	-157.9	-177.1	-8.6	37.3	0	0	0	0	107.7
70	Q	28.1	Very low	30.7	Very low	153 Å²	153	135 Å²	135	72%	0.715	76%	0.761	S	S	*	*			cis	-123.8	-163.3	2.6	-90.7	94.8	-30.2	0	0	109.5
71	T	32	Very low	30.6	Very low	118 Å²	118	135 Å²	135	72%	0.724	77%	0.77	S	S	*	*			cis	72.6	145	21	12.1	0	0	0	0	116.4
72	E	33.4	Very low	30.2	Very low	173 Å²	173	135.9 Å²	135.9	81%	0.808	78%	0.779	S	S	*	*			cis	-133	139.5	4.6	-95.2	-173.4	137.7	0	0	111.2
73	V	32	Very low	30.1	Very low	129 Å²	129	134.2 Å²	134.2	78%	0.782	78%	0.783	S	S	*	*				80.7	116.7	77.7	177.2	0	0	0	0	116.8
74	A	27.8	Very low	29.6	Very low	101 Å²	101	130.8 Å²	130.8	84%	0.835	79%	0.787	S	S	*	*			trans	-161.1	144.9	145	0	0	0	0	0	110
75	A	30.1	Very low	29.3	Very low	101 Å²	101	126.7 Å²	126.7	84%	0.835	79%	0.786	S	S	*	*			trans	-152.6	163.5	180	0	0	0	0	0	111.5
76	V	25.7	Very low	29.2	Very low	145 Å²	145	128.6 Å²	128.6	88%	0.879	79%	0.785	S	S	*	*			trans	-168.1	154.9	154.4	130	0	0	0	0	110.8
77	V	28.3	Very low	28.9	Very low	135 Å²	135	125.6 Å²	125.6	82%	0.818	78%	0.779	S	S	*	*			trans	-139.3	135.8	-179.6	170.7	0	0	0	0	109.8
78	A	30.1	Very low	28.8	Very low	93 Å²	93	127.8 Å²	127.8	77%	0.769	78%	0.781	S	S	*	*			trans	-167.1	99.7	159.3	0	0	0	0	0	115
79	I	29.8	Very low	28.4	Very low	160 Å²	160	125 Å²	125	82%	0.821	78%	0.776	S	S	*	*				21.7	143.9	127.2	-45.1	175.3	0	0	0	120.8
80	A	30.1	Very low	28.3	Very low	85 Å²	85	127.8 Å²	127.8	70%	0.702	78%	0.782	S	S	*	*			trans	104.1	145.2	151.7	0	0	0	0	0	119
81	T	28.9	Very low	28.2	Very low	129 Å²	129	125.6 Å²	125.6	79%	0.791	78%	0.779	S	S	*	*			cis	-171.9	147.5	-30.7	35.3	0	0	0	0	110.3
82	D	26.7	Very low	28	Very low	158 Å²	158	128 Å²	128	85%	0.845	78%	0.782	S	S	*	*			trans	86.9	148.9	144.4	-135	0	0	0	0	124.9
83	A	28.4	Very low	27.8	Very low	89 Å²	89	123.6 Å²	123.6	74%	0.736	78%	0.776	S	S	*	*			trans	55.6	145.9	149.8	0	0	0	0	0	125.4
84	G	25.4	Very low	27.5	Very low	74 Å²	74	126.4 Å²	126.4	76%	0.763	78%	0.78	S	S	*	*			trans	94.7	106.4	161.9	0	0	0	0	0	115.1
85	A	26.7	Very low	27.6	Very low	90 Å²	90	125.1 Å²	125.1	74%	0.744	77%	0.769	S	S	*	*			cis	93.6	141.4	26.9	0	0	0	0	0	115.2
86	E	26.6	Very low	27.4	Very low	177 Å²	177	129 Å²	129	83%	0.827	77%	0.77	S	S	*	*			trans	65.5	113.6	169.4	-69.7	162.2	-159.3	0	0	115.9
87	T	24.9	Very low	27.5	Very low	121 Å²	121	132 Å²	132	74%	0.742	77%	0.771	S	S	*	*				85.4	165.9	59.8	58.8	0	0	0	0	114.3
88	E	27.4	Very low	27.5	Very low	169 Å²	169	133.6 Å²	133.6	79%	0.79	77%	0.77	S	S	*	*			trans	73.1	108	177.5	-72.9	178.9	-163.5	0	0	114.1
89	T	24.6	Very low	28	Very low	116 Å²	116	134.6 Å²	134.6	71%	0.712	77%	0.769	S	S	*	*				72.1	148.9	84.9	58.2	0	0	0	0	113
90	E	26.8	Very low	28	Very low	168 Å²	168	130.5 Å²	130.5	79%	0.785	76%	0.759	S	S	*	*			cis	-145.5	-164.6	12.5	-143.3	160.1	-155.1	0	0	112.5
91	T	26	Very low	27.8	Very low	107 Å²	107	133.6 Å²	133.6	66%	0.656	77%	0.769	S	S	*	*			trans	-59.2	175.1	166	48.9	0	0	0	0	111.9
92	E	28.8	Very low	27.8	Very low	167 Å²	167	130.6 Å²	130.6	78%	0.78	76%	0.764	S	S	*	*			cis	-166	171.2	23.2	-148	153.7	-137.9	0	0	111.6
93	A	28.6	Very low	28.5	Very low	82 Å²	82	129.7 Å²	129.7	68%	0.678	77%	0.767	S	S	*	*			trans	57.7	152.1	143	0	0	0	0	0	121.9
94	E	26.8	Very low	28.6	Very low	187 Å²	187	133.2 Å²	133.2	87%	0.874	77%	0.768	S	S	*	*			cis	-164	-177.2	-19.7	-115.7	-160.9	132.5	0	0	110
95	A	28.9	Very low	28.9	Very low	74 Å²	74	137.2 Å²	137.2	61%	0.612	77%	0.767	S	S	*	*			trans	69.3	90.4	149.2	0	0	0	0	0	120.9
96	Q	26.9	Very low	29.1	Very low	183 Å²	183	140.6 Å²	140.6	86%	0.855	77%	0.771	S	S	*	*				52.6	119.1	114.9	-62.8	166.6	-6.4	0	0	120.5
97	K	26.8	Very low	29.3	Very low	207 Å²	207	141.1 Å²	141.1	90%	0.9	77%	0.771	S	S	*	*				-168	123.8	112.2	-108.6	167	-176.1	169.3	0	115
98	E	28.4	Very low	29.6	Very low	169 Å²	169	139.9 Å²	139.9	79%	0.79	77%	0.773	S	S	*	*			trans	-78.9	165.2	144.5	-115	-159.9	131	0	0	108.9
99	P	40.3	Very low	29.6	Very low	114 Å²	114	137 Å²	137	74%	0.74	78%	0.778	S	S	*	*			cis	-146.8	160.7	46.6	41.1	-21.3	0	0	0	119.3
100	A	30.1	Very low	29.8	Very low	74 Å²	74	136 Å²	136	61%	0.612	78%	0.781	S	S	*	*			trans	43.3	120.9	140	0	0	0	0	0	121.7
101	T	26	Very low	30.1	Very low	151 Å²	151	136.4 Å²	136.4	93%	0.926	78%	0.783	S	S	*	*				-166.3	144.5	118.2	11.1	0	0	0	0	111.6
102	G	28.1	Very low	30.2	Very low	66 Å²	66	137 Å²	137	68%	0.68	79%	0.786	S	S	*	*			trans	-119.9	166.9	166.6	0	0	0	0	0	110.8
103	P	41.7	Very low	30.1	Very low	139 Å²	139	135.8 Å²	135.8	90%	0.903	79%	0.785	S	S	*	*				-141.1	-179.2	119.4	36.8	-22.7	0	0	0	114.5
104	E	31.1	Very low	30.1	Very low	163 Å²	163	138.9 Å²	138.9	76%	0.762	79%	0.789	S	S	*	*			trans	-97.3	-176	-165.3	-55.7	-169.8	134.9	0	0	116.8
105	H	32.3	Very low	30.1	Very low	158 Å²	158	136.1 Å²	136.1	73%	0.731	79%	0.785	S	S	*	*			trans	103.4	142.5	156.9	-53.4	-25.4	0	0	0	115.3
106	L	31.3	Very low	30.3	Very low	160 Å²	160	139.9 Å²	139.9	84%	0.838	79%	0.793	S	S	*	*			cis	-132.1	162.7	16.9	-93.8	96.3	0	0	0	116.4
107	K	28.7	Very low	30.4	Very low	188 Å²	188	143 Å²	143	82%	0.817	80%	0.797	S	S	*	*			trans	-39.3	173.5	154.2	-58.9	158	-176.3	170	0	115.8
108	A	31.6	Very low	30.5	Very low	96 Å²	96	142 Å²	142	79%	0.793	80%	0.795	S	S	*	*			cis	171.5	140.5	-31	0	0	0	0	0	108.6
109	A	27.9	Very low	30.4	Very low	109 Å²	109	138.4 Å²	138.4	90%	0.901	80%	0.795	S	S	*	*			trans	-168.6	168.8	164.9	0	0	0	0	0	111.4
110	A	29.6	Very low	29.9	Very low	93 Å²	93	144.8 Å²	144.8	77%	0.769	81%	0.805	S	S	*	*			trans	-150.2	176.9	-177.4	0	0	0	0	0	113.7
111	Q	31.7	Very low	29.7	Very low	177 Å²	177	150.7 Å²	150.7	83%	0.827	82%	0.819	S	S	*	*			trans	94.9	146.5	153.5	-145.3	74.9	1.4	0	0	119.4
112	V	27.8	Very low	29.7	Very low	120 Å²	120	152.1 Å²	152.1	73%	0.727	82%	0.816	S	S	*	*			trans	111.4	115	149.9	-178.2	0	0	0	0	118.9
113	L	27.2	Very low	29.7	Very low	142 Å²	142	156 Å²	156	74%	0.743	82%	0.821	S	S	*	*			trans	47.1	134.7	159.5	-82.6	86.9	0	0	0	120.1
114	L	28.1	Very low	28.9	Very low	146 Å²	146	156.1 Å²	156.1	76%	0.764	81%	0.814	S	S	*	*				73.2	150	58.4	-85.9	167.2	0	0	0	115.5
115	T	28.2	Very low	28.7	Very low	130 Å²	130	157.5 Å²	157.5	80%	0.798	82%	0.817	S	S	*	*			trans	69.9	142.3	-159.7	77.1	0	0	0	0	112.5
116	I	32.9	Very low	28.5	Very low	152 Å²	152	158.5 Å²	158.5	78%	0.779	82%	0.822	S	S	*	*			cis	-115.7	125.2	3.5	-65	169.7	0	0	0	110.1	Q118	I116-Q118 HydrophobicContact CG2-CB 4.41Å
117	R	29.4	Very low	28.1	Very low	250 Å²	250	157 Å²	157	94%	0.943	82%	0.824	S	S	*	*			trans	-127.6	60.9	167	-160.5	-176.1	-162	-179.9	6.8	109.1
118	Q	29.1	Very low	27.9	Very low	184 Å²	184	153 Å²	153	86%	0.86	82%	0.82	S	S	*	*			trans	-151.7	63.3	-169.5	-140.5	168	12.6	0	0	113.6	I116	I116-Q118 HydrophobicContact CG2-CB 4.41Å
119	A	26.4	Very low	27.5	Very low	95 Å²	95	154 Å²	154	79%	0.785	82%	0.822	S	S	*	*	S	Bend	trans	-147.6	140.1	160.2	0	0	0	0	0	109.5
120	R	28	Very low	27.4	Very low	248 Å²	248	157.2 Å²	157.2	94%	0.936	82%	0.818	S	S	*	*			trans	55.7	71.7	175.8	-70.5	-176.4	167.5	157.6	-2.3	116.7
121	Q	26.8	Very low	27.1	Very low	198 Å²	198	159.9 Å²	159.9	93%	0.925	82%	0.824	S	S	*	*			trans	-131.2	77.6	132.2	-127.3	-170.1	6.2	0	0	110.3
122	E	26.6	Very low	26.8	Very low	181 Å²	181	155.2 Å²	155.2	85%	0.846	82%	0.816	S	S	*	*			trans	-134.4	90.9	166.7	-77	-164.9	134.3	0	0	109.6
123	N	26.3	Very low	26.8	Very low	147 Å²	147	158 Å²	158	79%	0.786	82%	0.821	S	S	*	*	S	Bend		-171.2	132.3	126.6	-103	-58.3	0	0	0	112.6
124	N	26.3	Very low	26.7	Very low	142 Å²	142	157.9 Å²	157.9	76%	0.759	83%	0.827	S	S	*	*			trans	50.3	95.8	155.7	-62.4	-19	0	0	0	121.5
125	K	25.5	Very low	26.7	Very low	191 Å²	191	159.6 Å²	159.6	83%	0.83	83%	0.831	S	S	*	*				-5.4	120.2	118.5	-83.2	179.3	177.6	179	0	114.9
126	H	28.8	Very low	26.6	Very low	179 Å²	179	161.5 Å²	161.5	83%	0.829	83%	0.828	S	S	*	*				70.8	121.6	92.4	-81	34.2	0	0	0	116.2
127	S	22.3	Very low	26.3	Very low	128 Å²	128	159.1 Å²	159.1	90%	0.895	82%	0.817	S	S	*	*			trans	-134.6	145	135.4	-172.3	0	0	0	0	108.3
128	S	25.1	Very low	26.2	Very low	104 Å²	104	156.2 Å²	156.2	73%	0.727	81%	0.814	S	S	*	*			trans	-149.6	146.1	179.6	176.1	0	0	0	0	108.5
129	S	22.9	Very low	26.1	Very low	118 Å²	118	150.5 Å²	150.5	83%	0.825	80%	0.804	S	S	*	*			trans	-136.9	131.3	170.7	-167.6	0	0	0	0	109.4
130	Q	26.6	Very low	26.3	Very low	176 Å²	176	155.3 Å²	155.3	82%	0.822	81%	0.81	S	S	*	*			trans	-101.9	151	176.8	-62.4	174.8	-62.6	0	0	110.1
131	V	23.7	Very low	26.3	Very low	149 Å²	149	150.5 Å²	150.5	90%	0.903	80%	0.803	S	S	*	*			trans	-135.1	149	152.3	-176.4	0	0	0	0	106.5
132	A	24.7	Very low	26.4	Very low	80 Å²	80	144.8 Å²	144.8	66%	0.661	79%	0.79	S	S	*	*			trans	-135.4	158.1	-167.3	0	0	0	0	0	113.2
133	E	27.6	Very low	26.4	Very low	178 Å²	178	144.2 Å²	144.2	83%	0.832	79%	0.792	S	S	*	*			trans	60.3	130.8	159.6	-65.1	173.2	173.8	0	0	118.2
134	T	25.1	Very low	26.4	Very low	140 Å²	140	141.1 Å²	141.1	86%	0.859	79%	0.787	S	S	*	*				-165.9	169.5	77.6	24.2	0	0	0	0	113.1
135	H	27.9	Very low	26.4	Very low	182 Å²	182	145.3 Å²	145.3	84%	0.843	79%	0.792	S	S	*	*			trans	-85	147.9	-177.3	-73.1	-107.7	0	0	0	114.6
136	K	26.5	Very low	26.5	Very low	169 Å²	169	145 Å²	145	74%	0.735	79%	0.793	S	S	*	*				176.2	163.3	103.8	-100	-163.2	154.3	-115.2	0	115.2
137	D	27.2	Very low	26.4	Very low	103 Å²	103	140 Å²	140	55%	0.551	79%	0.79	S	S	*	*			trans	-1.9	150.3	150.3	-20.3	-21.5	0	0	0	117.6
138	E	27.6	Very low	26.6	Very low	189 Å²	189	139 Å²	139	88%	0.883	78%	0.783	S	S	*	*			cis	-171.9	172.5	-4.7	-111.3	161	-154.5	0	0	106.5
139	G	25.8	Very low	26.7	Very low	63 Å²	63	141.1 Å²	141.1	65%	0.649	79%	0.785	S	S	*	*			cis	166.9	151.4	-2.1	0	0	0	0	0	110.6
140	E	30	Very low	27	Very low	196 Å²	196	141.4 Å²	141.4	92%	0.916	78%	0.782	S	S	*	*			trans	62.3	156	170.5	-73.7	-174.8	175.4	0	0	119.4
141	D	28.1	Very low	27	Very low	147 Å²	147	140.3 Å²	140.3	79%	0.786	78%	0.782	S	S	*	*			cis	-161	177.6	-30.6	-159.7	8.3	0	0	0	111.4
142	A	29.3	Very low	27.2	Very low	79 Å²	79	139 Å²	139	65%	0.653	77%	0.774	S	S	*	*			trans	13.8	127.3	160.8	0	0	0	0	0	121.7
143	L	27	Very low	27.4	Very low	168 Å²	168	139.4 Å²	139.4	88%	0.88	78%	0.778	S	S	*	*				95.8	111.8	55.2	-157.5	107.7	0	0	0	115.4
144	A	27.2	Very low	27.4	Very low	83 Å²	83	136.1 Å²	136.1	69%	0.686	78%	0.78	S	S	*	*			trans	38.6	137.9	146	0	0	0	0	0	124.1
145	R	26.3	Very low	27.6	Very low	229 Å²	229	133.3 Å²	133.3	86%	0.864	78%	0.779	S	S	*	*			trans	-136.4	138.9	133.9	-71.8	-166	176.5	135.4	6.8	108.6
146	Q	27.4	Very low	27.6	Very low	184 Å²	184	135.6 Å²	135.6	86%	0.86	78%	0.78	S	S	*	*			cis	76.4	123.6	38.1	-167.9	-175.2	18.7	0	0	111.6
147	G	26.8	Very low	27.7	Very low	74 Å²	74	135.2 Å²	135.2	76%	0.763	79%	0.785	S	S	*	*			cis	-160.8	-138.7	-2.7	0	0	0	0	0	107.4
148	S	25.9	Very low	27.7	Very low	108 Å²	108	133.8 Å²	133.8	76%	0.755	79%	0.794	S	S	*	*			cis	-178.5	168.1	-24.1	-169.1	0	0	0	0	106.9
149	I	28	Very low	27.7	Very low	149 Å²	149	132 Å²	132	76%	0.764	79%	0.789	S	S	*	*			trans	70.1	113.1	168.3	-51.3	175.3	0	0	0	113.5
150	V	28.5	Very low	27.7	Very low	124 Å²	124	135.5 Å²	135.5	75%	0.752	79%	0.793	S	S	*	*			cis	78.1	109.4	46.5	-179.6	0	0	0	0	114.2
151	D	25.7	Very low	27.5	Very low	153 Å²	153	133.2 Å²	133.2	82%	0.818	79%	0.786	S	S	*	*				-161.2	-171.5	119.5	-135.9	-44.3	0	0	0	112.5
152	T	28	Very low	27.5	Very low	120 Å²	120	130.8 Å²	130.8	74%	0.736	79%	0.786	S	S	*	*			trans	-123.5	160.8	-141.5	-45.2	0	0	0	0	115.2
153	A	29.1	Very low	27.4	Very low	90 Å²	90	130.6 Å²	130.6	74%	0.744	79%	0.785	S	S	*	*			trans	105.6	111.8	146	0	0	0	0	0	121.2
154	A	29.1	Very low	27.4	Very low	108 Å²	108	128.5 Å²	128.5	89%	0.893	78%	0.779	S	S	*	*			trans	57	114.1	132.9	0	0	0	0	0	122.1
155	G	27.5	Very low	27.4	Very low	81 Å²	81	130.2 Å²	130.2	84%	0.835	78%	0.781	S	S	*	*			trans	-164.5	147.2	159.3	0	0	0	0	0	110
156	R	28.8	Very low	27.4	Very low	230 Å²	230	125.6 Å²	125.6	87%	0.868	77%	0.772	S	S	*	*			trans	-129.1	139.9	-170.4	-111	-173.3	-177.5	179.4	1.7	113
157	I	28	Very low	27.4	Very low	162 Å²	162	124.9 Å²	124.9	83%	0.831	77%	0.769	S	S	*	*			trans	70.5	126.9	153.3	-59.1	163.2	0	0	0	116.8
158	G	26.9	Very low	27.3	Very low	72 Å²	72	127.3 Å²	127.3	74%	0.742	77%	0.768	S	S	*	*			trans	174.6	121.1	167.9	0	0	0	0	0	109.3
159	I	28.7	Very low	27.3	Very low	151 Å²	151	126.3 Å²	126.3	77%	0.774	77%	0.767	S	S	*	*			trans	-126.1	161.4	179.8	-64.8	176.4	0	0	0	108
160	D	24.6	Very low	27.1	Very low	138 Å²	138	126.1 Å²	126.1	74%	0.738	76%	0.762	S	S	*	*			trans	101.3	120.1	-178.5	-59.5	-31.2	0	0	0	113.3
161	I	27.7	Very low	26.9	Very low	148 Å²	148	129.5 Å²	129.5	76%	0.759	76%	0.762	S	S	*	*			cis	81.1	132.4	38.2	-56.9	171.3	0	0	0	112.1
162	A	26.9	Very low	26.9	Very low	95 Å²	95	129.6 Å²	129.6	79%	0.785	76%	0.757	S	S	*	*			trans	69.3	148.4	177.2	0	0	0	0	0	116.9
163	A	27	Very low	26.9	Very low	76 Å²	76	130.9 Å²	130.9	63%	0.628	75%	0.754	S	S	*	*			cis	-165.2	154.4	-23.1	0	0	0	0	0	111.6
164	T	27.7	Very low	26.8	Very low	123 Å²	123	133.5 Å²	133.5	76%	0.755	76%	0.756	S	S	*	*			trans	62.7	154.3	144.6	46.8	0	0	0	0	122.7
165	T	26.3	Very low	26.7	Very low	119 Å²	119	132 Å²	132	73%	0.73	75%	0.751	S	S	*	*			trans	71.7	149.7	147.8	49.1	0	0	0	0	121.3
166	I	27.6	Very low	26.8	Very low	133 Å²	133	135.9 Å²	135.9	68%	0.682	75%	0.748	S	S	*	*			cis	-169	154	-38.3	-136.1	166	0	0	0	109.5
167	Q	26.4	Very low	26.8	Very low	169 Å²	169	131.1 Å²	131.1	79%	0.79	74%	0.735	S	S	*	*			trans	62.7	166.6	161.6	-76.8	178.4	7.3	0	0	118.6
168	V	25.2	Very low	26.8	Very low	125 Å²	125	133 Å²	133	76%	0.758	73%	0.732	S	S	*	*			cis	-162.2	174.2	-42	91.5	0	0	0	0	108.9
169	A	26.1	Very low	26.8	Very low	87 Å²	87	136.8 Å²	136.8	72%	0.719	73%	0.73	S	S	*	*			trans	70.4	156.3	166.9	0	0	0	0	0	117.6
170	E	24.1	Very low	26.8	Very low	144 Å²	144	138 Å²	138	67%	0.673	73%	0.733	S	S	*	*			cis	-169.8	166.8	-30.1	-164.5	-174.4	-118.6	0	0	108.2
171	R	23.1	Very low	27	Very low	195 Å²	195	139.3 Å²	139.3	74%	0.736	73%	0.734	S	S	*	*			trans	91.8	114.3	137.2	-156.7	177.5	-66.2	-165.7	1.1	121.4
172	H	25.6	Very low	27	Very low	156 Å²	156	138.8 Å²	138.8	72%	0.722	73%	0.733	S	S	*	*			trans	55	153.2	146.7	-69.9	-63.6	0	0	0	120.4
173	E	28.8	Very low	27.3	Very low	146 Å²	146	140.2 Å²	140.2	68%	0.682	73%	0.731	S	S	*	*			cis	-153.9	-178.6	-3.7	-141.3	146.4	-156.9	0	0	114
174	D	27	Very low	27.3	Very low	146 Å²	146	147.8 Å²	147.8	78%	0.781	74%	0.744	S	S	*	*			trans	78.4	139.7	151.8	-81.8	-30.7	0	0	0	123.3
175	G	26.3	Very low	27.5	Very low	77 Å²	77	151.3 Å²	151.3	79%	0.794	74%	0.743	S	S	*	*			trans	154	113.9	175.4	0	0	0	0	0	112.2
176	Q	29.7	Very low	27.6	Very low	162 Å²	162	156 Å²	156	76%	0.757	75%	0.747	S	S	*	*			trans	-115.8	150.7	-160.5	-62.1	-172.7	-7.9	0	0	117.7
177	H	29.1	Very low	27.7	Very low	130 Å²	130	160.7 Å²	160.7	60%	0.602	76%	0.757	S	S	*	*			trans	88.7	145.4	133.9	-111.8	-89.2	0	0	0	124
178	W	27.4	Very low	27.6	Very low	200 Å²	200	164.6 Å²	164.6	76%	0.758	76%	0.764	S	S	*	*			trans	70.3	142.6	159	-66.4	127.8	0	0	0	119.2
179	Q	27.8	Very low	27.8	Very low	153 Å²	153	166.4 Å²	166.4	72%	0.715	76%	0.764	S	S	*	*			cis	-154.2	167.9	-5	-161.1	155.4	55.1	0	0	111.4
180	Q	28.6	Very low	28.8	Very low	176 Å²	176	167.5 Å²	167.5	82%	0.822	76%	0.764	S	S	*	*			trans	-108.5	165.6	-178.2	-61.4	176.1	-25	0	0	113.4
181	H	28.8	Very low	28.9	Very low	166 Å²	166	167.2 Å²	167.2	77%	0.769	77%	0.767	S	S	*	*			trans	-165.6	122.2	140.8	-99.1	-46.5	0	0	0	118.7
182	N	28.4	Very low	30.3	Very low	137 Å²	137	163.8 Å²	163.8	73%	0.733	77%	0.77	S	S	*	*			trans	61.6	87.3	131.5	-63.1	-1	0	0	0	126.6
183	V	32.6	Very low	30.5	Very low	125 Å²	125	161 Å²	161	76%	0.758	77%	0.774	S	S	*	*				7.6	137.1	119.2	179.8	0	0	0	0	122.4
184	R	26.2	Very low	30.3	Very low	234 Å²	234	158.7 Å²	158.7	88%	0.883	78%	0.78	S	S	*	*			trans	-172.2	122.2	133.5	-98.4	157.2	-169.3	-160.2	3.7	111.2
185	R	31.9	Very low	30.3	Very low	198 Å²	198	160.8 Å²	160.8	75%	0.747	79%	0.785	S	S	*	*				65.3	139.4	87.2	-69.7	-171.7	177.9	-173.9	2	115.3
186	R	30.2	Very low	31	Very low	216 Å²	216	162.9 Å²	162.9	82%	0.815	78%	0.784	S	S	*	*			cis	-163.6	167.9	5.9	-125.8	178.8	-174.8	-178.3	-0.4	113.6
187	R	27.7	Very low	30.8	Very low	232 Å²	232	159.6 Å²	159.6	88%	0.875	79%	0.785	S	S	*	*			trans	-55.5	162.5	-179.4	-63.1	175.4	171.8	168.9	-5.8	119
188	R	25.4	Very low	30.6	Very low	251 Å²	251	158.7 Å²	158.7	95%	0.947	79%	0.793	S	S	*	*			trans	-155.6	166.1	135.3	-105.2	-179.9	-165.2	-173.1	4.5	113.3
189	Q	29.9	Very low	30.6	Very low	164 Å²	164	156.5 Å²	156.5	77%	0.766	79%	0.794	S	S	*	*			trans	-167.7	175.1	-169.7	-129.6	165.4	-27.3	0	0	107.6
190	P	45.9	Very low	30.7	Very low	110 Å²	110	154.8 Å²	154.8	71%	0.714	80%	0.795	S	S	*	*			cis	-140	-149.9	6.9	46.1	-24.7	0	0	0	115.7
191	D	27.1	Very low	30.7	Very low	137 Å²	137	156 Å²	156	73%	0.733	80%	0.797	S	S	*	*			trans	-80.9	-157.4	-178.2	-34.1	-95.9	0	0	0	113
192	P	52.3	Low	30.7	Very low	124 Å²	124	156.6 Å²	156.6	81%	0.805	81%	0.805	S	S	*	*			cis	-131	-162.6	9.5	43.1	-24.2	0	0	0	114.7
193	A	28.7	Very low	30.9	Very low	96 Å²	96	155 Å²	155	79%	0.793	80%	0.804	S	S	*	*				-169.6	153.9	-55.3	0	0	0	0	0	110.1
194	A	25.1	Very low	30.9	Very low	98 Å²	98	153 Å²	153	81%	0.81	80%	0.802	S	S	*	*			trans	-156.5	155.7	169.2	0	0	0	0	0	113
195	H	28.3	Very low	31.3	Very low	190 Å²	190	149.5 Å²	149.5	88%	0.88	80%	0.799	S	S	*	*			trans	-133.2	175.5	-176.4	-76.5	-44.9	0	0	0	110.2
196	P	39.4	Very low	31.6	Very low	122 Å²	122	145.7 Å²	145.7	79%	0.792	80%	0.803	S	S	*	*			cis	-138.6	-176.2	9.2	42.7	-24.2	0	0	0	117.7
197	A	25.5	Very low	32	Very low	92 Å²	92	142 Å²	142	76%	0.76	80%	0.798	S	S	*	*			trans	97.9	144.1	142.4	0	0	0	0	0	123.3
198	S	26.2	Very low	32.6	Very low	111 Å²	111	137.9 Å²	137.9	78%	0.776	79%	0.789	S	S	*	*			trans	80.6	100.7	154.8	66.9	0	0	0	0	124.9
199	I	27.8	Very low	33.2	Very low	154 Å²	154	135 Å²	135	79%	0.79	78%	0.783	S	S	*	*				28.7	119.5	128.6	-24.3	-179.4	0	0	0	120.5
200	T	28.5	Very low	33.7	Very low	118 Å²	118	135 Å²	135	72%	0.724	78%	0.783	S	S	*	*				176.2	139.7	106.9	30.8	0	0	0	0	117.2
201	K	28	Very low	33.3	Very low	201 Å²	201	132.3 Å²	132.3	87%	0.874	77%	0.77	S	S	*	*			trans	55.7	116	144.2	-65	176.1	-179.5	179.7	0	121
202	L	28.7	Very low	33.9	Very low	179 Å²	179	132.1 Å²	132.1	94%	0.937	77%	0.768	S	S	*	*			trans	-124.6	145.2	154.4	-100.3	164	0	0	0	109.3
203	S	33.3	Very low	33.2	Very low	102 Å²	102	130.2 Å²	130.2	71%	0.713	76%	0.762	S	S	*	*			trans	-136.4	120.6	167.6	54.8	0	0	0	0	106.8
204	A	32.2	Very low	33.5	Very low	85 Å²	85	128.9 Å²	128.9	70%	0.702	75%	0.751	S	S	*	*				45.8	109.9	79.1	0	0	0	0	0	110.5
205	I	34.4	Very low	34	Very low	160 Å²	160	130.2 Å²	130.2	82%	0.821	74%	0.744	S	S	*	*	S	Bend	cis	-127	112.9	33	-62.9	122.9	0	0	0	111.8
206	S	38.1	Very low	34.3	Very low	118 Å²	118	125.7 Å²	125.7	83%	0.825	74%	0.74	S	S	*	*	S	Bend	trans	-150.2	28.2	166.2	-160	0	0	0	0	111.8
207	L	40.1	Very low	34	Very low	137 Å²	137	128.9 Å²	128.9	72%	0.717	74%	0.741	S	S	*	*			trans	-133.8	12	-166.3	-107.9	165.8	0	0	0	114.3
208	H	39.1	Very low	34.4	Very low	147 Å²	147	129.9 Å²	129.9	68%	0.681	74%	0.738	S	S	*	*	S	Bend	trans	-98.6	-23.9	178.4	-91	33	0	0	0	114.6
209	F	38.8	Very low	34.6	Very low	189 Å²	189	132 Å²	132	83%	0.829	74%	0.74	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89	-14.1	-179.2	-86.1	-78.2	0	0	0	115.4
210	H	39.4	Very low	34.7	Very low	166 Å²	166	134.1 Å²	134.1	77%	0.769	75%	0.746	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.7	-10.3	174.9	-85.5	86.3	0	0	0	114.3
211	A	38	Very low	34.6	Very low	52 Å²	52	137.6 Å²	137.6	43%	0.43	75%	0.751	S	S	.	*	T	Hydrogen-bonded Turn	trans	-80.9	-36.3	178.8	0	0	0	0	0	113.1	A213 A214	A211-A213 VanDerWaalsContact C-N 3.3Å; A211-A213 PolarHBondContact O-N 3.26Å; A211-A214 PolarHBondContact O-N 3.34Å
212	L	41	Very low	34.5	Very low	134 Å²	134	136.1 Å²	136.1	70%	0.702	75%	0.748	S	S	*	*	H	α-helix	trans	-67.6	-26.7	-176.3	-72.9	166.8	0	0	0	113.5	A214	L212-A214 VanDerWaalsContact C-N 3.29Å; L212-A214 PolarHBondContact O-N 2.74Å
213	A	36.4	Very low	34.4	Very low	83 Å²	83	136.3 Å²	136.3	69%	0.686	74%	0.743	S	S	*	*	H	α-helix	trans	-74.9	-13.7	176.1	0	0	0	0	0	114.1	A211	A211-A213 VanDerWaalsContact C-N 3.3Å; A211-A213 PolarHBondContact O-N 3.26Å
214	A	36.3	Very low	34	Very low	68 Å²	68	139.2 Å²	139.2	56%	0.562	75%	0.751	S	S	*	*	H	α-helix	trans	-96.4	-28	-176	0	0	0	0	0	113.8	A211 L212	A211-A214 PolarHBondContact O-N 3.34Å; L212-A214 VanDerWaalsContact C-N 3.29Å; L212-A214 PolarHBondContact O-N 2.74Å
215	L	35.3	Very low	33.8	Very low	127 Å²	127	143.6 Å²	143.6	67%	0.665	76%	0.762	S	S	*	*	H	α-helix	trans	-83	-19.2	-177.1	-94.8	162.9	0	0	0	114.3	K217	L215-K217 PolarHBondContact O-N 3.24Å
216	A	34.3	Very low	33.3	Very low	95 Å²	95	140.9 Å²	140.9	79%	0.785	76%	0.757	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.9	10.4	176.8	0	0	0	0	0	114.5
217	K	32.3	Very low	33.2	Very low	188 Å²	188	140.4 Å²	140.4	82%	0.817	75%	0.751	S	S	*	*	T	Hydrogen-bonded Turn	trans	-126.5	7.7	-171.4	-124.6	173.7	-174.8	174.5	0	115.7	L215	L215-K217 PolarHBondContact O-N 3.24Å
218	T	33.6	Very low	32.5	Very low	113 Å²	113	140 Å²	140	69%	0.693	75%	0.754	S	S	*	*	S	Bend	trans	-128.8	11.9	-177.1	46.7	0	0	0	0	114.4
219	L	31.6	Very low	31.7	Very low	156 Å²	156	140.4 Å²	140.4	82%	0.817	76%	0.756	S	S	*	*	S	Bend	trans	-132	24.2	-174	-110.5	174.4	0	0	0	116.3
220	Q	29.9	Very low	31.1	Very low	198 Å²	198	137.4 Å²	137.4	93%	0.925	75%	0.749	S	S	*	*			trans	-152	81.3	167.9	-122.6	162.3	-9.2	0	0	112.3
221	K	26.2	Very low	30.3	Very low	191 Å²	191	140.7 Å²	140.7	83%	0.83	75%	0.754	S	S	*	*			trans	-154.6	59	167.8	-160.8	-154	171.4	-177.3	0	113.8
222	H	25.9	Very low	29.7	Very low	171 Å²	171	146.9 Å²	146.9	79%	0.792	78%	0.775	S	S	*	*			trans	-178.9	117.5	137.5	-119	-97.9	0	0	0	109.5
223	E	26.9	Very low	29.7	Very low	182 Å²	182	145.3 Å²	145.3	85%	0.85	77%	0.772	S	S	*	*				173.6	139.7	107.9	-95.1	-178.6	142.1	0	0	110.1
224	D	23.6	Very low	29.4	Very low	164 Å²	164	149 Å²	149	88%	0.877	78%	0.78	S	S	*	*			trans	-161	95.5	167.9	-142.3	-10.5	0	0	0	108.1
225	L	28.8	Very low	28.9	Very low	176 Å²	176	149.6 Å²	149.6	92%	0.921	79%	0.785	S	S	*	*			trans	-177.5	131.6	163.7	-105	158	0	0	0	110.8
226	S	24.3	Very low	28.5	Very low	103 Å²	103	152.5 Å²	152.5	72%	0.72	79%	0.788	S	S	*	*			trans	-96.8	179.6	173.9	62	0	0	0	0	110.2
227	P	35	Very low	28.4	Very low	109 Å²	109	158 Å²	158	71%	0.708	79%	0.789	S	S	*	*			cis	-142.8	169.3	9.6	43.6	-25.4	0	0	0	118.2
228	V	25.3	Very low	28.3	Very low	127 Å²	127	152.4 Å²	152.4	77%	0.77	78%	0.777	S	S	*	*			trans	59.5	141.8	141	170.2	0	0	0	0	122
229	Q	23	Very low	28.1	Very low	156 Å²	156	156.8 Å²	156.8	73%	0.729	78%	0.781	S	S	*	*			trans	100.5	114.9	158.9	-138.6	72.6	50.2	0	0	119.6
230	D	25.1	Very low	27.7	Very low	127 Å²	127	156.2 Å²	156.2	68%	0.679	77%	0.774	S	S	*	*			trans	33.3	143.1	148.7	-74.3	-60.5	0	0	0	125.6
231	R	24.3	Very low	27.5	Very low	234 Å²	234	153.5 Å²	153.5	88%	0.883	76%	0.762	S	S	*	*			trans	77	115	149.5	-75.4	174.1	179.2	-170.6	-0.2	121.7
232	Q	25.6	Very low	27.4	Very low	183 Å²	183	152.1 Å²	152.1	86%	0.855	76%	0.758	S	S	*	*			trans	-29.9	167.3	134.8	-90.4	179.7	-1.9	0	0	116.7
233	P	40.4	Very low	28.5	Very low	100 Å²	100	148.8 Å²	148.8	65%	0.649	75%	0.751	S	S	*	*			cis	-145.8	-160.5	6.6	33	-7	0	0	0	116.2
234	L	29.3	Very low	28.4	Very low	161 Å²	161	150.8 Å²	150.8	84%	0.843	75%	0.753	S	S	*	*			trans	74.8	152.3	154.8	-68.6	171.1	0	0	0	118.1
235	A	26.9	Very low	28.6	Very low	81 Å²	81	147 Å²	147	67%	0.669	74%	0.744	S	S	*	*			cis	-159.7	160.6	7.9	0	0	0	0	0	114.7
236	Y	27	Very low	28.5	Very low	188 Å²	188	145.4 Å²	145.4	74%	0.737	73%	0.732	S	S	*	*			trans	52	120.3	142.1	-82	-122.6	0	0	0	121.9
237	R	31.6	Very low	28.5	Very low	211 Å²	211	147.5 Å²	147.5	80%	0.796	74%	0.74	S	S	*	*				85	146.6	78.6	-99.6	-171.2	-173.5	-177	4	115.2
238	A	30.6	Very low	28.2	Very low	70 Å²	70	148.7 Å²	148.7	58%	0.579	74%	0.737	S	S	*	*			cis	-166.9	163.5	2.2	0	0	0	0	0	116.3
239	W	28.6	Very low	28.4	Very low	205 Å²	205	149.9 Å²	149.9	78%	0.777	74%	0.736	S	S	*	*			trans	62.6	158.4	152.8	-62.6	118.5	0	0	0	120.8
240	Q	24.4	Very low	29.1	Very low	144 Å²	144	148.5 Å²	148.5	67%	0.673	74%	0.74	S	S	*	*			cis	-157.7	142.1	8	-148.2	142	-6	0	0	115.8
241	E	24.8	Very low	29.4	Very low	140 Å²	140	146.6 Å²	146.6	65%	0.654	74%	0.742	S	S	*	*			trans	37.6	151.5	141.1	-66.1	-178.2	-100.9	0	0	126.4
242	H	24.5	Very low	29.8	Very low	162 Å²	162	141.5 Å²	141.5	75%	0.75	74%	0.737	S	S	*	*			cis	-155	-67.5	-24.4	-131.7	-29.9	0	0	0	121.8
243	P	48.4	Very low	30.3	Very low	101 Å²	101	141.2 Å²	141.2	66%	0.656	74%	0.738	S	S	*	*			trans	-137.5	179.8	-139.7	40.8	-23	0	0	0	122.4
244	Y	26.1	Very low	30.1	Very low	225 Å²	225	141.3 Å²	141.3	88%	0.882	74%	0.741	S	S	*	*			trans	78.6	141.2	173.4	-63.4	-82.7	0	0	0	119.6
245	A	27.4	Very low	30.5	Very low	84 Å²	84	137.4 Å²	137.4	69%	0.694	73%	0.732	S	S	*	*			cis	176.7	172.4	-19.5	0	0	0	0	0	108.8
246	E	26.8	Very low	31	Very low	142 Å²	142	136.7 Å²	136.7	66%	0.664	73%	0.726	S	S	*	*			cis	-171.7	150.6	-35.3	178.8	178.9	-33.2	0	0	109.4	Q248	E246-Q248 PolarHBondContact OE2-NE2 2.6Å
247	T	24.3	Very low	31.6	Very low	147 Å²	147	133.7 Å²	133.7	90%	0.902	72%	0.721	S	S	*	*			trans	-165.6	157.2	151.2	1.4	0	0	0	0	113.6
248	Q	28.3	Very low	32	Very low	135 Å²	135	130.5 Å²	130.5	63%	0.631	72%	0.719	S	S	*	*			trans	-144.3	176.2	-164.8	-65.2	-171.9	47.3	0	0	112.3	E246	E246-Q248 PolarHBondContact OE2-NE2 2.6Å
249	M	28.6	Very low	32.5	Very low	151 Å²	151	130.5 Å²	130.5	74%	0.744	72%	0.719	S	S	*	*			cis	-169.9	152.7	-39.1	-93	-157.2	-72.5	0	0	107.3
250	P	37.8	Very low	33.2	Very low	127 Å²	127	126.3 Å²	126.3	83%	0.825	71%	0.712	S	S	*	*				-154.6	175.9	108.8	39.1	-21.9	0	0	0	115.5
251	A	31.3	Very low	33.9	Very low	87 Å²	87	124.3 Å²	124.3	72%	0.719	71%	0.709	S	S	*	*			cis	160.7	128.3	-37.7	0	0	0	0	0	109
252	T	33.3	Very low	34.8	Very low	127 Å²	127	120.1 Å²	120.1	78%	0.779	70%	0.704	S	S	*	*			trans	-135	137.4	165.3	51.6	0	0	0	0	110.1	S254	T252-S254 VanDerWaalsContact C-N 3.31Å; T252-S254 PolarHBondContact O-N 3.21Å
253	M	35.2	Very low	35.8	Very low	177 Å²	177	115.9 Å²	115.9	87%	0.872	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.7	28.5	-151.1	-59.2	-160.8	-60.5	0	0	117.2
254	S	36.6	Very low	35.7	Very low	102 Å²	102	115.2 Å²	115.2	71%	0.713	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.7	-26	179.9	-52.8	0	0	0	0	114.6	T252	T252-S254 VanDerWaalsContact C-N 3.31Å; T252-S254 PolarHBondContact O-N 3.21Å
255	A	39	Very low	36.5	Very low	79 Å²	79	107.1 Å²	107.1	65%	0.653	67%	0.671	S	S	*	*	S	Bend	trans	-80.3	-28.8	-176	0	0	0	0	0	114	I257	A255-I257 VanDerWaalsContact C-N 3.33Å; A255-I257 PolarHBondContact O-N 2.99Å
256	A	36	Very low	37.4	Very low	67 Å²	67	106.2 Å²	106.2	55%	0.554	66%	0.663	S	S	*	*	H	α-helix	trans	-70.5	-24.2	-171.5	0	0	0	0	0	114.5
257	I	39.5	Very low	38.4	Very low	124 Å²	124	102.8 Å²	102.8	64%	0.636	66%	0.659	S	S	*	*	H	α-helix	trans	-75.3	-37.4	-172.9	-62.6	175.5	0	0	0	111.5	A255 V261	A255-I257 VanDerWaalsContact C-N 3.33Å; A255-I257 PolarHBondContact O-N 2.99Å; I257-V261 WeakPolarHBondContact O-CG2 3.48Å
258	I	40.3	Very low	39.6	Very low	144 Å²	144	100.5 Å²	100.5	74%	0.738	65%	0.645	S	S	*	*	H	α-helix	trans	-77.4	-36.9	-177.4	-57.7	179.7	0	0	0	111.1
259	A	41.9	Very low	40.7	Very low	70 Å²	70	96.6 Å²	96.6	58%	0.579	63%	0.633	S	S	*	*	H	α-helix	trans	-66.6	-40.4	-177.7	0	0	0	0	0	113.7	V261	A259-V261 PolarHBondContact O-N 2.94Å
260	N	42.7	Very low	41.8	Very low	118 Å²	118	91.9 Å²	91.9	63%	0.631	62%	0.617	S	S	*	*	H	α-helix	trans	-77.3	-17.2	-174.7	-88.7	4.1	0	0	0	114.8	T264	N260-T264 WeakPolarHBondContact O-CG2 3.48Å; N260-T264 PolarHBondContact O-OG1 2.82Å
261	V	39.9	Very low	42.5	Very low	101 Å²	101	88.8 Å²	88.8	61%	0.612	60%	0.603	S	S	*	*	H	α-helix	trans	-74.3	-37	178.9	174	0	0	0	0	111.6	I257 A259	I257-V261 WeakPolarHBondContact O-CG2 3.48Å; A259-V261 PolarHBondContact O-N 2.94Å
262	G	43.4	Very low	43.4	Very low	53 Å²	53	87 Å²	87	55%	0.546	59%	0.588	S	S	.	*	H	α-helix	trans	-68.5	-45.2	-179.4	0	0	0	0	0	113.7
263	A	44.3	Very low	44.4	Very low	73 Å²	73	88.5 Å²	88.5	60%	0.603	58%	0.584	S	S	*	*	H	α-helix	trans	-72	-32.7	-174.3	0	0	0	0	0	113.7
264	T	46.5	Very low	45.3	Very low	86 Å²	86	87 Å²	87	53%	0.528	58%	0.575	S	S	.	*	H	α-helix	trans	-81.8	-29.2	-175.7	51.7	0	0	0	0	113.4	N260 T268	N260-T264 WeakPolarHBondContact O-CG2 3.48Å; N260-T264 PolarHBondContact O-OG1 2.82Å; T264-T268 WeakPolarHBondContact O-CG2 3.36Å; T264-T268 PolarHBondContact O-N 2.82Å; T264-T268 PolarHBondContact O-OG1 3.32Å
265	A	43.2	Very low	46.1	Very low	56 Å²	56	90.1 Å²	90.1	46%	0.463	57%	0.573	S	S	.	*	H	α-helix	trans	-70.5	-35.6	177.8	0	0	0	0	0	113.5	T268 S269	A265-T268 PolarHBondContact O-OG1 3.26Å; A265-S269 WeakPolarHBondContact O-CB 3.33Å; A265-S269 PolarHBondContact O-N 3.49Å; A265-S269 PolarHBondContact O-OG 3.45Å
266	A	45.9	Very low	46.8	Very low	64 Å²	64	90.4 Å²	90.4	53%	0.529	56%	0.563	S	S	.	*	H	α-helix	trans	-71.4	-40.2	-178	0	0	0	0	0	113.1	S269	A266-S269 PolarHBondContact O-OG 3.5Å; A266-S269 VanDerWaalsContact O-OG 3.14Å
267	A	48.8	Very low	47.8	Very low	71 Å²	71	89.8 Å²	89.8	59%	0.587	56%	0.562	S	S	*	*	H	α-helix	trans	-72.8	-38.3	-179.4	0	0	0	0	0	112.9
268	T	48.7	Very low	48.6	Very low	98 Å²	98	91.8 Å²	91.8	60%	0.601	57%	0.569	S	S	*	*	H	α-helix	trans	-73.7	-37	-177.6	48.3	0	0	0	0	112.8	T264 A265 A272	T264-T268 WeakPolarHBondContact O-CG2 3.36Å; T264-T268 PolarHBondContact O-N 2.82Å; T264-T268 PolarHBondContact O-OG1 3.32Å; A265-T268 PolarHBondContact O-OG1 3.26Å; T268-A272 WeakPolarHBondContact O-CB 3.41Å; T268-A272 PolarHBondContact O-N 3.12Å
269	S	50.8	Low	49.2	Very low	54 Å²	54	90.4 Å²	90.4	38%	0.378	56%	0.559	S	S	.	*	H	α-helix	trans	-65.5	-41.1	177.5	51.1	0	0	0	0	113.1	A265 A266 A271 A272 F273	A265-S269 WeakPolarHBondContact O-CB 3.33Å; A265-S269 PolarHBondContact O-N 3.49Å; A265-S269 PolarHBondContact O-OG 3.45Å; A266-S269 PolarHBondContact O-OG 3.5Å; A266-S269 VanDerWaalsContact O-OG 3.14Å; S269-A271 PolarHBondContact O-N 2.79Å; S269-A272 PolarHBondContact O-N 3.08Å; S269-F273 WeakPolarHBondContact O-CD2 3.23Å; S269-F273 PolarHBondContact O-N 3.44Å
270	A	51.7	Low	49.8	Very low	51 Å²	51	95 Å²	95	42%	0.421	56%	0.563	S	S	.	*	H	α-helix	trans	-59	-47.7	178.8	0	0	0	0	0	112.7	F273 Q274	A270-F273 PolarHBondContact O-N 3.18Å; A270-Q274 PolarHBondContact O-N 2.96Å
271	A	52.9	Low	50.3	Low	63 Å²	63	98.9 Å²	98.9	52%	0.521	57%	0.574	S	S	.	*	H	α-helix	trans	-64.2	-42	177.1	0	0	0	0	0	112.2	S269 F273 Q274 Y275	S269-A271 PolarHBondContact O-N 2.79Å; A271-F273 PolarHBondContact O-N 3.28Å; A271-Q274 PolarHBondContact O-N 3.16Å; A271-Y275 PolarHBondContact O-N 3.47Å
272	A	51	Low	51	Low	50 Å²	50	102.2 Å²	102.2	41%	0.413	58%	0.582	S	S	.	*	H	α-helix	trans	-61.2	-43.7	177.5	0	0	0	0	0	112.4	T268 S269 Y275 L276	T268-A272 WeakPolarHBondContact O-CB 3.41Å; T268-A272 PolarHBondContact O-N 3.12Å; S269-A272 PolarHBondContact O-N 3.08Å; A272-Y275 PolarHBondContact O-N 3.4Å; A272-L276 WeakPolarHBondContact O-CB 3.43Å; A272-L276 PolarHBondContact O-N 3.47Å
273	F	53.5	Low	51.5	Low	157 Å²	157	106.3 Å²	106.3	69%	0.689	58%	0.582	S	S	*	*	H	α-helix	trans	-65.7	-37	177.8	-90.8	-73.3	0	0	0	113.1	S269 A270 A271 G277	S269-F273 WeakPolarHBondContact O-CD2 3.23Å; S269-F273 PolarHBondContact O-N 3.44Å; A270-F273 PolarHBondContact O-N 3.18Å; A271-F273 PolarHBondContact O-N 3.28Å; F273-G277 PolarHBondContact O-N 3.48Å
274	Q	54.7	Low	51.8	Low	147 Å²	147	106.1 Å²	106.1	69%	0.687	58%	0.577	S	S	*	*	H	α-helix	trans	-70.3	-37.3	176.1	-69.1	-175.3	-88.6	0	0	112.4	A270 A271 G277 Q278	A270-Q274 PolarHBondContact O-N 2.96Å; A271-Q274 PolarHBondContact O-N 3.16Å; Q274-G277 PolarHBondContact O-N 3.22Å; Q274-Q278 PolarHBondContact O-N 3.46Å
275	Y	52.8	Low	52.3	Low	167 Å²	167	111.2 Å²	111.2	66%	0.655	60%	0.595	S	S	*	*	H	α-helix	trans	-67.5	-45.1	176.1	-163.2	-98.3	0	0	0	112.1	A271 A272 G277 Q278 H279	A271-Y275 PolarHBondContact O-N 3.47Å; A272-Y275 PolarHBondContact O-N 3.4Å; Y275-G277 VanDerWaalsContact C-N 3.32Å; Y275-G277 PolarHBondContact O-N 3.15Å; Y275-Q278 PolarHBondContact O-N 3.07Å; Y275-H279 PolarHBondContact O-N 2.96Å
276	L	54.1	Low	53.1	Low	85 Å²	85	109.9 Å²	109.9	45%	0.445	58%	0.582	S	S	.	*	H	α-helix	trans	-59.3	-41.8	171.8	-87.8	156.9	0	0	0	111.9	A272 Q278 H279 Y280 F289	A272-L276 WeakPolarHBondContact O-CB 3.43Å; A272-L276 PolarHBondContact O-N 3.47Å; L276-Q278 VanDerWaalsContact C-N 3.33Å; L276-Q278 PolarHBondContact O-N 3.15Å; L276-H279 PolarHBondContact O-N 3.1Å; L276-Y280 WeakPolarHBondContact O-CB 3.26Å; L276-Y280 PolarHBondContact O-N 2.98Å; L276-F289 HydrophobicContact CD2-CE1 4.34Å; L276-F289 HydrophobicContact CD2-CZ 4.42Å
277	G	57.4	Low	53.8	Low	53 Å²	53	114.1 Å²	114.1	55%	0.546	59%	0.594	S	S	.	*	H	α-helix	trans	-60.4	-36.5	-179.9	0	0	0	0	0	114.3	F273 Q274 Y275	F273-G277 PolarHBondContact O-N 3.48Å; Q274-G277 PolarHBondContact O-N 3.22Å; Y275-G277 VanDerWaalsContact C-N 3.32Å; Y275-G277 PolarHBondContact O-N 3.15Å
278	Q	55.5	Low	54.3	Low	167 Å²	167	114.7 Å²	114.7	78%	0.78	59%	0.594	S	S	*	*	H	α-helix	trans	-76.5	-30.5	179.7	-72.4	-173.6	-27.2	0	0	113.6	Q274 Y275 L276	Q274-Q278 PolarHBondContact O-N 3.46Å; Y275-Q278 PolarHBondContact O-N 3.07Å; L276-Q278 VanDerWaalsContact C-N 3.33Å; L276-Q278 PolarHBondContact O-N 3.15Å
279	H	54.2	Low	55	Low	114 Å²	114	114.9 Å²	114.9	53%	0.528	59%	0.586	S	S	.	*	H	α-helix	trans	-99	-6.9	179.2	-83.3	-83.1	0	0	0	115.3	Y275 L276 K281 H282	Y275-H279 PolarHBondContact O-N 2.96Å; L276-H279 PolarHBondContact O-N 3.1Å; H279-K281 PolarHBondContact O-N 3.06Å; H279-H282 PolarHBondContact O-N 3.31Å
280	Y	53.6	Low	55.6	Low	167 Å²	167	120.8 Å²	120.8	66%	0.655	60%	0.602	S	S	*	*	G	3₁₀ helix	trans	-48.6	-40.5	-176.8	-168.9	-102.3	0	0	0	114	L276 H282	L276-Y280 WeakPolarHBondContact O-CB 3.26Å; L276-Y280 PolarHBondContact O-N 2.98Å; Y280-H282 PolarHBondContact O-N 3.42Å
281	K	52.7	Low	56.4	Low	199 Å²	199	121 Å²	121	87%	0.865	60%	0.603	S	S	*	*	G	3₁₀ helix	trans	-71.6	-8.4	-177.2	-137.5	178.6	-173.4	-178.6	0	114.5	H279	H279-K281 PolarHBondContact O-N 3.06Å
282	H	54.5	Low	57.1	Low	171 Å²	171	120.6 Å²	120.6	79%	0.792	60%	0.6	S	S	*	*	G	3₁₀ helix	trans	-111.5	-2.4	-176.3	-124.1	-62	0	0	0	114.4	H279 Y280	H279-H282 PolarHBondContact O-N 3.31Å; Y280-H282 PolarHBondContact O-N 3.42Å
283	Y	53.8	Low	58.1	Low	139 Å²	139	121.1 Å²	121.1	55%	0.545	60%	0.601	S	S	.	*	T	Hydrogen-bonded Turn	trans	-129.3	-3.3	-174.1	-140.2	-89.7	0	0	0	114.8	Q285 S286 F289	Y283-Q285 PolarHBondContact O-N 3.32Å; Y283-S286 WeakPolarHBondContact CD1-OG 3.37Å; Y283-S286 WeakPolarHBondContact CE1-OG 3.37Å; Y283-S286 PolarHBondContact O-N 3.36Å; Y283-S286 PolarHBondContact O-OG 3.44Å; Y283-S286 VanDerWaalsContact O-OG 3.11Å; Y283-F289 AromaticContact CD1-CD2 3.47Å; Y283-F289 HydrophobicContact CD1-CD2 3.47Å; Y283-F289 VanDerWaalsContact CD1-CD2 3.47Å; Y283-F289 AromaticContact CD1-CE2 3.29Å; Y283-F289 HydrophobicContact CD1-CE2 3.29Å; Y283-F289 HydrophobicContact CD1-CZ 4.24Å; Y283-F289 AromaticContact CE1-CD2 3.64Å; Y283-F289 HydrophobicContact CE1-CD2 3.64Å; Y283-F289 AromaticContact CE1-CE2 3.49Å; Y283-F289 HydrophobicContact CE1-CE2 3.49Å; Y283-F289 VanDerWaalsContact CE1-CE2 3.49Å; Y283-F289 HydrophobicContact CG-CE2 4.29Å
284	S	51.4	Low	59.1	Low	69 Å²	69	116.9 Å²	116.9	48%	0.483	59%	0.59	S	S	.	*	T	Hydrogen-bonded Turn	trans	-68.3	-0.5	-174	59.1	0	0	0	0	116.1
285	Q	56.9	Low	60	Low	194 Å²	194	114 Å²	114	91%	0.907	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106	8.5	176.5	-68.8	-173.4	-32.1	0	0	113.8	Y283	Y283-Q285 PolarHBondContact O-N 3.32Å
286	S	61	Low	61.1	Low	28 Å²	28	111.3 Å²	111.3	20%	0.196	58%	0.579	C	S	.	*			trans	-90	128.1	174.6	66.5	0	0	0	0	112.4	Y283 S288 F289	Y283-S286 WeakPolarHBondContact CD1-OG 3.37Å; Y283-S286 WeakPolarHBondContact CE1-OG 3.37Å; Y283-S286 PolarHBondContact O-N 3.36Å; Y283-S286 PolarHBondContact O-OG 3.44Å; Y283-S286 VanDerWaalsContact O-OG 3.11Å; S286-S288 PolarHBondContact O-N 3Å; S286-F289 PolarHBondContact O-N 3.23Å
287	I	59.5	Low	62	Low	152 Å²	152	112 Å²	112	78%	0.779	58%	0.583	S	S	*	*	H	α-helix	trans	-61.7	-31.9	177.5	-63.7	171.8	0	0	0	111	F289 Y290	I287-F289 PolarHBondContact O-N 3.3Å; I287-Y290 PolarHBondContact O-N 3.48Å
288	S	60.3	Low	62.9	Low	83 Å²	83	115.1 Å²	115.1	58%	0.58	58%	0.584	S	S	*	*	H	α-helix	trans	-56.6	-30.8	-178.5	-43.8	0	0	0	0	114.5	S286 A291 A292	S286-S288 PolarHBondContact O-N 3Å; S288-A291 PolarHBondContact O-N 2.87Å; S288-A292 PolarHBondContact O-N 3.43Å; S288-A292 VanDerWaalsContact O-N 3.1Å
289	F	62.1	Low	63.6	Low	103 Å²	103	111.8 Å²	111.8	45%	0.452	57%	0.571	S	S	.	*	H	α-helix	trans	-69.9	-37.3	-178.1	-108.1	-105.1	0	0	0	113.1	L276 Y283 S286 I287 A292 S293	L276-F289 HydrophobicContact CD2-CE1 4.34Å; L276-F289 HydrophobicContact CD2-CZ 4.42Å; Y283-F289 AromaticContact CD1-CD2 3.47Å; Y283-F289 HydrophobicContact CD1-CD2 3.47Å; Y283-F289 VanDerWaalsContact CD1-CD2 3.47Å; Y283-F289 AromaticContact CD1-CE2 3.29Å; Y283-F289 HydrophobicContact CD1-CE2 3.29Å; Y283-F289 HydrophobicContact CD1-CZ 4.24Å; Y283-F289 AromaticContact CE1-CD2 3.64Å; Y283-F289 HydrophobicContact CE1-CD2 3.64Å; Y283-F289 AromaticContact CE1-CE2 3.49Å; Y283-F289 HydrophobicContact CE1-CE2 3.49Å; Y283-F289 VanDerWaalsContact CE1-CE2 3.49Å; Y283-F289 HydrophobicContact CG-CE2 4.29Å; S286-F289 PolarHBondContact O-N 3.23Å; I287-F289 PolarHBondContact O-N 3.3Å; F289-A292 PolarHBondContact O-N 3.25Å; F289-S293 WeakPolarHBondContact O-CB 3.24Å; F289-S293 PolarHBondContact O-N 3.05Å
290	Y	63.3	Low	64.3	Low	177 Å²	177	110 Å²	110	69%	0.694	57%	0.571	S	S	*	*	H	α-helix	trans	-69.1	-36.8	177.4	-70.8	-81.2	0	0	0	111.8	I287 S293 S294	I287-Y290 PolarHBondContact O-N 3.48Å; Y290-S293 PolarHBondContact O-N 2.92Å; Y290-S294 PolarHBondContact O-N 3.41Å; Y290-S294 VanDerWaalsContact O-N 3.12Å; Y290-S294 PolarHBondContact O-OG 3.02Å
291	A	69.2	Low	65	Low	55 Å²	55	110.1 Å²	110.1	46%	0.455	57%	0.572	S	S	.	*	H	α-helix	trans	-65.8	-42.9	174.3	0	0	0	0	0	112.4	S288 S293 S294 V295	S288-A291 PolarHBondContact O-N 2.87Å; A291-S293 VanDerWaalsContact C-N 3.34Å; A291-S293 PolarHBondContact O-N 2.82Å; A291-S294 PolarHBondContact O-OG 3.16Å; A291-S294 VanDerWaalsContact O-OG 3.08Å; A291-V295 WeakPolarHBondContact O-CG2 3.2Å; A291-V295 PolarHBondContact O-N 3.27Å
292	A	68.5	Low	65.6	Low	55 Å²	55	105.6 Å²	105.6	46%	0.455	56%	0.556	S	S	.	*	H	α-helix	trans	-63.8	-39.8	175.7	0	0	0	0	0	112.1	S288 F289 L296	S288-A292 PolarHBondContact O-N 3.43Å; S288-A292 VanDerWaalsContact O-N 3.1Å; F289-A292 PolarHBondContact O-N 3.25Å; A292-L296 WeakPolarHBondContact O-CG 3.37Å; A292-L296 PolarHBondContact O-N 3.05Å; A292-L296 VanDerWaalsContact O-N 3.15Å
293	S	71.4	Confident	65.8	Low	62 Å²	62	101.6 Å²	101.6	43%	0.434	54%	0.544	S	S	.	.	H	α-helix	trans	-65	-42.4	179	-174.9	0	0	0	0	112.9	F289 Y290 A291 L296 L297	F289-S293 WeakPolarHBondContact O-CB 3.24Å; F289-S293 PolarHBondContact O-N 3.05Å; Y290-S293 PolarHBondContact O-N 2.92Å; A291-S293 VanDerWaalsContact C-N 3.34Å; A291-S293 PolarHBondContact O-N 2.82Å; S293-L296 PolarHBondContact O-N 3.48Å; S293-L297 WeakPolarHBondContact O-CG 3.46Å; S293-L297 PolarHBondContact O-N 3.27Å
294	S	73.6	Confident	65.9	Low	67 Å²	67	98.9 Å²	98.9	47%	0.469	54%	0.542	S	S	.	.	H	α-helix	trans	-68.2	-36.7	179.6	63.7	0	0	0	0	113	Y290 A291 L297 M298	Y290-S294 PolarHBondContact O-N 3.41Å; Y290-S294 VanDerWaalsContact O-N 3.12Å; Y290-S294 PolarHBondContact O-OG 3.02Å; A291-S294 PolarHBondContact O-OG 3.16Å; A291-S294 VanDerWaalsContact O-OG 3.08Å; S294-L297 PolarHBondContact O-N 3.22Å; S294-M298 PolarHBondContact O-N 3.28Å
295	V	74.9	Confident	66.1	Low	86 Å²	86	98.5 Å²	98.5	52%	0.521	54%	0.543	S	S	.	.	H	α-helix	trans	-65.6	-42.9	175	173.7	0	0	0	0	111.5	A291 M298 L299	A291-V295 WeakPolarHBondContact O-CG2 3.2Å; A291-V295 PolarHBondContact O-N 3.27Å; V295-M298 PolarHBondContact O-N 3.2Å; V295-L299 HydrophobicContact CG1-CD1 4.13Å; V295-L299 WeakPolarHBondContact O-CG 3.14Å; V295-L299 PolarHBondContact O-N 2.78Å
296	L	74.3	Confident	65.9	Low	112 Å²	112	93 Å²	93	59%	0.586	53%	0.526	S	S	*	.	H	α-helix	trans	-63.3	-41.9	175.8	-73.2	169.2	0	0	0	112.1	A292 S293 L299 C300	A292-L296 WeakPolarHBondContact O-CG 3.37Å; A292-L296 PolarHBondContact O-N 3.05Å; A292-L296 VanDerWaalsContact O-N 3.15Å; S293-L296 PolarHBondContact O-N 3.48Å; L296-L299 PolarHBondContact O-N 3.23Å; L296-C300 PolarHBondContact O-N 3.05Å; L296-C300 PolarHBondContact O-SG 2.8Å; L296-C300 VanDerWaalsContact O-SG 3.36Å
297	L	74.9	Confident	65.5	Low	98 Å²	98	96 Å²	96	51%	0.513	54%	0.543	S	S	.	.	H	α-helix	trans	-62.4	-43.6	175.1	-74.9	167.8	0	0	0	112	S293 S294 L299 C300 Y301	S293-L297 WeakPolarHBondContact O-CG 3.46Å; S293-L297 PolarHBondContact O-N 3.27Å; S294-L297 PolarHBondContact O-N 3.22Å; L297-L299 VanDerWaalsContact C-N 3.33Å; L297-L299 PolarHBondContact O-N 3.31Å; L297-C300 PolarHBondContact O-N 3.5Å; L297-Y301 WeakPolarHBondContact O-CD2 3.42Å; L297-Y301 PolarHBondContact O-N 3.49Å
298	M	75.1	Confident	65	Low	119 Å²	119	90.9 Å²	90.9	59%	0.586	52%	0.524	S	S	*	.	H	α-helix	trans	-59.3	-41.6	175.1	-81.7	-68.7	-69.4	0	0	112.6	S294 V295 Y301 L302	S294-M298 PolarHBondContact O-N 3.28Å; V295-M298 PolarHBondContact O-N 3.2Å; M298-Y301 PolarHBondContact O-N 3.28Å; M298-L302 WeakPolarHBondContact O-CG 3.42Å; M298-L302 PolarHBondContact O-N 2.92Å
299	L	71.1	Confident	64.4	Low	97 Å²	97	90.2 Å²	90.2	51%	0.508	52%	0.523	S	S	.	.	H	α-helix	trans	-66.4	-36.7	176.7	-71.5	165.9	0	0	0	112.5	V295 L296 L297 T303	V295-L299 HydrophobicContact CG1-CD1 4.13Å; V295-L299 WeakPolarHBondContact O-CG 3.14Å; V295-L299 PolarHBondContact O-N 2.78Å; L296-L299 PolarHBondContact O-N 3.23Å; L297-L299 VanDerWaalsContact C-N 3.33Å; L297-L299 PolarHBondContact O-N 3.31Å; L299-T303 WeakPolarHBondContact O-CB 3.4Å; L299-T303 WeakPolarHBondContact O-CG2 3.23Å; L299-T303 PolarHBondContact O-N 2.94Å; L299-T303 PolarHBondContact O-OG1 3.08Å
300	C	67.8	Low	63.8	Low	77 Å²	77	88.5 Å²	88.5	52%	0.52	53%	0.528	S	S	.	.	H	α-helix	trans	-66	-38.1	172.2	-69.5	0	0	0	0	112.9	L296 L297 T303 T304	L296-C300 PolarHBondContact O-N 3.05Å; L296-C300 PolarHBondContact O-SG 2.8Å; L296-C300 VanDerWaalsContact O-SG 3.36Å; L297-C300 PolarHBondContact O-N 3.5Å; C300-T303 WeakPolarHBondContact CA-OG1 3.37Å; C300-T303 PolarHBondContact O-OG1 2.84Å; C300-T304 WeakPolarHBondContact O-CG2 3.33Å; C300-T304 PolarHBondContact O-N 2.93Å; C300-T304 VanDerWaalsContact O-N 3.14Å; C300-T304 PolarHBondContact O-OG1 3.42Å
301	Y	68.9	Low	62.8	Low	170 Å²	170	84.5 Å²	84.5	67%	0.667	52%	0.522	S	S	*	.	H	α-helix	trans	-69.4	-41	175.4	-89.1	-74.8	0	0	0	112.5	L297 M298 T304 A305	L297-Y301 WeakPolarHBondContact O-CD2 3.42Å; L297-Y301 PolarHBondContact O-N 3.49Å; M298-Y301 PolarHBondContact O-N 3.28Å; Y301-T304 PolarHBondContact O-OG1 2.95Å; Y301-A305 WeakPolarHBondContact O-CB 3.25Å; Y301-A305 PolarHBondContact O-N 3.29Å; Y301-A305 VanDerWaalsContact O-N 3.07Å
302	L	64.5	Low	61.3	Low	104 Å²	104	89 Å²	89	55%	0.545	53%	0.534	S	S	.	.	H	α-helix	trans	-66.5	-37.6	177.3	-73.9	164.3	0	0	0	112.8	M298 S306	M298-L302 WeakPolarHBondContact O-CG 3.42Å; M298-L302 PolarHBondContact O-N 2.92Å; L302-S306 PolarHBondContact O-N 2.75Å; L302-S306 PolarHBondContact O-OG 3.36Å
303	T	58.3	Low	59.8	Low	86 Å²	86	91 Å²	91	53%	0.528	55%	0.545	S	S	.	.	H	α-helix	trans	-73.1	-38.6	178.5	45.8	0	0	0	0	112.6	L299 C300 S306 T307	L299-T303 WeakPolarHBondContact O-CB 3.4Å; L299-T303 WeakPolarHBondContact O-CG2 3.23Å; L299-T303 PolarHBondContact O-N 2.94Å; L299-T303 PolarHBondContact O-OG1 3.08Å; C300-T303 WeakPolarHBondContact CA-OG1 3.37Å; C300-T303 PolarHBondContact O-OG1 2.84Å; T303-S306 PolarHBondContact O-N 3.14Å; T303-T307 PolarHBondContact O-N 3.17Å; T303-T307 PolarHBondContact O-OG1 3.03Å
304	T	56.7	Low	58.2	Low	83 Å²	83	96.3 Å²	96.3	51%	0.509	56%	0.562	S	S	.	*	H	α-helix	trans	-69.9	-35.9	175.8	47.1	0	0	0	0	113.2	C300 Y301 S306 T307 A308	C300-T304 WeakPolarHBondContact O-CG2 3.33Å; C300-T304 PolarHBondContact O-N 2.93Å; C300-T304 VanDerWaalsContact O-N 3.14Å; C300-T304 PolarHBondContact O-OG1 3.42Å; Y301-T304 PolarHBondContact O-OG1 2.95Å; T304-S306 VanDerWaalsContact C-N 3.31Å; T304-S306 PolarHBondContact O-N 3.46Å; T304-T307 PolarHBondContact O-OG1 3.05Å; T304-A308 WeakPolarHBondContact O-CB 3.41Å; T304-A308 PolarHBondContact O-N 3.11Å; T304-A308 VanDerWaalsContact O-N 3.15Å
305	A	56.2	Low	56.5	Low	61 Å²	61	98.4 Å²	98.4	50%	0.504	57%	0.572	S	S	.	*	H	α-helix	trans	-62.2	-38.8	171	0	0	0	0	0	112.2	Y301 A308 A309	Y301-A305 WeakPolarHBondContact O-CB 3.25Å; Y301-A305 PolarHBondContact O-N 3.29Å; Y301-A305 VanDerWaalsContact O-N 3.07Å; A305-A308 PolarHBondContact O-N 3.23Å; A305-A309 PolarHBondContact O-N 2.72Å; A305-A309 VanDerWaalsContact O-N 3.1Å
306	S	53.1	Low	54.5	Low	78 Å²	78	97.9 Å²	97.9	55%	0.545	58%	0.584	S	S	.	*	H	α-helix	trans	-68	-38.4	-179	-58.6	0	0	0	0	113.1	L302 T303 T304 A310	L302-S306 PolarHBondContact O-N 2.75Å; L302-S306 PolarHBondContact O-OG 3.36Å; T303-S306 PolarHBondContact O-N 3.14Å; T304-S306 VanDerWaalsContact C-N 3.31Å; T304-S306 PolarHBondContact O-N 3.46Å; S306-A310 PolarHBondContact O-N 2.87Å
307	T	51.9	Low	52.8	Low	91 Å²	91	96 Å²	96	56%	0.558	59%	0.585	S	S	*	*	H	α-helix	trans	-77	-29.4	177.3	53.1	0	0	0	0	113	T303 T304 A310 T311	T303-T307 PolarHBondContact O-N 3.17Å; T303-T307 PolarHBondContact O-OG1 3.03Å; T304-T307 PolarHBondContact O-OG1 3.05Å; T307-A310 PolarHBondContact O-N 3.19Å; T307-T311 PolarHBondContact O-N 2.57Å; T307-T311 PolarHBondContact O-OG1 3.17Å
308	A	48.5	Very low	51.4	Low	45 Å²	45	98.5 Å²	98.5	37%	0.372	60%	0.598	S	S	.	*	H	α-helix	trans	-65	-42.5	170.6	0	0	0	0	0	111.8	T304 A305 A310 T311 Q312	T304-A308 WeakPolarHBondContact O-CB 3.41Å; T304-A308 PolarHBondContact O-N 3.11Å; T304-A308 VanDerWaalsContact O-N 3.15Å; A305-A308 PolarHBondContact O-N 3.23Å; A308-A310 PolarHBondContact O-N 3.04Å; A308-T311 PolarHBondContact O-N 3.42Å; A308-T311 PolarHBondContact O-OG1 3.15Å; A308-Q312 PolarHBondContact O-N 3.1Å
309	A	48.9	Very low	50	Low	68 Å²	68	100.8 Å²	100.8	56%	0.562	61%	0.613	S	S	*	*	H	α-helix	trans	-63.1	-39.9	176.5	0	0	0	0	0	112.6	A305 T311	A305-A309 PolarHBondContact O-N 2.72Å; A305-A309 VanDerWaalsContact O-N 3.1Å; A309-T311 PolarHBondContact O-N 3.12Å
310	A	48.2	Very low	49.4	Very low	67 Å²	67	105 Å²	105	55%	0.554	63%	0.627	S	S	*	*	H	α-helix	trans	-66.7	-34.5	179.1	0	0	0	0	0	113.5	S306 T307 A308	S306-A310 PolarHBondContact O-N 2.87Å; T307-A310 PolarHBondContact O-N 3.19Å; A308-A310 PolarHBondContact O-N 3.04Å
311	T	43.1	Very low	49.6	Very low	94 Å²	94	106 Å²	106	58%	0.577	62%	0.624	S	S	*	*	H	α-helix	trans	-83.8	-13.6	-174.2	44.8	0	0	0	0	114.5	T307 A308 A309 T315	T307-T311 PolarHBondContact O-N 2.57Å; T307-T311 PolarHBondContact O-OG1 3.17Å; A308-T311 PolarHBondContact O-N 3.42Å; A308-T311 PolarHBondContact O-OG1 3.15Å; A309-T311 PolarHBondContact O-N 3.12Å; T311-T315 PolarHBondContact O-OG1 2.85Å
312	Q	37.5	Very low	50	Low	150 Å²	150	99.8 Å²	99.8	70%	0.701	60%	0.604	S	S	*	*	H	α-helix	trans	-85	-12.3	175.4	-70.6	-177.3	-7.6	0	0	114.3	A308	A308-Q312 PolarHBondContact O-N 3.1Å
313	S	36.3	Very low	50.7	Low	97 Å²	97	100.5 Å²	100.5	68%	0.678	61%	0.607	S	S	*	*	H	α-helix	trans	-79.8	-35.5	-176.2	-163.8	0	0	0	0	114
314	E	39.3	Very low	51.7	Low	173 Å²	173	97.2 Å²	97.2	81%	0.808	59%	0.586	S	S	*	*	H	α-helix	trans	-92.7	-18.6	-177.6	-67.9	-171.1	123.6	0	0	113.8
315	T	36.3	Very low	52.6	Low	110 Å²	110	97.1 Å²	97.1	68%	0.675	58%	0.582	S	S	*	*	H	α-helix	trans	-86.1	-18.2	-174.8	44.9	0	0	0	0	114.1	T311	T311-T315 PolarHBondContact O-OG1 2.85Å
316	G	32.7	Very low	53.3	Low	75 Å²	75	101 Å²	101	77%	0.773	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.7	2.8	-177.5	0	0	0	0	0	116.5
317	A	39.1	Very low	54.3	Low	73 Å²	73	102.6 Å²	102.6	60%	0.603	60%	0.601	S	S	*	*	S	Bend	trans	-113.5	-4.3	-168.1	0	0	0	0	0	115.5
318	L	45.6	Very low	55.6	Low	151 Å²	151	99 Å²	99	79%	0.791	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89	-7.3	-166.3	-153.6	66.3	0	0	0	115.3
319	D	45.6	Very low	57.4	Low	167 Å²	167	99.4 Å²	99.4	89%	0.893	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.8	15.2	-178	-79.5	-40	0	0	0	114.6
320	K	59.6	Low	59.1	Low	186 Å²	186	97.8 Å²	97.8	81%	0.809	56%	0.562	S	S	*	*	S	Bend	trans	-114.1	122.5	172.5	-73.7	-178.1	179.1	174.6	0	110.6
321	H	71.4	Confident	61	Low	98 Å²	98	101.9 Å²	101.9	45%	0.454	57%	0.567	S	S	.	*			trans	-53.8	136.3	173	-54.6	-71.8	0	0	0	110.4	I323 Q392	H321-I323 PolarHBondContact O-N 3.48Å; H321-Q392 PolarHBondContact CE1-OE1 3.38Å; H321-Q392 WeakPolarHBondContact ND1-CB 3.37Å; H321-Q392 PolarHBondContact NE2-OE1 2.99Å
322	P	77.8	Confident	63.1	Low	38 Å²	38	102 Å²	102	25%	0.247	56%	0.561	C	S	.	*			trans	-62	125.1	-175.2	26.8	-36.9	0	0	0	110.7	F324 L337 G394	P322-F324 HydrophobicContact CB-CD2 4.43Å; P322-F324 HydrophobicContact CB-CE1 4.39Å; P322-F324 HydrophobicContact CB-CE2 3.69Å; P322-F324 HydrophobicContact CB-CZ 3.68Å; P322-F324 HydrophobicContact CG-CE2 3.58Å; P322-F324 HydrophobicContact CG-CZ 3.77Å; P322-L337 HydrophobicContact CG-CD2 3.99Å; P322-G394 PolarHBondContact O-N 2.97Å
323	I	78.3	Confident	65.6	Low	119 Å²	119	94.9 Å²	94.9	61%	0.61	53%	0.528	S	S	*	.			trans	-96.5	103.6	174.7	-51.3	179.2	0	0	0	107.5	H321 K396	H321-I323 PolarHBondContact O-N 3.48Å; I323-K396 HydrophobicContact CG2-CD 4.3Å; I323-K396 HydrophobicContact CG2-CG 4.18Å
324	F	79.4	Confident	68.1	Low	17 Å²	17	90.4 Å²	90.4	8%	0.075	50%	0.496	C	S	.	.			trans	-81	157.8	175	-57.9	-81.8	0	0	0	110.8	P322 I333 L336 L337 Y393 K396	P322-F324 HydrophobicContact CB-CD2 4.43Å; P322-F324 HydrophobicContact CB-CE1 4.39Å; P322-F324 HydrophobicContact CB-CE2 3.69Å; P322-F324 HydrophobicContact CB-CZ 3.68Å; P322-F324 HydrophobicContact CG-CE2 3.58Å; P322-F324 HydrophobicContact CG-CZ 3.77Å; F324-I333 HydrophobicContact CB-CD1 4.32Å; F324-I333 HydrophobicContact CB-CG1 4.08Å; F324-I333 HydrophobicContact CD1-CG1 3.99Å; F324-I333 HydrophobicContact CD2-CB 4.47Å; F324-I333 HydrophobicContact CD2-CG1 4.15Å; F324-I333 HydrophobicContact CD2-CG2 3.8Å; F324-I333 HydrophobicContact CE1-CG1 4.49Å; F324-I333 HydrophobicContact CE1-CG2 4.49Å; F324-I333 HydrophobicContact CE2-CB 4.49Å; F324-I333 HydrophobicContact CE2-CG2 3.65Å; F324-I333 HydrophobicContact CG-CB 4.48Å; F324-I333 HydrophobicContact CG-CD1 4.45Å; F324-I333 HydrophobicContact CG-CG1 3.8Å; F324-I333 HydrophobicContact CG-CG2 4.29Å; F324-I333 HydrophobicContact CZ-CG2 4.02Å; F324-L336 HydrophobicContact CD1-CD1 4.43Å; F324-L336 HydrophobicContact CE1-CB 3.83Å; F324-L336 HydrophobicContact CE1-CD1 3.76Å; F324-L336 HydrophobicContact CE1-CG 4.45Å; F324-L336 HydrophobicContact CZ-CB 4.09Å; F324-L337 HydrophobicContact CE2-CD2 4.14Å; F324-L337 HydrophobicContact CZ-CD2 4.28Å; F324-Y393 HydrophobicContact CD2-CD2 4.32Å; F324-Y393 HydrophobicContact CE2-CG 4.5Å; F324-K396 VanDerWaalsContact O-CB 3.26Å; F324-K396 WeakPolarHBondContact O-CB 3.44Å; F324-K396 WeakPolarHBondContact O-CD 3.44Å; F324-K396 WeakPolarHBondContact O-CG 3.35Å
325	D	75.7	Confident	70.5	Confident	82 Å²	82	86.7 Å²	86.7	44%	0.439	48%	0.482	S	S	.	.			trans	-87.1	161.6	176.5	-76.4	-42.2	0	0	0	112.6	S327 S328 K396	D325-S327 PolarHBondContact O-N 3.05Å; D325-S328 WeakPolarHBondContact O-CB 3.43Å; D325-S328 PolarHBondContact O-N 3.09Å; D325-K396 VanDerWaalsContact OD1-CD 3.23Å; D325-K396 WeakPolarHBondContact OD1-CD 3.37Å; D325-K396 WeakPolarHBondContact OD1-CE 3.47Å; D325-K396 IonicContact OD1-NZ 2.6Å; D325-K396 PolarHBondContact OD1-NZ 2.88Å
326	E	71.4	Confident	73.1	Confident	141 Å²	141	85.6 Å²	85.6	66%	0.659	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-26.3	-175.7	-172.8	170.4	-168	0	0	113	K396	E326-K396 WeakPolarHBondContact CA-O 3.12Å; E326-K396 WeakPolarHBondContact CB-O 3.47Å; E326-K396 WeakPolarHBondContact CG-O 3.41Å
327	S	74.2	Confident	75.8	Confident	113 Å²	113	82 Å²	82	79%	0.79	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.6	-9.4	174.3	54.3	0	0	0	0	114.9	D325	D325-S327 PolarHBondContact O-N 3.05Å
328	S	79.4	Confident	78.4	Confident	15 Å²	15	79.6 Å²	79.6	11%	0.105	41%	0.411	C	S	.	.			trans	-72.5	133.8	-177.6	-80	0	0	0	0	112	D325 E332	D325-S328 WeakPolarHBondContact O-CB 3.43Å; D325-S328 PolarHBondContact O-N 3.09Å; S328-E332 WeakPolarHBondContact CA-OE2 3.28Å; S328-E332 WeakPolarHBondContact CB-OE2 3.45Å; S328-E332 PolarHBondContact OG-OE2 3.4Å
329	S	85.4	Confident	80.6	Confident	53 Å²	53	76.1 Å²	76.1	37%	0.371	39%	0.391	S	S	.	.			trans	-80.2	146.4	-179.3	-174.6	0	0	0	0	111.5	K331 E332 I333	S329-K331 PolarHBondContact O-N 3.27Å; S329-E332 WeakPolarHBondContact O-CB 3.19Å; S329-E332 PolarHBondContact O-N 3.22Å; S329-I333 WeakPolarHBondContact O-CG1 3.28Å; S329-I333 PolarHBondContact O-N 2.76Å
330	D	85.7	Confident	82.6	Confident	34 Å²	34	77.6 Å²	77.6	18%	0.182	39%	0.389	C	S	.	.	H	α-helix	trans	-37.7	-42.1	168.8	-92.1	-4.9	0	0	0	113.8	L334 Y399 L402	D330-L334 WeakPolarHBondContact O-CB 3.45Å; D330-L334 PolarHBondContact O-N 3.15Å; D330-Y399 WeakPolarHBondContact OD1-CB 3.41Å; D330-Y399 VanDerWaalsContact OD1-CD2 3.24Å; D330-Y399 WeakPolarHBondContact OD1-CD2 3.44Å; D330-L402 VanDerWaalsContact OD1-CD2 3.28Å; D330-L402 WeakPolarHBondContact OD1-CD2 3.21Å
331	K	87.1	Confident	83.9	Confident	154 Å²	154	77.4 Å²	77.4	67%	0.67	39%	0.389	S	S	*	.	H	α-helix	trans	-71.2	-45.6	-179.1	-63.2	-178.8	179.7	-179.7	0	112.8	S329 I333 L334 D335	S329-K331 PolarHBondContact O-N 3.27Å; K331-I333 VanDerWaalsContact C-N 3.34Å; K331-L334 PolarHBondContact O-N 2.82Å; K331-D335 WeakPolarHBondContact O-CB 3.32Å; K331-D335 PolarHBondContact O-N 2.83Å
332	E	87.8	Confident	84.7	Confident	97 Å²	97	76.5 Å²	76.5	45%	0.453	38%	0.381	S	S	.	.	H	α-helix	trans	-63.1	-43.8	177.6	176.2	-176.4	-131.6	0	0	110.5	S328 S329 L336	S328-E332 WeakPolarHBondContact CA-OE2 3.28Å; S328-E332 WeakPolarHBondContact CB-OE2 3.45Å; S328-E332 PolarHBondContact OG-OE2 3.4Å; S329-E332 WeakPolarHBondContact O-CB 3.19Å; S329-E332 PolarHBondContact O-N 3.22Å; E332-L336 HydrophobicContact CG-CD1 4.09Å; E332-L336 WeakPolarHBondContact O-CB 3.49Å; E332-L336 VanDerWaalsContact O-CG 3.32Å; E332-L336 WeakPolarHBondContact O-CG 3.49Å; E332-L336 PolarHBondContact O-N 2.87Å; E332-L336 VanDerWaalsContact O-N 3.08Å
333	I	88.8	Confident	85.5	Confident	0 Å²	0	75.2 Å²	75.2	0%	0	37%	0.371	C	S	.	.	H	α-helix	trans	-56.9	-53.9	172.1	-62.1	172.7	0	0	0	109.2	F324 S329 K331 D335 L336 L337 Y393 L402	F324-I333 HydrophobicContact CB-CD1 4.32Å; F324-I333 HydrophobicContact CB-CG1 4.08Å; F324-I333 HydrophobicContact CD1-CG1 3.99Å; F324-I333 HydrophobicContact CD2-CB 4.47Å; F324-I333 HydrophobicContact CD2-CG1 4.15Å; F324-I333 HydrophobicContact CD2-CG2 3.8Å; F324-I333 HydrophobicContact CE1-CG1 4.49Å; F324-I333 HydrophobicContact CE1-CG2 4.49Å; F324-I333 HydrophobicContact CE2-CB 4.49Å; F324-I333 HydrophobicContact CE2-CG2 3.65Å; F324-I333 HydrophobicContact CG-CB 4.48Å; F324-I333 HydrophobicContact CG-CD1 4.45Å; F324-I333 HydrophobicContact CG-CG1 3.8Å; F324-I333 HydrophobicContact CG-CG2 4.29Å; F324-I333 HydrophobicContact CZ-CG2 4.02Å; S329-I333 WeakPolarHBondContact O-CG1 3.28Å; S329-I333 PolarHBondContact O-N 2.76Å; K331-I333 VanDerWaalsContact C-N 3.34Å; I333-D335 PolarHBondContact O-N 2.72Å; I333-L336 CarbonylContact O-C 3.57Å; I333-L336 PolarHBondContact O-N 2.91Å; I333-L337 HydrophobicContact CG2-CD1 4.14Å; I333-L337 HydrophobicContact CG2-CG 4.23Å; I333-L337 VanDerWaalsContact O-CG 3.28Å; I333-L337 WeakPolarHBondContact O-CG 3.39Å; I333-L337 PolarHBondContact O-N 2.87Å; I333-Y393 HydrophobicContact CG2-CD2 4.37Å; I333-L402 HydrophobicContact CB-CD1 4.35Å; I333-L402 HydrophobicContact CB-CD2 4.2Å; I333-L402 HydrophobicContact CD1-CD2 4.17Å; I333-L402 HydrophobicContact CG2-CD1 3.5Å; I333-L402 HydrophobicContact CG2-CD2 3.85Å; I333-L402 HydrophobicContact CG2-CG 4.33Å
334	L	90.2	Very high	86.2	Confident	3 Å²	3	72.5 Å²	72.5	2%	0.016	36%	0.358	C	S	.	.	H	α-helix	trans	-64.8	-40.1	-175.8	-173.1	62.1	0	0	0	113.7	D330 K331 L336 L337 L338 A404 H407 I437	D330-L334 WeakPolarHBondContact O-CB 3.45Å; D330-L334 PolarHBondContact O-N 3.15Å; K331-L334 PolarHBondContact O-N 2.82Å; L334-L336 VanDerWaalsContact C-N 3.34Å; L334-L337 PolarHBondContact O-N 2.9Å; L334-L338 HydrophobicContact CD1-CD1 3.73Å; L334-L338 HydrophobicContact CD1-CG 4.07Å; L334-L338 HydrophobicContact CG-CD1 3.88Å; L334-L338 HydrophobicContact CG-CG 4.46Å; L334-L338 WeakPolarHBondContact O-CB 3.36Å; L334-L338 VanDerWaalsContact O-CG 3.32Å; L334-L338 WeakPolarHBondContact O-CG 3.17Å; L334-L338 PolarHBondContact O-N 2.89Å; L334-A404 HydrophobicContact CD1-CB 4.02Å; L334-A404 HydrophobicContact CD2-CB 3.81Å; L334-H407 HydrophobicContact CD2-CB 4.07Å; L334-I437 HydrophobicContact CD1-CD1 3.71Å
335	D	90.1	Very high	86.9	Confident	94 Å²	94	76.2 Å²	76.2	50%	0.503	37%	0.374	S	S	.	.	H	α-helix	trans	-65.3	-37.8	176.2	-75.4	-31.6	0	0	0	111.4	K331 I333 L338 E339 H407	K331-D335 WeakPolarHBondContact O-CB 3.32Å; K331-D335 PolarHBondContact O-N 2.83Å; I333-D335 PolarHBondContact O-N 2.72Å; D335-L338 PolarHBondContact O-N 3.31Å; D335-E339 PolarHBondContact O-N 2.92Å; D335-H407 IonicContact OD1-CE1 2.85Å; D335-H407 PolarHBondContact OD1-CE1 3.07Å
336	L	89.4	Confident	87.7	Confident	87 Å²	87	81.9 Å²	81.9	46%	0.455	39%	0.39	S	S	.	.	H	α-helix	trans	-74.5	-26.6	172.7	-70.2	168.9	0	0	0	113	F324 E332 I333 L334 R342	F324-L336 HydrophobicContact CD1-CD1 4.43Å; F324-L336 HydrophobicContact CE1-CB 3.83Å; F324-L336 HydrophobicContact CE1-CD1 3.76Å; F324-L336 HydrophobicContact CE1-CG 4.45Å; F324-L336 HydrophobicContact CZ-CB 4.09Å; E332-L336 HydrophobicContact CG-CD1 4.09Å; E332-L336 WeakPolarHBondContact O-CB 3.49Å; E332-L336 VanDerWaalsContact O-CG 3.32Å; E332-L336 WeakPolarHBondContact O-CG 3.49Å; E332-L336 PolarHBondContact O-N 2.87Å; E332-L336 VanDerWaalsContact O-N 3.08Å; I333-L336 CarbonylContact O-C 3.57Å; I333-L336 PolarHBondContact O-N 2.91Å; L334-L336 VanDerWaalsContact C-N 3.34Å; L336-R342 PolarHBondContact O-NH1 3.36Å
337	L	90.8	Very high	88.7	Confident	0 Å²	0	80.3 Å²	80.3	0%	0	39%	0.385	C	S	.	.	H	α-helix	trans	-70.2	-35.3	170.3	-71.8	-175.1	0	0	0	112.5	P322 F324 I333 L334 L391 Y393 L402	P322-L337 HydrophobicContact CG-CD2 3.99Å; F324-L337 HydrophobicContact CE2-CD2 4.14Å; F324-L337 HydrophobicContact CZ-CD2 4.28Å; I333-L337 HydrophobicContact CG2-CD1 4.14Å; I333-L337 HydrophobicContact CG2-CG 4.23Å; I333-L337 VanDerWaalsContact O-CG 3.28Å; I333-L337 WeakPolarHBondContact O-CG 3.39Å; I333-L337 PolarHBondContact O-N 2.87Å; L334-L337 PolarHBondContact O-N 2.9Å; L337-L391 HydrophobicContact CB-CD2 4.09Å; L337-Y393 HydrophobicContact CD1-CD1 4.11Å; L337-L402 HydrophobicContact CD1-CD1 3.4Å
338	L	93.1	Very high	89.6	Confident	22 Å²	22	77.3 Å²	77.3	12%	0.115	36%	0.36	C	S	.	.	S	Bend	trans	-101.3	15.3	-174.4	-59.9	177.1	0	0	0	113.8	L334 D335 K340 Y343 L391 H407 I411	L334-L338 HydrophobicContact CD1-CD1 3.73Å; L334-L338 HydrophobicContact CD1-CG 4.07Å; L334-L338 HydrophobicContact CG-CD1 3.88Å; L334-L338 HydrophobicContact CG-CG 4.46Å; L334-L338 WeakPolarHBondContact O-CB 3.36Å; L334-L338 VanDerWaalsContact O-CG 3.32Å; L334-L338 WeakPolarHBondContact O-CG 3.17Å; L334-L338 PolarHBondContact O-N 2.89Å; D335-L338 PolarHBondContact O-N 3.31Å; L338-K340 PolarHBondContact O-N 3.21Å; L338-Y343 HydrophobicContact CD2-CD1 3.78Å; L338-Y343 HydrophobicContact CD2-CE1 4.06Å; L338-Y343 HydrophobicContact CD2-CG 4.19Å; L338-L391 HydrophobicContact CD2-CD2 3.83Å; L338-H407 HydrophobicContact CD1-CB 3.72Å; L338-I411 HydrophobicContact CD1-CD1 4.29Å; L338-I411 HydrophobicContact CD1-CG1 4.08Å; L338-I411 HydrophobicContact CD2-CG1 3.73Å
339	E	91.8	Very high	90.3	Very high	78 Å²	78	76.7 Å²	76.7	36%	0.364	36%	0.356	S	S	.	.			trans	-60	127.7	174.8	-166.9	-167.7	174.2	0	0	110.3	D335 K341 R342 Y343	D335-E339 PolarHBondContact O-N 2.92Å; E339-K341 PolarHBondContact O-N 3.46Å; E339-K341 WeakPolarHBondContact OE1-CD 3.43Å; E339-K341 VanDerWaalsContact OE1-CE 3.27Å; E339-K341 WeakPolarHBondContact OE1-CE 3.45Å; E339-K341 IonicContact OE1-NZ 2.87Å; E339-K341 PolarHBondContact OE1-NZ 2.69Å; E339-R342 PolarHBondContact O-N 3.3Å; E339-Y343 PolarHBondContact O-N 2.81Å
340	K	86.7	Confident	90.6	Very high	198 Å²	198	78 Å²	78	86%	0.861	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-17.6	-176.1	-63.8	-179.2	-178.9	175.6	0	115.5	L338 R342	L338-K340 PolarHBondContact O-N 3.21Å; K340-R342 VanDerWaalsContact C-N 3.3Å
341	K	87.1	Confident	90.8	Very high	183 Å²	183	78.4 Å²	78.4	80%	0.796	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.7	-22	173.1	-61	-171.8	-164.5	120.6	0	113	E339	E339-K341 PolarHBondContact O-N 3.46Å; E339-K341 WeakPolarHBondContact OE1-CD 3.43Å; E339-K341 VanDerWaalsContact OE1-CE 3.27Å; E339-K341 WeakPolarHBondContact OE1-CE 3.45Å; E339-K341 IonicContact OE1-NZ 2.87Å; E339-K341 PolarHBondContact OE1-NZ 2.69Å
342	R	88.8	Confident	90.8	Very high	79 Å²	79	79.6 Å²	79.6	30%	0.298	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-121.1	-27.2	-166.7	-150.4	-159.5	83.1	-171.5	18.6	113.1	L336 E339 K340 R390	L336-R342 PolarHBondContact O-NH1 3.36Å; E339-R342 PolarHBondContact O-N 3.3Å; K340-R342 VanDerWaalsContact C-N 3.3Å; R342-R390 PolarHBondContact NH2-O 2.94Å
343	Y	94.3	Very high	90.9	Very high	10 Å²	10	78.1 Å²	78.1	4%	0.039	39%	0.391	C	S	.	.			trans	-128.8	117.4	178.5	-165.8	-96.1	0	0	0	111.5	L338 E339 K345 D388 R390 L391 W412	L338-Y343 HydrophobicContact CD2-CD1 3.78Å; L338-Y343 HydrophobicContact CD2-CE1 4.06Å; L338-Y343 HydrophobicContact CD2-CG 4.19Å; E339-Y343 PolarHBondContact O-N 2.81Å; Y343-K345 HydrophobicContact CE1-CB 3.88Å; Y343-D388 WeakPolarHBondContact CE2-OD2 3.36Å; Y343-D388 PolarHBondContact OH-OD2 2.64Å; Y343-R390 HydrophobicContact CD2-CB 3.8Å; Y343-R390 HydrophobicContact CE2-CB 3.92Å; Y343-L391 HydrophobicContact CD2-CD2 3.7Å; Y343-L391 HydrophobicContact CD2-CG 4.12Å; Y343-L391 HydrophobicContact CE2-CD1 3.93Å; Y343-L391 HydrophobicContact CE2-CD2 3.7Å; Y343-L391 HydrophobicContact CE2-CG 3.66Å; Y343-L391 HydrophobicContact CG-CD2 4.31Å; Y343-W412 WeakPolarHBondContact OH-CB 3.15Å; Y343-W412 PolarHBondContact OH-N 3.24Å
344	D	93.3	Very high	91.1	Very high	63 Å²	63	80.8 Å²	80.8	34%	0.337	41%	0.407	S	S	.	.			trans	-112.9	111.7	164.5	-172.2	-7	0	0	0	109.9	R346 L347 R390	D344-R346 PolarHBondContact O-N 3.23Å; D344-R346 VanDerWaalsContact O-N 3.08Å; D344-R346 VanDerWaalsContact OD1-CB 3.27Å; D344-R346 WeakPolarHBondContact OD1-CB 3.15Å; D344-R346 WeakPolarHBondContact OD1-CD 3.46Å; D344-R346 VanDerWaalsContact OD1-CG 3.25Å; D344-R346 WeakPolarHBondContact OD1-CG 3.42Å; D344-R346 PolarHBondContact OD1-N 3.29Å; D344-L347 HydrophobicContact CB-CD1 4.31Å; D344-L347 HydrophobicContact CB-CG 4.32Å; D344-L347 PolarHBondContact O-N 3.04Å; D344-R390 PolarHBondContact O-NH1 2.94Å; D344-R390 VanDerWaalsContact O-NH1 3.09Å
345	K	93.6	Very high	91.4	Very high	94 Å²	94	80.8 Å²	80.8	41%	0.409	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-7.6	177.1	75	163.2	-159.6	164	0	114.9	Y343 D409 W412	Y343-K345 HydrophobicContact CE1-CB 3.88Å; K345-D409 VanDerWaalsContact CD-O 3.29Å; K345-D409 WeakPolarHBondContact CD-O 3.27Å; K345-D409 VanDerWaalsContact CE-O 3.29Å; K345-D409 WeakPolarHBondContact CE-O 3.35Å; K345-D409 PolarHBondContact NZ-O 2.89Å; K345-W412 HydrophobicContact CB-CB 4.48Å; K345-W412 VanDerWaalsContact O-CD1 3.24Å
346	R	92.1	Very high	91.7	Very high	201 Å²	201	79.3 Å²	79.3	76%	0.758	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.5	-22	176.5	-63.2	164.6	172.6	169.4	-4.5	112.6	D344	D344-R346 PolarHBondContact O-N 3.23Å; D344-R346 VanDerWaalsContact O-N 3.08Å; D344-R346 VanDerWaalsContact OD1-CB 3.27Å; D344-R346 WeakPolarHBondContact OD1-CB 3.15Å; D344-R346 WeakPolarHBondContact OD1-CD 3.46Å; D344-R346 VanDerWaalsContact OD1-CG 3.25Å; D344-R346 WeakPolarHBondContact OD1-CG 3.42Å; D344-R346 PolarHBondContact OD1-N 3.29Å
347	L	92.6	Very high	92	Very high	109 Å²	109	75.2 Å²	75.2	57%	0.571	38%	0.38	S	S	*	.	S	Bend	trans	-88.7	133.4	179.8	-57.8	178.1	0	0	0	109.6	D344 R390	D344-L347 HydrophobicContact CB-CD1 4.31Å; D344-L347 HydrophobicContact CB-CG 4.32Å; D344-L347 PolarHBondContact O-N 3.04Å; L347-R390 PolarHBondContact O-NH1 2.84Å; L347-R390 PolarHBondContact O-NH2 2.94Å
348	L	93.4	Very high	92.2	Very high	49 Å²	49	77.8 Å²	77.8	26%	0.257	39%	0.394	S	S	.	.	P	Polyproline II helix	trans	-54.5	139.6	171.2	-172.5	72.2	0	0	0	109.5	L355 W412 Y478 Q482 I483	L348-L355 HydrophobicContact CD1-CD2 4.05Å; L348-W412 HydrophobicContact CD1-CH2 4.28Å; L348-W412 HydrophobicContact CD1-CZ2 3.6Å; L348-Y478 HydrophobicContact CD1-CD1 4.43Å; L348-Y478 HydrophobicContact CD1-CE1 4.09Å; L348-Q482 HydrophobicContact CD2-CB 4.42Å; L348-I483 HydrophobicContact CD1-CD1 3.87Å; L348-I483 HydrophobicContact CD1-CG1 4.02Å
349	P	94.9	Very high	92.3	Very high	3 Å²	3	76.8 Å²	76.8	2%	0.019	39%	0.389	C	S	.	.	P	Polyproline II helix	trans	-51.1	127.4	174.4	-31	36.7	0	0	0	112.3	V351 L355 D388 W412	P349-V351 HydrophobicContact CB-CG1 4.47Å; P349-V351 PolarHBondContact O-N 3.03Å; P349-L355 HydrophobicContact CB-CD1 4.39Å; P349-L355 HydrophobicContact CB-CD2 4.23Å; P349-L355 HydrophobicContact CG-CD2 3.85Å; P349-D388 HydrophobicContact CB-CB 4.13Å; P349-D388 HydrophobicContact CG-CB 4.18Å; P349-W412 VanDerWaalsContact CD-CD2 3.45Å; P349-W412 HydrophobicContact CG-CD2 3.8Å; P349-W412 HydrophobicContact CG-CE3 3.51Å; P349-W412 HydrophobicContact CG-CG 4.35Å; P349-W412 HydrophobicContact CG-CH2 4.49Å; P349-W412 HydrophobicContact CG-CZ3 3.9Å
350	P	92	Very high	92.4	Very high	80 Å²	80	73.8 Å²	73.8	52%	0.519	38%	0.375	S	S	.	.			trans	-75.2	93.5	-178.5	29.9	-33.8	0	0	0	109.8	R390	P350-R390 HydrophobicContact CG-CG 3.83Å
351	V	89.6	Confident	92.8	Very high	42 Å²	42	64.4 Å²	64.4	26%	0.255	33%	0.334	S	S	.	.			trans	-116	154.2	178	-64.7	0	0	0	0	111.2	P349 G353 L355 P389	P349-V351 HydrophobicContact CB-CG1 4.47Å; P349-V351 PolarHBondContact O-N 3.03Å; V351-G353 PolarHBondContact O-N 3.02Å; V351-L355 HydrophobicContact CG1-CD1 3.99Å; V351-L355 HydrophobicContact CG2-CB 3.94Å; V351-L355 HydrophobicContact CG2-CD1 4.19Å; V351-P389 HydrophobicContact CG1-CG 4.44Å
352	N	87.2	Confident	93	Very high	180 Å²	180	57.5 Å²	57.5	96%	0.963	31%	0.306	S	S	*	.	S	Bend	trans	-76.8	93.1	178.2	-70.1	-18.9	0	0	0	110.1
353	G	89.8	Confident	93.1	Very high	65 Å²	65	53.8 Å²	53.8	67%	0.67	29%	0.292	S	S	*	.	S	Bend	trans	96	-136.4	-176.7	0	0	0	0	0	112	V351	V351-G353 PolarHBondContact O-N 3.02Å
354	T	93.3	Very high	92.8	Very high	57 Å²	57	55.3 Å²	55.3	35%	0.35	30%	0.301	S	S	.	.			trans	-83.4	138	-174.3	-52.6	0	0	0	0	112.3	T356 E480 A481 K484	T354-T356 PolarHBondContact O-N 2.99Å; T354-E480 WeakPolarHBondContact CG2-O 3.16Å; T354-A481 WeakPolarHBondContact CB-O 3.4Å; T354-A481 PolarHBondContact OG1-O 2.75Å; T354-K484 HydrophobicContact CG2-CB 3.69Å
355	L	95.8	Very high	92.6	Very high	3 Å²	3	53.5 Å²	53.5	2%	0.016	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	106.2	173	-178.3	62.8	0	0	0	110.8	L348 P349 V351 W386 W412 Q482 I483 K484	L348-L355 HydrophobicContact CD1-CD2 4.05Å; P349-L355 HydrophobicContact CB-CD1 4.39Å; P349-L355 HydrophobicContact CB-CD2 4.23Å; P349-L355 HydrophobicContact CG-CD2 3.85Å; V351-L355 HydrophobicContact CG1-CD1 3.99Å; V351-L355 HydrophobicContact CG2-CB 3.94Å; V351-L355 HydrophobicContact CG2-CD1 4.19Å; L355-W386 HydrophobicContact CD1-CB 4.34Å; L355-W412 HydrophobicContact CD2-CH2 3.39Å; L355-W412 HydrophobicContact CD2-CZ2 4.16Å; L355-W412 HydrophobicContact CD2-CZ3 3.65Å; L355-Q482 WeakPolarHBondContact CB-O 3.5Å; L355-Q482 PolarHBondContact N-O 2.89Å; L355-I483 HydrophobicContact CB-CG1 4.46Å; L355-I483 WeakPolarHBondContact O-CA 3.4Å; L355-K484 PolarHBondContact O-N 3.15Å
356	T	95.4	Very high	92.4	Very high	63 Å²	63	49.3 Å²	49.3	39%	0.387	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	127.5	173	-54.4	0	0	0	0	111	T354 K484 V486	T354-T356 PolarHBondContact O-N 2.99Å; T356-K484 CarbonylContact C-O 3.52Å; T356-K484 WeakPolarHBondContact CA-O 3.4Å; T356-V486 HydrophobicContact CG2-CB 4.16Å; T356-V486 HydrophobicContact CG2-CG2 3.77Å
357	V	96.4	Very high	92.2	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	106	171.8	-176.5	0	0	0	0	108.3	V359 Q384 Q385 W386 P414 I483 K484 Y485 V486	V357-V359 HydrophobicContact CG1-CG2 4.3Å; V357-Q384 HydrophobicContact CG1-CB 4.31Å; V357-Q385 CarbonylContact C-O 3.6Å; V357-Q385 WeakPolarHBondContact CA-O 3.41Å; V357-W386 HydrophobicContact CG2-CB 4.23Å; V357-P414 HydrophobicContact CG1-CB 4.49Å; V357-P414 HydrophobicContact CG1-CG 4.16Å; V357-P414 HydrophobicContact CG2-CB 4.07Å; V357-P414 HydrophobicContact CG2-CG 4.44Å; V357-I483 HydrophobicContact CG2-CG2 3.88Å; V357-K484 PolarHBondContact N-O 2.82Å; V357-Y485 HydrophobicContact CB-CD1 3.77Å; V357-Y485 HydrophobicContact CB-CE1 4Å; V357-Y485 HydrophobicContact CG1-CD1 3.83Å; V357-Y485 HydrophobicContact CG1-CE1 3.85Å; V357-Y485 HydrophobicContact CG2-CD1 4.49Å; V357-Y485 HydrophobicContact CG2-CE1 4.34Å; V357-Y485 WeakPolarHBondContact O-CA 3.37Å; V357-V486 PolarHBondContact O-N 3.12Å
358	N	95.6	Very high	91.8	Very high	54 Å²	54	35.4 Å²	35.4	29%	0.289	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75	131.3	174.9	-64.5	-27.1	0	0	0	109.6	Q384 Q385 V486	N358-Q384 CarbonylContact O-C 3.58Å; N358-Q384 WeakPolarHBondContact O-CA 3.48Å; N358-Q385 HydrophobicContact CB-CB 4.26Å; N358-Q385 PolarHBondContact N-O 3.07Å; N358-Q385 PolarHBondContact O-N 3.22Å; N358-V486 CarbonylContact C-O 3.59Å; N358-V486 WeakPolarHBondContact CA-O 3.16Å
359	V	95.5	Very high	91.1	Very high	1 Å²	1	36.1 Å²	36.1	1%	0.006	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	141.1	-174.8	-177	0	0	0	0	111.4	V357 L382 N383 M473 Y485 V486 W487 K488 L527	V357-V359 HydrophobicContact CG1-CG2 4.3Å; V359-L382 HydrophobicContact CG1-CD1 3.55Å; V359-L382 HydrophobicContact CG1-CG 4.47Å; V359-N383 WeakPolarHBondContact CA-O 3.37Å; V359-M473 HydrophobicContact CG1-CE 4.36Å; V359-Y485 HydrophobicContact CG2-CD1 3.84Å; V359-V486 PolarHBondContact N-O 2.79Å; V359-W487 HydrophobicContact CB-CE3 4.33Å; V359-W487 HydrophobicContact CB-CZ3 4.4Å; V359-W487 HydrophobicContact CG1-CE3 4.29Å; V359-W487 HydrophobicContact CG1-CZ3 3.87Å; V359-K488 WeakPolarHBondContact O-CB 3.47Å; V359-K488 PolarHBondContact O-N 3.24Å; V359-L527 HydrophobicContact CB-CD1 3.77Å; V359-L527 HydrophobicContact CG1-CD1 4.35Å; V359-L527 HydrophobicContact CG2-CD1 3.84Å
360	N	93.6	Very high	90.2	Very high	16 Å²	16	40.9 Å²	40.9	9%	0.086	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	141.1	174.9	166.8	-57.5	0	0	0	109	N383 K488 D492	N360-N383 HydrophobicContact CB-CB 4.1Å; N360-N383 PolarHBondContact N-O 3.47Å; N360-N383 PolarHBondContact O-N 2.96Å; N360-N383 PolarHBondContact OD1-ND2 2.92Å; N360-N383 VanDerWaalsContact OD1-ND2 3.11Å; N360-K488 HydrophobicContact CB-CB 4.43Å; N360-D492 PolarHBondContact ND2-O 2.9Å
361	V	93.7	Very high	89.5	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	125.9	179.7	172.9	0	0	0	0	110.2	L363 F380 L382 M473 W487 T493 L494 R495	V361-L363 HydrophobicContact CG1-CD2 4.08Å; V361-F380 HydrophobicContact CG1-CB 3.88Å; V361-F380 HydrophobicContact CG1-CD2 3.86Å; V361-F380 HydrophobicContact CG1-CG 3.98Å; V361-L382 HydrophobicContact CG2-CD1 3.63Å; V361-M473 HydrophobicContact CG2-CE 4.19Å; V361-W487 HydrophobicContact CG2-CH2 4.22Å; V361-W487 HydrophobicContact CG2-CZ3 4.05Å; V361-T493 PolarHBondContact N-O 2.78Å; V361-L494 HydrophobicContact CB-CD1 3.73Å; V361-L494 HydrophobicContact CG1-CD1 3.55Å; V361-L494 CarbonylContact O-C 3.58Å; V361-L494 VanDerWaalsContact O-CA 3.32Å; V361-L494 WeakPolarHBondContact O-CA 3.02Å; V361-R495 PolarHBondContact O-N 3.15Å; V361-R495 VanDerWaalsContact O-N 3.09Å
362	L	91.6	Very high	88.7	Confident	39 Å²	39	36.3 Å²	36.3	20%	0.204	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	109.2	170.7	172.3	65.7	0	0	0	109.6	L364 F380 L381 R495	L362-L364 HydrophobicContact CD2-CD2 4.17Å; L362-L364 HydrophobicContact CG-CD2 4.25Å; L362-L364 PolarHBondContact O-N 2.82Å; L362-F380 CarbonylContact O-C 3.57Å; L362-F380 WeakPolarHBondContact O-CA 3.47Å; L362-F380 WeakPolarHBondContact O-CB 3.37Å; L362-L381 HydrophobicContact CB-CB 4.37Å; L362-L381 HydrophobicContact CD2-CD1 4.27Å; L362-L381 PolarHBondContact N-O 2.85Å; L362-L381 PolarHBondContact O-N 2.91Å; L362-R495 HydrophobicContact CD1-CB 3.59Å
363	L	91.4	Very high	88.5	Confident	0 Å²	0	28.6 Å²	28.6	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	117.1	175.4	-59	177.5	0	0	0	110	V361 L366 V378 F380 L494 R495 K496 S497 L507 L531	V361-L363 HydrophobicContact CG1-CD2 4.08Å; L363-L366 HydrophobicContact CD1-CD1 4.46Å; L363-V378 HydrophobicContact CD2-CG1 4.38Å; L363-F380 HydrophobicContact CD2-CB 4.25Å; L363-L494 HydrophobicContact CD1-CD1 4.12Å; L363-L494 HydrophobicContact CD2-CD1 4.11Å; L363-L494 HydrophobicContact CG-CD1 3.86Å; L363-R495 PolarHBondContact N-O 3.01Å; L363-K496 HydrophobicContact CD1-CG 4.47Å; L363-S497 WeakPolarHBondContact O-CB 3.29Å; L363-S497 PolarHBondContact O-N 3.11Å; L363-L507 HydrophobicContact CD1-CD2 4.04Å; L363-L531 HydrophobicContact CD1-CD2 4.08Å
364	L	88.6	Confident	88.3	Confident	42 Å²	42	27 Å²	27	22%	0.22	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	-49.4	179	-64.6	-178.1	0	0	0	111.7	L362 E379 L381 R448 S497 L500	L362-L364 HydrophobicContact CD2-CD2 4.17Å; L362-L364 HydrophobicContact CG-CD2 4.25Å; L362-L364 PolarHBondContact O-N 2.82Å; L364-E379 HydrophobicContact CB-CG 4.38Å; L364-E379 HydrophobicContact CD1-CG 4.42Å; L364-E379 PolarHBondContact N-O 2.97Å; L364-L381 HydrophobicContact CD1-CD2 3.84Å; L364-L381 HydrophobicContact CD1-CG 3.96Å; L364-L381 HydrophobicContact CD2-CG 4.25Å; L364-L381 HydrophobicContact CG-CG 4.26Å; L364-R448 HydrophobicContact CD1-CG 4.17Å; L364-S497 PolarHBondContact O-OG 3.38Å; L364-L500 WeakPolarHBondContact O-CD1 3.29Å
365	S	88.6	Confident	88.1	Confident	26 Å²	26	29.9 Å²	29.9	18%	0.182	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	148.4	-175.4	-170.3	0	0	0	0	111.1	E379 L503	S365-E379 PolarHBondContact N-O 3Å; S365-E379 VanDerWaalsContact N-O 3.16Å; S365-E379 PolarHBondContact O-N 2.86Å; S365-L503 WeakPolarHBondContact OG-CD2 3.38Å
366	L	89.7	Confident	87.8	Confident	5 Å²	5	30 Å²	30	3%	0.026	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	123.4	-180	-59.8	171	0	0	0	107.8	L363 E377 V378 L500 L503 A505 L507 L531 F533	L363-L366 HydrophobicContact CD1-CD1 4.46Å; L366-E377 CarbonylContact C-O 3.3Å; L366-E377 WeakPolarHBondContact CA-O 3.32Å; L366-V378 HydrophobicContact CD2-CB 4.22Å; L366-V378 HydrophobicContact CD2-CG1 3.82Å; L366-V378 HydrophobicContact CD2-CG2 3.95Å; L366-L500 HydrophobicContact CD1-CD1 4.29Å; L366-L500 HydrophobicContact CD1-CD2 4.1Å; L366-L500 HydrophobicContact CG-CD1 4.1Å; L366-L503 WeakPolarHBondContact O-CB 3.35Å; L366-A505 HydrophobicContact CB-CB 3.98Å; L366-L507 HydrophobicContact CD1-CB 3.94Å; L366-L507 HydrophobicContact CD1-CD2 3.54Å; L366-L507 HydrophobicContact CD1-CG 4.26Å; L366-L531 HydrophobicContact CD2-CD1 4.26Å; L366-F533 HydrophobicContact CB-CE1 4.25Å; L366-F533 HydrophobicContact CD1-CE1 4.07Å; L366-F533 HydrophobicContact CD1-CZ 4.41Å; L366-F533 HydrophobicContact CD2-CZ 4.25Å
367	A	88.1	Confident	87.7	Confident	13 Å²	13	28.9 Å²	28.9	11%	0.107	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	152.9	-178.8	0	0	0	0	0	112.5	Y376 E377 L503	A367-Y376 CarbonylContact O-C 3.58Å; A367-Y376 VanDerWaalsContact O-CA 3.29Å; A367-Y376 WeakPolarHBondContact O-CA 3.41Å; A367-E377 HydrophobicContact CB-CB 4.26Å; A367-E377 PolarHBondContact N-O 3.27Å; A367-E377 PolarHBondContact O-N 2.73Å; A367-L503 HydrophobicContact CB-CD2 3.82Å
368	S	84.3	Confident	87.5	Confident	5 Å²	5	28.9 Å²	28.9	4%	0.035	16%	0.155	C	C	.	.			trans	-104.7	137.8	151.6	64.9	0	0	0	0	107.6	D370 N504	S368-D370 VanDerWaalsContact C-N 3.31Å; S368-N504 WeakPolarHBondContact CB-O 3.42Å; S368-N504 WeakPolarHBondContact OG-CB 3.31Å; S368-N504 PolarHBondContact OG-O 3.2Å
369	P	78.1	Confident	87.3	Confident	65 Å²	65	27.5 Å²	27.5	42%	0.422	15%	0.147	S	C	.	.	S	Bend	trans	-63.8	-38.9	173.6	-24	35.3	0	0	0	112.2	K375 E377	P369-K375 WeakPolarHBondContact CD-O 3.32Å; P369-E377 HydrophobicContact CG-CG 4.35Å
370	D	75.6	Confident	87.2	Confident	102 Å²	102	27.4 Å²	27.4	55%	0.545	15%	0.147	S	C	.	.	S	Bend	trans	-143.7	149	177.3	-59.9	-80.7	0	0	0	108.6	S368 S372 S373	S368-D370 VanDerWaalsContact C-N 3.31Å; D370-S372 PolarHBondContact O-N 3.15Å; D370-S373 WeakPolarHBondContact O-CB 3.49Å; D370-S373 PolarHBondContact O-N 3.19Å
371	E	77.6	Confident	87.2	Confident	23 Å²	23	27.5 Å²	27.5	11%	0.107	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-34	176.2	-72.9	-62.8	145.3	0	0	112.7	S373 R535 D536 Y539 Y540	E371-S373 PolarHBondContact O-N 2.74Å; E371-R535 PolarHBondContact O-NH1 3.44Å; E371-D536 WeakPolarHBondContact OE2-CB 3.47Å; E371-D536 PolarHBondContact OE2-N 3.42Å; E371-D536 VanDerWaalsContact OE2-N 3.15Å; E371-Y539 HydrophobicContact CB-CD1 3.76Å; E371-Y539 HydrophobicContact CB-CE1 3.96Å; E371-Y539 HydrophobicContact CB-CG 4.18Å; E371-Y539 HydrophobicContact CG-CD1 4.06Å; E371-Y539 HydrophobicContact CG-CD2 4.28Å; E371-Y539 HydrophobicContact CG-CG 3.95Å; E371-Y540 HydrophobicContact CB-CE2 4.31Å; E371-Y540 PolarHBondContact O-OH 2.83Å
372	S	73.8	Confident	87.3	Confident	3 Å²	3	27.5 Å²	27.5	2%	0.021	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-2	175.7	56.4	0	0	0	0	114.4	D370 Y540 T590	D370-S372 PolarHBondContact O-N 3.15Å; S372-Y540 VanDerWaalsContact CA-OH 3.27Å; S372-Y540 WeakPolarHBondContact CA-OH 3.39Å; S372-Y540 PolarHBondContact N-OH 2.99Å; S372-T590 WeakPolarHBondContact CB-O 3.42Å; S372-T590 WeakPolarHBondContact CB-OG1 3.38Å; S372-T590 WeakPolarHBondContact OG-CB 3.44Å; S372-T590 PolarHBondContact OG-O 2.88Å; S372-T590 PolarHBondContact OG-OG1 2.84Å
373	S	81.6	Confident	87.4	Confident	18 Å²	18	28.1 Å²	28.1	13%	0.126	15%	0.151	C	C	.	.			trans	-70.5	147.3	177.4	-170.5	0	0	0	0	112.1	D370 E371 K375 R535	D370-S373 WeakPolarHBondContact O-CB 3.49Å; D370-S373 PolarHBondContact O-N 3.19Å; E371-S373 PolarHBondContact O-N 2.74Å; S373-K375 WeakPolarHBondContact OG-CA 3.27Å; S373-K375 WeakPolarHBondContact OG-CB 3.39Å; S373-K375 PolarHBondContact OG-N 3.27Å; S373-K375 PolarHBondContact OG-O 2.81Å; S373-R535 PolarHBondContact O-NH1 2.92Å
374	L	85.2	Confident	87.7	Confident	33 Å²	33	28.3 Å²	28.3	17%	0.173	15%	0.152	C	C	.	.	S	Bend	trans	-100.5	-4.2	159.6	-58.2	-179.7	0	0	0	111.7	C455 L459 P592 V594	L374-C455 PolarHBondContact O-N 2.84Å; L374-L459 HydrophobicContact CD1-CD1 4.45Å; L374-L459 HydrophobicContact CD1-CD2 3.96Å; L374-L459 HydrophobicContact CD2-CD2 3.82Å; L374-P592 HydrophobicContact CD1-CG 3.67Å; L374-P592 HydrophobicContact CG-CG 3.84Å; L374-V594 HydrophobicContact CD1-CG2 4.47Å
375	K	89.3	Confident	88	Confident	117 Å²	117	29 Å²	29	51%	0.509	15%	0.154	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	128.9	174.1	-61.7	-173.5	177.4	-170.2	0	110.6	P369 S373 I452 L453	P369-K375 WeakPolarHBondContact CD-O 3.32Å; S373-K375 WeakPolarHBondContact OG-CA 3.27Å; S373-K375 WeakPolarHBondContact OG-CB 3.39Å; S373-K375 PolarHBondContact OG-N 3.27Å; S373-K375 PolarHBondContact OG-O 2.81Å; K375-I452 HydrophobicContact CB-CG2 4Å; K375-I452 HydrophobicContact CD-CG2 4.01Å; K375-I452 HydrophobicContact CG-CG2 4.39Å; K375-L453 CarbonylContact C-O 3.56Å; K375-L453 VanDerWaalsContact CA-O 3.26Å; K375-L453 WeakPolarHBondContact CA-O 3.45Å
376	Y	91.2	Very high	88.4	Confident	4 Å²	4	28.1 Å²	28.1	2%	0.016	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	132.5	174	-73.2	-102.5	0	0	0	109.5	A367 I452 L453 C455 P467 A505 F533	A367-Y376 CarbonylContact O-C 3.58Å; A367-Y376 VanDerWaalsContact O-CA 3.29Å; A367-Y376 WeakPolarHBondContact O-CA 3.41Å; Y376-I452 CarbonylContact O-C 3.58Å; Y376-L453 PolarHBondContact N-O 2.85Å; Y376-L453 PolarHBondContact O-N 2.92Å; Y376-C455 HydrophobicContact CD2-CB 3.95Å; Y376-C455 VanDerWaalsContact CD2-SG 3.51Å; Y376-C455 HydrophobicContact CE2-CB 4.37Å; Y376-P467 HydrophobicContact CE2-CB 4.33Å; Y376-P467 HydrophobicContact CE2-CG 3.96Å; Y376-P467 WeakPolarHBondContact OH-CG 3.39Å; Y376-A505 HydrophobicContact CD1-CB 4.06Å; Y376-A505 HydrophobicContact CE1-CB 4.24Å; Y376-F533 HydrophobicContact CD1-CD1 4.4Å; Y376-F533 HydrophobicContact CD1-CD2 4.37Å; Y376-F533 HydrophobicContact CD1-CG 4.32Å; Y376-F533 HydrophobicContact CE1-CB 4.26Å; Y376-F533 HydrophobicContact CE1-CD1 4.36Å; Y376-F533 HydrophobicContact CE1-CG 4.14Å
377	E	92.2	Very high	88.7	Confident	40 Å²	40	30.2 Å²	30.2	19%	0.187	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	128	173.9	-49.9	-164.6	141.3	0	0	109.3	L366 A367 P369 K425 H450 L451	L366-E377 CarbonylContact C-O 3.3Å; L366-E377 WeakPolarHBondContact CA-O 3.32Å; A367-E377 HydrophobicContact CB-CB 4.26Å; A367-E377 PolarHBondContact N-O 3.27Å; A367-E377 PolarHBondContact O-N 2.73Å; P369-E377 HydrophobicContact CG-CG 4.35Å; E377-K425 WeakPolarHBondContact OE1-CE 3.31Å; E377-K425 IonicContact OE1-NZ 3.65Å; E377-K425 PolarHBondContact OE1-NZ 3.09Å; E377-K425 IonicContact OE2-NZ 2.72Å; E377-K425 PolarHBondContact OE2-NZ 3.11Å; E377-H450 IonicContact OE2-NE2 3.63Å; E377-L451 CarbonylContact C-O 3.24Å; E377-L451 WeakPolarHBondContact CA-O 3.39Å
378	V	92.6	Very high	89.1	Confident	0 Å²	0	29.6 Å²	29.6	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	115.2	-176.3	177.5	0	0	0	0	108.8	L363 L366 F380 L451 L453 F471 L531	L363-V378 HydrophobicContact CD2-CG1 4.38Å; L366-V378 HydrophobicContact CD2-CB 4.22Å; L366-V378 HydrophobicContact CD2-CG1 3.82Å; L366-V378 HydrophobicContact CD2-CG2 3.95Å; V378-F380 HydrophobicContact CG1-CD1 4.09Å; V378-F380 HydrophobicContact CG1-CE1 4.44Å; V378-L451 PolarHBondContact N-O 2.82Å; V378-L451 PolarHBondContact O-N 3.14Å; V378-L453 HydrophobicContact CB-CD1 4.18Å; V378-L453 HydrophobicContact CG2-CD1 3.73Å; V378-L453 HydrophobicContact CG2-CG 4.25Å; V378-F471 HydrophobicContact CG1-CE1 4.31Å; V378-L531 HydrophobicContact CG1-CD1 3.94Å; V378-L531 HydrophobicContact CG2-CD1 4.18Å
379	E	91.9	Very high	89.5	Confident	25 Å²	25	31 Å²	31	12%	0.117	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	130.5	-177.9	-172.4	171.7	-123.7	0	0	111.3	L364 S365 R448 R449 H450	L364-E379 HydrophobicContact CB-CG 4.38Å; L364-E379 HydrophobicContact CD1-CG 4.42Å; L364-E379 PolarHBondContact N-O 2.97Å; S365-E379 PolarHBondContact N-O 3Å; S365-E379 VanDerWaalsContact N-O 3.16Å; S365-E379 PolarHBondContact O-N 2.86Å; E379-R448 HydrophobicContact CG-CG 4.31Å; E379-R448 IonicContact OE1-CZ 2.69Å; E379-R448 VanDerWaalsContact OE1-CZ 3.27Å; E379-R448 IonicContact OE1-NE 2.74Å; E379-R448 PolarHBondContact OE1-NE 3.46Å; E379-R448 IonicContact OE1-NH2 2.64Å; E379-R448 PolarHBondContact OE1-NH2 2.95Å; E379-R448 IonicContact OE2-CZ 2.72Å; E379-R448 IonicContact OE2-NE 3.36Å; E379-R448 IonicContact OE2-NH2 3.84Å; E379-R448 PolarHBondContact OE2-NH2 3.03Å; E379-R449 WeakPolarHBondContact CA-O 3.37Å; E379-H450 VanDerWaalsContact CD-ND1 3.25Å; E379-H450 HydrophobicContact CG-CB 4.43Å; E379-H450 IonicContact OE1-CE1 2.88Å; E379-H450 IonicContact OE1-CG 3.08Å; E379-H450 IonicContact OE1-ND1 3.61Å; E379-H450 PolarHBondContact OE1-ND1 2.82Å
380	F	92.9	Very high	90.3	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	160.1	-175.6	56.2	-85	0	0	0	112.9	V361 L362 L363 V378 L382 F418 R448 R449 L451 F471	V361-F380 HydrophobicContact CG1-CB 3.88Å; V361-F380 HydrophobicContact CG1-CD2 3.86Å; V361-F380 HydrophobicContact CG1-CG 3.98Å; L362-F380 CarbonylContact O-C 3.57Å; L362-F380 WeakPolarHBondContact O-CA 3.47Å; L362-F380 WeakPolarHBondContact O-CB 3.37Å; L363-F380 HydrophobicContact CD2-CB 4.25Å; V378-F380 HydrophobicContact CG1-CD1 4.09Å; V378-F380 HydrophobicContact CG1-CE1 4.44Å; F380-L382 HydrophobicContact CD2-CB 4.32Å; F380-L382 HydrophobicContact CE2-CB 4.17Å; F380-L382 HydrophobicContact CE2-CD1 4.48Å; F380-F418 AromaticContact CE2-CE1 3.97Å; F380-F418 HydrophobicContact CE2-CE1 3.97Å; F380-F418 HydrophobicContact CE2-CZ 4.39Å; F380-F418 HydrophobicContact CZ-CD1 4.4Å; F380-F418 AromaticContact CZ-CE1 3.7Å; F380-F418 HydrophobicContact CZ-CE1 3.7Å; F380-F418 HydrophobicContact CZ-CZ 4.38Å; F380-R448 WeakPolarHBondContact O-CA 3.46Å; F380-R449 HydrophobicContact CD2-CB 4.4Å; F380-R449 HydrophobicContact CE1-CB 4.17Å; F380-R449 HydrophobicContact CE2-CB 3.92Å; F380-R449 HydrophobicContact CE2-CG 4.19Å; F380-R449 HydrophobicContact CZ-CB 3.8Å; F380-R449 HydrophobicContact CZ-CG 4.36Å; F380-R449 PolarHBondContact N-O 3.29Å; F380-R449 PolarHBondContact O-N 3.18Å; F380-L451 HydrophobicContact CE1-CD1 3.67Å; F380-L451 HydrophobicContact CE1-CG 3.79Å; F380-L451 HydrophobicContact CZ-CD1 3.94Å; F380-L451 HydrophobicContact CZ-CG 4.26Å; F380-F471 HydrophobicContact CD1-CZ 4.28Å; F380-F471 HydrophobicContact CE1-CE1 4.34Å; F380-F471 AromaticContact CE1-CE2 3.95Å; F380-F471 HydrophobicContact CE1-CE2 3.95Å; F380-F471 AromaticContact CE1-CZ 3.71Å; F380-F471 HydrophobicContact CE1-CZ 3.71Å; F380-F471 HydrophobicContact CE2-CE2 4.2Å; F380-F471 HydrophobicContact CE2-CZ 4.42Å; F380-F471 HydrophobicContact CZ-CD2 4.36Å; F380-F471 AromaticContact CZ-CE2 3.57Å; F380-F471 HydrophobicContact CZ-CE2 3.57Å; F380-F471 AromaticContact CZ-CZ 3.8Å; F380-F471 HydrophobicContact CZ-CZ 3.8Å
381	L	93.6	Very high	91.1	Very high	18 Å²	18	25 Å²	25	9%	0.094	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	125.4	156.5	-56.6	-173.9	0	0	0	108.6	L362 L364 F433 M447 R448	L362-L381 HydrophobicContact CB-CB 4.37Å; L362-L381 HydrophobicContact CD2-CD1 4.27Å; L362-L381 PolarHBondContact N-O 2.85Å; L362-L381 PolarHBondContact O-N 2.91Å; L364-L381 HydrophobicContact CD1-CD2 3.84Å; L364-L381 HydrophobicContact CD1-CG 3.96Å; L364-L381 HydrophobicContact CD2-CG 4.25Å; L364-L381 HydrophobicContact CG-CG 4.26Å; L381-F433 HydrophobicContact CD1-CD1 4.24Å; L381-F433 HydrophobicContact CD1-CE1 4.43Å; L381-M447 CarbonylContact C-O 3.55Å; L381-M447 WeakPolarHBondContact CA-O 3.46Å; L381-R448 HydrophobicContact CD2-CB 3.68Å; L381-R448 HydrophobicContact CD2-CG 4.11Å
382	L	95.1	Very high	91.7	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	121.6	161	-170	69.9	0	0	0	108	V359 V361 F380 Q384 T416 F418 A446 M447 M473	V359-L382 HydrophobicContact CG1-CD1 3.55Å; V359-L382 HydrophobicContact CG1-CG 4.47Å; V361-L382 HydrophobicContact CG2-CD1 3.63Å; F380-L382 HydrophobicContact CD2-CB 4.32Å; F380-L382 HydrophobicContact CE2-CB 4.17Å; F380-L382 HydrophobicContact CE2-CD1 4.48Å; L382-Q384 HydrophobicContact CD2-CG 3.73Å; L382-Q384 HydrophobicContact CG-CG 3.85Å; L382-T416 HydrophobicContact CD2-CG2 4.38Å; L382-F418 HydrophobicContact CD2-CZ 4.07Å; L382-A446 WeakPolarHBondContact O-CA 3.31Å; L382-M447 HydrophobicContact CB-CE 4.48Å; L382-M447 HydrophobicContact CB-CG 4.33Å; L382-M447 HydrophobicContact CD2-CE 3.71Å; L382-M447 PolarHBondContact N-O 2.98Å; L382-M447 PolarHBondContact O-N 3.27Å; L382-M473 HydrophobicContact CD1-CE 4.22Å; L382-M473 HydrophobicContact CD1-SD 3.45Å; L382-M473 WeakPolarHBondContact CD1-SD 3.34Å; L382-M473 HydrophobicContact CD2-SD 4.02Å; L382-M473 HydrophobicContact CG-SD 4.4Å
383	N	95	Very high	92.4	Very high	52 Å²	52	26.5 Å²	26.5	28%	0.278	13%	0.129	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	127.6	170.7	-60.2	-56.7	0	0	0	108.4	V359 N360 Y445 A446	V359-N383 WeakPolarHBondContact CA-O 3.37Å; N360-N383 HydrophobicContact CB-CB 4.1Å; N360-N383 PolarHBondContact N-O 3.47Å; N360-N383 PolarHBondContact O-N 2.96Å; N360-N383 PolarHBondContact OD1-ND2 2.92Å; N360-N383 VanDerWaalsContact OD1-ND2 3.11Å; N383-Y445 WeakPolarHBondContact CA-O 3.35Å; N383-A446 WeakPolarHBondContact OD1-CB 3.47Å
384	Q	96	Very high	92.3	Very high	4 Å²	4	26.2 Å²	26.2	2%	0.019	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	139.7	-179.5	-55.6	-171.6	-81.2	0	0	109.9	V357 N358 L382 W386 T416 T444 Y445	V357-Q384 HydrophobicContact CG1-CB 4.31Å; N358-Q384 CarbonylContact O-C 3.58Å; N358-Q384 WeakPolarHBondContact O-CA 3.48Å; L382-Q384 HydrophobicContact CD2-CG 3.73Å; L382-Q384 HydrophobicContact CG-CG 3.85Å; Q384-W386 HydrophobicContact CB-CE3 4.35Å; Q384-W386 HydrophobicContact CB-CZ3 4.08Å; Q384-T416 PolarHBondContact NE2-OG1 3.35Å; Q384-T444 WeakPolarHBondContact O-CA 3.44Å; Q384-Y445 PolarHBondContact N-O 2.93Å; Q384-Y445 PolarHBondContact O-N 3.47Å
385	Q	96.1	Very high	91.3	Very high	57 Å²	57	30.3 Å²	30.3	27%	0.266	15%	0.151	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	126.6	178.7	180	-178.2	44.5	0	0	110.8	V357 N358 T442 I443 T444	V357-Q385 CarbonylContact C-O 3.6Å; V357-Q385 WeakPolarHBondContact CA-O 3.41Å; N358-Q385 HydrophobicContact CB-CB 4.26Å; N358-Q385 PolarHBondContact N-O 3.07Å; N358-Q385 PolarHBondContact O-N 3.22Å; Q385-T442 HydrophobicContact CG-CG2 3.69Å; Q385-I443 VanDerWaalsContact CA-O 3.27Å; Q385-I443 WeakPolarHBondContact CA-O 3.16Å; Q385-T444 HydrophobicContact CB-CG2 4.15Å; Q385-T444 HydrophobicContact CG-CG2 3.86Å
386	W	96.4	Very high	90.2	Very high	6 Å²	6	29.7 Å²	29.7	2%	0.023	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	178.4	176.4	67.9	94.4	0	0	0	109.8	L355 V357 Q384 W412 T413 P414 T442 I443 Y445	L355-W386 HydrophobicContact CD1-CB 4.34Å; V357-W386 HydrophobicContact CG2-CB 4.23Å; Q384-W386 HydrophobicContact CB-CE3 4.35Å; Q384-W386 HydrophobicContact CB-CZ3 4.08Å; W386-W412 AromaticContact CD1-CZ3 3.76Å; W386-W412 HydrophobicContact CD2-CZ3 4.33Å; W386-W412 HydrophobicContact CG-CZ3 4.18Å; W386-W412 VanDerWaalsContact CZ2-O 3.31Å; W386-W412 WeakPolarHBondContact CZ2-O 3.33Å; W386-W412 AromaticContact NE1-CE3 3.59Å; W386-W412 AromaticContact NE1-CZ3 3.66Å; W386-T413 HydrophobicContact CH2-CG2 4.14Å; W386-T413 HydrophobicContact CZ2-CG2 4.29Å; W386-P414 HydrophobicContact CD2-CG 4.46Å; W386-P414 HydrophobicContact CE3-CG 3.91Å; W386-P414 HydrophobicContact CH2-CG 4.45Å; W386-P414 VanDerWaalsContact CZ3-CD 3.46Å; W386-P414 HydrophobicContact CZ3-CG 3.9Å; W386-T442 CarbonylContact O-C 3.57Å; W386-T442 WeakPolarHBondContact O-CA 3.29Å; W386-I443 HydrophobicContact CD2-CB 4.29Å; W386-I443 HydrophobicContact CH2-CB 4.48Å; W386-I443 HydrophobicContact CH2-CG2 4.09Å; W386-I443 HydrophobicContact CZ2-CB 3.96Å; W386-I443 HydrophobicContact CZ2-CD1 3.9Å; W386-I443 HydrophobicContact CZ2-CG1 4.46Å; W386-I443 HydrophobicContact CZ2-CG2 3.82Å; W386-I443 PolarHBondContact N-O 3.16Å; W386-I443 PolarHBondContact O-N 3.36Å; W386-Y445 HydrophobicContact CH2-CD1 4.26Å; W386-Y445 HydrophobicContact CH2-CG 4.25Å; W386-Y445 HydrophobicContact CZ3-CD1 4.26Å; W386-Y445 HydrophobicContact CZ3-CG 4.39Å
387	N	96	Very high	89.1	Confident	49 Å²	49	29.7 Å²	29.7	26%	0.262	15%	0.149	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	128.5	-180	-169.2	76.1	0	0	0	111.5	N440 G441 T442	N387-N440 PolarHBondContact OD1-O 2.98Å; N387-G441 VanDerWaalsContact OD1-C 3.28Å; N387-T442 PolarHBondContact OD1-N 3.45Å; N387-T442 VanDerWaalsContact OD1-N 3.17Å; N387-T442 PolarHBondContact OD1-OG1 2.94Å; N387-T442 VanDerWaalsContact OD1-OG1 3.12Å
388	D	96.3	Very high	88.3	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	17%	0.173	C	C	.	.			trans	-123	100.1	174.5	-169.6	-15.5	0	0	0	110.4	Y343 P349 R390 L391 G441 I443	Y343-D388 WeakPolarHBondContact CE2-OD2 3.36Å; Y343-D388 PolarHBondContact OH-OD2 2.64Å; P349-D388 HydrophobicContact CB-CB 4.13Å; P349-D388 HydrophobicContact CG-CB 4.18Å; D388-R390 PolarHBondContact O-N 2.83Å; D388-R390 VanDerWaalsContact OD1-CB 3.31Å; D388-R390 WeakPolarHBondContact OD1-CB 3.5Å; D388-R390 WeakPolarHBondContact OD1-CG 3.27Å; D388-R390 IonicContact OD1-CZ 3.19Å; D388-R390 PolarHBondContact OD1-N 2.91Å; D388-R390 VanDerWaalsContact OD1-N 3.15Å; D388-R390 IonicContact OD1-NE 2.57Å; D388-R390 PolarHBondContact OD1-NE 2.82Å; D388-R390 IonicContact OD1-NH2 3.46Å; D388-R390 IonicContact OD2-CZ 2.93Å; D388-R390 IonicContact OD2-NE 2.65Å; D388-R390 PolarHBondContact OD2-NE 2.89Å; D388-R390 IonicContact OD2-NH2 3.85Å; D388-R390 PolarHBondContact OD2-NH2 2.78Å; D388-L391 HydrophobicContact CB-CD1 4.32Å; D388-L391 PolarHBondContact O-N 3.36Å; D388-L391 VanDerWaalsContact O-N 3.09Å; D388-G441 PolarHBondContact N-O 3.4Å; D388-I443 HydrophobicContact CB-CD1 4.16Å
389	P	93.7	Very high	87.6	Confident	35 Å²	35	39.6 Å²	39.6	23%	0.227	19%	0.191	C	C	.	.	G	3₁₀ helix	trans	-58	-21.5	-178.5	-27.9	37.4	0	0	0	114.6	V351 L391 Q392	V351-P389 HydrophobicContact CG1-CG 4.44Å; P389-L391 PolarHBondContact O-N 3.06Å; P389-Q392 WeakPolarHBondContact O-CB 3.41Å; P389-Q392 PolarHBondContact O-N 3.2Å
390	R	93.8	Very high	87.3	Confident	41 Å²	41	43.9 Å²	43.9	16%	0.155	22%	0.215	C	C	.	.	G	3₁₀ helix	trans	-67.8	-16.6	179.2	-56.8	172.5	-68.2	-174.3	-1	113.1	R342 Y343 D344 L347 P350 D388	R342-R390 PolarHBondContact NH2-O 2.94Å; Y343-R390 HydrophobicContact CD2-CB 3.8Å; Y343-R390 HydrophobicContact CE2-CB 3.92Å; D344-R390 PolarHBondContact O-NH1 2.94Å; D344-R390 VanDerWaalsContact O-NH1 3.09Å; L347-R390 PolarHBondContact O-NH1 2.84Å; L347-R390 PolarHBondContact O-NH2 2.94Å; P350-R390 HydrophobicContact CG-CG 3.83Å; D388-R390 PolarHBondContact O-N 2.83Å; D388-R390 VanDerWaalsContact OD1-CB 3.31Å; D388-R390 WeakPolarHBondContact OD1-CB 3.5Å; D388-R390 WeakPolarHBondContact OD1-CG 3.27Å; D388-R390 IonicContact OD1-CZ 3.19Å; D388-R390 PolarHBondContact OD1-N 2.91Å; D388-R390 VanDerWaalsContact OD1-N 3.15Å; D388-R390 IonicContact OD1-NE 2.57Å; D388-R390 PolarHBondContact OD1-NE 2.82Å; D388-R390 IonicContact OD1-NH2 3.46Å; D388-R390 IonicContact OD2-CZ 2.93Å; D388-R390 IonicContact OD2-NE 2.65Å; D388-R390 PolarHBondContact OD2-NE 2.89Å; D388-R390 IonicContact OD2-NH2 3.85Å; D388-R390 PolarHBondContact OD2-NH2 2.78Å
391	L	92.9	Very high	87.2	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	23%	0.229	C	C	.	.	G	3₁₀ helix	trans	-106.7	8	-179	-60.8	173.4	0	0	0	113.1	L337 L338 Y343 D388 P389 I437 I443	L337-L391 HydrophobicContact CB-CD2 4.09Å; L338-L391 HydrophobicContact CD2-CD2 3.83Å; Y343-L391 HydrophobicContact CD2-CD2 3.7Å; Y343-L391 HydrophobicContact CD2-CG 4.12Å; Y343-L391 HydrophobicContact CE2-CD1 3.93Å; Y343-L391 HydrophobicContact CE2-CD2 3.7Å; Y343-L391 HydrophobicContact CE2-CG 3.66Å; Y343-L391 HydrophobicContact CG-CD2 4.31Å; D388-L391 HydrophobicContact CB-CD1 4.32Å; D388-L391 PolarHBondContact O-N 3.36Å; D388-L391 VanDerWaalsContact O-N 3.09Å; P389-L391 PolarHBondContact O-N 3.06Å; L391-I437 HydrophobicContact CB-CG2 4.11Å; L391-I437 HydrophobicContact CD1-CD1 4.17Å; L391-I443 HydrophobicContact CD1-CD1 3.66Å
392	Q	91.2	Very high	87.1	Confident	46 Å²	46	46.2 Å²	46.2	22%	0.215	23%	0.225	C	C	.	.			trans	-64.7	142.6	171.9	-79.1	174.2	2.3	0	0	112	H321 P389 N440	H321-Q392 PolarHBondContact CE1-OE1 3.38Å; H321-Q392 WeakPolarHBondContact ND1-CB 3.37Å; H321-Q392 PolarHBondContact NE2-OE1 2.99Å; P389-Q392 WeakPolarHBondContact O-CB 3.41Å; P389-Q392 PolarHBondContact O-N 3.2Å; Q392-N440 VanDerWaalsContact CG-O 3.25Å; Q392-N440 WeakPolarHBondContact CG-O 3.39Å; Q392-N440 PolarHBondContact NE2-O 3.48Å
393	Y	88.3	Confident	87	Confident	11 Å²	11	50.1 Å²	50.1	4%	0.043	25%	0.246	C	C	.	.			trans	-145.5	153.8	-179	64.9	-84.8	0	0	0	114.4	F324 I333 L337 L402 R439	F324-Y393 HydrophobicContact CD2-CD2 4.32Å; F324-Y393 HydrophobicContact CE2-CG 4.5Å; I333-Y393 HydrophobicContact CG2-CD2 4.37Å; L337-Y393 HydrophobicContact CD1-CD1 4.11Å; Y393-L402 HydrophobicContact CD1-CD1 4.28Å; Y393-L402 HydrophobicContact CE1-CD1 3.75Å; Y393-L402 HydrophobicContact CE1-CD2 4.36Å; Y393-L402 HydrophobicContact CE1-CG 3.83Å; Y393-L402 HydrophobicContact CE2-CD2 4.2Å; Y393-L402 WeakPolarHBondContact OH-CD2 3.32Å; Y393-L402 WeakPolarHBondContact OH-CG 3.41Å; Y393-R439 HydrophobicContact CD2-CG 4.46Å; Y393-R439 HydrophobicContact CE1-CB 4.4Å; Y393-R439 HydrophobicContact CE1-CG 4.3Å; Y393-R439 HydrophobicContact CE2-CB 4.42Å; Y393-R439 HydrophobicContact CE2-CG 3.75Å; Y393-R439 PolarHBondContact N-O 2.85Å; Y393-R439 VanDerWaalsContact N-O 3.16Å
394	G	79.8	Confident	86.9	Confident	13 Å²	13	47.6 Å²	47.6	13%	0.134	23%	0.232	C	C	.	.			trans	-80.6	156.2	-171.3	0	0	0	0	0	115.3	P322 K396	P322-G394 PolarHBondContact O-N 2.97Å; G394-K396 PolarHBondContact O-N 3.02Å
395	N	64.1	Low	86.7	Confident	118 Å²	118	49.8 Å²	49.8	63%	0.631	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.8	78	-162.1	-169.4	48.7	0	0	0	114.1	R439	N395-R439 PolarHBondContact OD1-NH1 3.36Å
396	K	65.6	Low	86.5	Confident	105 Å²	105	55.1 Å²	55.1	46%	0.457	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-130.8	-23	158.1	-45.1	176.7	-176.9	175.1	0	114.2	I323 F324 D325 E326 G394	I323-K396 HydrophobicContact CG2-CD 4.3Å; I323-K396 HydrophobicContact CG2-CG 4.18Å; F324-K396 VanDerWaalsContact O-CB 3.26Å; F324-K396 WeakPolarHBondContact O-CB 3.44Å; F324-K396 WeakPolarHBondContact O-CD 3.44Å; F324-K396 WeakPolarHBondContact O-CG 3.35Å; D325-K396 VanDerWaalsContact OD1-CD 3.23Å; D325-K396 WeakPolarHBondContact OD1-CD 3.37Å; D325-K396 WeakPolarHBondContact OD1-CE 3.47Å; D325-K396 IonicContact OD1-NZ 2.6Å; D325-K396 PolarHBondContact OD1-NZ 2.88Å; E326-K396 WeakPolarHBondContact CA-O 3.12Å; E326-K396 WeakPolarHBondContact CB-O 3.47Å; E326-K396 WeakPolarHBondContact CG-O 3.41Å; G394-K396 PolarHBondContact O-N 3.02Å
397	S	66.9	Low	86.2	Confident	3 Å²	3	57 Å²	57	2%	0.021	28%	0.277	C	S	.	.	S	Bend	trans	-65.4	138	177.3	62.3	0	0	0	0	112.3	Y399 R439	S397-Y399 VanDerWaalsContact C-N 3.25Å; S397-Y399 PolarHBondContact O-N 3.09Å; S397-R439 PolarHBondContact O-NH2 2.86Å
398	H	76.2	Confident	85.9	Confident	150 Å²	150	55.9 Å²	55.9	69%	0.694	27%	0.27	S	S	*	.	S	Bend	trans	-65.5	-21.2	-179.8	-167.5	-56.4	0	0	0	114.1	R439	H398-R439 PolarHBondContact O-NH2 3.35Å
399	Y	78.4	Confident	85.7	Confident	98 Å²	98	61.5 Å²	61.5	38%	0.384	30%	0.301	S	S	.	.			trans	-78.4	126.6	-170.7	-54.2	-81.9	0	0	0	113.7	D330 S397 F401 R439	D330-Y399 WeakPolarHBondContact OD1-CB 3.41Å; D330-Y399 VanDerWaalsContact OD1-CD2 3.24Å; D330-Y399 WeakPolarHBondContact OD1-CD2 3.44Å; S397-Y399 VanDerWaalsContact C-N 3.25Å; S397-Y399 PolarHBondContact O-N 3.09Å; Y399-F401 VanDerWaalsContact C-N 3.3Å; Y399-F401 PolarHBondContact O-N 2.96Å; Y399-R439 VanDerWaalsContact O-CZ 3.3Å; Y399-R439 PolarHBondContact O-NE 3.34Å; Y399-R439 PolarHBondContact O-NH2 2.98Å
400	D	85.1	Confident	85.7	Confident	115 Å²	115	62.8 Å²	62.8	62%	0.615	31%	0.31	S	S	*	.	S	Bend	trans	-66.7	-33.3	178.1	-62.7	-41.1	0	0	0	112.7	R439	D400-R439 IonicContact OD1-NH2 3.59Å
401	F	91.1	Very high	85.8	Confident	68 Å²	68	61 Å²	61	30%	0.298	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	151.3	174.6	63.5	-93.3	0	0	0	110	Y399 R436 I437 F438	Y399-F401 VanDerWaalsContact C-N 3.3Å; Y399-F401 PolarHBondContact O-N 2.96Å; F401-R436 HydrophobicContact CB-CB 4.13Å; F401-R436 HydrophobicContact CD2-CB 3.67Å; F401-R436 HydrophobicContact CD2-CG 3.48Å; F401-R436 VanDerWaalsContact CD2-CG 3.48Å; F401-R436 HydrophobicContact CE2-CB 4.39Å; F401-R436 HydrophobicContact CE2-CG 3.69Å; F401-R436 HydrophobicContact CG-CB 4Å; F401-R436 HydrophobicContact CG-CG 4.13Å; F401-R436 HydrophobicContact CZ-CG 4.45Å; F401-I437 CarbonylContact C-O 3.48Å; F401-I437 WeakPolarHBondContact CA-O 3.49Å; F401-I437 WeakPolarHBondContact CB-O 3.46Å; F401-F438 HydrophobicContact CB-CD1 3.93Å; F401-F438 HydrophobicContact CB-CE1 3.96Å; F401-F438 HydrophobicContact CB-CG 4.27Å; F401-F438 HydrophobicContact CB-CZ 4.3Å; F401-F438 HydrophobicContact CD1-CE1 4.28Å
402	L	91.7	Very high	85.9	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	133.4	169.8	-46.6	175.8	0	0	0	109.5	D330 I333 L337 Y393 A404 R436 I437	D330-L402 VanDerWaalsContact OD1-CD2 3.28Å; D330-L402 WeakPolarHBondContact OD1-CD2 3.21Å; I333-L402 HydrophobicContact CB-CD1 4.35Å; I333-L402 HydrophobicContact CB-CD2 4.2Å; I333-L402 HydrophobicContact CD1-CD2 4.17Å; I333-L402 HydrophobicContact CG2-CD1 3.5Å; I333-L402 HydrophobicContact CG2-CD2 3.85Å; I333-L402 HydrophobicContact CG2-CG 4.33Å; L337-L402 HydrophobicContact CD1-CD1 3.4Å; Y393-L402 HydrophobicContact CD1-CD1 4.28Å; Y393-L402 HydrophobicContact CE1-CD1 3.75Å; Y393-L402 HydrophobicContact CE1-CD2 4.36Å; Y393-L402 HydrophobicContact CE1-CG 3.83Å; Y393-L402 HydrophobicContact CE2-CD2 4.2Å; Y393-L402 WeakPolarHBondContact OH-CD2 3.32Å; Y393-L402 WeakPolarHBondContact OH-CG 3.41Å; L402-A404 PolarHBondContact O-N 2.85Å; L402-R436 WeakPolarHBondContact O-CA 3.5Å; L402-I437 HydrophobicContact CB-CB 4.47Å; L402-I437 PolarHBondContact N-O 2.7Å; L402-I437 PolarHBondContact O-N 3.24Å
403	N	92.3	Very high	86.1	Confident	81 Å²	81	61.4 Å²	61.4	43%	0.433	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	101.9	171.2	-179.6	12.3	0	0	0	111	L405	N403-L405 WeakPolarHBondContact OD1-CB 3.47Å; N403-L405 PolarHBondContact OD1-N 2.99Å
404	A	92.6	Very high	86.4	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	31%	0.308	C	S	.	.			trans	-100.4	13.5	-175.7	0	0	0	0	0	114.2	L334 L402 H406 H407 H408 I411 L435 I437	L334-A404 HydrophobicContact CD1-CB 4.02Å; L334-A404 HydrophobicContact CD2-CB 3.81Å; L402-A404 PolarHBondContact O-N 2.85Å; A404-H406 VanDerWaalsContact C-N 3.28Å; A404-H406 PolarHBondContact O-N 3.45Å; A404-H406 VanDerWaalsContact O-N 3.16Å; A404-H407 CarbonylContact O-C 3.41Å; A404-H407 WeakPolarHBondContact O-CA 3.38Å; A404-H407 PolarHBondContact O-N 3.22Å; A404-H408 PolarHBondContact O-N 3.08Å; A404-I411 HydrophobicContact CB-CD1 3.64Å; A404-L435 HydrophobicContact CB-CD2 4.2Å; A404-L435 HydrophobicContact CB-CG 4.19Å; A404-L435 PolarHBondContact N-O 3.09Å; A404-I437 HydrophobicContact CB-CD1 3.76Å; A404-I437 HydrophobicContact CB-CG1 4.13Å
405	L	92.9	Very high	86.9	Confident	49 Å²	49	62.2 Å²	62.2	26%	0.257	31%	0.311	S	S	.	.	G	3₁₀ helix	trans	-52.8	-40.2	-173.9	-177	61.3	0	0	0	113.9	N403 H407 H432	N403-L405 WeakPolarHBondContact OD1-CB 3.47Å; N403-L405 PolarHBondContact OD1-N 2.99Å; L405-H407 PolarHBondContact O-N 2.88Å; L405-H432 HydrophobicContact CD1-CB 3.7Å
406	H	90.6	Very high	88.3	Confident	169 Å²	169	57.7 Å²	57.7	78%	0.782	29%	0.287	S	S	*	.	G	3₁₀ helix	trans	-75.6	-8.4	177.9	-60.2	-65.8	0	0	0	114.2	A404	A404-H406 VanDerWaalsContact C-N 3.28Å; A404-H406 PolarHBondContact O-N 3.45Å; A404-H406 VanDerWaalsContact O-N 3.16Å
407	H	90.6	Very high	89.6	Confident	45 Å²	45	57.6 Å²	57.6	21%	0.208	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	-113.4	15.4	-178.7	-60.5	-119.2	0	0	0	111.8	L334 D335 L338 A404 L405 D409 S410 I411	L334-H407 HydrophobicContact CD2-CB 4.07Å; D335-H407 IonicContact OD1-CE1 2.85Å; D335-H407 PolarHBondContact OD1-CE1 3.07Å; L338-H407 HydrophobicContact CD1-CB 3.72Å; A404-H407 CarbonylContact O-C 3.41Å; A404-H407 WeakPolarHBondContact O-CA 3.38Å; A404-H407 PolarHBondContact O-N 3.22Å; L405-H407 PolarHBondContact O-N 2.88Å; H407-D409 VanDerWaalsContact C-N 3.25Å; H407-D409 PolarHBondContact O-N 3.47Å; H407-S410 WeakPolarHBondContact O-CA 3.42Å; H407-S410 WeakPolarHBondContact O-CB 3.25Å; H407-S410 PolarHBondContact O-N 2.84Å; H407-I411 HydrophobicContact CB-CD1 4.33Å; H407-I411 PolarHBondContact O-N 3.16Å
408	H	90.5	Very high	90.8	Very high	26 Å²	26	57.8 Å²	57.8	12%	0.12	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	-45.4	-50.4	174	172	-86.7	0	0	0	111.8	A404 S410 I411 H432 L435 Y445	A404-H408 PolarHBondContact O-N 3.08Å; H408-S410 PolarHBondContact O-N 2.81Å; H408-S410 VanDerWaalsContact O-N 3.09Å; H408-I411 PolarHBondContact O-N 3.35Å; H408-I411 VanDerWaalsContact O-N 3.1Å; H408-H432 AromaticContact CD2-CE1 3.78Å; H408-H432 AromaticContact CD2-ND1 3.53Å; H408-H432 AromaticContact CE1-CE1 3.25Å; H408-H432 PolarHBondContact CE1-CE1 2.82Å; H408-H432 AromaticContact CE1-ND1 3.79Å; H408-H432 AromaticContact CG-CE1 3.91Å; H408-H432 AromaticContact CG-ND1 3.92Å; H408-H432 AromaticContact ND1-CE1 3.58Å; H408-H432 AromaticContact ND1-NE2 3.96Å; H408-H432 AromaticContact NE2-CE1 3.36Å; H408-H432 PolarHBondContact NE2-CE1 2.91Å; H408-H432 AromaticContact NE2-ND1 3.44Å; H408-H432 PolarHBondContact NE2-ND1 3.32Å; H408-L435 HydrophobicContact CB-CD2 4.19Å; H408-Y445 AromaticContact CD2-CE2 3.69Å; H408-Y445 AromaticContact CD2-CZ 3.89Å; H408-Y445 AromaticContact NE2-CE2 3.94Å; H408-Y445 AromaticContact NE2-CZ 3.62Å; H408-Y445 PolarHBondContact NE2-OH 2.84Å
409	D	91.9	Very high	91.5	Very high	119 Å²	119	53.3 Å²	53.3	64%	0.636	27%	0.266	S	S	*	.	G	3₁₀ helix	trans	-72.6	-1.8	-178.3	-62.9	-13.1	0	0	0	114.1	K345 H407	K345-D409 VanDerWaalsContact CD-O 3.29Å; K345-D409 WeakPolarHBondContact CD-O 3.27Å; K345-D409 VanDerWaalsContact CE-O 3.29Å; K345-D409 WeakPolarHBondContact CE-O 3.35Å; K345-D409 PolarHBondContact NZ-O 2.89Å; H407-D409 VanDerWaalsContact C-N 3.25Å; H407-D409 PolarHBondContact O-N 3.47Å
410	S	93.3	Very high	92.2	Very high	62 Å²	62	50.4 Å²	50.4	43%	0.434	26%	0.256	S	S	.	.	G	3₁₀ helix	trans	-105.3	-7.2	173.9	-62.7	0	0	0	0	113.1	H407 H408	H407-S410 WeakPolarHBondContact O-CA 3.42Å; H407-S410 WeakPolarHBondContact O-CB 3.25Å; H407-S410 PolarHBondContact O-N 2.84Å; H408-S410 PolarHBondContact O-N 2.81Å; H408-S410 VanDerWaalsContact O-N 3.09Å
411	I	94.9	Very high	92.5	Very high	3 Å²	3	51.4 Å²	51.4	2%	0.015	26%	0.257	C	S	.	.	S	Bend	trans	-106.5	151.8	-175.7	-72.4	160.7	0	0	0	110.1	L338 A404 H407 H408 L435 I437 I443	L338-I411 HydrophobicContact CD1-CD1 4.29Å; L338-I411 HydrophobicContact CD1-CG1 4.08Å; L338-I411 HydrophobicContact CD2-CG1 3.73Å; A404-I411 HydrophobicContact CB-CD1 3.64Å; H407-I411 HydrophobicContact CB-CD1 4.33Å; H407-I411 PolarHBondContact O-N 3.16Å; H408-I411 PolarHBondContact O-N 3.35Å; H408-I411 VanDerWaalsContact O-N 3.1Å; I411-L435 HydrophobicContact CD1-CD2 3.73Å; I411-I437 HydrophobicContact CD1-CD1 3.96Å; I411-I443 HydrophobicContact CG2-CD1 4.08Å
412	W	95.6	Very high	92.5	Very high	11 Å²	11	50 Å²	50	4%	0.042	26%	0.262	C	S	.	.			trans	-75.2	130.1	168.1	-179.7	98.4	0	0	0	109.4	Y343 K345 L348 P349 L355 W386 P414 I483	Y343-W412 WeakPolarHBondContact OH-CB 3.15Å; Y343-W412 PolarHBondContact OH-N 3.24Å; K345-W412 HydrophobicContact CB-CB 4.48Å; K345-W412 VanDerWaalsContact O-CD1 3.24Å; L348-W412 HydrophobicContact CD1-CH2 4.28Å; L348-W412 HydrophobicContact CD1-CZ2 3.6Å; P349-W412 VanDerWaalsContact CD-CD2 3.45Å; P349-W412 HydrophobicContact CG-CD2 3.8Å; P349-W412 HydrophobicContact CG-CE3 3.51Å; P349-W412 HydrophobicContact CG-CG 4.35Å; P349-W412 HydrophobicContact CG-CH2 4.49Å; P349-W412 HydrophobicContact CG-CZ3 3.9Å; L355-W412 HydrophobicContact CD2-CH2 3.39Å; L355-W412 HydrophobicContact CD2-CZ2 4.16Å; L355-W412 HydrophobicContact CD2-CZ3 3.65Å; W386-W412 AromaticContact CD1-CZ3 3.76Å; W386-W412 HydrophobicContact CD2-CZ3 4.33Å; W386-W412 HydrophobicContact CG-CZ3 4.18Å; W386-W412 VanDerWaalsContact CZ2-O 3.31Å; W386-W412 WeakPolarHBondContact CZ2-O 3.33Å; W386-W412 AromaticContact NE1-CE3 3.59Å; W386-W412 AromaticContact NE1-CZ3 3.66Å; W412-P414 VanDerWaalsContact CH2-CA 3.49Å; W412-P414 HydrophobicContact CH2-CB 3.85Å; W412-P414 HydrophobicContact CZ3-CB 4.23Å; W412-I483 HydrophobicContact CH2-CD1 3.99Å; W412-I483 HydrophobicContact CZ2-CD1 3.85Å
413	T	94.9	Very high	92.5	Very high	43 Å²	43	54.9 Å²	54.9	26%	0.264	29%	0.288	S	S	.	.			trans	-126.4	146.2	175.8	56	0	0	0	0	109.8	W386	W386-T413 HydrophobicContact CH2-CG2 4.14Å; W386-T413 HydrophobicContact CZ2-CG2 4.29Å
414	P	94.9	Very high	92.4	Very high	8 Å²	8	53 Å²	53	5%	0.052	28%	0.276	C	S	.	.			trans	-60.9	141.5	174.9	27.4	-34.5	0	0	0	110.9	V357 W386 W412 T416 Y485	V357-P414 HydrophobicContact CG1-CB 4.49Å; V357-P414 HydrophobicContact CG1-CG 4.16Å; V357-P414 HydrophobicContact CG2-CB 4.07Å; V357-P414 HydrophobicContact CG2-CG 4.44Å; W386-P414 HydrophobicContact CD2-CG 4.46Å; W386-P414 HydrophobicContact CE3-CG 3.91Å; W386-P414 HydrophobicContact CH2-CG 4.45Å; W386-P414 VanDerWaalsContact CZ3-CD 3.46Å; W386-P414 HydrophobicContact CZ3-CG 3.9Å; W412-P414 VanDerWaalsContact CH2-CA 3.49Å; W412-P414 HydrophobicContact CH2-CB 3.85Å; W412-P414 HydrophobicContact CZ3-CB 4.23Å; P414-T416 PolarHBondContact O-N 2.85Å; P414-Y485 HydrophobicContact CB-CE1 4.37Å
415	D	91.4	Very high	92.3	Very high	34 Å²	34	56.2 Å²	56.2	18%	0.182	29%	0.29	C	S	.	.			trans	-86.3	53.5	-171.9	68.1	-28.2	0	0	0	112.1	Y417 S475 I476 S477	D415-Y417 PolarHBondContact O-N 3.36Å; D415-Y417 VanDerWaalsContact O-N 3.12Å; D415-S475 WeakPolarHBondContact OD1-CB 3.48Å; D415-S475 PolarHBondContact OD1-OG 2.94Å; D415-S475 PolarHBondContact OD2-OG 2.65Å; D415-I476 HydrophobicContact CB-CG2 3.91Å; D415-I476 PolarHBondContact O-N 3.26Å; D415-I476 VanDerWaalsContact OD2-CG2 3.24Å; D415-I476 WeakPolarHBondContact OD2-CG2 3.49Å; D415-I476 PolarHBondContact OD2-N 3.02Å; D415-S477 WeakPolarHBondContact OD2-CA 3.38Å; D415-S477 WeakPolarHBondContact OD2-CB 3.21Å; D415-S477 PolarHBondContact OD2-N 2.59Å; D415-S477 PolarHBondContact OD2-OG 3.47Å
416	T	93.4	Very high	91.9	Very high	23 Å²	23	60.4 Å²	60.4	14%	0.141	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70	107.8	-170.3	-49.4	0	0	0	0	112.2	L382 Q384 P414 M473 E474 Y485	L382-T416 HydrophobicContact CD2-CG2 4.38Å; Q384-T416 PolarHBondContact NE2-OG1 3.35Å; P414-T416 PolarHBondContact O-N 2.85Å; T416-M473 HydrophobicContact CG2-CB 3.95Å; T416-M473 HydrophobicContact CG2-CG 4.27Å; T416-E474 WeakPolarHBondContact CA-O 3.14Å; T416-Y485 WeakPolarHBondContact CA-OH 3.24Å; T416-Y485 HydrophobicContact CG2-CE1 4.15Å; T416-Y485 PolarHBondContact N-OH 2.83Å; T416-Y485 VanDerWaalsContact OG1-CE1 3.3Å; T416-Y485 WeakPolarHBondContact OG1-CE1 3.33Å; T416-Y485 PolarHBondContact OG1-OH 3.02Å
417	Y	91.6	Very high	91.6	Very high	102 Å²	102	57.2 Å²	57.2	40%	0.4	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	143.5	175.2	-178.3	-100.4	0	0	0	110.8	D415 I419 M473 E474 I476	D415-Y417 PolarHBondContact O-N 3.36Å; D415-Y417 VanDerWaalsContact O-N 3.12Å; Y417-I419 HydrophobicContact CD1-CG1 3.97Å; Y417-I419 HydrophobicContact CE1-CG1 4.01Å; Y417-M473 WeakPolarHBondContact O-CA 3.07Å; Y417-E474 PolarHBondContact N-O 2.93Å; Y417-E474 PolarHBondContact O-N 2.85Å; Y417-I476 HydrophobicContact CD2-CD1 4.31Å
418	F	93	Very high	91.3	Very high	8 Å²	8	59.6 Å²	59.6	4%	0.035	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	121	177.7	-64.6	-95.6	0	0	0	110.5	F380 L382 F424 R449 L451 F471 S472 M473	F380-F418 AromaticContact CE2-CE1 3.97Å; F380-F418 HydrophobicContact CE2-CE1 3.97Å; F380-F418 HydrophobicContact CE2-CZ 4.39Å; F380-F418 HydrophobicContact CZ-CD1 4.4Å; F380-F418 AromaticContact CZ-CE1 3.7Å; F380-F418 HydrophobicContact CZ-CE1 3.7Å; F380-F418 HydrophobicContact CZ-CZ 4.38Å; L382-F418 HydrophobicContact CD2-CZ 4.07Å; F418-F424 HydrophobicContact CB-CE1 4.06Å; F418-F424 HydrophobicContact CB-CZ 3.98Å; F418-F424 HydrophobicContact CD2-CE1 4.03Å; F418-F424 HydrophobicContact CD2-CZ 4.24Å; F418-F424 HydrophobicContact CG-CE1 4.2Å; F418-F424 HydrophobicContact CG-CZ 4.45Å; F418-R449 HydrophobicContact CE2-CG 4.09Å; F418-R449 HydrophobicContact CZ-CG 3.73Å; F418-L451 HydrophobicContact CD1-CD1 4.45Å; F418-F471 HydrophobicContact CD1-CD2 4.2Å; F418-S472 CarbonylContact C-O 3.53Å; F418-S472 WeakPolarHBondContact CA-O 3.39Å; F418-M473 HydrophobicContact CD1-CG 3.61Å; F418-M473 HydrophobicContact CD1-SD 4.26Å; F418-M473 HydrophobicContact CE1-CG 3.52Å; F418-M473 HydrophobicContact CE1-SD 3.59Å; F418-M473 VanDerWaalsContact CE1-SD 3.59Å; F418-M473 HydrophobicContact CG-CG 4.46Å; F418-M473 HydrophobicContact CZ-CG 4.32Å; F418-M473 HydrophobicContact CZ-SD 4.28Å
419	I	91.3	Very high	91	Very high	55 Å²	55	64.5 Å²	64.5	28%	0.282	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	121.6	170.8	-53.8	174	0	0	0	107.6	Y417 F471 S472 E474	Y417-I419 HydrophobicContact CD1-CG1 3.97Å; Y417-I419 HydrophobicContact CE1-CG1 4.01Å; I419-F471 CarbonylContact O-C 3.59Å; I419-F471 WeakPolarHBondContact O-CA 3.43Å; I419-S472 PolarHBondContact N-O 2.73Å; I419-S472 PolarHBondContact O-N 2.8Å; I419-E474 HydrophobicContact CD1-CB 4.17Å
420	M	92.4	Very high	90.8	Very high	37 Å²	37	60.4 Å²	60.4	18%	0.182	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	153.7	-178.5	56.8	-177.5	174.6	0	0	111.1	F424 L451 L453 F471	M420-F424 HydrophobicContact CE-CD1 3.68Å; M420-F424 HydrophobicContact CE-CD2 3.93Å; M420-F424 HydrophobicContact CE-CE1 3.58Å; M420-F424 HydrophobicContact CE-CE2 3.85Å; M420-F424 HydrophobicContact CE-CG 3.86Å; M420-F424 HydrophobicContact CE-CZ 3.69Å; M420-L451 HydrophobicContact CE-CD2 4.23Å; M420-L451 HydrophobicContact SD-CB 4.03Å; M420-L451 HydrophobicContact SD-CD1 3.94Å; M420-L451 HydrophobicContact SD-CD2 3.93Å; M420-L451 HydrophobicContact SD-CG 4.17Å; M420-L453 HydrophobicContact CB-CD2 3.8Å; M420-L453 HydrophobicContact CG-CD2 4.37Å; M420-L453 HydrophobicContact SD-CD2 3.84Å; M420-F471 HydrophobicContact CB-CB 4Å
421	H	91	Very high	90.6	Very high	136 Å²	136	62.7 Å²	62.7	63%	0.63	33%	0.331	S	S	*	.	S	Bend	trans	-84.9	109.6	159.4	-62.1	-46.4	0	0	0	107.4	L453 S454	H421-L453 CarbonylContact O-C 3.51Å; H421-L453 WeakPolarHBondContact O-CA 3.48Å; H421-S454 PolarHBondContact O-N 2.82Å
422	G	91.1	Very high	90.5	Very high	39 Å²	39	65.4 Å²	65.4	40%	0.402	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	147.1	-157.3	-170.5	0	0	0	0	0	112.8	I452	G422-I452 CarbonylContact C-O 3.56Å; G422-I452 WeakPolarHBondContact CA-O 3.49Å
423	D	91.7	Very high	90.3	Very high	103 Å²	103	71.2 Å²	71.2	55%	0.551	37%	0.369	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-146.3	169.9	175.9	-153	-15.9	0	0	0	110.4	I452	D423-I452 PolarHBondContact N-O 2.84Å; D423-I452 PolarHBondContact O-N 2.87Å
424	F	91.3	Very high	90.3	Very high	42 Å²	42	70 Å²	70	18%	0.184	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	145.7	168.1	-61.5	-71.7	0	0	0	110.1	F418 M420 I428 L451	F418-F424 HydrophobicContact CB-CE1 4.06Å; F418-F424 HydrophobicContact CB-CZ 3.98Å; F418-F424 HydrophobicContact CD2-CE1 4.03Å; F418-F424 HydrophobicContact CD2-CZ 4.24Å; F418-F424 HydrophobicContact CG-CE1 4.2Å; F418-F424 HydrophobicContact CG-CZ 4.45Å; M420-F424 HydrophobicContact CE-CD1 3.68Å; M420-F424 HydrophobicContact CE-CD2 3.93Å; M420-F424 HydrophobicContact CE-CE1 3.58Å; M420-F424 HydrophobicContact CE-CE2 3.85Å; M420-F424 HydrophobicContact CE-CG 3.86Å; M420-F424 HydrophobicContact CE-CZ 3.69Å; F424-I428 HydrophobicContact CB-CG1 4.34Å; F424-I428 HydrophobicContact CB-CG2 4.26Å; F424-I428 HydrophobicContact CD2-CG2 4.04Å; F424-I428 HydrophobicContact CG-CG2 4.29Å; F424-L451 HydrophobicContact CD1-CD2 3.42Å; F424-L451 VanDerWaalsContact CD1-CD2 3.42Å; F424-L451 HydrophobicContact CE1-CD2 3.51Å
425	K	89.8	Confident	90.3	Very high	67 Å²	67	69.6 Å²	69.6	29%	0.291	36%	0.361	S	S	.	.	P	Polyproline II helix	trans	-79.9	139.2	168	-168.7	166.7	-176.4	161.9	0	109.4	E377 P427 H450 I452	E377-K425 WeakPolarHBondContact OE1-CE 3.31Å; E377-K425 IonicContact OE1-NZ 3.65Å; E377-K425 PolarHBondContact OE1-NZ 3.09Å; E377-K425 IonicContact OE2-NZ 2.72Å; E377-K425 PolarHBondContact OE2-NZ 3.11Å; K425-P427 CarbonylContact O-C 3.53Å; K425-P427 VanDerWaalsContact O-C 3.3Å; K425-H450 HydrophobicContact CB-CB 4.11Å; K425-H450 VanDerWaalsContact CD-CD2 3.42Å; K425-H450 WeakPolarHBondContact CD-CD2 3.42Å; K425-H450 VanDerWaalsContact CD-NE2 3.31Å; K425-H450 WeakPolarHBondContact CD-NE2 3.26Å; K425-H450 PolarHBondContact N-O 3.05Å; K425-I452 HydrophobicContact CB-CD1 3.95Å; K425-I452 HydrophobicContact CB-CG1 3.86Å; K425-I452 HydrophobicContact CD-CD1 4.48Å; K425-I452 HydrophobicContact CG-CD1 4.08Å; K425-I452 HydrophobicContact CG-CG1 4.4Å
426	D	85.4	Confident	90.5	Very high	136 Å²	136	73 Å²	73	73%	0.727	37%	0.371	S	S	*	.	S	Bend	trans	-63.1	136	174.4	-87.1	-49	0	0	0	111.9
427	P	83.6	Confident	90.6	Very high	103 Å²	103	72 Å²	72	67%	0.669	37%	0.365	S	S	*	.	S	Bend	cis	-79.3	136.7	-0.6	32.3	-34.7	0	0	0	113.2	K425 I429	K425-P427 CarbonylContact O-C 3.53Å; K425-P427 VanDerWaalsContact O-C 3.3Å; P427-I429 PolarHBondContact O-N 3.44Å; P427-I429 VanDerWaalsContact O-N 3.15Å
428	I	84.4	Confident	90.7	Very high	94 Å²	94	70.2 Å²	70.2	48%	0.482	36%	0.359	S	S	.	.			trans	-58.1	-29.8	178.7	-57	170.4	0	0	0	112.6	F424 R449	F424-I428 HydrophobicContact CB-CG1 4.34Å; F424-I428 HydrophobicContact CB-CG2 4.26Å; F424-I428 HydrophobicContact CD2-CG2 4.04Å; F424-I428 HydrophobicContact CG-CG2 4.29Å; I428-R449 PolarHBondContact O-NH1 2.95Å; I428-R449 PolarHBondContact O-NH2 3.39Å; I428-R449 VanDerWaalsContact O-NH2 3.15Å
429	I	84.4	Confident	90.5	Very high	129 Å²	129	73.2 Å²	73.2	66%	0.662	37%	0.37	S	S	*	.	S	Bend	trans	-69.1	130	-179.2	-58.1	177.4	0	0	0	110.1	P427	P427-I429 PolarHBondContact O-N 3.44Å; P427-I429 VanDerWaalsContact O-N 3.15Å
430	P	87	Confident	90.5	Very high	34 Å²	34	74.6 Å²	74.6	22%	0.221	38%	0.378	C	S	.	.			trans	-64	141.4	177.9	27.2	-34.7	0	0	0	111.9	H432 M447 R449	P430-H432 PolarHBondContact O-N 3.32Å; P430-M447 HydrophobicContact CB-CB 4.19Å; P430-M447 HydrophobicContact CB-CG 4.44Å; P430-M447 HydrophobicContact CB-SD 3.54Å; P430-M447 VanDerWaalsContact CB-SD 3.54Å; P430-M447 HydrophobicContact CG-SD 4.01Å; P430-R449 VanDerWaalsContact CA-NH1 3.32Å; P430-R449 VanDerWaalsContact N-NH1 3.17Å
431	M	90.2	Very high	90.5	Very high	109 Å²	109	72.8 Å²	72.8	54%	0.537	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	103.7	168.3	-179.3	162.7	56.8	0	0	109.1	F433 M447 R448	M431-F433 PolarHBondContact O-N 3.1Å; M431-M447 WeakPolarHBondContact O-CA 3.48Å; M431-R448 HydrophobicContact CB-CB 4.31Å; M431-R448 PolarHBondContact N-O 3.48Å; M431-R448 PolarHBondContact O-N 3.45Å
432	H	92.5	Very high	90.7	Very high	60 Å²	60	67.4 Å²	67.4	28%	0.278	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60	123.7	174	-43.2	-73.5	0	0	0	109.7	L405 H408 P430 Y445	L405-H432 HydrophobicContact CD1-CB 3.7Å; H408-H432 AromaticContact CD2-CE1 3.78Å; H408-H432 AromaticContact CD2-ND1 3.53Å; H408-H432 AromaticContact CE1-CE1 3.25Å; H408-H432 PolarHBondContact CE1-CE1 2.82Å; H408-H432 AromaticContact CE1-ND1 3.79Å; H408-H432 AromaticContact CG-CE1 3.91Å; H408-H432 AromaticContact CG-ND1 3.92Å; H408-H432 AromaticContact ND1-CE1 3.58Å; H408-H432 AromaticContact ND1-NE2 3.96Å; H408-H432 AromaticContact NE2-CE1 3.36Å; H408-H432 PolarHBondContact NE2-CE1 2.91Å; H408-H432 AromaticContact NE2-ND1 3.44Å; H408-H432 PolarHBondContact NE2-ND1 3.32Å; P430-H432 PolarHBondContact O-N 3.32Å; H432-Y445 HydrophobicContact CB-CE2 4.39Å; H432-Y445 PolarHBondContact CE1-OH 2.77Å; H432-Y445 AromaticContact ND1-CE2 3.76Å; H432-Y445 AromaticContact ND1-CZ 3.73Å; H432-Y445 PolarHBondContact ND1-OH 2.84Å
433	F	91.1	Very high	91	Very high	133 Å²	133	65.5 Å²	65.5	58%	0.583	33%	0.327	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.4	-38.8	-173.9	-168.3	-98.5	0	0	0	112.1	L381 M431 A446	L381-F433 HydrophobicContact CD1-CD1 4.24Å; L381-F433 HydrophobicContact CD1-CE1 4.43Å; M431-F433 PolarHBondContact O-N 3.1Å; F433-A446 WeakPolarHBondContact CA-O 3.37Å; F433-A446 HydrophobicContact CB-CB 4.4Å; F433-A446 WeakPolarHBondContact CB-O 3.12Å; F433-A446 PolarHBondContact N-O 3.2Å
434	A	94.8	Very high	91.2	Very high	17 Å²	17	62.2 Å²	62.2	14%	0.14	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.8	146.7	170.8	0	0	0	0	0	111	Y445 A446	A434-Y445 WeakPolarHBondContact O-CA 3.39Å; A434-A446 HydrophobicContact CB-CB 4.27Å; A434-A446 PolarHBondContact N-O 3.34Å; A434-A446 VanDerWaalsContact N-O 3.16Å; A434-A446 PolarHBondContact O-N 3.36Å
435	L	96	Very high	91.4	Very high	0 Å²	0	60.8 Å²	60.8	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	117.5	165.1	-175.3	63	0	0	0	107.7	A404 H408 I411 I443 Y445	A404-L435 HydrophobicContact CB-CD2 4.2Å; A404-L435 HydrophobicContact CB-CG 4.19Å; A404-L435 PolarHBondContact N-O 3.09Å; H408-L435 HydrophobicContact CB-CD2 4.19Å; I411-L435 HydrophobicContact CD1-CD2 3.73Å; L435-I443 HydrophobicContact CD1-CG2 3.52Å; L435-I443 HydrophobicContact CG-CG2 4.45Å; L435-Y445 HydrophobicContact CB-CD2 4.43Å; L435-Y445 HydrophobicContact CD1-CD2 3.86Å; L435-Y445 HydrophobicContact CD1-CG 4.05Å
436	R	95.4	Very high	91.7	Very high	107 Å²	107	58 Å²	58	40%	0.404	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	133.1	-176.4	-58.6	179.3	175.3	131.5	-1.3	110.1	F401 L402 F438 I443 T444	F401-R436 HydrophobicContact CB-CB 4.13Å; F401-R436 HydrophobicContact CD2-CB 3.67Å; F401-R436 HydrophobicContact CD2-CG 3.48Å; F401-R436 VanDerWaalsContact CD2-CG 3.48Å; F401-R436 HydrophobicContact CE2-CB 4.39Å; F401-R436 HydrophobicContact CE2-CG 3.69Å; F401-R436 HydrophobicContact CG-CB 4Å; F401-R436 HydrophobicContact CG-CG 4.13Å; F401-R436 HydrophobicContact CZ-CG 4.45Å; L402-R436 WeakPolarHBondContact O-CA 3.5Å; R436-F438 HydrophobicContact CB-CE2 4.4Å; R436-I443 WeakPolarHBondContact O-CA 3.32Å; R436-T444 PolarHBondContact N-O 2.88Å; R436-T444 PolarHBondContact O-N 3.34Å
437	I	95.1	Very high	92.2	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	121.5	175	-56.8	166.9	0	0	0	107.9	L334 L391 F401 L402 A404 I411 I443	L334-I437 HydrophobicContact CD1-CD1 3.71Å; L391-I437 HydrophobicContact CB-CG2 4.11Å; L391-I437 HydrophobicContact CD1-CD1 4.17Å; F401-I437 CarbonylContact C-O 3.48Å; F401-I437 WeakPolarHBondContact CA-O 3.49Å; F401-I437 WeakPolarHBondContact CB-O 3.46Å; L402-I437 HydrophobicContact CB-CB 4.47Å; L402-I437 PolarHBondContact N-O 2.7Å; L402-I437 PolarHBondContact O-N 3.24Å; A404-I437 HydrophobicContact CB-CD1 3.76Å; A404-I437 HydrophobicContact CB-CG1 4.13Å; I411-I437 HydrophobicContact CD1-CD1 3.96Å; I437-I443 HydrophobicContact CG1-CG1 4.46Å; I437-I443 HydrophobicContact CG1-CG2 4.43Å
438	F	93.8	Very high	92.6	Very high	65 Å²	65	51.4 Å²	51.4	29%	0.285	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	157.2	176.2	-68.4	-90.3	0	0	0	111.3	F401 R436 N440 G441 T442 T444	F401-F438 HydrophobicContact CB-CD1 3.93Å; F401-F438 HydrophobicContact CB-CE1 3.96Å; F401-F438 HydrophobicContact CB-CG 4.27Å; F401-F438 HydrophobicContact CB-CZ 4.3Å; F401-F438 HydrophobicContact CD1-CE1 4.28Å; R436-F438 HydrophobicContact CB-CE2 4.4Å; F438-N440 WeakPolarHBondContact CB-OD1 3.44Å; F438-N440 PolarHBondContact O-N 3.48Å; F438-G441 PolarHBondContact O-N 2.86Å; F438-T442 WeakPolarHBondContact CD2-O 3.42Å; F438-T442 PolarHBondContact N-O 3.39Å; F438-T444 HydrophobicContact CE2-CG2 3.82Å
439	R	89.4	Confident	93.1	Very high	71 Å²	71	47.9 Å²	47.9	27%	0.268	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.5	-32.9	-177.6	-56.1	-175.3	-171.3	163.6	14.4	113.9	Y393 N395 S397 H398 Y399 D400 G441	Y393-R439 HydrophobicContact CD2-CG 4.46Å; Y393-R439 HydrophobicContact CE1-CB 4.4Å; Y393-R439 HydrophobicContact CE1-CG 4.3Å; Y393-R439 HydrophobicContact CE2-CB 4.42Å; Y393-R439 HydrophobicContact CE2-CG 3.75Å; Y393-R439 PolarHBondContact N-O 2.85Å; Y393-R439 VanDerWaalsContact N-O 3.16Å; N395-R439 PolarHBondContact OD1-NH1 3.36Å; S397-R439 PolarHBondContact O-NH2 2.86Å; H398-R439 PolarHBondContact O-NH2 3.35Å; Y399-R439 VanDerWaalsContact O-CZ 3.3Å; Y399-R439 PolarHBondContact O-NE 3.34Å; Y399-R439 PolarHBondContact O-NH2 2.98Å; D400-R439 IonicContact OD1-NH2 3.59Å; R439-G441 VanDerWaalsContact C-N 3.3Å; R439-G441 PolarHBondContact O-N 3.37Å
440	N	90.8	Very high	93.5	Very high	84 Å²	84	43.8 Å²	43.8	45%	0.449	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.3	6.4	178.6	74.5	-25	0	0	0	114.9	N387 Q392 F438 T442	N387-N440 PolarHBondContact OD1-O 2.98Å; Q392-N440 VanDerWaalsContact CG-O 3.25Å; Q392-N440 WeakPolarHBondContact CG-O 3.39Å; Q392-N440 PolarHBondContact NE2-O 3.48Å; F438-N440 WeakPolarHBondContact CB-OD1 3.44Å; F438-N440 PolarHBondContact O-N 3.48Å; N440-T442 VanDerWaalsContact C-N 3.26Å; N440-T442 PolarHBondContact ND2-OG1 3.28Å; N440-T442 PolarHBondContact O-N 3.09Å; N440-T442 VanDerWaalsContact OD1-CB 3.23Å; N440-T442 WeakPolarHBondContact OD1-CB 3.29Å; N440-T442 PolarHBondContact OD1-N 2.86Å; N440-T442 PolarHBondContact OD1-OG1 3Å
441	G	92.1	Very high	93.9	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	19%	0.194	C	C	.	.	S	Bend	trans	79.4	2.1	-178.2	0	0	0	0	0	114.4	N387 D388 F438 R439 I443	N387-G441 VanDerWaalsContact OD1-C 3.28Å; D388-G441 PolarHBondContact N-O 3.4Å; F438-G441 PolarHBondContact O-N 2.86Å; R439-G441 VanDerWaalsContact C-N 3.3Å; R439-G441 PolarHBondContact O-N 3.37Å; G441-I443 PolarHBondContact O-N 3.28Å
442	T	95.4	Very high	94.1	Very high	22 Å²	22	38.7 Å²	38.7	14%	0.135	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	130.5	170.8	-63.5	0	0	0	0	109.3	Q385 W386 N387 F438 N440	Q385-T442 HydrophobicContact CG-CG2 3.69Å; W386-T442 CarbonylContact O-C 3.57Å; W386-T442 WeakPolarHBondContact O-CA 3.29Å; N387-T442 PolarHBondContact OD1-N 3.45Å; N387-T442 VanDerWaalsContact OD1-N 3.17Å; N387-T442 PolarHBondContact OD1-OG1 2.94Å; N387-T442 VanDerWaalsContact OD1-OG1 3.12Å; F438-T442 WeakPolarHBondContact CD2-O 3.42Å; F438-T442 PolarHBondContact N-O 3.39Å; N440-T442 VanDerWaalsContact C-N 3.26Å; N440-T442 PolarHBondContact ND2-OG1 3.28Å; N440-T442 PolarHBondContact O-N 3.09Å; N440-T442 VanDerWaalsContact OD1-CB 3.23Å; N440-T442 WeakPolarHBondContact OD1-CB 3.29Å; N440-T442 PolarHBondContact OD1-N 2.86Å; N440-T442 PolarHBondContact OD1-OG1 3Å
443	I	96.8	Very high	94.1	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	133.5	176.2	-45.8	-171.8	0	0	0	108	Q385 W386 D388 L391 I411 L435 R436 I437 G441	Q385-I443 VanDerWaalsContact CA-O 3.27Å; Q385-I443 WeakPolarHBondContact CA-O 3.16Å; W386-I443 HydrophobicContact CD2-CB 4.29Å; W386-I443 HydrophobicContact CH2-CB 4.48Å; W386-I443 HydrophobicContact CH2-CG2 4.09Å; W386-I443 HydrophobicContact CZ2-CB 3.96Å; W386-I443 HydrophobicContact CZ2-CD1 3.9Å; W386-I443 HydrophobicContact CZ2-CG1 4.46Å; W386-I443 HydrophobicContact CZ2-CG2 3.82Å; W386-I443 PolarHBondContact N-O 3.16Å; W386-I443 PolarHBondContact O-N 3.36Å; D388-I443 HydrophobicContact CB-CD1 4.16Å; L391-I443 HydrophobicContact CD1-CD1 3.66Å; I411-I443 HydrophobicContact CG2-CD1 4.08Å; L435-I443 HydrophobicContact CD1-CG2 3.52Å; L435-I443 HydrophobicContact CG-CG2 4.45Å; R436-I443 WeakPolarHBondContact O-CA 3.32Å; I437-I443 HydrophobicContact CG1-CG1 4.46Å; I437-I443 HydrophobicContact CG1-CG2 4.43Å; G441-I443 PolarHBondContact O-N 3.28Å
444	T	96.3	Very high	94.1	Very high	34 Å²	34	32 Å²	32	21%	0.209	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	125.1	164.9	59.6	0	0	0	0	109.7	Q384 Q385 R436 F438	Q384-T444 WeakPolarHBondContact O-CA 3.44Å; Q385-T444 HydrophobicContact CB-CG2 4.15Å; Q385-T444 HydrophobicContact CG-CG2 3.86Å; R436-T444 PolarHBondContact N-O 2.88Å; R436-T444 PolarHBondContact O-N 3.34Å; F438-T444 HydrophobicContact CE2-CG2 3.82Å
445	Y	96.3	Very high	93.9	Very high	11 Å²	11	31.6 Å²	31.6	4%	0.043	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	132.5	-178.5	174.2	-133.6	0	0	0	109.4	N383 Q384 W386 H408 H432 A434 L435 M447	N383-Y445 WeakPolarHBondContact CA-O 3.35Å; Q384-Y445 PolarHBondContact N-O 2.93Å; Q384-Y445 PolarHBondContact O-N 3.47Å; W386-Y445 HydrophobicContact CH2-CD1 4.26Å; W386-Y445 HydrophobicContact CH2-CG 4.25Å; W386-Y445 HydrophobicContact CZ3-CD1 4.26Å; W386-Y445 HydrophobicContact CZ3-CG 4.39Å; H408-Y445 AromaticContact CD2-CE2 3.69Å; H408-Y445 AromaticContact CD2-CZ 3.89Å; H408-Y445 AromaticContact NE2-CE2 3.94Å; H408-Y445 AromaticContact NE2-CZ 3.62Å; H408-Y445 PolarHBondContact NE2-OH 2.84Å; H432-Y445 HydrophobicContact CB-CE2 4.39Å; H432-Y445 PolarHBondContact CE1-OH 2.77Å; H432-Y445 AromaticContact ND1-CE2 3.76Å; H432-Y445 AromaticContact ND1-CZ 3.73Å; H432-Y445 PolarHBondContact ND1-OH 2.84Å; A434-Y445 WeakPolarHBondContact O-CA 3.39Å; L435-Y445 HydrophobicContact CB-CD2 4.43Å; L435-Y445 HydrophobicContact CD1-CD2 3.86Å; L435-Y445 HydrophobicContact CD1-CG 4.05Å; Y445-M447 HydrophobicContact CE1-CB 4.33Å; Y445-M447 HydrophobicContact CE1-CE 4.22Å; Y445-M447 HydrophobicContact CE1-CG 3.95Å; Y445-M447 HydrophobicContact CE1-SD 3.9Å; Y445-M447 HydrophobicContact CE2-CB 4.18Å; Y445-M447 WeakPolarHBondContact OH-CB 3.47Å; Y445-M447 PolarHBondContact OH-SD 2.92Å; Y445-M447 VanDerWaalsContact OH-SD 3.35Å
446	A	95.4	Very high	93.2	Very high	9 Å²	9	39.3 Å²	39.3	7%	0.074	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	127.2	176.4	0	0	0	0	0	109.6	L382 N383 F433 A434	L382-A446 WeakPolarHBondContact O-CA 3.31Å; N383-A446 WeakPolarHBondContact OD1-CB 3.47Å; F433-A446 WeakPolarHBondContact CA-O 3.37Å; F433-A446 HydrophobicContact CB-CB 4.4Å; F433-A446 WeakPolarHBondContact CB-O 3.12Å; F433-A446 PolarHBondContact N-O 3.2Å; A434-A446 HydrophobicContact CB-CB 4.27Å; A434-A446 PolarHBondContact N-O 3.34Å; A434-A446 VanDerWaalsContact N-O 3.16Å; A434-A446 PolarHBondContact O-N 3.36Å
447	M	94.8	Very high	92.6	Very high	12 Å²	12	34.9 Å²	34.9	6%	0.059	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	142.7	176.2	59.1	164.9	172.8	0	0	112.5	L381 L382 P430 M431 Y445	L381-M447 CarbonylContact C-O 3.55Å; L381-M447 WeakPolarHBondContact CA-O 3.46Å; L382-M447 HydrophobicContact CB-CE 4.48Å; L382-M447 HydrophobicContact CB-CG 4.33Å; L382-M447 HydrophobicContact CD2-CE 3.71Å; L382-M447 PolarHBondContact N-O 2.98Å; L382-M447 PolarHBondContact O-N 3.27Å; P430-M447 HydrophobicContact CB-CB 4.19Å; P430-M447 HydrophobicContact CB-CG 4.44Å; P430-M447 HydrophobicContact CB-SD 3.54Å; P430-M447 VanDerWaalsContact CB-SD 3.54Å; P430-M447 HydrophobicContact CG-SD 4.01Å; M431-M447 WeakPolarHBondContact O-CA 3.48Å; Y445-M447 HydrophobicContact CE1-CB 4.33Å; Y445-M447 HydrophobicContact CE1-CE 4.22Å; Y445-M447 HydrophobicContact CE1-CG 3.95Å; Y445-M447 HydrophobicContact CE1-SD 3.9Å; Y445-M447 HydrophobicContact CE2-CB 4.18Å; Y445-M447 WeakPolarHBondContact OH-CB 3.47Å; Y445-M447 PolarHBondContact OH-SD 2.92Å; Y445-M447 VanDerWaalsContact OH-SD 3.35Å
448	R	93.6	Very high	92.2	Very high	89 Å²	89	37.8 Å²	37.8	34%	0.336	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	129.9	173.4	-170.9	173	174	163.8	-0	110.1	L364 E379 F380 L381 M431	L364-R448 HydrophobicContact CD1-CG 4.17Å; E379-R448 HydrophobicContact CG-CG 4.31Å; E379-R448 IonicContact OE1-CZ 2.69Å; E379-R448 VanDerWaalsContact OE1-CZ 3.27Å; E379-R448 IonicContact OE1-NE 2.74Å; E379-R448 PolarHBondContact OE1-NE 3.46Å; E379-R448 IonicContact OE1-NH2 2.64Å; E379-R448 PolarHBondContact OE1-NH2 2.95Å; E379-R448 IonicContact OE2-CZ 2.72Å; E379-R448 IonicContact OE2-NE 3.36Å; E379-R448 IonicContact OE2-NH2 3.84Å; E379-R448 PolarHBondContact OE2-NH2 3.03Å; F380-R448 WeakPolarHBondContact O-CA 3.46Å; L381-R448 HydrophobicContact CD2-CB 3.68Å; L381-R448 HydrophobicContact CD2-CG 4.11Å; M431-R448 HydrophobicContact CB-CB 4.31Å; M431-R448 PolarHBondContact N-O 3.48Å; M431-R448 PolarHBondContact O-N 3.45Å
449	R	93.8	Very high	91.7	Very high	20 Å²	20	36 Å²	36	8%	0.075	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	148.8	171.4	-60.8	-59.6	-65.7	150.4	-8	109.6	E379 F380 F418 I428 P430	E379-R449 WeakPolarHBondContact CA-O 3.37Å; F380-R449 HydrophobicContact CD2-CB 4.4Å; F380-R449 HydrophobicContact CE1-CB 4.17Å; F380-R449 HydrophobicContact CE2-CB 3.92Å; F380-R449 HydrophobicContact CE2-CG 4.19Å; F380-R449 HydrophobicContact CZ-CB 3.8Å; F380-R449 HydrophobicContact CZ-CG 4.36Å; F380-R449 PolarHBondContact N-O 3.29Å; F380-R449 PolarHBondContact O-N 3.18Å; F418-R449 HydrophobicContact CE2-CG 4.09Å; F418-R449 HydrophobicContact CZ-CG 3.73Å; I428-R449 PolarHBondContact O-NH1 2.95Å; I428-R449 PolarHBondContact O-NH2 3.39Å; I428-R449 VanDerWaalsContact O-NH2 3.15Å; P430-R449 VanDerWaalsContact CA-NH1 3.32Å; P430-R449 VanDerWaalsContact N-NH1 3.17Å
450	H	93.4	Very high	91.6	Very high	42 Å²	42	37.4 Å²	37.4	19%	0.194	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	113.8	177	-157.1	127.4	0	0	0	108.1	E377 E379 K425	E377-H450 IonicContact OE2-NE2 3.63Å; E379-H450 VanDerWaalsContact CD-ND1 3.25Å; E379-H450 HydrophobicContact CG-CB 4.43Å; E379-H450 IonicContact OE1-CE1 2.88Å; E379-H450 IonicContact OE1-CG 3.08Å; E379-H450 IonicContact OE1-ND1 3.61Å; E379-H450 PolarHBondContact OE1-ND1 2.82Å; K425-H450 HydrophobicContact CB-CB 4.11Å; K425-H450 VanDerWaalsContact CD-CD2 3.42Å; K425-H450 WeakPolarHBondContact CD-CD2 3.42Å; K425-H450 VanDerWaalsContact CD-NE2 3.31Å; K425-H450 WeakPolarHBondContact CD-NE2 3.26Å; K425-H450 PolarHBondContact N-O 3.05Å
451	L	94.4	Very high	91.5	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	148.2	-177	-48.3	-175.6	0	0	0	109.7	E377 V378 F380 F418 M420 F424 L453 F471	E377-L451 CarbonylContact C-O 3.24Å; E377-L451 WeakPolarHBondContact CA-O 3.39Å; V378-L451 PolarHBondContact N-O 2.82Å; V378-L451 PolarHBondContact O-N 3.14Å; F380-L451 HydrophobicContact CE1-CD1 3.67Å; F380-L451 HydrophobicContact CE1-CG 3.79Å; F380-L451 HydrophobicContact CZ-CD1 3.94Å; F380-L451 HydrophobicContact CZ-CG 4.26Å; F418-L451 HydrophobicContact CD1-CD1 4.45Å; M420-L451 HydrophobicContact CE-CD2 4.23Å; M420-L451 HydrophobicContact SD-CB 4.03Å; M420-L451 HydrophobicContact SD-CD1 3.94Å; M420-L451 HydrophobicContact SD-CD2 3.93Å; M420-L451 HydrophobicContact SD-CG 4.17Å; F424-L451 HydrophobicContact CD1-CD2 3.42Å; F424-L451 VanDerWaalsContact CD1-CD2 3.42Å; F424-L451 HydrophobicContact CE1-CD2 3.51Å; L451-L453 HydrophobicContact CB-CD2 3.87Å; L451-L453 HydrophobicContact CB-CG 4.17Å; L451-L453 HydrophobicContact CD1-CD2 4Å; L451-F471 HydrophobicContact CD1-CB 4.08Å; L451-F471 HydrophobicContact CD1-CD1 4.14Å; L451-F471 HydrophobicContact CD1-CD2 3.94Å; L451-F471 HydrophobicContact CD1-CE2 4.37Å; L451-F471 HydrophobicContact CD1-CG 3.8Å
452	I	94.1	Very high	91.3	Very high	36 Å²	36	34.5 Å²	34.5	19%	0.185	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	88.3	169.1	-52.9	-179.8	0	0	0	107	K375 Y376 G422 D423 K425	K375-I452 HydrophobicContact CB-CG2 4Å; K375-I452 HydrophobicContact CD-CG2 4.01Å; K375-I452 HydrophobicContact CG-CG2 4.39Å; Y376-I452 CarbonylContact O-C 3.58Å; G422-I452 CarbonylContact C-O 3.56Å; G422-I452 WeakPolarHBondContact CA-O 3.49Å; D423-I452 PolarHBondContact N-O 2.84Å; D423-I452 PolarHBondContact O-N 2.87Å; K425-I452 HydrophobicContact CB-CD1 3.95Å; K425-I452 HydrophobicContact CB-CG1 3.86Å; K425-I452 HydrophobicContact CD-CD1 4.48Å; K425-I452 HydrophobicContact CG-CD1 4.08Å; K425-I452 HydrophobicContact CG-CG1 4.4Å
453	L	93.7	Very high	90.9	Very high	1 Å²	1	33.5 Å²	33.5	1%	0.005	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	132.5	-177.5	-55.7	-178.8	0	0	0	110.1	K375 Y376 V378 M420 H421 L451 C469 F471	K375-L453 CarbonylContact C-O 3.56Å; K375-L453 VanDerWaalsContact CA-O 3.26Å; K375-L453 WeakPolarHBondContact CA-O 3.45Å; Y376-L453 PolarHBondContact N-O 2.85Å; Y376-L453 PolarHBondContact O-N 2.92Å; V378-L453 HydrophobicContact CB-CD1 4.18Å; V378-L453 HydrophobicContact CG2-CD1 3.73Å; V378-L453 HydrophobicContact CG2-CG 4.25Å; M420-L453 HydrophobicContact CB-CD2 3.8Å; M420-L453 HydrophobicContact CG-CD2 4.37Å; M420-L453 HydrophobicContact SD-CD2 3.84Å; H421-L453 CarbonylContact O-C 3.51Å; H421-L453 WeakPolarHBondContact O-CA 3.48Å; L451-L453 HydrophobicContact CB-CD2 3.87Å; L451-L453 HydrophobicContact CB-CG 4.17Å; L451-L453 HydrophobicContact CD1-CD2 4Å; L453-C469 HydrophobicContact CB-CB 4.28Å; L453-C469 HydrophobicContact CD1-CB 3.84Å; L453-F471 HydrophobicContact CD1-CD1 3.8Å; L453-F471 HydrophobicContact CD2-CB 4.11Å
454	S	91.3	Very high	90.5	Very high	52 Å²	52	33.7 Å²	33.7	36%	0.364	18%	0.175	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	104.6	170.9	-60.8	0	0	0	0	108.4	H421	H421-S454 PolarHBondContact O-N 2.82Å
455	C	89.6	Confident	90.1	Very high	9 Å²	9	32.1 Å²	32.1	6%	0.061	17%	0.165	C	C	.	.			trans	-96	144	-162.1	-53.3	0	0	0	0	112.7	L374 Y376 G457 P467 K468 C469	L374-C455 PolarHBondContact O-N 2.84Å; Y376-C455 HydrophobicContact CD2-CB 3.95Å; Y376-C455 VanDerWaalsContact CD2-SG 3.51Å; Y376-C455 HydrophobicContact CE2-CB 4.37Å; C455-G457 PolarHBondContact O-N 3.44Å; C455-P467 HydrophobicContact CB-CB 4.29Å; C455-K468 CarbonylContact C-O 3.58Å; C455-K468 WeakPolarHBondContact CA-O 3.04Å; C455-K468 WeakPolarHBondContact CB-O 3.04Å; C455-C469 HydrophobicContact CB-CB 4Å; C455-C469 WeakPolarHBondContact CB-SG 3.45Å; C455-C469 WeakPolarHBondContact SG-CB 3.47Å; C455-C469 CovalentContact SG-SG 2.02Å; C455-C469 PolarHBondContact SG-SG 3.46Å
456	Q	82.6	Confident	89.8	Confident	161 Å²	161	34 Å²	34	75%	0.752	18%	0.176	S	C	*	.	B	Isolated β-bridge	trans	-92.6	101.6	-176.3	-169.2	170.6	-2.4	0	0	110.2	K468	Q456-K468 PolarHBondContact N-O 3.25Å; Q456-K468 PolarHBondContact O-N 2.9Å
457	G	82.8	Confident	89.6	Confident	14 Å²	14	33.6 Å²	33.6	14%	0.144	17%	0.173	C	C	.	.			trans	-99.6	164.1	166.9	0	0	0	0	0	112.2	C455 L459	C455-G457 PolarHBondContact O-N 3.44Å; G457-L459 VanDerWaalsContact C-N 3.35Å; G457-L459 PolarHBondContact O-N 2.81Å
458	S	85.8	Confident	89.4	Confident	61 Å²	61	38 Å²	38	43%	0.427	19%	0.192	S	C	.	.			trans	-79.4	82.5	174.3	-173.4	0	0	0	0	110.4	H460 I461 F462	S458-H460 PolarHBondContact O-N 3.18Å; S458-I461 VanDerWaalsContact O-CG1 3.3Å; S458-I461 WeakPolarHBondContact O-CG1 3.45Å; S458-I461 PolarHBondContact O-N 3.14Å; S458-F462 PolarHBondContact O-N 2.77Å
459	L	84.1	Confident	89.4	Confident	28 Å²	28	33.8 Å²	33.8	15%	0.147	18%	0.176	C	C	.	.	G	3₁₀ helix	trans	-56.9	-23.2	-173.9	-61.3	178.4	0	0	0	114.2	L374 G457 I461 F462 V594 N596 L597	L374-L459 HydrophobicContact CD1-CD1 4.45Å; L374-L459 HydrophobicContact CD1-CD2 3.96Å; L374-L459 HydrophobicContact CD2-CD2 3.82Å; G457-L459 VanDerWaalsContact C-N 3.35Å; G457-L459 PolarHBondContact O-N 2.81Å; L459-I461 VanDerWaalsContact C-N 3.26Å; L459-I461 PolarHBondContact O-N 3.12Å; L459-F462 VanDerWaalsContact O-CB 3.31Å; L459-F462 WeakPolarHBondContact O-CB 3.4Å; L459-F462 PolarHBondContact O-N 2.99Å; L459-V594 HydrophobicContact CD1-CB 4.36Å; L459-V594 HydrophobicContact CD1-CG1 3.61Å; L459-N596 CarbonylContact C-O 3.29Å; L459-N596 VanDerWaalsContact C-O 3.29Å; L459-N596 HydrophobicContact CB-CB 4.22Å; L459-N596 HydrophobicContact CD1-CB 4.47Å; L459-L597 HydrophobicContact CD2-CD2 4.39Å
460	H	86.8	Confident	89.4	Confident	100 Å²	100	35 Å²	35	46%	0.463	19%	0.188	S	C	.	.	G	3₁₀ helix	trans	-62.7	-30.6	175.3	-62.9	-57.6	0	0	0	113.4	S458 N596 T598 A599	S458-H460 PolarHBondContact O-N 3.18Å; H460-N596 PolarHBondContact N-O 3.29Å; H460-N596 PolarHBondContact ND1-O 3.32Å; H460-T598 PolarHBondContact ND1-OG1 3.17Å; H460-A599 WeakPolarHBondContact O-CB 3.25Å; H460-A599 PolarHBondContact O-N 3.18Å
461	I	89	Confident	89.4	Confident	23 Å²	23	33.1 Å²	33.1	12%	0.118	18%	0.179	C	C	.	.	G	3₁₀ helix	trans	-106.5	7.1	178	68.4	170.5	0	0	0	113.2	S458 L459 F464 D465 Y751 F754	S458-I461 VanDerWaalsContact O-CG1 3.3Å; S458-I461 WeakPolarHBondContact O-CG1 3.45Å; S458-I461 PolarHBondContact O-N 3.14Å; L459-I461 VanDerWaalsContact C-N 3.26Å; L459-I461 PolarHBondContact O-N 3.12Å; I461-F464 WeakPolarHBondContact O-CB 3.41Å; I461-F464 WeakPolarHBondContact O-CD2 3.3Å; I461-F464 PolarHBondContact O-N 2.93Å; I461-D465 HydrophobicContact CG1-CB 4.28Å; I461-Y751 HydrophobicContact CB-CD1 4.43Å; I461-Y751 HydrophobicContact CG2-CD1 4.14Å; I461-F754 HydrophobicContact CD1-CB 4.38Å; I461-F754 HydrophobicContact CG2-CB 4.24Å
462	F	87.6	Confident	89.4	Confident	1 Å²	1	33.8 Å²	33.8	0%	0.004	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.7	129.1	177.7	178.9	-84.5	0	0	0	111	S458 L459 D465 Y540 F587 L591 L597 M600	S458-F462 PolarHBondContact O-N 2.77Å; L459-F462 VanDerWaalsContact O-CB 3.31Å; L459-F462 WeakPolarHBondContact O-CB 3.4Å; L459-F462 PolarHBondContact O-N 2.99Å; F462-D465 WeakPolarHBondContact CD2-OD1 3.43Å; F462-Y540 HydrophobicContact CE1-CE1 4.03Å; F462-Y540 AromaticContact CZ-CE1 3.84Å; F462-Y540 HydrophobicContact CZ-CE1 3.84Å; F462-Y540 AromaticContact CZ-CZ 3.9Å; F462-F587 HydrophobicContact CE1-CZ 4.19Å; F462-L591 HydrophobicContact CE1-CD1 4.23Å; F462-L591 HydrophobicContact CE1-CD2 3.58Å; F462-L591 HydrophobicContact CE2-CD2 4.18Å; F462-L591 HydrophobicContact CZ-CD2 3.31Å; F462-L597 HydrophobicContact CB-CD2 3.87Å; F462-L597 HydrophobicContact CD1-CD2 3.77Å; F462-L597 HydrophobicContact CD2-CD2 4.35Å; F462-L597 HydrophobicContact CE1-CD2 4.46Å; F462-L597 HydrophobicContact CG-CD2 3.73Å; F462-M600 HydrophobicContact CD1-CE 4.4Å; F462-M600 HydrophobicContact CD1-CG 3.88Å; F462-M600 HydrophobicContact CE1-CE 4.23Å; F462-M600 HydrophobicContact CE1-CG 4.33Å
463	P	87.9	Confident	89.4	Confident	0 Å²	0	32 Å²	32	0%	0	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	cis	-103.9	20.4	18.1	41	-33	0	0	0	113.5	D465 Y540 F545 M600	P463-D465 PolarHBondContact O-N 2.81Å; P463-Y540 HydrophobicContact CB-CD1 3.67Å; P463-Y540 HydrophobicContact CB-CD2 3.54Å; P463-Y540 HydrophobicContact CB-CE1 3.81Å; P463-Y540 HydrophobicContact CB-CE2 3.74Å; P463-Y540 HydrophobicContact CB-CG 3.52Å; P463-Y540 HydrophobicContact CG-CD1 3.79Å; P463-Y540 HydrophobicContact CG-CD2 3.9Å; P463-Y540 HydrophobicContact CG-CE1 4.42Å; P463-Y540 HydrophobicContact CG-CG 3.48Å; P463-Y540 VanDerWaalsContact CG-CG 3.48Å; P463-F545 HydrophobicContact CG-CE2 4.03Å; P463-F545 HydrophobicContact CG-CZ 4.33Å; P463-M600 HydrophobicContact CB-CE 4.3Å; P463-M600 HydrophobicContact CG-CE 3.67Å
464	F	87.9	Confident	89.3	Confident	4 Å²	4	32 Å²	32	2%	0.018	18%	0.175	C	C	.	.	S	Bend	trans	-91	20.8	179.7	-46.5	-66.4	0	0	0	112	I461 F541 F545 F747 F748	I461-F464 WeakPolarHBondContact O-CB 3.41Å; I461-F464 WeakPolarHBondContact O-CD2 3.3Å; I461-F464 PolarHBondContact O-N 2.93Å; F464-F541 AromaticContact CE1-CE2 3.95Å; F464-F541 HydrophobicContact CE1-CE2 3.95Å; F464-F541 HydrophobicContact CE1-CZ 4.03Å; F464-F541 HydrophobicContact CZ-CZ 4.41Å; F464-F545 HydrophobicContact CE1-CE2 4.27Å; F464-F545 HydrophobicContact CE2-CE2 4.5Å; F464-F545 HydrophobicContact CE2-CZ 4.2Å; F464-F545 AromaticContact CZ-CE2 3.68Å; F464-F545 HydrophobicContact CZ-CE2 3.68Å; F464-F545 AromaticContact CZ-CZ 3.78Å; F464-F545 HydrophobicContact CZ-CZ 3.78Å; F464-F747 HydrophobicContact CE2-CE1 4.35Å; F464-F748 HydrophobicContact CZ-CD1 4.22Å; F464-F748 HydrophobicContact CZ-CE1 4.16Å
465	D	88.2	Confident	89.3	Confident	1 Å²	1	29.6 Å²	29.6	1%	0.005	16%	0.158	C	C	.	.			trans	-87.6	143.9	178.6	64.7	-58.7	0	0	0	112.2	I461 F462 P463 P467 R535	I461-D465 HydrophobicContact CG1-CB 4.28Å; F462-D465 WeakPolarHBondContact CD2-OD1 3.43Å; P463-D465 PolarHBondContact O-N 2.81Å; D465-P467 WeakPolarHBondContact O-CD 3.47Å; D465-R535 IonicContact OD1-CZ 2.78Å; D465-R535 IonicContact OD1-NE 3.17Å; D465-R535 PolarHBondContact OD1-NE 2.77Å; D465-R535 IonicContact OD1-NH2 3.66Å; D465-R535 PolarHBondContact OD1-NH2 3.48Å; D465-R535 IonicContact OD2-CZ 3.61Å; D465-R535 IonicContact OD2-NE 3.91Å; D465-R535 IonicContact OD2-NH2 2.64Å; D465-R535 PolarHBondContact OD2-NH2 2.99Å
466	D	89.4	Confident	89.3	Confident	51 Å²	51	33.7 Å²	33.7	27%	0.273	18%	0.178	S	C	.	.			trans	-100.9	93.6	168.4	-71.1	-21.6	0	0	0	109.1	I508 T532 F533 T534 R537	D466-I508 HydrophobicContact CB-CD1 4.21Å; D466-T532 HydrophobicContact CB-CG2 4.32Å; D466-F533 CarbonylContact C-O 3.57Å; D466-F533 VanDerWaalsContact C-O 3.24Å; D466-F533 WeakPolarHBondContact CA-O 3.39Å; D466-F533 VanDerWaalsContact CB-O 3.32Å; D466-F533 WeakPolarHBondContact CB-O 3.43Å; D466-T534 VanDerWaalsContact OD1-CA 3.31Å; D466-T534 WeakPolarHBondContact OD1-CA 3.35Å; D466-T534 VanDerWaalsContact OD1-CB 3.27Å; D466-T534 WeakPolarHBondContact OD1-CB 3.49Å; D466-T534 PolarHBondContact OD1-OG1 3.16Å; D466-R537 IonicContact OD1-CZ 3.63Å; D466-R537 IonicContact OD1-NH2 2.81Å; D466-R537 PolarHBondContact OD1-NH2 2.89Å; D466-R537 IonicContact OD2-NH2 2.75Å; D466-R537 PolarHBondContact OD2-NH2 2.9Å
467	P	90.2	Very high	89.6	Confident	1 Å²	1	29.7 Å²	29.7	1%	0.006	17%	0.168	C	C	.	.			trans	-68	138.1	-173.9	24	-33.4	0	0	0	113.4	Y376 C455 D465 F533	Y376-P467 HydrophobicContact CE2-CB 4.33Å; Y376-P467 HydrophobicContact CE2-CG 3.96Å; Y376-P467 WeakPolarHBondContact OH-CG 3.39Å; C455-P467 HydrophobicContact CB-CB 4.29Å; D465-P467 WeakPolarHBondContact O-CD 3.47Å; P467-F533 VanDerWaalsContact CD-O 3.27Å; P467-F533 WeakPolarHBondContact CD-O 3.21Å; P467-F533 HydrophobicContact CG-CB 4.4Å; P467-F533 PolarHBondContact O-N 3.03Å
468	K	92.1	Very high	90	Very high	103 Å²	103	31.2 Å²	31.2	45%	0.448	17%	0.17	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	124	177.3	-70.3	170.5	166.5	-111.7	0	110.9	C455 Q456 E530 T532	C455-K468 CarbonylContact C-O 3.58Å; C455-K468 WeakPolarHBondContact CA-O 3.04Å; C455-K468 WeakPolarHBondContact CB-O 3.04Å; Q456-K468 PolarHBondContact N-O 3.25Å; Q456-K468 PolarHBondContact O-N 2.9Å; K468-E530 WeakPolarHBondContact CD-OE1 3.48Å; K468-E530 WeakPolarHBondContact CE-OE1 3.26Å; K468-E530 IonicContact NZ-OE1 3.91Å; K468-E530 PolarHBondContact NZ-OE1 2.85Å; K468-T532 HydrophobicContact CG-CG2 4.07Å
469	C	92.9	Very high	90.3	Very high	1 Å²	1	32.8 Å²	32.8	1%	0.007	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	126.4	173.2	-52.3	0	0	0	0	108.8	L453 C455 L531 F533	L453-C469 HydrophobicContact CB-CB 4.28Å; L453-C469 HydrophobicContact CD1-CB 3.84Å; C455-C469 HydrophobicContact CB-CB 4Å; C455-C469 WeakPolarHBondContact CB-SG 3.45Å; C455-C469 WeakPolarHBondContact SG-CB 3.47Å; C455-C469 CovalentContact SG-SG 2.02Å; C455-C469 PolarHBondContact SG-SG 3.46Å; C469-L531 HydrophobicContact CB-CB 4.39Å; C469-L531 PolarHBondContact N-O 3.49Å; C469-L531 PolarHBondContact O-N 3.38Å; C469-F533 HydrophobicContact CB-CE2 4.03Å; C469-F533 WeakPolarHBondContact SG-CE2 3.5Å
470	S	93.2	Very high	90.7	Very high	47 Å²	47	33.3 Å²	33.3	33%	0.329	17%	0.172	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	145.3	174.1	55.2	0	0	0	0	111.9	V529	S470-V529 VanDerWaalsContact CA-O 3.3Å; S470-V529 WeakPolarHBondContact CA-O 3.38Å
471	F	94.5	Very high	90.9	Very high	1 Å²	1	31.6 Å²	31.6	0%	0.004	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	145.6	166.5	67	-87.1	0	0	0	109.4	V378 F380 F418 I419 M420 L451 L453 M473 V529 L531	V378-F471 HydrophobicContact CG1-CE1 4.31Å; F380-F471 HydrophobicContact CD1-CZ 4.28Å; F380-F471 HydrophobicContact CE1-CE1 4.34Å; F380-F471 AromaticContact CE1-CE2 3.95Å; F380-F471 HydrophobicContact CE1-CE2 3.95Å; F380-F471 AromaticContact CE1-CZ 3.71Å; F380-F471 HydrophobicContact CE1-CZ 3.71Å; F380-F471 HydrophobicContact CE2-CE2 4.2Å; F380-F471 HydrophobicContact CE2-CZ 4.42Å; F380-F471 HydrophobicContact CZ-CD2 4.36Å; F380-F471 AromaticContact CZ-CE2 3.57Å; F380-F471 HydrophobicContact CZ-CE2 3.57Å; F380-F471 AromaticContact CZ-CZ 3.8Å; F380-F471 HydrophobicContact CZ-CZ 3.8Å; F418-F471 HydrophobicContact CD1-CD2 4.2Å; I419-F471 CarbonylContact O-C 3.59Å; I419-F471 WeakPolarHBondContact O-CA 3.43Å; M420-F471 HydrophobicContact CB-CB 4Å; L451-F471 HydrophobicContact CD1-CB 4.08Å; L451-F471 HydrophobicContact CD1-CD1 4.14Å; L451-F471 HydrophobicContact CD1-CD2 3.94Å; L451-F471 HydrophobicContact CD1-CE2 4.37Å; L451-F471 HydrophobicContact CD1-CG 3.8Å; L453-F471 HydrophobicContact CD1-CD1 3.8Å; L453-F471 HydrophobicContact CD2-CB 4.11Å; F471-M473 HydrophobicContact CE2-CE 4.21Å; F471-M473 HydrophobicContact CE2-SD 4.49Å; F471-V529 HydrophobicContact CD1-CB 4.12Å; F471-V529 HydrophobicContact CD2-CB 4.48Å; F471-V529 HydrophobicContact CD2-CG2 4.45Å; F471-V529 HydrophobicContact CE1-CB 3.74Å; F471-V529 HydrophobicContact CE1-CG1 3.81Å; F471-V529 HydrophobicContact CE1-CG2 4.23Å; F471-V529 HydrophobicContact CE2-CB 4.12Å; F471-V529 HydrophobicContact CE2-CG2 3.81Å; F471-V529 HydrophobicContact CG-CB 4.49Å; F471-V529 HydrophobicContact CZ-CB 3.74Å; F471-V529 HydrophobicContact CZ-CG1 3.99Å; F471-V529 HydrophobicContact CZ-CG2 3.69Å; F471-V529 PolarHBondContact N-O 3.34Å; F471-V529 VanDerWaalsContact N-O 3.15Å; F471-V529 PolarHBondContact O-N 3.06Å; F471-L531 HydrophobicContact CE1-CD1 4.48Å
472	S	93.8	Very high	91.1	Very high	14 Å²	14	34.7 Å²	34.7	10%	0.098	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	159	179.2	-54.4	0	0	0	0	111.1	F418 I419 L527 Q528	F418-S472 CarbonylContact C-O 3.53Å; F418-S472 WeakPolarHBondContact CA-O 3.39Å; I419-S472 PolarHBondContact N-O 2.73Å; I419-S472 PolarHBondContact O-N 2.8Å; S472-L527 CarbonylContact C-O 3.48Å; S472-L527 WeakPolarHBondContact CA-O 3.21Å; S472-L527 WeakPolarHBondContact CB-O 3.48Å; S472-Q528 WeakPolarHBondContact OG-CB 3.16Å; S472-Q528 WeakPolarHBondContact OG-CG 3.48Å
473	M	93.8	Very high	91.4	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	128.2	-178	-69.7	167.8	-72.1	0	0	109	V359 V361 L382 T416 Y417 F418 F471 W487 C526 L527 V529	V359-M473 HydrophobicContact CG1-CE 4.36Å; V361-M473 HydrophobicContact CG2-CE 4.19Å; L382-M473 HydrophobicContact CD1-CE 4.22Å; L382-M473 HydrophobicContact CD1-SD 3.45Å; L382-M473 WeakPolarHBondContact CD1-SD 3.34Å; L382-M473 HydrophobicContact CD2-SD 4.02Å; L382-M473 HydrophobicContact CG-SD 4.4Å; T416-M473 HydrophobicContact CG2-CB 3.95Å; T416-M473 HydrophobicContact CG2-CG 4.27Å; Y417-M473 WeakPolarHBondContact O-CA 3.07Å; F418-M473 HydrophobicContact CD1-CG 3.61Å; F418-M473 HydrophobicContact CD1-SD 4.26Å; F418-M473 HydrophobicContact CE1-CG 3.52Å; F418-M473 HydrophobicContact CE1-SD 3.59Å; F418-M473 VanDerWaalsContact CE1-SD 3.59Å; F418-M473 HydrophobicContact CG-CG 4.46Å; F418-M473 HydrophobicContact CZ-CG 4.32Å; F418-M473 HydrophobicContact CZ-SD 4.28Å; F471-M473 HydrophobicContact CE2-CE 4.21Å; F471-M473 HydrophobicContact CE2-SD 4.49Å; M473-W487 HydrophobicContact CE-CH2 3.59Å; M473-W487 HydrophobicContact CE-CZ2 4.29Å; M473-W487 HydrophobicContact CE-CZ3 4.33Å; M473-C526 WeakPolarHBondContact O-CA 3.48Å; M473-L527 PolarHBondContact N-O 3.23Å; M473-L527 PolarHBondContact O-N 2.98Å; M473-V529 HydrophobicContact CE-CG2 4.17Å
474	E	92.6	Very high	91.7	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	165	-171.2	-164.2	-170.8	-127.5	0	0	109.3	T416 Y417 I419 R521 Y524 C526	T416-E474 WeakPolarHBondContact CA-O 3.14Å; Y417-E474 PolarHBondContact N-O 2.93Å; Y417-E474 PolarHBondContact O-N 2.85Å; I419-E474 HydrophobicContact CD1-CB 4.17Å; E474-R521 IonicContact OE2-CZ 3.39Å; E474-R521 IonicContact OE2-NE 3.27Å; E474-R521 IonicContact OE2-NH1 2.89Å; E474-R521 PolarHBondContact OE2-NH1 3.34Å; E474-R521 IonicContact OE2-NH2 3.48Å; E474-R521 PolarHBondContact OE2-NH2 2.99Å; E474-R521 VanDerWaalsContact OE2-NH2 3.08Å; E474-Y524 WeakPolarHBondContact OE1-CB 3.1Å; E474-C526 HydrophobicContact CB-CB 4.44Å; E474-C526 HydrophobicContact CG-CB 4.18Å
475	S	91.6	Very high	92	Very high	1 Å²	1	38.6 Å²	38.6	1%	0.007	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	146.4	164.4	177.3	0	0	0	0	110	D415 S477 Y478 R521	D415-S475 WeakPolarHBondContact OD1-CB 3.48Å; D415-S475 PolarHBondContact OD1-OG 2.94Å; D415-S475 PolarHBondContact OD2-OG 2.65Å; S475-S477 PolarHBondContact OG-N 2.04Å; S475-Y478 VanDerWaalsContact CB-O 3.26Å; S475-Y478 WeakPolarHBondContact CB-O 3.26Å; S475-Y478 WeakPolarHBondContact OG-CB 3.26Å; S475-Y478 PolarHBondContact OG-N 3.35Å; S475-Y478 PolarHBondContact OG-O 2.93Å; S475-R521 PolarHBondContact O-NH1 3.43Å
476	I	88	Confident	92.3	Very high	96 Å²	96	40.3 Å²	40.3	49%	0.492	22%	0.217	S	C	.	.	S	Bend	trans	-89.3	-22.7	172	-171.2	166.6	0	0	0	112.9	D415 Y417	D415-I476 HydrophobicContact CB-CG2 3.91Å; D415-I476 PolarHBondContact O-N 3.26Å; D415-I476 VanDerWaalsContact OD2-CG2 3.24Å; D415-I476 WeakPolarHBondContact OD2-CG2 3.49Å; D415-I476 PolarHBondContact OD2-N 3.02Å; Y417-I476 HydrophobicContact CD2-CD1 4.31Å
477	S	89.7	Confident	92.5	Very high	76 Å²	76	39 Å²	39	53%	0.531	21%	0.208	S	C	.	.	S	Bend	trans	-124.1	-16.6	-169.9	-29	0	0	0	0	115.5	D415 S475	D415-S477 WeakPolarHBondContact OD2-CA 3.38Å; D415-S477 WeakPolarHBondContact OD2-CB 3.21Å; D415-S477 PolarHBondContact OD2-N 2.59Å; D415-S477 PolarHBondContact OD2-OG 3.47Å; S475-S477 PolarHBondContact OG-N 2.04Å
478	Y	91.7	Very high	92.4	Very high	47 Å²	47	42.7 Å²	42.7	18%	0.184	22%	0.224	C	C	.	.			trans	-126	129.4	-169.2	-58.8	-80.6	0	0	0	111.9	L348 S475 Q482 I483 Y524	L348-Y478 HydrophobicContact CD1-CD1 4.43Å; L348-Y478 HydrophobicContact CD1-CE1 4.09Å; S475-Y478 VanDerWaalsContact CB-O 3.26Å; S475-Y478 WeakPolarHBondContact CB-O 3.26Å; S475-Y478 WeakPolarHBondContact OG-CB 3.26Å; S475-Y478 PolarHBondContact OG-N 3.35Å; S475-Y478 PolarHBondContact OG-O 2.93Å; Y478-Q482 HydrophobicContact CD1-CB 4.32Å; Y478-I483 HydrophobicContact CD1-CD1 4.5Å; Y478-I483 HydrophobicContact CD2-CD1 3.37Å; Y478-I483 HydrophobicContact CD2-CG1 4.28Å; Y478-I483 HydrophobicContact CE2-CD1 4.01Å; Y478-I483 HydrophobicContact CG-CD1 3.65Å; Y478-I483 HydrophobicContact CG-CG1 4.05Å; Y478-Y524 VanDerWaalsContact O-CD1 3.26Å; Y478-Y524 WeakPolarHBondContact O-CD1 3.34Å; Y478-Y524 WeakPolarHBondContact O-CE1 3.39Å
479	E	91.8	Very high	91.4	Very high	93 Å²	93	45 Å²	45	44%	0.435	24%	0.241	S	C	.	.			trans	-72.3	166.4	176.2	-66.3	-174	173.7	0	0	112.2	A481 Q482 I483 Y524	E479-A481 PolarHBondContact O-N 2.85Å; E479-A481 VanDerWaalsContact O-N 3.09Å; E479-Q482 PolarHBondContact O-N 3.36Å; E479-I483 PolarHBondContact O-N 3.46Å; E479-Y524 HydrophobicContact CG-CE1 4.48Å; E479-Y524 HydrophobicContact CG-CE2 4.14Å
480	E	91.3	Very high	90.4	Very high	39 Å²	39	48.5 Å²	48.5	18%	0.182	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56	-29.3	179.6	178.1	163.7	-121.4	0	0	113.1	T354 Q482 I483 K484 N523 S525	T354-E480 WeakPolarHBondContact CG2-O 3.16Å; E480-Q482 PolarHBondContact O-N 2.84Å; E480-I483 WeakPolarHBondContact CA-O 3.35Å; E480-K484 HydrophobicContact CG-CG 4.33Å; E480-K484 IonicContact OE1-NZ 3.66Å; E480-K484 PolarHBondContact OE1-NZ 2.84Å; E480-K484 IonicContact OE2-NZ 2.67Å; E480-N523 PolarHBondContact N-O 2.89Å; E480-S525 PolarHBondContact OE1-OG 3.03Å
481	A	91.4	Very high	88.9	Confident	65 Å²	65	56 Å²	56	54%	0.537	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-27.6	174.9	0	0	0	0	0	113.2	T354 E479	T354-A481 WeakPolarHBondContact CB-O 3.4Å; T354-A481 PolarHBondContact OG1-O 2.75Å; E479-A481 PolarHBondContact O-N 2.85Å; E479-A481 VanDerWaalsContact O-N 3.09Å
482	Q	93	Very high	87.4	Confident	88 Å²	88	58.9 Å²	58.9	41%	0.411	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.3	-45.7	-177.4	-63.1	179.3	-65.1	0	0	112.4	L348 L355 Y478 E479 E480	L348-Q482 HydrophobicContact CD2-CB 4.42Å; L355-Q482 WeakPolarHBondContact CB-O 3.5Å; L355-Q482 PolarHBondContact N-O 2.89Å; Y478-Q482 HydrophobicContact CD1-CB 4.32Å; E479-Q482 PolarHBondContact O-N 3.36Å; E480-Q482 PolarHBondContact O-N 2.84Å
483	I	94.2	Very high	86.6	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	123.4	177.7	-59.8	-174.5	0	0	0	109.9	L348 L355 V357 W412 Y478 E479 E480 Y485 S525	L348-I483 HydrophobicContact CD1-CD1 3.87Å; L348-I483 HydrophobicContact CD1-CG1 4.02Å; L355-I483 HydrophobicContact CB-CG1 4.46Å; L355-I483 WeakPolarHBondContact O-CA 3.4Å; V357-I483 HydrophobicContact CG2-CG2 3.88Å; W412-I483 HydrophobicContact CH2-CD1 3.99Å; W412-I483 HydrophobicContact CZ2-CD1 3.85Å; Y478-I483 HydrophobicContact CD1-CD1 4.5Å; Y478-I483 HydrophobicContact CD2-CD1 3.37Å; Y478-I483 HydrophobicContact CD2-CG1 4.28Å; Y478-I483 HydrophobicContact CE2-CD1 4.01Å; Y478-I483 HydrophobicContact CG-CD1 3.65Å; Y478-I483 HydrophobicContact CG-CG1 4.05Å; E479-I483 PolarHBondContact O-N 3.46Å; E480-I483 WeakPolarHBondContact CA-O 3.35Å; I483-Y485 HydrophobicContact CG2-CD2 4.34Å; I483-Y485 HydrophobicContact CG2-CE2 3.96Å; I483-S525 WeakPolarHBondContact O-CB 3.33Å
484	K	94.1	Very high	85.9	Confident	81 Å²	81	60 Å²	60	35%	0.352	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	115.3	175	-168.7	-177	-174.2	77	0	110.4	T354 L355 T356 V357 E480 V486 S525	T354-K484 HydrophobicContact CG2-CB 3.69Å; L355-K484 PolarHBondContact O-N 3.15Å; T356-K484 CarbonylContact C-O 3.52Å; T356-K484 WeakPolarHBondContact CA-O 3.4Å; V357-K484 PolarHBondContact N-O 2.82Å; E480-K484 HydrophobicContact CG-CG 4.33Å; E480-K484 IonicContact OE1-NZ 3.66Å; E480-K484 PolarHBondContact OE1-NZ 2.84Å; E480-K484 IonicContact OE2-NZ 2.67Å; K484-V486 HydrophobicContact CD-CG2 4.11Å; K484-V486 HydrophobicContact CG-CG2 3.97Å; K484-S525 WeakPolarHBondContact CA-OG 3.3Å
485	Y	94.9	Very high	85.2	Confident	5 Å²	5	66 Å²	66	2%	0.02	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	134.6	170.1	-67.2	-84.1	0	0	0	109.2	V357 V359 P414 T416 I483 S525	V357-Y485 HydrophobicContact CB-CD1 3.77Å; V357-Y485 HydrophobicContact CB-CE1 4Å; V357-Y485 HydrophobicContact CG1-CD1 3.83Å; V357-Y485 HydrophobicContact CG1-CE1 3.85Å; V357-Y485 HydrophobicContact CG2-CD1 4.49Å; V357-Y485 HydrophobicContact CG2-CE1 4.34Å; V357-Y485 WeakPolarHBondContact O-CA 3.37Å; V359-Y485 HydrophobicContact CG2-CD1 3.84Å; P414-Y485 HydrophobicContact CB-CE1 4.37Å; T416-Y485 WeakPolarHBondContact CA-OH 3.24Å; T416-Y485 HydrophobicContact CG2-CE1 4.15Å; T416-Y485 PolarHBondContact N-OH 2.83Å; T416-Y485 VanDerWaalsContact OG1-CE1 3.3Å; T416-Y485 WeakPolarHBondContact OG1-CE1 3.33Å; T416-Y485 PolarHBondContact OG1-OH 3.02Å; I483-Y485 HydrophobicContact CG2-CD2 4.34Å; I483-Y485 HydrophobicContact CG2-CE2 3.96Å; Y485-S525 WeakPolarHBondContact CD2-O 3.03Å; Y485-S525 PolarHBondContact N-OG 2.79Å; Y485-S525 PolarHBondContact O-OG 2.87Å
486	V	93.9	Very high	84.6	Confident	38 Å²	38	70.1 Å²	70.1	23%	0.23	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	133.6	-178.1	-179	0	0	0	0	109.3	T356 V357 N358 V359 K484 K488	T356-V486 HydrophobicContact CG2-CB 4.16Å; T356-V486 HydrophobicContact CG2-CG2 3.77Å; V357-V486 PolarHBondContact O-N 3.12Å; N358-V486 CarbonylContact C-O 3.59Å; N358-V486 WeakPolarHBondContact CA-O 3.16Å; V359-V486 PolarHBondContact N-O 2.79Å; K484-V486 HydrophobicContact CD-CG2 4.11Å; K484-V486 HydrophobicContact CG-CG2 3.97Å; V486-K488 PolarHBondContact O-N 3.36Å
487	W	93.6	Very high	84.1	Confident	24 Å²	24	66.2 Å²	66.2	9%	0.091	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.7	132.2	170.8	-73.1	122.1	0	0	0	110.1	V359 V361 M473 N489 T493 T512 T513 L527 Q528 V529	V359-W487 HydrophobicContact CB-CE3 4.33Å; V359-W487 HydrophobicContact CB-CZ3 4.4Å; V359-W487 HydrophobicContact CG1-CE3 4.29Å; V359-W487 HydrophobicContact CG1-CZ3 3.87Å; V361-W487 HydrophobicContact CG2-CH2 4.22Å; V361-W487 HydrophobicContact CG2-CZ3 4.05Å; M473-W487 HydrophobicContact CE-CH2 3.59Å; M473-W487 HydrophobicContact CE-CZ2 4.29Å; M473-W487 HydrophobicContact CE-CZ3 4.33Å; W487-N489 PolarHBondContact O-N 2.64Å; W487-N489 PolarHBondContact O-OD1 3.3Å; W487-T493 HydrophobicContact CB-CG2 3.86Å; W487-T493 HydrophobicContact CD2-CG2 3.78Å; W487-T493 HydrophobicContact CE3-CG2 3.47Å; W487-T493 VanDerWaalsContact CE3-CG2 3.47Å; W487-T493 HydrophobicContact CG-CG2 3.97Å; W487-T493 HydrophobicContact CZ3-CG2 4.26Å; W487-T512 HydrophobicContact CD2-CG2 4.32Å; W487-T512 HydrophobicContact CE3-CG2 4.39Å; W487-T512 HydrophobicContact CH2-CG2 3.87Å; W487-T512 HydrophobicContact CZ2-CG2 3.78Å; W487-T512 HydrophobicContact CZ3-CG2 4.18Å; W487-T513 PolarHBondContact NE1-O 2.76Å; W487-L527 HydrophobicContact CD2-CD1 3.93Å; W487-L527 HydrophobicContact CE3-CD1 4.23Å; W487-L527 HydrophobicContact CG-CD1 4.27Å; W487-L527 HydrophobicContact CG-CD2 4.25Å; W487-L527 HydrophobicContact CH2-CB 4.44Å; W487-L527 HydrophobicContact CZ2-CB 3.73Å; W487-L527 HydrophobicContact CZ2-CD1 4.41Å; W487-Q528 WeakPolarHBondContact CZ2-O 3.26Å; W487-V529 HydrophobicContact CH2-CG2 3.58Å; W487-V529 HydrophobicContact CZ2-CG2 3.92Å
488	K	88.6	Confident	83.1	Confident	78 Å²	78	68.7 Å²	68.7	34%	0.339	35%	0.346	S	S	.	.			trans	-67.6	107.9	176.5	-169.8	177.3	-170.9	-75.5	0	108.8	V359 N360 V486 D490 T493	V359-K488 WeakPolarHBondContact O-CB 3.47Å; V359-K488 PolarHBondContact O-N 3.24Å; N360-K488 HydrophobicContact CB-CB 4.43Å; V486-K488 PolarHBondContact O-N 3.36Å; K488-D490 WeakPolarHBondContact CG-OD2 3.27Å; K488-D490 IonicContact NZ-OD2 3.68Å; K488-D490 PolarHBondContact NZ-OD2 2.78Å; K488-D490 PolarHBondContact O-N 2.95Å; K488-T493 PolarHBondContact O-OG1 2.67Å
489	N	71.8	Confident	81.7	Confident	150 Å²	150	71.1 Å²	71.1	80%	0.802	37%	0.37	S	S	*	.	S	Bend	trans	-59.3	21.9	-165.9	-66.6	-30.7	0	0	0	118.2	W487	W487-N489 PolarHBondContact O-N 2.64Å; W487-N489 PolarHBondContact O-OD1 3.3Å
490	D	71.4	Confident	80.5	Confident	76 Å²	76	69 Å²	69	41%	0.406	36%	0.362	S	S	.	.	S	Bend	trans	-99	163.3	177.4	-44.2	-52.3	0	0	0	110.8	K488 D492 T493	K488-D490 WeakPolarHBondContact CG-OD2 3.27Å; K488-D490 IonicContact NZ-OD2 3.68Å; K488-D490 PolarHBondContact NZ-OD2 2.78Å; K488-D490 PolarHBondContact O-N 2.95Å; D490-D492 HydrophobicContact CB-CB 4.16Å; D490-D492 PolarHBondContact O-N 2.86Å; D490-T493 PolarHBondContact O-N 2.84Å; D490-T493 PolarHBondContact O-OG1 2.71Å
491	E	61.8	Low	78.5	Confident	204 Å²	204	71.8 Å²	71.8	95%	0.953	38%	0.381	S	S	*	.	G	3₁₀ helix	trans	-53.4	-23.3	168.2	-58.4	-174.6	159.2	0	0	112.6	T493	E491-T493 PolarHBondContact O-N 3.15Å
492	D	63.4	Low	76.7	Confident	61 Å²	61	75.2 Å²	75.2	33%	0.326	40%	0.395	S	S	.	.	G	3₁₀ helix	trans	-71.5	-1.9	176.6	-96.8	7.6	0	0	0	115.3	N360 D490 L494 R495	N360-D492 PolarHBondContact ND2-O 2.9Å; D490-D492 HydrophobicContact CB-CB 4.16Å; D490-D492 PolarHBondContact O-N 2.86Å; D492-L494 VanDerWaalsContact C-N 3.27Å; D492-L494 PolarHBondContact O-N 2.86Å; D492-L494 VanDerWaalsContact O-N 3.15Å; D492-R495 HydrophobicContact CB-CG 4.21Å; D492-R495 VanDerWaalsContact CG-CD 3.46Å; D492-R495 WeakPolarHBondContact O-CG 3.29Å; D492-R495 WeakPolarHBondContact OD1-CD 3.45Å; D492-R495 IonicContact OD1-CZ 3.27Å; D492-R495 IonicContact OD1-NE 2.73Å; D492-R495 PolarHBondContact OD1-NE 2.88Å; D492-R495 IonicContact OD1-NH1 2.8Å; D492-R495 PolarHBondContact OD1-NH1 3.02Å; D492-R495 IonicContact OD1-NH2 3.57Å; D492-R495 IonicContact OD2-CZ 3.07Å; D492-R495 IonicContact OD2-NH1 3.93Å; D492-R495 PolarHBondContact OD2-NH1 3.01Å
493	T	75.7	Confident	75.2	Confident	19 Å²	19	74.7 Å²	74.7	12%	0.117	40%	0.395	C	S	.	.	G	3₁₀ helix	trans	-48.4	-45.4	-175.7	-56.5	0	0	0	0	113.4	V361 W487 K488 D490 E491 T512	V361-T493 PolarHBondContact N-O 2.78Å; W487-T493 HydrophobicContact CB-CG2 3.86Å; W487-T493 HydrophobicContact CD2-CG2 3.78Å; W487-T493 HydrophobicContact CE3-CG2 3.47Å; W487-T493 VanDerWaalsContact CE3-CG2 3.47Å; W487-T493 HydrophobicContact CG-CG2 3.97Å; W487-T493 HydrophobicContact CZ3-CG2 4.26Å; K488-T493 PolarHBondContact O-OG1 2.67Å; D490-T493 PolarHBondContact O-N 2.84Å; D490-T493 PolarHBondContact O-OG1 2.71Å; E491-T493 PolarHBondContact O-N 3.15Å; T493-T512 HydrophobicContact CG2-CG2 4.09Å
494	L	78.9	Confident	73.8	Confident	18 Å²	18	78.7 Å²	78.7	9%	0.094	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	78.3	-179	-177.3	58.7	0	0	0	111.1	V361 L363 D492 N510 T512 V529 L531	V361-L494 HydrophobicContact CB-CD1 3.73Å; V361-L494 HydrophobicContact CG1-CD1 3.55Å; V361-L494 CarbonylContact O-C 3.58Å; V361-L494 VanDerWaalsContact O-CA 3.32Å; V361-L494 WeakPolarHBondContact O-CA 3.02Å; L363-L494 HydrophobicContact CD1-CD1 4.12Å; L363-L494 HydrophobicContact CD2-CD1 4.11Å; L363-L494 HydrophobicContact CG-CD1 3.86Å; D492-L494 VanDerWaalsContact C-N 3.27Å; D492-L494 PolarHBondContact O-N 2.86Å; D492-L494 VanDerWaalsContact O-N 3.15Å; L494-N510 HydrophobicContact CD2-CB 3.78Å; L494-T512 HydrophobicContact CB-CG2 3.76Å; L494-T512 HydrophobicContact CD2-CG2 3.75Å; L494-T512 HydrophobicContact CG-CG2 4.28Å; L494-V529 HydrophobicContact CD2-CG1 3.96Å; L494-L531 HydrophobicContact CD2-CD2 4.41Å
495	R	78.6	Confident	72.9	Confident	127 Å²	127	75.3 Å²	75.3	48%	0.479	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	144	179.3	-61.9	-173.6	81.9	139.9	2.7	111.4	V361 L362 L363 D492	V361-R495 PolarHBondContact O-N 3.15Å; V361-R495 VanDerWaalsContact O-N 3.09Å; L362-R495 HydrophobicContact CD1-CB 3.59Å; L363-R495 PolarHBondContact N-O 3.01Å; D492-R495 HydrophobicContact CB-CG 4.21Å; D492-R495 VanDerWaalsContact CG-CD 3.46Å; D492-R495 WeakPolarHBondContact O-CG 3.29Å; D492-R495 WeakPolarHBondContact OD1-CD 3.45Å; D492-R495 IonicContact OD1-CZ 3.27Å; D492-R495 IonicContact OD1-NE 2.73Å; D492-R495 PolarHBondContact OD1-NE 2.88Å; D492-R495 IonicContact OD1-NH1 2.8Å; D492-R495 PolarHBondContact OD1-NH1 3.02Å; D492-R495 IonicContact OD1-NH2 3.57Å; D492-R495 IonicContact OD2-CZ 3.07Å; D492-R495 IonicContact OD2-NH1 3.93Å; D492-R495 PolarHBondContact OD2-NH1 3.01Å
496	K	79.3	Confident	72.3	Confident	87 Å²	87	80.5 Å²	80.5	38%	0.378	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	134.8	159.6	-61.4	180	-170	-177.8	0	108	L363 L500 L507 N510	L363-K496 HydrophobicContact CD1-CG 4.47Å; K496-L500 HydrophobicContact CB-CD2 3.87Å; K496-L500 HydrophobicContact CD-CD2 4.16Å; K496-L500 HydrophobicContact CG-CD2 4.04Å; K496-L507 HydrophobicContact CD-CD2 4.36Å; K496-N510 WeakPolarHBondContact CE-OD1 2.94Å; K496-N510 PolarHBondContact NZ-OD1 3.02Å
497	S	77.6	Confident	72	Confident	14 Å²	14	79.9 Å²	79.9	10%	0.098	42%	0.419	C	S	.	.	P	Polyproline II helix	trans	-68.1	146.2	174.9	82.9	0	0	0	0	110.9	L363 L364 S499 L500	L363-S497 WeakPolarHBondContact O-CB 3.29Å; L363-S497 PolarHBondContact O-N 3.11Å; L364-S497 PolarHBondContact O-OG 3.38Å; S497-S499 PolarHBondContact O-N 3.44Å; S497-S499 PolarHBondContact OG-N 3.08Å; S497-L500 WeakPolarHBondContact O-CB 3.45Å; S497-L500 PolarHBondContact O-N 3.08Å; S497-L500 PolarHBondContact OG-N 2.64Å
498	P	67.1	Low	71.6	Confident	129 Å²	129	83.2 Å²	83.2	84%	0.838	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-22.5	172.4	-24.1	35	0	0	0	113.1	L500	P498-L500 VanDerWaalsContact C-N 3.29Å
499	S	63.9	Low	71.6	Confident	97 Å²	97	84.3 Å²	84.3	68%	0.678	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	9.9	175.6	-49.1	0	0	0	0	113.7	S497 T501	S497-S499 PolarHBondContact O-N 3.44Å; S497-S499 PolarHBondContact OG-N 3.08Å; S499-T501 PolarHBondContact O-N 2.74Å
500	L	65.7	Low	72.4	Confident	50 Å²	50	79.5 Å²	79.5	26%	0.262	42%	0.417	S	S	.	.			trans	-74.1	41.4	172.6	-164.4	70.9	0	0	0	111.4	L364 L366 K496 S497 P498	L364-L500 WeakPolarHBondContact O-CD1 3.29Å; L366-L500 HydrophobicContact CD1-CD1 4.29Å; L366-L500 HydrophobicContact CD1-CD2 4.1Å; L366-L500 HydrophobicContact CG-CD1 4.1Å; K496-L500 HydrophobicContact CB-CD2 3.87Å; K496-L500 HydrophobicContact CD-CD2 4.16Å; K496-L500 HydrophobicContact CG-CD2 4.04Å; S497-L500 WeakPolarHBondContact O-CB 3.45Å; S497-L500 PolarHBondContact O-N 3.08Å; S497-L500 PolarHBondContact OG-N 2.64Å; P498-L500 VanDerWaalsContact C-N 3.29Å
501	T	49.8	Very low	73.3	Confident	96 Å²	96	79.5 Å²	79.5	59%	0.589	42%	0.415	S	S	*	.			trans	-92.7	119.9	-178.1	49.7	0	0	0	0	110	S499	S499-T501 PolarHBondContact O-N 2.74Å
502	T	53.8	Low	74.7	Confident	137 Å²	137	71.8 Å²	71.8	84%	0.84	38%	0.382	S	S	*	.	S	Bend	trans	58.2	86.7	169.6	59.3	0	0	0	0	116.9
503	L	61.1	Low	75.9	Confident	77 Å²	77	72 Å²	72	40%	0.403	39%	0.386	S	S	.	.			trans	-140.6	163.1	155.4	-76.2	100.1	0	0	0	109.5	S365 L366 A367 A505	S365-L503 WeakPolarHBondContact OG-CD2 3.38Å; L366-L503 WeakPolarHBondContact O-CB 3.35Å; A367-L503 HydrophobicContact CB-CD2 3.82Å; L503-A505 PolarHBondContact O-N 2.75Å
504	N	64.1	Low	76.6	Confident	84 Å²	84	74.4 Å²	74.4	45%	0.449	41%	0.407	S	S	.	.	S	Bend	trans	-73.6	36.7	-168.6	-50.7	-8.7	0	0	0	114.9	S368	S368-N504 WeakPolarHBondContact CB-O 3.42Å; S368-N504 WeakPolarHBondContact OG-CB 3.31Å; S368-N504 PolarHBondContact OG-O 3.2Å
505	A	75.8	Confident	77	Confident	11 Å²	11	74.8 Å²	74.8	9%	0.091	41%	0.411	C	S	.	.			trans	-138.1	91.7	-177.3	0	0	0	0	0	111.2	L366 Y376 L503 L507 F533	L366-A505 HydrophobicContact CB-CB 3.98Å; Y376-A505 HydrophobicContact CD1-CB 4.06Å; Y376-A505 HydrophobicContact CE1-CB 4.24Å; L503-A505 PolarHBondContact O-N 2.75Å; A505-L507 PolarHBondContact O-N 3.41Å; A505-F533 HydrophobicContact CB-CD1 3.85Å; A505-F533 HydrophobicContact CB-CE1 3.72Å
506	Y	82.2	Confident	76.9	Confident	113 Å²	113	75.9 Å²	75.9	44%	0.443	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	80.9	-174.4	-55.3	-85.8	0	0	0	111.9	I508 F533 T534 D536	Y506-I508 PolarHBondContact O-N 3.29Å; Y506-I508 VanDerWaalsContact O-N 3.12Å; Y506-F533 CarbonylContact O-C 3.58Å; Y506-F533 VanDerWaalsContact O-CA 3.29Å; Y506-F533 WeakPolarHBondContact O-CA 3.08Å; Y506-T534 HydrophobicContact CG-CG2 4.42Å; Y506-T534 PolarHBondContact O-N 2.96Å; Y506-D536 HydrophobicContact CE2-CB 3.95Å
507	L	87	Confident	76.2	Confident	25 Å²	25	78.9 Å²	78.9	13%	0.131	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	102.4	-178.9	180	67	0	0	0	112.1	L363 L366 K496 A505 K509 N510 L531 F533	L363-L507 HydrophobicContact CD1-CD2 4.04Å; L366-L507 HydrophobicContact CD1-CB 3.94Å; L366-L507 HydrophobicContact CD1-CD2 3.54Å; L366-L507 HydrophobicContact CD1-CG 4.26Å; K496-L507 HydrophobicContact CD-CD2 4.36Å; A505-L507 PolarHBondContact O-N 3.41Å; L507-K509 VanDerWaalsContact CD1-O 3.26Å; L507-K509 WeakPolarHBondContact CD1-O 3.36Å; L507-N510 HydrophobicContact CD2-CB 4.28Å; L507-L531 HydrophobicContact CD1-CB 3.81Å; L507-L531 HydrophobicContact CD1-CD2 4.05Å; L507-L531 HydrophobicContact CD1-CG 4.45Å; L507-L531 HydrophobicContact CD2-CD2 4.41Å; L507-F533 HydrophobicContact CB-CD1 3.93Å; L507-F533 HydrophobicContact CB-CE1 3.79Å; L507-F533 HydrophobicContact CD1-CD1 4.22Å; L507-F533 HydrophobicContact CD1-CE1 3.92Å; L507-F533 HydrophobicContact CD1-CE2 4.27Å; L507-F533 HydrophobicContact CD1-CZ 3.95Å; L507-F533 HydrophobicContact CG-CE1 4.42Å
508	I	86.9	Confident	75.5	Confident	94 Å²	94	86 Å²	86	48%	0.482	48%	0.478	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	-51.3	176.8	-34.7	171.6	0	0	0	110.6	D466 Y506 T532 T534	D466-I508 HydrophobicContact CB-CD1 4.21Å; Y506-I508 PolarHBondContact O-N 3.29Å; Y506-I508 VanDerWaalsContact O-N 3.12Å; I508-T532 PolarHBondContact N-O 2.92Å; I508-T534 HydrophobicContact CD1-CG2 4.38Å; I508-T534 HydrophobicContact CG1-CG2 4.13Å
509	K	86.9	Confident	75.4	Confident	102 Å²	102	81.5 Å²	81.5	44%	0.443	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	139.3	-167.1	-160	-165.9	-166.7	-166.9	0	110.4	L507 Q511 T532	L507-K509 VanDerWaalsContact CD1-O 3.26Å; L507-K509 WeakPolarHBondContact CD1-O 3.36Å; K509-Q511 HydrophobicContact CD-CG 4.35Å; K509-Q511 HydrophobicContact CG-CG 4.39Å; K509-T532 PolarHBondContact N-O 2.84Å; K509-T532 VanDerWaalsContact N-O 3.14Å; K509-T532 PolarHBondContact O-N 3.02Å
510	N	89.6	Confident	75.7	Confident	49 Å²	49	87 Å²	87	26%	0.262	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	134.1	173.2	58.3	-66.7	0	0	0	109.6	L494 K496 L507 E530 L531	L494-N510 HydrophobicContact CD2-CB 3.78Å; K496-N510 WeakPolarHBondContact CE-OD1 2.94Å; K496-N510 PolarHBondContact NZ-OD1 3.02Å; L507-N510 HydrophobicContact CD2-CB 4.28Å; N510-E530 CarbonylContact C-O 3.48Å; N510-E530 WeakPolarHBondContact CA-O 3.5Å; N510-L531 HydrophobicContact CB-CD2 3.72Å
511	Q	89.1	Confident	76.2	Confident	76 Å²	76	87.5 Å²	87.5	36%	0.355	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	152.6	-178.9	-60.9	-163.8	-100.4	0	0	111.4	K509 V529 E530	K509-Q511 HydrophobicContact CD-CG 4.35Å; K509-Q511 HydrophobicContact CG-CG 4.39Å; Q511-V529 WeakPolarHBondContact O-CA 3.27Å; Q511-E530 PolarHBondContact N-O 3.03Å; Q511-E530 PolarHBondContact O-N 2.02Å
512	T	91.3	Very high	77.7	Confident	42 Å²	42	84.6 Å²	84.6	26%	0.258	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	126.1	175.8	47.2	0	0	0	0	109.5	W487 T493 L494 Q528 V529	W487-T512 HydrophobicContact CD2-CG2 4.32Å; W487-T512 HydrophobicContact CE3-CG2 4.39Å; W487-T512 HydrophobicContact CH2-CG2 3.87Å; W487-T512 HydrophobicContact CZ2-CG2 3.78Å; W487-T512 HydrophobicContact CZ3-CG2 4.18Å; T493-T512 HydrophobicContact CG2-CG2 4.09Å; L494-T512 HydrophobicContact CB-CG2 3.76Å; L494-T512 HydrophobicContact CD2-CG2 3.75Å; L494-T512 HydrophobicContact CG-CG2 4.28Å; T512-Q528 WeakPolarHBondContact CA-O 3.31Å; T512-V529 HydrophobicContact CG2-CG2 4.42Å
513	T	90.2	Very high	79.4	Confident	66 Å²	66	81.7 Å²	81.7	41%	0.405	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	164.9	180	60.6	0	0	0	0	110.5	W487 Q528	W487-T513 PolarHBondContact NE1-O 2.76Å; T513-Q528 PolarHBondContact N-O 2.75Å; T513-Q528 PolarHBondContact O-N 2.72Å
514	A	89.8	Confident	80.8	Confident	69 Å²	69	80.3 Å²	80.3	57%	0.57	41%	0.413	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71	158.6	154.9	0	0	0	0	0	109.1
515	C	86.6	Confident	82.1	Confident	26 Å²	26	76.5 Å²	76.5	18%	0.176	39%	0.393	C	S	.	.	P	Polyproline II helix	trans	-79.5	152	168.4	-46.1	0	0	0	0	110	C526	C515-C526 HydrophobicContact CB-CB 3.51Å; C515-C526 WeakPolarHBondContact CB-SG 3.32Å; C515-C526 PolarHBondContact N-O 3.3Å; C515-C526 WeakPolarHBondContact SG-CB 3.17Å; C515-C526 PolarHBondContact SG-O 3.1Å; C515-C526 VanDerWaalsContact SG-O 3.36Å; C515-C526 CovalentContact SG-SG 2.04Å; C515-C526 PolarHBondContact SG-SG 2.99Å
516	D	78.3	Confident	82.8	Confident	150 Å²	150	76.9 Å²	76.9	80%	0.802	40%	0.395	S	S	*	.	P	Polyproline II helix	trans	-64.2	141.3	172.2	-67.5	-42.5	0	0	0	111	N518	D516-N518 PolarHBondContact O-N 3.43Å
517	Q	64.6	Low	83.4	Confident	150 Å²	150	71.8 Å²	71.8	70%	0.701	38%	0.375	S	S	*	.	S	Bend	trans	-67.1	-7	-173.3	-69.3	179.8	-55.8	0	0	114.7	S519	Q517-S519 PolarHBondContact O-N 3.11Å
518	N	61.4	Low	83.7	Confident	162 Å²	162	73.2 Å²	73.2	87%	0.866	38%	0.381	S	S	*	.			trans	-82.9	42.6	178.8	-68	15	0	0	0	112.4	D516	D516-N518 PolarHBondContact O-N 3.43Å
519	S	66.4	Low	84.1	Confident	36 Å²	36	68.8 Å²	68.8	25%	0.252	36%	0.358	S	S	.	.			trans	-67.3	134.1	174.1	-178.4	0	0	0	0	110.6	Q517 R521 G522	Q517-S519 PolarHBondContact O-N 3.11Å; S519-R521 PolarHBondContact O-N 3.4Å; S519-R521 VanDerWaalsContact O-N 3.08Å; S519-R521 PolarHBondContact OG-N 3.15Å; S519-G522 PolarHBondContact O-N 2.78Å; S519-G522 VanDerWaalsContact O-N 3.11Å
520	W	70.1	Confident	84.4	Confident	212 Å²	212	66 Å²	66	80%	0.803	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-16.7	176.4	61.1	-94.8	0	0	0	113.4
521	R	76.3	Confident	84.5	Confident	61 Å²	61	63.7 Å²	63.7	23%	0.23	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.3	-13.6	179.2	-157.6	-176.2	-65.4	165.9	13.9	113.3	E474 S475 S519 Y524	E474-R521 IonicContact OE2-CZ 3.39Å; E474-R521 IonicContact OE2-NE 3.27Å; E474-R521 IonicContact OE2-NH1 2.89Å; E474-R521 PolarHBondContact OE2-NH1 3.34Å; E474-R521 IonicContact OE2-NH2 3.48Å; E474-R521 PolarHBondContact OE2-NH2 2.99Å; E474-R521 VanDerWaalsContact OE2-NH2 3.08Å; S475-R521 PolarHBondContact O-NH1 3.43Å; S519-R521 PolarHBondContact O-N 3.4Å; S519-R521 VanDerWaalsContact O-N 3.08Å; S519-R521 PolarHBondContact OG-N 3.15Å; R521-Y524 HydrophobicContact CB-CD2 4.19Å; R521-Y524 HydrophobicContact CB-CE2 4.39Å; R521-Y524 HydrophobicContact CG-CD2 4.11Å; R521-Y524 HydrophobicContact CG-CE2 3.89Å; R521-Y524 WeakPolarHBondContact O-CE2 3.16Å
522	G	81	Confident	84.6	Confident	35 Å²	35	60.8 Å²	60.8	36%	0.361	32%	0.322	S	S	.	.			trans	105.5	-158	-173.5	0	0	0	0	0	112.8	S519 Y524	S519-G522 PolarHBondContact O-N 2.78Å; S519-G522 VanDerWaalsContact O-N 3.11Å; G522-Y524 VanDerWaalsContact C-N 3.33Å; G522-Y524 PolarHBondContact O-N 2.81Å
523	N	88.4	Confident	84.6	Confident	75 Å²	75	58.9 Å²	58.9	40%	0.401	31%	0.31	S	S	.	.	S	Bend	trans	-82.8	68.6	-169.4	-167.3	40.3	0	0	0	113.4	E480	E480-N523 PolarHBondContact N-O 2.89Å
524	Y	90.5	Very high	84.4	Confident	48 Å²	48	57.4 Å²	57.4	19%	0.188	30%	0.301	C	S	.	.			trans	-100.6	140.1	177.7	-72.8	-102	0	0	0	111.2	E474 Y478 E479 R521 G522 C526	E474-Y524 WeakPolarHBondContact OE1-CB 3.1Å; Y478-Y524 VanDerWaalsContact O-CD1 3.26Å; Y478-Y524 WeakPolarHBondContact O-CD1 3.34Å; Y478-Y524 WeakPolarHBondContact O-CE1 3.39Å; E479-Y524 HydrophobicContact CG-CE1 4.48Å; E479-Y524 HydrophobicContact CG-CE2 4.14Å; R521-Y524 HydrophobicContact CB-CD2 4.19Å; R521-Y524 HydrophobicContact CB-CE2 4.39Å; R521-Y524 HydrophobicContact CG-CD2 4.11Å; R521-Y524 HydrophobicContact CG-CE2 3.89Å; R521-Y524 WeakPolarHBondContact O-CE2 3.16Å; G522-Y524 VanDerWaalsContact C-N 3.33Å; G522-Y524 PolarHBondContact O-N 2.81Å; Y524-C526 PolarHBondContact O-N 2.82Å
525	S	91.3	Very high	84.3	Confident	5 Å²	5	54.2 Å²	54.2	4%	0.035	28%	0.275	C	S	.	.			trans	-75.9	122.8	176.5	-164.6	0	0	0	0	110.3	E480 I483 K484 Y485	E480-S525 PolarHBondContact OE1-OG 3.03Å; I483-S525 WeakPolarHBondContact O-CB 3.33Å; K484-S525 WeakPolarHBondContact CA-OG 3.3Å; Y485-S525 WeakPolarHBondContact CD2-O 3.03Å; Y485-S525 PolarHBondContact N-OG 2.79Å; Y485-S525 PolarHBondContact O-OG 2.87Å
526	C	91.8	Very high	84.2	Confident	18 Å²	18	55.2 Å²	55.2	12%	0.122	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	132.3	-169.6	176.8	0	0	0	0	111.2	M473 E474 C515 Y524	M473-C526 WeakPolarHBondContact O-CA 3.48Å; E474-C526 HydrophobicContact CB-CB 4.44Å; E474-C526 HydrophobicContact CG-CB 4.18Å; C515-C526 HydrophobicContact CB-CB 3.51Å; C515-C526 WeakPolarHBondContact CB-SG 3.32Å; C515-C526 PolarHBondContact N-O 3.3Å; C515-C526 WeakPolarHBondContact SG-CB 3.17Å; C515-C526 PolarHBondContact SG-O 3.1Å; C515-C526 VanDerWaalsContact SG-O 3.36Å; C515-C526 CovalentContact SG-SG 2.04Å; C515-C526 PolarHBondContact SG-SG 2.99Å; Y524-C526 PolarHBondContact O-N 2.82Å
527	L	94.1	Very high	84.5	Confident	6 Å²	6	51.4 Å²	51.4	3%	0.031	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	136.2	175.6	-62	-176.2	0	0	0	110.5	V359 S472 M473 W487	V359-L527 HydrophobicContact CB-CD1 3.77Å; V359-L527 HydrophobicContact CG1-CD1 4.35Å; V359-L527 HydrophobicContact CG2-CD1 3.84Å; S472-L527 CarbonylContact C-O 3.48Å; S472-L527 WeakPolarHBondContact CA-O 3.21Å; S472-L527 WeakPolarHBondContact CB-O 3.48Å; M473-L527 PolarHBondContact N-O 3.23Å; M473-L527 PolarHBondContact O-N 2.98Å; W487-L527 HydrophobicContact CD2-CD1 3.93Å; W487-L527 HydrophobicContact CE3-CD1 4.23Å; W487-L527 HydrophobicContact CG-CD1 4.27Å; W487-L527 HydrophobicContact CG-CD2 4.25Å; W487-L527 HydrophobicContact CH2-CB 4.44Å; W487-L527 HydrophobicContact CZ2-CB 3.73Å; W487-L527 HydrophobicContact CZ2-CD1 4.41Å
528	Q	93.5	Very high	85.6	Confident	56 Å²	56	46.8 Å²	46.8	26%	0.262	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	138.8	-175.8	179.2	170.2	-22.3	0	0	112.4	S472 W487 T512 T513	S472-Q528 WeakPolarHBondContact OG-CB 3.16Å; S472-Q528 WeakPolarHBondContact OG-CG 3.48Å; W487-Q528 WeakPolarHBondContact CZ2-O 3.26Å; T512-Q528 WeakPolarHBondContact CA-O 3.31Å; T513-Q528 PolarHBondContact N-O 2.75Å; T513-Q528 PolarHBondContact O-N 2.72Å
529	V	94.2	Very high	86.8	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	129.7	168.8	-175.7	0	0	0	0	108.7	S470 F471 M473 W487 L494 Q511 T512 L531	S470-V529 VanDerWaalsContact CA-O 3.3Å; S470-V529 WeakPolarHBondContact CA-O 3.38Å; F471-V529 HydrophobicContact CD1-CB 4.12Å; F471-V529 HydrophobicContact CD2-CB 4.48Å; F471-V529 HydrophobicContact CD2-CG2 4.45Å; F471-V529 HydrophobicContact CE1-CB 3.74Å; F471-V529 HydrophobicContact CE1-CG1 3.81Å; F471-V529 HydrophobicContact CE1-CG2 4.23Å; F471-V529 HydrophobicContact CE2-CB 4.12Å; F471-V529 HydrophobicContact CE2-CG2 3.81Å; F471-V529 HydrophobicContact CG-CB 4.49Å; F471-V529 HydrophobicContact CZ-CB 3.74Å; F471-V529 HydrophobicContact CZ-CG1 3.99Å; F471-V529 HydrophobicContact CZ-CG2 3.69Å; F471-V529 PolarHBondContact N-O 3.34Å; F471-V529 VanDerWaalsContact N-O 3.15Å; F471-V529 PolarHBondContact O-N 3.06Å; M473-V529 HydrophobicContact CE-CG2 4.17Å; W487-V529 HydrophobicContact CH2-CG2 3.58Å; W487-V529 HydrophobicContact CZ2-CG2 3.92Å; L494-V529 HydrophobicContact CD2-CG1 3.96Å; Q511-V529 WeakPolarHBondContact O-CA 3.27Å; T512-V529 HydrophobicContact CG2-CG2 4.42Å; V529-L531 HydrophobicContact CG1-CD2 4.01Å; V529-L531 HydrophobicContact CG1-CG 4.12Å
530	E	93.4	Very high	87.8	Confident	44 Å²	44	41.5 Å²	41.5	21%	0.206	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	128.1	169.1	-171.3	-175.2	177	0	0	110	K468 N510 Q511	K468-E530 WeakPolarHBondContact CD-OE1 3.48Å; K468-E530 WeakPolarHBondContact CE-OE1 3.26Å; K468-E530 IonicContact NZ-OE1 3.91Å; K468-E530 PolarHBondContact NZ-OE1 2.85Å; N510-E530 CarbonylContact C-O 3.48Å; N510-E530 WeakPolarHBondContact CA-O 3.5Å; Q511-E530 PolarHBondContact N-O 3.03Å; Q511-E530 PolarHBondContact O-N 2.02Å
531	L	92.3	Very high	88.8	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	121.9	175.3	-57.5	178.2	0	0	0	108.6	L363 L366 V378 C469 F471 L494 L507 N510 V529 F533	L363-L531 HydrophobicContact CD1-CD2 4.08Å; L366-L531 HydrophobicContact CD2-CD1 4.26Å; V378-L531 HydrophobicContact CG1-CD1 3.94Å; V378-L531 HydrophobicContact CG2-CD1 4.18Å; C469-L531 HydrophobicContact CB-CB 4.39Å; C469-L531 PolarHBondContact N-O 3.49Å; C469-L531 PolarHBondContact O-N 3.38Å; F471-L531 HydrophobicContact CE1-CD1 4.48Å; L494-L531 HydrophobicContact CD2-CD2 4.41Å; L507-L531 HydrophobicContact CD1-CB 3.81Å; L507-L531 HydrophobicContact CD1-CD2 4.05Å; L507-L531 HydrophobicContact CD1-CG 4.45Å; L507-L531 HydrophobicContact CD2-CD2 4.41Å; N510-L531 HydrophobicContact CB-CD2 3.72Å; V529-L531 HydrophobicContact CG1-CD2 4.01Å; V529-L531 HydrophobicContact CG1-CG 4.12Å; L531-F533 HydrophobicContact CB-CD2 4.41Å; L531-F533 HydrophobicContact CB-CE2 3.56Å; L531-F533 HydrophobicContact CB-CZ 3.99Å; L531-F533 HydrophobicContact CD1-CE2 4.42Å; L531-F533 HydrophobicContact CD1-CZ 4.21Å
532	T	91.9	Very high	89.5	Confident	16 Å²	16	36 Å²	36	10%	0.098	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	121.9	176	-43.2	0	0	0	0	109.9	D466 K468 I508 K509	D466-T532 HydrophobicContact CB-CG2 4.32Å; K468-T532 HydrophobicContact CG-CG2 4.07Å; I508-T532 PolarHBondContact N-O 2.92Å; K509-T532 PolarHBondContact N-O 2.84Å; K509-T532 VanDerWaalsContact N-O 3.14Å; K509-T532 PolarHBondContact O-N 3.02Å
533	F	89.9	Confident	89.8	Confident	1 Å²	1	36.8 Å²	36.8	0%	0.004	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	155	-179.9	-59.3	-95.3	0	0	0	110.4	L366 Y376 D466 P467 C469 A505 Y506 L507 L531	L366-F533 HydrophobicContact CB-CE1 4.25Å; L366-F533 HydrophobicContact CD1-CE1 4.07Å; L366-F533 HydrophobicContact CD1-CZ 4.41Å; L366-F533 HydrophobicContact CD2-CZ 4.25Å; Y376-F533 HydrophobicContact CD1-CD1 4.4Å; Y376-F533 HydrophobicContact CD1-CD2 4.37Å; Y376-F533 HydrophobicContact CD1-CG 4.32Å; Y376-F533 HydrophobicContact CE1-CB 4.26Å; Y376-F533 HydrophobicContact CE1-CD1 4.36Å; Y376-F533 HydrophobicContact CE1-CG 4.14Å; D466-F533 CarbonylContact C-O 3.57Å; D466-F533 VanDerWaalsContact C-O 3.24Å; D466-F533 WeakPolarHBondContact CA-O 3.39Å; D466-F533 VanDerWaalsContact CB-O 3.32Å; D466-F533 WeakPolarHBondContact CB-O 3.43Å; P467-F533 VanDerWaalsContact CD-O 3.27Å; P467-F533 WeakPolarHBondContact CD-O 3.21Å; P467-F533 HydrophobicContact CG-CB 4.4Å; P467-F533 PolarHBondContact O-N 3.03Å; C469-F533 HydrophobicContact CB-CE2 4.03Å; C469-F533 WeakPolarHBondContact SG-CE2 3.5Å; A505-F533 HydrophobicContact CB-CD1 3.85Å; A505-F533 HydrophobicContact CB-CE1 3.72Å; Y506-F533 CarbonylContact O-C 3.58Å; Y506-F533 VanDerWaalsContact O-CA 3.29Å; Y506-F533 WeakPolarHBondContact O-CA 3.08Å; L507-F533 HydrophobicContact CB-CD1 3.93Å; L507-F533 HydrophobicContact CB-CE1 3.79Å; L507-F533 HydrophobicContact CD1-CD1 4.22Å; L507-F533 HydrophobicContact CD1-CE1 3.92Å; L507-F533 HydrophobicContact CD1-CE2 4.27Å; L507-F533 HydrophobicContact CD1-CZ 3.95Å; L507-F533 HydrophobicContact CG-CE1 4.42Å; L531-F533 HydrophobicContact CB-CD2 4.41Å; L531-F533 HydrophobicContact CB-CE2 3.56Å; L531-F533 HydrophobicContact CB-CZ 3.99Å; L531-F533 HydrophobicContact CD1-CE2 4.42Å; L531-F533 HydrophobicContact CD1-CZ 4.21Å
534	T	86.9	Confident	89.9	Confident	36 Å²	36	33.9 Å²	33.9	22%	0.221	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	145.5	157.8	176.7	0	0	0	0	109	D466 Y506 I508 R537	D466-T534 VanDerWaalsContact OD1-CA 3.31Å; D466-T534 WeakPolarHBondContact OD1-CA 3.35Å; D466-T534 VanDerWaalsContact OD1-CB 3.27Å; D466-T534 WeakPolarHBondContact OD1-CB 3.49Å; D466-T534 PolarHBondContact OD1-OG1 3.16Å; Y506-T534 HydrophobicContact CG-CG2 4.42Å; Y506-T534 PolarHBondContact O-N 2.96Å; I508-T534 HydrophobicContact CD1-CG2 4.38Å; I508-T534 HydrophobicContact CG1-CG2 4.13Å; T534-R537 PolarHBondContact OG1-NE 2.95Å; T534-R537 PolarHBondContact OG1-NH2 2.78Å
535	R	86.6	Confident	90	Very high	2 Å²	2	31.6 Å²	31.6	1%	0.008	17%	0.168	C	C	.	.			trans	-76.8	151.9	167.7	-158.9	177.1	-63	-73.8	-4.3	110.3	E371 S373 D465 R537 Y540	E371-R535 PolarHBondContact O-NH1 3.44Å; S373-R535 PolarHBondContact O-NH1 2.92Å; D465-R535 IonicContact OD1-CZ 2.78Å; D465-R535 IonicContact OD1-NE 3.17Å; D465-R535 PolarHBondContact OD1-NE 2.77Å; D465-R535 IonicContact OD1-NH2 3.66Å; D465-R535 PolarHBondContact OD1-NH2 3.48Å; D465-R535 IonicContact OD2-CZ 3.61Å; D465-R535 IonicContact OD2-NE 3.91Å; D465-R535 IonicContact OD2-NH2 2.64Å; D465-R535 PolarHBondContact OD2-NH2 2.99Å; R535-R537 PolarHBondContact O-N 3.49Å; R535-Y540 HydrophobicContact CG-CE2 3.76Å
536	D	84.9	Confident	90.2	Very high	47 Å²	47	35.3 Å²	35.3	25%	0.251	19%	0.186	S	C	.	.			trans	-74.4	99.7	173.3	179.8	23.2	0	0	0	111.1	E371 Y506 A538 Y539 Y540	E371-D536 WeakPolarHBondContact OE2-CB 3.47Å; E371-D536 PolarHBondContact OE2-N 3.42Å; E371-D536 VanDerWaalsContact OE2-N 3.15Å; Y506-D536 HydrophobicContact CE2-CB 3.95Å; D536-A538 PolarHBondContact O-N 2.83Å; D536-A538 VanDerWaalsContact OD1-CB 3.29Å; D536-A538 WeakPolarHBondContact OD1-CB 3.39Å; D536-A538 PolarHBondContact OD1-N 3.02Å; D536-Y539 PolarHBondContact O-N 2.96Å; D536-Y539 WeakPolarHBondContact OD2-CB 3.38Å; D536-Y539 PolarHBondContact OD2-N 3Å; D536-Y540 WeakPolarHBondContact O-CD2 3.3Å
537	R	85.2	Confident	90.3	Very high	69 Å²	69	36.3 Å²	36.3	26%	0.26	19%	0.193	S	C	.	.	H	α-helix	trans	-63.6	-29.7	178.6	-57.3	165.8	-161.5	-159.2	-1.1	111	D466 T534 R535 Y540 F541 S755	D466-R537 IonicContact OD1-CZ 3.63Å; D466-R537 IonicContact OD1-NH2 2.81Å; D466-R537 PolarHBondContact OD1-NH2 2.89Å; D466-R537 IonicContact OD2-NH2 2.75Å; D466-R537 PolarHBondContact OD2-NH2 2.9Å; T534-R537 PolarHBondContact OG1-NE 2.95Å; T534-R537 PolarHBondContact OG1-NH2 2.78Å; R535-R537 PolarHBondContact O-N 3.49Å; R537-Y540 PolarHBondContact O-N 3.44Å; R537-F541 WeakPolarHBondContact O-CD2 3.46Å; R537-F541 PolarHBondContact O-N 3.48Å; R537-F541 VanDerWaalsContact O-N 3.11Å; R537-S755 VanDerWaalsContact CZ-OG 3.32Å; R537-S755 PolarHBondContact NH1-OG 2.99Å; R537-S755 PolarHBondContact NH2-OG 3.42Å
538	A	86.6	Confident	90.3	Very high	53 Å²	53	36.2 Å²	36.2	44%	0.438	19%	0.193	S	C	.	.	H	α-helix	trans	-70.5	-37.6	-178.8	0	0	0	0	0	112.9	D536 Y540 F541 T542	D536-A538 PolarHBondContact O-N 2.83Å; D536-A538 VanDerWaalsContact OD1-CB 3.29Å; D536-A538 WeakPolarHBondContact OD1-CB 3.39Å; D536-A538 PolarHBondContact OD1-N 3.02Å; A538-Y540 PolarHBondContact O-N 3.06Å; A538-F541 PolarHBondContact O-N 2.88Å; A538-T542 WeakPolarHBondContact O-CG2 3.44Å; A538-T542 PolarHBondContact O-N 3.33Å; A538-T542 PolarHBondContact O-OG1 2.92Å
539	Y	87.3	Confident	90.4	Very high	88 Å²	88	35.7 Å²	35.7	35%	0.345	19%	0.192	S	C	.	.	H	α-helix	trans	-52.2	-51.3	170.1	176.6	-95.5	0	0	0	111.8	E371 D536 T542 T543	E371-Y539 HydrophobicContact CB-CD1 3.76Å; E371-Y539 HydrophobicContact CB-CE1 3.96Å; E371-Y539 HydrophobicContact CB-CG 4.18Å; E371-Y539 HydrophobicContact CG-CD1 4.06Å; E371-Y539 HydrophobicContact CG-CD2 4.28Å; E371-Y539 HydrophobicContact CG-CG 3.95Å; D536-Y539 PolarHBondContact O-N 2.96Å; D536-Y539 WeakPolarHBondContact OD2-CB 3.38Å; D536-Y539 PolarHBondContact OD2-N 3Å; Y539-T542 PolarHBondContact O-N 3.31Å; Y539-T542 PolarHBondContact O-OG1 2.84Å; Y539-T542 VanDerWaalsContact O-OG1 3.1Å; Y539-T543 HydrophobicContact CD2-CG2 4.05Å; Y539-T543 HydrophobicContact CE2-CG2 3.85Å; Y539-T543 WeakPolarHBondContact O-CB 3.38Å; Y539-T543 WeakPolarHBondContact O-CG2 2.97Å; Y539-T543 PolarHBondContact O-N 2.94Å; Y539-T543 PolarHBondContact O-OG1 3.35Å
540	Y	88.6	Confident	90.5	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-69	-36.9	179.9	-64.7	-86.6	0	0	0	113.3	E371 S372 F462 P463 R535 D536 R537 A538 T542 V544 F545 F587 M600	E371-Y540 HydrophobicContact CB-CE2 4.31Å; E371-Y540 PolarHBondContact O-OH 2.83Å; S372-Y540 VanDerWaalsContact CA-OH 3.27Å; S372-Y540 WeakPolarHBondContact CA-OH 3.39Å; S372-Y540 PolarHBondContact N-OH 2.99Å; F462-Y540 HydrophobicContact CE1-CE1 4.03Å; F462-Y540 AromaticContact CZ-CE1 3.84Å; F462-Y540 HydrophobicContact CZ-CE1 3.84Å; F462-Y540 AromaticContact CZ-CZ 3.9Å; P463-Y540 HydrophobicContact CB-CD1 3.67Å; P463-Y540 HydrophobicContact CB-CD2 3.54Å; P463-Y540 HydrophobicContact CB-CE1 3.81Å; P463-Y540 HydrophobicContact CB-CE2 3.74Å; P463-Y540 HydrophobicContact CB-CG 3.52Å; P463-Y540 HydrophobicContact CG-CD1 3.79Å; P463-Y540 HydrophobicContact CG-CD2 3.9Å; P463-Y540 HydrophobicContact CG-CE1 4.42Å; P463-Y540 HydrophobicContact CG-CG 3.48Å; P463-Y540 VanDerWaalsContact CG-CG 3.48Å; R535-Y540 HydrophobicContact CG-CE2 3.76Å; D536-Y540 WeakPolarHBondContact O-CD2 3.3Å; R537-Y540 PolarHBondContact O-N 3.44Å; A538-Y540 PolarHBondContact O-N 3.06Å; Y540-T542 VanDerWaalsContact C-N 3.32Å; Y540-T542 PolarHBondContact O-N 3.45Å; Y540-V544 HydrophobicContact CD1-CG2 4.3Å; Y540-V544 WeakPolarHBondContact O-CB 3.08Å; Y540-V544 PolarHBondContact O-N 3.45Å; Y540-F545 WeakPolarHBondContact O-CD2 3.24Å; Y540-F545 PolarHBondContact O-N 3.21Å; Y540-F587 AromaticContact CD1-CE2 3.89Å; Y540-F587 HydrophobicContact CD1-CE2 3.89Å; Y540-F587 AromaticContact CD1-CZ 3.76Å; Y540-F587 HydrophobicContact CD1-CZ 3.76Å; Y540-F587 AromaticContact CE1-CE2 3.59Å; Y540-F587 HydrophobicContact CE1-CE2 3.59Å; Y540-F587 AromaticContact CE1-CZ 3.57Å; Y540-F587 HydrophobicContact CE1-CZ 3.57Å; Y540-M600 HydrophobicContact CD1-CE 3.93Å
541	F	90.2	Very high	90.6	Very high	69 Å²	69	39.1 Å²	39.1	30%	0.303	21%	0.211	S	C	.	.	I	π-helix	trans	-59.2	-43.6	174	-87.5	-66.3	0	0	0	111.9	F464 R537 A538 F545 I546 F748	F464-F541 AromaticContact CE1-CE2 3.95Å; F464-F541 HydrophobicContact CE1-CE2 3.95Å; F464-F541 HydrophobicContact CE1-CZ 4.03Å; F464-F541 HydrophobicContact CZ-CZ 4.41Å; R537-F541 WeakPolarHBondContact O-CD2 3.46Å; R537-F541 PolarHBondContact O-N 3.48Å; R537-F541 VanDerWaalsContact O-N 3.11Å; A538-F541 PolarHBondContact O-N 2.88Å; F541-F545 HydrophobicContact CD1-CB 4.21Å; F541-F545 HydrophobicContact CD1-CD2 4.06Å; F541-F545 HydrophobicContact CD1-CG 4.45Å; F541-F545 HydrophobicContact CE1-CD2 4.36Å; F541-F545 HydrophobicContact CG-CD2 4.41Å; F541-I546 WeakPolarHBondContact O-CB 3.32Å; F541-I546 VanDerWaalsContact O-CG1 3.24Å; F541-I546 WeakPolarHBondContact O-CG1 3.34Å; F541-I546 PolarHBondContact O-N 3.01Å; F541-F748 HydrophobicContact CD1-CE1 4.4Å; F541-F748 AromaticContact CE1-CD1 3.88Å; F541-F748 HydrophobicContact CE1-CD1 3.88Å; F541-F748 AromaticContact CE1-CE1 3.41Å; F541-F748 HydrophobicContact CE1-CE1 3.41Å; F541-F748 VanDerWaalsContact CE1-CE1 3.41Å; F541-F748 HydrophobicContact CE1-CE2 4.47Å; F541-F748 AromaticContact CE1-CZ 3.76Å; F541-F748 HydrophobicContact CE1-CZ 3.76Å; F541-F748 AromaticContact CZ-CD1 3.96Å; F541-F748 HydrophobicContact CZ-CD1 3.96Å; F541-F748 AromaticContact CZ-CE1 3.86Å; F541-F748 HydrophobicContact CZ-CE1 3.86Å
542	T	90.2	Very high	90.8	Very high	87 Å²	87	39.1 Å²	39.1	53%	0.534	21%	0.211	S	C	.	.	I	π-helix	trans	-81.6	-34	-176.8	53.7	0	0	0	0	114.2	A538 Y539 Y540 P547	A538-T542 WeakPolarHBondContact O-CG2 3.44Å; A538-T542 PolarHBondContact O-N 3.33Å; A538-T542 PolarHBondContact O-OG1 2.92Å; Y539-T542 PolarHBondContact O-N 3.31Å; Y539-T542 PolarHBondContact O-OG1 2.84Å; Y539-T542 VanDerWaalsContact O-OG1 3.1Å; Y540-T542 VanDerWaalsContact C-N 3.32Å; Y540-T542 PolarHBondContact O-N 3.45Å; T542-P547 WeakPolarHBondContact O-CD 3.27Å
543	T	88.5	Confident	90.9	Very high	53 Å²	53	41.4 Å²	41.4	33%	0.325	22%	0.224	S	C	.	.	I	π-helix	trans	-95.7	-27.7	-175	60.8	0	0	0	0	114.8	Y539	Y539-T543 HydrophobicContact CD2-CG2 4.05Å; Y539-T543 HydrophobicContact CE2-CG2 3.85Å; Y539-T543 WeakPolarHBondContact O-CB 3.38Å; Y539-T543 WeakPolarHBondContact O-CG2 2.97Å; Y539-T543 PolarHBondContact O-N 2.94Å; Y539-T543 PolarHBondContact O-OG1 3.35Å
544	V	90.2	Very high	91.1	Very high	13 Å²	13	43 Å²	43	8%	0.079	24%	0.236	C	C	.	.	I	π-helix	trans	-114.7	-59.4	-176	-175.6	0	0	0	0	111.4	Y540 G548 F587 M600	Y540-V544 HydrophobicContact CD1-CG2 4.3Å; Y540-V544 WeakPolarHBondContact O-CB 3.08Å; Y540-V544 PolarHBondContact O-N 3.45Å; V544-G548 PolarHBondContact O-N 3Å; V544-F587 HydrophobicContact CG1-CD1 4.33Å; V544-F587 HydrophobicContact CG1-CE1 4.37Å; V544-F587 HydrophobicContact CG2-CD1 4.07Å; V544-F587 HydrophobicContact CG2-CD2 3.59Å; V544-F587 HydrophobicContact CG2-CE1 4.07Å; V544-F587 HydrophobicContact CG2-CE2 3.6Å; V544-F587 HydrophobicContact CG2-CG 3.83Å; V544-F587 HydrophobicContact CG2-CZ 3.84Å; V544-M600 HydrophobicContact CG1-CE 4.35Å
545	F	93.2	Very high	91.5	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	23%	0.225	C	C	.	.	I	π-helix	trans	-70.7	-47.5	-169.3	-65	-64.7	0	0	0	112.7	P463 F464 Y540 F541 G548 I549 M600 W603 F747 F748	P463-F545 HydrophobicContact CG-CE2 4.03Å; P463-F545 HydrophobicContact CG-CZ 4.33Å; F464-F545 HydrophobicContact CE1-CE2 4.27Å; F464-F545 HydrophobicContact CE2-CE2 4.5Å; F464-F545 HydrophobicContact CE2-CZ 4.2Å; F464-F545 AromaticContact CZ-CE2 3.68Å; F464-F545 HydrophobicContact CZ-CE2 3.68Å; F464-F545 AromaticContact CZ-CZ 3.78Å; F464-F545 HydrophobicContact CZ-CZ 3.78Å; Y540-F545 WeakPolarHBondContact O-CD2 3.24Å; Y540-F545 PolarHBondContact O-N 3.21Å; F541-F545 HydrophobicContact CD1-CB 4.21Å; F541-F545 HydrophobicContact CD1-CD2 4.06Å; F541-F545 HydrophobicContact CD1-CG 4.45Å; F541-F545 HydrophobicContact CE1-CD2 4.36Å; F541-F545 HydrophobicContact CG-CD2 4.41Å; F545-G548 PolarHBondContact O-N 2.68Å; F545-I549 VanDerWaalsContact O-CG1 3.29Å; F545-I549 WeakPolarHBondContact O-CG1 3.38Å; F545-I549 PolarHBondContact O-N 2.89Å; F545-M600 HydrophobicContact CE1-SD 4.2Å; F545-M600 HydrophobicContact CE2-CE 4.27Å; F545-M600 HydrophobicContact CZ-CE 3.86Å; F545-M600 HydrophobicContact CZ-SD 3.92Å; F545-W603 HydrophobicContact CB-CZ2 4.38Å; F545-W603 AromaticContact CD1-CD2 3.66Å; F545-W603 HydrophobicContact CD1-CD2 3.66Å; F545-W603 AromaticContact CD1-CE2 3.6Å; F545-W603 AromaticContact CD1-CE3 3.8Å; F545-W603 HydrophobicContact CD1-CE3 3.8Å; F545-W603 HydrophobicContact CD1-CG 4.31Å; F545-W603 AromaticContact CD1-CH2 3.86Å; F545-W603 HydrophobicContact CD1-CH2 3.86Å; F545-W603 AromaticContact CD1-CZ2 3.72Å; F545-W603 HydrophobicContact CD1-CZ2 3.72Å; F545-W603 AromaticContact CD1-CZ3 3.89Å; F545-W603 HydrophobicContact CD1-CZ3 3.89Å; F545-W603 AromaticContact CE1-CD2 3.72Å; F545-W603 HydrophobicContact CE1-CD2 3.72Å; F545-W603 AromaticContact CE1-CE3 3.88Å; F545-W603 HydrophobicContact CE1-CE3 3.88Å; F545-W603 HydrophobicContact CE1-CG 4Å; F545-W603 HydrophobicContact CE1-CZ3 4.37Å; F545-F747 HydrophobicContact CD1-CE1 4.47Å; F545-F747 AromaticContact CE1-CE1 3.67Å; F545-F747 HydrophobicContact CE1-CE1 3.67Å; F545-F747 HydrophobicContact CE1-CZ 4.03Å; F545-F747 HydrophobicContact CZ-CE1 4.12Å; F545-F747 HydrophobicContact CZ-CZ 4.46Å; F545-F748 HydrophobicContact CB-CZ 4.14Å; F545-F748 HydrophobicContact CD1-CE1 4.06Å; F545-F748 AromaticContact CD1-CZ 3.91Å; F545-F748 HydrophobicContact CD1-CZ 3.91Å; F545-F748 HydrophobicContact CD2-CE1 4.31Å; F545-F748 HydrophobicContact CE1-CE1 4.26Å; F545-F748 HydrophobicContact CE1-CZ 4.5Å; F545-F748 HydrophobicContact CE2-CE1 4.49Å; F545-F748 HydrophobicContact CG-CE1 4.11Å; F545-F748 AromaticContact CG-CZ 3.97Å; F545-F748 HydrophobicContact CG-CZ 3.97Å; F545-F748 HydrophobicContact CZ-CE1 4.47Å
546	I	94.3	Very high	91.8	Very high	83 Å²	83	41.8 Å²	41.8	43%	0.426	23%	0.228	S	C	.	.	H	α-helix	trans	-62.5	-49.5	178.8	-75.3	168.7	0	0	0	112.2	F541 G548 I549 I550	F541-I546 WeakPolarHBondContact O-CB 3.32Å; F541-I546 VanDerWaalsContact O-CG1 3.24Å; F541-I546 WeakPolarHBondContact O-CG1 3.34Å; F541-I546 PolarHBondContact O-N 3.01Å; I546-G548 VanDerWaalsContact C-N 3.32Å; I546-G548 PolarHBondContact O-N 2.75Å; I546-I549 PolarHBondContact O-N 3.48Å; I546-I550 HydrophobicContact CG2-CD1 3.8Å; I546-I550 WeakPolarHBondContact O-CG1 3.49Å; I546-I550 PolarHBondContact O-N 3.33Å
547	P	94.1	Very high	92.2	Very high	40 Å²	40	43.7 Å²	43.7	26%	0.26	24%	0.237	S	C	.	.	H	α-helix	trans	-60	-38.6	174.7	-28	38.3	0	0	0	113.3	T542 I550 L551	T542-P547 WeakPolarHBondContact O-CD 3.27Å; P547-I550 PolarHBondContact O-N 3.04Å; P547-L551 WeakPolarHBondContact O-CG 3.4Å; P547-L551 PolarHBondContact O-N 3.47Å
548	G	94.8	Very high	92.5	Very high	4 Å²	4	40.5 Å²	40.5	4%	0.041	23%	0.225	C	C	.	.	H	α-helix	trans	-59.5	-47.5	174.1	0	0	0	0	0	112.8	V544 F545 I546 I550 L551 V552	V544-G548 PolarHBondContact O-N 3Å; F545-G548 PolarHBondContact O-N 2.68Å; I546-G548 VanDerWaalsContact C-N 3.32Å; I546-G548 PolarHBondContact O-N 2.75Å; G548-I550 VanDerWaalsContact C-N 3.34Å; G548-I550 PolarHBondContact O-N 2.78Å; G548-L551 PolarHBondContact O-N 2.93Å; G548-V552 WeakPolarHBondContact O-CG2 3.1Å; G548-V552 PolarHBondContact O-N 3.48Å
549	I	95.8	Very high	92.7	Very high	45 Å²	45	38 Å²	38	23%	0.231	20%	0.204	C	C	.	.	H	α-helix	trans	-60.8	-42.5	176.5	-69.3	163.6	0	0	0	111.3	F545 I546 T553 W603 Y740 L744	F545-I549 VanDerWaalsContact O-CG1 3.29Å; F545-I549 WeakPolarHBondContact O-CG1 3.38Å; F545-I549 PolarHBondContact O-N 2.89Å; I546-I549 PolarHBondContact O-N 3.48Å; I549-T553 HydrophobicContact CG2-CG2 4.38Å; I549-T553 WeakPolarHBondContact O-CB 3.33Å; I549-T553 WeakPolarHBondContact O-CG2 3.2Å; I549-T553 PolarHBondContact O-N 3.44Å; I549-T553 PolarHBondContact O-OG1 3.42Å; I549-W603 HydrophobicContact CD1-CH2 4.15Å; I549-W603 HydrophobicContact CG1-CH2 3.8Å; I549-W603 HydrophobicContact CG1-CZ2 4.18Å; I549-Y740 HydrophobicContact CG1-CE1 4.43Å; I549-Y740 HydrophobicContact CG2-CE1 4.44Å; I549-L744 HydrophobicContact CD1-CD1 4.19Å; I549-L744 HydrophobicContact CD1-CD2 4.11Å; I549-L744 HydrophobicContact CG1-CD1 4.16Å; I549-L744 HydrophobicContact CG1-CD2 3.97Å
550	I	95.2	Very high	92.8	Very high	93 Å²	93	41.7 Å²	41.7	48%	0.477	22%	0.217	S	C	.	.	H	α-helix	trans	-63.3	-41.9	177.3	-67.8	166	0	0	0	110.9	I546 P547 G548 T553 S554	I546-I550 HydrophobicContact CG2-CD1 3.8Å; I546-I550 WeakPolarHBondContact O-CG1 3.49Å; I546-I550 PolarHBondContact O-N 3.33Å; P547-I550 PolarHBondContact O-N 3.04Å; G548-I550 VanDerWaalsContact C-N 3.34Å; G548-I550 PolarHBondContact O-N 2.78Å; I550-T553 PolarHBondContact O-OG1 2.86Å; I550-S554 WeakPolarHBondContact O-CB 3.42Å; I550-S554 PolarHBondContact O-N 3.39Å; I550-S554 PolarHBondContact O-OG 3.3Å
551	L	95.1	Very high	92.9	Very high	23 Å²	23	44.1 Å²	44.1	12%	0.12	23%	0.23	C	C	.	.	H	α-helix	trans	-68.4	-43.2	178.8	-72.3	171.9	0	0	0	112.7	P547 G548 S554 S555 N579 F580	P547-L551 WeakPolarHBondContact O-CG 3.4Å; P547-L551 PolarHBondContact O-N 3.47Å; G548-L551 PolarHBondContact O-N 2.93Å; L551-S554 PolarHBondContact O-N 3.34Å; L551-S555 PolarHBondContact O-N 3.45Å; L551-N579 HydrophobicContact CD1-CB 4.23Å; L551-N579 HydrophobicContact CD2-CB 3.74Å; L551-F580 HydrophobicContact CD1-CB 4.26Å; L551-F580 HydrophobicContact CD1-CD2 4.4Å
552	V	96.4	Very high	92.6	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-63.4	-49.4	176.2	175.6	0	0	0	0	110.5	G548 S554 S555 F556 C607 F610 I611 Y740	G548-V552 WeakPolarHBondContact O-CG2 3.1Å; G548-V552 PolarHBondContact O-N 3.48Å; V552-S554 VanDerWaalsContact C-N 3.32Å; V552-S554 PolarHBondContact O-N 2.96Å; V552-S555 WeakPolarHBondContact O-CB 3.32Å; V552-S555 PolarHBondContact O-N 3.05Å; V552-S555 VanDerWaalsContact O-N 3.09Å; V552-S555 PolarHBondContact O-OG 3Å; V552-F556 HydrophobicContact CG1-CE1 4.02Å; V552-F556 HydrophobicContact CG1-CE2 4.19Å; V552-F556 HydrophobicContact CG1-CZ 3.54Å; V552-C607 HydrophobicContact CG2-CB 3.71Å; V552-F610 HydrophobicContact CG1-CB 3.93Å; V552-I611 HydrophobicContact CB-CG1 4.49Å; V552-I611 HydrophobicContact CG2-CD1 3.92Å; V552-I611 HydrophobicContact CG2-CG1 4.02Å; V552-Y740 HydrophobicContact CB-CE1 3.96Å; V552-Y740 HydrophobicContact CB-CE2 4.31Å; V552-Y740 HydrophobicContact CG1-CD1 3.92Å; V552-Y740 HydrophobicContact CG1-CD2 3.97Å; V552-Y740 HydrophobicContact CG1-CE1 3.73Å; V552-Y740 HydrophobicContact CG1-CE2 3.8Å; V552-Y740 HydrophobicContact CG1-CG 4.04Å; V552-Y740 HydrophobicContact CG2-CE2 4.28Å
553	T	95.1	Very high	92.1	Very high	63 Å²	63	44.6 Å²	44.6	39%	0.387	23%	0.225	S	C	.	.	H	α-helix	trans	-65.5	-33.3	178.8	53.9	0	0	0	0	112.8	I549 I550 S555 F556 Y740	I549-T553 HydrophobicContact CG2-CG2 4.38Å; I549-T553 WeakPolarHBondContact O-CB 3.33Å; I549-T553 WeakPolarHBondContact O-CG2 3.2Å; I549-T553 PolarHBondContact O-N 3.44Å; I549-T553 PolarHBondContact O-OG1 3.42Å; I550-T553 PolarHBondContact O-OG1 2.86Å; T553-S555 VanDerWaalsContact C-N 3.27Å; T553-S555 PolarHBondContact O-N 3.31Å; T553-F556 WeakPolarHBondContact O-CB 3.36Å; T553-F556 PolarHBondContact O-N 3.37Å; T553-F556 VanDerWaalsContact O-N 3.11Å; T553-Y740 HydrophobicContact CG2-CE1 4.46Å
554	S	93.9	Very high	91.7	Very high	35 Å²	35	46.4 Å²	46.4	25%	0.245	23%	0.233	C	C	.	.	H	α-helix	trans	-62.4	-32	172.6	-64.3	0	0	0	0	112.8	I550 L551 V552 F556 I557	I550-S554 WeakPolarHBondContact O-CB 3.42Å; I550-S554 PolarHBondContact O-N 3.39Å; I550-S554 PolarHBondContact O-OG 3.3Å; L551-S554 PolarHBondContact O-N 3.34Å; V552-S554 VanDerWaalsContact C-N 3.32Å; V552-S554 PolarHBondContact O-N 2.96Å; S554-F556 VanDerWaalsContact C-N 3.25Å; S554-F556 PolarHBondContact O-N 3.45Å; S554-I557 WeakPolarHBondContact O-CB 3.31Å; S554-I557 WeakPolarHBondContact O-CG1 3.29Å; S554-I557 PolarHBondContact O-N 3.26Å
555	S	94.7	Very high	91.6	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-63.6	-32.4	174.5	81.1	0	0	0	0	112.2	L551 V552 T553 I557 T558 S614	L551-S555 PolarHBondContact O-N 3.45Å; V552-S555 WeakPolarHBondContact O-CB 3.32Å; V552-S555 PolarHBondContact O-N 3.05Å; V552-S555 VanDerWaalsContact O-N 3.09Å; V552-S555 PolarHBondContact O-OG 3Å; T553-S555 VanDerWaalsContact C-N 3.27Å; T553-S555 PolarHBondContact O-N 3.31Å; S555-I557 PolarHBondContact O-N 3.39Å; S555-T558 WeakPolarHBondContact O-CB 3.36Å; S555-T558 WeakPolarHBondContact O-CG2 3.41Å; S555-T558 PolarHBondContact O-N 2.96Å; S555-T558 PolarHBondContact O-OG1 3Å; S555-S614 WeakPolarHBondContact CB-OG 3.21Å
556	F	94.6	Very high	91.4	Very high	13 Å²	13	48.9 Å²	48.9	6%	0.057	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-72.1	-12.4	-179.5	-52.4	-20.8	0	0	0	113.6	V552 T553 S554 T558 F559 F610 F736 P737 Y740	V552-F556 HydrophobicContact CG1-CE1 4.02Å; V552-F556 HydrophobicContact CG1-CE2 4.19Å; V552-F556 HydrophobicContact CG1-CZ 3.54Å; T553-F556 WeakPolarHBondContact O-CB 3.36Å; T553-F556 PolarHBondContact O-N 3.37Å; T553-F556 VanDerWaalsContact O-N 3.11Å; S554-F556 VanDerWaalsContact C-N 3.25Å; S554-F556 PolarHBondContact O-N 3.45Å; F556-T558 PolarHBondContact O-N 3.19Å; F556-F559 HydrophobicContact CB-CD2 3.9Å; F556-F559 HydrophobicContact CB-CE2 3.69Å; F556-F559 AromaticContact CD1-CE2 3.63Å; F556-F559 HydrophobicContact CD1-CE2 3.63Å; F556-F559 HydrophobicContact CD1-CZ 4.05Å; F556-F559 AromaticContact CG-CE2 3.89Å; F556-F559 HydrophobicContact CG-CE2 3.89Å; F556-F559 VanDerWaalsContact O-CD2 3.26Å; F556-F559 WeakPolarHBondContact O-CD2 3.39Å; F556-F559 PolarHBondContact O-N 3.34Å; F556-F610 HydrophobicContact CE1-CB 4.45Å; F556-F610 HydrophobicContact CE1-CD1 4.41Å; F556-F610 HydrophobicContact CZ-CB 4.5Å; F556-F610 HydrophobicContact CZ-CD1 4.15Å; F556-F736 HydrophobicContact CD1-CB 4.08Å; F556-F736 HydrophobicContact CD1-CD1 4.23Å; F556-F736 HydrophobicContact CE1-CB 3.93Å; F556-F736 AromaticContact CE1-CD1 3.8Å; F556-F736 HydrophobicContact CE1-CD1 3.8Å; F556-F736 HydrophobicContact CE1-CG 4.35Å; F556-F736 HydrophobicContact CE2-CB 4.42Å; F556-F736 HydrophobicContact CG-CB 4.42Å; F556-F736 HydrophobicContact CZ-CB 4.1Å; F556-P737 HydrophobicContact CD2-CG 3.94Å; F556-P737 HydrophobicContact CE2-CG 4.42Å; F556-Y740 HydrophobicContact CE2-CD1 4.33Å; F556-Y740 HydrophobicContact CE2-CG 4.46Å; F556-Y740 HydrophobicContact CZ-CG 4.37Å
557	I	92.1	Very high	91.3	Very high	87 Å²	87	50 Å²	50	45%	0.446	26%	0.263	S	S	.	.	G	3₁₀ helix	trans	-61.7	-27.4	172.5	-59.3	174	0	0	0	110.6	S554 S555 F559 W560 L561	S554-I557 WeakPolarHBondContact O-CB 3.31Å; S554-I557 WeakPolarHBondContact O-CG1 3.29Å; S554-I557 PolarHBondContact O-N 3.26Å; S555-I557 PolarHBondContact O-N 3.39Å; I557-F559 PolarHBondContact O-N 3.04Å; I557-W560 WeakPolarHBondContact O-CB 3.42Å; I557-W560 PolarHBondContact O-N 3.48Å; I557-L561 PolarHBondContact O-N 3.06Å
558	T	90.8	Very high	91.2	Very high	2 Å²	2	49.6 Å²	49.6	1%	0.012	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	-57.9	-33.7	177.1	59.2	0	0	0	0	113.4	S555 F556 W560 R569 I572	S555-T558 WeakPolarHBondContact O-CB 3.36Å; S555-T558 WeakPolarHBondContact O-CG2 3.41Å; S555-T558 PolarHBondContact O-N 2.96Å; S555-T558 PolarHBondContact O-OG1 3Å; F556-T558 PolarHBondContact O-N 3.19Å; T558-W560 VanDerWaalsContact C-N 3.25Å; T558-W560 PolarHBondContact O-N 3.36Å; T558-R569 PolarHBondContact O-NE 3.11Å; T558-R569 VanDerWaalsContact O-NE 3.11Å; T558-I572 HydrophobicContact CG2-CB 4.08Å; T558-I572 HydrophobicContact CG2-CG2 3.87Å
559	F	92	Very high	91	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	26%	0.262	C	S	.	.	G	3₁₀ helix	trans	-69.4	-21.8	177.7	-44.7	-40	0	0	0	113	F556 I557 E617 A732 R733 F736	F556-F559 HydrophobicContact CB-CD2 3.9Å; F556-F559 HydrophobicContact CB-CE2 3.69Å; F556-F559 AromaticContact CD1-CE2 3.63Å; F556-F559 HydrophobicContact CD1-CE2 3.63Å; F556-F559 HydrophobicContact CD1-CZ 4.05Å; F556-F559 AromaticContact CG-CE2 3.89Å; F556-F559 HydrophobicContact CG-CE2 3.89Å; F556-F559 VanDerWaalsContact O-CD2 3.26Å; F556-F559 WeakPolarHBondContact O-CD2 3.39Å; F556-F559 PolarHBondContact O-N 3.34Å; I557-F559 PolarHBondContact O-N 3.04Å; F559-E617 HydrophobicContact CD1-CG 4.02Å; F559-E617 WeakPolarHBondContact CD1-OE2 3.18Å; F559-E617 HydrophobicContact CE1-CB 3.9Å; F559-E617 HydrophobicContact CE1-CG 3.74Å; F559-A732 HydrophobicContact CB-CB 4.39Å; F559-A732 HydrophobicContact CD1-CB 3.87Å; F559-A732 HydrophobicContact CD2-CB 4.04Å; F559-A732 HydrophobicContact CE1-CB 4.12Å; F559-A732 HydrophobicContact CE2-CB 4.27Å; F559-A732 HydrophobicContact CG-CB 3.84Å; F559-A732 HydrophobicContact CZ-CB 4.32Å; F559-R733 HydrophobicContact CB-CG 3.79Å; F559-R733 PolarHBondContact O-NE 3.21Å; F559-R733 PolarHBondContact O-NH2 3.41Å; F559-F736 HydrophobicContact CE2-CB 3.67Å; F559-F736 HydrophobicContact CE2-CD1 4.07Å; F559-F736 HydrophobicContact CE2-CD2 4.01Å; F559-F736 AromaticContact CE2-CG 3.68Å; F559-F736 HydrophobicContact CE2-CG 3.68Å; F559-F736 HydrophobicContact CZ-CB 4.21Å; F559-F736 AromaticContact CZ-CD1 3.72Å; F559-F736 HydrophobicContact CZ-CD1 3.72Å; F559-F736 AromaticContact CZ-CD2 3.9Å; F559-F736 HydrophobicContact CZ-CD2 3.9Å; F559-F736 AromaticContact CZ-CE1 3.94Å; F559-F736 HydrophobicContact CZ-CE1 3.94Å; F559-F736 HydrophobicContact CZ-CE2 4.11Å; F559-F736 AromaticContact CZ-CG 3.7Å; F559-F736 HydrophobicContact CZ-CG 3.7Å; F559-F736 HydrophobicContact CZ-CZ 4.13Å
560	W	90.1	Very high	90.8	Very high	165 Å²	165	50.1 Å²	50.1	63%	0.625	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.9	-30.6	-178	-70.9	89.7	0	0	0	113.2	I557 T558 R733	I557-W560 WeakPolarHBondContact O-CB 3.42Å; I557-W560 PolarHBondContact O-N 3.48Å; T558-W560 VanDerWaalsContact C-N 3.25Å; T558-W560 PolarHBondContact O-N 3.36Å; W560-R733 HydrophobicContact CD2-CG 4.21Å; W560-R733 HydrophobicContact CG-CG 4.47Å; W560-R733 HydrophobicContact CZ2-CB 4.29Å; W560-R733 HydrophobicContact CZ2-CG 4.16Å; W560-R733 PolarHBondContact O-NH2 2.71Å
561	L	89.4	Confident	90.7	Very high	52 Å²	52	51.4 Å²	51.4	27%	0.272	27%	0.273	S	S	.	.	S	Bend	trans	-60.7	157.8	171	-71.9	171.1	0	0	0	111.7	I557 A565 A568 R569 I572	I557-L561 PolarHBondContact O-N 3.06Å; L561-A565 HydrophobicContact CB-CB 4.43Å; L561-A568 HydrophobicContact CD1-CB 3.88Å; L561-R569 HydrophobicContact CB-CG 3.99Å; L561-R569 HydrophobicContact CD1-CG 3.9Å; L561-R569 PolarHBondContact O-NH2 3.36Å; L561-I572 HydrophobicContact CD1-CD1 3.85Å
562	E	84.3	Confident	90.6	Very high	111 Å²	111	52.4 Å²	52.4	52%	0.519	28%	0.278	S	S	.	.			trans	-70.3	151.8	170.8	-65	-149.1	144.3	0	0	112.3	N564 A565 R569	E562-N564 HydrophobicContact CB-CB 4.23Å; E562-N564 PolarHBondContact O-N 3.04Å; E562-N564 PolarHBondContact OE2-ND2 3.37Å; E562-A565 WeakPolarHBondContact O-CB 3.29Å; E562-A565 PolarHBondContact O-N 2.92Å; E562-R569 PolarHBondContact O-NE 3.28Å
563	W	80.6	Confident	90.4	Very high	54 Å²	54	52.4 Å²	52.4	21%	0.205	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-22.7	170.3	69.7	-80.8	0	0	0	113.2	A565 V621 I722	W563-A565 VanDerWaalsContact C-N 3.34Å; W563-V621 HydrophobicContact CB-CG1 3.94Å; W563-I722 HydrophobicContact CZ2-CD1 4.47Å; W563-I722 HydrophobicContact CZ2-CG1 4.47Å; W563-I722 HydrophobicContact CZ2-CG2 4.21Å
564	N	79.1	Confident	90.3	Very high	91 Å²	91	53.1 Å²	53.1	49%	0.487	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-29.1	171.9	-67.2	-45.1	0	0	0	113	E562 V566	E562-N564 HydrophobicContact CB-CB 4.23Å; E562-N564 PolarHBondContact O-N 3.04Å; E562-N564 PolarHBondContact OE2-ND2 3.37Å; N564-V566 PolarHBondContact O-N 2.99Å
565	A	88.3	Confident	90.3	Very high	29 Å²	29	54.6 Å²	54.6	24%	0.24	29%	0.29	C	S	.	.			trans	-81.7	47.1	-172.9	0	0	0	0	0	112.5	L561 E562 W563 P567 A568 R569	L561-A565 HydrophobicContact CB-CB 4.43Å; E562-A565 WeakPolarHBondContact O-CB 3.29Å; E562-A565 PolarHBondContact O-N 2.92Å; W563-A565 VanDerWaalsContact C-N 3.34Å; A565-P567 VanDerWaalsContact C-CD 3.49Å; A565-A568 HydrophobicContact CB-CB 4.4Å; A565-A568 PolarHBondContact O-N 3.49Å; A565-A568 VanDerWaalsContact O-N 3.1Å; A565-R569 PolarHBondContact O-N 2.93Å
566	V	88.6	Confident	90.3	Very high	37 Å²	37	55.1 Å²	55.1	22%	0.224	29%	0.293	C	S	.	.	H	α-helix	trans	-50.8	-46.9	-174.5	-173.1	0	0	0	0	112.9	N564 A568 R569 V570 F618 N622	N564-V566 PolarHBondContact O-N 2.99Å; V566-A568 VanDerWaalsContact C-N 3.35Å; V566-A568 PolarHBondContact O-N 3.19Å; V566-R569 PolarHBondContact O-N 3.49Å; V566-V570 HydrophobicContact CG1-CG2 4.37Å; V566-V570 VanDerWaalsContact O-CG2 3.3Å; V566-V570 WeakPolarHBondContact O-CG2 3.38Å; V566-V570 PolarHBondContact O-N 3.25Å; V566-V570 VanDerWaalsContact O-N 3.08Å; V566-F618 HydrophobicContact CG1-CE2 4.26Å; V566-F618 HydrophobicContact CG1-CZ 3.94Å; V566-N622 WeakPolarHBondContact CG2-ND2 3.22Å
567	P	91.8	Very high	90.2	Very high	105 Å²	105	57.3 Å²	57.3	68%	0.682	30%	0.304	S	S	*	.	H	α-helix	trans	-63.4	-39.7	-179.7	-21.3	34.5	0	0	0	112.8	A565 M571	A565-P567 VanDerWaalsContact C-CD 3.49Å; P567-M571 WeakPolarHBondContact O-CB 3.46Å; P567-M571 PolarHBondContact O-N 3.43Å
568	A	91.9	Very high	90.3	Very high	32 Å²	32	58.2 Å²	58.2	26%	0.264	31%	0.31	S	S	.	.	H	α-helix	trans	-69.8	-43.7	-179.3	0	0	0	0	0	112	L561 A565 V566 M571 I572	L561-A568 HydrophobicContact CD1-CB 3.88Å; A565-A568 HydrophobicContact CB-CB 4.4Å; A565-A568 PolarHBondContact O-N 3.49Å; A565-A568 VanDerWaalsContact O-N 3.1Å; V566-A568 VanDerWaalsContact C-N 3.35Å; V566-A568 PolarHBondContact O-N 3.19Å; A568-M571 PolarHBondContact O-N 3.26Å; A568-I572 WeakPolarHBondContact O-CB 3.5Å; A568-I572 VanDerWaalsContact O-CG1 3.31Å; A568-I572 WeakPolarHBondContact O-CG1 3.29Å; A568-I572 PolarHBondContact O-N 2.66Å
569	R	91.7	Very high	90.5	Very high	1 Å²	1	61.5 Å²	61.5	0%	0.004	33%	0.327	C	S	.	.	H	α-helix	trans	-61.9	-46.6	176.2	-73.1	-166.4	-176.6	-149.3	8.2	112	T558 L561 E562 A565 V566 G573 E617 F618 D729	T558-R569 PolarHBondContact O-NE 3.11Å; T558-R569 VanDerWaalsContact O-NE 3.11Å; L561-R569 HydrophobicContact CB-CG 3.99Å; L561-R569 HydrophobicContact CD1-CG 3.9Å; L561-R569 PolarHBondContact O-NH2 3.36Å; E562-R569 PolarHBondContact O-NE 3.28Å; A565-R569 PolarHBondContact O-N 2.93Å; V566-R569 PolarHBondContact O-N 3.49Å; R569-G573 PolarHBondContact O-N 3.44Å; R569-G573 VanDerWaalsContact O-N 3.09Å; R569-E617 IonicContact NH1-OE2 3.57Å; R569-F618 HydrophobicContact CB-CD2 3.67Å; R569-F618 HydrophobicContact CB-CE2 3.9Å; R569-F618 HydrophobicContact CB-CG 4.26Å; R569-F618 VanDerWaalsContact CD-CD2 3.49Å; R569-F618 HydrophobicContact CG-CD2 4.26Å; R569-D729 IonicContact CZ-OD1 2.77Å; R569-D729 IonicContact NH1-OD1 3.24Å; R569-D729 PolarHBondContact NH1-OD1 3.23Å; R569-D729 VanDerWaalsContact NH2-CG 3.28Å; R569-D729 IonicContact NH2-OD1 3.19Å; R569-D729 PolarHBondContact NH2-OD1 3.46Å; R569-D729 IonicContact NH2-OD2 3.5Å; R569-D729 PolarHBondContact NH2-OD2 2.84Å
570	V	91.8	Very high	90.7	Very high	59 Å²	59	62 Å²	62	36%	0.358	33%	0.329	S	S	.	.	H	α-helix	trans	-61.1	-49.6	177.3	173.5	0	0	0	0	110.9	V566 I572 G573 V574 F618	V566-V570 HydrophobicContact CG1-CG2 4.37Å; V566-V570 VanDerWaalsContact O-CG2 3.3Å; V566-V570 WeakPolarHBondContact O-CG2 3.38Å; V566-V570 PolarHBondContact O-N 3.25Å; V566-V570 VanDerWaalsContact O-N 3.08Å; V570-I572 PolarHBondContact O-N 3.25Å; V570-G573 PolarHBondContact O-N 2.89Å; V570-V574 HydrophobicContact CG1-CG2 4.23Å; V570-V574 WeakPolarHBondContact O-CB 3.44Å; V570-V574 WeakPolarHBondContact O-CG2 3.34Å; V570-V574 PolarHBondContact O-N 2.99Å; V570-F618 HydrophobicContact CG2-CD1 4.38Å; V570-F618 HydrophobicContact CG2-CE1 3.4Å; V570-F618 VanDerWaalsContact CG2-CE1 3.4Å; V570-F618 HydrophobicContact CG2-CE2 4.37Å; V570-F618 HydrophobicContact CG2-CZ 3.39Å
571	M	93.6	Very high	90.7	Very high	120 Å²	120	57.6 Å²	57.6	59%	0.591	32%	0.315	S	S	*	.	H	α-helix	trans	-58.5	-50.5	-178.4	-175.6	-178.8	68	0	0	111.3	P567 A568 G573 T575	P567-M571 WeakPolarHBondContact O-CB 3.46Å; P567-M571 PolarHBondContact O-N 3.43Å; A568-M571 PolarHBondContact O-N 3.26Å; M571-G573 PolarHBondContact O-N 2.96Å; M571-T575 WeakPolarHBondContact O-CB 3.38Å; M571-T575 PolarHBondContact O-N 2.99Å; M571-T575 PolarHBondContact O-OG1 2.96Å; M571-T575 VanDerWaalsContact O-OG1 3.04Å
572	I	92.7	Very high	90.9	Very high	45 Å²	45	59.2 Å²	59.2	23%	0.231	33%	0.327	C	S	.	.	H	α-helix	trans	-61.1	-49	-179.4	-67.8	167.9	0	0	0	110.9	T558 L561 A568 V570 T575 T576	T558-I572 HydrophobicContact CG2-CB 4.08Å; T558-I572 HydrophobicContact CG2-CG2 3.87Å; L561-I572 HydrophobicContact CD1-CD1 3.85Å; A568-I572 WeakPolarHBondContact O-CB 3.5Å; A568-I572 VanDerWaalsContact O-CG1 3.31Å; A568-I572 WeakPolarHBondContact O-CG1 3.29Å; A568-I572 PolarHBondContact O-N 2.66Å; V570-I572 PolarHBondContact O-N 3.25Å; I572-T575 PolarHBondContact O-N 3.18Å; I572-T576 HydrophobicContact CG2-CG2 4.47Å; I572-T576 WeakPolarHBondContact O-CG2 3.36Å; I572-T576 PolarHBondContact O-N 3.42Å; I572-T576 PolarHBondContact O-OG1 2.88Å
573	G	91.1	Very high	91.3	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-65.6	-40.2	-177.5	0	0	0	0	0	114	R569 V570 M571 T576 M577	R569-G573 PolarHBondContact O-N 3.44Å; R569-G573 VanDerWaalsContact O-N 3.09Å; V570-G573 PolarHBondContact O-N 2.89Å; M571-G573 PolarHBondContact O-N 2.96Å; G573-T576 PolarHBondContact O-OG1 3.28Å; G573-M577 VanDerWaalsContact O-CB 3.31Å; G573-M577 WeakPolarHBondContact O-CB 3.41Å; G573-M577 PolarHBondContact O-N 3.43Å; G573-M577 VanDerWaalsContact O-N 3.15Å
574	V	93.2	Very high	91.7	Very high	78 Å²	78	54.9 Å²	54.9	47%	0.473	32%	0.315	S	S	.	.	H	α-helix	trans	-73.6	-38.3	178.3	176.3	0	0	0	0	111	V570 M577 L578 L615	V570-V574 HydrophobicContact CG1-CG2 4.23Å; V570-V574 WeakPolarHBondContact O-CB 3.44Å; V570-V574 WeakPolarHBondContact O-CG2 3.34Å; V570-V574 PolarHBondContact O-N 2.99Å; V574-M577 PolarHBondContact O-N 3.48Å; V574-L578 WeakPolarHBondContact O-CB 3.38Å; V574-L578 PolarHBondContact O-N 3.33Å; V574-L615 HydrophobicContact CG2-CD2 4.27Å
575	T	94.5	Very high	92.1	Very high	66 Å²	66	55.1 Å²	55.1	41%	0.405	32%	0.316	S	S	.	.	H	α-helix	trans	-68.6	-39.7	176.8	-64.9	0	0	0	0	112.4	M571 I572 L578 N579	M571-T575 WeakPolarHBondContact O-CB 3.38Å; M571-T575 PolarHBondContact O-N 2.99Å; M571-T575 PolarHBondContact O-OG1 2.96Å; M571-T575 VanDerWaalsContact O-OG1 3.04Å; I572-T575 PolarHBondContact O-N 3.18Å; T575-L578 PolarHBondContact O-N 3.47Å; T575-N579 VanDerWaalsContact O-CB 3.3Å; T575-N579 WeakPolarHBondContact O-CB 3.34Å; T575-N579 PolarHBondContact O-N 2.95Å; T575-N579 PolarHBondContact O-ND2 3.21Å; T575-N579 PolarHBondContact O-OD1 3.02Å
576	T	94.4	Very high	92.1	Very high	10 Å²	10	55.4 Å²	55.4	6%	0.061	32%	0.321	C	S	.	.	H	α-helix	trans	-66.9	-39.4	174.6	53.5	0	0	0	0	111.9	I572 G573 F580	I572-T576 HydrophobicContact CG2-CG2 4.47Å; I572-T576 WeakPolarHBondContact O-CG2 3.36Å; I572-T576 PolarHBondContact O-N 3.42Å; I572-T576 PolarHBondContact O-OG1 2.88Å; G573-T576 PolarHBondContact O-OG1 3.28Å; T576-F580 VanDerWaalsContact O-CB 3.3Å; T576-F580 WeakPolarHBondContact O-CB 3.47Å; T576-F580 PolarHBondContact O-N 2.8Å
577	M	93.4	Very high	91.9	Very high	59 Å²	59	54.7 Å²	54.7	29%	0.291	32%	0.315	S	S	.	.	H	α-helix	trans	-60.3	-49.5	173.5	-175.4	177.5	-178.9	0	0	111.9	G573 V574 F580 F581 I611 Y612 L615	G573-M577 VanDerWaalsContact O-CB 3.31Å; G573-M577 WeakPolarHBondContact O-CB 3.41Å; G573-M577 PolarHBondContact O-N 3.43Å; G573-M577 VanDerWaalsContact O-N 3.15Å; V574-M577 PolarHBondContact O-N 3.48Å; M577-F580 PolarHBondContact O-N 2.83Å; M577-F581 HydrophobicContact CE-CE2 3.72Å; M577-F581 HydrophobicContact CE-CZ 4.45Å; M577-F581 HydrophobicContact CG-CD2 4.04Å; M577-F581 HydrophobicContact CG-CE2 3.75Å; M577-F581 WeakPolarHBondContact O-CD2 3.38Å; M577-F581 PolarHBondContact O-N 2.86Å; M577-F581 VanDerWaalsContact O-N 3.11Å; M577-I611 HydrophobicContact CB-CG2 3.86Å; M577-I611 HydrophobicContact CG-CG2 4.46Å; M577-Y612 HydrophobicContact CE-CD2 4.3Å; M577-L615 HydrophobicContact CB-CD1 4.19Å; M577-L615 HydrophobicContact CG-CD1 4.43Å; M577-L615 HydrophobicContact SD-CD1 3.44Å; M577-L615 WeakPolarHBondContact SD-CD1 3.43Å
578	L	94.1	Very high	91.6	Very high	107 Å²	107	53.5 Å²	53.5	56%	0.56	30%	0.297	S	S	*	.	H	α-helix	trans	-61.6	-48.8	178.3	179.4	60.4	0	0	0	111.7	V574 T575 F580 F581 T582	V574-L578 WeakPolarHBondContact O-CB 3.38Å; V574-L578 PolarHBondContact O-N 3.33Å; T575-L578 PolarHBondContact O-N 3.47Å; L578-F580 VanDerWaalsContact C-N 3.29Å; L578-F580 PolarHBondContact O-N 3.2Å; L578-F581 PolarHBondContact O-N 2.9Å; L578-T582 PolarHBondContact O-N 2.74Å; L578-T582 PolarHBondContact O-OG1 3.37Å
579	N	94.8	Very high	91.2	Very high	71 Å²	71	56.6 Å²	56.6	38%	0.38	32%	0.317	S	S	.	.	H	α-helix	trans	-59.4	-40.7	178.4	-71.5	-8.6	0	0	0	111.6	L551 T575 T582 T583	L551-N579 HydrophobicContact CD1-CB 4.23Å; L551-N579 HydrophobicContact CD2-CB 3.74Å; T575-N579 VanDerWaalsContact O-CB 3.3Å; T575-N579 WeakPolarHBondContact O-CB 3.34Å; T575-N579 PolarHBondContact O-N 2.95Å; T575-N579 PolarHBondContact O-ND2 3.21Å; T575-N579 PolarHBondContact O-OD1 3.02Å; N579-T582 PolarHBondContact O-N 2.78Å; N579-T583 PolarHBondContact O-N 2.86Å; N579-T583 PolarHBondContact O-OG1 2.71Å
580	F	94.6	Very high	90.7	Very high	10 Å²	10	59.7 Å²	59.7	4%	0.044	34%	0.336	C	S	.	.	H	α-helix	trans	-62	-47.1	177.6	-175.1	-93.4	0	0	0	112	L551 T576 M577 L578 T582 T583 S584 C607 M608 I611	L551-F580 HydrophobicContact CD1-CB 4.26Å; L551-F580 HydrophobicContact CD1-CD2 4.4Å; T576-F580 VanDerWaalsContact O-CB 3.3Å; T576-F580 WeakPolarHBondContact O-CB 3.47Å; T576-F580 PolarHBondContact O-N 2.8Å; M577-F580 PolarHBondContact O-N 2.83Å; L578-F580 VanDerWaalsContact C-N 3.29Å; L578-F580 PolarHBondContact O-N 3.2Å; F580-T582 PolarHBondContact O-N 3.39Å; F580-T583 PolarHBondContact O-N 3.44Å; F580-S584 VanDerWaalsContact O-CB 3.31Å; F580-S584 WeakPolarHBondContact O-CB 3.39Å; F580-S584 PolarHBondContact O-N 3.09Å; F580-C607 HydrophobicContact CE1-CB 4.35Å; F580-C607 HydrophobicContact CE2-CB 3.55Å; F580-C607 HydrophobicContact CZ-CB 3.46Å; F580-C607 VanDerWaalsContact CZ-CB 3.46Å; F580-M608 HydrophobicContact CD1-CB 4.49Å; F580-M608 HydrophobicContact CE1-CB 4.05Å; F580-I611 HydrophobicContact CB-CD1 3.71Å; F580-I611 HydrophobicContact CD1-CD1 4.29Å; F580-I611 HydrophobicContact CD2-CD1 3.79Å; F580-I611 HydrophobicContact CG-CD1 3.63Å
581	F	92.1	Very high	90	Very high	73 Å²	73	57.5 Å²	57.5	32%	0.32	32%	0.322	S	S	.	.	H	α-helix	trans	-62.3	-40.6	173.7	-77.7	-65.1	0	0	0	112.5	M577 L578 N585 M608	M577-F581 HydrophobicContact CE-CE2 3.72Å; M577-F581 HydrophobicContact CE-CZ 4.45Å; M577-F581 HydrophobicContact CG-CD2 4.04Å; M577-F581 HydrophobicContact CG-CE2 3.75Å; M577-F581 WeakPolarHBondContact O-CD2 3.38Å; M577-F581 PolarHBondContact O-N 2.86Å; M577-F581 VanDerWaalsContact O-N 3.11Å; L578-F581 PolarHBondContact O-N 2.9Å; F581-N585 WeakPolarHBondContact O-CB 3.48Å; F581-N585 VanDerWaalsContact O-CG 3.23Å; F581-N585 PolarHBondContact O-N 2.96Å; F581-N585 PolarHBondContact O-ND2 3.2Å; F581-M608 HydrophobicContact CE1-CG 4.29Å; F581-M608 HydrophobicContact CE1-SD 3.64Å; F581-M608 HydrophobicContact CZ-CG 3.85Å; F581-M608 HydrophobicContact CZ-SD 3.49Å; F581-M608 WeakPolarHBondContact CZ-SD 3.28Å
582	T	93	Very high	88.9	Confident	85 Å²	85	54.5 Å²	54.5	52%	0.521	31%	0.311	S	S	.	.	H	α-helix	trans	-62.8	-45.4	177.7	-58.2	0	0	0	0	111.7	L578 N579 F580 G586	L578-T582 PolarHBondContact O-N 2.74Å; L578-T582 PolarHBondContact O-OG1 3.37Å; N579-T582 PolarHBondContact O-N 2.78Å; F580-T582 PolarHBondContact O-N 3.39Å; T582-G586 PolarHBondContact O-N 3.11Å
583	T	91.3	Very high	87.6	Confident	62 Å²	62	59.9 Å²	59.9	38%	0.38	35%	0.346	S	S	.	.	H	α-helix	trans	-68.7	-46.9	178.3	-62.2	0	0	0	0	112.1	N579 F580 G586 F587	N579-T583 PolarHBondContact O-N 2.86Å; N579-T583 PolarHBondContact O-OG1 2.71Å; F580-T583 PolarHBondContact O-N 3.44Å; T583-G586 PolarHBondContact O-N 2.94Å; T583-F587 WeakPolarHBondContact O-CB 3.43Å; T583-F587 PolarHBondContact O-N 2.64Å
584	S	89.8	Confident	86.4	Confident	13 Å²	13	62.2 Å²	62.2	9%	0.091	36%	0.36	C	S	.	.	H	α-helix	trans	-62.9	-46.5	179.1	176.6	0	0	0	0	111.7	F580 F587 R588 D604	F580-S584 VanDerWaalsContact O-CB 3.31Å; F580-S584 WeakPolarHBondContact O-CB 3.39Å; F580-S584 PolarHBondContact O-N 3.09Å; S584-F587 PolarHBondContact O-N 2.66Å; S584-R588 WeakPolarHBondContact O-CB 3.34Å; S584-R588 VanDerWaalsContact O-CG 3.25Å; S584-R588 WeakPolarHBondContact O-CG 3.39Å; S584-R588 PolarHBondContact O-N 3.4Å; S584-D604 PolarHBondContact OG-OD1 3.41Å; S584-D604 PolarHBondContact OG-OD2 3.09Å
585	N	88.6	Confident	84.8	Confident	95 Å²	95	63.2 Å²	63.2	51%	0.508	37%	0.371	S	S	.	.	H	α-helix	trans	-67.8	-36.6	177	-69.4	-24.7	0	0	0	112.5	F581 R588 S589	F581-N585 WeakPolarHBondContact O-CB 3.48Å; F581-N585 VanDerWaalsContact O-CG 3.23Å; F581-N585 PolarHBondContact O-N 2.96Å; F581-N585 PolarHBondContact O-ND2 3.2Å; N585-R588 PolarHBondContact O-N 2.85Å; N585-S589 PolarHBondContact O-N 3.19Å
586	G	87.8	Confident	83.8	Confident	35 Å²	35	63.8 Å²	63.8	36%	0.361	37%	0.371	S	S	.	.	H	α-helix	trans	-59	-50.4	173.9	0	0	0	0	0	111.5	T582 T583 S589	T582-G586 PolarHBondContact O-N 3.11Å; T583-G586 PolarHBondContact O-N 2.94Å; G586-S589 PolarHBondContact O-N 3.41Å; G586-S589 PolarHBondContact O-OG 3.24Å
587	F	84.9	Confident	83.1	Confident	22 Å²	22	63.9 Å²	63.9	10%	0.096	37%	0.372	C	S	.	.	H	α-helix	trans	-63.4	-42.9	175.2	173.7	-112.1	0	0	0	113	F462 Y540 V544 T583 S584 S589 T590 L591 M600	F462-F587 HydrophobicContact CE1-CZ 4.19Å; Y540-F587 AromaticContact CD1-CE2 3.89Å; Y540-F587 HydrophobicContact CD1-CE2 3.89Å; Y540-F587 AromaticContact CD1-CZ 3.76Å; Y540-F587 HydrophobicContact CD1-CZ 3.76Å; Y540-F587 AromaticContact CE1-CE2 3.59Å; Y540-F587 HydrophobicContact CE1-CE2 3.59Å; Y540-F587 AromaticContact CE1-CZ 3.57Å; Y540-F587 HydrophobicContact CE1-CZ 3.57Å; V544-F587 HydrophobicContact CG1-CD1 4.33Å; V544-F587 HydrophobicContact CG1-CE1 4.37Å; V544-F587 HydrophobicContact CG2-CD1 4.07Å; V544-F587 HydrophobicContact CG2-CD2 3.59Å; V544-F587 HydrophobicContact CG2-CE1 4.07Å; V544-F587 HydrophobicContact CG2-CE2 3.6Å; V544-F587 HydrophobicContact CG2-CG 3.83Å; V544-F587 HydrophobicContact CG2-CZ 3.84Å; T583-F587 WeakPolarHBondContact O-CB 3.43Å; T583-F587 PolarHBondContact O-N 2.64Å; S584-F587 PolarHBondContact O-N 2.66Å; F587-S589 PolarHBondContact O-N 2.9Å; F587-T590 PolarHBondContact O-N 3.36Å; F587-T590 PolarHBondContact O-OG1 2.96Å; F587-T590 VanDerWaalsContact O-OG1 3.11Å; F587-L591 HydrophobicContact CD1-CD1 4.15Å; F587-L591 HydrophobicContact CE1-CD1 3.61Å; F587-L591 HydrophobicContact CZ-CD1 3.81Å; F587-L591 HydrophobicContact CZ-CD2 4.46Å; F587-L591 HydrophobicContact CZ-CG 4.35Å; F587-M600 HydrophobicContact CE1-CE 3.72Å; F587-M600 HydrophobicContact CE1-CG 4.41Å; F587-M600 HydrophobicContact CE1-SD 4.3Å; F587-M600 HydrophobicContact CZ-CE 3.71Å
588	R	83.9	Confident	82.7	Confident	81 Å²	81	63.7 Å²	63.7	31%	0.306	37%	0.374	S	S	.	.	H	α-helix	trans	-61.7	-24.2	175.4	-75.2	171.8	175.2	-82.6	-9.1	113.4	S584 N585 T590 L591 M600 N601 D604	S584-R588 WeakPolarHBondContact O-CB 3.34Å; S584-R588 VanDerWaalsContact O-CG 3.25Å; S584-R588 WeakPolarHBondContact O-CG 3.39Å; S584-R588 PolarHBondContact O-N 3.4Å; N585-R588 PolarHBondContact O-N 2.85Å; R588-T590 VanDerWaalsContact C-N 3.34Å; R588-L591 PolarHBondContact O-N 2.99Å; R588-M600 PolarHBondContact NH2-O 3.3Å; R588-N601 VanDerWaalsContact CZ-OD1 3.31Å; R588-N601 PolarHBondContact NH1-OD1 3.12Å; R588-N601 PolarHBondContact NH2-OD1 3.44Å; R588-D604 IonicContact CZ-OD2 2.71Å; R588-D604 IonicContact NE-OD2 2.69Å; R588-D604 PolarHBondContact NE-OD2 3.34Å; R588-D604 IonicContact NH2-OD2 2.8Å; R588-D604 PolarHBondContact NH2-OD2 3.45Å
589	S	84.3	Confident	82.5	Confident	96 Å²	96	58.6 Å²	58.6	67%	0.671	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.6	-17.6	174.8	78.3	0	0	0	0	114.4	N585 G586 F587	N585-S589 PolarHBondContact O-N 3.19Å; G586-S589 PolarHBondContact O-N 3.41Å; G586-S589 PolarHBondContact O-OG 3.24Å; F587-S589 PolarHBondContact O-N 2.9Å
590	T	80.6	Confident	82.3	Confident	66 Å²	66	55.4 Å²	55.4	41%	0.405	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.7	-5.2	174.2	78.6	0	0	0	0	113	S372 F587 R588	S372-T590 WeakPolarHBondContact CB-O 3.42Å; S372-T590 WeakPolarHBondContact CB-OG1 3.38Å; S372-T590 WeakPolarHBondContact OG-CB 3.44Å; S372-T590 PolarHBondContact OG-O 2.88Å; S372-T590 PolarHBondContact OG-OG1 2.84Å; F587-T590 PolarHBondContact O-N 3.36Å; F587-T590 PolarHBondContact O-OG1 2.96Å; F587-T590 VanDerWaalsContact O-OG1 3.11Å; R588-T590 VanDerWaalsContact C-N 3.34Å
591	L	77.9	Confident	82.1	Confident	14 Å²	14	58 Å²	58	7%	0.073	34%	0.344	C	S	.	.	S	Bend	trans	-93.5	142.8	174	-68.1	167.7	0	0	0	110.1	F462 F587 R588 L597	F462-L591 HydrophobicContact CE1-CD1 4.23Å; F462-L591 HydrophobicContact CE1-CD2 3.58Å; F462-L591 HydrophobicContact CE2-CD2 4.18Å; F462-L591 HydrophobicContact CZ-CD2 3.31Å; F587-L591 HydrophobicContact CD1-CD1 4.15Å; F587-L591 HydrophobicContact CE1-CD1 3.61Å; F587-L591 HydrophobicContact CZ-CD1 3.81Å; F587-L591 HydrophobicContact CZ-CD2 4.46Å; F587-L591 HydrophobicContact CZ-CG 4.35Å; R588-L591 PolarHBondContact O-N 2.99Å; L591-L597 HydrophobicContact CB-CD1 4.48Å; L591-L597 HydrophobicContact CD1-CD1 4.01Å
592	P	69.6	Low	82.1	Confident	56 Å²	56	57.2 Å²	57.2	36%	0.364	35%	0.345	S	S	.	.			trans	-61.9	148	169	27.3	-32.8	0	0	0	110.1	L374 V594	L374-P592 HydrophobicContact CD1-CG 3.67Å; L374-P592 HydrophobicContact CG-CG 3.84Å; P592-V594 VanDerWaalsContact C-N 3.28Å; P592-V594 HydrophobicContact CB-CG2 4.15Å; P592-V594 HydrophobicContact CG-CG2 4.17Å; P592-V594 PolarHBondContact O-N 2.92Å
593	V	66.2	Low	82.2	Confident	158 Å²	158	53.2 Å²	53.2	96%	0.958	32%	0.321	S	S	*	.	S	Bend	trans	-71.8	81.5	-176.2	-172.4	0	0	0	0	110.5
594	V	64.9	Low	82.3	Confident	49 Å²	49	51 Å²	51	30%	0.297	31%	0.307	S	S	.	.			trans	-124.7	124.6	-179.1	-167.3	0	0	0	0	110.1	L374 L459 P592 N596	L374-V594 HydrophobicContact CD1-CG2 4.47Å; L459-V594 HydrophobicContact CD1-CB 4.36Å; L459-V594 HydrophobicContact CD1-CG1 3.61Å; P592-V594 VanDerWaalsContact C-N 3.28Å; P592-V594 HydrophobicContact CB-CG2 4.15Å; P592-V594 HydrophobicContact CG-CG2 4.17Å; P592-V594 PolarHBondContact O-N 2.92Å; V594-N596 HydrophobicContact CG1-CB 4.42Å; V594-N596 PolarHBondContact O-N 3.27Å
595	S	59.7	Low	82.4	Confident	100 Å²	100	52 Å²	52	70%	0.699	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-20.6	-175.4	48.9	0	0	0	0	114.7	L597	S595-L597 VanDerWaalsContact C-N 3.3Å; S595-L597 PolarHBondContact O-N 3.22Å
596	N	72.9	Confident	82.8	Confident	77 Å²	77	49.5 Å²	49.5	41%	0.412	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.6	11.7	-165.2	-63.6	-13.4	0	0	0	115.1	L459 H460 V594 T598	L459-N596 CarbonylContact C-O 3.29Å; L459-N596 VanDerWaalsContact C-O 3.29Å; L459-N596 HydrophobicContact CB-CB 4.22Å; L459-N596 HydrophobicContact CD1-CB 4.47Å; H460-N596 PolarHBondContact N-O 3.29Å; H460-N596 PolarHBondContact ND1-O 3.32Å; V594-N596 HydrophobicContact CG1-CB 4.42Å; V594-N596 PolarHBondContact O-N 3.27Å; N596-T598 PolarHBondContact O-N 3.22Å; N596-T598 PolarHBondContact O-OG1 3.16Å
597	L	80.8	Confident	83.2	Confident	13 Å²	13	47.9 Å²	47.9	7%	0.068	29%	0.29	C	S	.	.			trans	-74.5	58.9	-179	-65.5	170	0	0	0	112.8	L459 F462 L591 S595 A599 M600 N601	L459-L597 HydrophobicContact CD2-CD2 4.39Å; F462-L597 HydrophobicContact CB-CD2 3.87Å; F462-L597 HydrophobicContact CD1-CD2 3.77Å; F462-L597 HydrophobicContact CD2-CD2 4.35Å; F462-L597 HydrophobicContact CE1-CD2 4.46Å; F462-L597 HydrophobicContact CG-CD2 3.73Å; L591-L597 HydrophobicContact CB-CD1 4.48Å; L591-L597 HydrophobicContact CD1-CD1 4.01Å; S595-L597 VanDerWaalsContact C-N 3.3Å; S595-L597 PolarHBondContact O-N 3.22Å; L597-A599 PolarHBondContact O-N 3.34Å; L597-M600 PolarHBondContact O-N 3.08Å; L597-N601 WeakPolarHBondContact O-CB 3.4Å; L597-N601 PolarHBondContact O-N 3.19Å; L597-N601 PolarHBondContact O-ND2 2.95Å
598	T	85.4	Confident	83.6	Confident	55 Å²	55	50.7 Å²	50.7	34%	0.337	30%	0.304	S	S	.	.	H	α-helix	trans	-59.8	-48.8	-166.9	-51.7	0	0	0	0	113.1	H460 N596 M600 N601 V602	H460-T598 PolarHBondContact ND1-OG1 3.17Å; N596-T598 PolarHBondContact O-N 3.22Å; N596-T598 PolarHBondContact O-OG1 3.16Å; T598-M600 PolarHBondContact O-N 2.89Å; T598-N601 PolarHBondContact O-N 2.94Å; T598-V602 WeakPolarHBondContact O-CG2 3.31Å; T598-V602 PolarHBondContact O-N 2.65Å
599	A	90.1	Very high	84.2	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-59.1	-47.9	179	0	0	0	0	0	113	H460 L597 N601 V602 W603 F747 Y751	H460-A599 WeakPolarHBondContact O-CB 3.25Å; H460-A599 PolarHBondContact O-N 3.18Å; L597-A599 PolarHBondContact O-N 3.34Å; A599-N601 PolarHBondContact O-N 3Å; A599-V602 PolarHBondContact O-N 3.42Å; A599-W603 PolarHBondContact O-N 3.49Å; A599-F747 HydrophobicContact CB-CZ 4.48Å; A599-F747 WeakPolarHBondContact O-CE2 3.42Å; A599-Y751 HydrophobicContact CB-CD1 3.72Å; A599-Y751 HydrophobicContact CB-CD2 4.12Å; A599-Y751 HydrophobicContact CB-CE1 3.64Å; A599-Y751 HydrophobicContact CB-CE2 4.04Å; A599-Y751 HydrophobicContact CB-CG 3.97Å
600	M	89.4	Confident	84.7	Confident	3 Å²	3	47.5 Å²	47.5	2%	0.015	29%	0.289	C	S	.	.	H	α-helix	trans	-67	-35	177.2	-70.2	-56.8	-158	0	0	112.9	F462 P463 Y540 V544 F545 F587 R588 L597 T598 W603 D604	F462-M600 HydrophobicContact CD1-CE 4.4Å; F462-M600 HydrophobicContact CD1-CG 3.88Å; F462-M600 HydrophobicContact CE1-CE 4.23Å; F462-M600 HydrophobicContact CE1-CG 4.33Å; P463-M600 HydrophobicContact CB-CE 4.3Å; P463-M600 HydrophobicContact CG-CE 3.67Å; Y540-M600 HydrophobicContact CD1-CE 3.93Å; V544-M600 HydrophobicContact CG1-CE 4.35Å; F545-M600 HydrophobicContact CE1-SD 4.2Å; F545-M600 HydrophobicContact CE2-CE 4.27Å; F545-M600 HydrophobicContact CZ-CE 3.86Å; F545-M600 HydrophobicContact CZ-SD 3.92Å; F587-M600 HydrophobicContact CE1-CE 3.72Å; F587-M600 HydrophobicContact CE1-CG 4.41Å; F587-M600 HydrophobicContact CE1-SD 4.3Å; F587-M600 HydrophobicContact CZ-CE 3.71Å; R588-M600 PolarHBondContact NH2-O 3.3Å; L597-M600 PolarHBondContact O-N 3.08Å; T598-M600 PolarHBondContact O-N 2.89Å; M600-W603 PolarHBondContact O-N 2.98Å; M600-D604 WeakPolarHBondContact O-CB 3.42Å; M600-D604 PolarHBondContact O-N 3.12Å
601	N	90.4	Very high	85.5	Confident	65 Å²	65	44.5 Å²	44.5	35%	0.348	27%	0.27	S	S	.	.	H	α-helix	trans	-66	-37.5	174.2	-68.2	-16	0	0	0	112	R588 L597 T598 A599 G605	R588-N601 VanDerWaalsContact CZ-OD1 3.31Å; R588-N601 PolarHBondContact NH1-OD1 3.12Å; R588-N601 PolarHBondContact NH2-OD1 3.44Å; L597-N601 WeakPolarHBondContact O-CB 3.4Å; L597-N601 PolarHBondContact O-N 3.19Å; L597-N601 PolarHBondContact O-ND2 2.95Å; T598-N601 PolarHBondContact O-N 2.94Å; A599-N601 PolarHBondContact O-N 3Å; N601-G605 PolarHBondContact O-N 2.86Å
602	V	92.6	Very high	86.2	Confident	56 Å²	56	49.7 Å²	49.7	34%	0.339	29%	0.29	S	S	.	.	H	α-helix	trans	-68.5	-44	173.2	169.5	0	0	0	0	111.3	T598 A599 V606 F747	T598-V602 WeakPolarHBondContact O-CG2 3.31Å; T598-V602 PolarHBondContact O-N 2.65Å; A599-V602 PolarHBondContact O-N 3.42Å; V602-V606 HydrophobicContact CG1-CG2 4.45Å; V602-V606 WeakPolarHBondContact O-CB 3.36Å; V602-V606 WeakPolarHBondContact O-CG2 3.2Å; V602-V606 PolarHBondContact O-N 3.17Å; V602-F747 HydrophobicContact CG1-CD2 4.45Å; V602-F747 HydrophobicContact CG1-CE2 4.48Å
603	W	94.2	Very high	87.4	Confident	2 Å²	2	48.4 Å²	48.4	1%	0.008	28%	0.284	C	S	.	.	H	α-helix	trans	-56.1	-54.5	176.1	176.6	-96.2	0	0	0	111.9	F545 I549 A599 M600 V606 C607 F743 L744 F747 F748	F545-W603 HydrophobicContact CB-CZ2 4.38Å; F545-W603 AromaticContact CD1-CD2 3.66Å; F545-W603 HydrophobicContact CD1-CD2 3.66Å; F545-W603 AromaticContact CD1-CE2 3.6Å; F545-W603 AromaticContact CD1-CE3 3.8Å; F545-W603 HydrophobicContact CD1-CE3 3.8Å; F545-W603 HydrophobicContact CD1-CG 4.31Å; F545-W603 AromaticContact CD1-CH2 3.86Å; F545-W603 HydrophobicContact CD1-CH2 3.86Å; F545-W603 AromaticContact CD1-CZ2 3.72Å; F545-W603 HydrophobicContact CD1-CZ2 3.72Å; F545-W603 AromaticContact CD1-CZ3 3.89Å; F545-W603 HydrophobicContact CD1-CZ3 3.89Å; F545-W603 AromaticContact CE1-CD2 3.72Å; F545-W603 HydrophobicContact CE1-CD2 3.72Å; F545-W603 AromaticContact CE1-CE3 3.88Å; F545-W603 HydrophobicContact CE1-CE3 3.88Å; F545-W603 HydrophobicContact CE1-CG 4Å; F545-W603 HydrophobicContact CE1-CZ3 4.37Å; I549-W603 HydrophobicContact CD1-CH2 4.15Å; I549-W603 HydrophobicContact CG1-CH2 3.8Å; I549-W603 HydrophobicContact CG1-CZ2 4.18Å; A599-W603 PolarHBondContact O-N 3.49Å; M600-W603 PolarHBondContact O-N 2.98Å; W603-V606 PolarHBondContact O-N 3.43Å; W603-C607 WeakPolarHBondContact O-CB 3.34Å; W603-C607 PolarHBondContact O-N 3.01Å; W603-C607 PolarHBondContact O-SG 3.05Å; W603-F743 AromaticContact CE3-CE1 4Å; W603-F743 HydrophobicContact CE3-CE1 4Å; W603-F743 HydrophobicContact CE3-CZ 4.12Å; W603-F743 HydrophobicContact CZ3-CE1 4.04Å; W603-L744 HydrophobicContact CH2-CD2 3.49Å; W603-L744 VanDerWaalsContact CH2-CD2 3.49Å; W603-L744 HydrophobicContact CZ3-CD2 3.52Å; W603-F747 HydrophobicContact CB-CE2 3.85Å; W603-F747 HydrophobicContact CB-CZ 3.84Å; W603-F747 HydrophobicContact CD2-CZ 4.46Å; W603-F747 AromaticContact CE3-CD1 3.76Å; W603-F747 HydrophobicContact CE3-CD1 3.76Å; W603-F747 HydrophobicContact CE3-CD2 4.26Å; W603-F747 AromaticContact CE3-CE1 3.67Å; W603-F747 HydrophobicContact CE3-CE1 3.67Å; W603-F747 HydrophobicContact CE3-CE2 4.18Å; W603-F747 HydrophobicContact CE3-CG 4.07Å; W603-F747 AromaticContact CE3-CZ 3.91Å; W603-F747 HydrophobicContact CE3-CZ 3.91Å; W603-F747 HydrophobicContact CG-CZ 4.46Å; W603-F747 HydrophobicContact CZ3-CD1 4.02Å; W603-F747 HydrophobicContact CZ3-CE1 4.26Å; W603-F747 HydrophobicContact CZ3-CG 4.46Å; W603-F748 HydrophobicContact CH2-CZ 4.24Å; W603-F748 HydrophobicContact CZ3-CE2 4.21Å; W603-F748 AromaticContact CZ3-CZ 3.92Å; W603-F748 HydrophobicContact CZ3-CZ 3.92Å
604	D	93.4	Very high	88.7	Confident	16 Å²	16	41 Å²	41	9%	0.086	24%	0.239	C	C	.	.	H	α-helix	trans	-64.4	-44.8	-177.9	-77.7	-29.5	0	0	0	111.8	S584 R588 M600 V606 C607 M608	S584-D604 PolarHBondContact OG-OD1 3.41Å; S584-D604 PolarHBondContact OG-OD2 3.09Å; R588-D604 IonicContact CZ-OD2 2.71Å; R588-D604 IonicContact NE-OD2 2.69Å; R588-D604 PolarHBondContact NE-OD2 3.34Å; R588-D604 IonicContact NH2-OD2 2.8Å; R588-D604 PolarHBondContact NH2-OD2 3.45Å; M600-D604 WeakPolarHBondContact O-CB 3.42Å; M600-D604 PolarHBondContact O-N 3.12Å; D604-V606 PolarHBondContact O-N 3.36Å; D604-C607 PolarHBondContact O-N 3.29Å; D604-M608 WeakPolarHBondContact O-CB 3.39Å; D604-M608 PolarHBondContact O-N 3.24Å
605	G	93.7	Very high	90	Very high	33 Å²	33	39.8 Å²	39.8	34%	0.34	23%	0.231	S	C	.	.	H	α-helix	trans	-60.5	-42.7	179.6	0	0	0	0	0	113	N601 C609	N601-G605 PolarHBondContact O-N 2.86Å; G605-C609 VanDerWaalsContact O-CB 3.28Å; G605-C609 WeakPolarHBondContact O-CB 3.41Å; G605-C609 PolarHBondContact O-N 2.82Å
606	V	95.8	Very high	91.6	Very high	43 Å²	43	38.7 Å²	38.7	26%	0.261	22%	0.217	S	C	.	.	H	α-helix	trans	-72.9	-43.2	178.6	175.8	0	0	0	0	111.6	V602 W603 D604 M608 C609 F610 F743	V602-V606 HydrophobicContact CG1-CG2 4.45Å; V602-V606 WeakPolarHBondContact O-CB 3.36Å; V602-V606 WeakPolarHBondContact O-CG2 3.2Å; V602-V606 PolarHBondContact O-N 3.17Å; W603-V606 PolarHBondContact O-N 3.43Å; D604-V606 PolarHBondContact O-N 3.36Å; V606-M608 PolarHBondContact O-N 3.03Å; V606-C609 WeakPolarHBondContact O-CB 3.16Å; V606-C609 PolarHBondContact O-N 3.27Å; V606-F610 HydrophobicContact CG1-CD2 3.74Å; V606-F610 HydrophobicContact CG1-CE2 3.64Å; V606-F610 WeakPolarHBondContact O-CD2 3.26Å; V606-F610 PolarHBondContact O-N 3.23Å; V606-F743 HydrophobicContact CB-CD2 4.32Å; V606-F743 HydrophobicContact CB-CE1 4.17Å; V606-F743 HydrophobicContact CB-CE2 3.81Å; V606-F743 HydrophobicContact CB-CZ 3.73Å; V606-F743 HydrophobicContact CG1-CD1 3.8Å; V606-F743 HydrophobicContact CG1-CD2 3.69Å; V606-F743 HydrophobicContact CG1-CE1 3.8Å; V606-F743 HydrophobicContact CG1-CE2 3.69Å; V606-F743 HydrophobicContact CG1-CG 3.74Å; V606-F743 HydrophobicContact CG1-CZ 3.75Å; V606-F743 HydrophobicContact CG2-CD2 4.35Å; V606-F743 HydrophobicContact CG2-CE2 3.84Å; V606-F743 HydrophobicContact CG2-CZ 4.22Å
607	C	95.6	Very high	92.6	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-63.3	-42.8	177.3	-67	0	0	0	0	111.9	V552 F580 W603 D604 C609 F610 I611	V552-C607 HydrophobicContact CG2-CB 3.71Å; F580-C607 HydrophobicContact CE1-CB 4.35Å; F580-C607 HydrophobicContact CE2-CB 3.55Å; F580-C607 HydrophobicContact CZ-CB 3.46Å; F580-C607 VanDerWaalsContact CZ-CB 3.46Å; W603-C607 WeakPolarHBondContact O-CB 3.34Å; W603-C607 PolarHBondContact O-N 3.01Å; W603-C607 PolarHBondContact O-SG 3.05Å; D604-C607 PolarHBondContact O-N 3.29Å; C607-C609 VanDerWaalsContact C-N 3.32Å; C607-C609 PolarHBondContact O-N 3.26Å; C607-F610 PolarHBondContact O-N 3.38Å; C607-I611 WeakPolarHBondContact O-CG1 3.35Å; C607-I611 PolarHBondContact O-N 2.7Å; C607-I611 VanDerWaalsContact O-N 3.09Å
608	M	94.3	Very high	93.1	Very high	81 Å²	81	36 Å²	36	40%	0.399	20%	0.201	S	C	.	.	H	α-helix	trans	-59.7	-41.8	172.3	-172.2	-170.7	77.9	0	0	111.5	F580 F581 D604 V606 I611 Y612	F580-M608 HydrophobicContact CD1-CB 4.49Å; F580-M608 HydrophobicContact CE1-CB 4.05Å; F581-M608 HydrophobicContact CE1-CG 4.29Å; F581-M608 HydrophobicContact CE1-SD 3.64Å; F581-M608 HydrophobicContact CZ-CG 3.85Å; F581-M608 HydrophobicContact CZ-SD 3.49Å; F581-M608 WeakPolarHBondContact CZ-SD 3.28Å; D604-M608 WeakPolarHBondContact O-CB 3.39Å; D604-M608 PolarHBondContact O-N 3.24Å; V606-M608 PolarHBondContact O-N 3.03Å; M608-I611 PolarHBondContact O-N 3.35Å; M608-Y612 VanDerWaalsContact O-CB 3.3Å; M608-Y612 WeakPolarHBondContact O-CB 3.5Å; M608-Y612 PolarHBondContact O-N 3.11Å
609	C	95.5	Very high	93.3	Very high	76 Å²	76	37.3 Å²	37.3	51%	0.514	21%	0.209	S	C	.	.	H	α-helix	trans	-61.6	-45.3	177.2	-171.7	0	0	0	0	112.1	G605 V606 C607 Y612 A613	G605-C609 VanDerWaalsContact O-CB 3.28Å; G605-C609 WeakPolarHBondContact O-CB 3.41Å; G605-C609 PolarHBondContact O-N 2.82Å; V606-C609 WeakPolarHBondContact O-CB 3.16Å; V606-C609 PolarHBondContact O-N 3.27Å; C607-C609 VanDerWaalsContact C-N 3.32Å; C607-C609 PolarHBondContact O-N 3.26Å; C609-Y612 PolarHBondContact O-N 3.25Å; C609-A613 WeakPolarHBondContact O-CB 3.17Å; C609-A613 PolarHBondContact O-N 3.43Å
610	F	96.4	Very high	93.3	Very high	35 Å²	35	40.5 Å²	40.5	15%	0.154	23%	0.23	C	C	.	.	H	α-helix	trans	-62.8	-43.6	176.4	-86	-74.5	0	0	0	112.7	V552 F556 V606 C607 A613 S614 F736 A739 Y740 F743	V552-F610 HydrophobicContact CG1-CB 3.93Å; F556-F610 HydrophobicContact CE1-CB 4.45Å; F556-F610 HydrophobicContact CE1-CD1 4.41Å; F556-F610 HydrophobicContact CZ-CB 4.5Å; F556-F610 HydrophobicContact CZ-CD1 4.15Å; V606-F610 HydrophobicContact CG1-CD2 3.74Å; V606-F610 HydrophobicContact CG1-CE2 3.64Å; V606-F610 WeakPolarHBondContact O-CD2 3.26Å; V606-F610 PolarHBondContact O-N 3.23Å; C607-F610 PolarHBondContact O-N 3.38Å; F610-A613 PolarHBondContact O-N 3.44Å; F610-S614 PolarHBondContact O-N 3.46Å; F610-F736 HydrophobicContact CD1-CD1 4.08Å; F610-A739 HydrophobicContact CE1-CB 3.99Å; F610-A739 HydrophobicContact CZ-CB 3.93Å; F610-Y740 AromaticContact CD2-CD2 3.65Å; F610-Y740 HydrophobicContact CD2-CD2 3.65Å; F610-Y740 HydrophobicContact CD2-CE2 4.33Å; F610-Y740 AromaticContact CE2-CD2 3.76Å; F610-Y740 HydrophobicContact CE2-CD2 3.76Å; F610-Y740 HydrophobicContact CG-CD2 4.19Å; F610-Y740 HydrophobicContact CZ-CD2 4.37Å; F610-F743 HydrophobicContact CE2-CB 4.5Å
611	I	95.7	Very high	93.3	Very high	2 Å²	2	40.4 Å²	40.4	1%	0.01	23%	0.23	C	C	.	.	H	α-helix	trans	-64.8	-46.4	178.1	-65.8	166.1	0	0	0	110.3	V552 M577 F580 C607 M608 A613 S614 L615	V552-I611 HydrophobicContact CB-CG1 4.49Å; V552-I611 HydrophobicContact CG2-CD1 3.92Å; V552-I611 HydrophobicContact CG2-CG1 4.02Å; M577-I611 HydrophobicContact CB-CG2 3.86Å; M577-I611 HydrophobicContact CG-CG2 4.46Å; F580-I611 HydrophobicContact CB-CD1 3.71Å; F580-I611 HydrophobicContact CD1-CD1 4.29Å; F580-I611 HydrophobicContact CD2-CD1 3.79Å; F580-I611 HydrophobicContact CG-CD1 3.63Å; C607-I611 WeakPolarHBondContact O-CG1 3.35Å; C607-I611 PolarHBondContact O-N 2.7Å; C607-I611 VanDerWaalsContact O-N 3.09Å; M608-I611 PolarHBondContact O-N 3.35Å; I611-A613 PolarHBondContact O-N 3.04Å; I611-S614 WeakPolarHBondContact O-CB 3.5Å; I611-S614 PolarHBondContact O-N 2.94Å; I611-S614 VanDerWaalsContact O-N 3.16Å; I611-S614 PolarHBondContact O-OG 3.48Å; I611-L615 PolarHBondContact O-N 3.15Å
612	Y	94.4	Very high	93.1	Very high	124 Å²	124	38.1 Å²	38.1	49%	0.486	22%	0.218	S	C	.	.	H	α-helix	trans	-64.3	-38.3	177.5	-176.3	-110.9	0	0	0	112.6	M577 M608 C609 S614 L615 L616	M577-Y612 HydrophobicContact CE-CD2 4.3Å; M608-Y612 VanDerWaalsContact O-CB 3.3Å; M608-Y612 WeakPolarHBondContact O-CB 3.5Å; M608-Y612 PolarHBondContact O-N 3.11Å; C609-Y612 PolarHBondContact O-N 3.25Å; Y612-S614 VanDerWaalsContact C-N 3.3Å; Y612-S614 PolarHBondContact O-N 3.36Å; Y612-L615 WeakPolarHBondContact O-CB 3.26Å; Y612-L615 PolarHBondContact O-N 3.26Å; Y612-L615 VanDerWaalsContact O-N 3.17Å; Y612-L616 HydrophobicContact CD1-CD1 3.97Å; Y612-L616 HydrophobicContact CD1-CG 4.3Å; Y612-L616 HydrophobicContact CE1-CD1 3.57Å; Y612-L616 HydrophobicContact CE1-CD2 4.33Å; Y612-L616 HydrophobicContact CE1-CG 3.94Å; Y612-L616 PolarHBondContact O-N 3.48Å
613	A	94.8	Very high	92.9	Very high	29 Å²	29	42.3 Å²	42.3	24%	0.24	23%	0.229	C	C	.	.	H	α-helix	trans	-64.8	-30.9	174.1	0	0	0	0	0	112.7	C609 F610 I611 L616 E617 F736	C609-A613 WeakPolarHBondContact O-CB 3.17Å; C609-A613 PolarHBondContact O-N 3.43Å; F610-A613 PolarHBondContact O-N 3.44Å; I611-A613 PolarHBondContact O-N 3.04Å; A613-L616 PolarHBondContact O-N 3.17Å; A613-E617 WeakPolarHBondContact O-CB 3.42Å; A613-E617 PolarHBondContact O-N 2.93Å; A613-F736 HydrophobicContact CB-CE1 3.66Å; A613-F736 HydrophobicContact CB-CZ 4.02Å
614	S	93.6	Very high	92.5	Very high	1 Å²	1	43.9 Å²	43.9	1%	0.007	24%	0.238	C	C	.	.	H	α-helix	trans	-67.5	-36.1	171.9	81.4	0	0	0	0	112.6	S555 F610 I611 Y612 E617 F618	S555-S614 WeakPolarHBondContact CB-OG 3.21Å; F610-S614 PolarHBondContact O-N 3.46Å; I611-S614 WeakPolarHBondContact O-CB 3.5Å; I611-S614 PolarHBondContact O-N 2.94Å; I611-S614 VanDerWaalsContact O-N 3.16Å; I611-S614 PolarHBondContact O-OG 3.48Å; Y612-S614 VanDerWaalsContact C-N 3.3Å; Y612-S614 PolarHBondContact O-N 3.36Å; S614-E617 PolarHBondContact O-N 2.9Å; S614-F618 PolarHBondContact O-N 2.94Å; S614-F618 VanDerWaalsContact O-N 3.15Å
615	L	92.3	Very high	91.9	Very high	24 Å²	24	43.6 Å²	43.6	13%	0.126	24%	0.24	C	C	.	.	H	α-helix	trans	-68.6	-40.4	173.2	-80.7	167.3	0	0	0	111.8	V574 M577 I611 Y612 F618 V619	V574-L615 HydrophobicContact CG2-CD2 4.27Å; M577-L615 HydrophobicContact CB-CD1 4.19Å; M577-L615 HydrophobicContact CG-CD1 4.43Å; M577-L615 HydrophobicContact SD-CD1 3.44Å; M577-L615 WeakPolarHBondContact SD-CD1 3.43Å; I611-L615 PolarHBondContact O-N 3.15Å; Y612-L615 WeakPolarHBondContact O-CB 3.26Å; Y612-L615 PolarHBondContact O-N 3.26Å; Y612-L615 VanDerWaalsContact O-N 3.17Å; L615-F618 PolarHBondContact O-N 3.38Å; L615-V619 WeakPolarHBondContact O-CG2 3.35Å; L615-V619 PolarHBondContact O-N 3.24Å
616	L	92.8	Very high	91.3	Very high	78 Å²	78	49.7 Å²	49.7	41%	0.408	25%	0.252	S	S	.	.	H	α-helix	trans	-64.7	-40.2	173.7	-71.4	-178.8	0	0	0	112.4	Y612 A613 F618 V619 C620	Y612-L616 HydrophobicContact CD1-CD1 3.97Å; Y612-L616 HydrophobicContact CD1-CG 4.3Å; Y612-L616 HydrophobicContact CE1-CD1 3.57Å; Y612-L616 HydrophobicContact CE1-CD2 4.33Å; Y612-L616 HydrophobicContact CE1-CG 3.94Å; Y612-L616 PolarHBondContact O-N 3.48Å; A613-L616 PolarHBondContact O-N 3.17Å; L616-F618 VanDerWaalsContact C-N 3.33Å; L616-F618 PolarHBondContact O-N 3.49Å; L616-V619 PolarHBondContact O-N 3.5Å; L616-C620 WeakPolarHBondContact O-CB 3.44Å; L616-C620 PolarHBondContact O-N 3.44Å; L616-C620 PolarHBondContact O-SG 3.02Å; L616-C620 VanDerWaalsContact O-SG 3.38Å
617	E	93.6	Very high	90.4	Very high	14 Å²	14	52.7 Å²	52.7	7%	0.065	26%	0.262	C	S	.	.	H	α-helix	trans	-54.4	-51.1	172.9	-171.7	-80.5	171.3	0	0	110.4	F559 R569 A613 S614 V619 C620 V621 I728 A732 F736	F559-E617 HydrophobicContact CD1-CG 4.02Å; F559-E617 WeakPolarHBondContact CD1-OE2 3.18Å; F559-E617 HydrophobicContact CE1-CB 3.9Å; F559-E617 HydrophobicContact CE1-CG 3.74Å; R569-E617 IonicContact NH1-OE2 3.57Å; A613-E617 WeakPolarHBondContact O-CB 3.42Å; A613-E617 PolarHBondContact O-N 2.93Å; S614-E617 PolarHBondContact O-N 2.9Å; E617-V619 PolarHBondContact O-N 3.1Å; E617-C620 WeakPolarHBondContact O-CB 3.3Å; E617-C620 PolarHBondContact O-N 3.07Å; E617-C620 VanDerWaalsContact O-N 3.15Å; E617-V621 WeakPolarHBondContact O-CG2 3.41Å; E617-V621 PolarHBondContact O-N 3.29Å; E617-V621 VanDerWaalsContact OE1-CG2 3.28Å; E617-V621 WeakPolarHBondContact OE1-CG2 3.2Å; E617-I728 HydrophobicContact CG-CG2 4.19Å; E617-A732 HydrophobicContact CG-CB 3.97Å; E617-F736 HydrophobicContact CB-CZ 4.46Å
618	F	90.4	Very high	88.6	Confident	18 Å²	18	63.3 Å²	63.3	8%	0.079	30%	0.302	C	S	.	.	H	α-helix	trans	-59.5	-45.1	178.1	157.3	-103.5	0	0	0	111.7	V566 R569 V570 S614 L615 L616 C620 V621 N622	V566-F618 HydrophobicContact CG1-CE2 4.26Å; V566-F618 HydrophobicContact CG1-CZ 3.94Å; R569-F618 HydrophobicContact CB-CD2 3.67Å; R569-F618 HydrophobicContact CB-CE2 3.9Å; R569-F618 HydrophobicContact CB-CG 4.26Å; R569-F618 VanDerWaalsContact CD-CD2 3.49Å; R569-F618 HydrophobicContact CG-CD2 4.26Å; V570-F618 HydrophobicContact CG2-CD1 4.38Å; V570-F618 HydrophobicContact CG2-CE1 3.4Å; V570-F618 VanDerWaalsContact CG2-CE1 3.4Å; V570-F618 HydrophobicContact CG2-CE2 4.37Å; V570-F618 HydrophobicContact CG2-CZ 3.39Å; S614-F618 PolarHBondContact O-N 2.94Å; S614-F618 VanDerWaalsContact O-N 3.15Å; L615-F618 PolarHBondContact O-N 3.38Å; L616-F618 VanDerWaalsContact C-N 3.33Å; L616-F618 PolarHBondContact O-N 3.49Å; F618-C620 VanDerWaalsContact C-N 3.33Å; F618-C620 PolarHBondContact O-N 3.46Å; F618-V621 PolarHBondContact O-N 3.04Å; F618-N622 HydrophobicContact CD2-CB 4.36Å; F618-N622 HydrophobicContact CE2-CB 3.92Å; F618-N622 HydrophobicContact CZ-CB 4.17Å; F618-N622 WeakPolarHBondContact O-CB 3.36Å; F618-N622 PolarHBondContact O-N 2.89Å
619	V	91.3	Very high	86.7	Confident	83 Å²	83	62.8 Å²	62.8	50%	0.503	31%	0.305	S	S	.	.	H	α-helix	trans	-60.5	-43	177	170	0	0	0	0	110.9	L615 L616 E617 N622 Y623	L615-V619 WeakPolarHBondContact O-CG2 3.35Å; L615-V619 PolarHBondContact O-N 3.24Å; L616-V619 PolarHBondContact O-N 3.5Å; E617-V619 PolarHBondContact O-N 3.1Å; V619-N622 PolarHBondContact O-N 2.9Å; V619-Y623 WeakPolarHBondContact O-CB 3.49Å; V619-Y623 PolarHBondContact O-N 2.84Å
620	C	89.3	Confident	84.5	Confident	67 Å²	67	67.6 Å²	67.6	45%	0.453	32%	0.324	S	S	.	.	H	α-helix	trans	-64.7	-48.1	176.4	-73.1	0	0	0	0	112.5	L616 E617 F618 N622 Y623 V624	L616-C620 WeakPolarHBondContact O-CB 3.44Å; L616-C620 PolarHBondContact O-N 3.44Å; L616-C620 PolarHBondContact O-SG 3.02Å; L616-C620 VanDerWaalsContact O-SG 3.38Å; E617-C620 WeakPolarHBondContact O-CB 3.3Å; E617-C620 PolarHBondContact O-N 3.07Å; E617-C620 VanDerWaalsContact O-N 3.15Å; F618-C620 VanDerWaalsContact C-N 3.33Å; F618-C620 PolarHBondContact O-N 3.46Å; C620-N622 VanDerWaalsContact C-N 3.32Å; C620-N622 PolarHBondContact O-N 3.18Å; C620-Y623 PolarHBondContact O-N 3.16Å; C620-V624 WeakPolarHBondContact O-CB 3.3Å; C620-V624 VanDerWaalsContact O-CG2 3.28Å; C620-V624 WeakPolarHBondContact O-CG2 3.24Å; C620-V624 PolarHBondContact O-N 3.41Å
621	V	88.8	Confident	82.1	Confident	1 Å²	1	72.9 Å²	72.9	1%	0.006	35%	0.349	C	S	.	.	H	α-helix	trans	-59	-44.1	175.8	166.5	0	0	0	0	111	W563 E617 F618 G625 A725 I728	W563-V621 HydrophobicContact CB-CG1 3.94Å; E617-V621 WeakPolarHBondContact O-CG2 3.41Å; E617-V621 PolarHBondContact O-N 3.29Å; E617-V621 VanDerWaalsContact OE1-CG2 3.28Å; E617-V621 WeakPolarHBondContact OE1-CG2 3.2Å; F618-V621 PolarHBondContact O-N 3.04Å; V621-G625 PolarHBondContact O-N 3.46Å; V621-A725 HydrophobicContact CG1-CB 4.22Å; V621-I728 HydrophobicContact CG2-CB 3.87Å; V621-I728 HydrophobicContact CG2-CG2 3.62Å
622	N	87.7	Confident	79.6	Confident	18 Å²	18	80.5 Å²	80.5	10%	0.096	39%	0.39	C	S	.	.	H	α-helix	trans	-69.6	-38.1	-178.5	-166.6	-113.1	0	0	0	112.5	V566 F618 V619 C620 R626	V566-N622 WeakPolarHBondContact CG2-ND2 3.22Å; F618-N622 HydrophobicContact CD2-CB 4.36Å; F618-N622 HydrophobicContact CE2-CB 3.92Å; F618-N622 HydrophobicContact CZ-CB 4.17Å; F618-N622 WeakPolarHBondContact O-CB 3.36Å; F618-N622 PolarHBondContact O-N 2.89Å; V619-N622 PolarHBondContact O-N 2.9Å; C620-N622 VanDerWaalsContact C-N 3.32Å; C620-N622 PolarHBondContact O-N 3.18Å; N622-R626 PolarHBondContact ND2-NH2 2.9Å; N622-R626 WeakPolarHBondContact O-CB 3.3Å; N622-R626 WeakPolarHBondContact O-CG 3.31Å; N622-R626 PolarHBondContact O-N 3.43Å; N622-R626 PolarHBondContact OD1-NH1 3.42Å; N622-R626 PolarHBondContact OD1-NH2 2.77Å
623	Y	87.4	Confident	77.3	Confident	144 Å²	144	80.1 Å²	80.1	57%	0.565	40%	0.4	S	S	*	.	H	α-helix	trans	-68.2	-46.4	173.6	175.8	-108.9	0	0	0	112.2	V619 C620 R626 K627	V619-Y623 WeakPolarHBondContact O-CB 3.49Å; V619-Y623 PolarHBondContact O-N 2.84Å; C620-Y623 PolarHBondContact O-N 3.16Å; Y623-R626 PolarHBondContact O-N 2.96Å; Y623-K627 HydrophobicContact CE1-CD 4.42Å; Y623-K627 PolarHBondContact O-N 3.37Å; Y623-K627 WeakPolarHBondContact OH-CE 3.48Å; Y623-K627 PolarHBondContact OH-NZ 2.77Å
624	V	85.9	Confident	74.7	Confident	34 Å²	34	84.9 Å²	84.9	21%	0.206	43%	0.426	C	S	.	.	H	α-helix	trans	-65.3	-43.8	177.6	170.7	0	0	0	0	111.2	C620 R626 K627 P721 V724 A725	C620-V624 WeakPolarHBondContact O-CB 3.3Å; C620-V624 VanDerWaalsContact O-CG2 3.28Å; C620-V624 WeakPolarHBondContact O-CG2 3.24Å; C620-V624 PolarHBondContact O-N 3.41Å; V624-R626 VanDerWaalsContact C-N 3.25Å; V624-R626 PolarHBondContact O-N 3.17Å; V624-K627 PolarHBondContact O-N 2.69Å; V624-P721 WeakPolarHBondContact O-CB 3.3Å; V624-V724 HydrophobicContact CG1-CB 3.96Å; V624-V724 HydrophobicContact CG1-CG1 3.95Å; V624-A725 HydrophobicContact CG1-CB 4.43Å
625	G	80	Confident	71.9	Confident	11 Å²	11	94.5 Å²	94.5	11%	0.113	46%	0.464	C	S	.	.	H	α-helix	trans	-63	-27.9	177.4	0	0	0	0	0	114	V621	V621-G625 PolarHBondContact O-N 3.46Å
626	R	82	Confident	69.1	Low	160 Å²	160	104.4 Å²	104.4	60%	0.604	50%	0.499	S	S	*	.	H	α-helix	trans	-87.1	-13.1	175.7	-74.3	-176.7	-175.2	138.4	9.2	114.8	N622 Y623 V624 R628	N622-R626 PolarHBondContact ND2-NH2 2.9Å; N622-R626 WeakPolarHBondContact O-CB 3.3Å; N622-R626 WeakPolarHBondContact O-CG 3.31Å; N622-R626 PolarHBondContact O-N 3.43Å; N622-R626 PolarHBondContact OD1-NH1 3.42Å; N622-R626 PolarHBondContact OD1-NH2 2.77Å; Y623-R626 PolarHBondContact O-N 2.96Å; V624-R626 VanDerWaalsContact C-N 3.25Å; V624-R626 PolarHBondContact O-N 3.17Å; R626-R628 PolarHBondContact O-N 3.45Å
627	K	76.8	Confident	66.5	Low	107 Å²	107	106.2 Å²	106.2	47%	0.465	52%	0.516	S	S	.	.			trans	-66.3	105.2	171	-78.6	-172	175.3	179.5	0	109	Y623 V624 P721	Y623-K627 HydrophobicContact CE1-CD 4.42Å; Y623-K627 PolarHBondContact O-N 3.37Å; Y623-K627 WeakPolarHBondContact OH-CE 3.48Å; Y623-K627 PolarHBondContact OH-NZ 2.77Å; V624-K627 PolarHBondContact O-N 2.69Å; K627-P721 WeakPolarHBondContact O-CB 3.49Å; K627-P721 WeakPolarHBondContact O-CG 3.47Å
628	R	57.1	Low	64.2	Low	222 Å²	222	109.1 Å²	109.1	84%	0.838	55%	0.55	S	S	*	.			trans	-63	136.2	168.5	-60.7	-174.5	-174.7	-168.7	2.3	108.6	R626 L630	R626-R628 PolarHBondContact O-N 3.45Å; R628-L630 PolarHBondContact O-N 3.24Å
629	P	54.8	Low	61.5	Low	71 Å²	71	117.5 Å²	117.5	46%	0.461	59%	0.589	S	S	.	*			trans	-65.9	124.4	169.6	28.3	-32.3	0	0	0	108.9	H631 P721	P629-H631 PolarHBondContact O-N 2.75Å; P629-P721 HydrophobicContact CB-CG 4.5Å; P629-P721 HydrophobicContact CG-CG 4.5Å
630	L	50.2	Low	58.6	Low	176 Å²	176	120.5 Å²	120.5	92%	0.921	60%	0.602	S	S	*	*			trans	-75.5	77	164.9	-91.8	80.6	0	0	0	108.9	R628	R628-L630 PolarHBondContact O-N 3.24Å
631	H	44.6	Very low	56.5	Low	146 Å²	146	123.6 Å²	123.6	68%	0.676	62%	0.621	S	S	*	*			trans	-148.6	125.4	156.3	-151.4	-80.1	0	0	0	110.8	P629 V633	P629-H631 PolarHBondContact O-N 2.75Å; H631-V633 VanDerWaalsContact C-N 3.33Å; H631-V633 HydrophobicContact CB-CG2 4.29Å; H631-V633 WeakPolarHBondContact ND1-CG2 3.28Å; H631-V633 PolarHBondContact O-N 3.25Å
632	N	43.8	Very low	54.3	Low	163 Å²	163	129.1 Å²	129.1	87%	0.872	66%	0.655	S	S	*	*			trans	-72.9	91.3	167.2	-70.3	-19.1	0	0	0	107.9
633	V	46.9	Very low	52.1	Low	116 Å²	116	134.9 Å²	134.9	70%	0.703	69%	0.691	S	S	*	*			trans	-106	106.5	163.5	-175.6	0	0	0	0	107.1	H631 Y635	H631-V633 VanDerWaalsContact C-N 3.33Å; H631-V633 HydrophobicContact CB-CG2 4.29Å; H631-V633 WeakPolarHBondContact ND1-CG2 3.28Å; H631-V633 PolarHBondContact O-N 3.25Å; V633-Y635 PolarHBondContact O-N 3.11Å
634	V	39	Very low	49.6	Very low	129 Å²	129	137.6 Å²	137.6	78%	0.782	71%	0.709	S	S	*	*			trans	-66.9	113.6	173.6	176.1	0	0	0	0	107.9	R636	V634-R636 PolarHBondContact O-N 3.25Å; V634-R636 VanDerWaalsContact O-N 3.11Å
635	Y	35.6	Very low	47.2	Very low	202 Å²	202	147.4 Å²	147.4	79%	0.792	74%	0.742	S	S	*	*			trans	-69.6	105.6	175.5	-165.7	-85.7	0	0	0	109.2	V633 P637	V633-Y635 PolarHBondContact O-N 3.11Å; Y635-P637 HydrophobicContact CD1-CG 4.34Å; Y635-P637 HydrophobicContact CE1-CB 4.38Å; Y635-P637 WeakPolarHBondContact O-CD 3.46Å
636	R	33.4	Very low	45.1	Very low	233 Å²	233	154.1 Å²	154.1	88%	0.879	77%	0.774	S	S	*	*			trans	-79.7	115.9	165.1	-87.7	-173.2	171	161.4	-1.6	108.4	V634	V634-R636 PolarHBondContact O-N 3.25Å; V634-R636 VanDerWaalsContact O-N 3.11Å
637	P	38	Very low	43.1	Very low	116 Å²	116	152.5 Å²	152.5	75%	0.753	79%	0.785	S	S	*	*			trans	-78	123.2	173.2	-3.3	21.7	0	0	0	109	Y635	Y635-P637 HydrophobicContact CD1-CG 4.34Å; Y635-P637 HydrophobicContact CE1-CB 4.38Å; Y635-P637 WeakPolarHBondContact O-CD 3.46Å
638	G	44.5	Very low	41.1	Very low	75 Å²	75	152.2 Å²	152.2	77%	0.773	80%	0.802	S	S	*	*			trans	156.6	49.5	175.2	0	0	0	0	0	117.2
639	E	34	Very low	40.2	Very low	193 Å²	193	147.8 Å²	147.8	90%	0.902	80%	0.799	S	S	*	*			trans	-147.2	142	163	-123.1	165.4	-158.2	0	0	110.4
640	N	31.1	Very low	39.4	Very low	147 Å²	147	152 Å²	152	79%	0.786	82%	0.817	S	S	*	*			trans	-92.3	148.2	-161.8	-71.4	-46.1	0	0	0	113.4	V642	N640-V642 PolarHBondContact O-N 2.66Å
641	P	44.4	Very low	38.7	Very low	131 Å²	131	149.5 Å²	149.5	85%	0.851	81%	0.814	S	S	*	*	S	Bend	trans	-81.7	72	-171.7	34.4	-37.6	0	0	0	113.2
642	V	42.5	Very low	38.7	Very low	118 Å²	118	154 Å²	154	72%	0.715	83%	0.826	S	S	*	*			trans	-132.2	150.1	171.7	-166	0	0	0	0	109.9	N640	N640-V642 PolarHBondContact O-N 2.66Å
643	T	42.8	Very low	38.7	Very low	138 Å²	138	154.2 Å²	154.2	85%	0.847	83%	0.825	S	S	*	*			trans	60.8	66.5	179.4	54.2	0	0	0	0	117.8
644	Q	34.4	Very low	38.2	Very low	201 Å²	201	152 Å²	152	94%	0.939	83%	0.826	S	S	*	*			trans	-139	86.5	137.5	-159	161.7	59.2	0	0	111.7
645	R	34.7	Very low	38.2	Very low	241 Å²	241	152.7 Å²	152.7	91%	0.909	83%	0.83	S	S	*	*			trans	-71.5	159.1	167.5	-73.3	-177.9	172.3	177.3	-2.4	110.2
646	L	35.4	Very low	38.4	Very low	151 Å²	151	151 Å²	151	79%	0.791	83%	0.833	S	S	*	*			trans	-49.4	149.7	157.9	-91.4	65.8	0	0	0	110.1
647	P	41.8	Very low	38.7	Very low	127 Å²	127	148.7 Å²	148.7	83%	0.825	84%	0.837	S	S	*	*			cis	-139.2	141.8	46.8	37.5	-19.5	0	0	0	117.3
648	A	33.2	Very low	38.4	Very low	100 Å²	100	147.5 Å²	147.5	83%	0.826	84%	0.837	S	S	*	*			trans	-154.6	22	166.6	0	0	0	0	0	114.1
649	V	39.5	Very low	37.9	Very low	129 Å²	129	149.8 Å²	149.8	78%	0.782	84%	0.841	S	S	*	*			trans	-124.8	96.6	-178.9	-177.8	0	0	0	0	109.1
650	L	37.4	Very low	38.2	Very low	159 Å²	159	146 Å²	146	83%	0.832	83%	0.834	S	S	*	*	S	Bend	trans	-175.5	-32.2	160.2	-108.6	163.5	0	0	0	112.1	R652	L650-R652 PolarHBondContact O-N 3.15Å; L650-R652 VanDerWaalsContact O-N 3.16Å
651	S	35.3	Very low	38.3	Very low	124 Å²	124	146.4 Å²	146.4	87%	0.867	84%	0.835	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.7	51	-174.4	-162.4	0	0	0	0	114.7
652	R	45.2	Very low	37.5	Very low	241 Å²	241	148.1 Å²	148.1	91%	0.909	83%	0.829	S	S	*	*	T	Hydrogen-bonded Turn	trans	-147.4	25.5	173.4	-77.5	-155.9	170.4	-137.8	-12.3	115.4	L650	L650-R652 PolarHBondContact O-N 3.15Å; L650-R652 VanDerWaalsContact O-N 3.16Å
653	I	42.6	Very low	37	Very low	168 Å²	168	151.2 Å²	151.2	86%	0.862	83%	0.833	S	S	*	*	S	Bend	trans	-121.4	62.5	176.6	-45	-179.8	0	0	0	109.7
654	G	37	Very low	36.1	Very low	70 Å²	70	153.6 Å²	153.6	72%	0.722	83%	0.832	S	S	*	*	S	Bend	trans	-155.6	-1.9	-175.3	0	0	0	0	0	117.8
655	V	40	Very low	35.8	Very low	143 Å²	143	153 Å²	153	87%	0.867	83%	0.826	S	S	*	*	S	Bend	trans	-143.7	47.7	-175.1	-157.6	0	0	0	0	113.1
656	I	39.5	Very low	35.4	Very low	167 Å²	167	147.5 Å²	147.5	86%	0.856	82%	0.82	S	S	*	*	S	Bend	trans	-142.9	52.7	161.5	-40	176.7	0	0	0	110.8
657	L	39.3	Very low	35.2	Very low	183 Å²	183	145.2 Å²	145.2	96%	0.958	82%	0.822	S	S	*	*			trans	-140.7	58	165.1	-80.1	-178	0	0	0	109.9
658	A	32.7	Very low	34.4	Very low	92 Å²	92	145.7 Å²	145.7	76%	0.76	82%	0.823	S	S	*	*	S	Bend	trans	-150.3	124.7	171.5	0	0	0	0	0	111.2
659	S	32.8	Very low	34.1	Very low	123 Å²	123	151.2 Å²	151.2	86%	0.86	82%	0.824	S	S	*	*			trans	71.6	147.7	167.1	-57.2	0	0	0	0	119.1
660	P	41.1	Very low	33.4	Very low	114 Å²	114	153.7 Å²	153.7	74%	0.74	83%	0.827	S	S	*	*			trans	-113.2	-179	-168.8	43.4	-35.6	0	0	0	115.2
661	L	32.7	Very low	32.8	Very low	154 Å²	154	149.7 Å²	149.7	81%	0.806	82%	0.824	S	S	*	*			trans	78.7	160.1	152.5	-91.4	162.6	0	0	0	120.4
662	F	28.6	Very low	32.5	Very low	167 Å²	167	151.7 Å²	151.7	73%	0.732	82%	0.82	S	S	*	*			trans	64.6	84.1	175.1	-86.3	-79.5	0	0	0	120
663	F	30.5	Very low	31.5	Very low	184 Å²	184	150.3 Å²	150.3	81%	0.807	82%	0.821	S	S	*	*			trans	-51.9	131.2	138	-110.1	-105.5	0	0	0	110.4	F665	F663-F665 HydrophobicContact CD1-CD2 4.3Å; F663-F665 HydrophobicContact CE1-CD2 4.15Å; F663-F665 HydrophobicContact CE1-CE2 4.44Å
664	K	24	Very low	30.8	Very low	187 Å²	187	152.5 Å²	152.5	81%	0.813	82%	0.818	S	S	*	*			trans	-138.8	114	153.1	-109.1	-174.9	178.5	-178.9	0	109.6
665	F	27.8	Very low	30.3	Very low	189 Å²	189	157.6 Å²	157.6	83%	0.829	82%	0.823	S	S	*	*			trans	-97.6	120.2	175.1	-129.3	-98.8	0	0	0	107.8	F663	F663-F665 HydrophobicContact CD1-CD2 4.3Å; F663-F665 HydrophobicContact CE1-CD2 4.15Å; F663-F665 HydrophobicContact CE1-CE2 4.44Å
666	T	27.2	Very low	29.6	Very low	126 Å²	126	157.6 Å²	157.6	77%	0.773	82%	0.818	S	S	*	*			trans	-137.1	133.8	167.2	40.1	0	0	0	0	109.1
667	A	30.9	Very low	29	Very low	102 Å²	102	154.9 Å²	154.9	84%	0.843	82%	0.82	S	S	*	*			trans	-76.8	160.3	-170.9	0	0	0	0	0	113.1
668	V	25.9	Very low	28.3	Very low	137 Å²	137	150.1 Å²	150.1	83%	0.83	82%	0.816	S	S	*	*			trans	-121.5	96.7	177	179.2	0	0	0	0	110.6
669	Y	25.3	Very low	28.2	Very low	216 Å²	216	150 Å²	150	85%	0.847	82%	0.815	S	S	*	*			trans	-157.6	142	162.1	-95.9	-87.6	0	0	0	104
670	Q	26.2	Very low	28.5	Very low	181 Å²	181	150.2 Å²	150.2	85%	0.846	81%	0.814	S	S	*	*			cis	-163.1	162.3	7.8	-175.3	174.2	-14.3	0	0	109.3
671	G	24.5	Very low	28	Very low	76 Å²	76	152.1 Å²	152.1	78%	0.784	82%	0.817	S	S	*	*			trans	110.7	144.9	151.8	0	0	0	0	0	117.7
672	E	27.8	Very low	27.8	Very low	166 Å²	166	154.1 Å²	154.1	78%	0.776	82%	0.823	S	S	*	*			trans	-93.2	158.7	179.1	-62.5	172.9	78.6	0	0	113.2
673	K	25.5	Very low	27.9	Very low	212 Å²	212	153.3 Å²	153.3	92%	0.922	82%	0.824	S	S	*	*				-156.2	144.8	120.9	-110.1	163	-173.7	175.7	0	111.9
674	R	27.6	Very low	28.1	Very low	214 Å²	214	151.5 Å²	151.5	81%	0.808	83%	0.828	S	S	*	*			trans	-90.4	148.8	177.7	-63.6	171.6	171.8	176.8	-5.5	110.9
675	Q	26.8	Very low	28.4	Very low	177 Å²	177	146.5 Å²	146.5	83%	0.827	82%	0.822	S	S	*	*				-165.8	119.2	118.2	-108	170.3	2	0	0	114.4
676	N	25.6	Very low	28.5	Very low	142 Å²	142	144 Å²	144	76%	0.759	83%	0.826	S	S	*	*			trans	55	127.4	137.4	-60.9	2.3	0	0	0	124.5
677	A	26.1	Very low	28.8	Very low	110 Å²	110	144.2 Å²	144.2	91%	0.909	83%	0.827	S	S	*	*			trans	92	141.9	134.9	0	0	0	0	0	120.4
678	G	25.5	Very low	28.8	Very low	84 Å²	84	145.4 Å²	145.4	87%	0.866	82%	0.824	S	S	*	*			trans	108.9	82.5	163.7	0	0	0	0	0	116.6
679	A	30.1	Very low	29.1	Very low	90 Å²	90	145.4 Å²	145.4	74%	0.744	83%	0.829	S	S	*	*			trans	-102.4	156.5	150	0	0	0	0	0	107.9
680	P	39.3	Very low	29.4	Very low	127 Å²	127	139 Å²	139	83%	0.825	83%	0.828	S	S	*	*				-136.7	170.6	80.6	36.8	-22.8	0	0	0	114.5
681	N	31.1	Very low	29.7	Very low	153 Å²	153	134 Å²	134	82%	0.818	83%	0.826	S	S	*	*			trans	-85.6	140	172.3	-55.3	-38.7	0	0	0	110.2
682	E	27.9	Very low	30.1	Very low	197 Å²	197	135.8 Å²	135.8	92%	0.921	83%	0.826	S	S	*	*			trans	-93.4	146.7	171.4	-164.9	163	-129.7	0	0	111.5
683	I	31	Very low	30.3	Very low	149 Å²	149	135.4 Å²	135.4	76%	0.764	83%	0.83	S	S	*	*			trans	-117.8	118.5	-169.6	-59.6	168.9	0	0	0	108.8	A685	I683-A685 PolarHBondContact O-N 3.27Å
684	V	34.3	Very low	30.8	Very low	146 Å²	146	130.6 Å²	130.6	89%	0.885	82%	0.822	S	S	*	*			trans	-80.3	115.5	172.7	-178.1	0	0	0	0	109.2
685	A	29	Very low	31.3	Very low	83 Å²	83	126.1 Å²	126.1	69%	0.686	82%	0.821	S	S	*	*			trans	-86.6	154	-179.1	0	0	0	0	0	112.8	I683	I683-A685 PolarHBondContact O-N 3.27Å
686	C	29.9	Very low	31.4	Very low	135 Å²	135	123.9 Å²	123.9	91%	0.912	82%	0.824	S	S	*	*			trans	-82.4	137.7	173.4	-60.9	0	0	0	0	111.6
687	T	33.7	Very low	31.8	Very low	131 Å²	131	122.7 Å²	122.7	80%	0.804	82%	0.822	S	S	*	*			trans	-97.6	111.6	-174.5	-21.2	0	0	0	0	113
688	T	32.4	Very low	32	Very low	127 Å²	127	126.6 Å²	126.6	78%	0.779	82%	0.821	S	S	*	*			trans	36.3	125.9	150.5	55.7	0	0	0	0	121.8
689	C	32.4	Very low	32.3	Very low	138 Å²	138	128.3 Å²	128.3	93%	0.932	82%	0.819	S	S	*	*			trans	-76.9	161.7	162.6	-54.6	0	0	0	0	113.1
690	G	31	Very low	32.5	Very low	80 Å²	80	128.4 Å²	128.4	83%	0.825	82%	0.82	S	S	*	*			trans	-152.8	98.8	174.6	0	0	0	0	0	115.7
691	G	31.5	Very low	32.3	Very low	78 Å²	78	129.5 Å²	129.5	80%	0.804	82%	0.819	S	S	*	*			trans	58.8	107.3	147.7	0	0	0	0	0	122
692	S	32.6	Very low	32.4	Very low	113 Å²	113	129.9 Å²	129.9	79%	0.79	82%	0.821	S	S	*	*				-177.6	132.3	102.4	48.7	0	0	0	0	115
693	N	32.8	Very low	32.7	Very low	158 Å²	158	124.4 Å²	124.4	85%	0.845	82%	0.818	S	S	*	*			trans	39.9	90.5	146.6	-57.2	-2.5	0	0	0	121.4
694	S	35.7	Very low	32.6	Very low	110 Å²	110	123.2 Å²	123.2	77%	0.769	82%	0.821	S	S	*	*				-172.3	148.4	125.9	41.4	0	0	0	0	111.5
695	P	38.4	Very low	32.6	Very low	121 Å²	121	120.4 Å²	120.4	79%	0.786	81%	0.813	S	S	*	*			trans	-93.9	122.1	179.7	34.1	-30.9	0	0	0	112.3
696	C	28.8	Very low	32.7	Very low	130 Å²	130	122.8 Å²	122.8	88%	0.878	82%	0.819	S	S	*	*			trans	-85.8	124.9	172.8	-62.1	0	0	0	0	111.1
697	T	33.3	Very low	32.8	Very low	116 Å²	116	125.2 Å²	125.2	71%	0.712	82%	0.817	S	S	*	*			trans	-114.3	147.9	172.6	52.4	0	0	0	0	112.1
698	H	32	Very low	32.7	Very low	193 Å²	193	123.7 Å²	123.7	89%	0.894	81%	0.808	S	S	*	*			trans	74.5	147.7	174.2	-68.2	-79	0	0	0	118.9
699	S	31.9	Very low	32.7	Very low	119 Å²	119	123.3 Å²	123.3	83%	0.832	81%	0.809	S	S	*	*			trans	-121.2	130.5	178.2	169.5	0	0	0	0	108.4
700	A	32.9	Very low	32.5	Very low	92 Å²	92	124.9 Å²	124.9	76%	0.76	80%	0.801	S	S	*	*			trans	-171.7	144	148.9	0	0	0	0	0	110.9
701	N	36.3	Very low	32.5	Very low	150 Å²	150	126.5 Å²	126.5	80%	0.802	79%	0.794	S	S	*	*			trans	-13.6	119.9	167.1	-58.7	-15.5	0	0	0	117.8
702	N	32.1	Very low	32.6	Very low	162 Å²	162	130.5 Å²	130.5	87%	0.866	79%	0.792	S	S	*	*				-159	163.7	97.3	-95.4	-33.3	0	0	0	111.7
703	G	34.6	Very low	32.6	Very low	82 Å²	82	130.4 Å²	130.4	85%	0.845	79%	0.786	S	S	*	*			trans	-67.4	144.4	-158.1	0	0	0	0	0	116.1
704	C	28.5	Very low	32.6	Very low	124 Å²	124	133.2 Å²	133.2	84%	0.838	79%	0.785	S	S	*	*			trans	-130.4	137	151	-169.9	0	0	0	0	107.6	T706	C704-T706 PolarHBondContact O-N 3.04Å
705	A	34.7	Very low	32.5	Very low	87 Å²	87	136.7 Å²	136.7	72%	0.719	79%	0.786	S	S	*	*			trans	-70.4	125.9	173	0	0	0	0	0	108.6	E707	A705-E707 PolarHBondContact O-N 3.09Å
706	T	30.5	Very low	32.4	Very low	132 Å²	132	140.1 Å²	140.1	81%	0.81	79%	0.789	S	S	*	*			trans	-69	101	166.7	36.6	0	0	0	0	108.3	C704 T708	C704-T706 PolarHBondContact O-N 3.04Å; T706-T708 PolarHBondContact O-N 3.48Å
707	E	32.4	Very low	33.2	Very low	187 Å²	187	141.9 Å²	141.9	87%	0.874	78%	0.784	S	S	*	*			trans	-59.5	89.2	163.6	-74.8	-163.5	126.1	0	0	108.5	A705 C709	A705-E707 PolarHBondContact O-N 3.09Å; E707-C709 PolarHBondContact O-N 3.49Å
708	T	32.3	Very low	34.1	Very low	99 Å²	99	141.9 Å²	141.9	61%	0.607	79%	0.786	S	S	*	*			trans	-56.9	112.7	163	48.8	0	0	0	0	106.5	T706 F710	T706-T708 PolarHBondContact O-N 3.48Å; T708-F710 PolarHBondContact O-N 3.42Å; T708-F710 WeakPolarHBondContact OG1-CD2 3.19Å
709	C	31.2	Very low	35.3	Very low	119 Å²	119	136.4 Å²	136.4	80%	0.804	77%	0.768	S	S	*	*			trans	-69.8	78.3	-179.2	-167.7	0	0	0	0	108.9	E707 V711	E707-C709 PolarHBondContact O-N 3.49Å; C709-V711 PolarHBondContact O-N 2.96Å
710	F	29	Very low	36.8	Very low	171 Å²	171	135.1 Å²	135.1	75%	0.75	75%	0.749	S	S	*	*			trans	-65.8	86.8	170.2	-97.8	-85.8	0	0	0	107.4	T708 Q712	T708-F710 PolarHBondContact O-N 3.42Å; T708-F710 WeakPolarHBondContact OG1-CD2 3.19Å; F710-Q712 PolarHBondContact O-N 2.92Å
711	V	31	Very low	38.4	Very low	113 Å²	113	131.8 Å²	131.8	69%	0.685	72%	0.719	S	S	*	*			trans	-58.4	92.3	153.7	-177.8	0	0	0	0	105.7	C709 V713	C709-V711 PolarHBondContact O-N 2.96Å; V711-V713 HydrophobicContact CG1-CG2 4.03Å; V711-V713 PolarHBondContact O-N 2.91Å
712	Q	32.9	Very low	40	Very low	162 Å²	162	127.5 Å²	127.5	76%	0.757	70%	0.696	S	S	*	*			trans	-63.7	84.5	160.1	-81.7	-156.9	5.2	0	0	106.8	F710 R714	F710-Q712 PolarHBondContact O-N 2.92Å; Q712-R714 PolarHBondContact O-N 3.48Å
713	V	33	Very low	42	Very low	112 Å²	112	128.3 Å²	128.3	68%	0.679	69%	0.686	S	S	*	*			trans	-56.1	93	146.7	179.1	0	0	0	0	104.3	V711 K715	V711-V713 HydrophobicContact CG1-CG2 4.03Å; V711-V713 PolarHBondContact O-N 2.91Å; V713-K715 PolarHBondContact O-N 3.1Å
714	R	33.5	Very low	44	Very low	216 Å²	216	126.7 Å²	126.7	82%	0.815	66%	0.66	S	S	*	*			trans	-68.7	77.1	179.2	-172	176.3	-172.7	150.9	4.7	107.2	Q712 K716	Q712-R714 PolarHBondContact O-N 3.48Å; R714-K716 VanDerWaalsContact C-N 3.26Å; R714-K716 PolarHBondContact O-N 3.41Å
715	K	33.3	Very low	46.4	Very low	184 Å²	184	120.8 Å²	120.8	80%	0.8	62%	0.62	S	S	*	*			trans	-51.8	99.8	169	-89.5	-174.1	173.5	177.6	0	105.4	V713 E717	V713-K715 PolarHBondContact O-N 3.1Å; K715-E717 VanDerWaalsContact C-N 3.33Å; K715-E717 PolarHBondContact O-N 3.01Å
716	K	35.8	Very low	48.6	Very low	192 Å²	192	121.8 Å²	121.8	84%	0.835	61%	0.608	S	S	*	*			trans	-68	99.2	-174.9	-170.5	177.3	-174.4	178.4	0	105.5	R714	R714-K716 VanDerWaalsContact C-N 3.26Å; R714-K716 PolarHBondContact O-N 3.41Å
717	E	46.6	Very low	51.2	Low	167 Å²	167	118.9 Å²	118.9	78%	0.78	59%	0.591	S	S	*	*			trans	-45.5	131.3	-175.7	-62.2	177.5	142.6	0	0	109	K715 P719	K715-E717 VanDerWaalsContact C-N 3.33Å; K715-E717 PolarHBondContact O-N 3.01Å; E717-P719 WeakPolarHBondContact O-CD 3.46Å
718	P	51.1	Low	53.7	Low	116 Å²	116	112.5 Å²	112.5	75%	0.753	56%	0.562	S	S	*	*	P	Polyproline II helix	trans	-56	119.1	-179.1	23.2	-32.4	0	0	0	107.3	H720	P718-H720 PolarHBondContact O-N 3.48Å; P718-H720 VanDerWaalsContact O-N 3.16Å
719	P	57.3	Low	56.3	Low	79 Å²	79	108 Å²	108	51%	0.513	53%	0.534	S	S	.	.	P	Polyproline II helix	trans	-56.7	127.6	-168.3	18.7	-31.1	0	0	0	109.3	E717 V724	E717-P719 WeakPolarHBondContact O-CD 3.46Å; P719-V724 HydrophobicContact CB-CG2 3.88Å; P719-V724 HydrophobicContact CG-CG2 3.69Å; P719-V724 VanDerWaalsContact O-CG2 3.29Å; P719-V724 WeakPolarHBondContact O-CG2 3.44Å
720	H	64	Low	59.1	Low	92 Å²	92	106.3 Å²	106.3	43%	0.426	52%	0.52	S	S	.	.	P	Polyproline II helix	trans	-47	132.6	-174.4	-167	-86.1	0	0	0	110.1	P718 I722 R723 V724	P718-H720 PolarHBondContact O-N 3.48Å; P718-H720 VanDerWaalsContact O-N 3.16Å; H720-I722 PolarHBondContact O-N 2.97Å; H720-R723 WeakPolarHBondContact O-CA 3.46Å; H720-R723 VanDerWaalsContact O-CB 3.24Å; H720-R723 WeakPolarHBondContact O-CB 3.44Å; H720-R723 PolarHBondContact O-N 2.67Å; H720-V724 PolarHBondContact O-N 3.24Å
721	P	66.9	Low	62.1	Low	21 Å²	21	102.7 Å²	102.7	14%	0.136	51%	0.507	C	S	.	.	H	α-helix	trans	-54.3	-35.7	-166.2	8.8	-23.3	0	0	0	114	V624 K627 P629 R723 V724 A725	V624-P721 WeakPolarHBondContact O-CB 3.3Å; K627-P721 WeakPolarHBondContact O-CB 3.49Å; K627-P721 WeakPolarHBondContact O-CG 3.47Å; P629-P721 HydrophobicContact CB-CG 4.5Å; P629-P721 HydrophobicContact CG-CG 4.5Å; P721-R723 VanDerWaalsContact C-N 3.34Å; P721-R723 PolarHBondContact O-N 3.05Å; P721-V724 WeakPolarHBondContact O-CB 3.31Å; P721-V724 PolarHBondContact O-N 2.95Å; P721-V724 VanDerWaalsContact O-N 3.14Å; P721-A725 PolarHBondContact O-N 3.04Å
722	I	69.6	Low	65	Low	61 Å²	61	97.5 Å²	97.5	31%	0.313	48%	0.476	S	S	.	.	H	α-helix	trans	-60	-37.8	172.5	-54.6	175.2	0	0	0	112.7	W563 H720 K726	W563-I722 HydrophobicContact CZ2-CD1 4.47Å; W563-I722 HydrophobicContact CZ2-CG1 4.47Å; W563-I722 HydrophobicContact CZ2-CG2 4.21Å; H720-I722 PolarHBondContact O-N 2.97Å; I722-K726 WeakPolarHBondContact O-CG 3.36Å; I722-K726 PolarHBondContact O-N 3.07Å
723	R	73.9	Confident	67.9	Low	178 Å²	178	93 Å²	93	67%	0.672	45%	0.452	S	S	*	.	H	α-helix	trans	-69.3	-36.4	175	-166.7	-174.8	-68	-176.6	1	111	H720 P721 T727	H720-R723 WeakPolarHBondContact O-CA 3.46Å; H720-R723 VanDerWaalsContact O-CB 3.24Å; H720-R723 WeakPolarHBondContact O-CB 3.44Å; H720-R723 PolarHBondContact O-N 2.67Å; P721-R723 VanDerWaalsContact C-N 3.34Å; P721-R723 PolarHBondContact O-N 3.05Å; R723-T727 WeakPolarHBondContact O-CB 3.21Å; R723-T727 PolarHBondContact O-N 3.02Å; R723-T727 PolarHBondContact O-OG1 3.4Å
724	V	77.7	Confident	70.8	Confident	48 Å²	48	93.1 Å²	93.1	29%	0.291	45%	0.448	S	S	.	.	H	α-helix	trans	-66.4	-49.5	174.6	-176.5	0	0	0	0	110.5	V624 P719 H720 P721 K726 T727 I728	V624-V724 HydrophobicContact CG1-CB 3.96Å; V624-V724 HydrophobicContact CG1-CG1 3.95Å; P719-V724 HydrophobicContact CB-CG2 3.88Å; P719-V724 HydrophobicContact CG-CG2 3.69Å; P719-V724 VanDerWaalsContact O-CG2 3.29Å; P719-V724 WeakPolarHBondContact O-CG2 3.44Å; H720-V724 PolarHBondContact O-N 3.24Å; P721-V724 WeakPolarHBondContact O-CB 3.31Å; P721-V724 PolarHBondContact O-N 2.95Å; P721-V724 VanDerWaalsContact O-N 3.14Å; V724-K726 PolarHBondContact O-N 3.4Å; V724-T727 WeakPolarHBondContact O-CA 3.39Å; V724-T727 WeakPolarHBondContact O-CB 3.44Å; V724-T727 PolarHBondContact O-N 2.83Å; V724-I728 HydrophobicContact CG1-CD1 4.23Å; V724-I728 WeakPolarHBondContact O-CG1 3.45Å; V724-I728 PolarHBondContact O-N 3.49Å
725	A	77.1	Confident	73.8	Confident	0 Å²	0	85.9 Å²	85.9	0%	0	43%	0.428	C	S	.	.	H	α-helix	trans	-52.4	-52.1	175.7	0	0	0	0	0	112	V621 V624 P721 T727 I728 D729	V621-A725 HydrophobicContact CG1-CB 4.22Å; V624-A725 HydrophobicContact CG1-CB 4.43Å; P721-A725 PolarHBondContact O-N 3.04Å; A725-T727 PolarHBondContact O-N 3.15Å; A725-I728 PolarHBondContact O-N 3.38Å; A725-I728 VanDerWaalsContact O-N 3.14Å; A725-D729 PolarHBondContact O-N 2.87Å
726	K	80.9	Confident	76.7	Confident	108 Å²	108	78.8 Å²	78.8	47%	0.47	40%	0.397	S	S	.	.	H	α-helix	trans	-62.6	-25.5	175.3	-72.2	-170.8	175.9	-163.4	0	114	I722 V724 V730	I722-K726 WeakPolarHBondContact O-CG 3.36Å; I722-K726 PolarHBondContact O-N 3.07Å; V724-K726 PolarHBondContact O-N 3.4Å; K726-V730 VanDerWaalsContact O-CG2 3.24Å; K726-V730 WeakPolarHBondContact O-CG2 3.49Å; K726-V730 PolarHBondContact O-N 3.14Å
727	T	84.9	Confident	79.6	Confident	72 Å²	72	72 Å²	72	44%	0.442	37%	0.373	S	S	.	.	H	α-helix	trans	-75.7	-35.8	176.4	-56.3	0	0	0	0	111.1	R723 V724 A725 V730 I731	R723-T727 WeakPolarHBondContact O-CB 3.21Å; R723-T727 PolarHBondContact O-N 3.02Å; R723-T727 PolarHBondContact O-OG1 3.4Å; V724-T727 WeakPolarHBondContact O-CA 3.39Å; V724-T727 WeakPolarHBondContact O-CB 3.44Å; V724-T727 PolarHBondContact O-N 2.83Å; A725-T727 PolarHBondContact O-N 3.15Å; T727-V730 PolarHBondContact O-N 2.92Å; T727-I731 HydrophobicContact CG2-CD1 3.99Å; T727-I731 VanDerWaalsContact O-CG1 3.3Å; T727-I731 WeakPolarHBondContact O-CG1 3.46Å; T727-I731 PolarHBondContact O-N 3.01Å; T727-I731 VanDerWaalsContact O-N 3.07Å
728	I	85.8	Confident	81.9	Confident	52 Å²	52	67.6 Å²	67.6	27%	0.267	36%	0.357	S	S	.	.	H	α-helix	trans	-64.2	-51.1	175.2	-62.7	163.6	0	0	0	109.6	E617 V621 V724 A725 V730 I731 A732	E617-I728 HydrophobicContact CG-CG2 4.19Å; V621-I728 HydrophobicContact CG2-CB 3.87Å; V621-I728 HydrophobicContact CG2-CG2 3.62Å; V724-I728 HydrophobicContact CG1-CD1 4.23Å; V724-I728 WeakPolarHBondContact O-CG1 3.45Å; V724-I728 PolarHBondContact O-N 3.49Å; A725-I728 PolarHBondContact O-N 3.38Å; A725-I728 VanDerWaalsContact O-N 3.14Å; I728-V730 VanDerWaalsContact C-N 3.28Å; I728-V730 PolarHBondContact O-N 2.85Å; I728-I731 PolarHBondContact O-N 3.38Å; I728-I731 VanDerWaalsContact O-N 3.1Å; I728-A732 WeakPolarHBondContact O-CB 3.37Å; I728-A732 PolarHBondContact O-N 3.08Å
729	D	87.5	Confident	84.1	Confident	6 Å²	6	64.1 Å²	64.1	3%	0.032	34%	0.339	C	S	.	.	H	α-helix	trans	-49.7	-48.1	175.1	-74.4	-46.5	0	0	0	111.7	R569 A725 A732 R733	R569-D729 IonicContact CZ-OD1 2.77Å; R569-D729 IonicContact NH1-OD1 3.24Å; R569-D729 PolarHBondContact NH1-OD1 3.23Å; R569-D729 VanDerWaalsContact NH2-CG 3.28Å; R569-D729 IonicContact NH2-OD1 3.19Å; R569-D729 PolarHBondContact NH2-OD1 3.46Å; R569-D729 IonicContact NH2-OD2 3.5Å; R569-D729 PolarHBondContact NH2-OD2 2.84Å; A725-D729 PolarHBondContact O-N 2.87Å; D729-A732 PolarHBondContact O-N 2.88Å; D729-R733 VanDerWaalsContact O-CG 3.26Å; D729-R733 WeakPolarHBondContact O-CG 3.45Å; D729-R733 PolarHBondContact O-N 3.14Å; D729-R733 VanDerWaalsContact O-N 3.12Å
730	V	89.9	Confident	86	Confident	83 Å²	83	60.6 Å²	60.6	50%	0.503	32%	0.315	S	S	.	.	H	α-helix	trans	-68.4	-33.8	-176.9	167	0	0	0	0	112.6	K726 T727 I728	K726-V730 VanDerWaalsContact O-CG2 3.24Å; K726-V730 WeakPolarHBondContact O-CG2 3.49Å; K726-V730 PolarHBondContact O-N 3.14Å; T727-V730 PolarHBondContact O-N 2.92Å; I728-V730 VanDerWaalsContact C-N 3.28Å; I728-V730 PolarHBondContact O-N 2.85Å
731	I	91.8	Very high	87.5	Confident	94 Å²	94	58.3 Å²	58.3	48%	0.482	31%	0.312	S	S	.	.	H	α-helix	trans	-71.1	-46.8	173.7	-68.7	166.9	0	0	0	109.8	T727 I728 R733 I734 T735	T727-I731 HydrophobicContact CG2-CD1 3.99Å; T727-I731 VanDerWaalsContact O-CG1 3.3Å; T727-I731 WeakPolarHBondContact O-CG1 3.46Å; T727-I731 PolarHBondContact O-N 3.01Å; T727-I731 VanDerWaalsContact O-N 3.07Å; I728-I731 PolarHBondContact O-N 3.38Å; I728-I731 VanDerWaalsContact O-N 3.1Å; I731-R733 VanDerWaalsContact C-N 3.3Å; I731-R733 PolarHBondContact O-N 2.85Å; I731-I734 PolarHBondContact O-N 2.9Å; I731-T735 HydrophobicContact CG2-CG2 3.7Å; I731-T735 PolarHBondContact O-N 3.19Å; I731-T735 PolarHBondContact O-OG1 2.96Å
732	A	92.8	Very high	89	Confident	4 Å²	4	62.9 Å²	62.9	3%	0.033	33%	0.334	C	S	.	.	H	α-helix	trans	-57.9	-40	-177.6	0	0	0	0	0	112.8	F559 E617 I728 D729 I734 T735 F736	F559-A732 HydrophobicContact CB-CB 4.39Å; F559-A732 HydrophobicContact CD1-CB 3.87Å; F559-A732 HydrophobicContact CD2-CB 4.04Å; F559-A732 HydrophobicContact CE1-CB 4.12Å; F559-A732 HydrophobicContact CE2-CB 4.27Å; F559-A732 HydrophobicContact CG-CB 3.84Å; F559-A732 HydrophobicContact CZ-CB 4.32Å; E617-A732 HydrophobicContact CG-CB 3.97Å; I728-A732 WeakPolarHBondContact O-CB 3.37Å; I728-A732 PolarHBondContact O-N 3.08Å; D729-A732 PolarHBondContact O-N 2.88Å; A732-I734 PolarHBondContact O-N 3.02Å; A732-I734 VanDerWaalsContact O-N 3.08Å; A732-T735 PolarHBondContact O-N 3.4Å; A732-F736 HydrophobicContact CB-CD2 3.98Å; A732-F736 HydrophobicContact CB-CE2 4.09Å; A732-F736 PolarHBondContact O-N 2.88Å; A732-F736 VanDerWaalsContact O-N 3.12Å
733	R	93.6	Very high	90.2	Very high	68 Å²	68	61.3 Å²	61.3	26%	0.257	33%	0.325	S	S	.	.	H	α-helix	trans	-54.2	-24.9	174.1	-73	169.8	-160.9	-157.8	-0.5	114.6	F559 W560 D729 I731 P737	F559-R733 HydrophobicContact CB-CG 3.79Å; F559-R733 PolarHBondContact O-NE 3.21Å; F559-R733 PolarHBondContact O-NH2 3.41Å; W560-R733 HydrophobicContact CD2-CG 4.21Å; W560-R733 HydrophobicContact CG-CG 4.47Å; W560-R733 HydrophobicContact CZ2-CB 4.29Å; W560-R733 HydrophobicContact CZ2-CG 4.16Å; W560-R733 PolarHBondContact O-NH2 2.71Å; D729-R733 VanDerWaalsContact O-CG 3.26Å; D729-R733 WeakPolarHBondContact O-CG 3.45Å; D729-R733 PolarHBondContact O-N 3.14Å; D729-R733 VanDerWaalsContact O-N 3.12Å; I731-R733 VanDerWaalsContact C-N 3.3Å; I731-R733 PolarHBondContact O-N 2.85Å; R733-P737 WeakPolarHBondContact O-CD 3.49Å; R733-P737 WeakPolarHBondContact O-CG 3.44Å
734	I	93.9	Very high	91.2	Very high	114 Å²	114	54.3 Å²	54.3	59%	0.585	30%	0.301	S	S	*	.	H	α-helix	trans	-103.4	-48.7	179.2	-57.6	177.9	0	0	0	110	I731 A732 T738	I731-I734 PolarHBondContact O-N 2.9Å; A732-I734 PolarHBondContact O-N 3.02Å; A732-I734 VanDerWaalsContact O-N 3.08Å; I734-T738 HydrophobicContact CG2-CG2 4.41Å; I734-T738 WeakPolarHBondContact O-CB 3.09Å; I734-T738 WeakPolarHBondContact O-CG2 3.39Å; I734-T738 PolarHBondContact O-N 3.39Å; I734-T738 PolarHBondContact O-OG1 2.9Å
735	T	94.9	Very high	92	Very high	65 Å²	65	57.5 Å²	57.5	40%	0.399	32%	0.315	S	S	.	.	H	α-helix	trans	-68.4	-39.8	-171.7	56	0	0	0	0	113.6	I731 A732 T738 A739	I731-T735 HydrophobicContact CG2-CG2 3.7Å; I731-T735 PolarHBondContact O-N 3.19Å; I731-T735 PolarHBondContact O-OG1 2.96Å; A732-T735 PolarHBondContact O-N 3.4Å; T735-T738 PolarHBondContact O-OG1 3.23Å; T735-A739 WeakPolarHBondContact O-CB 3.4Å; T735-A739 PolarHBondContact O-N 3.48Å
736	F	95.7	Very high	92.9	Very high	35 Å²	35	63.8 Å²	63.8	15%	0.154	34%	0.343	C	S	.	.	H	α-helix	trans	-68.5	-50.9	-179.7	-80.5	-110.8	0	0	0	112.4	F556 F559 F610 A613 E617 A732 T738 Y740	F556-F736 HydrophobicContact CD1-CB 4.08Å; F556-F736 HydrophobicContact CD1-CD1 4.23Å; F556-F736 HydrophobicContact CE1-CB 3.93Å; F556-F736 AromaticContact CE1-CD1 3.8Å; F556-F736 HydrophobicContact CE1-CD1 3.8Å; F556-F736 HydrophobicContact CE1-CG 4.35Å; F556-F736 HydrophobicContact CE2-CB 4.42Å; F556-F736 HydrophobicContact CG-CB 4.42Å; F556-F736 HydrophobicContact CZ-CB 4.1Å; F559-F736 HydrophobicContact CE2-CB 3.67Å; F559-F736 HydrophobicContact CE2-CD1 4.07Å; F559-F736 HydrophobicContact CE2-CD2 4.01Å; F559-F736 AromaticContact CE2-CG 3.68Å; F559-F736 HydrophobicContact CE2-CG 3.68Å; F559-F736 HydrophobicContact CZ-CB 4.21Å; F559-F736 AromaticContact CZ-CD1 3.72Å; F559-F736 HydrophobicContact CZ-CD1 3.72Å; F559-F736 AromaticContact CZ-CD2 3.9Å; F559-F736 HydrophobicContact CZ-CD2 3.9Å; F559-F736 AromaticContact CZ-CE1 3.94Å; F559-F736 HydrophobicContact CZ-CE1 3.94Å; F559-F736 HydrophobicContact CZ-CE2 4.11Å; F559-F736 AromaticContact CZ-CG 3.7Å; F559-F736 HydrophobicContact CZ-CG 3.7Å; F559-F736 HydrophobicContact CZ-CZ 4.13Å; F610-F736 HydrophobicContact CD1-CD1 4.08Å; A613-F736 HydrophobicContact CB-CE1 3.66Å; A613-F736 HydrophobicContact CB-CZ 4.02Å; E617-F736 HydrophobicContact CB-CZ 4.46Å; A732-F736 HydrophobicContact CB-CD2 3.98Å; A732-F736 HydrophobicContact CB-CE2 4.09Å; A732-F736 PolarHBondContact O-N 2.88Å; A732-F736 VanDerWaalsContact O-N 3.12Å; F736-T738 PolarHBondContact O-N 3.44Å; F736-Y740 WeakPolarHBondContact O-CB 3.3Å; F736-Y740 PolarHBondContact O-N 3.5Å
737	P	95.8	Very high	93.5	Very high	50 Å²	50	58.8 Å²	58.8	33%	0.325	32%	0.321	S	S	.	.	H	α-helix	trans	-63.1	-38.8	177.6	-25.7	36.7	0	0	0	113.6	F556 R733 A741	F556-P737 HydrophobicContact CD2-CG 3.94Å; F556-P737 HydrophobicContact CE2-CG 4.42Å; R733-P737 WeakPolarHBondContact O-CD 3.49Å; R733-P737 WeakPolarHBondContact O-CG 3.44Å; P737-A741 VanDerWaalsContact O-CB 3.29Å; P737-A741 WeakPolarHBondContact O-CB 3.24Å; P737-A741 PolarHBondContact O-N 2.72Å
738	T	95.8	Very high	93.8	Very high	73 Å²	73	57.4 Å²	57.4	45%	0.448	31%	0.309	S	S	.	.	H	α-helix	trans	-69.5	-43.9	179	51.3	0	0	0	0	112.4	I734 T735 F736 Y740 A741 I742	I734-T738 HydrophobicContact CG2-CG2 4.41Å; I734-T738 WeakPolarHBondContact O-CB 3.09Å; I734-T738 WeakPolarHBondContact O-CG2 3.39Å; I734-T738 PolarHBondContact O-N 3.39Å; I734-T738 PolarHBondContact O-OG1 2.9Å; T735-T738 PolarHBondContact O-OG1 3.23Å; F736-T738 PolarHBondContact O-N 3.44Å; T738-Y740 PolarHBondContact O-N 3.45Å; T738-A741 PolarHBondContact O-N 2.84Å; T738-I742 WeakPolarHBondContact O-CD1 3.48Å; T738-I742 VanDerWaalsContact O-CG1 3.29Å; T738-I742 WeakPolarHBondContact O-CG1 3.29Å; T738-I742 PolarHBondContact O-N 2.78Å
739	A	96.4	Very high	94.1	Very high	44 Å²	44	59.8 Å²	59.8	36%	0.364	33%	0.326	S	S	.	.	H	α-helix	trans	-63.4	-39.9	174.6	0	0	0	0	0	112.2	F610 T735 I742 F743	F610-A739 HydrophobicContact CE1-CB 3.99Å; F610-A739 HydrophobicContact CZ-CB 3.93Å; T735-A739 WeakPolarHBondContact O-CB 3.4Å; T735-A739 PolarHBondContact O-N 3.48Å; A739-I742 PolarHBondContact O-N 3.16Å; A739-F743 PolarHBondContact O-N 3.29Å
740	Y	97.2	Very high	94.2	Very high	5 Å²	5	63.1 Å²	63.1	2%	0.02	34%	0.341	C	S	.	.	H	α-helix	trans	-68.6	-39.6	176.4	-171	-121	0	0	0	112.1	I549 V552 T553 F556 F610 F736 T738 I742 F743 L744	I549-Y740 HydrophobicContact CG1-CE1 4.43Å; I549-Y740 HydrophobicContact CG2-CE1 4.44Å; V552-Y740 HydrophobicContact CB-CE1 3.96Å; V552-Y740 HydrophobicContact CB-CE2 4.31Å; V552-Y740 HydrophobicContact CG1-CD1 3.92Å; V552-Y740 HydrophobicContact CG1-CD2 3.97Å; V552-Y740 HydrophobicContact CG1-CE1 3.73Å; V552-Y740 HydrophobicContact CG1-CE2 3.8Å; V552-Y740 HydrophobicContact CG1-CG 4.04Å; V552-Y740 HydrophobicContact CG2-CE2 4.28Å; T553-Y740 HydrophobicContact CG2-CE1 4.46Å; F556-Y740 HydrophobicContact CE2-CD1 4.33Å; F556-Y740 HydrophobicContact CE2-CG 4.46Å; F556-Y740 HydrophobicContact CZ-CG 4.37Å; F610-Y740 AromaticContact CD2-CD2 3.65Å; F610-Y740 HydrophobicContact CD2-CD2 3.65Å; F610-Y740 HydrophobicContact CD2-CE2 4.33Å; F610-Y740 AromaticContact CE2-CD2 3.76Å; F610-Y740 HydrophobicContact CE2-CD2 3.76Å; F610-Y740 HydrophobicContact CG-CD2 4.19Å; F610-Y740 HydrophobicContact CZ-CD2 4.37Å; F736-Y740 WeakPolarHBondContact O-CB 3.3Å; F736-Y740 PolarHBondContact O-N 3.5Å; T738-Y740 PolarHBondContact O-N 3.45Å; Y740-I742 PolarHBondContact O-N 3.19Å; Y740-F743 AromaticContact CD2-CD1 3.89Å; Y740-F743 HydrophobicContact CD2-CD1 3.89Å; Y740-F743 AromaticContact CE2-CD1 3.76Å; Y740-F743 HydrophobicContact CE2-CD1 3.76Å; Y740-F743 HydrophobicContact CE2-CE1 4.12Å; Y740-F743 WeakPolarHBondContact O-CB 3.34Å; Y740-F743 PolarHBondContact O-N 3.22Å; Y740-L744 HydrophobicContact CD1-CD1 4.05Å; Y740-L744 HydrophobicContact CD1-CG 4.32Å; Y740-L744 HydrophobicContact CE1-CD1 3.76Å; Y740-L744 HydrophobicContact CE1-CD2 4.17Å; Y740-L744 HydrophobicContact CE1-CG 4.06Å; Y740-L744 HydrophobicContact CE2-CD2 4.19Å; Y740-L744 HydrophobicContact CE2-CG 4.43Å; Y740-L744 WeakPolarHBondContact O-CG 3.37Å; Y740-L744 PolarHBondContact O-N 3.01Å
741	A	96.6	Very high	94	Very high	44 Å²	44	60.3 Å²	60.3	36%	0.364	32%	0.321	S	S	.	.	H	α-helix	trans	-62.2	-41.6	174.4	0	0	0	0	0	112.4	P737 T738 F743 L744 I745	P737-A741 VanDerWaalsContact O-CB 3.29Å; P737-A741 WeakPolarHBondContact O-CB 3.24Å; P737-A741 PolarHBondContact O-N 2.72Å; T738-A741 PolarHBondContact O-N 2.84Å; A741-F743 VanDerWaalsContact C-N 3.34Å; A741-L744 PolarHBondContact O-N 2.77Å; A741-I745 WeakPolarHBondContact O-CG1 3.47Å; A741-I745 PolarHBondContact O-N 2.88Å
742	I	96.5	Very high	93.2	Very high	117 Å²	117	62.4 Å²	62.4	60%	0.6	33%	0.327	S	S	*	.	H	α-helix	trans	-61.2	-43.4	173.1	-68.6	163.5	0	0	0	110.6	T738 A739 Y740 I745 F746	T738-I742 WeakPolarHBondContact O-CD1 3.48Å; T738-I742 VanDerWaalsContact O-CG1 3.29Å; T738-I742 WeakPolarHBondContact O-CG1 3.29Å; T738-I742 PolarHBondContact O-N 2.78Å; A739-I742 PolarHBondContact O-N 3.16Å; Y740-I742 PolarHBondContact O-N 3.19Å; I742-I745 PolarHBondContact O-N 3.35Å; I742-F746 WeakPolarHBondContact O-CB 3.21Å; I742-F746 PolarHBondContact O-N 2.74Å
743	F	96	Very high	91.6	Very high	27 Å²	27	65.1 Å²	65.1	12%	0.118	36%	0.355	C	S	.	.	H	α-helix	trans	-60.7	-46.5	174.4	166	-104.9	0	0	0	112.5	W603 V606 F610 A739 Y740 A741 I745 F746 F747	W603-F743 AromaticContact CE3-CE1 4Å; W603-F743 HydrophobicContact CE3-CE1 4Å; W603-F743 HydrophobicContact CE3-CZ 4.12Å; W603-F743 HydrophobicContact CZ3-CE1 4.04Å; V606-F743 HydrophobicContact CB-CD2 4.32Å; V606-F743 HydrophobicContact CB-CE1 4.17Å; V606-F743 HydrophobicContact CB-CE2 3.81Å; V606-F743 HydrophobicContact CB-CZ 3.73Å; V606-F743 HydrophobicContact CG1-CD1 3.8Å; V606-F743 HydrophobicContact CG1-CD2 3.69Å; V606-F743 HydrophobicContact CG1-CE1 3.8Å; V606-F743 HydrophobicContact CG1-CE2 3.69Å; V606-F743 HydrophobicContact CG1-CG 3.74Å; V606-F743 HydrophobicContact CG1-CZ 3.75Å; V606-F743 HydrophobicContact CG2-CD2 4.35Å; V606-F743 HydrophobicContact CG2-CE2 3.84Å; V606-F743 HydrophobicContact CG2-CZ 4.22Å; F610-F743 HydrophobicContact CE2-CB 4.5Å; A739-F743 PolarHBondContact O-N 3.29Å; Y740-F743 AromaticContact CD2-CD1 3.89Å; Y740-F743 HydrophobicContact CD2-CD1 3.89Å; Y740-F743 AromaticContact CE2-CD1 3.76Å; Y740-F743 HydrophobicContact CE2-CD1 3.76Å; Y740-F743 HydrophobicContact CE2-CE1 4.12Å; Y740-F743 WeakPolarHBondContact O-CB 3.34Å; Y740-F743 PolarHBondContact O-N 3.22Å; A741-F743 VanDerWaalsContact C-N 3.34Å; F743-I745 PolarHBondContact O-N 2.81Å; F743-F746 PolarHBondContact O-N 2.69Å; F743-F747 HydrophobicContact CD2-CB 4.46Å; F743-F747 HydrophobicContact CE2-CB 4.02Å; F743-F747 HydrophobicContact CE2-CD2 4.02Å; F743-F747 HydrophobicContact CE2-CG 4.38Å; F743-F747 HydrophobicContact CZ-CB 4.06Å; F743-F747 AromaticContact CZ-CD2 3.83Å; F743-F747 HydrophobicContact CZ-CD2 3.83Å; F743-F747 HydrophobicContact CZ-CG 4.11Å; F743-F747 WeakPolarHBondContact O-CB 3.37Å; F743-F747 PolarHBondContact O-N 3.31Å
744	L	95.4	Very high	89.6	Confident	32 Å²	32	68.1 Å²	68.1	17%	0.168	37%	0.37	C	S	.	.	H	α-helix	trans	-60.4	-44.9	179.1	-69.3	179.9	0	0	0	111.8	I549 W603 Y740 A741 F748	I549-L744 HydrophobicContact CD1-CD1 4.19Å; I549-L744 HydrophobicContact CD1-CD2 4.11Å; I549-L744 HydrophobicContact CG1-CD1 4.16Å; I549-L744 HydrophobicContact CG1-CD2 3.97Å; W603-L744 HydrophobicContact CH2-CD2 3.49Å; W603-L744 VanDerWaalsContact CH2-CD2 3.49Å; W603-L744 HydrophobicContact CZ3-CD2 3.52Å; Y740-L744 HydrophobicContact CD1-CD1 4.05Å; Y740-L744 HydrophobicContact CD1-CG 4.32Å; Y740-L744 HydrophobicContact CE1-CD1 3.76Å; Y740-L744 HydrophobicContact CE1-CD2 4.17Å; Y740-L744 HydrophobicContact CE1-CG 4.06Å; Y740-L744 HydrophobicContact CE2-CD2 4.19Å; Y740-L744 HydrophobicContact CE2-CG 4.43Å; Y740-L744 WeakPolarHBondContact O-CG 3.37Å; Y740-L744 PolarHBondContact O-N 3.01Å; A741-L744 PolarHBondContact O-N 2.77Å; L744-F748 HydrophobicContact CD2-CE2 4.21Å; L744-F748 WeakPolarHBondContact O-CD2 3.28Å; L744-F748 PolarHBondContact O-N 3.31Å
745	I	94.4	Very high	87.3	Confident	115 Å²	115	66.5 Å²	66.5	59%	0.59	37%	0.369	S	S	*	.	H	α-helix	trans	-61.9	-50	176.6	-66.4	165.3	0	0	0	109.9	A741 I742 F743 F747 V749	A741-I745 WeakPolarHBondContact O-CG1 3.47Å; A741-I745 PolarHBondContact O-N 2.88Å; I742-I745 PolarHBondContact O-N 3.35Å; F743-I745 PolarHBondContact O-N 2.81Å; I745-F747 PolarHBondContact O-N 2.77Å; I745-V749 HydrophobicContact CG2-CG2 4.25Å; I745-V749 VanDerWaalsContact O-CB 3.26Å; I745-V749 WeakPolarHBondContact O-CB 3.02Å; I745-V749 WeakPolarHBondContact O-CG2 3.38Å; I745-V749 PolarHBondContact O-N 2.69Å
746	F	94.2	Very high	86.9	Confident	132 Å²	132	66.6 Å²	66.6	58%	0.579	37%	0.368	S	S	*	.	H	α-helix	trans	-60.3	-47.2	178.9	178.6	-95	0	0	0	112.1	I742 F743 V749 H750	I742-F746 WeakPolarHBondContact O-CB 3.21Å; I742-F746 PolarHBondContact O-N 2.74Å; F743-F746 PolarHBondContact O-N 2.69Å; F746-V749 PolarHBondContact O-N 3.05Å; F746-H750 HydrophobicContact CE1-CB 4.46Å; F746-H750 WeakPolarHBondContact O-CB 3.41Å; F746-H750 PolarHBondContact O-N 3.11Å
747	F	94	Very high	86.5	Confident	2 Å²	2	68.3 Å²	68.3	1%	0.009	38%	0.379	C	S	.	.	H	α-helix	trans	-59.5	-52.3	-178.7	-178.6	-89.7	0	0	0	111.5	F464 F545 A599 V602 W603 F743 I745 Y751	F464-F747 HydrophobicContact CE2-CE1 4.35Å; F545-F747 HydrophobicContact CD1-CE1 4.47Å; F545-F747 AromaticContact CE1-CE1 3.67Å; F545-F747 HydrophobicContact CE1-CE1 3.67Å; F545-F747 HydrophobicContact CE1-CZ 4.03Å; F545-F747 HydrophobicContact CZ-CE1 4.12Å; F545-F747 HydrophobicContact CZ-CZ 4.46Å; A599-F747 HydrophobicContact CB-CZ 4.48Å; A599-F747 WeakPolarHBondContact O-CE2 3.42Å; V602-F747 HydrophobicContact CG1-CD2 4.45Å; V602-F747 HydrophobicContact CG1-CE2 4.48Å; W603-F747 HydrophobicContact CB-CE2 3.85Å; W603-F747 HydrophobicContact CB-CZ 3.84Å; W603-F747 HydrophobicContact CD2-CZ 4.46Å; W603-F747 AromaticContact CE3-CD1 3.76Å; W603-F747 HydrophobicContact CE3-CD1 3.76Å; W603-F747 HydrophobicContact CE3-CD2 4.26Å; W603-F747 AromaticContact CE3-CE1 3.67Å; W603-F747 HydrophobicContact CE3-CE1 3.67Å; W603-F747 HydrophobicContact CE3-CE2 4.18Å; W603-F747 HydrophobicContact CE3-CG 4.07Å; W603-F747 AromaticContact CE3-CZ 3.91Å; W603-F747 HydrophobicContact CE3-CZ 3.91Å; W603-F747 HydrophobicContact CG-CZ 4.46Å; W603-F747 HydrophobicContact CZ3-CD1 4.02Å; W603-F747 HydrophobicContact CZ3-CE1 4.26Å; W603-F747 HydrophobicContact CZ3-CG 4.46Å; F743-F747 HydrophobicContact CD2-CB 4.46Å; F743-F747 HydrophobicContact CE2-CB 4.02Å; F743-F747 HydrophobicContact CE2-CD2 4.02Å; F743-F747 HydrophobicContact CE2-CG 4.38Å; F743-F747 HydrophobicContact CZ-CB 4.06Å; F743-F747 AromaticContact CZ-CD2 3.83Å; F743-F747 HydrophobicContact CZ-CD2 3.83Å; F743-F747 HydrophobicContact CZ-CG 4.11Å; F743-F747 WeakPolarHBondContact O-CB 3.37Å; F743-F747 PolarHBondContact O-N 3.31Å; I745-F747 PolarHBondContact O-N 2.77Å; F747-Y751 HydrophobicContact CD1-CD2 4.35Å; F747-Y751 AromaticContact CD2-CD2 3.6Å; F747-Y751 HydrophobicContact CD2-CD2 3.6Å; F747-Y751 AromaticContact CD2-CE2 3.6Å; F747-Y751 HydrophobicContact CD2-CE2 3.6Å; F747-Y751 HydrophobicContact CE1-CD2 4.24Å; F747-Y751 AromaticContact CE2-CD2 3.48Å; F747-Y751 HydrophobicContact CE2-CD2 3.48Å; F747-Y751 VanDerWaalsContact CE2-CD2 3.48Å; F747-Y751 AromaticContact CE2-CE2 3.45Å; F747-Y751 HydrophobicContact CE2-CE2 3.45Å; F747-Y751 VanDerWaalsContact CE2-CE2 3.45Å; F747-Y751 HydrophobicContact CG-CD2 4.04Å; F747-Y751 HydrophobicContact CG-CE2 4.45Å; F747-Y751 AromaticContact CZ-CD2 3.81Å; F747-Y751 HydrophobicContact CZ-CD2 3.81Å; F747-Y751 HydrophobicContact CZ-CE2 4.19Å; F747-Y751 WeakPolarHBondContact O-CD2 3.44Å; F747-Y751 PolarHBondContact O-N 3.17Å
748	F	91.7	Very high	85.9	Confident	43 Å²	43	69.3 Å²	69.3	19%	0.189	38%	0.382	C	S	.	.	H	α-helix	trans	-72.6	-35.5	-178.9	-68.2	-57.8	0	0	0	112.7	F464 F541 F545 W603 L744 K752	F464-F748 HydrophobicContact CZ-CD1 4.22Å; F464-F748 HydrophobicContact CZ-CE1 4.16Å; F541-F748 HydrophobicContact CD1-CE1 4.4Å; F541-F748 AromaticContact CE1-CD1 3.88Å; F541-F748 HydrophobicContact CE1-CD1 3.88Å; F541-F748 AromaticContact CE1-CE1 3.41Å; F541-F748 HydrophobicContact CE1-CE1 3.41Å; F541-F748 VanDerWaalsContact CE1-CE1 3.41Å; F541-F748 HydrophobicContact CE1-CE2 4.47Å; F541-F748 AromaticContact CE1-CZ 3.76Å; F541-F748 HydrophobicContact CE1-CZ 3.76Å; F541-F748 AromaticContact CZ-CD1 3.96Å; F541-F748 HydrophobicContact CZ-CD1 3.96Å; F541-F748 AromaticContact CZ-CE1 3.86Å; F541-F748 HydrophobicContact CZ-CE1 3.86Å; F545-F748 HydrophobicContact CB-CZ 4.14Å; F545-F748 HydrophobicContact CD1-CE1 4.06Å; F545-F748 AromaticContact CD1-CZ 3.91Å; F545-F748 HydrophobicContact CD1-CZ 3.91Å; F545-F748 HydrophobicContact CD2-CE1 4.31Å; F545-F748 HydrophobicContact CE1-CE1 4.26Å; F545-F748 HydrophobicContact CE1-CZ 4.5Å; F545-F748 HydrophobicContact CE2-CE1 4.49Å; F545-F748 HydrophobicContact CG-CE1 4.11Å; F545-F748 AromaticContact CG-CZ 3.97Å; F545-F748 HydrophobicContact CG-CZ 3.97Å; F545-F748 HydrophobicContact CZ-CE1 4.47Å; W603-F748 HydrophobicContact CH2-CZ 4.24Å; W603-F748 HydrophobicContact CZ3-CE2 4.21Å; W603-F748 AromaticContact CZ3-CZ 3.92Å; W603-F748 HydrophobicContact CZ3-CZ 3.92Å; L744-F748 HydrophobicContact CD2-CE2 4.21Å; L744-F748 WeakPolarHBondContact O-CD2 3.28Å; L744-F748 PolarHBondContact O-N 3.31Å; F748-K752 WeakPolarHBondContact O-CA 3.35Å; F748-K752 WeakPolarHBondContact O-CB 3.16Å; F748-K752 PolarHBondContact O-N 2.99Å
749	V	91.1	Very high	85.4	Confident	103 Å²	103	69.1 Å²	69.1	62%	0.624	38%	0.378	S	S	*	.	H	α-helix	trans	-65.7	-42.5	174.3	171.1	0	0	0	0	111.1	I745 F746 G753	I745-V749 HydrophobicContact CG2-CG2 4.25Å; I745-V749 VanDerWaalsContact O-CB 3.26Å; I745-V749 WeakPolarHBondContact O-CB 3.02Å; I745-V749 WeakPolarHBondContact O-CG2 3.38Å; I745-V749 PolarHBondContact O-N 2.69Å; F746-V749 PolarHBondContact O-N 3.05Å; V749-G753 WeakPolarHBondContact O-CA 3.36Å; V749-G753 PolarHBondContact O-N 3Å
750	H	89.8	Confident	84.7	Confident	75 Å²	75	70.6 Å²	70.6	35%	0.347	38%	0.379	S	S	.	.	H	α-helix	trans	-65.1	-57.8	178.8	-171.8	78.5	0	0	0	111.2	F746 G753 F754	F746-H750 HydrophobicContact CE1-CB 4.46Å; F746-H750 WeakPolarHBondContact O-CB 3.41Å; F746-H750 PolarHBondContact O-N 3.11Å; H750-G753 PolarHBondContact O-N 3.42Å; H750-F754 AromaticContact CE1-CE2 3.68Å; H750-F754 AromaticContact ND1-CE2 3.89Å; H750-F754 AromaticContact NE2-CE2 3.83Å; H750-F754 WeakPolarHBondContact O-CD2 3.47Å
751	Y	85.7	Confident	83.8	Confident	24 Å²	24	75 Å²	75	9%	0.094	40%	0.403	C	S	.	.	H	α-helix	trans	-78.6	-23.2	-173.1	-68.8	-65.4	0	0	0	114.7	I461 A599 F747	I461-Y751 HydrophobicContact CB-CD1 4.43Å; I461-Y751 HydrophobicContact CG2-CD1 4.14Å; A599-Y751 HydrophobicContact CB-CD1 3.72Å; A599-Y751 HydrophobicContact CB-CD2 4.12Å; A599-Y751 HydrophobicContact CB-CE1 3.64Å; A599-Y751 HydrophobicContact CB-CE2 4.04Å; A599-Y751 HydrophobicContact CB-CG 3.97Å; F747-Y751 HydrophobicContact CD1-CD2 4.35Å; F747-Y751 AromaticContact CD2-CD2 3.6Å; F747-Y751 HydrophobicContact CD2-CD2 3.6Å; F747-Y751 AromaticContact CD2-CE2 3.6Å; F747-Y751 HydrophobicContact CD2-CE2 3.6Å; F747-Y751 HydrophobicContact CE1-CD2 4.24Å; F747-Y751 AromaticContact CE2-CD2 3.48Å; F747-Y751 HydrophobicContact CE2-CD2 3.48Å; F747-Y751 VanDerWaalsContact CE2-CD2 3.48Å; F747-Y751 AromaticContact CE2-CE2 3.45Å; F747-Y751 HydrophobicContact CE2-CE2 3.45Å; F747-Y751 VanDerWaalsContact CE2-CE2 3.45Å; F747-Y751 HydrophobicContact CG-CD2 4.04Å; F747-Y751 HydrophobicContact CG-CE2 4.45Å; F747-Y751 AromaticContact CZ-CD2 3.81Å; F747-Y751 HydrophobicContact CZ-CD2 3.81Å; F747-Y751 HydrophobicContact CZ-CE2 4.19Å; F747-Y751 WeakPolarHBondContact O-CD2 3.44Å; F747-Y751 PolarHBondContact O-N 3.17Å
752	K	75.3	Confident	82.9	Confident	139 Å²	139	77.2 Å²	77.2	60%	0.604	41%	0.406	S	S	*	.	H	α-helix	trans	-81.3	-23.7	169.9	-165.1	-179.2	176.2	-177.4	0	112.5	F748 F754 S755	F748-K752 WeakPolarHBondContact O-CA 3.35Å; F748-K752 WeakPolarHBondContact O-CB 3.16Å; F748-K752 PolarHBondContact O-N 2.99Å; K752-F754 PolarHBondContact O-N 2.75Å; K752-S755 PolarHBondContact O-N 2.94Å
753	G	59.6	Low	81.9	Confident	60 Å²	60	74.2 Å²	74.2	62%	0.619	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-3.6	177.2	0	0	0	0	0	115.1	V749 H750	V749-G753 WeakPolarHBondContact O-CA 3.36Å; V749-G753 PolarHBondContact O-N 3Å; H750-G753 PolarHBondContact O-N 3.42Å
754	F	52.3	Low	80.7	Confident	132 Å²	132	78.1 Å²	78.1	58%	0.579	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.6	12.3	172.4	-67.3	-63.1	0	0	0	113.3	I461 H750 K752	I461-F754 HydrophobicContact CD1-CB 4.38Å; I461-F754 HydrophobicContact CG2-CB 4.24Å; H750-F754 AromaticContact CE1-CE2 3.68Å; H750-F754 AromaticContact ND1-CE2 3.89Å; H750-F754 AromaticContact NE2-CE2 3.83Å; H750-F754 WeakPolarHBondContact O-CD2 3.47Å; K752-F754 PolarHBondContact O-N 2.75Å
755	S	44.9	Very low	79.4	Confident	80 Å²	80	82.3 Å²	82.3	56%	0.559	44%	0.436	S	S	*	.			trans	-106.8	0	172.9	170.2	0	0	0	0	111.6	R537 K752	R537-S755 VanDerWaalsContact CZ-OG 3.32Å; R537-S755 PolarHBondContact NH1-OG 2.99Å; R537-S755 PolarHBondContact NH2-OG 3.42Å; K752-S755 PolarHBondContact O-N 2.94Å

Retrieved 755 of 755 residues in 555.3 ms (Link to these results)

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