A0A077Z3U4_TRITR Loading...

Axin 1

AlphaFold DB , UniProt , Accession A0A077Z3U4, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 593 aa.

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(Predicted Aligned Error values between residue pairs)

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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	40.7	Very low	45.1	Very low	237 Å²	237	153.6 Å²	153.6	100%	1.167	86%	0.864	S	S	*	*				0	135.2	0	-54.4	169.8	88.1	0	0	106.9
2	S	37.9	Very low	44.7	Very low	108 Å²	108	153.3 Å²	153.3	76%	0.755	87%	0.868	S	S	*	*			cis	-163.6	167.7	-16.7	-80.3	0	0	0	0	107.6
3	A	45.4	Very low	45	Very low	95 Å²	95	149.2 Å²	149.2	79%	0.785	87%	0.866	S	S	*	*			trans	71	130.7	-172	0	0	0	0	0	112.5
4	A	44.1	Very low	44.8	Very low	102 Å²	102	150.3 Å²	150.3	84%	0.843	86%	0.859	S	S	*	*			cis	66.1	134.9	29.7	0	0	0	0	0	113.2
5	G	40.9	Very low	44.6	Very low	73 Å²	73	151.9 Å²	151.9	75%	0.753	86%	0.862	S	S	*	*			cis	144.1	113.4	3.9	0	0	0	0	0	108.3
6	K	48.8	Very low	45	Very low	198 Å²	198	147.9 Å²	147.9	86%	0.861	85%	0.847	S	S	*	*			trans	-168.3	164.2	-175.8	-131.6	175.4	-177	-177.5	0	112.5
7	L	54	Low	45.6	Very low	163 Å²	163	146.5 Å²	146.5	85%	0.853	84%	0.844	S	S	*	*			trans	86	66.3	174.6	-51.4	-174.1	0	0	0	115.8
8	D	39.8	Very low	46.3	Very low	156 Å²	156	147.6 Å²	147.6	83%	0.834	85%	0.846	S	S	*	*			trans	-77.9	123.1	142	-32.2	-104.4	0	0	0	108.7
9	E	49.5	Very low	47.6	Very low	197 Å²	197	145.5 Å²	145.5	92%	0.921	84%	0.838	S	S	*	*			trans	-178.4	175.8	147.4	-109.5	-173.6	121.5	0	0	111.3
10	E	46.4	Very low	48.5	Very low	177 Å²	177	144.7 Å²	144.7	83%	0.827	84%	0.838	S	S	*	*			trans	63.8	87.1	167.6	-160.2	174.6	-179.2	0	0	118.5
11	M	48.6	Very low	49.1	Very low	184 Å²	184	149.1 Å²	149.1	91%	0.906	84%	0.841	S	S	*	*				-172.8	71.3	122.9	-100.6	-172	-168.3	0	0	112
12	T	40.1	Very low	50.6	Low	149 Å²	149	143 Å²	143	91%	0.914	82%	0.819	S	S	*	*			trans	-105	98.3	165.2	49.6	0	0	0	0	109.6
13	A	48.3	Very low	52	Low	101 Å²	101	143.6 Å²	143.6	84%	0.835	82%	0.82	S	S	*	*			trans	-107.4	146.2	177.4	0	0	0	0	0	111.6
14	E	43	Very low	52.1	Low	164 Å²	164	144 Å²	144	77%	0.766	82%	0.824	S	S	*	*			trans	-61.8	140.4	-159.9	-64.7	-164.4	142.4	0	0	117.7	S16	E14-S16 PolarHBondContact O-N 2.67Å; E14-S16 PolarHBondContact OE2-OG 2.97Å
15	L	41.1	Very low	52.8	Low	175 Å²	175	146.2 Å²	146.2	92%	0.916	83%	0.826	S	S	*	*			trans	-83.5	87.1	146.1	-86.7	158.4	0	0	0	109.5	P17	L15-P17 WeakPolarHBondContact O-CD 3.23Å
16	S	51.9	Low	53	Low	88 Å²	88	146 Å²	146	62%	0.615	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-80.9	116	178.4	-124.5	0	0	0	0	111.1	E14	E14-S16 PolarHBondContact O-N 2.67Å; E14-S16 PolarHBondContact OE2-OG 2.97Å
17	P	55	Low	52.8	Low	123 Å²	123	141 Å²	141	80%	0.799	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-79.9	135.3	-176.2	-12.1	29.4	0	0	0	112.8	L15	L15-P17 WeakPolarHBondContact O-CD 3.23Å
18	L	58.5	Low	52.2	Low	166 Å²	166	138.4 Å²	138.4	87%	0.869	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-67.7	140.7	175.8	-70.3	173.5	0	0	0	112.1
19	P	70.1	Confident	52.5	Low	109 Å²	109	139.7 Å²	139.7	71%	0.708	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-70.2	153.7	-173.9	28.1	-35.8	0	0	0	113.5
20	P	65.1	Low	52.1	Low	128 Å²	128	137.9 Å²	137.9	83%	0.831	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-67.5	139.1	-178.2	27.8	-34.9	0	0	0	112.4
21	R	62	Low	52	Low	238 Å²	238	134 Å²	134	90%	0.898	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-67.9	135.4	179.1	-172.2	-177.9	-175.5	-173.1	2	111.1
22	P	71.4	Confident	51.7	Low	108 Å²	108	129.9 Å²	129.9	70%	0.701	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-64.3	149.9	177	26.4	-34.9	0	0	0	112.2
23	P	67	Low	51.8	Low	122 Å²	122	130 Å²	130	79%	0.792	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-69	150.9	-178.8	29.3	-35.4	0	0	0	112.2
24	A	48.9	Very low	51.5	Low	103 Å²	103	130.8 Å²	130.8	85%	0.851	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-73.7	129.2	175.4	0	0	0	0	0	111	G26	A24-G26 PolarHBondContact O-N 3.25Å
25	V	57.8	Low	51.3	Low	148 Å²	148	127 Å²	127	90%	0.897	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-70.6	125.5	174.4	176.6	0	0	0	0	109.4
26	G	45.6	Very low	51.3	Low	68 Å²	68	122.7 Å²	122.7	70%	0.701	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-75.8	173.9	-179.8	0	0	0	0	0	114	A24	A24-G26 PolarHBondContact O-N 3.25Å
27	A	44.8	Very low	50.9	Low	94 Å²	94	129.8 Å²	129.8	78%	0.777	81%	0.814	S	S	*	*			trans	-90.1	174	-174.4	0	0	0	0	0	114.1
28	S	41.4	Very low	50.4	Low	108 Å²	108	127.9 Å²	127.9	76%	0.755	80%	0.804	S	S	*	*			trans	60.1	109.8	161.8	60.5	0	0	0	0	118.8
29	F	45.7	Very low	49.7	Very low	184 Å²	184	128.7 Å²	128.7	81%	0.807	80%	0.803	S	S	*	*				-147.2	102.1	128.5	-160.5	-98.1	0	0	0	110.6	S31	F29-S31 VanDerWaalsContact CE1-OG 3.23Å; F29-S31 WeakPolarHBondContact CE1-OG 3.03Å
30	D	40.8	Very low	48.5	Very low	158 Å²	158	128.3 Å²	128.3	85%	0.845	80%	0.803	S	S	*	*			trans	-81.5	123.9	168.4	-75.5	-61.4	0	0	0	109.7
31	S	44.5	Very low	47.6	Very low	96 Å²	96	128 Å²	128	67%	0.671	80%	0.803	S	S	*	*			trans	-159.9	132.5	161.2	-83	0	0	0	0	110.5	F29	F29-S31 VanDerWaalsContact CE1-OG 3.23Å; F29-S31 WeakPolarHBondContact CE1-OG 3.03Å
32	A	41.8	Very low	46.6	Very low	98 Å²	98	123.7 Å²	123.7	81%	0.81	80%	0.798	S	S	*	*			trans	-85.1	150.2	-173.7	0	0	0	0	0	112.8
33	T	42.7	Very low	45.6	Very low	150 Å²	150	127.4 Å²	127.4	92%	0.92	81%	0.809	S	S	*	*			trans	-152	160.9	145.9	-3.6	0	0	0	0	110.1
34	S	41.9	Very low	44.5	Very low	119 Å²	119	130.7 Å²	130.7	83%	0.832	81%	0.81	S	S	*	*			trans	-106.3	153.8	-162.8	52.6	0	0	0	0	113.9
35	G	40.3	Very low	44.4	Very low	85 Å²	85	132 Å²	132	88%	0.876	81%	0.807	S	S	*	*			trans	147.9	143.1	158.2	0	0	0	0	0	115.2
36	G	40.4	Very low	43.9	Very low	84 Å²	84	130 Å²	130	87%	0.866	80%	0.8	S	S	*	*			trans	117	92.9	170.8	0	0	0	0	0	114.5
37	R	42.3	Very low	43.5	Very low	237 Å²	237	134 Å²	134	89%	0.894	81%	0.805	S	S	*	*			trans	-101.8	145.6	168.8	-63.9	164.5	65.8	-167.9	3.8	109.4
38	S	45.7	Very low	43.6	Very low	82 Å²	82	135 Å²	135	57%	0.573	80%	0.804	S	S	*	*				138.8	151.1	117.7	-65.1	0	0	0	0	115.5
39	H	44.3	Very low	43.4	Very low	183 Å²	183	134.4 Å²	134.4	85%	0.847	80%	0.8	S	S	*	*			trans	72.6	153.6	162.3	-52.3	-63.4	0	0	0	119
40	S	43.3	Very low	43.2	Very low	102 Å²	102	136.9 Å²	136.9	71%	0.713	80%	0.804	S	S	*	*			cis	171.7	113.3	-40.1	160.6	0	0	0	0	110
41	S	46.9	Very low	43.2	Very low	120 Å²	120	136.2 Å²	136.2	84%	0.839	80%	0.799	S	S	*	*			trans	-177.6	123.5	145.4	26.5	0	0	0	0	112.4
42	D	41.1	Very low	43.1	Very low	149 Å²	149	138.4 Å²	138.4	80%	0.797	80%	0.804	S	S	*	*			trans	-78.4	152.5	161.2	-66.2	-96.1	0	0	0	111.1
43	M	51.4	Low	43.1	Very low	186 Å²	186	141.8 Å²	141.8	92%	0.916	80%	0.8	S	S	*	*			trans	-145	158.9	139.1	-95.4	-54.8	118.5	0	0	110.1
44	K	43.3	Very low	43.3	Very low	190 Å²	190	144.7 Å²	144.7	83%	0.826	80%	0.796	S	S	*	*			trans	-138.9	179	-160.8	-177	173	175.2	178.1	0	109.9
45	V	45.6	Very low	43.3	Very low	130 Å²	130	146.2 Å²	146.2	79%	0.788	80%	0.795	S	S	*	*			trans	85.4	136.5	171.9	-176.7	0	0	0	0	113.8
46	S	47.4	Very low	43.4	Very low	106 Å²	106	147.2 Å²	147.2	74%	0.741	79%	0.788	S	S	*	*			cis	-165.3	153.7	-24.9	-93.5	0	0	0	0	109.9
47	D	37	Very low	43.3	Very low	152 Å²	152	154.8 Å²	154.8	81%	0.813	79%	0.791	S	S	*	*			trans	-70.5	153.5	160.2	-120.1	-50.1	0	0	0	110.6
48	P	47.4	Very low	43.2	Very low	117 Å²	117	147.9 Å²	147.9	76%	0.76	78%	0.784	S	S	*	*				-154.4	168.4	81.2	41.2	-22	0	0	0	118.4
49	S	38.1	Very low	43	Very low	95 Å²	95	153.3 Å²	153.3	66%	0.664	80%	0.8	S	S	*	*			trans	-60.3	151.8	170.3	65.4	0	0	0	0	116.2
50	R	40.5	Very low	42.7	Very low	235 Å²	235	149.9 Å²	149.9	89%	0.887	80%	0.797	S	S	*	*				-171.4	167.7	118.9	-103.9	166.8	-170.5	-148.3	1.6	114.8
51	L	41.6	Very low	43	Very low	144 Å²	144	151.3 Å²	151.3	75%	0.754	80%	0.804	S	S	*	*			trans	-61.6	159	-171.6	-67.6	64.9	0	0	0	114.7
52	N	43.1	Very low	42.8	Very low	142 Å²	142	153.1 Å²	153.1	76%	0.759	80%	0.803	S	S	*	*			trans	-141.3	159.4	132.4	-149.6	-10	0	0	0	112
53	K	41.6	Very low	42.9	Very low	170 Å²	170	154.5 Å²	154.5	74%	0.739	81%	0.81	S	S	*	*			trans	-135	115.7	-172.3	-91	-174	172.7	-178.3	0	112.9
54	Y	47.1	Very low	42.5	Very low	211 Å²	211	152.1 Å²	152.1	83%	0.827	81%	0.805	S	S	*	*			trans	-148.4	123	155.5	-63.1	-83.5	0	0	0	105.8
55	N	40.3	Very low	42.3	Very low	151 Å²	151	148.9 Å²	148.9	81%	0.807	80%	0.802	S	S	*	*			cis	82.2	139.5	22.2	-158	23.7	0	0	0	115.8
56	S	43.1	Very low	42.1	Very low	105 Å²	105	148.8 Å²	148.8	73%	0.734	81%	0.807	S	S	*	*			trans	69.6	143.5	-171	86.9	0	0	0	0	114.4
57	R	38	Very low	41.9	Very low	244 Å²	244	155.1 Å²	155.1	92%	0.921	81%	0.814	S	S	*	*			cis	-152.8	150.6	-11.9	-149.7	168.4	179	149	-3.9	109.4
58	A	39.9	Very low	42.2	Very low	92 Å²	92	157.9 Å²	157.9	76%	0.76	82%	0.819	S	S	*	*			trans	-86.1	150.1	172.6	0	0	0	0	0	111.8
59	Q	41.9	Very low	42	Very low	196 Å²	196	157.2 Å²	157.2	92%	0.916	82%	0.818	S	S	*	*			trans	-154.5	120.9	160.3	-116.8	171.6	8.3	0	0	111
60	S	37.9	Very low	42.3	Very low	110 Å²	110	158 Å²	158	77%	0.769	82%	0.823	S	S	*	*			trans	-111.7	132.5	164.5	-49.9	0	0	0	0	107.6	L62	S60-L62 PolarHBondContact O-N 3.15Å
61	P	50.3	Low	42.5	Very low	133 Å²	133	158.9 Å²	158.9	86%	0.864	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-78	122.1	173.9	30.1	-31.3	0	0	0	110.3
62	L	41.3	Very low	42.6	Very low	158 Å²	158	157 Å²	157	83%	0.827	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-96.9	157.7	166.9	-77.8	173.1	0	0	0	110.6	S60 V64	S60-L62 PolarHBondContact O-N 3.15Å; L62-V64 PolarHBondContact O-N 3.08Å
63	L	43.9	Very low	42.6	Very low	177 Å²	177	154 Å²	154	93%	0.927	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-59.1	129.7	177.5	-61	169.2	0	0	0	111.6
64	V	43.8	Very low	42.8	Very low	137 Å²	137	151.8 Å²	151.8	83%	0.83	84%	0.84	S	S	*	*			trans	-131.5	136.8	164.6	179.9	0	0	0	0	108.8	L62	L62-V64 PolarHBondContact O-N 3.08Å
65	T	37.9	Very low	42.5	Very low	122 Å²	122	149.2 Å²	149.2	75%	0.748	84%	0.84	S	S	*	*			trans	-86.9	163.1	-176.1	60.2	0	0	0	0	112.1
66	S	41.5	Very low	42.7	Very low	128 Å²	128	147 Å²	147	90%	0.895	84%	0.837	S	S	*	*			trans	-141.9	127.9	160.4	-83.6	0	0	0	0	110.7
67	R	43.3	Very low	43.1	Very low	238 Å²	238	149.4 Å²	149.4	90%	0.898	84%	0.841	S	S	*	*			trans	-117.1	106.1	-179.7	-76.9	180	168.7	-174	-2.7	110.3
68	K	43.5	Very low	43.1	Very low	210 Å²	210	147.3 Å²	147.3	91%	0.913	84%	0.839	S	S	*	*			trans	-177.8	154.7	153.5	-105.3	161.1	-179.1	179.9	0	108.5
69	S	44.1	Very low	43.4	Very low	104 Å²	104	148.7 Å²	148.7	73%	0.727	84%	0.84	S	S	*	*			cis	-134.7	147.5	1	-170.6	0	0	0	0	111.2
70	S	44.2	Very low	43.6	Very low	112 Å²	112	149.3 Å²	149.3	78%	0.783	83%	0.834	S	S	*	*			trans	-71.3	140	169.5	52.1	0	0	0	0	111.8
71	R	44.9	Very low	43.9	Very low	253 Å²	253	152.3 Å²	152.3	96%	0.955	84%	0.836	S	S	*	*			trans	-150.5	121	152.4	-156.4	169.5	-178.7	178.1	-2.6	109.1
72	A	43.4	Very low	43.6	Very low	105 Å²	105	149.2 Å²	149.2	87%	0.868	83%	0.828	S	S	*	*			trans	-130.2	157.2	178.9	0	0	0	0	0	109.5
73	G	43.7	Very low	43.8	Very low	79 Å²	79	147.1 Å²	147.1	81%	0.814	83%	0.827	S	S	*	*			trans	115.7	137.6	-172.1	0	0	0	0	0	111
74	S	44	Very low	44.1	Very low	122 Å²	122	147.4 Å²	147.4	85%	0.853	82%	0.823	S	S	*	*			cis	-147.7	162	-4.4	-172.5	0	0	0	0	110.7
75	L	42.3	Very low	44	Very low	157 Å²	157	149.4 Å²	149.4	82%	0.822	82%	0.823	S	S	*	*			trans	-75.1	175.1	168.5	-79.5	160.6	0	0	0	111.9
76	S	43.4	Very low	44.4	Very low	106 Å²	106	147.9 Å²	147.9	74%	0.741	82%	0.823	S	S	*	*			trans	64.6	119.7	-178.4	53.3	0	0	0	0	114.5
77	D	51.4	Low	45.4	Very low	155 Å²	155	147.2 Å²	147.2	83%	0.829	82%	0.816	S	S	*	*				-144	149.8	50.1	-81.6	-38.7	0	0	0	116.5
78	F	39.3	Very low	45.7	Very low	200 Å²	200	144.7 Å²	144.7	88%	0.877	82%	0.819	S	S	*	*			trans	-107.3	155	152.8	-81.2	-81.5	0	0	0	106.5
79	P	46.3	Very low	45.7	Very low	120 Å²	120	138 Å²	138	78%	0.779	81%	0.809	S	S	*	*			cis	-151.5	178.4	43.3	41	-20.2	0	0	0	117.9
80	R	46.4	Very low	46.1	Very low	210 Å²	210	143.2 Å²	143.2	79%	0.792	82%	0.815	S	S	*	*				137.9	106.7	121	-169.5	173.1	-177.8	-148	-3.4	115.7
81	E	43.6	Very low	46.5	Very low	173 Å²	173	147 Å²	147	81%	0.808	82%	0.82	S	S	*	*			trans	29.6	112.3	139.1	-51.5	171.2	136.5	0	0	119.7
82	G	42.9	Very low	47	Very low	67 Å²	67	140.6 Å²	140.6	69%	0.691	81%	0.809	S	S	*	*			trans	163.6	110.8	156.3	0	0	0	0	0	116
83	S	46.6	Very low	47.4	Very low	115 Å²	115	140 Å²	140	80%	0.804	80%	0.797	S	S	*	*			trans	53.8	139.3	161.6	52.3	0	0	0	0	120.2
84	E	48.8	Very low	47.6	Very low	182 Å²	182	144.5 Å²	144.5	85%	0.85	80%	0.803	S	S	*	*			trans	-52.4	132.8	-179	45.7	-100.5	96.4	0	0	117.4
85	E	43.5	Very low	48.1	Very low	180 Å²	180	145.2 Å²	145.2	84%	0.841	80%	0.797	S	S	*	*			trans	-47.1	147.8	157.5	-160.1	163.1	-158.2	0	0	111.4
86	A	45.8	Very low	48.5	Very low	89 Å²	89	144.7 Å²	144.7	74%	0.736	80%	0.795	S	S	*	*			cis	-143.8	142.5	42.6	0	0	0	0	0	115.7
87	P	61.9	Low	49	Very low	115 Å²	115	147.1 Å²	147.1	75%	0.747	80%	0.799	S	S	*	*			trans	-71.1	131.4	171	-17.8	32	0	0	0	113.5
88	L	49.2	Very low	48.9	Very low	184 Å²	184	143.1 Å²	143.1	96%	0.963	80%	0.795	S	S	*	*			trans	-71.9	124.3	157.3	-71.4	164.2	0	0	0	108.3
89	G	44.7	Very low	49.5	Very low	69 Å²	69	141.3 Å²	141.3	71%	0.711	80%	0.795	S	S	*	*			trans	178.9	56.8	-171.5	0	0	0	0	0	116.6
90	Y	52.1	Low	49.7	Very low	214 Å²	214	144.1 Å²	144.1	84%	0.839	80%	0.803	S	S	*	*			trans	-137.6	90.9	153	43.6	-92.8	0	0	0	109.6	V92	Y90-V92 PolarHBondContact O-N 3.31Å
91	E	52.5	Low	49.9	Very low	191 Å²	191	141 Å²	141	89%	0.893	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-67.3	121.9	154.1	-66.9	-174.8	160.4	0	0	106.8
92	V	55.7	Low	50.3	Low	119 Å²	119	137 Å²	137	72%	0.721	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-88	123.5	161.7	178.1	0	0	0	0	105.1	Y90 D94	Y90-V92 PolarHBondContact O-N 3.31Å; V92-D94 PolarHBondContact O-N 2.92Å
93	C	52.1	Low	50.6	Low	92 Å²	92	137.7 Å²	137.7	62%	0.622	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-68.6	121.9	-176.3	-53.5	0	0	0	0	110.3	D95	C93-D95 WeakPolarHBondContact CB-OD2 3.17Å; C93-D95 PolarHBondContact O-N 3.02Å
94	D	47.1	Very low	51.1	Low	175 Å²	175	137.1 Å²	137.1	94%	0.936	79%	0.786	S	S	*	*			trans	-80.1	62.8	166.8	-72.6	-52	0	0	0	109.9	V92	V92-D94 PolarHBondContact O-N 2.92Å
95	D	53.8	Low	51.3	Low	137 Å²	137	137.7 Å²	137.7	73%	0.733	78%	0.782	S	S	*	*			trans	-124	146	169	-61.6	-71.7	0	0	0	106	C93	C93-D95 WeakPolarHBondContact CB-OD2 3.17Å; C93-D95 PolarHBondContact O-N 3.02Å
96	D	52.6	Low	51.7	Low	145 Å²	145	133.6 Å²	133.6	78%	0.775	77%	0.774	S	S	*	*			cis	176.3	146.6	-6.9	-179.8	-131.2	0	0	0	102.5
97	D	52.5	Low	52	Low	157 Å²	157	135.7 Å²	135.7	84%	0.84	77%	0.768	S	S	*	*			trans	-14.3	127.3	-175	-68	-28.3	0	0	0	120.8
98	G	50.5	Low	51.6	Low	72 Å²	72	141.1 Å²	141.1	74%	0.742	77%	0.774	S	S	*	*			trans	159.2	118.3	152.7	0	0	0	0	0	119.6
99	D	50.7	Low	52.2	Low	161 Å²	161	136.2 Å²	136.2	86%	0.861	76%	0.76	S	S	*	*			trans	47.6	88.9	150.3	-59.2	-36.9	0	0	0	120.1	D101	D99-D101 PolarHBondContact O-N 2.72Å
100	D	51.8	Low	53.2	Low	180 Å²	180	135.7 Å²	135.7	96%	0.963	74%	0.743	S	S	*	*			trans	-66.3	65.3	160.3	-92.8	-64.7	0	0	0	112.6	A102	D100-A102 PolarHBondContact O-N 3.2Å
101	D	50.3	Low	54.1	Low	144 Å²	144	127.6 Å²	127.6	77%	0.77	72%	0.716	S	S	*	*			trans	-81.8	104.1	166.5	-171.5	36.2	0	0	0	110.3	D99 S103	D99-D101 PolarHBondContact O-N 2.72Å; D101-S103 PolarHBondContact O-N 3.11Å
102	A	52.3	Low	55.2	Low	89 Å²	89	122 Å²	122	74%	0.736	70%	0.696	S	S	*	*			trans	-66.2	99.9	-172.3	0	0	0	0	0	112.3	D100 P104	D100-A102 PolarHBondContact O-N 3.2Å; A102-P104 WeakPolarHBondContact O-CD 3.49Å; A102-P104 VanDerWaalsContact O-N 3.11Å
103	S	49.2	Very low	56.3	Low	82 Å²	82	119.2 Å²	119.2	57%	0.573	67%	0.673	S	S	*	*			trans	-45.7	113.4	-176.9	-179.3	0	0	0	0	113.3	D101 Y105	D101-S103 PolarHBondContact O-N 3.11Å; S103-Y105 PolarHBondContact O-N 3.24Å
104	P	55.7	Low	57.7	Low	102 Å²	102	119.6 Å²	119.6	66%	0.662	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76	16	-168.1	30	-37	0	0	0	114.7	A102	A102-P104 WeakPolarHBondContact O-CD 3.49Å; A102-P104 VanDerWaalsContact O-N 3.11Å
105	Y	53.2	Low	59.4	Low	195 Å²	195	114.1 Å²	114.1	77%	0.765	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.5	-24.2	-175.6	-91.8	-88.1	0	0	0	115.1	S103	S103-Y105 PolarHBondContact O-N 3.24Å
106	S	53	Low	61.1	Low	94 Å²	94	107.7 Å²	107.7	66%	0.657	60%	0.599	S	S	*	*	S	Bend	trans	-70	-37	-176.9	-63.1	0	0	0	0	113.4	R108 A109	S106-R108 VanDerWaalsContact C-N 3.35Å; S106-R108 PolarHBondContact O-N 3.26Å; S106-A109 PolarHBondContact O-N 2.86Å
107	E	51.8	Low	62.7	Low	133 Å²	133	102.8 Å²	102.8	62%	0.621	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.1	-19.4	-166.2	-144.2	-156.9	-133.2	0	0	114.6	R115	E107-R115 PolarHBondContact O-NH1 2.92Å; E107-R115 IonicContact OE2-CZ 3.94Å; E107-R115 IonicContact OE2-NH1 2.91Å; E107-R115 PolarHBondContact OE2-NH1 3.45Å; E107-R115 IonicContact OE2-NH2 2.77Å
108	R	53	Low	64.2	Low	228 Å²	228	100.8 Å²	100.8	86%	0.86	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.4	-6.1	-179.1	-71.2	-174.4	176	-178.9	0.4	114.6	S106	S106-R108 VanDerWaalsContact C-N 3.35Å; S106-R108 PolarHBondContact O-N 3.26Å
109	A	61.2	Low	65.8	Low	82 Å²	82	101.3 Å²	101.3	68%	0.678	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.7	-27.1	179	0	0	0	0	0	113	S106	S106-A109 PolarHBondContact O-N 2.86Å
110	T	66.3	Low	67.6	Low	58 Å²	58	93.9 Å²	93.9	36%	0.356	52%	0.518	S	S	.	.	S	Bend	trans	-69.1	123.4	-177.8	-54.6	0	0	0	0	111.3	M114 R115	T110-M114 HydrophobicContact CG2-CB 3.59Å; T110-R115 HydrophobicContact CG2-CG 3.82Å
111	P	71.4	Confident	69.2	Low	43 Å²	43	88 Å²	88	28%	0.279	49%	0.485	S	S	.	.			trans	-55.4	147.8	177.9	-26.9	35	0	0	0	112.7	Y113 M114 R115	P111-Y113 VanDerWaalsContact C-N 3.3Å; P111-Y113 HydrophobicContact CB-CD1 3.77Å; P111-Y113 HydrophobicContact CB-CE1 3.34Å; P111-Y113 HydrophobicContact CB-CE2 4.19Å; P111-Y113 HydrophobicContact CB-CG 4.35Å; P111-Y113 HydrophobicContact CG-CE1 4.16Å; P111-Y113 PolarHBondContact O-N 2.82Å; P111-M114 HydrophobicContact CG-SD 4.31Å; P111-M114 PolarHBondContact O-N 3.28Å; P111-R115 PolarHBondContact O-N 3.43Å; P111-R115 VanDerWaalsContact O-N 3.13Å
112	P	75.2	Confident	70.8	Confident	73 Å²	73	82.4 Å²	82.4	47%	0.474	45%	0.454	S	S	.	.	H	α-helix	trans	-54.3	-45.5	-174.9	-26.6	34.4	0	0	0	112.8	M114 R115 W116 D126	P112-M114 PolarHBondContact O-N 3.26Å; P112-M114 VanDerWaalsContact O-N 3.13Å; P112-R115 WeakPolarHBondContact O-CA 3.44Å; P112-R115 WeakPolarHBondContact O-CB 3.39Å; P112-R115 PolarHBondContact O-N 3.02Å; P112-W116 PolarHBondContact O-N 2.8Å; P112-W116 PolarHBondContact O-NE1 3.02Å; P112-D126 WeakPolarHBondContact CB-OD2 3.3Å
113	Y	78.2	Confident	72.5	Confident	61 Å²	61	78.1 Å²	78.1	24%	0.239	42%	0.419	C	S	.	.	H	α-helix	trans	-58.4	-25.8	177.3	63.9	-101.1	0	0	0	114.5	P111 Y235 L239 I242	P111-Y113 VanDerWaalsContact C-N 3.3Å; P111-Y113 HydrophobicContact CB-CD1 3.77Å; P111-Y113 HydrophobicContact CB-CE1 3.34Å; P111-Y113 HydrophobicContact CB-CE2 4.19Å; P111-Y113 HydrophobicContact CB-CG 4.35Å; P111-Y113 HydrophobicContact CG-CE1 4.16Å; P111-Y113 PolarHBondContact O-N 2.82Å; Y113-Y235 WeakPolarHBondContact O-CE2 3.44Å; Y113-Y235 PolarHBondContact O-OH 3.24Å; Y113-L239 HydrophobicContact CD2-CD2 3.49Å; Y113-L239 VanDerWaalsContact CD2-CD2 3.49Å; Y113-L239 HydrophobicContact CE2-CD2 4.15Å; Y113-L239 HydrophobicContact CG-CD2 4.37Å; Y113-I242 HydrophobicContact CD1-CD1 3.66Å; Y113-I242 HydrophobicContact CD1-CG2 4.44Å; Y113-I242 HydrophobicContact CD2-CD1 4.01Å; Y113-I242 HydrophobicContact CE1-CD1 4.12Å; Y113-I242 HydrophobicContact CE1-CG2 3.79Å; Y113-I242 HydrophobicContact CE2-CD1 4.43Å; Y113-I242 HydrophobicContact CE2-CG2 4.36Å; Y113-I242 HydrophobicContact CG-CD1 3.6Å
114	M	80.8	Confident	74.3	Confident	100 Å²	100	74.7 Å²	74.7	49%	0.493	39%	0.394	S	S	.	.	H	α-helix	trans	-83.7	-35.4	172.2	-67.7	-178.2	69.7	0	0	111.9	T110 P111 P112 W116 A117	T110-M114 HydrophobicContact CG2-CB 3.59Å; P111-M114 HydrophobicContact CG-SD 4.31Å; P111-M114 PolarHBondContact O-N 3.28Å; P112-M114 PolarHBondContact O-N 3.26Å; P112-M114 VanDerWaalsContact O-N 3.13Å; M114-W116 PolarHBondContact O-N 3.21Å; M114-A117 PolarHBondContact O-N 2.83Å
115	R	84.5	Confident	75.7	Confident	60 Å²	60	76.3 Å²	76.3	23%	0.226	39%	0.393	C	S	.	.	H	α-helix	trans	-62.1	-28.5	173	-70	-174.5	57.5	126.2	1	111.9	E107 T110 P111 P112 A117 V118 N122	E107-R115 PolarHBondContact O-NH1 2.92Å; E107-R115 IonicContact OE2-CZ 3.94Å; E107-R115 IonicContact OE2-NH1 2.91Å; E107-R115 PolarHBondContact OE2-NH1 3.45Å; E107-R115 IonicContact OE2-NH2 2.77Å; T110-R115 HydrophobicContact CG2-CG 3.82Å; P111-R115 PolarHBondContact O-N 3.43Å; P111-R115 VanDerWaalsContact O-N 3.13Å; P112-R115 WeakPolarHBondContact O-CA 3.44Å; P112-R115 WeakPolarHBondContact O-CB 3.39Å; P112-R115 PolarHBondContact O-N 3.02Å; R115-A117 PolarHBondContact O-N 2.8Å; R115-V118 PolarHBondContact O-N 3.25Å; R115-N122 HydrophobicContact CB-CB 4.09Å; R115-N122 PolarHBondContact NE-OD1 3.32Å; R115-N122 VanDerWaalsContact NE-OD1 3.07Å; R115-N122 PolarHBondContact NH2-OD1 2.91Å; R115-N122 VanDerWaalsContact O-CB 3.24Å; R115-N122 WeakPolarHBondContact O-CB 3.43Å; R115-N122 PolarHBondContact O-ND2 2.78Å
116	W	88.6	Confident	77.4	Confident	3 Å²	3	68.9 Å²	68.9	1%	0.011	37%	0.367	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-31.9	174.4	-64.3	0.6	0	0	0	113.5	P112 M114 V118 V123 D126 E128 G129 L132 H226 Y235 Y238	P112-W116 PolarHBondContact O-N 2.8Å; P112-W116 PolarHBondContact O-NE1 3.02Å; M114-W116 PolarHBondContact O-N 3.21Å; W116-V118 VanDerWaalsContact C-N 3.35Å; W116-V123 HydrophobicContact CB-CG2 3.79Å; W116-V123 HydrophobicContact CG-CG2 4.26Å; W116-V123 WeakPolarHBondContact O-CG2 3.24Å; W116-D126 HydrophobicContact CZ2-CB 4.35Å; W116-D126 WeakPolarHBondContact CZ2-OD2 3.42Å; W116-D126 VanDerWaalsContact NE1-CB 3.3Å; W116-D126 VanDerWaalsContact NE1-CG 3.33Å; W116-D126 PolarHBondContact NE1-OD2 3.15Å; W116-E128 HydrophobicContact CH2-CB 4.01Å; W116-E128 HydrophobicContact CH2-CG 4.17Å; W116-E128 HydrophobicContact CZ2-CB 4.04Å; W116-G129 VanDerWaalsContact CE2-CA 3.44Å; W116-G129 VanDerWaalsContact CH2-CA 3.48Å; W116-G129 VanDerWaalsContact CH2-N 3.3Å; W116-G129 VanDerWaalsContact CZ2-CA 3.4Å; W116-L132 HydrophobicContact CZ3-CD2 4.08Å; W116-H226 PolarHBondContact O-NE2 3.05Å; W116-Y235 HydrophobicContact CB-CE2 4.2Å; W116-Y235 HydrophobicContact CE3-CD2 4.12Å; W116-Y235 AromaticContact CE3-CE2 3.97Å; W116-Y235 HydrophobicContact CE3-CE2 3.97Å; W116-Y238 HydrophobicContact CE3-CE1 4.26Å; W116-Y238 HydrophobicContact CH2-CD1 4.15Å; W116-Y238 AromaticContact CH2-CE1 3.29Å; W116-Y238 HydrophobicContact CH2-CE1 3.29Å; W116-Y238 AromaticContact CH2-CZ 3.57Å; W116-Y238 HydrophobicContact CZ2-CE1 4.41Å; W116-Y238 AromaticContact CZ3-CD1 3.6Å; W116-Y238 HydrophobicContact CZ3-CD1 3.6Å; W116-Y238 AromaticContact CZ3-CE1 3.2Å; W116-Y238 HydrophobicContact CZ3-CE1 3.2Å; W116-Y238 AromaticContact CZ3-CZ 3.91Å
117	A	86	Confident	78.9	Confident	42 Å²	42	72 Å²	72	35%	0.347	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-22.8	177.7	0	0	0	0	0	113.9	M114 R115 V230 Y235	M114-A117 PolarHBondContact O-N 2.83Å; R115-A117 PolarHBondContact O-N 2.8Å; A117-V230 HydrophobicContact CB-CG1 3.8Å; A117-V230 HydrophobicContact CB-CG2 4.34Å; A117-Y235 HydrophobicContact CB-CE1 4.47Å
118	V	84.8	Confident	80.5	Confident	114 Å²	114	68.8 Å²	68.8	69%	0.691	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.4	-41.5	-171.6	-176.9	0	0	0	0	112	R115 W116	R115-V118 PolarHBondContact O-N 3.25Å; W116-V118 VanDerWaalsContact C-N 3.35Å
119	D	84.1	Confident	82.2	Confident	83 Å²	83	57.9 Å²	57.9	44%	0.444	31%	0.313	S	S	.	.			trans	-155.6	143	-171.3	-156.1	-17.9	0	0	0	111.8	Q121 N122	D119-Q121 PolarHBondContact O-N 2.97Å; D119-N122 WeakPolarHBondContact CB-ND2 3.29Å; D119-N122 WeakPolarHBondContact O-CB 3.46Å; D119-N122 PolarHBondContact O-N 3.09Å; D119-N122 VanDerWaalsContact O-N 3.11Å
120	L	87.4	Confident	83.5	Confident	5 Å²	5	55.9 Å²	55.9	3%	0.026	29%	0.29	C	S	.	.	H	α-helix	trans	-55.3	-41	178.8	170.5	67.4	0	0	0	110.8	N122 V123 L124 F133 E219 L222 R223 H226	L120-N122 VanDerWaalsContact C-N 3.28Å; L120-N122 PolarHBondContact O-N 2.95Å; L120-V123 WeakPolarHBondContact O-CB 3.44Å; L120-V123 PolarHBondContact O-N 3.24Å; L120-V123 VanDerWaalsContact O-N 3.11Å; L120-L124 HydrophobicContact CD1-CD1 3.84Å; L120-L124 HydrophobicContact CD1-CD2 4.49Å; L120-L124 HydrophobicContact CD1-CG 4Å; L120-L124 HydrophobicContact CD2-CD1 4.29Å; L120-L124 HydrophobicContact CG-CD1 3.8Å; L120-L124 HydrophobicContact CG-CG 4.25Å; L120-L124 WeakPolarHBondContact O-CG 3.38Å; L120-L124 PolarHBondContact O-N 2.92Å; L120-L124 VanDerWaalsContact O-N 3.1Å; L120-F133 HydrophobicContact CD1-CE1 3.77Å; L120-F133 HydrophobicContact CD1-CZ 3.97Å; L120-E219 HydrophobicContact CD2-CG 4.25Å; L120-L222 HydrophobicContact CD1-CB 4.41Å; L120-L222 HydrophobicContact CD2-CB 3.83Å; L120-R223 HydrophobicContact CB-CG 4.12Å; L120-R223 HydrophobicContact CD2-CG 3.69Å; L120-H226 HydrophobicContact CB-CB 4.37Å; L120-H226 HydrophobicContact CD1-CB 3.86Å; L120-H226 PolarHBondContact N-CE1 2.97Å
121	Q	85.7	Confident	84.6	Confident	58 Å²	58	56.8 Å²	56.8	27%	0.271	29%	0.291	S	S	.	.	H	α-helix	trans	-65.4	-30.2	-177.3	-175.1	58.5	24.2	0	0	112.2	D119 V123 L124 E125 K153	D119-Q121 PolarHBondContact O-N 2.97Å; Q121-V123 PolarHBondContact O-N 3Å; Q121-L124 PolarHBondContact O-N 3.1Å; Q121-E125 HydrophobicContact CG-CG 4.44Å; Q121-E125 WeakPolarHBondContact CG-OE1 3.4Å; Q121-E125 VanDerWaalsContact NE2-CG 3.34Å; Q121-E125 PolarHBondContact NE2-OE1 2.85Å; Q121-E125 WeakPolarHBondContact O-CG 3.34Å; Q121-E125 PolarHBondContact O-N 3.24Å; Q121-K153 VanDerWaalsContact NE2-NZ 3.14Å
122	N	83.7	Confident	85.4	Confident	25 Å²	25	55 Å²	55	13%	0.134	28%	0.278	C	S	.	.	H	α-helix	trans	-65.6	-36.4	173.3	-71	-59.9	0	0	0	112	R115 D119 L120 L124	R115-N122 HydrophobicContact CB-CB 4.09Å; R115-N122 PolarHBondContact NE-OD1 3.32Å; R115-N122 VanDerWaalsContact NE-OD1 3.07Å; R115-N122 PolarHBondContact NH2-OD1 2.91Å; R115-N122 VanDerWaalsContact O-CB 3.24Å; R115-N122 WeakPolarHBondContact O-CB 3.43Å; R115-N122 PolarHBondContact O-ND2 2.78Å; D119-N122 WeakPolarHBondContact CB-ND2 3.29Å; D119-N122 WeakPolarHBondContact O-CB 3.46Å; D119-N122 PolarHBondContact O-N 3.09Å; D119-N122 VanDerWaalsContact O-N 3.11Å; L120-N122 VanDerWaalsContact C-N 3.28Å; L120-N122 PolarHBondContact O-N 2.95Å; N122-L124 VanDerWaalsContact C-N 3.34Å
123	V	88.7	Confident	86.1	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-69.3	-35.4	175.3	-169.3	0	0	0	0	111.3	W116 L120 Q121 L130 F133 H226 F229	W116-V123 HydrophobicContact CB-CG2 3.79Å; W116-V123 HydrophobicContact CG-CG2 4.26Å; W116-V123 WeakPolarHBondContact O-CG2 3.24Å; L120-V123 WeakPolarHBondContact O-CB 3.44Å; L120-V123 PolarHBondContact O-N 3.24Å; L120-V123 VanDerWaalsContact O-N 3.11Å; Q121-V123 PolarHBondContact O-N 3Å; V123-L130 PolarHBondContact O-N 3.45Å; V123-L130 VanDerWaalsContact O-N 3.1Å; V123-F133 HydrophobicContact CG1-CB 3.78Å; V123-F133 HydrophobicContact CG1-CD1 4.42Å; V123-F133 HydrophobicContact CG1-CG 4.2Å; V123-H226 WeakPolarHBondContact CG2-NE2 3.41Å; V123-F229 HydrophobicContact CG1-CE1 4.11Å
124	L	87	Confident	86.7	Confident	9 Å²	9	51.5 Å²	51.5	5%	0.047	26%	0.257	C	S	.	.	H	α-helix	trans	-84	-15.3	-176.2	-63.9	-174.8	0	0	0	113.9	L120 Q121 N122 F133 L146 W149 Y150	L120-L124 HydrophobicContact CD1-CD1 3.84Å; L120-L124 HydrophobicContact CD1-CD2 4.49Å; L120-L124 HydrophobicContact CD1-CG 4Å; L120-L124 HydrophobicContact CD2-CD1 4.29Å; L120-L124 HydrophobicContact CG-CD1 3.8Å; L120-L124 HydrophobicContact CG-CG 4.25Å; L120-L124 WeakPolarHBondContact O-CG 3.38Å; L120-L124 PolarHBondContact O-N 2.92Å; L120-L124 VanDerWaalsContact O-N 3.1Å; Q121-L124 PolarHBondContact O-N 3.1Å; N122-L124 VanDerWaalsContact C-N 3.34Å; L124-F133 HydrophobicContact CD2-CD1 3.97Å; L124-F133 HydrophobicContact CD2-CE1 4.18Å; L124-L146 HydrophobicContact CD2-CD1 3.71Å; L124-W149 HydrophobicContact CD1-CE3 4.16Å; L124-W149 HydrophobicContact CD1-CH2 3.48Å; L124-W149 VanDerWaalsContact CD1-CH2 3.48Å; L124-W149 HydrophobicContact CD1-CZ2 4.12Å; L124-W149 HydrophobicContact CD1-CZ3 3.55Å; L124-Y150 HydrophobicContact CD2-CE2 4.24Å; L124-Y150 PolarHBondContact O-OH 2.71Å
125	E	85.1	Confident	87.1	Confident	136 Å²	136	49 Å²	49	64%	0.636	24%	0.243	S	C	*	.	H	α-helix	trans	-86.8	-22.2	170.6	-74.5	177.8	-172.6	0	0	113	Q121	Q121-E125 HydrophobicContact CG-CG 4.44Å; Q121-E125 WeakPolarHBondContact CG-OE1 3.4Å; Q121-E125 VanDerWaalsContact NE2-CG 3.34Å; Q121-E125 PolarHBondContact NE2-OE1 2.85Å; Q121-E125 WeakPolarHBondContact O-CG 3.34Å; Q121-E125 PolarHBondContact O-N 3.24Å
126	D	87.9	Confident	87.4	Confident	40 Å²	40	47.1 Å²	47.1	21%	0.214	24%	0.237	C	C	.	.			trans	-90.3	130.5	176.8	-162.8	-36.9	0	0	0	112	P112 W116 E128 L130	P112-D126 WeakPolarHBondContact CB-OD2 3.3Å; W116-D126 HydrophobicContact CZ2-CB 4.35Å; W116-D126 WeakPolarHBondContact CZ2-OD2 3.42Å; W116-D126 VanDerWaalsContact NE1-CB 3.3Å; W116-D126 VanDerWaalsContact NE1-CG 3.33Å; W116-D126 PolarHBondContact NE1-OD2 3.15Å; D126-E128 VanDerWaalsContact C-N 3.31Å; D126-E128 PolarHBondContact O-N 2.85Å; D126-E128 PolarHBondContact OD1-N 2.94Å; D126-L130 WeakPolarHBondContact O-CB 3.46Å; D126-L130 PolarHBondContact O-N 3.41Å
127	F	85.5	Confident	87.4	Confident	159 Å²	159	47 Å²	47	70%	0.697	24%	0.236	S	C	*	.	H	α-helix	trans	-66.9	-30.2	177.4	178.2	-113.7	0	0	0	113.3	Q131	F127-Q131 WeakPolarHBondContact O-CB 3.44Å; F127-Q131 WeakPolarHBondContact O-CG 3.46Å; F127-Q131 PolarHBondContact O-N 3.33Å; F127-Q131 PolarHBondContact O-NE2 2.75Å
128	E	86.2	Confident	87.5	Confident	65 Å²	65	49.3 Å²	49.3	30%	0.304	24%	0.243	S	C	.	.	H	α-helix	trans	-84.2	-42.2	-179.4	-160	168	154.5	0	0	110.9	W116 D126 Q131 L132 Y238 P250	W116-E128 HydrophobicContact CH2-CB 4.01Å; W116-E128 HydrophobicContact CH2-CG 4.17Å; W116-E128 HydrophobicContact CZ2-CB 4.04Å; D126-E128 VanDerWaalsContact C-N 3.31Å; D126-E128 PolarHBondContact O-N 2.85Å; D126-E128 PolarHBondContact OD1-N 2.94Å; E128-Q131 WeakPolarHBondContact O-CB 3.49Å; E128-Q131 PolarHBondContact O-N 2.85Å; E128-L132 PolarHBondContact O-N 3.44Å; E128-Y238 HydrophobicContact CG-CE2 4.45Å; E128-Y238 WeakPolarHBondContact OE1-CE2 3.33Å; E128-Y238 VanDerWaalsContact OE1-CZ 3.25Å; E128-Y238 PolarHBondContact OE1-OH 3.44Å; E128-P250 VanDerWaalsContact OE1-CG 3.23Å; E128-P250 WeakPolarHBondContact OE1-CG 3.36Å
129	G	87.3	Confident	87.6	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-59.3	-48.1	173.2	0	0	0	0	0	111.9	W116 Q131 L132 F133	W116-G129 VanDerWaalsContact CE2-CA 3.44Å; W116-G129 VanDerWaalsContact CH2-CA 3.48Å; W116-G129 VanDerWaalsContact CH2-N 3.3Å; W116-G129 VanDerWaalsContact CZ2-CA 3.4Å; G129-Q131 VanDerWaalsContact C-N 3.3Å; G129-Q131 PolarHBondContact O-N 3.37Å; G129-L132 PolarHBondContact O-N 3.13Å; G129-L132 VanDerWaalsContact O-N 3.13Å; G129-F133 WeakPolarHBondContact O-CB 3.06Å; G129-F133 PolarHBondContact O-N 3.43Å
130	L	89.2	Confident	87.8	Confident	40 Å²	40	50.1 Å²	50.1	21%	0.209	24%	0.241	C	C	.	.	H	α-helix	trans	-59.3	-39.5	174.6	-175.8	153.9	0	0	0	112.2	V123 D126 K134 Y150	V123-L130 PolarHBondContact O-N 3.45Å; V123-L130 VanDerWaalsContact O-N 3.1Å; D126-L130 WeakPolarHBondContact O-CB 3.46Å; D126-L130 PolarHBondContact O-N 3.41Å; L130-K134 WeakPolarHBondContact O-CB 3.2Å; L130-K134 PolarHBondContact O-N 2.77Å; L130-Y150 HydrophobicContact CD1-CE2 3.79Å; L130-Y150 VanDerWaalsContact CD1-OH 3.24Å; L130-Y150 WeakPolarHBondContact CD1-OH 3.34Å
131	Q	89	Confident	87.4	Confident	77 Å²	77	52.4 Å²	52.4	36%	0.36	27%	0.265	S	S	.	.	H	α-helix	trans	-68.1	-31.9	176.1	-89.8	-170.6	83.8	0	0	113.5	F127 E128 G129 K135	F127-Q131 WeakPolarHBondContact O-CB 3.44Å; F127-Q131 WeakPolarHBondContact O-CG 3.46Å; F127-Q131 PolarHBondContact O-N 3.33Å; F127-Q131 PolarHBondContact O-NE2 2.75Å; E128-Q131 WeakPolarHBondContact O-CB 3.49Å; E128-Q131 PolarHBondContact O-N 2.85Å; G129-Q131 VanDerWaalsContact C-N 3.3Å; G129-Q131 PolarHBondContact O-N 3.37Å; Q131-K135 VanDerWaalsContact O-CG 3.32Å; Q131-K135 WeakPolarHBondContact O-CG 3.46Å; Q131-K135 PolarHBondContact O-N 2.92Å; Q131-K135 PolarHBondContact O-NZ 3.08Å
132	L	88.8	Confident	87.2	Confident	4 Å²	4	50.1 Å²	50.1	2%	0.021	26%	0.256	C	S	.	.	H	α-helix	trans	-77.9	-44	177.6	-160.7	66.6	0	0	0	110.2	W116 E128 G129 K135 F136 F229 M234 Y238	W116-L132 HydrophobicContact CZ3-CD2 4.08Å; E128-L132 PolarHBondContact O-N 3.44Å; G129-L132 PolarHBondContact O-N 3.13Å; G129-L132 VanDerWaalsContact O-N 3.13Å; L132-K135 WeakPolarHBondContact O-CB 3.47Å; L132-K135 PolarHBondContact O-N 3.07Å; L132-F136 PolarHBondContact O-N 2.84Å; L132-F229 HydrophobicContact CB-CE2 4.18Å; L132-F229 HydrophobicContact CB-CZ 4.01Å; L132-F229 HydrophobicContact CD2-CE2 4.19Å; L132-F229 HydrophobicContact CD2-CZ 3.98Å; L132-F229 HydrophobicContact CG-CE2 3.92Å; L132-F229 HydrophobicContact CG-CZ 4.03Å; L132-M234 HydrophobicContact CD1-CG 3.78Å; L132-M234 HydrophobicContact CD1-SD 4.3Å; L132-M234 HydrophobicContact CG-CG 4Å; L132-Y238 HydrophobicContact CD2-CD1 3.9Å; L132-Y238 HydrophobicContact CD2-CD2 4.17Å; L132-Y238 HydrophobicContact CD2-CG 3.6Å
133	F	89.7	Confident	87.2	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-64.1	-40	175.2	-174.7	-129.8	0	0	0	112.6	L120 V123 L124 G129 K135 F136 L137 L146 L222 H226 F229	L120-F133 HydrophobicContact CD1-CE1 3.77Å; L120-F133 HydrophobicContact CD1-CZ 3.97Å; V123-F133 HydrophobicContact CG1-CB 3.78Å; V123-F133 HydrophobicContact CG1-CD1 4.42Å; V123-F133 HydrophobicContact CG1-CG 4.2Å; L124-F133 HydrophobicContact CD2-CD1 3.97Å; L124-F133 HydrophobicContact CD2-CE1 4.18Å; G129-F133 WeakPolarHBondContact O-CB 3.06Å; G129-F133 PolarHBondContact O-N 3.43Å; F133-K135 VanDerWaalsContact C-N 3.32Å; F133-K135 PolarHBondContact O-N 3.39Å; F133-F136 HydrophobicContact CD2-CD1 4.29Å; F133-F136 HydrophobicContact CE2-CD1 4.37Å; F133-F136 WeakPolarHBondContact O-CB 3.43Å; F133-F136 PolarHBondContact O-N 3Å; F133-L137 HydrophobicContact CD1-CD1 4.06Å; F133-L137 HydrophobicContact CD2-CG 4.29Å; F133-L137 HydrophobicContact CE1-CD1 3.69Å; F133-L137 HydrophobicContact CE1-CG 4.41Å; F133-L137 HydrophobicContact CE2-CD1 4.18Å; F133-L137 HydrophobicContact CE2-CD2 4.17Å; F133-L137 HydrophobicContact CE2-CG 4.03Å; F133-L137 HydrophobicContact CG-CD1 4.47Å; F133-L137 HydrophobicContact CZ-CD1 3.76Å; F133-L137 HydrophobicContact CZ-CD2 4.23Å; F133-L137 HydrophobicContact CZ-CG 4.11Å; F133-L137 WeakPolarHBondContact O-CG 3.28Å; F133-L137 PolarHBondContact O-N 3.25Å; F133-L146 HydrophobicContact CD1-CD1 4.5Å; F133-L146 HydrophobicContact CD1-CD2 4.46Å; F133-L146 HydrophobicContact CE1-CD1 4.28Å; F133-L222 HydrophobicContact CE1-CD2 4.11Å; F133-L222 HydrophobicContact CZ-CD2 4.11Å; F133-H226 HydrophobicContact CE2-CB 4.25Å; F133-H226 HydrophobicContact CZ-CB 4.22Å; F133-F229 HydrophobicContact CB-CD1 4.49Å; F133-F229 HydrophobicContact CB-CE1 4.24Å; F133-F229 HydrophobicContact CB-CE2 4.3Å; F133-F229 HydrophobicContact CB-CZ 4.13Å; F133-F229 HydrophobicContact CD2-CB 3.8Å; F133-F229 AromaticContact CD2-CD1 3.87Å; F133-F229 HydrophobicContact CD2-CD1 3.87Å; F133-F229 HydrophobicContact CD2-CD2 4.06Å; F133-F229 HydrophobicContact CD2-CE1 4.45Å; F133-F229 AromaticContact CD2-CG 3.64Å; F133-F229 HydrophobicContact CD2-CG 3.64Å; F133-F229 HydrophobicContact CE2-CB 3.99Å; F133-F229 HydrophobicContact CE2-CG 4.31Å
134	K	90.2	Very high	86.9	Confident	61 Å²	61	50.8 Å²	50.8	27%	0.265	26%	0.26	S	S	.	.	H	α-helix	trans	-66.2	-31.4	174.5	-173.2	161.4	-173.3	166.1	0	112.6	L130 N138 L146 D147	L130-K134 WeakPolarHBondContact O-CB 3.2Å; L130-K134 PolarHBondContact O-N 2.77Å; K134-N138 VanDerWaalsContact O-CB 3.3Å; K134-N138 WeakPolarHBondContact O-CB 3.38Å; K134-N138 PolarHBondContact O-N 3.22Å; K134-N138 PolarHBondContact O-ND2 2.82Å; K134-N138 PolarHBondContact O-OD1 3.27Å; K134-L146 HydrophobicContact CB-CD2 3.92Å; K134-L146 HydrophobicContact CD-CD2 4.25Å; K134-L146 HydrophobicContact CG-CD2 4.17Å; K134-D147 IonicContact NZ-OD1 2.61Å; K134-D147 PolarHBondContact NZ-OD1 2.87Å; K134-D147 IonicContact NZ-OD2 3.15Å; K134-D147 PolarHBondContact NZ-OD2 3.35Å
135	K	89.1	Confident	86.9	Confident	47 Å²	47	50.3 Å²	50.3	20%	0.204	26%	0.258	C	S	.	.	H	α-helix	trans	-67.6	-46.1	170.9	-71	178.9	-156.3	89.1	0	111.3	Q131 L132 F133 L137 N138 N139 Y253	Q131-K135 VanDerWaalsContact O-CG 3.32Å; Q131-K135 WeakPolarHBondContact O-CG 3.46Å; Q131-K135 PolarHBondContact O-N 2.92Å; Q131-K135 PolarHBondContact O-NZ 3.08Å; L132-K135 WeakPolarHBondContact O-CB 3.47Å; L132-K135 PolarHBondContact O-N 3.07Å; F133-K135 VanDerWaalsContact C-N 3.32Å; F133-K135 PolarHBondContact O-N 3.39Å; K135-L137 PolarHBondContact O-N 3.5Å; K135-N138 PolarHBondContact O-N 3.42Å; K135-N139 PolarHBondContact O-N 3.01Å; K135-N139 PolarHBondContact O-OD1 3.27Å; K135-Y253 HydrophobicContact CD-CD1 4.22Å; K135-Y253 HydrophobicContact CD-CG 4.26Å; K135-Y253 VanDerWaalsContact CE-CB 3.41Å; K135-Y253 VanDerWaalsContact CE-CG 3.47Å
136	F	90.8	Very high	87	Confident	21 Å²	21	43.9 Å²	43.9	9%	0.092	23%	0.228	C	C	.	.	H	α-helix	trans	-55.8	-50.8	174.4	174.3	-96.4	0	0	0	111.6	L132 F133 N138 N139 E140 K225 A228 F229	L132-F136 PolarHBondContact O-N 2.84Å; F133-F136 HydrophobicContact CD2-CD1 4.29Å; F133-F136 HydrophobicContact CE2-CD1 4.37Å; F133-F136 WeakPolarHBondContact O-CB 3.43Å; F133-F136 PolarHBondContact O-N 3Å; F136-N138 VanDerWaalsContact C-N 3.35Å; F136-N138 PolarHBondContact O-N 3.35Å; F136-N139 PolarHBondContact O-N 3.3Å; F136-E140 HydrophobicContact CD1-CG 4.37Å; F136-E140 HydrophobicContact CE1-CG 4.02Å; F136-E140 HydrophobicContact CE2-CG 4.25Å; F136-E140 HydrophobicContact CZ-CG 3.96Å; F136-E140 WeakPolarHBondContact O-CB 3.48Å; F136-E140 WeakPolarHBondContact O-CG 3.26Å; F136-E140 PolarHBondContact O-N 2.55Å; F136-K225 HydrophobicContact CE1-CB 4.49Å; F136-K225 HydrophobicContact CE1-CD 4.49Å; F136-K225 VanDerWaalsContact CE1-O 3.28Å; F136-K225 WeakPolarHBondContact CE1-O 3.43Å; F136-A228 HydrophobicContact CZ-CB 4.01Å; F136-F229 HydrophobicContact CB-CD2 3.68Å; F136-F229 HydrophobicContact CB-CE2 4.26Å; F136-F229 HydrophobicContact CD1-CB 3.75Å; F136-F229 HydrophobicContact CD1-CD2 4.18Å; F136-F229 HydrophobicContact CD1-CG 4.39Å; F136-F229 HydrophobicContact CD2-CD2 4.26Å; F136-F229 HydrophobicContact CE1-CB 3.83Å; F136-F229 HydrophobicContact CG-CB 4.12Å; F136-F229 AromaticContact CG-CD2 3.79Å; F136-F229 HydrophobicContact CG-CD2 3.79Å; F136-F229 HydrophobicContact CG-CG 4.42Å; F136-F229 HydrophobicContact CZ-CB 4.27Å
137	L	89.7	Confident	86.9	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-63.4	-35.8	177	-69.8	179.8	0	0	0	113.3	F133 K135 E140 G141 C142 G143 L146 L222 K225	F133-L137 HydrophobicContact CD1-CD1 4.06Å; F133-L137 HydrophobicContact CD2-CG 4.29Å; F133-L137 HydrophobicContact CE1-CD1 3.69Å; F133-L137 HydrophobicContact CE1-CG 4.41Å; F133-L137 HydrophobicContact CE2-CD1 4.18Å; F133-L137 HydrophobicContact CE2-CD2 4.17Å; F133-L137 HydrophobicContact CE2-CG 4.03Å; F133-L137 HydrophobicContact CG-CD1 4.47Å; F133-L137 HydrophobicContact CZ-CD1 3.76Å; F133-L137 HydrophobicContact CZ-CD2 4.23Å; F133-L137 HydrophobicContact CZ-CG 4.11Å; F133-L137 WeakPolarHBondContact O-CG 3.28Å; F133-L137 PolarHBondContact O-N 3.25Å; K135-L137 PolarHBondContact O-N 3.5Å; L137-E140 CarbonylContact O-C 3.6Å; L137-E140 PolarHBondContact O-N 3.05Å; L137-G141 CarbonylContact O-C 3.49Å; L137-G141 PolarHBondContact O-N 3.47Å; L137-G141 VanDerWaalsContact O-N 3.1Å; L137-C142 HydrophobicContact CD2-CB 3.99Å; L137-C142 CarbonylContact O-C 3.51Å; L137-C142 WeakPolarHBondContact O-CA 3.42Å; L137-C142 PolarHBondContact O-N 2.92Å; L137-G143 PolarHBondContact O-N 3.49Å; L137-L146 HydrophobicContact CD1-CB 3.74Å; L137-L146 HydrophobicContact CD1-CD2 4.04Å; L137-L146 HydrophobicContact CD1-CG 4.33Å; L137-L222 HydrophobicContact CD1-CD2 3.71Å; L137-K225 HydrophobicContact CD2-CB 3.74Å; L137-K225 HydrophobicContact CD2-CG 4.01Å
138	N	88.2	Confident	87	Confident	92 Å²	92	37.1 Å²	37.1	49%	0.492	20%	0.199	S	C	.	.	H	α-helix	trans	-65.2	-40.5	174.1	-75.6	-6.6	0	0	0	112	K134 K135 F136 E140 G141	K134-N138 VanDerWaalsContact O-CB 3.3Å; K134-N138 WeakPolarHBondContact O-CB 3.38Å; K134-N138 PolarHBondContact O-N 3.22Å; K134-N138 PolarHBondContact O-ND2 2.82Å; K134-N138 PolarHBondContact O-OD1 3.27Å; K135-N138 PolarHBondContact O-N 3.42Å; F136-N138 VanDerWaalsContact C-N 3.35Å; F136-N138 PolarHBondContact O-N 3.35Å; N138-E140 VanDerWaalsContact C-N 3.32Å; N138-G141 PolarHBondContact O-N 3.03Å
139	N	87.2	Confident	87.1	Confident	123 Å²	123	34.4 Å²	34.4	66%	0.658	19%	0.186	S	C	*	.	H	α-helix	trans	-64.8	-38.7	175.1	-69.8	10.2	0	0	0	111.4	K135 F136 G141	K135-N139 PolarHBondContact O-N 3.01Å; K135-N139 PolarHBondContact O-OD1 3.27Å; F136-N139 PolarHBondContact O-N 3.3Å; N139-G141 PolarHBondContact O-N 3.26Å
140	E	86.6	Confident	87.1	Confident	91 Å²	91	37.8 Å²	37.8	43%	0.425	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-0.2	174.8	-70.9	-73.6	105.7	0	0	114	F136 L137 N138 C142 K225	F136-E140 HydrophobicContact CD1-CG 4.37Å; F136-E140 HydrophobicContact CE1-CG 4.02Å; F136-E140 HydrophobicContact CE2-CG 4.25Å; F136-E140 HydrophobicContact CZ-CG 3.96Å; F136-E140 WeakPolarHBondContact O-CB 3.48Å; F136-E140 WeakPolarHBondContact O-CG 3.26Å; F136-E140 PolarHBondContact O-N 2.55Å; L137-E140 CarbonylContact O-C 3.6Å; L137-E140 PolarHBondContact O-N 3.05Å; N138-E140 VanDerWaalsContact C-N 3.32Å; E140-C142 HydrophobicContact CB-CB 4.43Å; E140-C142 PolarHBondContact O-N 2.8Å; E140-C142 VanDerWaalsContact O-N 3.16Å; E140-C142 PolarHBondContact O-SG 3.43Å; E140-K225 IonicContact OE2-NZ 2.77Å; E140-K225 PolarHBondContact OE2-NZ 3.45Å
141	G	80.6	Confident	87.1	Confident	52 Å²	52	37.1 Å²	37.1	54%	0.536	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	68.4	5	-175.2	0	0	0	0	0	115.5	L137 N138 N139	L137-G141 CarbonylContact O-C 3.49Å; L137-G141 PolarHBondContact O-N 3.47Å; L137-G141 VanDerWaalsContact O-N 3.1Å; N138-G141 PolarHBondContact O-N 3.03Å; N139-G141 PolarHBondContact O-N 3.26Å
142	C	81.3	Confident	87	Confident	11 Å²	11	33.5 Å²	33.5	7%	0.074	18%	0.183	C	C	.	.			trans	-101.4	20.9	-173.8	-61.4	0	0	0	0	113.5	L137 E140 N144 E145 F221	L137-C142 HydrophobicContact CD2-CB 3.99Å; L137-C142 CarbonylContact O-C 3.51Å; L137-C142 WeakPolarHBondContact O-CA 3.42Å; L137-C142 PolarHBondContact O-N 2.92Å; E140-C142 HydrophobicContact CB-CB 4.43Å; E140-C142 PolarHBondContact O-N 2.8Å; E140-C142 VanDerWaalsContact O-N 3.16Å; E140-C142 PolarHBondContact O-SG 3.43Å; C142-N144 PolarHBondContact O-N 3.1Å; C142-E145 WeakPolarHBondContact CA-OE2 3.46Å; C142-F221 HydrophobicContact CB-CE1 4.12Å
143	G	83.1	Confident	86.8	Confident	6 Å²	6	36.1 Å²	36.1	6%	0.062	19%	0.194	C	C	.	.	H	α-helix	trans	-66.3	-25.7	179.9	0	0	0	0	0	113.9	L137 L146 D147	L137-G143 PolarHBondContact O-N 3.49Å; G143-L146 PolarHBondContact O-N 2.84Å; G143-D147 PolarHBondContact O-N 3.33Å
144	N	83.3	Confident	86.6	Confident	32 Å²	32	37.2 Å²	37.2	17%	0.171	21%	0.205	C	C	.	.	H	α-helix	trans	-65.9	-39	-180	-64	-38.6	0	0	0	112	C142 L146 D147 F148 Y177 E183 F184 L186	C142-N144 PolarHBondContact O-N 3.1Å; N144-L146 VanDerWaalsContact C-N 3.33Å; N144-L146 PolarHBondContact O-N 2.84Å; N144-D147 PolarHBondContact O-N 3.44Å; N144-F148 PolarHBondContact O-N 2.84Å; N144-Y177 HydrophobicContact CB-CE1 4.36Å; N144-Y177 WeakPolarHBondContact O-CE1 3.34Å; N144-E183 PolarHBondContact ND2-O 2.94Å; N144-F184 WeakPolarHBondContact OD1-CD1 3.33Å; N144-L186 VanDerWaalsContact C-CD2 3.48Å; N144-L186 HydrophobicContact CB-CD2 3.73Å
145	E	86.2	Confident	86.4	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-59.2	-41.8	179.2	-77.6	69.6	-168.5	0	0	111.9	C142 W149 L186 T187 C188 V218 F221	C142-E145 WeakPolarHBondContact CA-OE2 3.46Å; E145-W149 PolarHBondContact O-N 3.14Å; E145-L186 HydrophobicContact CB-CD2 4.33Å; E145-L186 HydrophobicContact CG-CD2 3.89Å; E145-T187 PolarHBondContact OE1-N 3.31Å; E145-T187 PolarHBondContact OE1-OG1 2.9Å; E145-C188 WeakPolarHBondContact CG-SG 3.28Å; E145-V218 HydrophobicContact CB-CG1 4.13Å; E145-V218 VanDerWaalsContact O-CG1 3.27Å; E145-V218 WeakPolarHBondContact O-CG1 3.47Å; E145-F221 HydrophobicContact CB-CD1 4.43Å; E145-F221 HydrophobicContact CG-CD1 3.99Å; E145-F221 HydrophobicContact CG-CE1 3.95Å
146	L	87.2	Confident	86	Confident	1 Å²	1	36.3 Å²	36.3	1%	0.005	20%	0.201	C	C	.	.	H	α-helix	trans	-65.8	-46.8	175.5	-175.7	63.6	0	0	0	111.8	L124 F133 K134 L137 G143 N144 F148 W149 Y150 L222	L124-L146 HydrophobicContact CD2-CD1 3.71Å; F133-L146 HydrophobicContact CD1-CD1 4.5Å; F133-L146 HydrophobicContact CD1-CD2 4.46Å; F133-L146 HydrophobicContact CE1-CD1 4.28Å; K134-L146 HydrophobicContact CB-CD2 3.92Å; K134-L146 HydrophobicContact CD-CD2 4.25Å; K134-L146 HydrophobicContact CG-CD2 4.17Å; L137-L146 HydrophobicContact CD1-CB 3.74Å; L137-L146 HydrophobicContact CD1-CD2 4.04Å; L137-L146 HydrophobicContact CD1-CG 4.33Å; G143-L146 PolarHBondContact O-N 2.84Å; N144-L146 VanDerWaalsContact C-N 3.33Å; N144-L146 PolarHBondContact O-N 2.84Å; L146-F148 VanDerWaalsContact C-N 3.3Å; L146-F148 PolarHBondContact O-N 3.39Å; L146-W149 PolarHBondContact O-N 2.86Å; L146-Y150 HydrophobicContact CD1-CD2 3.99Å; L146-Y150 HydrophobicContact CD1-CE2 3.82Å; L146-Y150 HydrophobicContact CG-CD2 4.09Å; L146-Y150 HydrophobicContact CG-CE2 4.25Å; L146-Y150 WeakPolarHBondContact O-CD2 3.43Å; L146-Y150 PolarHBondContact O-N 3.48Å; L146-L222 HydrophobicContact CB-CD2 4.3Å; L146-L222 HydrophobicContact CD1-CD1 4.44Å; L146-L222 HydrophobicContact CD1-CD2 4.3Å
147	D	86.3	Confident	85.5	Confident	57 Å²	57	42.6 Å²	42.6	31%	0.305	23%	0.231	S	C	.	.	H	α-helix	trans	-68	-30	-178.6	-73.9	-12.4	0	0	0	112.2	K134 G143 N144 A151 Y177	K134-D147 IonicContact NZ-OD1 2.61Å; K134-D147 PolarHBondContact NZ-OD1 2.87Å; K134-D147 IonicContact NZ-OD2 3.15Å; K134-D147 PolarHBondContact NZ-OD2 3.35Å; G143-D147 PolarHBondContact O-N 3.33Å; N144-D147 PolarHBondContact O-N 3.44Å; D147-A151 WeakPolarHBondContact O-CB 3.29Å; D147-A151 PolarHBondContact O-N 2.88Å; D147-Y177 WeakPolarHBondContact CB-OH 3.4Å
148	F	87.8	Confident	85.1	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-67.2	-46.8	168.8	173.7	-94.9	0	0	0	112.7	N144 L146 Y150 A151 C152 I173 Y177 V178 L186 I189 F211 A214 V218	N144-F148 PolarHBondContact O-N 2.84Å; L146-F148 VanDerWaalsContact C-N 3.3Å; L146-F148 PolarHBondContact O-N 3.39Å; F148-Y150 VanDerWaalsContact C-N 3.26Å; F148-Y150 PolarHBondContact O-N 3.01Å; F148-A151 PolarHBondContact O-N 3.04Å; F148-A151 VanDerWaalsContact O-N 3.09Å; F148-C152 VanDerWaalsContact CZ-SG 3.52Å; F148-C152 PolarHBondContact O-N 2.86Å; F148-C152 PolarHBondContact O-SG 3.32Å; F148-I173 HydrophobicContact CD2-CG2 3.77Å; F148-I173 HydrophobicContact CE2-CG2 3.47Å; F148-I173 VanDerWaalsContact CE2-CG2 3.47Å; F148-Y177 HydrophobicContact CB-CD1 3.97Å; F148-Y177 HydrophobicContact CB-CD2 4.29Å; F148-Y177 HydrophobicContact CB-CE1 4.18Å; F148-Y177 HydrophobicContact CB-CE2 4.47Å; F148-Y177 HydrophobicContact CB-CG 4.03Å; F148-Y177 HydrophobicContact CD2-CD1 4.48Å; F148-Y177 AromaticContact CD2-CD2 3.83Å; F148-Y177 HydrophobicContact CD2-CD2 3.83Å; F148-Y177 AromaticContact CD2-CG 3.74Å; F148-Y177 HydrophobicContact CD2-CG 3.74Å; F148-Y177 HydrophobicContact CG-CG 4.35Å; F148-V178 HydrophobicContact CE2-CG2 4.32Å; F148-L186 HydrophobicContact CB-CD1 3.7Å; F148-L186 HydrophobicContact CB-CD2 4.18Å; F148-L186 HydrophobicContact CD1-CD1 3.75Å; F148-L186 HydrophobicContact CD2-CD1 3.62Å; F148-L186 HydrophobicContact CE1-CD1 4.22Å; F148-L186 HydrophobicContact CE2-CD1 4.09Å; F148-L186 HydrophobicContact CG-CD1 3.41Å; F148-L186 VanDerWaalsContact CG-CD1 3.41Å; F148-L186 HydrophobicContact CZ-CD1 4.37Å; F148-I189 HydrophobicContact CE1-CD1 4.12Å; F148-I189 HydrophobicContact CZ-CD1 4Å; F148-F211 HydrophobicContact CE2-CD1 4.38Å; F148-F211 HydrophobicContact CZ-CD1 4.29Å; F148-A214 HydrophobicContact CE1-CB 4.04Å; F148-A214 HydrophobicContact CZ-CB 3.8Å; F148-V218 HydrophobicContact CD1-CB 4.25Å; F148-V218 HydrophobicContact CD1-CG1 4.19Å; F148-V218 HydrophobicContact CD1-CG2 3.79Å; F148-V218 HydrophobicContact CE1-CB 4.44Å; F148-V218 HydrophobicContact CE1-CG2 3.85Å
149	W	88.4	Confident	84.4	Confident	7 Å²	7	45.2 Å²	45.2	3%	0.027	24%	0.244	C	C	.	.	H	α-helix	trans	-60.5	-40	178.2	-177.4	96.9	0	0	0	111	L124 E145 L146 C152 K153 Q215 V218 E219 L222	L124-W149 HydrophobicContact CD1-CE3 4.16Å; L124-W149 HydrophobicContact CD1-CH2 3.48Å; L124-W149 VanDerWaalsContact CD1-CH2 3.48Å; L124-W149 HydrophobicContact CD1-CZ2 4.12Å; L124-W149 HydrophobicContact CD1-CZ3 3.55Å; E145-W149 PolarHBondContact O-N 3.14Å; L146-W149 PolarHBondContact O-N 2.86Å; W149-C152 PolarHBondContact O-N 2.7Å; W149-K153 HydrophobicContact CE3-CD 4.17Å; W149-K153 HydrophobicContact CH2-CD 3.53Å; W149-K153 VanDerWaalsContact CH2-NZ 3.26Å; W149-K153 HydrophobicContact CZ2-CD 4.12Å; W149-K153 HydrophobicContact CZ3-CD 3.51Å; W149-K153 WeakPolarHBondContact O-CB 3.33Å; W149-K153 PolarHBondContact O-N 2.98Å; W149-Q215 HydrophobicContact CG-CG 4.41Å; W149-V218 HydrophobicContact CB-CG1 4.14Å; W149-E219 PolarHBondContact NE1-OE2 2.84Å; W149-L222 HydrophobicContact CB-CD1 3.78Å; W149-L222 HydrophobicContact CG-CD1 3.98Å
150	Y	87.6	Confident	83.7	Confident	72 Å²	72	44.9 Å²	44.9	28%	0.282	24%	0.239	S	C	.	.	H	α-helix	trans	-63.8	-41.8	171.4	-91.7	-72.5	0	0	0	113.3	L124 L130 L146 F148 C152 K153 G154	L124-Y150 HydrophobicContact CD2-CE2 4.24Å; L124-Y150 PolarHBondContact O-OH 2.71Å; L130-Y150 HydrophobicContact CD1-CE2 3.79Å; L130-Y150 VanDerWaalsContact CD1-OH 3.24Å; L130-Y150 WeakPolarHBondContact CD1-OH 3.34Å; L146-Y150 HydrophobicContact CD1-CD2 3.99Å; L146-Y150 HydrophobicContact CD1-CE2 3.82Å; L146-Y150 HydrophobicContact CG-CD2 4.09Å; L146-Y150 HydrophobicContact CG-CE2 4.25Å; L146-Y150 WeakPolarHBondContact O-CD2 3.43Å; L146-Y150 PolarHBondContact O-N 3.48Å; F148-Y150 VanDerWaalsContact C-N 3.26Å; F148-Y150 PolarHBondContact O-N 3.01Å; Y150-C152 VanDerWaalsContact C-N 3.32Å; Y150-C152 PolarHBondContact O-N 3.47Å; Y150-K153 PolarHBondContact O-N 3.41Å; Y150-G154 PolarHBondContact O-N 3.48Å
151	A	88	Confident	82.9	Confident	25 Å²	25	49.7 Å²	49.7	21%	0.207	26%	0.258	C	S	.	.	H	α-helix	trans	-63	-37.2	175.4	0	0	0	0	0	112.2	D147 F148 L155 I173	D147-A151 WeakPolarHBondContact O-CB 3.29Å; D147-A151 PolarHBondContact O-N 2.88Å; F148-A151 PolarHBondContact O-N 3.04Å; F148-A151 VanDerWaalsContact O-N 3.09Å; A151-L155 WeakPolarHBondContact O-CB 3.45Å; A151-L155 PolarHBondContact O-N 3.46Å; A151-I173 HydrophobicContact CB-CD1 3.76Å; A151-I173 HydrophobicContact CB-CG1 3.8Å
152	C	86.2	Confident	82.9	Confident	1 Å²	1	51.6 Å²	51.6	1%	0.007	25%	0.253	C	S	.	.	H	α-helix	trans	-70.6	-41.2	173.6	-69.2	0	0	0	0	112.9	F148 W149 Y150 G154 L155 K156 Q215	F148-C152 VanDerWaalsContact CZ-SG 3.52Å; F148-C152 PolarHBondContact O-N 2.86Å; F148-C152 PolarHBondContact O-SG 3.32Å; W149-C152 PolarHBondContact O-N 2.7Å; Y150-C152 VanDerWaalsContact C-N 3.32Å; Y150-C152 PolarHBondContact O-N 3.47Å; C152-G154 VanDerWaalsContact C-N 3.32Å; C152-L155 PolarHBondContact O-N 2.96Å; C152-K156 PolarHBondContact O-N 3.47Å; C152-Q215 HydrophobicContact CB-CB 4.39Å; C152-Q215 HydrophobicContact CB-CG 4.24Å
153	K	86	Confident	82.6	Confident	60 Å²	60	58.2 Å²	58.2	26%	0.261	28%	0.277	S	S	.	.	H	α-helix	trans	-62.4	-40.3	174.2	-167.3	166.8	-176.8	172.5	0	110.7	Q121 W149 Y150	Q121-K153 VanDerWaalsContact NE2-NZ 3.14Å; W149-K153 HydrophobicContact CE3-CD 4.17Å; W149-K153 HydrophobicContact CH2-CD 3.53Å; W149-K153 VanDerWaalsContact CH2-NZ 3.26Å; W149-K153 HydrophobicContact CZ2-CD 4.12Å; W149-K153 HydrophobicContact CZ3-CD 3.51Å; W149-K153 WeakPolarHBondContact O-CB 3.33Å; W149-K153 PolarHBondContact O-N 2.98Å; Y150-K153 PolarHBondContact O-N 3.41Å
154	G	85.8	Confident	82.4	Confident	22 Å²	22	62 Å²	62	23%	0.227	30%	0.301	C	S	.	.	H	α-helix	trans	-66.4	-41.5	172.5	0	0	0	0	0	113.7	Y150 C152 K156 Q157 Y158	Y150-G154 PolarHBondContact O-N 3.48Å; C152-G154 VanDerWaalsContact C-N 3.32Å; G154-K156 PolarHBondContact O-N 3.01Å; G154-K156 VanDerWaalsContact O-N 3.15Å; G154-Q157 WeakPolarHBondContact O-CB 3.31Å; G154-Q157 PolarHBondContact O-N 3.39Å; G154-Y158 WeakPolarHBondContact O-CD2 3.45Å
155	L	84.6	Confident	82.3	Confident	3 Å²	3	63.1 Å²	63.1	2%	0.016	31%	0.306	C	S	.	.	H	α-helix	trans	-56.9	-33.5	177.9	-170.7	70.7	0	0	0	112.5	A151 C152 I166 V169 A170 I173 F211	A151-L155 WeakPolarHBondContact O-CB 3.45Å; A151-L155 PolarHBondContact O-N 3.46Å; C152-L155 PolarHBondContact O-N 2.96Å; L155-I166 HydrophobicContact CD1-CB 4.42Å; L155-I166 HydrophobicContact CD1-CG2 3.94Å; L155-V169 HydrophobicContact CD1-CB 3.9Å; L155-V169 HydrophobicContact CD1-CG1 3.84Å; L155-A170 HydrophobicContact CD1-CB 4.48Å; L155-A170 HydrophobicContact CD2-CB 4.37Å; L155-I173 HydrophobicContact CB-CD1 4.46Å; L155-I173 HydrophobicContact CD2-CD1 4.47Å; L155-F211 HydrophobicContact CD2-CD2 3.47Å; L155-F211 VanDerWaalsContact CD2-CD2 3.47Å; L155-F211 HydrophobicContact CD2-CE2 3.55Å
156	K	82.2	Confident	82.2	Confident	86 Å²	86	63.5 Å²	63.5	37%	0.374	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-14.5	177.3	-69.2	172.3	174.3	177.5	0	114.4	C152 G154 N212	C152-K156 PolarHBondContact O-N 3.47Å; G154-K156 PolarHBondContact O-N 3.01Å; G154-K156 VanDerWaalsContact O-N 3.15Å; K156-N212 WeakPolarHBondContact CE-OD1 3.39Å; K156-N212 PolarHBondContact NZ-OD1 3.44Å
157	Q	80.2	Confident	81.9	Confident	154 Å²	154	67.8 Å²	67.8	72%	0.72	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.1	-23.6	177.7	-68.6	179.2	2.1	0	0	113	G154 S159	G154-Q157 WeakPolarHBondContact O-CB 3.31Å; G154-Q157 PolarHBondContact O-N 3.39Å; Q157-S159 PolarHBondContact O-N 3.05Å
158	Y	80.7	Confident	81.9	Confident	81 Å²	81	73.5 Å²	73.5	32%	0.318	35%	0.345	S	S	.	.	S	Bend	trans	-65.8	130.8	175.4	-63.8	-69.1	0	0	0	110.9	G154 E162 L165 I166 V169 Q208	G154-Y158 WeakPolarHBondContact O-CD2 3.45Å; Y158-E162 WeakPolarHBondContact CD1-OE2 3.49Å; Y158-L165 HydrophobicContact CD1-CD2 3.75Å; Y158-L165 HydrophobicContact CD1-CG 4.4Å; Y158-L165 HydrophobicContact CE1-CD2 3.52Å; Y158-L165 HydrophobicContact CE1-CG 4.24Å; Y158-I166 HydrophobicContact CG-CG1 4.46Å; Y158-V169 HydrophobicContact CE2-CG2 4.24Å; Y158-Q208 PolarHBondContact O-NE2 3.5Å
159	S	73.7	Confident	81.7	Confident	65 Å²	65	74.4 Å²	74.4	46%	0.455	35%	0.351	S	S	.	.			trans	-65.2	146.2	173.7	-170.7	0	0	0	0	110.3	Q157 K161 E162	Q157-S159 PolarHBondContact O-N 3.05Å; S159-K161 PolarHBondContact O-N 2.81Å; S159-E162 PolarHBondContact O-N 2.95Å
160	E	71.6	Confident	81.5	Confident	117 Å²	117	74 Å²	74	55%	0.547	35%	0.349	S	S	.	.	G	3₁₀ helix	trans	-54.9	-23.7	175.1	-171.8	179.1	-168.6	0	0	112.8	E162 R163	E160-E162 PolarHBondContact O-N 3.44Å; E160-R163 HydrophobicContact CG-CG 4.25Å; E160-R163 WeakPolarHBondContact O-CG 3.48Å; E160-R163 PolarHBondContact O-N 3.49Å; E160-R163 VanDerWaalsContact O-N 3.15Å; E160-R163 IonicContact OE1-CZ 3.48Å; E160-R163 IonicContact OE1-NE 3.54Å; E160-R163 PolarHBondContact OE1-NE 3.26Å; E160-R163 IonicContact OE1-NH2 2.67Å; E160-R163 PolarHBondContact OE1-NH2 2.82Å
161	K	70.7	Confident	81.3	Confident	191 Å²	191	74.4 Å²	74.4	83%	0.83	35%	0.353	S	S	*	.	G	3₁₀ helix	trans	-53.9	-22.6	171.3	-62.4	177.1	-177.4	176.6	0	113.5	S159	S159-K161 PolarHBondContact O-N 2.81Å
162	E	79.6	Confident	81.1	Confident	92 Å²	92	78.1 Å²	78.1	43%	0.43	37%	0.368	S	S	.	.	G	3₁₀ helix	trans	-104.9	34	-179.1	-55.4	-169.5	146.7	0	0	112.9	Y158 S159 E160 P164 L165 I166	Y158-E162 WeakPolarHBondContact CD1-OE2 3.49Å; S159-E162 PolarHBondContact O-N 2.95Å; E160-E162 PolarHBondContact O-N 3.44Å; E162-P164 VanDerWaalsContact C-N 3.32Å; E162-P164 VanDerWaalsContact O-N 3.1Å; E162-L165 HydrophobicContact CB-CB 4.17Å; E162-L165 WeakPolarHBondContact O-CA 3.43Å; E162-L165 WeakPolarHBondContact O-CB 3.36Å; E162-L165 PolarHBondContact O-N 2.9Å; E162-I166 PolarHBondContact O-N 3.47Å
163	R	74.8	Confident	81	Confident	150 Å²	150	78.1 Å²	78.1	57%	0.566	37%	0.368	S	S	*	.	H	α-helix	trans	-38.4	-47.9	174.8	-61.3	-153.5	-176.5	135.6	-3.7	115.2	E160 L165 I166 E167	E160-R163 HydrophobicContact CG-CG 4.25Å; E160-R163 WeakPolarHBondContact O-CG 3.48Å; E160-R163 PolarHBondContact O-N 3.49Å; E160-R163 VanDerWaalsContact O-N 3.15Å; E160-R163 IonicContact OE1-CZ 3.48Å; E160-R163 IonicContact OE1-NE 3.54Å; E160-R163 PolarHBondContact OE1-NE 3.26Å; E160-R163 IonicContact OE1-NH2 2.67Å; E160-R163 PolarHBondContact OE1-NH2 2.82Å; R163-L165 VanDerWaalsContact C-N 3.27Å; R163-L165 PolarHBondContact O-N 3Å; R163-I166 PolarHBondContact O-N 3.15Å; R163-E167 WeakPolarHBondContact O-CB 3.35Å; R163-E167 WeakPolarHBondContact O-CG 3.31Å; R163-E167 PolarHBondContact O-N 2.86Å
164	P	79.7	Confident	80.7	Confident	87 Å²	87	75.4 Å²	75.4	57%	0.565	36%	0.356	S	S	*	.	H	α-helix	trans	-68.2	-19.8	179.2	27.1	-36.6	0	0	0	114.7	E162 R168	E162-P164 VanDerWaalsContact C-N 3.32Å; E162-P164 VanDerWaalsContact O-N 3.1Å; P164-R168 WeakPolarHBondContact O-CB 3.36Å; P164-R168 PolarHBondContact O-N 3.27Å
165	L	81.6	Confident	80.3	Confident	55 Å²	55	78.1 Å²	78.1	29%	0.288	36%	0.363	S	S	.	.	H	α-helix	trans	-82.7	-43.4	171	-174.9	59.3	0	0	0	110.7	Y158 E162 R163 E167 R168 V169	Y158-L165 HydrophobicContact CD1-CD2 3.75Å; Y158-L165 HydrophobicContact CD1-CG 4.4Å; Y158-L165 HydrophobicContact CE1-CD2 3.52Å; Y158-L165 HydrophobicContact CE1-CG 4.24Å; E162-L165 HydrophobicContact CB-CB 4.17Å; E162-L165 WeakPolarHBondContact O-CA 3.43Å; E162-L165 WeakPolarHBondContact O-CB 3.36Å; E162-L165 PolarHBondContact O-N 2.9Å; R163-L165 VanDerWaalsContact C-N 3.27Å; R163-L165 PolarHBondContact O-N 3Å; L165-E167 VanDerWaalsContact C-N 3.29Å; L165-E167 PolarHBondContact O-N 3.41Å; L165-R168 PolarHBondContact O-N 3.43Å; L165-R168 VanDerWaalsContact O-N 3.13Å; L165-V169 HydrophobicContact CD1-CG2 4.19Å; L165-V169 HydrophobicContact CG-CG2 4.42Å; L165-V169 WeakPolarHBondContact O-CG2 3.22Å; L165-V169 PolarHBondContact O-N 2.69Å
166	I	82.9	Confident	79.8	Confident	7 Å²	7	81.2 Å²	81.2	4%	0.036	38%	0.379	C	S	.	.	H	α-helix	trans	-55.1	-47.2	171.8	-65.1	170.7	0	0	0	109.9	L155 Y158 E162 R163 V169 A170 Q208	L155-I166 HydrophobicContact CD1-CB 4.42Å; L155-I166 HydrophobicContact CD1-CG2 3.94Å; Y158-I166 HydrophobicContact CG-CG1 4.46Å; E162-I166 PolarHBondContact O-N 3.47Å; R163-I166 PolarHBondContact O-N 3.15Å; I166-V169 PolarHBondContact O-N 2.75Å; I166-A170 WeakPolarHBondContact O-CB 3.39Å; I166-A170 PolarHBondContact O-N 2.87Å; I166-Q208 HydrophobicContact CD1-CG 4.3Å; I166-Q208 HydrophobicContact CG2-CG 4.47Å
167	E	82.7	Confident	79.4	Confident	91 Å²	91	78.6 Å²	78.6	43%	0.425	37%	0.367	S	S	.	.	H	α-helix	trans	-57.2	-50.8	173.5	-78.2	176.3	-151.5	0	0	111.9	R163 L165 V169 A170 H171 V206	R163-E167 WeakPolarHBondContact O-CB 3.35Å; R163-E167 WeakPolarHBondContact O-CG 3.31Å; R163-E167 PolarHBondContact O-N 2.86Å; L165-E167 VanDerWaalsContact C-N 3.29Å; L165-E167 PolarHBondContact O-N 3.41Å; E167-V169 PolarHBondContact O-N 2.98Å; E167-A170 PolarHBondContact O-N 3.4Å; E167-H171 WeakPolarHBondContact O-CB 3.43Å; E167-H171 PolarHBondContact O-N 2.87Å; E167-H171 PolarHBondContact O-ND1 3.46Å; E167-V206 HydrophobicContact CG-CB 4.22Å; E167-V206 HydrophobicContact CG-CG1 4.24Å; E167-V206 HydrophobicContact CG-CG2 4.5Å
168	R	84.6	Confident	78.8	Confident	177 Å²	177	71.3 Å²	71.3	67%	0.668	33%	0.333	S	S	*	.	H	α-helix	trans	-61.3	-42.6	-179	-172.2	-179.3	-59.8	162.6	4.6	112.5	P164 L165 M172	P164-R168 WeakPolarHBondContact O-CB 3.36Å; P164-R168 PolarHBondContact O-N 3.27Å; L165-R168 PolarHBondContact O-N 3.43Å; L165-R168 VanDerWaalsContact O-N 3.13Å; R168-M172 WeakPolarHBondContact O-CB 3.23Å; R168-M172 PolarHBondContact O-N 3.48Å
169	V	85	Confident	78.2	Confident	19 Å²	19	72.7 Å²	72.7	12%	0.115	34%	0.338	C	S	.	.	H	α-helix	trans	-70.5	-43.1	178.7	176.9	0	0	0	0	110.4	L155 Y158 L165 I166 E167 H171 M172 I173	L155-V169 HydrophobicContact CD1-CB 3.9Å; L155-V169 HydrophobicContact CD1-CG1 3.84Å; Y158-V169 HydrophobicContact CE2-CG2 4.24Å; L165-V169 HydrophobicContact CD1-CG2 4.19Å; L165-V169 HydrophobicContact CG-CG2 4.42Å; L165-V169 WeakPolarHBondContact O-CG2 3.22Å; L165-V169 PolarHBondContact O-N 2.69Å; I166-V169 PolarHBondContact O-N 2.75Å; E167-V169 PolarHBondContact O-N 2.98Å; V169-H171 VanDerWaalsContact C-N 3.35Å; V169-H171 PolarHBondContact O-N 2.88Å; V169-M172 WeakPolarHBondContact O-CB 3.34Å; V169-M172 PolarHBondContact O-N 2.77Å; V169-M172 VanDerWaalsContact O-N 3.14Å; V169-I173 HydrophobicContact CG1-CD1 3.83Å; V169-I173 HydrophobicContact CG1-CG1 4.33Å; V169-I173 VanDerWaalsContact O-CG1 3.31Å; V169-I173 WeakPolarHBondContact O-CG1 3.4Å; V169-I173 PolarHBondContact O-N 2.77Å
170	A	84.5	Confident	77.7	Confident	0 Å²	0	74 Å²	74	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-61.5	-40.1	174.1	0	0	0	0	0	112.6	L155 I166 E167 I173 H174 V206 M210 F211	L155-A170 HydrophobicContact CD1-CB 4.48Å; L155-A170 HydrophobicContact CD2-CB 4.37Å; I166-A170 WeakPolarHBondContact O-CB 3.39Å; I166-A170 PolarHBondContact O-N 2.87Å; E167-A170 PolarHBondContact O-N 3.4Å; A170-I173 PolarHBondContact O-N 2.98Å; A170-H174 VanDerWaalsContact O-CB 3.26Å; A170-H174 WeakPolarHBondContact O-CB 3.23Å; A170-H174 PolarHBondContact O-N 2.88Å; A170-V206 HydrophobicContact CB-CG1 3.51Å; A170-M210 HydrophobicContact CB-SD 4.11Å; A170-F211 HydrophobicContact CB-CE2 3.79Å; A170-F211 HydrophobicContact CB-CZ 4.15Å
171	H	82.7	Confident	77	Confident	80 Å²	80	75.6 Å²	75.6	37%	0.37	35%	0.352	S	S	.	.	H	α-helix	trans	-61.6	-42.6	172.3	-79.7	66.8	0	0	0	111.6	E167 V169 H174 Q175 F201	E167-H171 WeakPolarHBondContact O-CB 3.43Å; E167-H171 PolarHBondContact O-N 2.87Å; E167-H171 PolarHBondContact O-ND1 3.46Å; V169-H171 VanDerWaalsContact C-N 3.35Å; V169-H171 PolarHBondContact O-N 2.88Å; H171-H174 PolarHBondContact O-N 2.94Å; H171-Q175 VanDerWaalsContact O-CG 3.31Å; H171-Q175 WeakPolarHBondContact O-CG 3.47Å; H171-Q175 PolarHBondContact O-N 2.98Å; H171-F201 HydrophobicContact CB-CE2 4.35Å; H171-F201 AromaticContact CD2-CE2 3.8Å; H171-F201 AromaticContact CD2-CZ 3.46Å; H171-F201 VanDerWaalsContact CD2-CZ 3.46Å; H171-F201 WeakPolarHBondContact CD2-CZ 3.41Å; H171-F201 AromaticContact CE1-CE2 3.91Å; H171-F201 AromaticContact CG-CE2 3.71Å; H171-F201 AromaticContact CG-CZ 3.83Å; H171-F201 AromaticContact ND1-CE2 3.79Å; H171-F201 AromaticContact NE2-CE2 3.92Å; H171-F201 AromaticContact NE2-CZ 3.68Å
172	M	83.2	Confident	76.5	Confident	103 Å²	103	68.8 Å²	68.8	51%	0.507	34%	0.336	S	S	.	.	H	α-helix	trans	-64.6	-47.7	176.9	-175.9	176.2	69.9	0	0	111.8	R168 V169 H174 Q175 N176	R168-M172 WeakPolarHBondContact O-CB 3.23Å; R168-M172 PolarHBondContact O-N 3.48Å; V169-M172 WeakPolarHBondContact O-CB 3.34Å; V169-M172 PolarHBondContact O-N 2.77Å; V169-M172 VanDerWaalsContact O-N 3.14Å; M172-H174 VanDerWaalsContact C-N 3.32Å; M172-H174 PolarHBondContact O-N 3.09Å; M172-Q175 PolarHBondContact O-N 3.37Å; M172-N176 WeakPolarHBondContact O-CB 3.4Å; M172-N176 VanDerWaalsContact O-CG 3.26Å; M172-N176 PolarHBondContact O-N 3.49Å; M172-N176 PolarHBondContact O-OD1 2.88Å
173	I	84.5	Confident	75.7	Confident	1 Å²	1	72.8 Å²	72.8	1%	0.005	36%	0.355	C	S	.	.	H	α-helix	trans	-57.2	-46.6	175.9	-69.2	168.9	0	0	0	110.3	F148 A151 L155 V169 A170 Y177 F211	F148-I173 HydrophobicContact CD2-CG2 3.77Å; F148-I173 HydrophobicContact CE2-CG2 3.47Å; F148-I173 VanDerWaalsContact CE2-CG2 3.47Å; A151-I173 HydrophobicContact CB-CD1 3.76Å; A151-I173 HydrophobicContact CB-CG1 3.8Å; L155-I173 HydrophobicContact CB-CD1 4.46Å; L155-I173 HydrophobicContact CD2-CD1 4.47Å; V169-I173 HydrophobicContact CG1-CD1 3.83Å; V169-I173 HydrophobicContact CG1-CG1 4.33Å; V169-I173 VanDerWaalsContact O-CG1 3.31Å; V169-I173 WeakPolarHBondContact O-CG1 3.4Å; V169-I173 PolarHBondContact O-N 2.77Å; A170-I173 PolarHBondContact O-N 2.98Å; I173-Y177 HydrophobicContact CG2-CD2 4.37Å; I173-Y177 WeakPolarHBondContact O-CB 3.46Å; I173-Y177 PolarHBondContact O-N 2.69Å; I173-F211 HydrophobicContact CB-CE1 4.42Å; I173-F211 HydrophobicContact CB-CZ 4.07Å; I173-F211 HydrophobicContact CG2-CD1 4.12Å; I173-F211 HydrophobicContact CG2-CE1 3.63Å; I173-F211 HydrophobicContact CG2-CE2 4.33Å; I173-F211 HydrophobicContact CG2-CZ 3.75Å
174	H	79.1	Confident	75.2	Confident	3 Å²	3	70.6 Å²	70.6	1%	0.014	35%	0.35	C	S	.	.	I	π-helix	trans	-63.8	-43.3	179.6	-174.9	-85.8	0	0	0	113.1	A170 H171 M172 V178 R179 Q198 F201	A170-H174 VanDerWaalsContact O-CB 3.26Å; A170-H174 WeakPolarHBondContact O-CB 3.23Å; A170-H174 PolarHBondContact O-N 2.88Å; H171-H174 PolarHBondContact O-N 2.94Å; M172-H174 VanDerWaalsContact C-N 3.32Å; M172-H174 PolarHBondContact O-N 3.09Å; H174-V178 PolarHBondContact O-N 3.21Å; H174-R179 PolarHBondContact O-N 3.35Å; H174-R179 VanDerWaalsContact O-N 3.15Å; H174-Q198 PolarHBondContact CE1-OE1 3.39Å; H174-Q198 VanDerWaalsContact CE1-OE1 3.3Å; H174-F201 HydrophobicContact CB-CD2 4.18Å; H174-F201 HydrophobicContact CB-CE2 4.1Å; H174-F201 AromaticContact CE1-CD1 3.96Å; H174-F201 AromaticContact CG-CD2 3.94Å
175	Q	78	Confident	74.5	Confident	79 Å²	79	67.9 Å²	67.9	37%	0.369	33%	0.333	S	S	.	.	I	π-helix	trans	-73	-33.1	179.9	-66.6	-60.3	-36.9	0	0	113.3	H171 M172	H171-Q175 VanDerWaalsContact O-CG 3.31Å; H171-Q175 WeakPolarHBondContact O-CG 3.47Å; H171-Q175 PolarHBondContact O-N 2.98Å; M172-Q175 PolarHBondContact O-N 3.37Å
176	N	73.7	Confident	73.9	Confident	68 Å²	68	65.3 Å²	65.3	36%	0.364	32%	0.32	S	S	.	.	I	π-helix	trans	-83.7	-46.4	-176.1	-67.2	3.2	0	0	0	112.7	M172 F184	M172-N176 WeakPolarHBondContact O-CB 3.4Å; M172-N176 VanDerWaalsContact O-CG 3.26Å; M172-N176 PolarHBondContact O-N 3.49Å; M172-N176 PolarHBondContact O-OD1 2.88Å; N176-F184 CarbonylContact O-C 3.57Å
177	Y	73	Confident	73.2	Confident	30 Å²	30	69.8 Å²	69.8	12%	0.118	35%	0.347	C	S	.	.	I	π-helix	trans	-108.5	-39.8	-166.4	-63.5	-72.9	0	0	0	114.1	N144 D147 F148 I173 F184 L186	N144-Y177 HydrophobicContact CB-CE1 4.36Å; N144-Y177 WeakPolarHBondContact O-CE1 3.34Å; D147-Y177 WeakPolarHBondContact CB-OH 3.4Å; F148-Y177 HydrophobicContact CB-CD1 3.97Å; F148-Y177 HydrophobicContact CB-CD2 4.29Å; F148-Y177 HydrophobicContact CB-CE1 4.18Å; F148-Y177 HydrophobicContact CB-CE2 4.47Å; F148-Y177 HydrophobicContact CB-CG 4.03Å; F148-Y177 HydrophobicContact CD2-CD1 4.48Å; F148-Y177 AromaticContact CD2-CD2 3.83Å; F148-Y177 HydrophobicContact CD2-CD2 3.83Å; F148-Y177 AromaticContact CD2-CG 3.74Å; F148-Y177 HydrophobicContact CD2-CG 3.74Å; F148-Y177 HydrophobicContact CG-CG 4.35Å; I173-Y177 HydrophobicContact CG2-CD2 4.37Å; I173-Y177 WeakPolarHBondContact O-CB 3.46Å; I173-Y177 PolarHBondContact O-N 2.69Å; Y177-F184 HydrophobicContact CD1-CB 4.28Å; Y177-F184 VanDerWaalsContact CD1-O 3.28Å; Y177-F184 WeakPolarHBondContact CD1-O 3.46Å; Y177-F184 HydrophobicContact CE1-CB 4.25Å; Y177-L186 HydrophobicContact CD1-CD1 4.38Å; Y177-L186 HydrophobicContact CD1-CD2 3.9Å; Y177-L186 HydrophobicContact CD1-CG 4.05Å; Y177-L186 HydrophobicContact CG-CD1 4.41Å; Y177-L186 HydrophobicContact CG-CG 4.43Å; Y177-L186 PolarHBondContact O-N 3.12Å
178	V	69.6	Low	72.6	Confident	2 Å²	2	66.9 Å²	66.9	1%	0.012	34%	0.337	C	S	.	.	I	π-helix	trans	-80.1	-34	-175.1	-174.5	0	0	0	0	111.1	F148 H174 R194 I197 F211	F148-V178 HydrophobicContact CE2-CG2 4.32Å; H174-V178 PolarHBondContact O-N 3.21Å; V178-R194 HydrophobicContact CG1-CG 3.77Å; V178-R194 VanDerWaalsContact O-CD 3.23Å; V178-R194 WeakPolarHBondContact O-CD 3.27Å; V178-R194 WeakPolarHBondContact O-CG 3.14Å; V178-R194 PolarHBondContact O-NH1 3.41Å; V178-I197 HydrophobicContact CG1-CB 4.46Å; V178-I197 HydrophobicContact CG1-CG2 4.1Å; V178-I197 HydrophobicContact CG2-CG2 4.36Å; V178-F211 HydrophobicContact CG2-CE1 4.19Å
179	R	66.6	Low	72.2	Confident	109 Å²	109	58.8 Å²	58.8	41%	0.411	31%	0.307	S	S	.	.	S	Bend	trans	-70.6	124.9	177	-166.1	178.1	-170	134.2	7.7	111	H174 Q181	H174-R179 PolarHBondContact O-N 3.35Å; H174-R179 VanDerWaalsContact O-N 3.15Å; R179-Q181 HydrophobicContact CG-CB 4.43Å; R179-Q181 PolarHBondContact O-N 3.06Å
180	P	64.5	Low	71.8	Confident	92 Å²	92	64.7 Å²	64.7	60%	0.597	33%	0.327	S	S	*	.	S	Bend	trans	-78.3	40.8	-175.9	34.1	-37.6	0	0	0	113.4
181	Q	55.6	Low	71.3	Confident	151 Å²	151	68.9 Å²	68.9	71%	0.706	36%	0.356	S	S	*	.	S	Bend	trans	-148.6	72.5	-173.3	-68.4	-173.3	-33.8	0	0	111.1	R179	R179-Q181 HydrophobicContact CG-CB 4.43Å; R179-Q181 PolarHBondContact O-N 3.06Å
182	G	59.8	Low	71	Confident	48 Å²	48	70.5 Å²	70.5	50%	0.495	36%	0.364	S	S	.	.	S	Bend	trans	174.2	161.7	174.6	0	0	0	0	0	111.7	F184 S185	G182-F184 PolarHBondContact O-N 2.91Å; G182-F184 VanDerWaalsContact O-N 3.15Å; G182-S185 VanDerWaalsContact O-CB 3.31Å; G182-S185 WeakPolarHBondContact O-CB 3.5Å; G182-S185 PolarHBondContact O-N 2.83Å
183	E	63.9	Low	70.9	Confident	177 Å²	177	66.5 Å²	66.5	83%	0.827	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-17.2	177.2	-64.2	169.7	161.9	0	0	112.8	N144	N144-E183 PolarHBondContact ND2-O 2.94Å
184	F	64.8	Low	70.8	Confident	103 Å²	103	68.4 Å²	68.4	45%	0.452	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.7	3.7	177.6	-52.5	-79.9	0	0	0	113.7	N144 N176 Y177 G182 L186	N144-F184 WeakPolarHBondContact OD1-CD1 3.33Å; N176-F184 CarbonylContact O-C 3.57Å; Y177-F184 HydrophobicContact CD1-CB 4.28Å; Y177-F184 VanDerWaalsContact CD1-O 3.28Å; Y177-F184 WeakPolarHBondContact CD1-O 3.46Å; Y177-F184 HydrophobicContact CE1-CB 4.25Å; G182-F184 PolarHBondContact O-N 2.91Å; G182-F184 VanDerWaalsContact O-N 3.15Å; F184-L186 PolarHBondContact O-N 3.29Å
185	S	64.3	Low	70.9	Confident	31 Å²	31	72.9 Å²	72.9	22%	0.217	38%	0.38	C	S	.	.			trans	-64.6	121	179.9	169.6	0	0	0	0	110.8	G182	G182-S185 VanDerWaalsContact O-CB 3.31Å; G182-S185 WeakPolarHBondContact O-CB 3.5Å; G182-S185 PolarHBondContact O-N 2.83Å
186	L	68.9	Low	71.2	Confident	1 Å²	1	72.2 Å²	72.2	1%	0.005	38%	0.377	C	S	.	.			trans	-67.4	139.9	-178.8	-60.6	176.2	0	0	0	112.1	N144 E145 F148 Y177 F184 I189 R194 V218	N144-L186 VanDerWaalsContact C-CD2 3.48Å; N144-L186 HydrophobicContact CB-CD2 3.73Å; E145-L186 HydrophobicContact CB-CD2 4.33Å; E145-L186 HydrophobicContact CG-CD2 3.89Å; F148-L186 HydrophobicContact CB-CD1 3.7Å; F148-L186 HydrophobicContact CB-CD2 4.18Å; F148-L186 HydrophobicContact CD1-CD1 3.75Å; F148-L186 HydrophobicContact CD2-CD1 3.62Å; F148-L186 HydrophobicContact CE1-CD1 4.22Å; F148-L186 HydrophobicContact CE2-CD1 4.09Å; F148-L186 HydrophobicContact CG-CD1 3.41Å; F148-L186 VanDerWaalsContact CG-CD1 3.41Å; F148-L186 HydrophobicContact CZ-CD1 4.37Å; Y177-L186 HydrophobicContact CD1-CD1 4.38Å; Y177-L186 HydrophobicContact CD1-CD2 3.9Å; Y177-L186 HydrophobicContact CD1-CG 4.05Å; Y177-L186 HydrophobicContact CG-CD1 4.41Å; Y177-L186 HydrophobicContact CG-CG 4.43Å; Y177-L186 PolarHBondContact O-N 3.12Å; F184-L186 PolarHBondContact O-N 3.29Å; L186-I189 HydrophobicContact CB-CD1 4.2Å; L186-I189 HydrophobicContact CB-CG1 4.26Å; L186-I189 HydrophobicContact CD1-CD1 3.38Å; L186-I189 HydrophobicContact CD1-CG1 4.1Å; L186-I189 HydrophobicContact CG-CD1 4.43Å; L186-R194 PolarHBondContact O-NH2 2.83Å; L186-V218 HydrophobicContact CD1-CG2 4.35Å
187	T	69.1	Low	71.7	Confident	101 Å²	101	69.2 Å²	69.2	62%	0.62	36%	0.36	S	S	*	.	S	Bend	trans	-90.4	-37	-177.6	60	0	0	0	0	112.1	E145	E145-T187 PolarHBondContact OE1-N 3.31Å; E145-T187 PolarHBondContact OE1-OG1 2.9Å
188	C	69.3	Low	72.1	Confident	29 Å²	29	71.7 Å²	71.7	20%	0.196	37%	0.373	C	S	.	.	S	Bend	trans	-83.6	-17	-172	62.5	0	0	0	0	115.9	E145 R190 F221	E145-C188 WeakPolarHBondContact CG-SG 3.28Å; C188-R190 PolarHBondContact O-N 3.3Å; C188-F221 HydrophobicContact CB-CB 3.82Å; C188-F221 HydrophobicContact CB-CD1 3.77Å; C188-F221 HydrophobicContact CB-CD2 3.56Å; C188-F221 HydrophobicContact CB-CE1 4.17Å; C188-F221 HydrophobicContact CB-CE2 3.98Å; C188-F221 HydrophobicContact CB-CG 3.43Å; C188-F221 VanDerWaalsContact CB-CG 3.43Å; C188-F221 HydrophobicContact CB-CZ 4.26Å
189	I	76.1	Confident	72.8	Confident	8 Å²	8	77.5 Å²	77.5	4%	0.041	40%	0.398	C	S	.	.	S	Bend	trans	-72	124.7	-179.5	-67	-178.3	0	0	0	110.8	F148 L186 T193 R194 A214 E217 V218	F148-I189 HydrophobicContact CE1-CD1 4.12Å; F148-I189 HydrophobicContact CZ-CD1 4Å; L186-I189 HydrophobicContact CB-CD1 4.2Å; L186-I189 HydrophobicContact CB-CG1 4.26Å; L186-I189 HydrophobicContact CD1-CD1 3.38Å; L186-I189 HydrophobicContact CD1-CG1 4.1Å; L186-I189 HydrophobicContact CG-CD1 4.43Å; I189-T193 HydrophobicContact CG2-CG2 4.25Å; I189-R194 HydrophobicContact CG2-CB 4.26Å; I189-A214 HydrophobicContact CD1-CB 3.77Å; I189-A214 HydrophobicContact CG1-CB 4.38Å; I189-E217 WeakPolarHBondContact CA-OE2 3.3Å; I189-V218 HydrophobicContact CD1-CG2 4.02Å; I189-V218 HydrophobicContact CG1-CG2 3.69Å
190	R	76.4	Confident	73.4	Confident	143 Å²	143	77.2 Å²	77.2	54%	0.54	40%	0.397	S	S	.	.			trans	-56.8	143.5	176	-66.6	177.4	67.8	112.9	-5.8	111	C188 E192 T193 R194 E217	C188-R190 PolarHBondContact O-N 3.3Å; R190-E192 IonicContact CZ-OE2 3.73Å; R190-E192 IonicContact NE-OE2 2.71Å; R190-E192 PolarHBondContact NE-OE2 3.49Å; R190-E192 IonicContact NH2-OE1 2.78Å; R190-E192 PolarHBondContact NH2-OE1 3.38Å; R190-E192 IonicContact NH2-OE2 3.86Å; R190-E192 PolarHBondContact NH2-OE2 2.97Å; R190-E192 PolarHBondContact O-N 2.87Å; R190-T193 PolarHBondContact O-N 2.8Å; R190-R194 PolarHBondContact O-N 3.26Å; R190-E217 WeakPolarHBondContact CD-OE1 3.38Å; R190-E217 PolarHBondContact N-OE2 2.92Å
191	S	73.3	Confident	74.2	Confident	88 Å²	88	74.5 Å²	74.5	62%	0.615	38%	0.376	S	S	*	.	H	α-helix	trans	-55.5	-39.1	176	48.2	0	0	0	0	112.5	R194 V195	S191-R194 WeakPolarHBondContact O-CB 3.46Å; S191-R194 PolarHBondContact O-N 3.24Å; S191-V195 WeakPolarHBondContact O-CG2 3.44Å; S191-V195 PolarHBondContact O-N 2.95Å
192	E	76.6	Confident	75.5	Confident	114 Å²	114	72.4 Å²	72.4	53%	0.533	37%	0.373	S	S	.	.	H	α-helix	trans	-60.3	-51.5	177.1	-61	155.3	150.4	0	0	112	R190 R194 V195 E196	R190-E192 IonicContact CZ-OE2 3.73Å; R190-E192 IonicContact NE-OE2 2.71Å; R190-E192 PolarHBondContact NE-OE2 3.49Å; R190-E192 IonicContact NH2-OE1 2.78Å; R190-E192 PolarHBondContact NH2-OE1 3.38Å; R190-E192 IonicContact NH2-OE2 3.86Å; R190-E192 PolarHBondContact NH2-OE2 2.97Å; R190-E192 PolarHBondContact O-N 2.87Å; E192-R194 VanDerWaalsContact C-N 3.33Å; E192-R194 PolarHBondContact O-N 3.48Å; E192-V195 WeakPolarHBondContact O-CA 3.4Å; E192-V195 WeakPolarHBondContact O-CB 3.41Å; E192-V195 PolarHBondContact O-N 2.8Å; E192-E196 PolarHBondContact O-N 2.88Å
193	T	82.2	Confident	76.4	Confident	18 Å²	18	73.1 Å²	73.1	11%	0.11	37%	0.374	C	S	.	.	H	α-helix	trans	-66	-36.1	179.7	-65.8	0	0	0	0	111.6	I189 R190 V195 E196 I197 A213 A214 E217	I189-T193 HydrophobicContact CG2-CG2 4.25Å; R190-T193 PolarHBondContact O-N 2.8Å; T193-V195 VanDerWaalsContact C-N 3.29Å; T193-V195 PolarHBondContact O-N 2.77Å; T193-E196 PolarHBondContact O-N 3.18Å; T193-I197 HydrophobicContact CG2-CD1 4Å; T193-I197 WeakPolarHBondContact O-CB 3.47Å; T193-I197 VanDerWaalsContact O-CG1 3.28Å; T193-I197 WeakPolarHBondContact O-CG1 3.46Å; T193-I197 PolarHBondContact O-N 3.1Å; T193-A213 HydrophobicContact CG2-CB 3.86Å; T193-A214 HydrophobicContact CG2-CB 3.86Å; T193-E217 VanDerWaalsContact CB-OE1 3.23Å; T193-E217 WeakPolarHBondContact CB-OE1 3.31Å; T193-E217 PolarHBondContact OG1-OE1 3.27Å
194	R	81.6	Confident	76.8	Confident	41 Å²	41	73.3 Å²	73.3	16%	0.155	37%	0.373	C	S	.	.	H	α-helix	trans	-60.1	-38.2	170	-161.1	-178.1	-63.5	-113.3	7.4	111.8	V178 L186 I189 R190 S191 E192 Q198	V178-R194 HydrophobicContact CG1-CG 3.77Å; V178-R194 VanDerWaalsContact O-CD 3.23Å; V178-R194 WeakPolarHBondContact O-CD 3.27Å; V178-R194 WeakPolarHBondContact O-CG 3.14Å; V178-R194 PolarHBondContact O-NH1 3.41Å; L186-R194 PolarHBondContact O-NH2 2.83Å; I189-R194 HydrophobicContact CG2-CB 4.26Å; R190-R194 PolarHBondContact O-N 3.26Å; S191-R194 WeakPolarHBondContact O-CB 3.46Å; S191-R194 PolarHBondContact O-N 3.24Å; E192-R194 VanDerWaalsContact C-N 3.33Å; E192-R194 PolarHBondContact O-N 3.48Å; R194-Q198 VanDerWaalsContact O-CB 3.29Å; R194-Q198 WeakPolarHBondContact O-CB 3.5Å; R194-Q198 PolarHBondContact O-N 3.41Å; R194-Q198 VanDerWaalsContact O-N 3.08Å
195	V	82.3	Confident	77.2	Confident	97 Å²	97	73.1 Å²	73.1	59%	0.588	37%	0.373	S	S	*	.	H	α-helix	trans	-73.2	-43.8	177.4	168.6	0	0	0	0	112.7	S191 E192 T193 I197 Q198 K199	S191-V195 WeakPolarHBondContact O-CG2 3.44Å; S191-V195 PolarHBondContact O-N 2.95Å; E192-V195 WeakPolarHBondContact O-CA 3.4Å; E192-V195 WeakPolarHBondContact O-CB 3.41Å; E192-V195 PolarHBondContact O-N 2.8Å; T193-V195 VanDerWaalsContact C-N 3.29Å; T193-V195 PolarHBondContact O-N 2.77Å; V195-I197 PolarHBondContact O-N 2.81Å; V195-Q198 PolarHBondContact O-N 2.93Å; V195-K199 VanDerWaalsContact O-CB 3.3Å; V195-K199 WeakPolarHBondContact O-CB 3.48Å; V195-K199 PolarHBondContact O-N 2.87Å
196	E	83.3	Confident	77.7	Confident	66 Å²	66	73.2 Å²	73.2	31%	0.308	37%	0.372	S	S	.	.	H	α-helix	trans	-64.7	-40.3	177.3	179.1	62.5	-165.6	0	0	111.3	E192 T193 K199 R200	E192-E196 PolarHBondContact O-N 2.88Å; T193-E196 PolarHBondContact O-N 3.18Å; E196-K199 WeakPolarHBondContact O-CB 3.39Å; E196-K199 PolarHBondContact O-N 3.13Å; E196-K199 IonicContact OE1-NZ 3.29Å; E196-K199 WeakPolarHBondContact OE2-CD 3.35Å; E196-K199 WeakPolarHBondContact OE2-CE 3.43Å; E196-K199 IonicContact OE2-NZ 2.72Å; E196-K199 PolarHBondContact OE2-NZ 3.17Å; E196-R200 WeakPolarHBondContact O-CG 3.24Å; E196-R200 PolarHBondContact O-N 3.43Å; E196-R200 IonicContact OE1-CZ 3.37Å; E196-R200 IonicContact OE1-NE 3.02Å; E196-R200 PolarHBondContact OE1-NE 2.72Å; E196-R200 IonicContact OE1-NH2 3.36Å; E196-R200 PolarHBondContact OE1-NH2 3.13Å
197	I	84.1	Confident	77.6	Confident	4 Å²	4	75.5 Å²	75.5	2%	0.021	39%	0.388	C	S	.	.	H	α-helix	trans	-62.3	-45.7	173.3	-67.4	169	0	0	0	110.7	V178 T193 V195 K199 R200 F201 M210 F211 A214	V178-I197 HydrophobicContact CG1-CB 4.46Å; V178-I197 HydrophobicContact CG1-CG2 4.1Å; V178-I197 HydrophobicContact CG2-CG2 4.36Å; T193-I197 HydrophobicContact CG2-CD1 4Å; T193-I197 WeakPolarHBondContact O-CB 3.47Å; T193-I197 VanDerWaalsContact O-CG1 3.28Å; T193-I197 WeakPolarHBondContact O-CG1 3.46Å; T193-I197 PolarHBondContact O-N 3.1Å; V195-I197 PolarHBondContact O-N 2.81Å; I197-K199 VanDerWaalsContact C-N 3.27Å; I197-K199 PolarHBondContact O-N 3.3Å; I197-R200 PolarHBondContact O-N 3.06Å; I197-F201 WeakPolarHBondContact O-CB 3.5Å; I197-F201 PolarHBondContact O-N 3.17Å; I197-M210 HydrophobicContact CG2-CE 4.08Å; I197-F211 HydrophobicContact CD1-CD1 4.2Å; I197-F211 HydrophobicContact CG2-CD1 4.2Å; I197-F211 HydrophobicContact CG2-CE1 3.9Å; I197-A214 HydrophobicContact CD1-CB 3.47Å; I197-A214 VanDerWaalsContact CD1-CB 3.47Å
198	Q	82.2	Confident	77.9	Confident	83 Å²	83	73.9 Å²	73.9	39%	0.388	37%	0.373	S	S	.	.	H	α-helix	trans	-61.7	-35.2	177	178.7	60.6	101.4	0	0	112	H174 R194 V195 V202	H174-Q198 PolarHBondContact CE1-OE1 3.39Å; H174-Q198 VanDerWaalsContact CE1-OE1 3.3Å; R194-Q198 VanDerWaalsContact O-CB 3.29Å; R194-Q198 WeakPolarHBondContact O-CB 3.5Å; R194-Q198 PolarHBondContact O-N 3.41Å; R194-Q198 VanDerWaalsContact O-N 3.08Å; V195-Q198 PolarHBondContact O-N 2.93Å; Q198-V202 WeakPolarHBondContact O-CG2 3.46Å; Q198-V202 PolarHBondContact O-N 3.49Å
199	K	83.9	Confident	78.4	Confident	124 Å²	124	76.6 Å²	76.6	54%	0.539	39%	0.39	S	S	.	.	H	α-helix	trans	-68.4	-46.1	175.6	172.7	179.3	152.4	-145.8	0	112.1	V195 E196 I197 F201 V202 A203	V195-K199 VanDerWaalsContact O-CB 3.3Å; V195-K199 WeakPolarHBondContact O-CB 3.48Å; V195-K199 PolarHBondContact O-N 2.87Å; E196-K199 WeakPolarHBondContact O-CB 3.39Å; E196-K199 PolarHBondContact O-N 3.13Å; E196-K199 IonicContact OE1-NZ 3.29Å; E196-K199 WeakPolarHBondContact OE2-CD 3.35Å; E196-K199 WeakPolarHBondContact OE2-CE 3.43Å; E196-K199 IonicContact OE2-NZ 2.72Å; E196-K199 PolarHBondContact OE2-NZ 3.17Å; I197-K199 VanDerWaalsContact C-N 3.27Å; I197-K199 PolarHBondContact O-N 3.3Å; K199-F201 VanDerWaalsContact C-N 3.31Å; K199-F201 PolarHBondContact O-N 3.26Å; K199-V202 PolarHBondContact O-N 3.33Å; K199-A203 WeakPolarHBondContact O-CB 3.46Å; K199-A203 PolarHBondContact O-N 2.78Å
200	R	80	Confident	78.6	Confident	102 Å²	102	77 Å²	77	39%	0.385	39%	0.391	S	S	.	.	H	α-helix	trans	-60.8	-40.4	173.1	-66.1	-66.2	172.2	156.3	6.4	112.2	E196 I197 A203 K204 E205	E196-R200 WeakPolarHBondContact O-CG 3.24Å; E196-R200 PolarHBondContact O-N 3.43Å; E196-R200 IonicContact OE1-CZ 3.37Å; E196-R200 IonicContact OE1-NE 3.02Å; E196-R200 PolarHBondContact OE1-NE 2.72Å; E196-R200 IonicContact OE1-NH2 3.36Å; E196-R200 PolarHBondContact OE1-NH2 3.13Å; I197-R200 PolarHBondContact O-N 3.06Å; R200-A203 CarbonylContact O-C 3.56Å; R200-A203 PolarHBondContact O-N 2.83Å; R200-K204 PolarHBondContact O-N 3.07Å; R200-K204 VanDerWaalsContact O-N 3.11Å; R200-E205 WeakPolarHBondContact CD-OE2 3.24Å; R200-E205 IonicContact CZ-OE2 3.25Å; R200-E205 IonicContact NE-OE2 2.76Å; R200-E205 IonicContact NH1-OE2 3.59Å; R200-E205 PolarHBondContact NH1-OE2 2.79Å; R200-E205 PolarHBondContact O-N 3.24Å; R200-E205 VanDerWaalsContact O-N 3.08Å
201	F	81.6	Confident	79	Confident	35 Å²	35	70.3 Å²	70.3	15%	0.154	37%	0.366	C	S	.	.	H	α-helix	trans	-63.2	-40.7	175.7	-169.9	-95.4	0	0	0	112.3	H171 H174 I197 K199 K204 M210	H171-F201 HydrophobicContact CB-CE2 4.35Å; H171-F201 AromaticContact CD2-CE2 3.8Å; H171-F201 AromaticContact CD2-CZ 3.46Å; H171-F201 VanDerWaalsContact CD2-CZ 3.46Å; H171-F201 WeakPolarHBondContact CD2-CZ 3.41Å; H171-F201 AromaticContact CE1-CE2 3.91Å; H171-F201 AromaticContact CG-CE2 3.71Å; H171-F201 AromaticContact CG-CZ 3.83Å; H171-F201 AromaticContact ND1-CE2 3.79Å; H171-F201 AromaticContact NE2-CE2 3.92Å; H171-F201 AromaticContact NE2-CZ 3.68Å; H174-F201 HydrophobicContact CB-CD2 4.18Å; H174-F201 HydrophobicContact CB-CE2 4.1Å; H174-F201 AromaticContact CE1-CD1 3.96Å; H174-F201 AromaticContact CG-CD2 3.94Å; I197-F201 WeakPolarHBondContact O-CB 3.5Å; I197-F201 PolarHBondContact O-N 3.17Å; K199-F201 VanDerWaalsContact C-N 3.31Å; K199-F201 PolarHBondContact O-N 3.26Å; F201-K204 PolarHBondContact O-N 2.98Å; F201-M210 HydrophobicContact CB-CE 4.39Å; F201-M210 HydrophobicContact CD2-CE 4.36Å
202	V	81	Confident	79.6	Confident	108 Å²	108	68.8 Å²	68.8	66%	0.655	35%	0.351	S	S	*	.	H	α-helix	trans	-67.9	-36.9	173.5	167.7	0	0	0	0	112.1	Q198 K199 K204	Q198-V202 WeakPolarHBondContact O-CG2 3.46Å; Q198-V202 PolarHBondContact O-N 3.49Å; K199-V202 PolarHBondContact O-N 3.33Å; V202-K204 PolarHBondContact O-N 2.91Å
203	A	79.8	Confident	80.1	Confident	62 Å²	62	65.9 Å²	65.9	51%	0.512	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-9.1	173.1	0	0	0	0	0	113.7	K199 R200 E205	K199-A203 WeakPolarHBondContact O-CB 3.46Å; K199-A203 PolarHBondContact O-N 2.78Å; R200-A203 CarbonylContact O-C 3.56Å; R200-A203 PolarHBondContact O-N 2.83Å; A203-E205 HydrophobicContact CB-CG 4.03Å; A203-E205 PolarHBondContact O-N 3.24Å
204	K	72.9	Confident	80.3	Confident	182 Å²	182	65 Å²	65	79%	0.791	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.8	19.6	-172.4	-53.8	-179.2	-179.1	177.9	0	114.2	R200 F201 V202 V206	R200-K204 PolarHBondContact O-N 3.07Å; R200-K204 VanDerWaalsContact O-N 3.11Å; F201-K204 PolarHBondContact O-N 2.98Å; V202-K204 PolarHBondContact O-N 2.91Å; K204-V206 PolarHBondContact O-N 3.1Å
205	E	73.3	Confident	80.6	Confident	99 Å²	99	63.9 Å²	63.9	46%	0.463	34%	0.338	S	S	.	.			trans	-79.3	66.4	175.2	-66.5	-175.2	161.7	0	0	110.5	R200 A203 S207	R200-E205 WeakPolarHBondContact CD-OE2 3.24Å; R200-E205 IonicContact CZ-OE2 3.25Å; R200-E205 IonicContact NE-OE2 2.76Å; R200-E205 IonicContact NH1-OE2 3.59Å; R200-E205 PolarHBondContact NH1-OE2 2.79Å; R200-E205 PolarHBondContact O-N 3.24Å; R200-E205 VanDerWaalsContact O-N 3.08Å; A203-E205 HydrophobicContact CB-CG 4.03Å; A203-E205 PolarHBondContact O-N 3.24Å; E205-S207 VanDerWaalsContact C-N 3.28Å; E205-S207 PolarHBondContact O-N 3.06Å
206	V	73	Confident	80.9	Confident	32 Å²	32	64.5 Å²	64.5	19%	0.194	34%	0.337	C	S	.	.			trans	-80.1	77.5	179.7	-172.4	0	0	0	0	110.3	E167 A170 K204 M210	E167-V206 HydrophobicContact CG-CB 4.22Å; E167-V206 HydrophobicContact CG-CG1 4.24Å; E167-V206 HydrophobicContact CG-CG2 4.5Å; A170-V206 HydrophobicContact CB-CG1 3.51Å; K204-V206 PolarHBondContact O-N 3.1Å; V206-M210 HydrophobicContact CB-SD 4.44Å; V206-M210 HydrophobicContact CG1-SD 3.92Å
207	S	68.1	Low	81.2	Confident	49 Å²	49	63.2 Å²	63.2	34%	0.343	33%	0.331	S	S	.	.			trans	-90.3	153	171.4	67.5	0	0	0	0	111.5	E205 T209 M210	E205-S207 VanDerWaalsContact C-N 3.28Å; E205-S207 PolarHBondContact O-N 3.06Å; S207-T209 WeakPolarHBondContact CB-OG1 3.48Å; S207-T209 PolarHBondContact O-N 3.11Å; S207-T209 VanDerWaalsContact O-N 3.09Å; S207-T209 PolarHBondContact OG-OG1 3.27Å; S207-M210 WeakPolarHBondContact O-CB 3.45Å; S207-M210 VanDerWaalsContact O-CG 3.24Å; S207-M210 WeakPolarHBondContact O-CG 3.36Å; S207-M210 PolarHBondContact O-N 3.25Å; S207-M210 PolarHBondContact OG-N 3.1Å
208	Q	75.3	Confident	81.4	Confident	67 Å²	67	63 Å²	63	31%	0.313	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-23	170.4	-65	175.7	-9.7	0	0	112.7	Y158 I166	Y158-Q208 PolarHBondContact O-NE2 3.5Å; I166-Q208 HydrophobicContact CD1-CG 4.3Å; I166-Q208 HydrophobicContact CG2-CG 4.47Å
209	T	79.6	Confident	81.8	Confident	87 Å²	87	61.2 Å²	61.2	53%	0.534	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.8	-10.4	178.9	53.8	0	0	0	0	114.1	S207 F211 N212	S207-T209 WeakPolarHBondContact CB-OG1 3.48Å; S207-T209 PolarHBondContact O-N 3.11Å; S207-T209 VanDerWaalsContact O-N 3.09Å; S207-T209 PolarHBondContact OG-OG1 3.27Å; T209-F211 PolarHBondContact O-N 3.11Å; T209-F211 VanDerWaalsContact O-N 3.1Å; T209-N212 VanDerWaalsContact O-CB 3.29Å; T209-N212 WeakPolarHBondContact O-CB 3.47Å; T209-N212 PolarHBondContact O-N 3.33Å
210	M	80.8	Confident	82	Confident	16 Å²	16	58 Å²	58	8%	0.079	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-27.9	-172.2	75.6	179.8	-76.9	0	0	113.8	A170 I197 F201 V206 S207	A170-M210 HydrophobicContact CB-SD 4.11Å; I197-M210 HydrophobicContact CG2-CE 4.08Å; F201-M210 HydrophobicContact CB-CE 4.39Å; F201-M210 HydrophobicContact CD2-CE 4.36Å; V206-M210 HydrophobicContact CB-SD 4.44Å; V206-M210 HydrophobicContact CG1-SD 3.92Å; S207-M210 WeakPolarHBondContact O-CB 3.45Å; S207-M210 VanDerWaalsContact O-CG 3.24Å; S207-M210 WeakPolarHBondContact O-CG 3.36Å; S207-M210 PolarHBondContact O-N 3.25Å; S207-M210 PolarHBondContact OG-N 3.1Å
211	F	83.7	Confident	82.4	Confident	2 Å²	2	55.4 Å²	55.4	1%	0.009	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.4	3.1	178.5	-59.5	-76.3	0	0	0	113.8	F148 L155 A170 I173 V178 I197 T209 A213 A214 Q215	F148-F211 HydrophobicContact CE2-CD1 4.38Å; F148-F211 HydrophobicContact CZ-CD1 4.29Å; L155-F211 HydrophobicContact CD2-CD2 3.47Å; L155-F211 VanDerWaalsContact CD2-CD2 3.47Å; L155-F211 HydrophobicContact CD2-CE2 3.55Å; A170-F211 HydrophobicContact CB-CE2 3.79Å; A170-F211 HydrophobicContact CB-CZ 4.15Å; I173-F211 HydrophobicContact CB-CE1 4.42Å; I173-F211 HydrophobicContact CB-CZ 4.07Å; I173-F211 HydrophobicContact CG2-CD1 4.12Å; I173-F211 HydrophobicContact CG2-CE1 3.63Å; I173-F211 HydrophobicContact CG2-CE2 4.33Å; I173-F211 HydrophobicContact CG2-CZ 3.75Å; V178-F211 HydrophobicContact CG2-CE1 4.19Å; I197-F211 HydrophobicContact CD1-CD1 4.2Å; I197-F211 HydrophobicContact CG2-CD1 4.2Å; I197-F211 HydrophobicContact CG2-CE1 3.9Å; T209-F211 PolarHBondContact O-N 3.11Å; T209-F211 VanDerWaalsContact O-N 3.1Å; F211-A213 VanDerWaalsContact C-N 3.33Å; F211-A213 PolarHBondContact O-N 2.64Å; F211-A214 PolarHBondContact O-N 3.27Å; F211-Q215 WeakPolarHBondContact O-CB 3.16Å; F211-Q215 PolarHBondContact O-N 3.4Å
212	N	86.1	Confident	82.7	Confident	57 Å²	57	53.7 Å²	53.7	31%	0.305	30%	0.299	S	S	.	.	H	α-helix	trans	-55.8	-43.7	-174.4	-81.3	-7.2	0	0	0	113.3	K156 T209 Q215 L216	K156-N212 WeakPolarHBondContact CE-OD1 3.39Å; K156-N212 PolarHBondContact NZ-OD1 3.44Å; T209-N212 VanDerWaalsContact O-CB 3.29Å; T209-N212 WeakPolarHBondContact O-CB 3.47Å; T209-N212 PolarHBondContact O-N 3.33Å; N212-Q215 PolarHBondContact O-N 2.69Å; N212-L216 WeakPolarHBondContact O-CG 3.24Å; N212-L216 PolarHBondContact O-N 2.92Å
213	A	86.5	Confident	83.2	Confident	53 Å²	53	53.9 Å²	53.9	44%	0.438	29%	0.288	S	S	.	.	H	α-helix	trans	-63	-48.8	178.6	0	0	0	0	0	111.8	T193 F211 Q215 L216 E217	T193-A213 HydrophobicContact CG2-CB 3.86Å; F211-A213 VanDerWaalsContact C-N 3.33Å; F211-A213 PolarHBondContact O-N 2.64Å; A213-Q215 VanDerWaalsContact C-N 3.34Å; A213-Q215 PolarHBondContact O-N 3.44Å; A213-L216 PolarHBondContact O-N 3.38Å; A213-E217 PolarHBondContact O-N 2.87Å
214	A	86.6	Confident	83.7	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-64.4	-36.4	176.1	0	0	0	0	0	112.9	F148 I189 T193 I197 F211 L216 E217 V218	F148-A214 HydrophobicContact CE1-CB 4.04Å; F148-A214 HydrophobicContact CZ-CB 3.8Å; I189-A214 HydrophobicContact CD1-CB 3.77Å; I189-A214 HydrophobicContact CG1-CB 4.38Å; T193-A214 HydrophobicContact CG2-CB 3.86Å; I197-A214 HydrophobicContact CD1-CB 3.47Å; I197-A214 VanDerWaalsContact CD1-CB 3.47Å; F211-A214 PolarHBondContact O-N 3.27Å; A214-L216 VanDerWaalsContact C-N 3.32Å; A214-L216 PolarHBondContact O-N 2.95Å; A214-E217 PolarHBondContact O-N 3.46Å; A214-V218 WeakPolarHBondContact O-CB 3.38Å; A214-V218 WeakPolarHBondContact O-CG2 3.34Å; A214-V218 PolarHBondContact O-N 3.46Å
215	Q	88.8	Confident	84.5	Confident	16 Å²	16	49.5 Å²	49.5	8%	0.075	26%	0.262	C	S	.	.	H	α-helix	trans	-64.5	-39.3	176.8	-170.4	177.1	3.2	0	0	110.9	W149 C152 F211 N212 A213 E219	W149-Q215 HydrophobicContact CG-CG 4.41Å; C152-Q215 HydrophobicContact CB-CB 4.39Å; C152-Q215 HydrophobicContact CB-CG 4.24Å; F211-Q215 WeakPolarHBondContact O-CB 3.16Å; F211-Q215 PolarHBondContact O-N 3.4Å; N212-Q215 PolarHBondContact O-N 2.69Å; A213-Q215 VanDerWaalsContact C-N 3.34Å; A213-Q215 PolarHBondContact O-N 3.44Å; Q215-E219 WeakPolarHBondContact O-CB 3.2Å; Q215-E219 PolarHBondContact O-N 3.48Å
216	L	88.7	Confident	85.3	Confident	111 Å²	111	45.6 Å²	45.6	58%	0.581	24%	0.243	S	C	*	.	H	α-helix	trans	-68.3	-38.8	176	-71.2	170.4	0	0	0	112.7	N212 A213 A214 S220	N212-L216 WeakPolarHBondContact O-CG 3.24Å; N212-L216 PolarHBondContact O-N 2.92Å; A213-L216 PolarHBondContact O-N 3.38Å; A214-L216 VanDerWaalsContact C-N 3.32Å; A214-L216 PolarHBondContact O-N 2.95Å; L216-S220 WeakPolarHBondContact O-CB 3.48Å; L216-S220 PolarHBondContact O-N 3.15Å
217	E	89.2	Confident	86.1	Confident	39 Å²	39	46.4 Å²	46.4	18%	0.182	25%	0.254	C	S	.	.	H	α-helix	trans	-62	-49.9	172.5	-74.1	177.3	-166.4	0	0	111.7	I189 R190 T193 A213 A214 E219 S220 F221	I189-E217 WeakPolarHBondContact CA-OE2 3.3Å; R190-E217 WeakPolarHBondContact CD-OE1 3.38Å; R190-E217 PolarHBondContact N-OE2 2.92Å; T193-E217 VanDerWaalsContact CB-OE1 3.23Å; T193-E217 WeakPolarHBondContact CB-OE1 3.31Å; T193-E217 PolarHBondContact OG1-OE1 3.27Å; A213-E217 PolarHBondContact O-N 2.87Å; A214-E217 PolarHBondContact O-N 3.46Å; E217-E219 VanDerWaalsContact C-N 3.34Å; E217-E219 PolarHBondContact O-N 3.22Å; E217-S220 WeakPolarHBondContact O-CB 3.46Å; E217-S220 PolarHBondContact O-N 3.04Å; E217-F221 PolarHBondContact O-N 3.31Å
218	V	88.2	Confident	87.2	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-65.4	-37.4	179.2	173.5	0	0	0	0	111.2	E145 F148 W149 L186 I189 A214 F221 L222	E145-V218 HydrophobicContact CB-CG1 4.13Å; E145-V218 VanDerWaalsContact O-CG1 3.27Å; E145-V218 WeakPolarHBondContact O-CG1 3.47Å; F148-V218 HydrophobicContact CD1-CB 4.25Å; F148-V218 HydrophobicContact CD1-CG1 4.19Å; F148-V218 HydrophobicContact CD1-CG2 3.79Å; F148-V218 HydrophobicContact CE1-CB 4.44Å; F148-V218 HydrophobicContact CE1-CG2 3.85Å; W149-V218 HydrophobicContact CB-CG1 4.14Å; L186-V218 HydrophobicContact CD1-CG2 4.35Å; I189-V218 HydrophobicContact CD1-CG2 4.02Å; I189-V218 HydrophobicContact CG1-CG2 3.69Å; A214-V218 WeakPolarHBondContact O-CB 3.38Å; A214-V218 WeakPolarHBondContact O-CG2 3.34Å; A214-V218 PolarHBondContact O-N 3.46Å; V218-F221 PolarHBondContact O-N 2.81Å; V218-L222 HydrophobicContact CG1-CD1 3.9Å; V218-L222 HydrophobicContact CG1-CG 4.31Å; V218-L222 WeakPolarHBondContact O-CB 3.4Å; V218-L222 VanDerWaalsContact O-CG 3.24Å; V218-L222 WeakPolarHBondContact O-CG 3.41Å; V218-L222 PolarHBondContact O-N 3.26Å
219	E	89.8	Confident	87.9	Confident	45 Å²	45	42.7 Å²	42.7	21%	0.21	24%	0.237	C	C	.	.	H	α-helix	trans	-68	-39.6	175.6	-168.2	176.8	121.5	0	0	112	L120 W149 Q215 E217 F221 L222 R223	L120-E219 HydrophobicContact CD2-CG 4.25Å; W149-E219 PolarHBondContact NE1-OE2 2.84Å; Q215-E219 WeakPolarHBondContact O-CB 3.2Å; Q215-E219 PolarHBondContact O-N 3.48Å; E217-E219 VanDerWaalsContact C-N 3.34Å; E217-E219 PolarHBondContact O-N 3.22Å; E219-F221 VanDerWaalsContact C-N 3.34Å; E219-F221 PolarHBondContact O-N 3.01Å; E219-L222 PolarHBondContact O-N 3.49Å; E219-R223 WeakPolarHBondContact O-CG 3.35Å; E219-R223 PolarHBondContact O-N 2.79Å; E219-R223 IonicContact OE1-CZ 2.64Å; E219-R223 IonicContact OE1-NE 3.53Å; E219-R223 IonicContact OE1-NH2 2.9Å; E219-R223 PolarHBondContact OE1-NH2 2.83Å
220	S	89.5	Confident	88.4	Confident	57 Å²	57	40.2 Å²	40.2	40%	0.399	22%	0.222	S	C	.	.	H	α-helix	trans	-60.7	-43.8	172.6	-164.8	0	0	0	0	111.4	L216 E217 R223 I224	L216-S220 WeakPolarHBondContact O-CB 3.48Å; L216-S220 PolarHBondContact O-N 3.15Å; E217-S220 WeakPolarHBondContact O-CB 3.46Å; E217-S220 PolarHBondContact O-N 3.04Å; S220-R223 PolarHBondContact O-N 2.9Å; S220-I224 WeakPolarHBondContact O-CG1 3.31Å; S220-I224 PolarHBondContact O-N 2.96Å; S220-I224 VanDerWaalsContact O-N 3.12Å
221	F	87.8	Confident	88.7	Confident	46 Å²	46	46.8 Å²	46.8	20%	0.202	25%	0.253	C	S	.	.	H	α-helix	trans	-64.3	-40.4	173.9	-177.3	-100.4	0	0	0	112.8	C142 E145 C188 E217 V218 E219 R223 I224 K225	C142-F221 HydrophobicContact CB-CE1 4.12Å; E145-F221 HydrophobicContact CB-CD1 4.43Å; E145-F221 HydrophobicContact CG-CD1 3.99Å; E145-F221 HydrophobicContact CG-CE1 3.95Å; C188-F221 HydrophobicContact CB-CB 3.82Å; C188-F221 HydrophobicContact CB-CD1 3.77Å; C188-F221 HydrophobicContact CB-CD2 3.56Å; C188-F221 HydrophobicContact CB-CE1 4.17Å; C188-F221 HydrophobicContact CB-CE2 3.98Å; C188-F221 HydrophobicContact CB-CG 3.43Å; C188-F221 VanDerWaalsContact CB-CG 3.43Å; C188-F221 HydrophobicContact CB-CZ 4.26Å; E217-F221 PolarHBondContact O-N 3.31Å; V218-F221 PolarHBondContact O-N 2.81Å; E219-F221 VanDerWaalsContact C-N 3.34Å; E219-F221 PolarHBondContact O-N 3.01Å; F221-R223 VanDerWaalsContact C-N 3.34Å; F221-R223 PolarHBondContact O-N 3.17Å; F221-I224 PolarHBondContact O-N 2.85Å; F221-K225 HydrophobicContact CD1-CG 4.35Å; F221-K225 HydrophobicContact CE1-CG 3.95Å; F221-K225 HydrophobicContact CZ-CG 4.15Å; F221-K225 PolarHBondContact O-N 3.39Å
222	L	88.6	Confident	89	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-65.3	-33.9	174.7	-74.4	166.7	0	0	0	112.1	L120 F133 L137 L146 W149 V218 E219 K225 H226	L120-L222 HydrophobicContact CD1-CB 4.41Å; L120-L222 HydrophobicContact CD2-CB 3.83Å; F133-L222 HydrophobicContact CE1-CD2 4.11Å; F133-L222 HydrophobicContact CZ-CD2 4.11Å; L137-L222 HydrophobicContact CD1-CD2 3.71Å; L146-L222 HydrophobicContact CB-CD2 4.3Å; L146-L222 HydrophobicContact CD1-CD1 4.44Å; L146-L222 HydrophobicContact CD1-CD2 4.3Å; W149-L222 HydrophobicContact CB-CD1 3.78Å; W149-L222 HydrophobicContact CG-CD1 3.98Å; V218-L222 HydrophobicContact CG1-CD1 3.9Å; V218-L222 HydrophobicContact CG1-CG 4.31Å; V218-L222 WeakPolarHBondContact O-CB 3.4Å; V218-L222 VanDerWaalsContact O-CG 3.24Å; V218-L222 WeakPolarHBondContact O-CG 3.41Å; V218-L222 PolarHBondContact O-N 3.26Å; E219-L222 PolarHBondContact O-N 3.49Å; L222-K225 CarbonylContact O-C 3.53Å; L222-K225 PolarHBondContact O-N 3.25Å; L222-H226 WeakPolarHBondContact O-CB 3.45Å; L222-H226 PolarHBondContact O-N 3.42Å
223	R	90.8	Very high	89.2	Confident	111 Å²	111	51.4 Å²	51.4	42%	0.419	28%	0.279	S	S	.	.	H	α-helix	trans	-66.3	-40.3	172.1	-70.5	-173.2	-137.7	124.2	-1.4	112	L120 E219 S220 F221 H226 A227	L120-R223 HydrophobicContact CB-CG 4.12Å; L120-R223 HydrophobicContact CD2-CG 3.69Å; E219-R223 WeakPolarHBondContact O-CG 3.35Å; E219-R223 PolarHBondContact O-N 2.79Å; E219-R223 IonicContact OE1-CZ 2.64Å; E219-R223 IonicContact OE1-NE 3.53Å; E219-R223 IonicContact OE1-NH2 2.9Å; E219-R223 PolarHBondContact OE1-NH2 2.83Å; S220-R223 PolarHBondContact O-N 2.9Å; F221-R223 VanDerWaalsContact C-N 3.34Å; F221-R223 PolarHBondContact O-N 3.17Å; R223-H226 WeakPolarHBondContact O-CB 3.39Å; R223-H226 PolarHBondContact O-N 2.87Å; R223-A227 PolarHBondContact O-N 2.84Å
224	I	90.5	Very high	89.3	Confident	114 Å²	114	51.5 Å²	51.5	59%	0.585	27%	0.271	S	S	*	.	H	α-helix	trans	-64	-44.6	174.2	-64.4	165.4	0	0	0	110.8	S220 F221 H226 A227 A228	S220-I224 WeakPolarHBondContact O-CG1 3.31Å; S220-I224 PolarHBondContact O-N 2.96Å; S220-I224 VanDerWaalsContact O-N 3.12Å; F221-I224 PolarHBondContact O-N 2.85Å; I224-H226 VanDerWaalsContact C-N 3.28Å; I224-H226 PolarHBondContact O-N 2.74Å; I224-A227 PolarHBondContact O-N 2.91Å; I224-A228 PolarHBondContact O-N 3.34Å
225	K	88.7	Confident	89.4	Confident	39 Å²	39	52.1 Å²	52.1	17%	0.17	27%	0.273	C	S	.	.	H	α-helix	trans	-69	-24.2	174.3	-72.1	-63.7	-170.7	-174.9	0	113.3	F136 L137 E140 F221 L222 F229	F136-K225 HydrophobicContact CE1-CB 4.49Å; F136-K225 HydrophobicContact CE1-CD 4.49Å; F136-K225 VanDerWaalsContact CE1-O 3.28Å; F136-K225 WeakPolarHBondContact CE1-O 3.43Å; L137-K225 HydrophobicContact CD2-CB 3.74Å; L137-K225 HydrophobicContact CD2-CG 4.01Å; E140-K225 IonicContact OE2-NZ 2.77Å; E140-K225 PolarHBondContact OE2-NZ 3.45Å; F221-K225 HydrophobicContact CD1-CG 4.35Å; F221-K225 HydrophobicContact CE1-CG 3.95Å; F221-K225 HydrophobicContact CZ-CG 4.15Å; F221-K225 PolarHBondContact O-N 3.39Å; L222-K225 CarbonylContact O-C 3.53Å; L222-K225 PolarHBondContact O-N 3.25Å; K225-F229 VanDerWaalsContact O-CB 3.31Å; K225-F229 WeakPolarHBondContact O-CB 3.45Å; K225-F229 PolarHBondContact O-N 2.72Å
226	H	90.1	Very high	89.4	Confident	16 Å²	16	55.4 Å²	55.4	7%	0.074	29%	0.29	C	S	.	.	H	α-helix	trans	-72.7	-42.7	174.3	164	-106.8	0	0	0	112	W116 L120 V123 F133 L222 R223 I224 A228 F229 V230	W116-H226 PolarHBondContact O-NE2 3.05Å; L120-H226 HydrophobicContact CB-CB 4.37Å; L120-H226 HydrophobicContact CD1-CB 3.86Å; L120-H226 PolarHBondContact N-CE1 2.97Å; V123-H226 WeakPolarHBondContact CG2-NE2 3.41Å; F133-H226 HydrophobicContact CE2-CB 4.25Å; F133-H226 HydrophobicContact CZ-CB 4.22Å; L222-H226 WeakPolarHBondContact O-CB 3.45Å; L222-H226 PolarHBondContact O-N 3.42Å; R223-H226 WeakPolarHBondContact O-CB 3.39Å; R223-H226 PolarHBondContact O-N 2.87Å; I224-H226 VanDerWaalsContact C-N 3.28Å; I224-H226 PolarHBondContact O-N 2.74Å; H226-A228 VanDerWaalsContact C-N 3.35Å; H226-A228 PolarHBondContact O-N 2.9Å; H226-F229 WeakPolarHBondContact O-CB 3.32Å; H226-F229 PolarHBondContact O-N 3.48Å; H226-F229 VanDerWaalsContact O-N 3.09Å; H226-V230 WeakPolarHBondContact O-CG2 3.36Å; H226-V230 PolarHBondContact O-N 3.29Å
227	A	91	Very high	89.3	Confident	50 Å²	50	53.1 Å²	53.1	41%	0.413	28%	0.284	S	S	.	.	H	α-helix	trans	-56.1	-49.9	169.9	0	0	0	0	0	111.2	R223 I224 F229 V230 E231	R223-A227 PolarHBondContact O-N 2.84Å; I224-A227 PolarHBondContact O-N 2.91Å; A227-F229 VanDerWaalsContact C-N 3.25Å; A227-F229 PolarHBondContact O-N 2.94Å; A227-V230 PolarHBondContact O-N 3.11Å; A227-V230 VanDerWaalsContact O-N 3.15Å; A227-E231 PolarHBondContact O-N 2.71Å; A227-E231 VanDerWaalsContact O-N 3.09Å
228	A	90.4	Very high	89.2	Confident	38 Å²	38	52.3 Å²	52.3	31%	0.314	28%	0.279	S	S	.	.	H	α-helix	trans	-62.8	-27.5	175.8	0	0	0	0	0	113.8	F136 I224 H226 S232	F136-A228 HydrophobicContact CZ-CB 4.01Å; I224-A228 PolarHBondContact O-N 3.34Å; H226-A228 VanDerWaalsContact C-N 3.35Å; H226-A228 PolarHBondContact O-N 2.9Å; A228-S232 WeakPolarHBondContact O-CB 3.24Å; A228-S232 PolarHBondContact O-N 3.29Å; A228-S232 VanDerWaalsContact O-N 3.17Å
229	F	90.8	Very high	89.2	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-71.8	-40.8	173.8	164.4	-108.9	0	0	0	112	V123 L132 F133 F136 K225 H226 A227 E231 S232 Y235	V123-F229 HydrophobicContact CG1-CE1 4.11Å; L132-F229 HydrophobicContact CB-CE2 4.18Å; L132-F229 HydrophobicContact CB-CZ 4.01Å; L132-F229 HydrophobicContact CD2-CE2 4.19Å; L132-F229 HydrophobicContact CD2-CZ 3.98Å; L132-F229 HydrophobicContact CG-CE2 3.92Å; L132-F229 HydrophobicContact CG-CZ 4.03Å; F133-F229 HydrophobicContact CB-CD1 4.49Å; F133-F229 HydrophobicContact CB-CE1 4.24Å; F133-F229 HydrophobicContact CB-CE2 4.3Å; F133-F229 HydrophobicContact CB-CZ 4.13Å; F133-F229 HydrophobicContact CD2-CB 3.8Å; F133-F229 AromaticContact CD2-CD1 3.87Å; F133-F229 HydrophobicContact CD2-CD1 3.87Å; F133-F229 HydrophobicContact CD2-CD2 4.06Å; F133-F229 HydrophobicContact CD2-CE1 4.45Å; F133-F229 AromaticContact CD2-CG 3.64Å; F133-F229 HydrophobicContact CD2-CG 3.64Å; F133-F229 HydrophobicContact CE2-CB 3.99Å; F133-F229 HydrophobicContact CE2-CG 4.31Å; F136-F229 HydrophobicContact CB-CD2 3.68Å; F136-F229 HydrophobicContact CB-CE2 4.26Å; F136-F229 HydrophobicContact CD1-CB 3.75Å; F136-F229 HydrophobicContact CD1-CD2 4.18Å; F136-F229 HydrophobicContact CD1-CG 4.39Å; F136-F229 HydrophobicContact CD2-CD2 4.26Å; F136-F229 HydrophobicContact CE1-CB 3.83Å; F136-F229 HydrophobicContact CG-CB 4.12Å; F136-F229 AromaticContact CG-CD2 3.79Å; F136-F229 HydrophobicContact CG-CD2 3.79Å; F136-F229 HydrophobicContact CG-CG 4.42Å; F136-F229 HydrophobicContact CZ-CB 4.27Å; K225-F229 VanDerWaalsContact O-CB 3.31Å; K225-F229 WeakPolarHBondContact O-CB 3.45Å; K225-F229 PolarHBondContact O-N 2.72Å; H226-F229 WeakPolarHBondContact O-CB 3.32Å; H226-F229 PolarHBondContact O-N 3.48Å; H226-F229 VanDerWaalsContact O-N 3.09Å; A227-F229 VanDerWaalsContact C-N 3.25Å; A227-F229 PolarHBondContact O-N 2.94Å; F229-E231 VanDerWaalsContact C-N 3.28Å; F229-E231 PolarHBondContact O-N 3.01Å; F229-S232 WeakPolarHBondContact O-CB 3.41Å; F229-S232 PolarHBondContact O-N 3.3Å; F229-S232 PolarHBondContact O-OG 3.36Å; F229-Y235 HydrophobicContact CE1-CD2 4.3Å; F229-Y235 HydrophobicContact CZ-CD2 4.32Å; F229-Y235 VanDerWaalsContact O-CB 3.3Å; F229-Y235 WeakPolarHBondContact O-CB 3.44Å
230	V	89.6	Confident	88.9	Confident	35 Å²	35	57.2 Å²	57.2	21%	0.212	30%	0.303	C	S	.	.	H	α-helix	trans	-66.9	-31.4	176.6	175.3	0	0	0	0	111.4	A117 H226 A227 S232 Y235	A117-V230 HydrophobicContact CB-CG1 3.8Å; A117-V230 HydrophobicContact CB-CG2 4.34Å; H226-V230 WeakPolarHBondContact O-CG2 3.36Å; H226-V230 PolarHBondContact O-N 3.29Å; A227-V230 PolarHBondContact O-N 3.11Å; A227-V230 VanDerWaalsContact O-N 3.15Å; V230-S232 VanDerWaalsContact C-N 3.33Å; V230-Y235 HydrophobicContact CG1-CD1 4.27Å; V230-Y235 HydrophobicContact CG1-CE1 3.97Å; V230-Y235 VanDerWaalsContact O-CD1 3.27Å; V230-Y235 WeakPolarHBondContact O-CD1 3.34Å
231	E	87.8	Confident	88.6	Confident	154 Å²	154	58.2 Å²	58.2	72%	0.72	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.1	-11.9	170.8	-67	178.4	174.4	0	0	113.6	A227 F229 I236	A227-E231 PolarHBondContact O-N 2.71Å; A227-E231 VanDerWaalsContact O-N 3.09Å; F229-E231 VanDerWaalsContact C-N 3.28Å; F229-E231 PolarHBondContact O-N 3.01Å; E231-I236 WeakPolarHBondContact O-CD1 3.39Å
232	S	90.2	Very high	88.4	Confident	18 Å²	18	58.5 Å²	58.5	13%	0.126	31%	0.309	C	S	.	.	S	Bend	trans	-79.1	146.3	-172.4	77.9	0	0	0	0	113.9	A228 F229 V230 M234 Y235 I236	A228-S232 WeakPolarHBondContact O-CB 3.24Å; A228-S232 PolarHBondContact O-N 3.29Å; A228-S232 VanDerWaalsContact O-N 3.17Å; F229-S232 WeakPolarHBondContact O-CB 3.41Å; F229-S232 PolarHBondContact O-N 3.3Å; F229-S232 PolarHBondContact O-OG 3.36Å; V230-S232 VanDerWaalsContact C-N 3.33Å; S232-M234 PolarHBondContact O-N 3.26Å; S232-M234 WeakPolarHBondContact OG-CB 3.48Å; S232-M234 PolarHBondContact OG-N 2.86Å; S232-Y235 PolarHBondContact O-N 2.93Å; S232-I236 WeakPolarHBondContact O-CG1 3.12Å; S232-I236 PolarHBondContact O-N 3.09Å
233	D	89.4	Confident	87.8	Confident	137 Å²	137	65.6 Å²	65.6	73%	0.733	34%	0.343	S	S	*	.	H	α-helix	trans	-49.5	-27.2	169	-69.7	-30.2	0	0	0	113.1	S237	D233-S237 WeakPolarHBondContact O-CB 3.46Å; D233-S237 PolarHBondContact O-N 3.07Å
234	M	88.2	Confident	87	Confident	56 Å²	56	65.4 Å²	65.4	28%	0.276	35%	0.354	S	S	.	.	H	α-helix	trans	-65.4	-43.1	179.3	-161.9	69.4	61.4	0	0	111.9	L132 S232 Y238	L132-M234 HydrophobicContact CD1-CG 3.78Å; L132-M234 HydrophobicContact CD1-SD 4.3Å; L132-M234 HydrophobicContact CG-CG 4Å; S232-M234 PolarHBondContact O-N 3.26Å; S232-M234 WeakPolarHBondContact OG-CB 3.48Å; S232-M234 PolarHBondContact OG-N 2.86Å; M234-Y238 WeakPolarHBondContact O-CB 3.15Å; M234-Y238 PolarHBondContact O-N 2.91Å
235	Y	88.6	Confident	85.5	Confident	13 Å²	13	62.8 Å²	62.8	5%	0.051	36%	0.355	C	S	.	.	H	α-helix	trans	-80.6	-40.7	176.5	173.7	-106.4	0	0	0	111.4	Y113 W116 A117 F229 V230 S232 S237 Y238 L239	Y113-Y235 WeakPolarHBondContact O-CE2 3.44Å; Y113-Y235 PolarHBondContact O-OH 3.24Å; W116-Y235 HydrophobicContact CB-CE2 4.2Å; W116-Y235 HydrophobicContact CE3-CD2 4.12Å; W116-Y235 AromaticContact CE3-CE2 3.97Å; W116-Y235 HydrophobicContact CE3-CE2 3.97Å; A117-Y235 HydrophobicContact CB-CE1 4.47Å; F229-Y235 HydrophobicContact CE1-CD2 4.3Å; F229-Y235 HydrophobicContact CZ-CD2 4.32Å; F229-Y235 VanDerWaalsContact O-CB 3.3Å; F229-Y235 WeakPolarHBondContact O-CB 3.44Å; V230-Y235 HydrophobicContact CG1-CD1 4.27Å; V230-Y235 HydrophobicContact CG1-CE1 3.97Å; V230-Y235 VanDerWaalsContact O-CD1 3.27Å; V230-Y235 WeakPolarHBondContact O-CD1 3.34Å; S232-Y235 PolarHBondContact O-N 2.93Å; Y235-S237 PolarHBondContact O-N 3.13Å; Y235-Y238 WeakPolarHBondContact O-CB 3.47Å; Y235-Y238 PolarHBondContact O-N 3.22Å; Y235-L239 HydrophobicContact CD1-CD1 4.1Å; Y235-L239 HydrophobicContact CD1-CG 4.42Å; Y235-L239 HydrophobicContact CE1-CD1 3.5Å; Y235-L239 VanDerWaalsContact CE1-CD1 3.5Å; Y235-L239 HydrophobicContact CE1-CG 4.06Å; Y235-L239 HydrophobicContact CE2-CD1 4.43Å; Y235-L239 HydrophobicContact CE2-CD2 4.12Å; Y235-L239 HydrophobicContact CE2-CG 4.16Å; Y235-L239 WeakPolarHBondContact O-CG 3.2Å; Y235-L239 PolarHBondContact O-N 3.13Å
236	I	90	Very high	83.8	Confident	84 Å²	84	63.2 Å²	63.2	43%	0.431	37%	0.371	S	S	.	.	H	α-helix	trans	-63.2	-44.4	178.7	-62.9	169.2	0	0	0	111.3	E231 S232 Y238 L239 Q240	E231-I236 WeakPolarHBondContact O-CD1 3.39Å; S232-I236 WeakPolarHBondContact O-CG1 3.12Å; S232-I236 PolarHBondContact O-N 3.09Å; I236-Y238 VanDerWaalsContact C-N 3.33Å; I236-Y238 PolarHBondContact O-N 3Å; I236-L239 PolarHBondContact O-N 2.85Å; I236-Q240 WeakPolarHBondContact O-CB 3.1Å; I236-Q240 PolarHBondContact O-N 3.31Å
237	S	86.6	Confident	81.7	Confident	63 Å²	63	74.2 Å²	74.2	44%	0.441	41%	0.412	S	S	.	.	H	α-helix	trans	-62.9	-39.2	174.7	-178.1	0	0	0	0	111.8	D233 Y235 Q240 V241	D233-S237 WeakPolarHBondContact O-CB 3.46Å; D233-S237 PolarHBondContact O-N 3.07Å; Y235-S237 PolarHBondContact O-N 3.13Å; S237-Q240 WeakPolarHBondContact O-CB 3.3Å; S237-Q240 PolarHBondContact O-N 3.17Å; S237-V241 WeakPolarHBondContact O-CG2 3.49Å; S237-V241 PolarHBondContact O-N 3.37Å
238	Y	87.6	Confident	79.5	Confident	23 Å²	23	79.3 Å²	79.3	9%	0.09	43%	0.432	C	S	.	.	H	α-helix	trans	-63.9	-44.8	175.5	177.4	-99.9	0	0	0	112.4	W116 E128 L132 M234 Y235 I236 Q240 V241 I242	W116-Y238 HydrophobicContact CE3-CE1 4.26Å; W116-Y238 HydrophobicContact CH2-CD1 4.15Å; W116-Y238 AromaticContact CH2-CE1 3.29Å; W116-Y238 HydrophobicContact CH2-CE1 3.29Å; W116-Y238 AromaticContact CH2-CZ 3.57Å; W116-Y238 HydrophobicContact CZ2-CE1 4.41Å; W116-Y238 AromaticContact CZ3-CD1 3.6Å; W116-Y238 HydrophobicContact CZ3-CD1 3.6Å; W116-Y238 AromaticContact CZ3-CE1 3.2Å; W116-Y238 HydrophobicContact CZ3-CE1 3.2Å; W116-Y238 AromaticContact CZ3-CZ 3.91Å; E128-Y238 HydrophobicContact CG-CE2 4.45Å; E128-Y238 WeakPolarHBondContact OE1-CE2 3.33Å; E128-Y238 VanDerWaalsContact OE1-CZ 3.25Å; E128-Y238 PolarHBondContact OE1-OH 3.44Å; L132-Y238 HydrophobicContact CD2-CD1 3.9Å; L132-Y238 HydrophobicContact CD2-CD2 4.17Å; L132-Y238 HydrophobicContact CD2-CG 3.6Å; M234-Y238 WeakPolarHBondContact O-CB 3.15Å; M234-Y238 PolarHBondContact O-N 2.91Å; Y235-Y238 WeakPolarHBondContact O-CB 3.47Å; Y235-Y238 PolarHBondContact O-N 3.22Å; I236-Y238 VanDerWaalsContact C-N 3.33Å; I236-Y238 PolarHBondContact O-N 3Å; Y238-Q240 VanDerWaalsContact C-N 3.3Å; Y238-Q240 PolarHBondContact O-N 2.94Å; Y238-V241 PolarHBondContact O-N 3.27Å; Y238-I242 HydrophobicContact CD1-CD1 3.81Å; Y238-I242 HydrophobicContact CE1-CD1 3.26Å; Y238-I242 HydrophobicContact CE1-CG1 4.35Å; Y238-I242 HydrophobicContact CE2-CD1 4.35Å; Y238-I242 PolarHBondContact O-N 2.75Å; Y238-I242 VanDerWaalsContact O-N 3.15Å
239	L	86.3	Confident	77.1	Confident	30 Å²	30	80.8 Å²	80.8	16%	0.157	44%	0.44	C	S	.	.	H	α-helix	trans	-58.1	-42	170.7	-69.9	-176.6	0	0	0	111.8	Y113 Y235 I236 V241 I242 Q243	Y113-L239 HydrophobicContact CD2-CD2 3.49Å; Y113-L239 VanDerWaalsContact CD2-CD2 3.49Å; Y113-L239 HydrophobicContact CE2-CD2 4.15Å; Y113-L239 HydrophobicContact CG-CD2 4.37Å; Y235-L239 HydrophobicContact CD1-CD1 4.1Å; Y235-L239 HydrophobicContact CD1-CG 4.42Å; Y235-L239 HydrophobicContact CE1-CD1 3.5Å; Y235-L239 VanDerWaalsContact CE1-CD1 3.5Å; Y235-L239 HydrophobicContact CE1-CG 4.06Å; Y235-L239 HydrophobicContact CE2-CD1 4.43Å; Y235-L239 HydrophobicContact CE2-CD2 4.12Å; Y235-L239 HydrophobicContact CE2-CG 4.16Å; Y235-L239 WeakPolarHBondContact O-CG 3.2Å; Y235-L239 PolarHBondContact O-N 3.13Å; I236-L239 PolarHBondContact O-N 2.85Å; L239-V241 PolarHBondContact O-N 2.97Å; L239-I242 PolarHBondContact O-N 3.44Å; L239-Q243 WeakPolarHBondContact O-CB 3.33Å; L239-Q243 VanDerWaalsContact O-CG 3.28Å; L239-Q243 WeakPolarHBondContact O-CG 3.38Å; L239-Q243 PolarHBondContact O-N 3.33Å
240	Q	84.3	Confident	75	Confident	118 Å²	118	84.5 Å²	84.5	55%	0.551	46%	0.464	S	S	*	.	H	α-helix	trans	-63.2	-39.6	178.5	-169.7	179.7	14.1	0	0	112.2	I236 S237 Y238 Q243 T244	I236-Q240 WeakPolarHBondContact O-CB 3.1Å; I236-Q240 PolarHBondContact O-N 3.31Å; S237-Q240 WeakPolarHBondContact O-CB 3.3Å; S237-Q240 PolarHBondContact O-N 3.17Å; Y238-Q240 VanDerWaalsContact C-N 3.3Å; Y238-Q240 PolarHBondContact O-N 2.94Å; Q240-Q243 PolarHBondContact O-N 3.21Å; Q240-T244 HydrophobicContact CG-CG2 4.42Å; Q240-T244 WeakPolarHBondContact O-CB 3.37Å; Q240-T244 WeakPolarHBondContact O-CG2 3.33Å; Q240-T244 PolarHBondContact O-N 3.32Å; Q240-T244 PolarHBondContact O-OG1 2.85Å
241	V	83.4	Confident	72.8	Confident	78 Å²	78	91.1 Å²	91.1	47%	0.473	49%	0.49	S	S	.	.	H	α-helix	trans	-63.3	-41.5	175.3	170	0	0	0	0	111.5	S237 Y238 L239 T244 G246	S237-V241 WeakPolarHBondContact O-CG2 3.49Å; S237-V241 PolarHBondContact O-N 3.37Å; Y238-V241 PolarHBondContact O-N 3.27Å; L239-V241 PolarHBondContact O-N 2.97Å; V241-T244 PolarHBondContact O-OG1 3.13Å; V241-G246 PolarHBondContact O-N 3.35Å
242	I	82.8	Confident	70.4	Confident	51 Å²	51	88.3 Å²	88.3	26%	0.262	49%	0.487	S	S	.	.	H	α-helix	trans	-65.7	-50	174.7	-63.1	159.5	0	0	0	111.1	Y113 Y238 L239 T244 G245	Y113-I242 HydrophobicContact CD1-CD1 3.66Å; Y113-I242 HydrophobicContact CD1-CG2 4.44Å; Y113-I242 HydrophobicContact CD2-CD1 4.01Å; Y113-I242 HydrophobicContact CE1-CD1 4.12Å; Y113-I242 HydrophobicContact CE1-CG2 3.79Å; Y113-I242 HydrophobicContact CE2-CD1 4.43Å; Y113-I242 HydrophobicContact CE2-CG2 4.36Å; Y113-I242 HydrophobicContact CG-CD1 3.6Å; Y238-I242 HydrophobicContact CD1-CD1 3.81Å; Y238-I242 HydrophobicContact CE1-CD1 3.26Å; Y238-I242 HydrophobicContact CE1-CG1 4.35Å; Y238-I242 HydrophobicContact CE2-CD1 4.35Å; Y238-I242 PolarHBondContact O-N 2.75Å; Y238-I242 VanDerWaalsContact O-N 3.15Å; L239-I242 PolarHBondContact O-N 3.44Å; I242-T244 VanDerWaalsContact C-N 3.27Å; I242-T244 PolarHBondContact O-N 2.79Å; I242-G245 PolarHBondContact O-N 2.82Å
243	Q	76.6	Confident	68.1	Low	150 Å²	150	93.8 Å²	93.8	70%	0.701	51%	0.505	S	S	*	.	H	α-helix	trans	-64.1	-30.2	-176.6	-73.6	175.9	6.4	0	0	113.1	L239 Q240 G245	L239-Q243 WeakPolarHBondContact O-CB 3.33Å; L239-Q243 VanDerWaalsContact O-CG 3.28Å; L239-Q243 WeakPolarHBondContact O-CG 3.38Å; L239-Q243 PolarHBondContact O-N 3.33Å; Q240-Q243 PolarHBondContact O-N 3.21Å; Q243-G245 PolarHBondContact O-N 3.47Å
244	T	74.9	Confident	65.8	Low	106 Å²	106	91.5 Å²	91.5	65%	0.65	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.3	2.9	175.9	50.5	0	0	0	0	113.7	Q240 V241 I242 G246	Q240-T244 HydrophobicContact CG-CG2 4.42Å; Q240-T244 WeakPolarHBondContact O-CB 3.37Å; Q240-T244 WeakPolarHBondContact O-CG2 3.33Å; Q240-T244 PolarHBondContact O-N 3.32Å; Q240-T244 PolarHBondContact O-OG1 2.85Å; V241-T244 PolarHBondContact O-OG1 3.13Å; I242-T244 VanDerWaalsContact C-N 3.27Å; I242-T244 PolarHBondContact O-N 2.79Å; T244-G246 VanDerWaalsContact C-N 3.35Å; T244-G246 PolarHBondContact O-N 2.9Å
245	G	59.3	Low	63.6	Low	60 Å²	60	96.1 Å²	96.1	62%	0.619	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.2	18.8	171.1	0	0	0	0	0	114.6	I242 Q243 W247	I242-G245 PolarHBondContact O-N 2.82Å; Q243-G245 PolarHBondContact O-N 3.47Å; G245-W247 PolarHBondContact O-N 2.94Å
246	G	51.9	Low	61.1	Low	48 Å²	48	104.2 Å²	104.2	50%	0.495	56%	0.564	S	S	.	*			trans	-72.6	58.5	179.5	0	0	0	0	0	113.9	V241 T244 D248	V241-G246 PolarHBondContact O-N 3.35Å; T244-G246 VanDerWaalsContact C-N 3.35Å; T244-G246 PolarHBondContact O-N 2.9Å; G246-D248 PolarHBondContact O-N 3.27Å
247	W	46.2	Very low	58.5	Low	247 Å²	247	105.2 Å²	105.2	94%	0.936	58%	0.579	S	S	*	*			trans	-77.3	46.5	178.9	-152.2	-58.6	0	0	0	112.5	G245	G245-W247 PolarHBondContact O-N 2.94Å
248	D	43.7	Very low	56.4	Low	157 Å²	157	114.3 Å²	114.3	84%	0.84	60%	0.603	S	S	*	*	S	Bend	trans	-94.8	102.6	151.5	-98.2	-49.2	0	0	0	106.6	G246	G246-D248 PolarHBondContact O-N 3.27Å
249	S	40.1	Very low	54.2	Low	68 Å²	68	118.2 Å²	118.2	48%	0.476	63%	0.634	S	S	.	*			trans	-31.6	134.5	-175.1	174.2	0	0	0	0	113.8	K251	S249-K251 PolarHBondContact O-N 3.27Å
250	P	47.9	Very low	51.9	Low	79 Å²	79	124.7 Å²	124.7	51%	0.513	67%	0.669	S	S	.	*			trans	-71.5	58.5	-179.9	28	-32.6	0	0	0	112.9	E128 C252	E128-P250 VanDerWaalsContact OE1-CG 3.23Å; E128-P250 WeakPolarHBondContact OE1-CG 3.36Å; P250-C252 PolarHBondContact O-N 3.38Å
251	K	42.1	Very low	49.8	Very low	173 Å²	173	125 Å²	125	75%	0.752	68%	0.684	S	S	*	*			trans	-64.7	100.1	168.3	-74.6	172.7	-179.3	166.2	0	108.1	S249	S249-K251 PolarHBondContact O-N 3.27Å
252	C	37.7	Very low	47.7	Very low	96 Å²	96	126.7 Å²	126.7	65%	0.649	70%	0.699	S	S	*	*			trans	70.4	99.7	163.1	-50.1	0	0	0	0	114.9	P250 S254	P250-C252 PolarHBondContact O-N 3.38Å; C252-S254 WeakPolarHBondContact CB-OG 3.31Å; C252-S254 PolarHBondContact O-N 2.71Å
253	Y	42.2	Very low	45.8	Very low	133 Å²	133	129.9 Å²	129.9	52%	0.522	73%	0.726	S	S	.	*			trans	-64.8	55.8	135.3	-68.3	-98.3	0	0	0	110	K135	K135-Y253 HydrophobicContact CD-CD1 4.22Å; K135-Y253 HydrophobicContact CD-CG 4.26Å; K135-Y253 VanDerWaalsContact CE-CB 3.41Å; K135-Y253 VanDerWaalsContact CE-CG 3.47Å
254	S	41	Very low	43.9	Very low	88 Å²	88	130.4 Å²	130.4	62%	0.615	73%	0.734	S	S	*	*			trans	-80.8	136.4	170.1	50.7	0	0	0	0	109	C252	C252-S254 WeakPolarHBondContact CB-OG 3.31Å; C252-S254 PolarHBondContact O-N 2.71Å
255	N	41.8	Very low	42.2	Very low	153 Å²	153	130.7 Å²	130.7	82%	0.818	74%	0.74	S	S	*	*			trans	-20.8	145.9	178	-56.5	2.9	0	0	0	117.8
256	E	36	Very low	41.3	Very low	184 Å²	184	133.5 Å²	133.5	86%	0.86	75%	0.75	S	S	*	*	S	Bend	trans	-34.7	151.1	159.9	-56.1	165.4	87.8	0	0	114.2
257	S	36.8	Very low	40.9	Very low	105 Å²	105	136.5 Å²	136.5	73%	0.734	76%	0.764	S	S	*	*			trans	99.6	51.5	166.7	-42.5	0	0	0	0	119.2
258	R	42.1	Very low	40.5	Very low	253 Å²	253	132.8 Å²	132.8	96%	0.955	76%	0.762	S	S	*	*			trans	-137.3	77.6	150.8	-75.3	-168.3	156.6	163.2	-5.8	110.5
259	S	41.6	Very low	40.3	Very low	105 Å²	105	129 Å²	129	73%	0.734	75%	0.752	S	S	*	*				67.9	112	78.4	-59.2	0	0	0	0	113.4
260	N	37.5	Very low	40.5	Very low	166 Å²	166	134.7 Å²	134.7	89%	0.888	77%	0.772	S	S	*	*			trans	-52.4	141.9	175.5	-68.2	-0.9	0	0	0	112.4
261	S	39.9	Very low	40	Very low	124 Å²	124	141.7 Å²	141.7	87%	0.867	79%	0.788	S	S	*	*			trans	-146.1	103	155.6	-79	0	0	0	0	109.8
262	S	39.2	Very low	39.8	Very low	115 Å²	115	139.1 Å²	139.1	80%	0.804	79%	0.788	S	S	*	*			trans	-79	140.8	176.2	51.7	0	0	0	0	111.8
263	S	42.6	Very low	40	Very low	118 Å²	118	139.2 Å²	139.2	83%	0.825	79%	0.791	S	S	*	*			trans	-140.3	131.6	160.4	48.3	0	0	0	0	110.3
264	N	37.5	Very low	40	Very low	161 Å²	161	137.9 Å²	137.9	86%	0.861	80%	0.8	S	S	*	*			trans	-103.2	132.6	-179.5	-81.8	2	0	0	0	110.4
265	S	40.3	Very low	40	Very low	112 Å²	112	139.8 Å²	139.8	78%	0.783	81%	0.809	S	S	*	*			trans	-162.7	113	149.6	40	0	0	0	0	108.2
266	S	39.4	Very low	40	Very low	118 Å²	118	140.7 Å²	140.7	83%	0.825	81%	0.812	S	S	*	*			cis	102.7	51.1	35.6	77.5	0	0	0	0	115.1
267	S	44.1	Very low	40.1	Very low	112 Å²	112	139.2 Å²	139.2	78%	0.783	81%	0.81	S	S	*	*			trans	-170.5	102.4	156.3	51	0	0	0	0	106.5
268	D	36.5	Very low	40.6	Very low	169 Å²	169	140.4 Å²	140.4	90%	0.904	82%	0.815	S	S	*	*				74.1	152	63.4	-156.3	10	0	0	0	113.4
269	A	41	Very low	41	Very low	76 Å²	76	134.5 Å²	134.5	63%	0.628	81%	0.807	S	S	*	*			trans	73	73.3	-177	0	0	0	0	0	118.8
270	Q	43.4	Very low	41.1	Very low	189 Å²	189	135.6 Å²	135.6	88%	0.883	81%	0.809	S	S	*	*			trans	62.1	122	132.3	-61.4	176.9	-84.8	0	0	123.1
271	R	36.8	Very low	41.5	Very low	226 Å²	226	136.7 Å²	136.7	85%	0.853	81%	0.808	S	S	*	*			trans	79	106.8	140.5	-166.9	-179.9	-179	-174.5	-0.6	119.1
272	P	38	Very low	42.1	Very low	118 Å²	118	137.7 Å²	137.7	77%	0.766	80%	0.8	S	S	*	*			trans	-87.3	149.8	171.4	35.9	-34.2	0	0	0	113
273	S	42.5	Very low	42.6	Very low	99 Å²	99	139.8 Å²	139.8	69%	0.692	80%	0.797	S	S	*	*			trans	-163.8	132.7	157.7	-74.7	0	0	0	0	110.4
274	S	41.8	Very low	43.2	Very low	104 Å²	104	141.1 Å²	141.1	73%	0.727	80%	0.8	S	S	*	*			trans	48.9	130.8	159	56.2	0	0	0	0	120.7
275	T	40.7	Very low	43.7	Very low	129 Å²	129	142 Å²	142	79%	0.791	80%	0.798	S	S	*	*			trans	55	112.6	153	55	0	0	0	0	118.8
276	L	43	Very low	44.1	Very low	171 Å²	171	144 Å²	144	90%	0.895	80%	0.799	S	S	*	*				-171	152.3	113.5	-97.6	161.6	0	0	0	110
277	L	37.9	Very low	44.5	Very low	153 Å²	153	147.6 Å²	147.6	80%	0.801	80%	0.803	S	S	*	*			trans	-88.2	132.5	-179.9	-65.7	166.6	0	0	0	110.1	T279	L277-T279 PolarHBondContact O-N 3.37Å
278	P	46.3	Very low	44.1	Very low	130 Å²	130	147.4 Å²	147.4	84%	0.844	80%	0.797	S	S	*	*			trans	-66	115.9	166.4	-19.8	33.3	0	0	0	110.2
279	T	51.5	Low	44.4	Very low	130 Å²	130	148.8 Å²	148.8	80%	0.798	80%	0.798	S	S	*	*			trans	-74.5	152.8	176.1	47	0	0	0	0	111.8	L277	L277-T279 PolarHBondContact O-N 3.37Å
280	V	42.9	Very low	44.3	Very low	128 Å²	128	153.3 Å²	153.3	78%	0.776	81%	0.806	S	S	*	*			trans	-54.6	151.9	167.4	-70.6	0	0	0	0	111.9
281	H	46.6	Very low	43.9	Very low	188 Å²	188	152.8 Å²	152.8	87%	0.87	80%	0.803	S	S	*	*			trans	-125.7	128.1	160.1	-160.9	-51.6	0	0	0	108
282	E	51.9	Low	43.9	Very low	146 Å²	146	146.1 Å²	146.1	68%	0.682	79%	0.789	S	S	*	*			trans	-96.9	171	-174.4	-71.8	175.7	143.4	0	0	112.1
283	E	50.4	Low	43.9	Very low	159 Å²	159	147.5 Å²	147.5	74%	0.743	79%	0.785	S	S	*	*			trans	52.1	113.1	165.1	-47	-42.3	94.3	0	0	121.5
284	V	54.2	Low	43.7	Very low	146 Å²	146	149.4 Å²	149.4	89%	0.885	78%	0.783	S	S	*	*				-142.6	144.2	128.6	178.6	0	0	0	0	108.3
285	E	49.4	Very low	43.6	Very low	179 Å²	179	151.8 Å²	151.8	84%	0.836	78%	0.783	S	S	*	*			trans	-77	164	-160.7	-64.8	158.3	110.8	0	0	116.9
286	I	47.9	Very low	43.4	Very low	155 Å²	155	153.1 Å²	153.1	80%	0.795	78%	0.78	S	S	*	*			trans	-114.6	109.4	166.8	-59.1	173.9	0	0	0	108.5
287	E	46.5	Very low	42.9	Very low	193 Å²	193	149.6 Å²	149.6	90%	0.902	77%	0.766	S	S	*	*			trans	-71.9	137.7	170.1	-70.9	-168.7	132.8	0	0	111.4
288	T	36.7	Very low	43	Very low	108 Å²	108	150.7 Å²	150.7	66%	0.663	77%	0.767	S	S	*	*			trans	-128.5	103.8	-179.2	-61	0	0	0	0	110.4
289	E	43.5	Very low	42.4	Very low	198 Å²	198	149.1 Å²	149.1	93%	0.925	76%	0.759	S	S	*	*			trans	-96.8	154.7	166.8	-81.2	-125.2	112.7	0	0	111.9
290	Q	39	Very low	41.9	Very low	171 Å²	171	148.5 Å²	148.5	80%	0.799	76%	0.76	S	S	*	*			trans	-121.4	139.5	-159.5	-58.4	179.2	25	0	0	113.5
291	H	34.3	Very low	41.7	Very low	178 Å²	178	152.1 Å²	152.1	82%	0.824	77%	0.765	S	S	*	*			trans	-11.3	156.7	141	-135.8	-140	0	0	0	116.9
292	P	37.7	Very low	41.5	Very low	85 Å²	85	148.3 Å²	148.3	55%	0.552	76%	0.757	S	S	*	*			cis	-143	-178.5	-15.6	22.8	3.5	0	0	0	115.8
293	Q	37.4	Very low	40.8	Very low	147 Å²	147	147.4 Å²	147.4	69%	0.687	76%	0.762	S	S	*	*				141.4	131.7	119.9	-72.8	-156.9	17.4	0	0	118.2
294	Q	39.1	Very low	40.1	Very low	139 Å²	139	145.5 Å²	145.5	65%	0.65	76%	0.761	S	S	*	*			trans	69.9	128.7	141.5	-72.1	-168.3	73.3	0	0	123.5
295	Q	38.6	Very low	39.4	Very low	155 Å²	155	146.7 Å²	146.7	72%	0.724	76%	0.763	S	S	*	*			trans	67.2	151.7	145.6	-66.6	-176.9	57.3	0	0	119.3
296	Q	36.5	Very low	38.9	Very low	156 Å²	156	144.1 Å²	144.1	73%	0.729	76%	0.759	S	S	*	*			cis	-160.4	155	-35.7	-131	-174.4	22.1	0	0	109.6
297	T	33.1	Very low	38.7	Very low	97 Å²	97	143.6 Å²	143.6	60%	0.595	76%	0.758	S	S	*	*			trans	58.5	130.1	154.1	53.1	0	0	0	0	123.5
298	Q	39.4	Very low	38.3	Very low	177 Å²	177	139.5 Å²	139.5	83%	0.827	75%	0.746	S	S	*	*			trans	70.1	153	138.9	-65.9	174.6	83.3	0	0	119.5
299	S	34.4	Very low	38.5	Very low	97 Å²	97	140 Å²	140	68%	0.678	75%	0.749	S	S	*	*			cis	-168.3	-176.4	-24	66.8	0	0	0	0	111.4
300	S	41	Very low	38.4	Very low	117 Å²	117	136.5 Å²	136.5	82%	0.818	74%	0.741	S	S	*	*			trans	84.7	173.6	165.7	84.8	0	0	0	0	119.2
301	K	38.2	Very low	38.3	Very low	204 Å²	204	134.6 Å²	134.6	89%	0.887	74%	0.741	S	S	*	*			trans	-156.1	-175.2	-149.6	-113.8	-156.5	169	175.9	0	112.9
302	P	42.1	Very low	38.8	Very low	107 Å²	107	131.7 Å²	131.7	70%	0.695	74%	0.741	S	S	*	*			trans	-119.1	177.8	-142.1	46	-36.8	0	0	0	116.9
303	T	37.8	Very low	38.6	Very low	127 Å²	127	137 Å²	137	78%	0.779	76%	0.756	S	S	*	*			trans	-151.6	120.5	160.7	32.4	0	0	0	0	108.3
304	T	35.4	Very low	39.1	Very low	119 Å²	119	135.7 Å²	135.7	73%	0.73	76%	0.76	S	S	*	*				63.2	123.2	72.1	64.7	0	0	0	0	116.3
305	N	39.2	Very low	39.2	Very low	172 Å²	172	137.5 Å²	137.5	92%	0.92	77%	0.765	S	S	*	*			trans	-152.1	160.7	151.6	-100.5	-26.1	0	0	0	110.4
306	V	40.1	Very low	39.1	Very low	125 Å²	125	138.1 Å²	138.1	76%	0.758	77%	0.766	S	S	*	*			trans	-149.5	146.1	-161.8	-177.8	0	0	0	0	110.8
307	D	43.6	Very low	39.4	Very low	144 Å²	144	136.4 Å²	136.4	77%	0.77	77%	0.766	S	S	*	*			trans	-147.9	139.5	149.2	-109.4	-40.8	0	0	0	109
308	T	38.4	Very low	39.6	Very low	106 Å²	106	137.1 Å²	137.1	65%	0.65	77%	0.766	S	S	*	*				62.9	137.7	50.3	1.5	0	0	0	0	113.4
309	T	40.6	Very low	39.7	Very low	119 Å²	119	137.7 Å²	137.7	73%	0.73	77%	0.769	S	S	*	*			cis	-133.5	-167.8	8.6	-36.8	0	0	0	0	107.9
310	T	40.8	Very low	39.8	Very low	125 Å²	125	138.4 Å²	138.4	77%	0.767	77%	0.774	S	S	*	*			cis	-148.9	-139.6	19.6	-44.9	0	0	0	0	110.9
311	T	36.5	Very low	39.8	Very low	130 Å²	130	136.6 Å²	136.6	80%	0.798	77%	0.774	S	S	*	*			trans	-165.8	149.9	-173.9	-63.4	0	0	0	0	111.4
312	S	44.8	Very low	39.7	Very low	117 Å²	117	137.1 Å²	137.1	82%	0.818	78%	0.776	S	S	*	*			trans	-154.4	157.7	149.1	66.9	0	0	0	0	113.6
313	K	33.8	Very low	39.6	Very low	197 Å²	197	137 Å²	137	86%	0.857	78%	0.784	S	S	*	*			trans	-176.7	-174.1	-171.9	-115.6	-170.9	175.8	-177.5	0	109
314	P	47.8	Very low	39.6	Very low	119 Å²	119	135.9 Å²	135.9	77%	0.773	79%	0.788	S	S	*	*			cis	-114.4	-117.5	-3.3	21	5.4	0	0	0	114.7
315	K	41.5	Very low	40	Very low	177 Å²	177	136.4 Å²	136.4	77%	0.77	80%	0.796	S	S	*	*			cis	-168.4	106.8	3.9	-179.3	-161.3	172.2	-170.6	0	115.3
316	K	37.1	Very low	40	Very low	168 Å²	168	131 Å²	131	73%	0.73	78%	0.782	S	S	*	*			trans	60.6	172.1	153.6	-74.2	-179	153.6	-89.2	0	118.9	D318	K316-D318 IonicContact NZ-OD2 2.8Å; K316-D318 PolarHBondContact NZ-OD2 3.09Å
317	T	41.3	Very low	40	Very low	120 Å²	120	131 Å²	131	74%	0.736	79%	0.786	S	S	*	*			cis	-128.1	148.8	1.1	34.3	0	0	0	0	109.5
318	D	38.9	Very low	40	Very low	113 Å²	113	131.7 Å²	131.7	60%	0.604	78%	0.782	S	S	*	*			cis	87.9	146.5	45.1	-66	-43.7	0	0	0	115.1	K316	K316-D318 IonicContact NZ-OD2 2.8Å; K316-D318 PolarHBondContact NZ-OD2 3.09Å
319	E	41	Very low	39.9	Very low	188 Å²	188	133.4 Å²	133.4	88%	0.879	78%	0.783	S	S	*	*			trans	79.1	163.6	-178.5	-61.7	-153.1	105.6	0	0	120.1
320	S	37	Very low	39.8	Very low	112 Å²	112	132.7 Å²	132.7	78%	0.783	78%	0.781	S	S	*	*				-167.8	155.3	-82.5	61.6	0	0	0	0	112.6
321	G	40.1	Very low	39.7	Very low	80 Å²	80	133.6 Å²	133.6	83%	0.825	79%	0.787	S	S	*	*			trans	179.8	148.7	175.8	0	0	0	0	0	114.5
322	K	36.9	Very low	39.8	Very low	214 Å²	214	131.3 Å²	131.3	93%	0.93	78%	0.781	S	S	*	*			trans	-159.6	131.3	-169.3	177.1	-176.6	176.9	-176.5	0	113.1
323	A	38.5	Very low	39.8	Very low	105 Å²	105	131.6 Å²	131.6	87%	0.868	78%	0.78	S	S	*	*			trans	-156.2	165.6	168.7	0	0	0	0	0	111.8
324	A	37.5	Very low	40.6	Very low	104 Å²	104	127.2 Å²	127.2	86%	0.86	77%	0.772	S	S	*	*			trans	-156.5	-178.4	-177.4	0	0	0	0	0	112.3
325	S	44.2	Very low	40	Very low	129 Å²	129	127.5 Å²	127.5	90%	0.902	78%	0.776	S	S	*	*			trans	105.4	141.7	179.8	-165.3	0	0	0	0	114.6
326	G	39.8	Very low	40	Very low	60 Å²	60	125.2 Å²	125.2	62%	0.619	78%	0.782	S	S	*	*			cis	162	142.1	-11	0	0	0	0	0	115.9
327	C	39	Very low	39.9	Very low	125 Å²	125	125.2 Å²	125.2	85%	0.845	79%	0.789	S	S	*	*			trans	63	166.2	163.5	-48.3	0	0	0	0	116.9
328	K	43.6	Very low	39.8	Very low	157 Å²	157	127.6 Å²	127.6	68%	0.683	80%	0.796	S	S	*	*			cis	-152	147.9	27.3	-92.9	-165.2	171	-117.2	0	111.3
329	E	36.4	Very low	39.6	Very low	143 Å²	143	127.5 Å²	127.5	67%	0.668	80%	0.8	S	S	*	*				67.7	127.9	90.3	-110.4	166	77.2	0	0	111.8
330	C	38.5	Very low	39.4	Very low	103 Å²	103	124.7 Å²	124.7	70%	0.696	80%	0.796	S	S	*	*			cis	-161.8	148.6	19	-54	0	0	0	0	115.9
331	T	39	Very low	39.3	Very low	144 Å²	144	124.5 Å²	124.5	88%	0.883	79%	0.794	S	S	*	*				69.2	151.1	126.8	-51.6	0	0	0	0	125.4
332	A	38.7	Very low	39.5	Very low	82 Å²	82	128 Å²	128	68%	0.678	80%	0.8	S	S	*	*			trans	-125.9	-148.3	177.7	0	0	0	0	0	112
333	P	45.5	Very low	39.4	Very low	123 Å²	123	123.3 Å²	123.3	80%	0.799	79%	0.794	S	S	*	*			cis	-132.6	-100.8	27.5	25.8	4.5	0	0	0	120.1
334	P	50.1	Low	39.8	Very low	106 Å²	106	126.8 Å²	126.8	69%	0.688	80%	0.796	S	S	*	*			trans	-139.1	168.4	-130.7	44.9	-24.6	0	0	0	122
335	C	35.5	Very low	39.8	Very low	125 Å²	125	128.3 Å²	128.3	85%	0.845	80%	0.795	S	S	*	*			trans	49.3	136.9	144.8	-64.2	0	0	0	0	126
336	S	41.1	Very low	39.3	Very low	129 Å²	129	128 Å²	128	90%	0.902	79%	0.788	S	S	*	*			trans	-158.3	163	149.6	-66	0	0	0	0	111.3
337	L	35.4	Very low	39.6	Very low	167 Å²	167	131.9 Å²	131.9	87%	0.874	80%	0.8	S	S	*	*			trans	-111.1	163.5	-170.2	-63.5	161.8	0	0	0	113.4
338	L	39.9	Very low	39.5	Very low	171 Å²	171	130.2 Å²	130.2	90%	0.895	80%	0.795	S	S	*	*			trans	-171.4	160.5	133.6	-102.3	158.2	0	0	0	111.9
339	T	33	Very low	39.7	Very low	110 Å²	110	129.9 Å²	129.9	68%	0.675	81%	0.806	S	S	*	*			trans	-143.8	-179.3	-164.6	49.7	0	0	0	0	113.1
340	T	37.7	Very low	39.9	Very low	129 Å²	129	128.3 Å²	128.3	79%	0.791	81%	0.811	S	S	*	*			trans	78.6	157.5	167.2	71.3	0	0	0	0	118.7
341	S	34.1	Very low	40.7	Very low	108 Å²	108	129 Å²	129	76%	0.755	81%	0.813	S	S	*	*			cis	-179.2	134.8	-37.8	-88.6	0	0	0	0	108.1
342	T	44.3	Very low	40.9	Very low	155 Å²	155	127.3 Å²	127.3	95%	0.951	81%	0.808	S	S	*	*			trans	-149.7	148.1	165.5	29.4	0	0	0	0	111.9
343	S	35	Very low	41.1	Very low	115 Å²	115	129.5 Å²	129.5	80%	0.804	81%	0.812	S	S	*	*			trans	-142.7	149.5	179	51.6	0	0	0	0	110.3
344	I	46.9	Very low	40.9	Very low	177 Å²	177	130.7 Å²	130.7	91%	0.908	81%	0.811	S	S	*	*			trans	-149.8	164.2	173.8	28.2	173.4	0	0	0	110.9
345	T	38.2	Very low	40.8	Very low	137 Å²	137	132 Å²	132	84%	0.84	82%	0.817	S	S	*	*			trans	-111.4	152.4	-145.3	-48.8	0	0	0	0	115.2
346	T	33.6	Very low	41.1	Very low	122 Å²	122	131.4 Å²	131.4	75%	0.748	81%	0.812	S	S	*	*			trans	-61.8	141.1	174.6	-32.5	0	0	0	0	114.9
347	T	47.1	Very low	40.9	Very low	142 Å²	142	130.8 Å²	130.8	87%	0.871	81%	0.807	S	S	*	*			trans	-142.5	162.7	146	49.9	0	0	0	0	109.4
348	A	36.5	Very low	41.1	Very low	89 Å²	89	131.8 Å²	131.8	74%	0.736	81%	0.808	S	S	*	*			trans	-142.8	149.6	-170.9	0	0	0	0	0	113.2
349	V	47.8	Very low	40.8	Very low	151 Å²	151	132.1 Å²	132.1	92%	0.915	81%	0.806	S	S	*	*			trans	-156.6	160.8	156.4	-96.5	0	0	0	0	109.1
350	S	39.4	Very low	41.1	Very low	110 Å²	110	133.2 Å²	133.2	77%	0.769	81%	0.813	S	S	*	*			trans	-136.1	-169.1	-172.9	-49.2	0	0	0	0	109.7
351	P	56.5	Low	41	Very low	116 Å²	116	131.6 Å²	131.6	75%	0.753	81%	0.813	S	S	*	*				-123.5	-178.2	-56.9	34.9	-20.8	0	0	0	111.4
352	S	41.8	Very low	41.4	Very low	109 Å²	109	133.5 Å²	133.5	76%	0.762	81%	0.813	S	S	*	*			trans	166.2	147.5	130.2	-80.3	0	0	0	0	116.7
353	V	43.4	Very low	40.9	Very low	128 Å²	128	131 Å²	131	78%	0.776	80%	0.799	S	S	*	*			trans	76.3	130.1	148.6	168.2	0	0	0	0	121.4
354	L	42	Very low	41	Very low	149 Å²	149	132 Å²	132	78%	0.78	80%	0.801	S	S	*	*			trans	-4.4	151.1	161.7	-69.5	65.5	0	0	0	119.3
355	V	48.2	Very low	40.7	Very low	133 Å²	133	134.6 Å²	134.6	81%	0.806	80%	0.799	S	S	*	*				-157.8	151.3	60.7	160.9	0	0	0	0	111.2
356	P	40.5	Very low	40.5	Very low	113 Å²	113	138.2 Å²	138.2	73%	0.734	80%	0.803	S	S	*	*			trans	-95.1	172.7	-177.8	38	-38.1	0	0	0	116.1
357	S	36.8	Very low	40.7	Very low	115 Å²	115	142 Å²	142	80%	0.804	81%	0.809	S	S	*	*			trans	83.7	112.5	158.9	-159.5	0	0	0	0	119.6
358	E	40.6	Very low	40.1	Very low	189 Å²	189	139.8 Å²	139.8	88%	0.883	80%	0.799	S	S	*	*				-151.5	148.1	127.5	-148.8	178.3	-179.8	0	0	110.9
359	M	34.3	Very low	40	Very low	177 Å²	177	141 Å²	141	87%	0.872	80%	0.802	S	S	*	*			trans	-95.5	119.6	-177.7	-68.6	179.4	171.6	0	0	112
360	V	38.5	Very low	39.4	Very low	133 Å²	133	137.2 Å²	137.2	81%	0.806	79%	0.794	S	S	*	*			trans	-98.4	90.6	174.8	-176.1	0	0	0	0	111	I362	V360-I362 PolarHBondContact O-N 3.5Å
361	A	36.3	Very low	39.3	Very low	96 Å²	96	141.7 Å²	141.7	79%	0.793	80%	0.802	S	S	*	*			trans	-76.8	116.5	173.6	0	0	0	0	0	111.5	P363	A361-P363 WeakPolarHBondContact O-CD 3.43Å
362	I	41	Very low	38.6	Very low	147 Å²	147	140 Å²	140	75%	0.754	79%	0.794	S	S	*	*			trans	-85.5	119	179.4	-59	177.3	0	0	0	110.3	V360 V364	V360-I362 PolarHBondContact O-N 3.5Å; I362-V364 PolarHBondContact O-N 3.32Å
363	P	35.7	Very low	38.6	Very low	103 Å²	103	143 Å²	143	67%	0.669	80%	0.801	S	S	*	*			trans	-81	111.4	-177.4	31	-34	0	0	0	112.2	A361 R365	A361-P363 WeakPolarHBondContact O-CD 3.43Å; P363-R365 PolarHBondContact O-N 3.09Å
364	V	36	Very low	38.7	Very low	137 Å²	137	145.6 Å²	145.6	83%	0.83	80%	0.802	S	S	*	*			trans	-69.4	92	176.1	-177.8	0	0	0	0	110.9	I362 K366	I362-V364 PolarHBondContact O-N 3.32Å; V364-K366 PolarHBondContact O-N 3.21Å; V364-K366 VanDerWaalsContact O-N 3.17Å
365	R	40	Very low	38.6	Very low	231 Å²	231	141.4 Å²	141.4	87%	0.872	80%	0.795	S	S	*	*			trans	-72.3	102.9	172.6	-77.8	-178.9	168.9	155.5	-1.9	111	P363 K367	P363-R365 PolarHBondContact O-N 3.09Å; R365-K367 PolarHBondContact O-N 3.28Å
366	K	35	Very low	38.9	Very low	212 Å²	212	143 Å²	143	92%	0.922	80%	0.799	S	S	*	*			trans	-56.2	121.4	159.1	-73.7	179.2	177	174.5	0	109.1	V364	V364-K366 PolarHBondContact O-N 3.21Å; V364-K366 VanDerWaalsContact O-N 3.17Å
367	K	37.1	Very low	39.5	Very low	203 Å²	203	148.5 Å²	148.5	88%	0.883	81%	0.805	S	S	*	*			trans	-126.5	147.2	162.3	-164.1	164.9	-176.5	178.2	0	109.9	R365	R365-K367 PolarHBondContact O-N 3.28Å
368	S	34.6	Very low	40.9	Very low	95 Å²	95	149 Å²	149	66%	0.664	80%	0.798	S	S	*	*			trans	-89.6	163.9	-161	58.5	0	0	0	0	114.5
369	S	34.5	Very low	42.7	Very low	113 Å²	113	144.2 Å²	144.2	79%	0.79	78%	0.782	S	S	*	*			trans	54.2	80.8	142	61.9	0	0	0	0	117.3
370	G	35.5	Very low	44.6	Very low	72 Å²	72	139.5 Å²	139.5	74%	0.742	77%	0.771	S	S	*	*			trans	-117.7	107.1	155.3	0	0	0	0	0	110.1
371	Q	37	Very low	46.5	Very low	204 Å²	204	135.5 Å²	135.5	95%	0.953	76%	0.757	S	S	*	*			trans	-74.6	124	170	-73.6	176.5	-35.5	0	0	109
372	S	41.3	Very low	48.3	Very low	82 Å²	82	132.6 Å²	132.6	57%	0.573	73%	0.733	S	S	*	*			trans	-140.2	135.5	170.5	58.3	0	0	0	0	110.8	F374	S372-F374 VanDerWaalsContact C-N 3.34Å; S372-F374 PolarHBondContact O-N 2.97Å
373	N	42	Very low	49.9	Very low	171 Å²	171	129.3 Å²	129.3	91%	0.914	72%	0.716	S	S	*	*			trans	-84.7	65.6	-165	-70.3	-29.5	0	0	0	113	G375	N373-G375 PolarHBondContact O-N 3.09Å
374	F	45.6	Very low	51.8	Low	183 Å²	183	129.3 Å²	129.3	80%	0.803	71%	0.714	S	S	*	*			trans	-88.6	90.1	171.3	-71.2	-74	0	0	0	111	S372	S372-F374 VanDerWaalsContact C-N 3.34Å; S372-F374 PolarHBondContact O-N 2.97Å
375	G	41.2	Very low	53.7	Low	60 Å²	60	126.5 Å²	126.5	62%	0.619	71%	0.705	S	S	*	*			trans	-67.3	152.8	-177.4	0	0	0	0	0	114.6	N373 R377	N373-G375 PolarHBondContact O-N 3.09Å; G375-R377 VanDerWaalsContact C-N 3.27Å; G375-R377 PolarHBondContact O-N 3.46Å
376	N	54	Low	55.4	Low	167 Å²	167	118 Å²	118	89%	0.893	68%	0.679	S	S	*	*			trans	56.6	19.7	154.4	-55.5	-3.2	0	0	0	118.2	L378	N376-L378 PolarHBondContact O-N 2.85Å
377	R	52.4	Low	57.4	Low	228 Å²	228	111.9 Å²	111.9	86%	0.86	66%	0.656	S	S	*	*			trans	-70.8	97.3	174	-164.8	177.9	-168.8	-165.3	3.2	110.7	G375 T379	G375-R377 VanDerWaalsContact C-N 3.27Å; G375-R377 PolarHBondContact O-N 3.46Å; R377-T379 PolarHBondContact O-N 3.48Å
378	L	65.8	Low	59	Low	125 Å²	125	109.9 Å²	109.9	65%	0.654	65%	0.65	S	S	*	*			trans	-55	111.2	172.1	-72.6	169	0	0	0	110.1	N376 A382 L383	N376-L378 PolarHBondContact O-N 2.85Å; L378-A382 HydrophobicContact CD2-CB 4.17Å; L378-L383 HydrophobicContact CD1-CD2 4.37Å
379	T	78.4	Confident	60.8	Low	89 Å²	89	112.2 Å²	112.2	55%	0.546	65%	0.65	S	S	.	*			trans	-74.9	159.4	173.9	53.8	0	0	0	0	110.7	R377 G381 A382 L383	R377-T379 PolarHBondContact O-N 3.48Å; T379-G381 PolarHBondContact O-N 3.25Å; T379-A382 PolarHBondContact O-N 3.21Å; T379-A382 PolarHBondContact OG1-N 3.1Å; T379-L383 PolarHBondContact O-N 3.04Å; T379-L383 VanDerWaalsContact O-N 3.13Å
380	A	74.2	Confident	62.5	Low	78 Å²	78	113.4 Å²	113.4	65%	0.645	64%	0.637	S	S	*	*	H	α-helix	trans	-53.5	-39.6	174.8	0	0	0	0	0	111.8	A382 L383 V384	A380-A382 PolarHBondContact O-N 3.37Å; A380-L383 PolarHBondContact O-N 2.77Å; A380-V384 WeakPolarHBondContact O-CG2 3.47Å; A380-V384 PolarHBondContact O-N 3.26Å
381	G	78.1	Confident	64.1	Low	50 Å²	50	115.8 Å²	115.8	52%	0.515	63%	0.631	S	S	.	*	H	α-helix	trans	-59	-40.7	173.9	0	0	0	0	0	114.1	T379 L383 V384 A385	T379-G381 PolarHBondContact O-N 3.25Å; G381-L383 VanDerWaalsContact C-N 3.34Å; G381-V384 PolarHBondContact O-N 3.47Å; G381-A385 VanDerWaalsContact O-CB 3.26Å; G381-A385 WeakPolarHBondContact O-CB 3.5Å; G381-A385 PolarHBondContact O-N 3.24Å
382	A	75.4	Confident	65.5	Low	34 Å²	34	108.7 Å²	108.7	28%	0.281	61%	0.607	S	S	.	*	H	α-helix	trans	-69.1	-31.7	176.1	0	0	0	0	0	112.7	L378 T379 A380 T386	L378-A382 HydrophobicContact CD2-CB 4.17Å; T379-A382 PolarHBondContact O-N 3.21Å; T379-A382 PolarHBondContact OG1-N 3.1Å; A380-A382 PolarHBondContact O-N 3.37Å; A382-T386 PolarHBondContact O-N 3.44Å; A382-T386 PolarHBondContact O-OG1 2.77Å
383	L	73.3	Confident	66.5	Low	79 Å²	79	112.8 Å²	112.8	41%	0.414	61%	0.611	S	S	.	*	H	α-helix	trans	-72.1	-40	173	-68.6	171.7	0	0	0	111.9	L378 T379 A380 G381 T386 L387 R390	L378-L383 HydrophobicContact CD1-CD2 4.37Å; T379-L383 PolarHBondContact O-N 3.04Å; T379-L383 VanDerWaalsContact O-N 3.13Å; A380-L383 PolarHBondContact O-N 2.77Å; G381-L383 VanDerWaalsContact C-N 3.34Å; L383-T386 PolarHBondContact O-N 2.92Å; L383-T386 PolarHBondContact O-OG1 2.96Å; L383-T386 VanDerWaalsContact O-OG1 3.09Å; L383-L387 PolarHBondContact O-N 3.16Å; L383-R390 PolarHBondContact O-NH2 3.09Å
384	V	77	Confident	67.4	Low	102 Å²	102	108.6 Å²	108.6	62%	0.618	60%	0.595	S	S	*	*	H	α-helix	trans	-68.9	-43.3	176.2	172.4	0	0	0	0	111.3	A380 G381 T386 L387	A380-V384 WeakPolarHBondContact O-CG2 3.47Å; A380-V384 PolarHBondContact O-N 3.26Å; G381-V384 PolarHBondContact O-N 3.47Å; V384-T386 PolarHBondContact O-N 3.26Å; V384-L387 WeakPolarHBondContact O-CB 3.38Å; V384-L387 PolarHBondContact O-N 3.03Å
385	A	74.8	Confident	68	Low	78 Å²	78	103.1 Å²	103.1	65%	0.645	58%	0.584	S	S	*	*	H	α-helix	trans	-60.6	-19.4	177.3	0	0	0	0	0	114	G381	G381-A385 VanDerWaalsContact O-CB 3.26Å; G381-A385 WeakPolarHBondContact O-CB 3.5Å; G381-A385 PolarHBondContact O-N 3.24Å
386	T	76.6	Confident	68.5	Low	54 Å²	54	104.6 Å²	104.6	33%	0.331	58%	0.584	S	S	.	*	T	Hydrogen-bonded Turn	trans	-106.1	7.3	176.4	53.6	0	0	0	0	113.2	A382 L383 V384 R390	A382-T386 PolarHBondContact O-N 3.44Å; A382-T386 PolarHBondContact O-OG1 2.77Å; L383-T386 PolarHBondContact O-N 2.92Å; L383-T386 PolarHBondContact O-OG1 2.96Å; L383-T386 VanDerWaalsContact O-OG1 3.09Å; V384-T386 PolarHBondContact O-N 3.26Å; T386-R390 WeakPolarHBondContact O-CG 3.3Å; T386-R390 PolarHBondContact O-N 3.39Å; T386-R390 PolarHBondContact O-NE 3.21Å; T386-R390 PolarHBondContact OG1-NH2 3.34Å
387	L	76.4	Confident	68.5	Low	83 Å²	83	105.6 Å²	105.6	44%	0.435	58%	0.575	S	S	.	*	H	α-helix	trans	-74.4	-45.3	179.9	-177.9	141.2	0	0	0	111.6	L383 V384 Q389 R390 M391	L383-L387 PolarHBondContact O-N 3.16Å; V384-L387 WeakPolarHBondContact O-CB 3.38Å; V384-L387 PolarHBondContact O-N 3.03Å; L387-Q389 PolarHBondContact O-N 2.79Å; L387-R390 PolarHBondContact O-N 3.34Å; L387-R390 VanDerWaalsContact O-N 3.14Å; L387-M391 HydrophobicContact CD2-CE 3.84Å; L387-M391 HydrophobicContact CD2-CG 4.31Å; L387-M391 HydrophobicContact CD2-SD 3.78Å; L387-M391 HydrophobicContact CG-CE 4.4Å; L387-M391 PolarHBondContact O-N 2.89Å
388	E	71.7	Confident	68.4	Low	160 Å²	160	99.7 Å²	99.7	75%	0.748	57%	0.568	S	S	*	*	H	α-helix	trans	-62.1	-45.2	179.8	-172.4	176.4	-168.5	0	0	111.8	R390 M391 A392	E388-R390 VanDerWaalsContact C-N 3.29Å; E388-R390 PolarHBondContact O-N 3.46Å; E388-M391 PolarHBondContact O-N 3.31Å; E388-A392 WeakPolarHBondContact O-CB 3.37Å; E388-A392 PolarHBondContact O-N 2.82Å
389	Q	70.9	Confident	67.8	Low	145 Å²	145	98.4 Å²	98.4	68%	0.678	57%	0.57	S	S	*	*	H	α-helix	trans	-59.5	-38.3	174	-69.3	-174.5	-11.9	0	0	112.5	L387 Y393	L387-Q389 PolarHBondContact O-N 2.79Å; Q389-Y393 WeakPolarHBondContact O-CB 3.43Å; Q389-Y393 PolarHBondContact O-N 3.18Å
390	R	70.7	Confident	66.4	Low	137 Å²	137	104.6 Å²	104.6	52%	0.517	58%	0.584	S	S	.	*	H	α-helix	trans	-69.4	-37.8	175.7	-79.2	-178.9	-81.9	170.3	-7.9	112.4	L383 T386 L387 E388 S394	L383-R390 PolarHBondContact O-NH2 3.09Å; T386-R390 WeakPolarHBondContact O-CG 3.3Å; T386-R390 PolarHBondContact O-N 3.39Å; T386-R390 PolarHBondContact O-NE 3.21Å; T386-R390 PolarHBondContact OG1-NH2 3.34Å; L387-R390 PolarHBondContact O-N 3.34Å; L387-R390 VanDerWaalsContact O-N 3.14Å; E388-R390 VanDerWaalsContact C-N 3.29Å; E388-R390 PolarHBondContact O-N 3.46Å; R390-S394 WeakPolarHBondContact O-CB 3.28Å; R390-S394 PolarHBondContact O-N 2.76Å; R390-S394 VanDerWaalsContact O-N 3.09Å
391	M	68.5	Low	65.1	Low	123 Å²	123	106.7 Å²	106.7	61%	0.606	59%	0.593	S	S	*	*	H	α-helix	trans	-66.5	-43.2	173.5	-73.1	-169.5	168.4	0	0	112	L387 E388 Y393 S394 A395	L387-M391 HydrophobicContact CD2-CE 3.84Å; L387-M391 HydrophobicContact CD2-CG 4.31Å; L387-M391 HydrophobicContact CD2-SD 3.78Å; L387-M391 HydrophobicContact CG-CE 4.4Å; L387-M391 PolarHBondContact O-N 2.89Å; E388-M391 PolarHBondContact O-N 3.31Å; M391-Y393 PolarHBondContact O-N 3.44Å; M391-S394 WeakPolarHBondContact O-CB 3.44Å; M391-S394 PolarHBondContact O-N 2.96Å; M391-A395 PolarHBondContact O-N 3.29Å
392	A	67.7	Low	63.2	Low	55 Å²	55	107.3 Å²	107.3	46%	0.455	60%	0.6	S	S	.	*	H	α-helix	trans	-59.9	-46	175	0	0	0	0	0	111.9	E388 S394 A395 C396	E388-A392 WeakPolarHBondContact O-CB 3.37Å; E388-A392 PolarHBondContact O-N 2.82Å; A392-S394 VanDerWaalsContact C-N 3.28Å; A392-S394 PolarHBondContact O-N 2.94Å; A392-A395 PolarHBondContact O-N 2.84Å; A392-C396 PolarHBondContact O-N 2.87Å; A392-C396 VanDerWaalsContact O-N 3.11Å; A392-C396 PolarHBondContact O-SG 2.93Å
393	Y	61.1	Low	62.4	Low	168 Å²	168	112.2 Å²	112.2	66%	0.659	63%	0.626	S	S	*	*	H	α-helix	trans	-66.1	-29.6	178.8	-146.9	-96.1	0	0	0	113.1	Q389 M391	Q389-Y393 WeakPolarHBondContact O-CB 3.43Å; Q389-Y393 PolarHBondContact O-N 3.18Å; M391-Y393 PolarHBondContact O-N 3.44Å
394	S	61.4	Low	61.7	Low	82 Å²	82	113.8 Å²	113.8	57%	0.573	64%	0.641	S	S	*	*	H	α-helix	trans	-68.4	-50.5	170.6	-171.9	0	0	0	0	111.8	R390 M391 A392 C396 R397	R390-S394 WeakPolarHBondContact O-CB 3.28Å; R390-S394 PolarHBondContact O-N 2.76Å; R390-S394 VanDerWaalsContact O-N 3.09Å; M391-S394 WeakPolarHBondContact O-CB 3.44Å; M391-S394 PolarHBondContact O-N 2.96Å; A392-S394 VanDerWaalsContact C-N 3.28Å; A392-S394 PolarHBondContact O-N 2.94Å; S394-C396 VanDerWaalsContact C-N 3.31Å; S394-C396 PolarHBondContact O-N 3.37Å; S394-R397 PolarHBondContact O-N 3.17Å
395	A	57.4	Low	60.6	Low	69 Å²	69	114.5 Å²	114.5	57%	0.57	65%	0.648	S	S	*	*	H	α-helix	trans	-56.2	-42.4	-179.6	0	0	0	0	0	112.6	M391 A392 R397 S398	M391-A395 PolarHBondContact O-N 3.29Å; A392-A395 PolarHBondContact O-N 2.84Å; A395-R397 VanDerWaalsContact C-N 3.26Å; A395-R397 PolarHBondContact O-N 3.27Å; A395-S398 PolarHBondContact O-N 3.23Å
396	C	53.7	Low	59.4	Low	91 Å²	91	114.6 Å²	114.6	62%	0.615	64%	0.637	S	S	*	*	H	α-helix	trans	-56.3	-36.2	175.7	-70.3	0	0	0	0	113.7	A392 S394 S399	A392-C396 PolarHBondContact O-N 2.87Å; A392-C396 VanDerWaalsContact O-N 3.11Å; A392-C396 PolarHBondContact O-SG 2.93Å; S394-C396 VanDerWaalsContact C-N 3.31Å; S394-C396 PolarHBondContact O-N 3.37Å; C396-S399 PolarHBondContact O-OG 2.84Å
397	R	52.2	Low	58.9	Low	187 Å²	187	116 Å²	116	71%	0.706	65%	0.648	S	S	*	*	H	α-helix	trans	-75.4	-19.8	-178.9	-74.1	-171.5	171.2	-141	-1.1	113.8	S394 A395 S399	S394-R397 PolarHBondContact O-N 3.17Å; A395-R397 VanDerWaalsContact C-N 3.26Å; A395-R397 PolarHBondContact O-N 3.27Å; R397-S399 PolarHBondContact O-N 3.34Å; R397-S399 VanDerWaalsContact O-N 3.13Å
398	S	51.3	Low	57.7	Low	104 Å²	104	120.7 Å²	120.7	73%	0.727	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.6	-2.3	179	-161.8	0	0	0	0	114.1	A395 R400	A395-S398 PolarHBondContact O-N 3.23Å; S398-R400 VanDerWaalsContact C-N 3.34Å; S398-R400 PolarHBondContact O-N 2.97Å
399	S	52.6	Low	56.9	Low	99 Å²	99	119.1 Å²	119.1	69%	0.692	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.3	-0.2	-178	61.7	0	0	0	0	115.2	C396 R397	C396-S399 PolarHBondContact O-OG 2.84Å; R397-S399 PolarHBondContact O-N 3.34Å; R397-S399 VanDerWaalsContact O-N 3.13Å
400	R	50.2	Low	56.1	Low	219 Å²	219	117.2 Å²	117.2	83%	0.826	65%	0.651	S	S	*	*	S	Bend	trans	-134.6	117	179.4	-73.1	-171.3	171.5	-149.6	-2.7	112.2	S398	S398-R400 VanDerWaalsContact C-N 3.34Å; S398-R400 PolarHBondContact O-N 2.97Å
401	S	47	Very low	55.5	Low	121 Å²	121	118 Å²	118	85%	0.846	66%	0.658	S	S	*	*	S	Bend	trans	65.6	127.8	-172.7	-161.4	0	0	0	0	113.7
402	G	38.4	Very low	54.9	Low	63 Å²	63	121.7 Å²	121.7	65%	0.649	67%	0.667	S	S	*	*			trans	-86.2	-168.7	-175.2	0	0	0	0	0	114.6
403	V	56.9	Low	53.7	Low	138 Å²	138	123.3 Å²	123.3	84%	0.836	67%	0.671	S	S	*	*			trans	76.4	102.8	-171.2	-171.2	0	0	0	0	113.1
404	P	59.6	Low	53.1	Low	111 Å²	111	121 Å²	121	72%	0.721	68%	0.676	S	S	*	*			trans	-67.1	144.9	168.4	29.6	-33.8	0	0	0	110.2	N406	P404-N406 PolarHBondContact O-N 2.76Å; P404-N406 VanDerWaalsContact O-N 3.1Å
405	P	54.4	Low	52.3	Low	118 Å²	118	124.8 Å²	124.8	77%	0.766	68%	0.68	S	S	*	*			trans	-65.3	114.1	-177	25.8	-33.8	0	0	0	111
406	N	49.4	Very low	52.2	Low	80 Å²	80	128.1 Å²	128.1	43%	0.428	69%	0.687	S	S	.	*			trans	-58.7	122.9	-178.4	176.9	0.5	0	0	0	111	P404 Y408 H409	P404-N406 PolarHBondContact O-N 2.76Å; P404-N406 VanDerWaalsContact O-N 3.1Å; N406-Y408 PolarHBondContact O-N 2.9Å; N406-Y408 WeakPolarHBondContact OD1-CD2 3.45Å; N406-H409 PolarHBondContact O-N 2.64Å
407	P	65.8	Low	52.1	Low	84 Å²	84	129.1 Å²	129.1	55%	0.545	69%	0.692	S	S	.	*	T	Hydrogen-bonded Turn	trans	-64	-2.9	-168.8	24.5	-36.3	0	0	0	116.4
408	Y	50.1	Low	51.8	Low	180 Å²	180	123 Å²	123	71%	0.706	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.9	-22.9	173.7	-65.8	-85	0	0	0	113.8	N406	N406-Y408 PolarHBondContact O-N 2.9Å; N406-Y408 WeakPolarHBondContact OD1-CD2 3.45Å
409	H	55.3	Low	52	Low	128 Å²	128	120.9 Å²	120.9	59%	0.593	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.5	-15.4	-177.2	-77.2	-89.4	0	0	0	114.3	N406 K411 V413	N406-H409 PolarHBondContact O-N 2.64Å; H409-K411 VanDerWaalsContact C-N 3.33Å; H409-K411 PolarHBondContact O-N 2.86Å; H409-V413 WeakPolarHBondContact O-CG2 3.24Å
410	T	54.4	Low	52.1	Low	104 Å²	104	120.3 Å²	120.3	64%	0.638	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80	-10.4	-178.6	54.1	0	0	0	0	114.4
411	K	58	Low	52.2	Low	154 Å²	154	112 Å²	112	67%	0.67	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.2	-11.8	-168	-58.7	-171.8	-177.5	-174.8	0	115.4	H409	H409-K411 VanDerWaalsContact C-N 3.33Å; H409-K411 PolarHBondContact O-N 2.86Å
412	Y	55.3	Low	52.7	Low	200 Å²	200	108.8 Å²	108.8	78%	0.784	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-136	-4	-171	-67.3	-71.4	0	0	0	115.4
413	V	43.2	Very low	53.8	Low	90 Å²	90	109.1 Å²	109.1	55%	0.545	60%	0.599	S	S	.	*			trans	-85.7	124	170.5	-176.1	0	0	0	0	108.1	H409 Y415	H409-V413 WeakPolarHBondContact O-CG2 3.24Å; V413-Y415 PolarHBondContact O-N 3.02Å
414	P	49.2	Very low	53.9	Low	118 Å²	118	105 Å²	105	77%	0.766	57%	0.57	S	S	*	*			trans	-76.9	53	172.7	34.9	-36.4	0	0	0	110.4	L416	P414-L416 VanDerWaalsContact C-N 3.26Å; P414-L416 PolarHBondContact O-N 3.48Å
415	Y	43.6	Very low	53.8	Low	163 Å²	163	104.3 Å²	104.3	64%	0.639	56%	0.56	S	S	*	*			trans	-72.8	91.1	167.2	-160.4	-95.1	0	0	0	106.2	V413	V413-Y415 PolarHBondContact O-N 3.02Å
416	L	54.6	Low	54	Low	139 Å²	139	104.3 Å²	104.3	73%	0.728	55%	0.55	S	S	*	.			trans	-47.6	125.4	156.9	-86	66.3	0	0	0	105.3	P414 T418	P414-L416 VanDerWaalsContact C-N 3.26Å; P414-L416 PolarHBondContact O-N 3.48Å; L416-T418 PolarHBondContact O-N 2.84Å
417	P	51.8	Low	54.5	Low	111 Å²	111	104.4 Å²	104.4	72%	0.721	56%	0.557	S	S	*	*			trans	-58	112.4	167.3	25.4	-31.3	0	0	0	105.6	S419	P417-S419 PolarHBondContact O-N 3.2Å
418	T	46.4	Very low	54	Low	58 Å²	58	102.6 Å²	102.6	36%	0.356	54%	0.542	S	S	.	.			trans	-45.1	119.8	165.6	47.1	0	0	0	0	105.6	L416 D422	L416-T418 PolarHBondContact O-N 2.84Å; T418-D422 WeakPolarHBondContact CB-OD2 3.39Å
419	S	54.9	Low	54.3	Low	61 Å²	61	98.5 Å²	98.5	43%	0.427	54%	0.539	S	S	.	.			trans	-49	154.6	-167.7	178.1	0	0	0	0	110.4	P417 Q421 D422	P417-S419 PolarHBondContact O-N 3.2Å; S419-Q421 PolarHBondContact O-N 2.87Å; S419-Q421 PolarHBondContact OG-N 2.6Å; S419-D422 WeakPolarHBondContact O-CB 3.17Å; S419-D422 PolarHBondContact O-N 3.47Å
420	A	55.4	Low	54.3	Low	87 Å²	87	96.6 Å²	96.6	72%	0.719	54%	0.54	S	S	*	.	H	α-helix	trans	-49	-32.3	171.1	0	0	0	0	0	111.4
421	Q	52.9	Low	54.1	Low	43 Å²	43	96.8 Å²	96.8	20%	0.201	54%	0.537	C	S	.	.	H	α-helix	trans	-72	-28.2	173.9	-63.2	175.2	-18.2	0	0	115.1	S419 E424 L425	S419-Q421 PolarHBondContact O-N 2.87Å; S419-Q421 PolarHBondContact OG-N 2.6Å; Q421-E424 CarbonylContact O-C 3.55Å; Q421-E424 WeakPolarHBondContact O-CA 3.16Å; Q421-E424 WeakPolarHBondContact O-CB 3.45Å; Q421-E424 PolarHBondContact O-N 3.14Å; Q421-E424 VanDerWaalsContact O-N 3.11Å; Q421-L425 HydrophobicContact CB-CD1 4.48Å; Q421-L425 WeakPolarHBondContact O-CB 3.48Å; Q421-L425 VanDerWaalsContact O-CG 3.23Å; Q421-L425 WeakPolarHBondContact O-CG 3.49Å; Q421-L425 PolarHBondContact O-N 3.49Å
422	D	57.3	Low	53.8	Low	54 Å²	54	93.7 Å²	93.7	29%	0.289	54%	0.541	S	S	.	.	H	α-helix	trans	-69.9	-39	-172.2	-162.9	-11.3	0	0	0	111.5	T418 S419 E424 L425 Q426	T418-D422 WeakPolarHBondContact CB-OD2 3.39Å; S419-D422 WeakPolarHBondContact O-CB 3.17Å; S419-D422 PolarHBondContact O-N 3.47Å; D422-E424 VanDerWaalsContact C-N 3.27Å; D422-E424 PolarHBondContact O-N 3.17Å; D422-L425 PolarHBondContact O-N 2.89Å; D422-Q426 WeakPolarHBondContact O-CB 3.23Å; D422-Q426 WeakPolarHBondContact O-CG 3.13Å; D422-Q426 PolarHBondContact O-N 2.9Å; D422-Q426 PolarHBondContact OD1-NE2 2.77Å
423	S	61.6	Low	53.8	Low	71 Å²	71	89 Å²	89	50%	0.497	54%	0.543	S	S	.	.	H	α-helix	trans	-63.9	-31.9	169.9	-66.5	0	0	0	0	112.7	S427	S423-S427 WeakPolarHBondContact O-CB 3.46Å; S423-S427 PolarHBondContact O-N 3.34Å; S423-S427 PolarHBondContact O-OG 3.21Å
424	E	59.1	Low	54.1	Low	50 Å²	50	90.5 Å²	90.5	23%	0.234	55%	0.553	C	S	.	*	H	α-helix	trans	-74.7	-39.2	174.6	-61.1	-178.5	144.3	0	0	111.5	Q421 D422 S427 M428 I455	Q421-E424 CarbonylContact O-C 3.55Å; Q421-E424 WeakPolarHBondContact O-CA 3.16Å; Q421-E424 WeakPolarHBondContact O-CB 3.45Å; Q421-E424 PolarHBondContact O-N 3.14Å; Q421-E424 VanDerWaalsContact O-N 3.11Å; D422-E424 VanDerWaalsContact C-N 3.27Å; D422-E424 PolarHBondContact O-N 3.17Å; E424-S427 WeakPolarHBondContact O-CB 3.46Å; E424-S427 PolarHBondContact O-N 2.91Å; E424-M428 WeakPolarHBondContact O-CB 3.4Å; E424-M428 WeakPolarHBondContact O-CG 3.45Å; E424-M428 PolarHBondContact O-N 3.35Å; E424-M428 VanDerWaalsContact O-N 3.13Å; E424-I455 HydrophobicContact CB-CD1 3.9Å; E424-I455 HydrophobicContact CB-CG1 3.91Å; E424-I455 HydrophobicContact CG-CG1 4.28Å
425	L	57.3	Low	54	Low	98 Å²	98	94.4 Å²	94.4	51%	0.513	56%	0.561	S	S	.	*	H	α-helix	trans	-67.9	-41.1	177.6	-72.4	168.4	0	0	0	112.2	Q421 D422 S427 M428 S429	Q421-L425 HydrophobicContact CB-CD1 4.48Å; Q421-L425 WeakPolarHBondContact O-CB 3.48Å; Q421-L425 VanDerWaalsContact O-CG 3.23Å; Q421-L425 WeakPolarHBondContact O-CG 3.49Å; Q421-L425 PolarHBondContact O-N 3.49Å; D422-L425 PolarHBondContact O-N 2.89Å; L425-S427 VanDerWaalsContact C-N 3.32Å; L425-S427 PolarHBondContact O-N 2.93Å; L425-M428 PolarHBondContact O-N 2.98Å; L425-M428 VanDerWaalsContact O-N 3.09Å; L425-S429 PolarHBondContact O-N 3.43Å; L425-S429 VanDerWaalsContact O-N 3.09Å; L425-S429 PolarHBondContact O-OG 3.02Å
426	Q	59	Low	54	Low	117 Å²	117	91.2 Å²	91.2	55%	0.547	56%	0.562	S	S	.	*	H	α-helix	trans	-64	-38.9	172.9	-69.7	175.5	34	0	0	111.2	D422 M428 S429	D422-Q426 WeakPolarHBondContact O-CB 3.23Å; D422-Q426 WeakPolarHBondContact O-CG 3.13Å; D422-Q426 PolarHBondContact O-N 2.9Å; D422-Q426 PolarHBondContact OD1-NE2 2.77Å; Q426-M428 PolarHBondContact O-N 2.92Å; Q426-S429 PolarHBondContact O-N 3.42Å
427	S	58.4	Low	53.9	Low	83 Å²	83	88.4 Å²	88.4	58%	0.58	55%	0.554	S	S	*	*	H	α-helix	trans	-64.6	-19.1	173.1	-59.4	0	0	0	0	113.8	S423 E424 L425	S423-S427 WeakPolarHBondContact O-CB 3.46Å; S423-S427 PolarHBondContact O-N 3.34Å; S423-S427 PolarHBondContact O-OG 3.21Å; E424-S427 WeakPolarHBondContact O-CB 3.46Å; E424-S427 PolarHBondContact O-N 2.91Å; L425-S427 VanDerWaalsContact C-N 3.32Å; L425-S427 PolarHBondContact O-N 2.93Å
428	M	56.1	Low	53.8	Low	46 Å²	46	92.6 Å²	92.6	23%	0.227	57%	0.569	C	S	.	*	H	α-helix	trans	-99.8	-13.9	-178.8	-79.4	-58.9	-47.7	0	0	114.6	E424 L425 Q426 I451 R452 I455	E424-M428 WeakPolarHBondContact O-CB 3.4Å; E424-M428 WeakPolarHBondContact O-CG 3.45Å; E424-M428 PolarHBondContact O-N 3.35Å; E424-M428 VanDerWaalsContact O-N 3.13Å; L425-M428 PolarHBondContact O-N 2.98Å; L425-M428 VanDerWaalsContact O-N 3.09Å; Q426-M428 PolarHBondContact O-N 2.92Å; M428-I451 HydrophobicContact SD-CG2 4.23Å; M428-R452 HydrophobicContact CE-CG 3.83Å; M428-R452 HydrophobicContact SD-CG 4.06Å; M428-I455 HydrophobicContact CG-CD1 3.64Å; M428-I455 HydrophobicContact SD-CD1 4.27Å
429	S	55.9	Low	54.1	Low	94 Å²	94	93.5 Å²	93.5	66%	0.657	58%	0.578	S	S	*	*			trans	-87.5	-3.4	-168.2	-63.9	0	0	0	0	115.1	L425 Q426 D431	L425-S429 PolarHBondContact O-N 3.43Å; L425-S429 VanDerWaalsContact O-N 3.09Å; L425-S429 PolarHBondContact O-OG 3.02Å; Q426-S429 PolarHBondContact O-N 3.42Å; S429-D431 PolarHBondContact O-N 2.77Å
430	S	55	Low	54.2	Low	87 Å²	87	95.3 Å²	95.3	61%	0.608	58%	0.583	S	S	*	*			trans	-94.5	53.3	-172	-41.7	0	0	0	0	113.7
431	D	50.6	Low	54.3	Low	108 Å²	108	95.1 Å²	95.1	58%	0.578	58%	0.577	S	S	*	*			trans	-143.5	44.5	-174.3	-131.9	14.8	0	0	0	113.9	S429 R448	S429-D431 PolarHBondContact O-N 2.77Å; D431-R448 IonicContact OD1-NH1 3.57Å; D431-R448 PolarHBondContact OD1-NH1 3.12Å; D431-R448 IonicContact OD2-CZ 2.75Å; D431-R448 IonicContact OD2-NH1 3.75Å; D431-R448 PolarHBondContact OD2-NH1 2.93Å
432	A	53.1	Low	54.6	Low	90 Å²	90	103.5 Å²	103.5	74%	0.744	61%	0.606	S	S	*	*	S	Bend	trans	-97.9	96.6	170	0	0	0	0	0	110.7	T434	A432-T434 PolarHBondContact O-N 3.13Å
433	A	54.1	Low	54.7	Low	100 Å²	100	108.5 Å²	108.5	83%	0.826	62%	0.622	S	S	*	*	S	Bend	trans	31.5	74.3	162.8	0	0	0	0	0	117.6
434	T	50.4	Low	54.7	Low	122 Å²	122	110.8 Å²	110.8	75%	0.748	62%	0.62	S	S	*	*			trans	-130.5	111.3	163.9	47.3	0	0	0	0	111.3	A432 S436	A432-T434 PolarHBondContact O-N 3.13Å; T434-S436 VanDerWaalsContact C-N 3.35Å; T434-S436 PolarHBondContact O-N 3.11Å
435	E	46.4	Very low	55.1	Low	201 Å²	201	114.7 Å²	114.7	94%	0.939	64%	0.638	S	S	*	*			trans	-84.4	52.8	-167.8	60.2	-145.5	98.4	0	0	115.3
436	S	44.3	Very low	56	Low	96 Å²	96	116.7 Å²	116.7	67%	0.671	64%	0.643	S	S	*	*			trans	-140.8	76.2	-172	54	0	0	0	0	115.8	T434	T434-S436 VanDerWaalsContact C-N 3.35Å; T434-S436 PolarHBondContact O-N 3.11Å
437	S	52.1	Low	56.5	Low	80 Å²	80	116.7 Å²	116.7	56%	0.559	64%	0.642	S	S	*	*			trans	-170.3	88.2	158	-92.5	0	0	0	0	113.2	S439	S437-S439 PolarHBondContact O-N 3.15Å
438	L	49.9	Very low	57.1	Low	198 Å²	198	116.7 Å²	116.7	100%	1.037	63%	0.63	S	S	*	*			trans	-76.3	52.2	170.8	-67	175.9	0	0	0	112.3
439	S	51.9	Low	58	Low	78 Å²	78	121.7 Å²	121.7	55%	0.545	65%	0.646	S	S	.	*	S	Bend	trans	-147	124.2	174.6	-176.7	0	0	0	0	112.6	S437 S441 R444	S437-S439 PolarHBondContact O-N 3.15Å; S439-S441 VanDerWaalsContact C-N 3.35Å; S439-S441 PolarHBondContact O-N 2.67Å; S439-R444 PolarHBondContact O-NH2 3.23Å
440	N	56.8	Low	59	Low	99 Å²	99	120.6 Å²	120.6	53%	0.529	63%	0.632	S	S	.	*			trans	56.9	26.3	168	-131.3	23.6	0	0	0	118.9	R442 Y443 R444	N440-R442 VanDerWaalsContact C-N 3.3Å; N440-R442 PolarHBondContact O-N 3.46Å; N440-R442 VanDerWaalsContact O-N 3.16Å; N440-Y443 PolarHBondContact O-N 3.04Å; N440-Y443 VanDerWaalsContact O-N 3.1Å; N440-Y443 WeakPolarHBondContact OD1-CD2 3.22Å; N440-Y443 WeakPolarHBondContact OD1-CE2 3.35Å; N440-R444 PolarHBondContact O-N 3.47Å
441	S	58.3	Low	59.8	Low	83 Å²	83	119.8 Å²	119.8	58%	0.58	62%	0.62	S	S	*	*	H	α-helix	trans	-45.8	-45	178.5	166.2	0	0	0	0	114.5	S439 Y443 R444 H445	S439-S441 VanDerWaalsContact C-N 3.35Å; S439-S441 PolarHBondContact O-N 2.67Å; S441-Y443 VanDerWaalsContact C-N 3.27Å; S441-Y443 PolarHBondContact O-N 2.97Å; S441-R444 PolarHBondContact O-N 2.96Å; S441-H445 WeakPolarHBondContact O-CB 3.32Å; S441-H445 PolarHBondContact O-N 3.25Å
442	R	59.4	Low	61	Low	219 Å²	219	120.5 Å²	120.5	83%	0.826	62%	0.615	S	S	*	*	H	α-helix	trans	-61.5	-28.2	-177.4	-70.1	-168.2	-68.5	-171.9	-2.2	114.6	N440 K446	N440-R442 VanDerWaalsContact C-N 3.3Å; N440-R442 PolarHBondContact O-N 3.46Å; N440-R442 VanDerWaalsContact O-N 3.16Å; R442-K446 PolarHBondContact O-N 3.17Å
443	Y	60	Low	62	Low	159 Å²	159	121.8 Å²	121.8	62%	0.624	61%	0.605	S	S	*	*	H	α-helix	trans	-80.8	-50.3	176.9	-71.7	-97.4	0	0	0	110.5	N440 S441 H445 K446 E447	N440-Y443 PolarHBondContact O-N 3.04Å; N440-Y443 VanDerWaalsContact O-N 3.1Å; N440-Y443 WeakPolarHBondContact OD1-CD2 3.22Å; N440-Y443 WeakPolarHBondContact OD1-CE2 3.35Å; S441-Y443 VanDerWaalsContact C-N 3.27Å; S441-Y443 PolarHBondContact O-N 2.97Å; Y443-H445 PolarHBondContact O-N 3.4Å; Y443-K446 WeakPolarHBondContact O-CB 3.43Å; Y443-K446 PolarHBondContact O-N 3.19Å; Y443-E447 WeakPolarHBondContact O-CB 3.48Å; Y443-E447 PolarHBondContact O-N 3.39Å
444	R	61.6	Low	62.9	Low	119 Å²	119	122.4 Å²	122.4	45%	0.449	59%	0.591	S	S	.	*	H	α-helix	trans	-55.2	-37	175.9	-63.7	-164.5	-114	-172.4	-0.3	112.3	S439 N440 S441 R448	S439-R444 PolarHBondContact O-NH2 3.23Å; N440-R444 PolarHBondContact O-N 3.47Å; S441-R444 PolarHBondContact O-N 2.96Å; R444-R448 WeakPolarHBondContact O-CB 3.45Å; R444-R448 WeakPolarHBondContact O-CG 3.43Å; R444-R448 PolarHBondContact O-N 3.19Å
445	H	67.4	Low	63.7	Low	131 Å²	131	118.4 Å²	118.4	61%	0.606	57%	0.565	S	S	*	*	H	α-helix	trans	-75.8	-24.9	177.7	-155.5	71.4	0	0	0	114.1	S441 Y443 R449	S441-H445 WeakPolarHBondContact O-CB 3.32Å; S441-H445 PolarHBondContact O-N 3.25Å; Y443-H445 PolarHBondContact O-N 3.4Å; H445-R449 PolarHBondContact NE2-NH2 2.93Å; H445-R449 VanDerWaalsContact O-CG 3.31Å; H445-R449 WeakPolarHBondContact O-CG 3.27Å; H445-R449 PolarHBondContact O-N 3.43Å
446	K	74.9	Confident	64.7	Low	141 Å²	141	115 Å²	115	61%	0.613	55%	0.549	S	S	*	.	H	α-helix	trans	-74.4	-45.8	170.3	-170.6	-159.3	176.7	-156.9	0	110	R442 Y443 R449 I450	R442-K446 PolarHBondContact O-N 3.17Å; Y443-K446 WeakPolarHBondContact O-CB 3.43Å; Y443-K446 PolarHBondContact O-N 3.19Å; K446-R449 WeakPolarHBondContact O-CB 3.49Å; K446-R449 PolarHBondContact O-N 2.61Å; K446-R449 VanDerWaalsContact O-N 3.15Å; K446-I450 HydrophobicContact CD-CD1 4.36Å; K446-I450 HydrophobicContact CG-CD1 4.19Å; K446-I450 WeakPolarHBondContact O-CG1 3.33Å; K446-I450 PolarHBondContact O-N 3.33Å
447	E	70.8	Confident	65.9	Low	116 Å²	116	118.2 Å²	118.2	54%	0.542	55%	0.553	S	S	.	*	H	α-helix	trans	-59.6	-50.1	178.1	-174.2	169.7	-143	0	0	111.6	Y443 R449 I450 I451	Y443-E447 WeakPolarHBondContact O-CB 3.48Å; Y443-E447 PolarHBondContact O-N 3.39Å; E447-R449 PolarHBondContact O-N 3Å; E447-I450 PolarHBondContact O-N 2.95Å; E447-I450 VanDerWaalsContact O-N 3.11Å; E447-I451 HydrophobicContact CG-CD1 4.06Å; E447-I451 WeakPolarHBondContact O-CG1 3.3Å; E447-I451 PolarHBondContact O-N 3.3Å
448	R	70.4	Confident	66.5	Low	84 Å²	84	118.7 Å²	118.7	32%	0.317	55%	0.549	S	S	.	.	H	α-helix	trans	-59.8	-26.8	173.4	-77.3	-175.5	168	-170.7	-3.1	114	D431 R444 R452	D431-R448 IonicContact OD1-NH1 3.57Å; D431-R448 PolarHBondContact OD1-NH1 3.12Å; D431-R448 IonicContact OD2-CZ 2.75Å; D431-R448 IonicContact OD2-NH1 3.75Å; D431-R448 PolarHBondContact OD2-NH1 2.93Å; R444-R448 WeakPolarHBondContact O-CB 3.45Å; R444-R448 WeakPolarHBondContact O-CG 3.43Å; R444-R448 PolarHBondContact O-N 3.19Å; R448-R452 VanDerWaalsContact O-CG 3.31Å; R448-R452 WeakPolarHBondContact O-CG 3.4Å; R448-R452 PolarHBondContact O-N 3.15Å; R448-R452 VanDerWaalsContact O-N 3.17Å
449	R	75	Confident	67.3	Low	150 Å²	150	118.3 Å²	118.3	57%	0.566	53%	0.534	S	S	*	.	H	α-helix	trans	-75.9	-41.7	172.6	-75.7	176.6	-173.5	-151.1	-2.3	112.4	H445 K446 E447 I451 R452 Q453	H445-R449 PolarHBondContact NE2-NH2 2.93Å; H445-R449 VanDerWaalsContact O-CG 3.31Å; H445-R449 WeakPolarHBondContact O-CG 3.27Å; H445-R449 PolarHBondContact O-N 3.43Å; K446-R449 WeakPolarHBondContact O-CB 3.49Å; K446-R449 PolarHBondContact O-N 2.61Å; K446-R449 VanDerWaalsContact O-N 3.15Å; E447-R449 PolarHBondContact O-N 3Å; R449-I451 VanDerWaalsContact C-N 3.35Å; R449-R452 PolarHBondContact O-N 3.14Å; R449-Q453 WeakPolarHBondContact O-CG 3.48Å; R449-Q453 PolarHBondContact O-N 3.11Å
450	I	76.7	Confident	67.7	Low	71 Å²	71	119.4 Å²	119.4	36%	0.364	53%	0.534	S	S	.	.	H	α-helix	trans	-61.4	-46.8	175.4	-67.6	163.6	0	0	0	109.5	K446 E447 R452 Q453 H454	K446-I450 HydrophobicContact CD-CD1 4.36Å; K446-I450 HydrophobicContact CG-CD1 4.19Å; K446-I450 WeakPolarHBondContact O-CG1 3.33Å; K446-I450 PolarHBondContact O-N 3.33Å; E447-I450 PolarHBondContact O-N 2.95Å; E447-I450 VanDerWaalsContact O-N 3.11Å; I450-R452 PolarHBondContact O-N 2.68Å; I450-Q453 PolarHBondContact O-N 2.95Å; I450-Q453 VanDerWaalsContact O-N 3.15Å; I450-H454 PolarHBondContact O-CD2 2.86Å; I450-H454 VanDerWaalsContact O-CD2 3.31Å; I450-H454 PolarHBondContact O-N 2.9Å
451	I	72.7	Confident	67.9	Low	71 Å²	71	120.1 Å²	120.1	36%	0.364	54%	0.544	S	S	.	.	H	α-helix	trans	-57	-48.6	175.9	-68	165.4	0	0	0	110.9	M428 E447 R449 Q453 H454 I455	M428-I451 HydrophobicContact SD-CG2 4.23Å; E447-I451 HydrophobicContact CG-CD1 4.06Å; E447-I451 WeakPolarHBondContact O-CG1 3.3Å; E447-I451 PolarHBondContact O-N 3.3Å; R449-I451 VanDerWaalsContact C-N 3.35Å; I451-Q453 PolarHBondContact O-N 2.67Å; I451-H454 PolarHBondContact O-N 3.34Å; I451-I455 HydrophobicContact CG2-CD1 3.7Å; I451-I455 HydrophobicContact CG2-CG1 4.42Å; I451-I455 VanDerWaalsContact O-CG1 3.28Å; I451-I455 WeakPolarHBondContact O-CG1 3.35Å; I451-I455 PolarHBondContact O-N 2.95Å
452	R	74.5	Confident	67.9	Low	123 Å²	123	121.9 Å²	121.9	46%	0.464	55%	0.545	S	S	.	.	H	α-helix	trans	-57.5	-44.2	174.2	-75	178.2	-165.2	-124.9	1.3	113	M428 R448 R449 I450 H454 I455 E456	M428-R452 HydrophobicContact CE-CG 3.83Å; M428-R452 HydrophobicContact SD-CG 4.06Å; R448-R452 VanDerWaalsContact O-CG 3.31Å; R448-R452 WeakPolarHBondContact O-CG 3.4Å; R448-R452 PolarHBondContact O-N 3.15Å; R448-R452 VanDerWaalsContact O-N 3.17Å; R449-R452 PolarHBondContact O-N 3.14Å; I450-R452 PolarHBondContact O-N 2.68Å; R452-H454 VanDerWaalsContact C-N 3.32Å; R452-H454 PolarHBondContact O-N 2.88Å; R452-I455 PolarHBondContact O-N 2.85Å; R452-E456 WeakPolarHBondContact O-CB 3.47Å; R452-E456 WeakPolarHBondContact O-CG 3.34Å; R452-E456 PolarHBondContact O-N 2.91Å
453	Q	73.7	Confident	67.6	Low	116 Å²	116	114.7 Å²	114.7	54%	0.542	53%	0.533	S	S	.	.	H	α-helix	trans	-64.4	-34.4	179	-73.7	-174.5	-65	0	0	113	R449 I450 I451 H457	R449-Q453 WeakPolarHBondContact O-CG 3.48Å; R449-Q453 PolarHBondContact O-N 3.11Å; I450-Q453 PolarHBondContact O-N 2.95Å; I450-Q453 VanDerWaalsContact O-N 3.15Å; I451-Q453 PolarHBondContact O-N 2.67Å; Q453-H457 PolarHBondContact O-N 3.42Å; Q453-H457 VanDerWaalsContact O-N 3.13Å; Q453-H457 PolarHBondContact O-ND1 3.04Å
454	H	73.3	Confident	67.3	Low	114 Å²	114	112.1 Å²	112.1	53%	0.528	54%	0.538	S	S	.	.	H	α-helix	trans	-70	-44.2	172.6	-82.6	-80.1	0	0	0	111.9	I450 I451 R452 E456 H457 N458	I450-H454 PolarHBondContact O-CD2 2.86Å; I450-H454 VanDerWaalsContact O-CD2 3.31Å; I450-H454 PolarHBondContact O-N 2.9Å; I451-H454 PolarHBondContact O-N 3.34Å; R452-H454 VanDerWaalsContact C-N 3.32Å; R452-H454 PolarHBondContact O-N 2.88Å; H454-E456 VanDerWaalsContact C-N 3.28Å; H454-E456 PolarHBondContact O-N 3.48Å; H454-H457 PolarHBondContact O-N 3.12Å; H454-N458 WeakPolarHBondContact O-CB 3.4Å; H454-N458 VanDerWaalsContact O-CG 3.23Å; H454-N458 PolarHBondContact O-N 3.29Å
455	I	68.6	Low	67.1	Low	37 Å²	37	113.5 Å²	113.5	19%	0.19	55%	0.55	C	S	.	.	H	α-helix	trans	-59.2	-40.6	174.9	-65.9	167.5	0	0	0	111	E424 M428 I451 R452 N458 R459	E424-I455 HydrophobicContact CB-CD1 3.9Å; E424-I455 HydrophobicContact CB-CG1 3.91Å; E424-I455 HydrophobicContact CG-CG1 4.28Å; M428-I455 HydrophobicContact CG-CD1 3.64Å; M428-I455 HydrophobicContact SD-CD1 4.27Å; I451-I455 HydrophobicContact CG2-CD1 3.7Å; I451-I455 HydrophobicContact CG2-CG1 4.42Å; I451-I455 VanDerWaalsContact O-CG1 3.28Å; I451-I455 WeakPolarHBondContact O-CG1 3.35Å; I451-I455 PolarHBondContact O-N 2.95Å; R452-I455 PolarHBondContact O-N 2.85Å; I455-N458 PolarHBondContact O-N 2.93Å; I455-R459 PolarHBondContact O-N 2.67Å
456	E	67.6	Low	66.7	Low	131 Å²	131	114 Å²	114	61%	0.612	56%	0.555	S	S	*	*	H	α-helix	trans	-69.5	-31.3	177.8	-74	171.3	173.1	0	0	113	R452 H454 R459	R452-E456 WeakPolarHBondContact O-CB 3.47Å; R452-E456 WeakPolarHBondContact O-CG 3.34Å; R452-E456 PolarHBondContact O-N 2.91Å; H454-E456 VanDerWaalsContact C-N 3.28Å; H454-E456 PolarHBondContact O-N 3.48Å; E456-R459 WeakPolarHBondContact O-CB 3.47Å
457	H	67.5	Low	66	Low	162 Å²	162	115.5 Å²	115.5	75%	0.75	56%	0.562	S	S	*	*	H	α-helix	trans	-78.9	-33.9	172.7	-82	75.2	0	0	0	113.4	Q453 H454 R459	Q453-H457 PolarHBondContact O-N 3.42Å; Q453-H457 VanDerWaalsContact O-N 3.13Å; Q453-H457 PolarHBondContact O-ND1 3.04Å; H454-H457 PolarHBondContact O-N 3.12Å; H457-R459 PolarHBondContact O-N 3.1Å
458	N	65.8	Low	65.4	Low	90 Å²	90	113.8 Å²	113.8	48%	0.481	56%	0.556	S	S	.	*	S	Bend	trans	-81.2	8.9	177.3	-66.4	-13.9	0	0	0	112.8	H454 I455 D460	H454-N458 WeakPolarHBondContact O-CB 3.4Å; H454-N458 VanDerWaalsContact O-CG 3.23Å; H454-N458 PolarHBondContact O-N 3.29Å; I455-N458 PolarHBondContact O-N 2.93Å; N458-D460 PolarHBondContact O-N 3.41Å
459	R	67.1	Low	64.8	Low	190 Å²	190	111.8 Å²	111.8	72%	0.717	55%	0.554	S	S	*	*			trans	-78.4	89.7	-173.4	-170.2	178.2	-178.6	172.5	1.5	111.7	I455 E456 H457	I455-R459 PolarHBondContact O-N 2.67Å; E456-R459 WeakPolarHBondContact O-CB 3.47Å; H457-R459 PolarHBondContact O-N 3.1Å
460	D	58.7	Low	63.8	Low	102 Å²	102	116.1 Å²	116.1	55%	0.545	57%	0.57	S	S	.	*			trans	-48.7	124	174.2	-91.5	-46.2	0	0	0	112.4	N458 I462 A463	N458-D460 PolarHBondContact O-N 3.41Å; D460-I462 PolarHBondContact O-N 3.45Å; D460-I462 VanDerWaalsContact O-N 3.13Å; D460-A463 WeakPolarHBondContact O-CB 3.48Å; D460-A463 PolarHBondContact O-N 3.16Å
461	P	61.7	Low	63.1	Low	113 Å²	113	119.1 Å²	119.1	73%	0.734	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.9	-9.1	179.8	29.1	-35.3	0	0	0	113.1
462	I	58.8	Low	62.4	Low	120 Å²	120	122.4 Å²	122.4	62%	0.615	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.9	-17.1	-179.7	-58	173.6	0	0	0	111.5	D460 S464 Q465	D460-I462 PolarHBondContact O-N 3.45Å; D460-I462 VanDerWaalsContact O-N 3.13Å; I462-S464 PolarHBondContact O-N 3Å; I462-Q465 VanDerWaalsContact O-CB 3.31Å; I462-Q465 WeakPolarHBondContact O-CB 3.23Å; I462-Q465 PolarHBondContact O-N 2.84Å
463	A	53.4	Low	61.6	Low	69 Å²	69	123 Å²	123	57%	0.57	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.5	-10.3	-174.4	0	0	0	0	0	115.3	D460	D460-A463 WeakPolarHBondContact O-CB 3.48Å; D460-A463 PolarHBondContact O-N 3.16Å
464	S	54.2	Low	61	Low	105 Å²	105	125.7 Å²	125.7	73%	0.734	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.9	-2.2	172.9	56.8	0	0	0	0	114	I462 I466	I462-S464 PolarHBondContact O-N 3Å; S464-I466 PolarHBondContact O-N 3.2Å; S464-I466 VanDerWaalsContact O-N 3.12Å
465	Q	56.7	Low	60.3	Low	148 Å²	148	126.8 Å²	126.8	69%	0.692	64%	0.635	S	S	*	*	S	Bend	trans	-74.2	106	-178.9	-167.8	166.5	64.6	0	0	110.5	I462 F467	I462-Q465 VanDerWaalsContact O-CB 3.31Å; I462-Q465 WeakPolarHBondContact O-CB 3.23Å; I462-Q465 PolarHBondContact O-N 2.84Å; Q465-F467 PolarHBondContact O-N 2.92Å
466	I	59.6	Low	59.7	Low	140 Å²	140	131.3 Å²	131.3	72%	0.718	66%	0.658	S	S	*	*			trans	-45	131.9	-179.5	-61.5	170.5	0	0	0	110.6	S464 I468	S464-I466 PolarHBondContact O-N 3.2Å; S464-I466 VanDerWaalsContact O-N 3.12Å; I466-I468 VanDerWaalsContact C-N 3.25Å; I466-I468 PolarHBondContact O-N 2.9Å
467	F	58.5	Low	59.2	Low	174 Å²	174	129.3 Å²	129.3	76%	0.763	66%	0.664	S	S	*	*			trans	-70	80.6	177.6	-176	-97.5	0	0	0	110.7	Q465 P469	Q465-F467 PolarHBondContact O-N 2.92Å; F467-P469 VanDerWaalsContact O-CD 3.3Å; F467-P469 WeakPolarHBondContact O-CD 3.31Å
468	I	59.3	Low	58.6	Low	80 Å²	80	131.2 Å²	131.2	41%	0.41	67%	0.665	S	S	.	*			trans	-73.6	117.4	168.1	-53.8	174.2	0	0	0	107.3	I466 Q472 R473	I466-I468 VanDerWaalsContact C-N 3.25Å; I466-I468 PolarHBondContact O-N 2.9Å; I468-Q472 HydrophobicContact CG2-CB 4Å; I468-Q472 WeakPolarHBondContact CG2-O 3.07Å; I468-R473 HydrophobicContact CB-CG 3.93Å; I468-R473 HydrophobicContact CG2-CB 4.41Å; I468-R473 HydrophobicContact CG2-CG 3.57Å; I468-R473 PolarHBondContact O-NE 2.88Å
469	P	57.1	Low	58.3	Low	42 Å²	42	132.8 Å²	132.8	27%	0.273	67%	0.673	S	S	.	*			trans	-54.3	150.1	177.7	-26.9	35.9	0	0	0	112	F467 T471 Q472 R473	F467-P469 VanDerWaalsContact O-CD 3.3Å; F467-P469 WeakPolarHBondContact O-CD 3.31Å; P469-T471 PolarHBondContact O-N 2.98Å; P469-Q472 PolarHBondContact O-N 2.94Å; P469-R473 PolarHBondContact O-N 3.31Å
470	R	54.1	Low	57.8	Low	241 Å²	241	131.5 Å²	131.5	91%	0.909	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.9	-17.4	-176	-149	176.3	-166.9	161.1	3	113.8
471	T	62	Low	58	Low	134 Å²	134	130.9 Å²	130.9	82%	0.822	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94	-10.9	176.9	49.4	0	0	0	0	114.8	P469	P469-T471 PolarHBondContact O-N 2.98Å
472	Q	57.6	Low	58.7	Low	139 Å²	139	131.6 Å²	131.6	65%	0.65	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.4	3.8	-179.3	-73.4	-176.9	-37.6	0	0	113	I468 P469 E474	I468-Q472 HydrophobicContact CG2-CB 4Å; I468-Q472 WeakPolarHBondContact CG2-O 3.07Å; P469-Q472 PolarHBondContact O-N 2.94Å; Q472-E474 PolarHBondContact O-N 3.44Å
473	R	58.3	Low	59.7	Low	136 Å²	136	131.6 Å²	131.6	51%	0.513	67%	0.667	S	S	.	*	S	Bend	trans	-78.2	111.7	168.8	-67.3	179.1	-175.9	-146.2	-5.4	108.1	I468 P469 V475	I468-R473 HydrophobicContact CB-CG 3.93Å; I468-R473 HydrophobicContact CG2-CB 4.41Å; I468-R473 HydrophobicContact CG2-CG 3.57Å; I468-R473 PolarHBondContact O-NE 2.88Å; P469-R473 PolarHBondContact O-N 3.31Å; R473-V475 PolarHBondContact O-N 3.29Å
474	E	60	Low	61.1	Low	172 Å²	172	135.8 Å²	135.8	80%	0.804	68%	0.675	S	S	*	*			trans	-54.2	128.1	163.5	-68.8	-173.2	143.1	0	0	108.8	Q472 I476	Q472-E474 PolarHBondContact O-N 3.44Å; E474-I476 HydrophobicContact CB-CG1 4.44Å; E474-I476 PolarHBondContact O-N 3.48Å
475	V	59.8	Low	62.6	Low	138 Å²	138	135.8 Å²	135.8	84%	0.836	66%	0.662	S	S	*	*			trans	-78.8	75.9	175.8	-174.2	0	0	0	0	107.5	R473 A477	R473-V475 PolarHBondContact O-N 3.29Å; V475-A477 PolarHBondContact O-N 3.15Å
476	I	56.2	Low	63.9	Low	132 Å²	132	130.9 Å²	130.9	68%	0.677	64%	0.638	S	S	*	*			trans	-65.3	92.2	164.1	-57.3	177.3	0	0	0	106.1	E474 R478	E474-I476 HydrophobicContact CB-CG1 4.44Å; E474-I476 PolarHBondContact O-N 3.48Å; I476-R478 PolarHBondContact O-N 3.27Å
477	A	56.6	Low	65.3	Low	89 Å²	89	128.5 Å²	128.5	74%	0.736	63%	0.63	S	S	*	*			trans	-63.5	90.8	169.4	0	0	0	0	0	107.7	V475 D479	V475-A477 PolarHBondContact O-N 3.15Å; A477-D479 PolarHBondContact O-N 3.41Å
478	R	55.9	Low	66.7	Low	202 Å²	202	124.4 Å²	124.4	76%	0.762	61%	0.613	S	S	*	*			trans	-65.5	119.1	165.3	-67.7	-172.6	-177.8	122.1	1	107	I476 M480	I476-R478 PolarHBondContact O-N 3.27Å; R478-M480 HydrophobicContact CB-CG 3.74Å; R478-M480 PolarHBondContact O-N 3.34Å
479	D	59.3	Low	68.2	Low	123 Å²	123	123.1 Å²	123.1	66%	0.658	61%	0.609	S	S	*	*			trans	-61.2	87.9	156.2	-94.2	-34.6	0	0	0	108.1	A477 M481 K486	A477-D479 PolarHBondContact O-N 3.41Å; D479-M481 PolarHBondContact O-N 3.06Å; D479-K486 WeakPolarHBondContact OD1-CE 3.41Å; D479-K486 IonicContact OD1-NZ 3.71Å; D479-K486 PolarHBondContact OD1-NZ 2.95Å; D479-K486 IonicContact OD2-NZ 2.72Å; D479-K486 PolarHBondContact OD2-NZ 3.09Å
480	M	55.4	Low	69.7	Low	163 Å²	163	125.8 Å²	125.8	80%	0.803	62%	0.62	S	S	*	*			trans	-93.9	35	171.6	-74.3	-165.6	59	0	0	110.6	R478	R478-M480 HydrophobicContact CB-CG 3.74Å; R478-M480 PolarHBondContact O-N 3.34Å
481	M	63.3	Low	71.5	Confident	89 Å²	89	120.2 Å²	120.2	44%	0.438	60%	0.604	S	S	.	*	S	Bend	trans	-144	107.1	-171.1	-170.8	172.7	-69.3	0	0	107	D479 F485 K486	D479-M481 PolarHBondContact O-N 3.06Å; M481-F485 HydrophobicContact CE-CD1 4.23Å; M481-F485 HydrophobicContact CE-CE1 3.94Å; M481-F485 HydrophobicContact CG-CB 4.28Å; M481-F485 HydrophobicContact CG-CD1 3.4Å; M481-F485 HydrophobicContact CG-CE1 4.08Å; M481-F485 HydrophobicContact CG-CG 4.2Å; M481-F485 HydrophobicContact SD-CD1 3.62Å; M481-F485 HydrophobicContact SD-CE1 3.87Å; M481-K486 HydrophobicContact CB-CG 4.46Å; M481-K486 HydrophobicContact CG-CG 3.96Å; M481-K486 WeakPolarHBondContact O-CE 3.35Å; M481-K486 HydrophobicContact SD-CG 4.14Å
482	D	75.9	Confident	73.1	Confident	127 Å²	127	120 Å²	120	68%	0.679	59%	0.592	S	S	*	*			trans	-56.6	142.3	-177.9	-53.3	-60.7	0	0	0	110.1	E484 F485 K486	D482-E484 PolarHBondContact O-N 3.44Å; D482-E484 VanDerWaalsContact O-N 3.14Å; D482-F485 WeakPolarHBondContact O-CA 3.13Å; D482-F485 WeakPolarHBondContact O-CB 3.16Å; D482-F485 PolarHBondContact O-N 3.49Å; D482-K486 PolarHBondContact O-N 2.88Å
483	E	80.2	Confident	74.9	Confident	121 Å²	121	118.8 Å²	118.8	57%	0.565	59%	0.589	S	S	*	*	H	α-helix	trans	-56.1	-34.7	-177.2	-69	-61.7	143.4	0	0	112.1	F485 K486 V487	E483-F485 VanDerWaalsContact C-N 3.28Å; E483-F485 PolarHBondContact O-N 2.86Å; E483-K486 WeakPolarHBondContact O-CB 3.45Å; E483-K486 PolarHBondContact O-N 2.82Å; E483-K486 WeakPolarHBondContact OE1-CE 3.43Å; E483-K486 IonicContact OE1-NZ 2.64Å; E483-K486 PolarHBondContact OE1-NZ 2.9Å; E483-K486 IonicContact OE2-NZ 2.69Å; E483-V487 WeakPolarHBondContact O-CG2 3.38Å; E483-V487 PolarHBondContact O-N 2.89Å
484	E	83.5	Confident	76.5	Confident	156 Å²	156	117.5 Å²	117.5	73%	0.729	59%	0.589	S	S	*	*	H	α-helix	trans	-58.6	-37.5	173.1	-59.4	-179.3	-177.5	0	0	112.6	D482 Q488	D482-E484 PolarHBondContact O-N 3.44Å; D482-E484 VanDerWaalsContact O-N 3.14Å; E484-Q488 WeakPolarHBondContact O-CG 3.19Å; E484-Q488 PolarHBondContact O-N 2.91Å; E484-Q488 VanDerWaalsContact O-N 3.15Å
485	F	85.5	Confident	78.1	Confident	105 Å²	105	114.5 Å²	114.5	46%	0.461	58%	0.575	S	S	.	*	H	α-helix	trans	-75.8	-38	175.8	-173.6	-83.2	0	0	0	111.3	M481 D482 E483 V487 Q488 V489	M481-F485 HydrophobicContact CE-CD1 4.23Å; M481-F485 HydrophobicContact CE-CE1 3.94Å; M481-F485 HydrophobicContact CG-CB 4.28Å; M481-F485 HydrophobicContact CG-CD1 3.4Å; M481-F485 HydrophobicContact CG-CE1 4.08Å; M481-F485 HydrophobicContact CG-CG 4.2Å; M481-F485 HydrophobicContact SD-CD1 3.62Å; M481-F485 HydrophobicContact SD-CE1 3.87Å; D482-F485 WeakPolarHBondContact O-CA 3.13Å; D482-F485 WeakPolarHBondContact O-CB 3.16Å; D482-F485 PolarHBondContact O-N 3.49Å; E483-F485 VanDerWaalsContact C-N 3.28Å; E483-F485 PolarHBondContact O-N 2.86Å; F485-V487 VanDerWaalsContact C-N 3.32Å; F485-V487 PolarHBondContact O-N 3.38Å; F485-Q488 PolarHBondContact O-N 3.17Å; F485-V489 HydrophobicContact CD1-CG2 3.68Å; F485-V489 HydrophobicContact CE1-CG2 3.35Å; F485-V489 HydrophobicContact CZ-CG2 3.95Å; F485-V489 WeakPolarHBondContact O-CG2 3.25Å; F485-V489 PolarHBondContact O-N 3.11Å
486	K	84.4	Confident	79.6	Confident	45 Å²	45	112 Å²	112	20%	0.196	56%	0.56	C	S	.	*	H	α-helix	trans	-56.9	-46.4	173.2	-64.7	-177	-175.7	173	0	110.8	D479 M481 D482 E483 V489 I490	D479-K486 WeakPolarHBondContact OD1-CE 3.41Å; D479-K486 IonicContact OD1-NZ 3.71Å; D479-K486 PolarHBondContact OD1-NZ 2.95Å; D479-K486 IonicContact OD2-NZ 2.72Å; D479-K486 PolarHBondContact OD2-NZ 3.09Å; M481-K486 HydrophobicContact CB-CG 4.46Å; M481-K486 HydrophobicContact CG-CG 3.96Å; M481-K486 WeakPolarHBondContact O-CE 3.35Å; M481-K486 HydrophobicContact SD-CG 4.14Å; D482-K486 PolarHBondContact O-N 2.88Å; E483-K486 WeakPolarHBondContact O-CB 3.45Å; E483-K486 PolarHBondContact O-N 2.82Å; E483-K486 WeakPolarHBondContact OE1-CE 3.43Å; E483-K486 IonicContact OE1-NZ 2.64Å; E483-K486 PolarHBondContact OE1-NZ 2.9Å; E483-K486 IonicContact OE2-NZ 2.69Å; K486-V489 PolarHBondContact O-N 3.2Å; K486-I490 VanDerWaalsContact O-CG1 3.32Å; K486-I490 WeakPolarHBondContact O-CG1 3.45Å; K486-I490 PolarHBondContact O-N 3.21Å
487	V	88.1	Confident	81.4	Confident	90 Å²	90	113.7 Å²	113.7	55%	0.545	56%	0.558	S	S	.	*	H	α-helix	trans	-60.9	-48	175.9	173.9	0	0	0	0	111.6	E483 F485 V489 I490 E491	E483-V487 WeakPolarHBondContact O-CG2 3.38Å; E483-V487 PolarHBondContact O-N 2.89Å; F485-V487 VanDerWaalsContact C-N 3.32Å; F485-V487 PolarHBondContact O-N 3.38Å; V487-V489 VanDerWaalsContact C-N 3.29Å; V487-V489 PolarHBondContact O-N 2.93Å; V487-I490 PolarHBondContact O-N 3.35Å; V487-E491 PolarHBondContact O-N 2.89Å
488	Q	87.8	Confident	83	Confident	89 Å²	89	115.3 Å²	115.3	42%	0.416	55%	0.545	S	S	.	.	H	α-helix	trans	-62	-33.1	177.4	-75.3	178.1	49.3	0	0	113.7	E484 F485 K492	E484-Q488 WeakPolarHBondContact O-CG 3.19Å; E484-Q488 PolarHBondContact O-N 2.91Å; E484-Q488 VanDerWaalsContact O-N 3.15Å; F485-Q488 PolarHBondContact O-N 3.17Å; Q488-K492 WeakPolarHBondContact O-CB 3.38Å; Q488-K492 WeakPolarHBondContact O-CD 3.44Å; Q488-K492 VanDerWaalsContact O-CG 3.26Å; Q488-K492 WeakPolarHBondContact O-CG 3.42Å; Q488-K492 PolarHBondContact O-N 3.21Å
489	V	91.2	Very high	84.7	Confident	53 Å²	53	109.7 Å²	109.7	32%	0.321	53%	0.527	S	S	.	.	H	α-helix	trans	-70.4	-42.8	174.8	167.8	0	0	0	0	110.7	F485 K486 V487 K492 L493	F485-V489 HydrophobicContact CD1-CG2 3.68Å; F485-V489 HydrophobicContact CE1-CG2 3.35Å; F485-V489 HydrophobicContact CZ-CG2 3.95Å; F485-V489 WeakPolarHBondContact O-CG2 3.25Å; F485-V489 PolarHBondContact O-N 3.11Å; K486-V489 PolarHBondContact O-N 3.2Å; V487-V489 VanDerWaalsContact C-N 3.29Å; V487-V489 PolarHBondContact O-N 2.93Å; V489-K492 PolarHBondContact O-N 3.41Å; V489-L493 HydrophobicContact CG1-CD1 3.72Å; V489-L493 HydrophobicContact CG1-CG 4.28Å; V489-L493 WeakPolarHBondContact O-CB 3.49Å; V489-L493 VanDerWaalsContact O-CG 3.25Å; V489-L493 WeakPolarHBondContact O-CG 3.36Å; V489-L493 PolarHBondContact O-N 2.84Å
490	I	89.1	Confident	86.3	Confident	98 Å²	98	111.2 Å²	111.2	50%	0.503	52%	0.524	S	S	.	.	H	α-helix	trans	-60.8	-50	176.2	-67.7	162.8	0	0	0	110.4	K486 V487 K492 L493 E494	K486-I490 VanDerWaalsContact O-CG1 3.32Å; K486-I490 WeakPolarHBondContact O-CG1 3.45Å; K486-I490 PolarHBondContact O-N 3.21Å; V487-I490 PolarHBondContact O-N 3.35Å; I490-K492 VanDerWaalsContact C-N 3.32Å; I490-K492 PolarHBondContact O-N 3.5Å; I490-L493 PolarHBondContact O-N 3.17Å; I490-E494 HydrophobicContact CG2-CG 4.48Å; I490-E494 WeakPolarHBondContact O-CG 3.45Å; I490-E494 PolarHBondContact O-N 3.13Å
491	E	91.9	Very high	88	Confident	124 Å²	124	106.3 Å²	106.3	58%	0.579	50%	0.499	S	S	*	.	H	α-helix	trans	-56.7	-44	178.6	-176.4	-175.1	-164.4	0	0	112.3	V487 E494 H495	V487-E491 PolarHBondContact O-N 2.89Å; E491-E494 PolarHBondContact O-N 3.47Å; E491-H495 PolarHBondContact O-N 3.27Å
492	K	94.8	Very high	89.3	Confident	129 Å²	129	106.1 Å²	106.1	56%	0.561	50%	0.503	S	S	*	.	H	α-helix	trans	-68.5	-39.5	177.9	-73.6	169.8	-176	166.9	0	112.4	Q488 V489 I490 H495 V496	Q488-K492 WeakPolarHBondContact O-CB 3.38Å; Q488-K492 WeakPolarHBondContact O-CD 3.44Å; Q488-K492 VanDerWaalsContact O-CG 3.26Å; Q488-K492 WeakPolarHBondContact O-CG 3.42Å; Q488-K492 PolarHBondContact O-N 3.21Å; V489-K492 PolarHBondContact O-N 3.41Å; I490-K492 VanDerWaalsContact C-N 3.32Å; I490-K492 PolarHBondContact O-N 3.5Å; K492-H495 PolarHBondContact O-N 3.23Å; K492-V496 WeakPolarHBondContact O-CG2 3.42Å; K492-V496 PolarHBondContact O-N 3.01Å
493	L	94.9	Very high	89.9	Confident	113 Å²	113	107 Å²	107	59%	0.592	50%	0.498	S	S	*	.	H	α-helix	trans	-67.1	-36.6	175	-72.4	172.7	0	0	0	111.9	V489 I490 H495 R497	V489-L493 HydrophobicContact CG1-CD1 3.72Å; V489-L493 HydrophobicContact CG1-CG 4.28Å; V489-L493 WeakPolarHBondContact O-CB 3.49Å; V489-L493 VanDerWaalsContact O-CG 3.25Å; V489-L493 WeakPolarHBondContact O-CG 3.36Å; V489-L493 PolarHBondContact O-N 2.84Å; I490-L493 PolarHBondContact O-N 3.17Å; L493-H495 VanDerWaalsContact C-N 3.34Å; L493-R497 WeakPolarHBondContact O-CB 3.06Å; L493-R497 PolarHBondContact O-N 2.96Å
494	E	92.9	Very high	90.4	Very high	110 Å²	110	105.6 Å²	105.6	51%	0.514	49%	0.491	S	S	.	.	H	α-helix	trans	-66.7	-34.8	171.4	-74.3	-169.9	173	0	0	112.5	I490 E491 R498	I490-E494 HydrophobicContact CG2-CG 4.48Å; I490-E494 WeakPolarHBondContact O-CG 3.45Å; I490-E494 PolarHBondContact O-N 3.13Å; E491-E494 PolarHBondContact O-N 3.47Å; E494-R498 WeakPolarHBondContact O-CB 3.42Å; E494-R498 WeakPolarHBondContact O-CG 3.36Å; E494-R498 PolarHBondContact O-N 3.31Å; E494-R498 PolarHBondContact O-NE 2.95Å
495	H	93	Very high	90.7	Very high	108 Å²	108	103.8 Å²	103.8	50%	0.5	48%	0.481	S	S	.	.	H	α-helix	trans	-64.5	-53.9	173.3	-161.5	117.3	0	0	0	111.3	E491 K492 L493 R497 R498 E499	E491-H495 PolarHBondContact O-N 3.27Å; K492-H495 PolarHBondContact O-N 3.23Å; L493-H495 VanDerWaalsContact C-N 3.34Å; H495-R497 PolarHBondContact O-N 3.4Å; H495-R498 PolarHBondContact O-N 3.03Å; H495-R498 VanDerWaalsContact O-N 3.12Å; H495-E499 WeakPolarHBondContact O-CB 3.48Å; H495-E499 PolarHBondContact O-N 3.28Å
496	V	92.9	Very high	90.9	Very high	87 Å²	87	104 Å²	104	53%	0.527	49%	0.486	S	S	.	.	H	α-helix	trans	-59.4	-35.9	177.4	172	0	0	0	0	111.3	K492 R500	K492-V496 WeakPolarHBondContact O-CG2 3.42Å; K492-V496 PolarHBondContact O-N 3.01Å; V496-R500 VanDerWaalsContact O-CB 3.24Å; V496-R500 WeakPolarHBondContact O-CB 3.28Å; V496-R500 PolarHBondContact O-N 3.13Å
497	R	92.4	Very high	90.9	Very high	167 Å²	167	106.7 Å²	106.7	63%	0.63	50%	0.503	S	S	*	.	H	α-helix	trans	-64.1	-50.2	173	179.6	-178.3	166.4	172.2	-0.7	111.9	L493 H495 E499 R500 E501	L493-R497 WeakPolarHBondContact O-CB 3.06Å; L493-R497 PolarHBondContact O-N 2.96Å; H495-R497 PolarHBondContact O-N 3.4Å; R497-E499 VanDerWaalsContact C-N 3.33Å; R497-E499 PolarHBondContact O-N 3Å; R497-R500 PolarHBondContact O-N 3.47Å; R497-E501 HydrophobicContact CG-CG 4.49Å; R497-E501 IonicContact CZ-OE1 3.2Å; R497-E501 VanDerWaalsContact CZ-OE1 3.29Å; R497-E501 IonicContact NE-OE1 2.71Å; R497-E501 PolarHBondContact NE-OE1 3.26Å; R497-E501 IonicContact NH2-OE1 3.57Å; R497-E501 PolarHBondContact NH2-OE1 2.95Å; R497-E501 WeakPolarHBondContact O-CB 3.4Å; R497-E501 WeakPolarHBondContact O-CG 3.38Å; R497-E501 PolarHBondContact O-N 3.12Å
498	R	91.6	Very high	90.9	Very high	122 Å²	122	106.7 Å²	106.7	46%	0.46	50%	0.497	S	S	.	.	H	α-helix	trans	-61.2	-42.9	178.8	-80.8	-178.2	-81.9	97	-3.8	111.8	E494 H495 E501 T502	E494-R498 WeakPolarHBondContact O-CB 3.42Å; E494-R498 WeakPolarHBondContact O-CG 3.36Å; E494-R498 PolarHBondContact O-N 3.31Å; E494-R498 PolarHBondContact O-NE 2.95Å; H495-R498 PolarHBondContact O-N 3.03Å; H495-R498 VanDerWaalsContact O-N 3.12Å; R498-E501 PolarHBondContact O-N 3.09Å; R498-T502 PolarHBondContact O-N 3.43Å; R498-T502 PolarHBondContact O-OG1 3.18Å
499	E	91.4	Very high	90.7	Very high	84 Å²	84	105.5 Å²	105.5	39%	0.393	50%	0.498	S	S	.	.	H	α-helix	trans	-59.8	-50.6	175.1	178.8	175.1	-158.6	0	0	111.1	H495 R497 E501 T502 Y503	H495-E499 WeakPolarHBondContact O-CB 3.48Å; H495-E499 PolarHBondContact O-N 3.28Å; R497-E499 VanDerWaalsContact C-N 3.33Å; R497-E499 PolarHBondContact O-N 3Å; E499-E501 PolarHBondContact O-N 3.47Å; E499-T502 WeakPolarHBondContact CA-OG1 3.37Å; E499-T502 PolarHBondContact O-N 3.27Å; E499-T502 PolarHBondContact O-OG1 3.41Å; E499-Y503 HydrophobicContact CG-CD2 3.83Å; E499-Y503 HydrophobicContact CG-CE2 3.56Å; E499-Y503 VanDerWaalsContact O-CD2 3.3Å; E499-Y503 WeakPolarHBondContact O-CD2 3.31Å; E499-Y503 PolarHBondContact O-N 3.18Å
500	R	91.7	Very high	90.2	Very high	156 Å²	156	107.9 Å²	107.9	59%	0.589	51%	0.509	S	S	*	.	H	α-helix	trans	-58.3	-44.8	174.4	179	176	168.7	171.3	-1	112.1	V496 R497 T502 Y503 E504	V496-R500 VanDerWaalsContact O-CB 3.24Å; V496-R500 WeakPolarHBondContact O-CB 3.28Å; V496-R500 PolarHBondContact O-N 3.13Å; R497-R500 PolarHBondContact O-N 3.47Å; R500-T502 PolarHBondContact O-N 2.69Å; R500-Y503 PolarHBondContact O-N 3.33Å; R500-E504 HydrophobicContact CG-CG 4.26Å; R500-E504 IonicContact CZ-OE1 3.04Å; R500-E504 IonicContact NE-OE1 2.69Å; R500-E504 PolarHBondContact NE-OE1 3.19Å; R500-E504 IonicContact NE-OE2 3.64Å; R500-E504 IonicContact NH2-OE1 2.8Å; R500-E504 PolarHBondContact NH2-OE1 3.31Å; R500-E504 WeakPolarHBondContact O-CB 3.47Å; R500-E504 WeakPolarHBondContact O-CG 3.45Å; R500-E504 PolarHBondContact O-N 3.01Å
501	E	92.3	Very high	89.9	Confident	59 Å²	59	107.7 Å²	107.7	28%	0.276	51%	0.505	S	S	.	.	H	α-helix	trans	-62.3	-28.1	175.9	-76.8	-175.8	-159	0	0	112.4	R497 R498 E499 K505	R497-E501 HydrophobicContact CG-CG 4.49Å; R497-E501 IonicContact CZ-OE1 3.2Å; R497-E501 VanDerWaalsContact CZ-OE1 3.29Å; R497-E501 IonicContact NE-OE1 2.71Å; R497-E501 PolarHBondContact NE-OE1 3.26Å; R497-E501 IonicContact NH2-OE1 3.57Å; R497-E501 PolarHBondContact NH2-OE1 2.95Å; R497-E501 WeakPolarHBondContact O-CB 3.4Å; R497-E501 WeakPolarHBondContact O-CG 3.38Å; R497-E501 PolarHBondContact O-N 3.12Å; R498-E501 PolarHBondContact O-N 3.09Å; E499-E501 PolarHBondContact O-N 3.47Å; E501-K505 WeakPolarHBondContact O-CB 3.38Å; E501-K505 WeakPolarHBondContact O-CD 3.28Å; E501-K505 WeakPolarHBondContact O-CG 3.49Å; E501-K505 PolarHBondContact O-N 2.9Å; E501-K505 IonicContact OE2-NZ 2.69Å
502	T	89.8	Confident	89.2	Confident	85 Å²	85	108.7 Å²	108.7	52%	0.521	50%	0.504	S	S	.	.	H	α-helix	trans	-76.8	-39.6	171.5	48.7	0	0	0	0	113.2	R498 E499 R500 K505 L506	R498-T502 PolarHBondContact O-N 3.43Å; R498-T502 PolarHBondContact O-OG1 3.18Å; E499-T502 WeakPolarHBondContact CA-OG1 3.37Å; E499-T502 PolarHBondContact O-N 3.27Å; E499-T502 PolarHBondContact O-OG1 3.41Å; R500-T502 PolarHBondContact O-N 2.69Å; T502-K505 PolarHBondContact O-N 2.91Å; T502-L506 WeakPolarHBondContact O-CB 3.45Å; T502-L506 PolarHBondContact O-N 3.33Å
503	Y	87.9	Confident	88	Confident	147 Å²	147	108 Å²	108	58%	0.576	51%	0.506	S	S	*	.	H	α-helix	trans	-64.7	-40.7	172.9	-79.3	-69.3	0	0	0	112.1	E499 R500 L506 N507	E499-Y503 HydrophobicContact CG-CD2 3.83Å; E499-Y503 HydrophobicContact CG-CE2 3.56Å; E499-Y503 VanDerWaalsContact O-CD2 3.3Å; E499-Y503 WeakPolarHBondContact O-CD2 3.31Å; E499-Y503 PolarHBondContact O-N 3.18Å; R500-Y503 PolarHBondContact O-N 3.33Å; Y503-L506 PolarHBondContact O-N 2.81Å; Y503-N507 WeakPolarHBondContact O-CB 3.46Å; Y503-N507 PolarHBondContact O-N 3.25Å
504	E	90.8	Very high	86.8	Confident	90 Å²	90	106.6 Å²	106.6	42%	0.421	51%	0.505	S	S	.	.	H	α-helix	trans	-64.9	-41.5	176.6	-74.4	176.8	163.8	0	0	111.4	R500 N507 E508	R500-E504 HydrophobicContact CG-CG 4.26Å; R500-E504 IonicContact CZ-OE1 3.04Å; R500-E504 IonicContact NE-OE1 2.69Å; R500-E504 PolarHBondContact NE-OE1 3.19Å; R500-E504 IonicContact NE-OE2 3.64Å; R500-E504 IonicContact NH2-OE1 2.8Å; R500-E504 PolarHBondContact NH2-OE1 3.31Å; R500-E504 WeakPolarHBondContact O-CB 3.47Å; R500-E504 WeakPolarHBondContact O-CG 3.45Å; R500-E504 PolarHBondContact O-N 3.01Å; E504-N507 PolarHBondContact O-N 2.84Å; E504-E508 VanDerWaalsContact O-CB 3.24Å; E504-E508 WeakPolarHBondContact O-CB 3.33Å; E504-E508 PolarHBondContact O-N 2.94Å
505	K	90.4	Very high	85.4	Confident	118 Å²	118	106.3 Å²	106.3	51%	0.513	50%	0.504	S	S	.	.	H	α-helix	trans	-64.3	-38.5	173.1	-73.4	162.8	-165.7	148.8	0	112.7	E501 T502 S509	E501-K505 WeakPolarHBondContact O-CB 3.38Å; E501-K505 WeakPolarHBondContact O-CD 3.28Å; E501-K505 WeakPolarHBondContact O-CG 3.49Å; E501-K505 PolarHBondContact O-N 2.9Å; E501-K505 IonicContact OE2-NZ 2.69Å; T502-K505 PolarHBondContact O-N 2.91Å; K505-S509 WeakPolarHBondContact O-CB 3.26Å; K505-S509 PolarHBondContact O-N 2.88Å
506	L	89.2	Confident	83.6	Confident	111 Å²	111	106.9 Å²	106.9	58%	0.581	52%	0.517	S	S	*	.	H	α-helix	trans	-65.8	-46.4	175.1	-174.5	154	0	0	0	110.8	T502 Y503 S509 L510	T502-L506 WeakPolarHBondContact O-CB 3.45Å; T502-L506 PolarHBondContact O-N 3.33Å; Y503-L506 PolarHBondContact O-N 2.81Å; L506-S509 PolarHBondContact O-N 3.04Å; L506-L510 WeakPolarHBondContact O-CB 3.4Å; L506-L510 PolarHBondContact O-N 3.19Å
507	N	85.2	Confident	81.6	Confident	100 Å²	100	109.1 Å²	109.1	54%	0.535	52%	0.522	S	S	.	.	H	α-helix	trans	-64.6	-41.7	178.3	-173.6	80.7	0	0	0	112	Y503 E504 S509 L510 Q511	Y503-N507 WeakPolarHBondContact O-CB 3.46Å; Y503-N507 PolarHBondContact O-N 3.25Å; E504-N507 PolarHBondContact O-N 2.84Å; N507-S509 VanDerWaalsContact C-N 3.34Å; N507-L510 PolarHBondContact O-N 2.83Å; N507-Q511 WeakPolarHBondContact O-CB 3.44Å; N507-Q511 PolarHBondContact O-N 3.04Å
508	E	87.4	Confident	79.8	Confident	91 Å²	91	109.4 Å²	109.4	43%	0.425	54%	0.536	S	S	.	.	H	α-helix	trans	-63.6	-38.9	173.8	-164.9	-156.5	-156.9	0	0	111.5	E504 L510 R512	E504-E508 VanDerWaalsContact O-CB 3.24Å; E504-E508 WeakPolarHBondContact O-CB 3.33Å; E504-E508 PolarHBondContact O-N 2.94Å; E508-L510 VanDerWaalsContact C-N 3.33Å; E508-R512 VanDerWaalsContact CD-CZ 3.41Å; E508-R512 WeakPolarHBondContact O-CG 3.38Å; E508-R512 PolarHBondContact O-N 3.02Å; E508-R512 IonicContact OE1-CZ 3.82Å; E508-R512 IonicContact OE1-NH1 3.14Å; E508-R512 IonicContact OE1-NH2 2.7Å; E508-R512 PolarHBondContact OE1-NH2 3.15Å; E508-R512 IonicContact OE2-CZ 3.89Å; E508-R512 IonicContact OE2-NH1 2.67Å; E508-R512 PolarHBondContact OE2-NH1 2.8Å; E508-R512 IonicContact OE2-NH2 3.38Å; E508-R512 PolarHBondContact OE2-NH2 2.69Å
509	S	84.2	Confident	78.1	Confident	63 Å²	63	107.5 Å²	107.5	44%	0.441	54%	0.535	S	S	.	.	H	α-helix	trans	-67.1	-32	172.1	-172.4	0	0	0	0	113	K505 L506 N507 L513	K505-S509 WeakPolarHBondContact O-CB 3.26Å; K505-S509 PolarHBondContact O-N 2.88Å; L506-S509 PolarHBondContact O-N 3.04Å; N507-S509 VanDerWaalsContact C-N 3.34Å; S509-L513 WeakPolarHBondContact O-CG 3.17Å; S509-L513 PolarHBondContact O-N 3.44Å
510	L	81.3	Confident	76.6	Confident	104 Å²	104	108.5 Å²	108.5	55%	0.545	55%	0.551	S	S	.	*	H	α-helix	trans	-77.2	-37	178.2	-169.3	142.1	0	0	0	110.9	L506 N507 E508 L513 S514	L506-L510 WeakPolarHBondContact O-CB 3.4Å; L506-L510 PolarHBondContact O-N 3.19Å; N507-L510 PolarHBondContact O-N 2.83Å; E508-L510 VanDerWaalsContact C-N 3.33Å; L510-L513 WeakPolarHBondContact O-CB 3.32Å; L510-L513 PolarHBondContact O-N 3.35Å; L510-L513 VanDerWaalsContact O-N 3.1Å; L510-S514 PolarHBondContact O-N 2.7Å
511	Q	81.1	Confident	75.2	Confident	93 Å²	93	106.5 Å²	106.5	44%	0.435	55%	0.552	S	S	.	*	H	α-helix	trans	-60.9	-45.6	171.3	-176.1	174.9	-22.1	0	0	111.3	N507 L513 S514 E515	N507-Q511 WeakPolarHBondContact O-CB 3.44Å; N507-Q511 PolarHBondContact O-N 3.04Å; Q511-L513 PolarHBondContact O-N 3.46Å; Q511-L513 VanDerWaalsContact O-N 3.13Å; Q511-S514 WeakPolarHBondContact CA-OG 3.42Å; Q511-S514 WeakPolarHBondContact O-CA 3.49Å; Q511-S514 PolarHBondContact O-N 3.24Å; Q511-S514 PolarHBondContact O-OG 3.31Å; Q511-E515 HydrophobicContact CG-CG 4.41Å; Q511-E515 WeakPolarHBondContact CG-OE1 3.41Å; Q511-E515 PolarHBondContact NE2-OE1 3.48Å; Q511-E515 PolarHBondContact O-N 2.96Å
512	R	79.1	Confident	73.9	Confident	145 Å²	145	106.1 Å²	106.1	55%	0.547	56%	0.556	S	S	.	*	H	α-helix	trans	-60.3	-18	173.2	-74.3	-176.3	-174.7	105.8	5.8	114.7	E508	E508-R512 VanDerWaalsContact CD-CZ 3.41Å; E508-R512 WeakPolarHBondContact O-CG 3.38Å; E508-R512 PolarHBondContact O-N 3.02Å; E508-R512 IonicContact OE1-CZ 3.82Å; E508-R512 IonicContact OE1-NH1 3.14Å; E508-R512 IonicContact OE1-NH2 2.7Å; E508-R512 PolarHBondContact OE1-NH2 3.15Å; E508-R512 IonicContact OE2-CZ 3.89Å; E508-R512 IonicContact OE2-NH1 2.67Å; E508-R512 PolarHBondContact OE2-NH1 2.8Å; E508-R512 IonicContact OE2-NH2 3.38Å; E508-R512 PolarHBondContact OE2-NH2 2.69Å
513	L	69.2	Low	72.5	Confident	114 Å²	114	109.1 Å²	109.1	60%	0.597	56%	0.564	S	S	*	*	H	α-helix	trans	-92.5	-13.2	172.6	-68.9	169.5	0	0	0	112.9	S509 L510 Q511	S509-L513 WeakPolarHBondContact O-CG 3.17Å; S509-L513 PolarHBondContact O-N 3.44Å; L510-L513 WeakPolarHBondContact O-CB 3.32Å; L510-L513 PolarHBondContact O-N 3.35Å; L510-L513 VanDerWaalsContact O-N 3.1Å; Q511-L513 PolarHBondContact O-N 3.46Å; Q511-L513 VanDerWaalsContact O-N 3.13Å
514	S	68	Low	71.5	Confident	84 Å²	84	111.5 Å²	111.5	59%	0.587	57%	0.572	S	S	*	*	H	α-helix	trans	-98.4	-23.5	177.6	72.1	0	0	0	0	113.8	L510 Q511	L510-S514 PolarHBondContact O-N 2.7Å; Q511-S514 WeakPolarHBondContact CA-OG 3.42Å; Q511-S514 WeakPolarHBondContact O-CA 3.49Å; Q511-S514 PolarHBondContact O-N 3.24Å; Q511-S514 PolarHBondContact O-OG 3.31Å
515	E	64.8	Low	70.4	Confident	105 Å²	105	109.4 Å²	109.4	49%	0.491	57%	0.57	S	S	.	*	S	Bend	trans	-75.5	126	174.6	-73.2	180	-162.4	0	0	110.3	Q511 E517	Q511-E515 HydrophobicContact CG-CG 4.41Å; Q511-E515 WeakPolarHBondContact CG-OE1 3.41Å; Q511-E515 PolarHBondContact NE2-OE1 3.48Å; Q511-E515 PolarHBondContact O-N 2.96Å; E515-E517 VanDerWaalsContact C-N 3.29Å; E515-E517 PolarHBondContact O-N 3.5Å
516	P	54.1	Low	69.3	Low	119 Å²	119	105 Å²	105	77%	0.773	56%	0.556	S	S	*	*			trans	-78.1	76.2	-176.9	32	-35.7	0	0	0	111.2	N518	P516-N518 PolarHBondContact O-N 2.94Å
517	E	51.9	Low	68.4	Low	135 Å²	135	104.1 Å²	104.1	63%	0.631	56%	0.555	S	S	*	*			trans	-59.2	123.6	167.8	-74.7	-158.1	128.7	0	0	110.1	E515 N519	E515-E517 VanDerWaalsContact C-N 3.29Å; E515-E517 PolarHBondContact O-N 3.5Å; E517-N519 PolarHBondContact O-N 2.99Å
518	N	54.9	Low	67.8	Low	173 Å²	173	104.3 Å²	104.3	93%	0.925	55%	0.552	S	S	*	*	S	Bend	trans	-70	29.1	-179.6	-78.9	-55.9	0	0	0	114.3	P516	P516-N518 PolarHBondContact O-N 2.94Å
519	N	55.6	Low	66.9	Low	82 Å²	82	107.2 Å²	107.2	44%	0.439	56%	0.564	S	S	.	*			trans	-110	94.9	175.8	-176.8	3.1	0	0	0	109.4	E517 N521 S522	E517-N519 PolarHBondContact O-N 2.99Å; N519-N521 PolarHBondContact O-N 3.43Å; N519-N521 WeakPolarHBondContact OD1-CB 3.45Å; N519-N521 PolarHBondContact OD1-N 2.98Å; N519-N521 PolarHBondContact OD1-ND2 3.15Å; N519-S522 WeakPolarHBondContact O-CB 3.26Å; N519-S522 PolarHBondContact O-N 3.31Å
520	S	59.3	Low	66.2	Low	104 Å²	104	111.7 Å²	111.7	73%	0.727	58%	0.576	S	S	*	*	H	α-helix	trans	-56.1	-14.9	-177	-42.8	0	0	0	0	114.6
521	N	61.7	Low	65.5	Low	114 Å²	114	108.7 Å²	108.7	61%	0.61	56%	0.563	S	S	*	*	H	α-helix	trans	-75.3	-27.4	174.5	-55	-67.3	0	0	0	113	N519 R524 A525	N519-N521 PolarHBondContact O-N 3.43Å; N519-N521 WeakPolarHBondContact OD1-CB 3.45Å; N519-N521 PolarHBondContact OD1-N 2.98Å; N519-N521 PolarHBondContact OD1-ND2 3.15Å; N521-R524 PolarHBondContact O-N 3.01Å; N521-A525 WeakPolarHBondContact O-CB 3.47Å; N521-A525 PolarHBondContact O-N 3.17Å
522	S	65.1	Low	64.8	Low	51 Å²	51	110.6 Å²	110.6	36%	0.357	57%	0.57	S	S	.	*	H	α-helix	trans	-65.1	-52.9	-179	-171.6	0	0	0	0	111.1	N519 R524 A525 A526	N519-S522 WeakPolarHBondContact O-CB 3.26Å; N519-S522 PolarHBondContact O-N 3.31Å; S522-R524 VanDerWaalsContact C-N 3.29Å; S522-R524 PolarHBondContact O-N 3.22Å; S522-A525 PolarHBondContact O-N 3.45Å; S522-A525 VanDerWaalsContact O-N 3.17Å; S522-A526 WeakPolarHBondContact O-CB 3.39Å; S522-A526 PolarHBondContact O-N 2.96Å
523	H	61.6	Low	64.2	Low	148 Å²	148	108.2 Å²	108.2	69%	0.685	57%	0.571	S	S	*	*	H	α-helix	trans	-56.8	-41.6	174.7	-119.2	-70.8	0	0	0	112.2	A526 V527	H523-A526 PolarHBondContact O-N 3.35Å; H523-V527 WeakPolarHBondContact O-CB 3.45Å; H523-V527 VanDerWaalsContact O-CG2 3.31Å; H523-V527 WeakPolarHBondContact O-CG2 3.44Å; H523-V527 PolarHBondContact O-N 3.45Å
524	R	67.1	Low	63.8	Low	197 Å²	197	107.2 Å²	107.2	74%	0.743	56%	0.563	S	S	*	*	H	α-helix	trans	-66.3	-40.6	178.7	-166	171.9	-175.7	154.6	2.3	112.1	N521 S522 E528	N521-R524 PolarHBondContact O-N 3.01Å; S522-R524 VanDerWaalsContact C-N 3.29Å; S522-R524 PolarHBondContact O-N 3.22Å; R524-E528 WeakPolarHBondContact O-CB 2.96Å; R524-E528 PolarHBondContact O-N 3.06Å
525	A	67.3	Low	63.4	Low	46 Å²	46	110 Å²	110	38%	0.38	57%	0.565	S	S	.	*	H	α-helix	trans	-70.3	-34.7	175.6	0	0	0	0	0	112.8	N521 S522 K529	N521-A525 WeakPolarHBondContact O-CB 3.47Å; N521-A525 PolarHBondContact O-N 3.17Å; S522-A525 PolarHBondContact O-N 3.45Å; S522-A525 VanDerWaalsContact O-N 3.17Å; A525-K529 WeakPolarHBondContact O-CB 3.34Å; A525-K529 WeakPolarHBondContact O-CG 3.41Å; A525-K529 PolarHBondContact O-N 3.38Å
526	A	66.8	Low	63.2	Low	27 Å²	27	109.1 Å²	109.1	22%	0.223	57%	0.57	C	S	.	*	H	α-helix	trans	-65.5	-47.4	173.2	0	0	0	0	0	111.3	S522 H523 E528 K529 F530	S522-A526 WeakPolarHBondContact O-CB 3.39Å; S522-A526 PolarHBondContact O-N 2.96Å; H523-A526 PolarHBondContact O-N 3.35Å; A526-E528 PolarHBondContact O-N 3.13Å; A526-K529 PolarHBondContact O-N 2.83Å; A526-F530 PolarHBondContact O-N 2.88Å
527	V	71.2	Confident	63.2	Low	92 Å²	92	112.7 Å²	112.7	56%	0.558	57%	0.574	S	S	*	*	H	α-helix	trans	-62.3	-39.8	174.4	170.4	0	0	0	0	111.5	H523 F530 C531	H523-V527 WeakPolarHBondContact O-CB 3.45Å; H523-V527 VanDerWaalsContact O-CG2 3.31Å; H523-V527 WeakPolarHBondContact O-CG2 3.44Å; H523-V527 PolarHBondContact O-N 3.45Å; V527-F530 PolarHBondContact O-N 3.41Å; V527-C531 WeakPolarHBondContact O-CB 3.31Å; V527-C531 PolarHBondContact O-N 2.9Å
528	E	71.1	Confident	63.4	Low	103 Å²	103	115.3 Å²	115.3	48%	0.481	58%	0.578	S	S	.	*	H	α-helix	trans	-68.3	-36.5	177.2	-159.5	-169	141.1	0	0	112.4	R524 A526 K532	R524-E528 WeakPolarHBondContact O-CB 2.96Å; R524-E528 PolarHBondContact O-N 3.06Å; A526-E528 PolarHBondContact O-N 3.13Å; E528-K532 HydrophobicContact CG-CD 4.49Å; E528-K532 WeakPolarHBondContact O-CB 3.33Å; E528-K532 PolarHBondContact O-N 3.15Å; E528-K532 WeakPolarHBondContact OE1-CE 3.43Å; E528-K532 IonicContact OE1-NZ 3.48Å; E528-K532 PolarHBondContact OE1-NZ 3.03Å
529	K	70.1	Confident	63.1	Low	153 Å²	153	109.9 Å²	109.9	67%	0.665	56%	0.557	S	S	*	*	H	α-helix	trans	-64.1	-48.6	171.5	-77.3	175.1	179.8	179.6	0	111.5	A525 A526 C531 K532 V533	A525-K529 WeakPolarHBondContact O-CB 3.34Å; A525-K529 WeakPolarHBondContact O-CG 3.41Å; A525-K529 PolarHBondContact O-N 3.38Å; A526-K529 PolarHBondContact O-N 2.83Å; K529-C531 VanDerWaalsContact C-N 3.35Å; K529-C531 PolarHBondContact O-N 3.28Å; K529-K532 PolarHBondContact O-N 3.43Å; K529-V533 WeakPolarHBondContact O-CG2 3.42Å; K529-V533 PolarHBondContact O-N 3.18Å
530	F	68.9	Low	62.9	Low	157 Å²	157	110.1 Å²	110.1	69%	0.689	57%	0.57	S	S	*	*	H	α-helix	trans	-58.8	-45.5	175	-100.9	-84.7	0	0	0	111.6	A526 V527 K532 V533 E534	A526-F530 PolarHBondContact O-N 2.88Å; V527-F530 PolarHBondContact O-N 3.41Å; F530-K532 VanDerWaalsContact C-N 3.28Å; F530-K532 PolarHBondContact O-N 2.96Å; F530-V533 PolarHBondContact O-N 3.25Å; F530-E534 WeakPolarHBondContact O-CB 3.35Å; F530-E534 PolarHBondContact O-N 3.1Å
531	C	66.4	Low	62.7	Low	41 Å²	41	110.6 Å²	110.6	28%	0.277	57%	0.571	S	S	.	*	H	α-helix	trans	-66.7	-27.2	178.2	-167.3	0	0	0	0	112.6	V527 K529 K535	V527-C531 WeakPolarHBondContact O-CB 3.31Å; V527-C531 PolarHBondContact O-N 2.9Å; K529-C531 VanDerWaalsContact C-N 3.35Å; K529-C531 PolarHBondContact O-N 3.28Å; C531-K535 WeakPolarHBondContact O-CB 3.36Å; C531-K535 WeakPolarHBondContact O-CD 3.48Å; C531-K535 WeakPolarHBondContact O-CG 3.4Å; C531-K535 PolarHBondContact O-N 3.24Å; C531-K535 VanDerWaalsContact SG-CE 3.52Å; C531-K535 PolarHBondContact SG-NZ 3.09Å
532	K	66.7	Low	62.6	Low	133 Å²	133	112.6 Å²	112.6	58%	0.578	58%	0.577	S	S	*	*	H	α-helix	trans	-76.9	-36.9	171.2	-84.7	167.1	171.5	165.9	0	113.1	E528 K529 F530 S536	E528-K532 HydrophobicContact CG-CD 4.49Å; E528-K532 WeakPolarHBondContact O-CB 3.33Å; E528-K532 PolarHBondContact O-N 3.15Å; E528-K532 WeakPolarHBondContact OE1-CE 3.43Å; E528-K532 IonicContact OE1-NZ 3.48Å; E528-K532 PolarHBondContact OE1-NZ 3.03Å; K529-K532 PolarHBondContact O-N 3.43Å; F530-K532 VanDerWaalsContact C-N 3.28Å; F530-K532 PolarHBondContact O-N 2.96Å; K532-S536 PolarHBondContact O-N 3.19Å; K532-S536 VanDerWaalsContact O-N 3.09Å
533	V	65.9	Low	62.7	Low	94 Å²	94	115.5 Å²	115.5	57%	0.57	59%	0.588	S	S	*	*	H	α-helix	trans	-67.3	-47.5	171.9	173.6	0	0	0	0	110.2	K529 F530 K535 S536 F537	K529-V533 WeakPolarHBondContact O-CG2 3.42Å; K529-V533 PolarHBondContact O-N 3.18Å; F530-V533 PolarHBondContact O-N 3.25Å; V533-K535 PolarHBondContact O-N 2.97Å; V533-S536 CarbonylContact O-C 3.51Å; V533-S536 WeakPolarHBondContact O-CA 3.48Å; V533-S536 PolarHBondContact O-N 2.83Å; V533-S536 PolarHBondContact O-OG 3.35Å; V533-F537 PolarHBondContact O-N 3.14Å
534	E	61.6	Low	63	Low	94 Å²	94	111.7 Å²	111.7	44%	0.439	58%	0.582	S	S	.	*	H	α-helix	trans	-58.9	-44.9	173.9	-164.1	-160.2	169.7	0	0	110.6	F530 S536 F537 R538	F530-E534 WeakPolarHBondContact O-CB 3.35Å; F530-E534 PolarHBondContact O-N 3.1Å; E534-S536 PolarHBondContact O-N 3.48Å; E534-S536 VanDerWaalsContact O-N 3.14Å; E534-F537 CarbonylContact O-C 3.55Å; E534-F537 PolarHBondContact O-N 2.97Å; E534-F537 VanDerWaalsContact O-N 3.11Å; E534-R538 HydrophobicContact CG-CB 4.43Å; E534-R538 WeakPolarHBondContact O-CA 3.36Å; E534-R538 WeakPolarHBondContact O-CB 3.46Å; E534-R538 PolarHBondContact O-N 2.9Å; E534-R538 IonicContact OE1-NH1 2.98Å; E534-R538 PolarHBondContact OE1-NH1 2.7Å; E534-R538 VanDerWaalsContact OE1-NH1 3.15Å
535	K	59.7	Low	63.1	Low	143 Å²	143	109.1 Å²	109.1	62%	0.622	58%	0.579	S	S	*	*	H	α-helix	trans	-68.3	-7	173.8	-75.2	168.9	179.8	164.3	0	115.1	C531 V533 A539	C531-K535 WeakPolarHBondContact O-CB 3.36Å; C531-K535 WeakPolarHBondContact O-CD 3.48Å; C531-K535 WeakPolarHBondContact O-CG 3.4Å; C531-K535 PolarHBondContact O-N 3.24Å; C531-K535 VanDerWaalsContact SG-CE 3.52Å; C531-K535 PolarHBondContact SG-NZ 3.09Å; V533-K535 PolarHBondContact O-N 2.97Å; K535-A539 WeakPolarHBondContact O-CA 3.44Å; K535-A539 WeakPolarHBondContact O-CB 3.15Å; K535-A539 PolarHBondContact O-N 2.67Å; K535-A539 VanDerWaalsContact O-N 3.12Å
536	S	59.7	Low	63.3	Low	86 Å²	86	109.5 Å²	109.5	60%	0.601	58%	0.582	S	S	*	*	H	α-helix	trans	-96.1	-29.7	168	72.1	0	0	0	0	112.8	K532 V533 E534	K532-S536 PolarHBondContact O-N 3.19Å; K532-S536 VanDerWaalsContact O-N 3.09Å; V533-S536 CarbonylContact O-C 3.51Å; V533-S536 WeakPolarHBondContact O-CA 3.48Å; V533-S536 PolarHBondContact O-N 2.83Å; V533-S536 PolarHBondContact O-OG 3.35Å; E534-S536 PolarHBondContact O-N 3.48Å; E534-S536 VanDerWaalsContact O-N 3.14Å
537	F	55.3	Low	63.7	Low	193 Å²	193	112.4 Å²	112.4	85%	0.846	59%	0.593	S	S	*	*	H	α-helix	trans	-84.6	-22.2	174.8	-153.7	-89.2	0	0	0	112.9	V533 E534	V533-F537 PolarHBondContact O-N 3.14Å; E534-F537 CarbonylContact O-C 3.55Å; E534-F537 PolarHBondContact O-N 2.97Å; E534-F537 VanDerWaalsContact O-N 3.11Å
538	R	55.7	Low	63.8	Low	191 Å²	191	112.2 Å²	112.2	72%	0.721	59%	0.588	S	S	*	*	S	Bend	trans	-123.9	18.5	179.5	-148.7	179.4	-166.4	-167.9	0.4	110.7	E534 A540	E534-R538 HydrophobicContact CG-CB 4.43Å; E534-R538 WeakPolarHBondContact O-CA 3.36Å; E534-R538 WeakPolarHBondContact O-CB 3.46Å; E534-R538 PolarHBondContact O-N 2.9Å; E534-R538 IonicContact OE1-NH1 2.98Å; E534-R538 PolarHBondContact OE1-NH1 2.7Å; E534-R538 VanDerWaalsContact OE1-NH1 3.15Å; R538-A540 PolarHBondContact O-N 3.33Å
539	A	48.8	Very low	64.2	Low	59 Å²	59	111 Å²	111	49%	0.488	59%	0.585	S	S	.	*	S	Bend	trans	-50	137	149.2	0	0	0	0	0	106.4	K535	K535-A539 WeakPolarHBondContact O-CA 3.44Å; K535-A539 WeakPolarHBondContact O-CB 3.15Å; K535-A539 PolarHBondContact O-N 2.67Å; K535-A539 VanDerWaalsContact O-N 3.12Å
540	A	51.3	Low	64.6	Low	86 Å²	86	107.2 Å²	107.2	71%	0.711	57%	0.572	S	S	*	*	P	Polyproline II helix	trans	-51.2	139.7	-172.1	0	0	0	0	0	110.1	R538 E542	R538-A540 PolarHBondContact O-N 3.33Å; A540-E542 PolarHBondContact O-N 3.24Å
541	P	55.2	Low	65.2	Low	115 Å²	115	106 Å²	106	75%	0.747	56%	0.564	S	S	*	*	P	Polyproline II helix	trans	-50	135.4	170.7	24.8	-34	0	0	0	107.3	D543	P541-D543 PolarHBondContact O-N 2.99Å; P541-D543 VanDerWaalsContact O-N 3.1Å
542	E	58.5	Low	65.5	Low	156 Å²	156	109 Å²	109	73%	0.729	57%	0.57	S	S	*	*	S	Bend	trans	-45.7	125.2	-179.4	-61.6	179.6	144.8	0	0	107.6	A540 A544 I547	A540-E542 PolarHBondContact O-N 3.24Å; E542-A544 PolarHBondContact O-N 2.76Å; E542-I547 HydrophobicContact CB-CD1 4Å; E542-I547 HydrophobicContact CB-CG1 3.8Å; E542-I547 WeakPolarHBondContact O-CD1 3.37Å; E542-I547 WeakPolarHBondContact O-CG1 3.39Å
543	D	67.3	Low	66	Low	112 Å²	112	107.2 Å²	107.2	60%	0.599	57%	0.57	S	S	*	*			trans	-46.1	127.2	-159.8	-172.4	-1.2	0	0	0	109.8	P541 E545 A546 I547	P541-D543 PolarHBondContact O-N 2.99Å; P541-D543 VanDerWaalsContact O-N 3.1Å; D543-E545 CarbonylContact O-C 3.53Å; D543-E545 PolarHBondContact O-N 3.44Å; D543-E545 VanDerWaalsContact O-N 3.09Å; D543-A546 HydrophobicContact CB-CB 3.89Å; D543-A546 CarbonylContact O-C 3.58Å; D543-A546 VanDerWaalsContact O-CA 3.28Å; D543-A546 WeakPolarHBondContact O-CA 3.34Å; D543-A546 WeakPolarHBondContact O-CB 3.36Å; D543-A546 PolarHBondContact O-N 3.28Å; D543-I547 PolarHBondContact O-N 3.46Å
544	A	68	Low	66.5	Low	68 Å²	68	111.5 Å²	111.5	56%	0.562	58%	0.576	S	S	*	*	H	α-helix	trans	-60.9	-32.1	-165.1	0	0	0	0	0	111.3	E542 L548	E542-A544 PolarHBondContact O-N 2.76Å; A544-L548 WeakPolarHBondContact O-CG 3.12Å; A544-L548 PolarHBondContact O-N 3.34Å
545	E	69.2	Low	66.9	Low	142 Å²	142	109.9 Å²	109.9	66%	0.664	57%	0.572	S	S	*	*	H	α-helix	trans	-62.6	-43.6	167.7	-67.6	-67.7	124.4	0	0	112.3	D543 L548 D549	D543-E545 CarbonylContact O-C 3.53Å; D543-E545 PolarHBondContact O-N 3.44Å; D543-E545 VanDerWaalsContact O-N 3.09Å; E545-L548 CarbonylContact O-C 3.57Å; E545-L548 PolarHBondContact O-N 2.91Å; E545-D549 WeakPolarHBondContact O-CB 3.28Å; E545-D549 PolarHBondContact O-N 3.01Å
546	A	71.8	Confident	66.9	Low	54 Å²	54	105.8 Å²	105.8	45%	0.446	57%	0.571	S	S	.	*	H	α-helix	trans	-71	-34.5	179.4	0	0	0	0	0	114.1	D543 L548 D549 D550	D543-A546 HydrophobicContact CB-CB 3.89Å; D543-A546 CarbonylContact O-C 3.58Å; D543-A546 VanDerWaalsContact O-CA 3.28Å; D543-A546 WeakPolarHBondContact O-CA 3.34Å; D543-A546 WeakPolarHBondContact O-CB 3.36Å; D543-A546 PolarHBondContact O-N 3.28Å; A546-L548 VanDerWaalsContact C-N 3.29Å; A546-D549 PolarHBondContact O-N 3.49Å; A546-D550 WeakPolarHBondContact O-CB 3.37Å; A546-D550 PolarHBondContact O-N 2.89Å
547	I	74.7	Confident	66.9	Low	88 Å²	88	110.5 Å²	110.5	45%	0.451	58%	0.576	S	S	.	*	H	α-helix	trans	-61.6	-43.5	169.3	-62.3	175.9	0	0	0	109.4	E542 D543 Y551	E542-I547 HydrophobicContact CB-CD1 4Å; E542-I547 HydrophobicContact CB-CG1 3.8Å; E542-I547 WeakPolarHBondContact O-CD1 3.37Å; E542-I547 WeakPolarHBondContact O-CG1 3.39Å; D543-I547 PolarHBondContact O-N 3.46Å; I547-Y551 WeakPolarHBondContact O-CB 3.38Å; I547-Y551 PolarHBondContact O-N 3.17Å
548	L	74.1	Confident	66.8	Low	89 Å²	89	107.7 Å²	107.7	47%	0.466	56%	0.563	S	S	.	*	H	α-helix	trans	-67.9	-40.2	177.2	-74.7	169.2	0	0	0	112.4	A544 E545 A546 Y551 Y552	A544-L548 WeakPolarHBondContact O-CG 3.12Å; A544-L548 PolarHBondContact O-N 3.34Å; E545-L548 CarbonylContact O-C 3.57Å; E545-L548 PolarHBondContact O-N 2.91Å; A546-L548 VanDerWaalsContact C-N 3.29Å; L548-Y551 WeakPolarHBondContact O-CB 3.43Å; L548-Y551 PolarHBondContact O-N 2.79Å; L548-Y552 WeakPolarHBondContact O-CB 3.1Å; L548-Y552 WeakPolarHBondContact O-CD2 3.23Å; L548-Y552 PolarHBondContact O-N 3.26Å
549	D	78.7	Confident	66.4	Low	76 Å²	76	106 Å²	106	41%	0.406	57%	0.568	S	S	.	*	H	α-helix	trans	-76.4	-32.1	-178.1	-140.7	14.7	0	0	0	111.8	E545 A546 T553 K558	E545-D549 WeakPolarHBondContact O-CB 3.28Å; E545-D549 PolarHBondContact O-N 3.01Å; A546-D549 PolarHBondContact O-N 3.49Å; D549-T553 VanDerWaalsContact O-CB 3.23Å; D549-T553 WeakPolarHBondContact O-CB 3.47Å; D549-T553 PolarHBondContact O-N 3.29Å; D549-T553 PolarHBondContact O-OG1 2.8Å; D549-K558 IonicContact OD1-NZ 2.72Å; D549-K558 PolarHBondContact OD1-NZ 3.23Å; D549-K558 IonicContact OD2-NZ 3.17Å; D549-K558 PolarHBondContact OD2-NZ 3.32Å
550	D	79.4	Confident	66.2	Low	75 Å²	75	108.1 Å²	108.1	40%	0.401	58%	0.58	S	S	.	*	H	α-helix	trans	-60.7	-48.3	164.2	176.8	83.9	0	0	0	110.4	A546 Y552 T553 R554	A546-D550 WeakPolarHBondContact O-CB 3.37Å; A546-D550 PolarHBondContact O-N 2.89Å; D550-Y552 PolarHBondContact O-N 2.93Å; D550-T553 PolarHBondContact O-N 3.38Å; D550-R554 WeakPolarHBondContact O-CB 3.44Å; D550-R554 PolarHBondContact O-N 2.71Å; D550-R554 IonicContact OD1-CZ 3.88Å; D550-R554 IonicContact OD1-NE 2.71Å; D550-R554 IonicContact OD1-NH2 3.34Å; D550-R554 PolarHBondContact OD1-NH2 3.33Å; D550-R554 IonicContact OD2-CZ 2.74Å; D550-R554 IonicContact OD2-NE 3.45Å; D550-R554 PolarHBondContact OD2-NE 3.24Å; D550-R554 IonicContact OD2-NH2 2.73Å; D550-R554 PolarHBondContact OD2-NH2 2.68Å
551	Y	80.6	Confident	65.8	Low	132 Å²	132	109.7 Å²	109.7	52%	0.518	58%	0.583	S	S	.	*	H	α-helix	trans	-57.2	-52.1	175.9	179.1	-95.6	0	0	0	111.5	I547 L548 T553 R554 V555	I547-Y551 WeakPolarHBondContact O-CB 3.38Å; I547-Y551 PolarHBondContact O-N 3.17Å; L548-Y551 WeakPolarHBondContact O-CB 3.43Å; L548-Y551 PolarHBondContact O-N 2.79Å; Y551-T553 VanDerWaalsContact C-N 3.28Å; Y551-T553 PolarHBondContact O-N 2.77Å; Y551-R554 CarbonylContact O-C 3.6Å; Y551-R554 PolarHBondContact O-N 2.73Å; Y551-V555 HydrophobicContact CD1-CG2 4.08Å; Y551-V555 HydrophobicContact CD2-CG1 4.17Å; Y551-V555 HydrophobicContact CE1-CG1 4.09Å; Y551-V555 HydrophobicContact CE1-CG2 3.8Å; Y551-V555 HydrophobicContact CE2-CG1 3.69Å; Y551-V555 VanDerWaalsContact O-CG2 3.26Å; Y551-V555 WeakPolarHBondContact O-CG2 3.26Å; Y551-V555 PolarHBondContact O-N 2.79Å
552	Y	73.9	Confident	65.4	Low	104 Å²	104	114 Å²	114	41%	0.408	59%	0.589	S	S	.	*	H	α-helix	trans	-58.3	-37	178.3	-84.9	-62.5	0	0	0	113.2	L548 D550 G556 W557	L548-Y552 WeakPolarHBondContact O-CB 3.1Å; L548-Y552 WeakPolarHBondContact O-CD2 3.23Å; L548-Y552 PolarHBondContact O-N 3.26Å; D550-Y552 PolarHBondContact O-N 2.93Å; Y552-G556 PolarHBondContact O-N 3.16Å; Y552-G556 VanDerWaalsContact O-N 3.16Å; Y552-W557 HydrophobicContact CD1-CB 4.25Å; Y552-W557 HydrophobicContact CD1-CE3 4.47Å; Y552-W557 HydrophobicContact CD1-CG 4.49Å; Y552-W557 HydrophobicContact CE1-CD2 4.49Å; Y552-W557 HydrophobicContact CE1-CE3 4.01Å; Y552-W557 PolarHBondContact O-N 3.3Å
553	T	77.6	Confident	64.6	Low	95 Å²	95	114.4 Å²	114.4	58%	0.583	59%	0.591	S	S	*	*	H	α-helix	trans	-69.7	-42	174.8	-57.7	0	0	0	0	111	D549 D550 Y551 G556	D549-T553 VanDerWaalsContact O-CB 3.23Å; D549-T553 WeakPolarHBondContact O-CB 3.47Å; D549-T553 PolarHBondContact O-N 3.29Å; D549-T553 PolarHBondContact O-OG1 2.8Å; D550-T553 PolarHBondContact O-N 3.38Å; Y551-T553 VanDerWaalsContact C-N 3.28Å; Y551-T553 PolarHBondContact O-N 2.77Å; T553-G556 PolarHBondContact O-N 3.07Å
554	R	75.6	Confident	63	Low	184 Å²	184	113.9 Å²	113.9	69%	0.694	60%	0.596	S	S	*	*	H	α-helix	trans	-75.9	-31.1	-176.6	-167.7	-176.1	-60.7	-94.8	2.6	113.6	D550 Y551	D550-R554 WeakPolarHBondContact O-CB 3.44Å; D550-R554 PolarHBondContact O-N 2.71Å; D550-R554 IonicContact OD1-CZ 3.88Å; D550-R554 IonicContact OD1-NE 2.71Å; D550-R554 IonicContact OD1-NH2 3.34Å; D550-R554 PolarHBondContact OD1-NH2 3.33Å; D550-R554 IonicContact OD2-CZ 2.74Å; D550-R554 IonicContact OD2-NE 3.45Å; D550-R554 PolarHBondContact OD2-NE 3.24Å; D550-R554 IonicContact OD2-NH2 2.73Å; D550-R554 PolarHBondContact OD2-NH2 2.68Å; Y551-R554 CarbonylContact O-C 3.6Å; Y551-R554 PolarHBondContact O-N 2.73Å
555	V	69.9	Low	62	Low	59 Å²	59	116.8 Å²	116.8	36%	0.358	61%	0.61	S	S	.	*	T	Hydrogen-bonded Turn	trans	-88.2	-5.8	169.8	-60.4	0	0	0	0	113.7	Y551 W557	Y551-V555 HydrophobicContact CD1-CG2 4.08Å; Y551-V555 HydrophobicContact CD2-CG1 4.17Å; Y551-V555 HydrophobicContact CE1-CG1 4.09Å; Y551-V555 HydrophobicContact CE1-CG2 3.8Å; Y551-V555 HydrophobicContact CE2-CG1 3.69Å; Y551-V555 VanDerWaalsContact O-CG2 3.26Å; Y551-V555 WeakPolarHBondContact O-CG2 3.26Å; Y551-V555 PolarHBondContact O-N 2.79Å; V555-W557 VanDerWaalsContact CG2-CD1 3.43Å; V555-W557 HydrophobicContact CG2-CG 4.09Å
556	G	59.7	Low	60.5	Low	57 Å²	57	118.4 Å²	118.4	59%	0.588	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	71.3	37	166.7	0	0	0	0	0	115.6	Y552 T553 K558	Y552-G556 PolarHBondContact O-N 3.16Å; Y552-G556 VanDerWaalsContact O-N 3.16Å; T553-G556 PolarHBondContact O-N 3.07Å; G556-K558 VanDerWaalsContact C-N 3.32Å
557	W	60.6	Low	59.1	Low	186 Å²	186	127.1 Å²	127.1	71%	0.705	64%	0.641	S	S	*	*			trans	-81.6	-12.5	-179	-74.5	29.8	0	0	0	113.5	Y552 V555 D559	Y552-W557 HydrophobicContact CD1-CB 4.25Å; Y552-W557 HydrophobicContact CD1-CE3 4.47Å; Y552-W557 HydrophobicContact CD1-CG 4.49Å; Y552-W557 HydrophobicContact CE1-CD2 4.49Å; Y552-W557 HydrophobicContact CE1-CE3 4.01Å; Y552-W557 PolarHBondContact O-N 3.3Å; V555-W557 VanDerWaalsContact CG2-CD1 3.43Å; V555-W557 HydrophobicContact CG2-CG 4.09Å; W557-D559 PolarHBondContact O-N 2.79Å
558	K	51.8	Low	57.5	Low	134 Å²	134	128.2 Å²	128.2	58%	0.583	66%	0.656	S	S	*	*	S	Bend	trans	-93.2	46.9	-167.4	-140.4	166	-167.8	168.1	0	112.6	D549 G556	D549-K558 IonicContact OD1-NZ 2.72Å; D549-K558 PolarHBondContact OD1-NZ 3.23Å; D549-K558 IonicContact OD2-NZ 3.17Å; D549-K558 PolarHBondContact OD2-NZ 3.32Å; G556-K558 VanDerWaalsContact C-N 3.32Å
559	D	48.4	Very low	55.8	Low	155 Å²	155	130.8 Å²	130.8	83%	0.829	68%	0.678	S	S	*	*	S	Bend	trans	-175.6	57.6	163.9	-103.5	-16.5	0	0	0	114.4	W557	W557-D559 PolarHBondContact O-N 2.79Å
560	S	43.7	Very low	53.9	Low	104 Å²	104	130.2 Å²	130.2	73%	0.727	69%	0.69	S	S	*	*			trans	-152.9	82.2	172.4	-85.3	0	0	0	0	115.4	K562	S560-K562 PolarHBondContact O-N 2.86Å
561	P	43.6	Very low	51.8	Low	119 Å²	119	136.7 Å²	136.7	77%	0.773	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66	126.3	160	28.9	-32.4	0	0	0	110
562	K	47.5	Very low	50	Low	204 Å²	204	134.9 Å²	134.9	89%	0.887	73%	0.727	S	S	*	*	T	Hydrogen-bonded Turn	trans	85.8	46.3	172.7	-45.5	163.7	-175	171.8	0	118.4	S560	S560-K562 PolarHBondContact O-N 2.86Å
563	H	40.4	Very low	48.6	Very low	165 Å²	165	139.8 Å²	139.8	76%	0.764	75%	0.751	S	S	*	*			trans	-151.3	108.9	147.4	-144.6	-76.5	0	0	0	114.4	P565	H563-P565 VanDerWaalsContact O-CD 3.31Å; H563-P565 WeakPolarHBondContact O-CD 3.31Å
564	S	34.4	Very low	46.6	Very low	102 Å²	102	139.2 Å²	139.2	71%	0.713	76%	0.764	S	S	*	*			trans	-76.1	121.1	173	-52.7	0	0	0	0	110.6	M566	S564-M566 VanDerWaalsContact C-N 3.26Å; S564-M566 PolarHBondContact O-N 2.99Å
565	P	45.9	Very low	45	Very low	129 Å²	129	135.7 Å²	135.7	84%	0.838	77%	0.768	S	S	*	*			trans	-76.9	55.7	-175	-19.9	35.9	0	0	0	115.7	H563 R567	H563-P565 VanDerWaalsContact O-CD 3.31Å; H563-P565 WeakPolarHBondContact O-CD 3.31Å; P565-R567 PolarHBondContact O-N 3.33Å
566	M	38.3	Very low	43.4	Very low	176 Å²	176	143.8 Å²	143.8	87%	0.867	79%	0.791	S	S	*	*			trans	-75.8	83.3	171	-74.7	-156.4	78.4	0	0	112.2	S564	S564-M566 VanDerWaalsContact C-N 3.26Å; S564-M566 PolarHBondContact O-N 2.99Å
567	R	43	Very low	42.8	Very low	237 Å²	237	152.5 Å²	152.5	89%	0.894	81%	0.807	S	S	*	*			trans	-170	129.9	152.3	-110.2	156.5	-174.9	-85.2	-2.4	113.2	P565	P565-R567 PolarHBondContact O-N 3.33Å
568	S	39.8	Very low	42	Very low	111 Å²	111	153 Å²	153	78%	0.776	81%	0.814	S	S	*	*			trans	-64.5	148.2	172.4	-41.8	0	0	0	0	111.8	G570	S568-G570 PolarHBondContact O-N 3.39Å
569	P	39.3	Very low	41.6	Very low	142 Å²	142	152 Å²	152	92%	0.922	82%	0.824	S	S	*	*			trans	-63	125.2	-179.1	-23	34.3	0	0	0	112.8
570	G	38.1	Very low	41.6	Very low	64 Å²	64	150.9 Å²	150.9	66%	0.66	83%	0.825	S	S	*	*			trans	-148.8	120.3	178.6	0	0	0	0	0	112.4	S568	S568-G570 PolarHBondContact O-N 3.39Å
571	F	36.2	Very low	41.7	Very low	212 Å²	212	149.3 Å²	149.3	93%	0.93	83%	0.825	S	S	*	*			trans	-0.2	114.7	165.7	-61.4	-97	0	0	0	118.7
572	A	43.3	Very low	41.6	Very low	94 Å²	94	155 Å²	155	78%	0.777	83%	0.831	S	S	*	*			trans	-158	121.4	145.2	0	0	0	0	0	114.3
573	F	42.7	Very low	41.6	Very low	207 Å²	207	153.2 Å²	153.2	91%	0.908	83%	0.83	S	S	*	*			trans	-25.3	132.7	163.5	-55.8	-90.4	0	0	0	118.1
574	G	35.9	Very low	41.7	Very low	82 Å²	82	151.3 Å²	151.3	85%	0.845	83%	0.825	S	S	*	*			trans	-76.8	144.7	167.9	0	0	0	0	0	113.4
575	S	43.2	Very low	42.1	Very low	111 Å²	111	153.2 Å²	153.2	78%	0.776	83%	0.826	S	S	*	*			trans	-149.4	99.2	175.6	-163.6	0	0	0	0	115
576	R	35.6	Very low	42	Very low	228 Å²	228	154.3 Å²	154.3	86%	0.86	83%	0.825	S	S	*	*			trans	32.8	108.9	136.6	-170.7	-172.3	-65.5	-120.5	1.2	118.9
577	R	47.6	Very low	42.4	Very low	241 Å²	241	150 Å²	150	91%	0.909	82%	0.818	S	S	*	*			trans	-123.8	113.8	148.2	-64.6	-176.8	-177.5	-103.9	-0.8	107.3
578	K	43.5	Very low	42.5	Very low	195 Å²	195	143.9 Å²	143.9	85%	0.848	81%	0.809	S	S	*	*				70.9	111.7	73.4	-76.1	-169.6	173.1	-176.3	0	112.2
579	S	43.5	Very low	43.1	Very low	115 Å²	115	145.8 Å²	145.8	80%	0.804	81%	0.811	S	S	*	*			trans	-117	154.3	-170.5	36	0	0	0	0	113.5
580	P	48.8	Very low	43.5	Very low	130 Å²	130	144.7 Å²	144.7	84%	0.844	80%	0.802	S	S	*	*			trans	-91.3	170.6	149.8	37.2	-30.3	0	0	0	110.4
581	G	45	Very low	44.2	Very low	71 Å²	71	148.1 Å²	148.1	73%	0.732	80%	0.803	S	S	*	*			cis	159.6	67.1	-4.4	0	0	0	0	0	113.9
582	R	41.6	Very low	44.7	Very low	238 Å²	238	146.4 Å²	146.4	90%	0.898	80%	0.795	S	S	*	*			trans	35.5	134.6	165.4	-62.9	-173.6	-178.8	-140.4	2.4	120.5
583	I	46.9	Very low	45	Very low	167 Å²	167	155.2 Å²	155.2	86%	0.856	82%	0.817	S	S	*	*				-155.7	153.6	124.4	-101.2	147.7	0	0	0	110.8
584	N	42.4	Very low	45.2	Very low	125 Å²	125	152.6 Å²	152.6	67%	0.668	81%	0.812	S	S	*	*			trans	-48.4	135.9	-170	-58.4	-20.1	0	0	0	115.7
585	I	43.6	Very low	45.6	Very low	142 Å²	142	156.3 Å²	156.3	73%	0.728	81%	0.81	S	S	*	*				80.3	111.1	65.2	-61.4	157.4	0	0	0	114.4
586	N	44	Very low	45.8	Very low	152 Å²	152	158.8 Å²	158.8	81%	0.813	81%	0.812	S	S	*	*			trans	179.6	120	135.4	-85.1	-26.1	0	0	0	106.3
587	A	45.7	Very low	46.4	Very low	87 Å²	87	154.8 Å²	154.8	72%	0.719	81%	0.809	S	S	*	*				67	121.4	74.1	0	0	0	0	0	112
588	C	46.4	Very low	46.3	Very low	107 Å²	107	149.4 Å²	149.4	72%	0.723	80%	0.803	S	S	*	*			cis	-147.4	-152.6	8.5	-103.3	0	0	0	0	111.8
589	D	51	Low	46.5	Very low	152 Å²	152	146.3 Å²	146.3	81%	0.813	80%	0.8	S	S	*	*			trans	72.9	91.4	167.8	-54.7	-9.6	0	0	0	116.1
590	V	49.3	Very low	46.7	Very low	119 Å²	119	148.6 Å²	148.6	72%	0.721	80%	0.8	S	S	*	*			cis	88	115.3	17.2	-175	0	0	0	0	116.2
591	I	51.6	Low	46.6	Very low	135 Å²	135	150 Å²	150	69%	0.692	80%	0.796	S	S	*	*			trans	92.2	102.3	157	-77.9	166.3	0	0	0	121
592	K	47.7	Very low	46.7	Very low	176 Å²	176	156.6 Å²	156.6	77%	0.765	80%	0.802	S	S	*	*				46.2	130.5	127.4	-48.2	175.5	-176	177.4	0	121
593	F	50	Low	47.1	Very low	279 Å²	279	149.2 Å²	149.2	100%	1.224	79%	0.793	S	S	*	*				-120.9	0	82.6	-120.8	-87	0	0	0	110.5

Retrieved 593 of 593 residues in 118.6 ms (Link to these results)

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