A0A5K4ENQ0_SCHMA Loading...

Putative nuclear receptor

AlphaFold DB , UniProt , Accession A0A5K4ENQ0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 813 aa.

						>A0A5K4ENQ0_SCHMA|A0A5K4ENQ0
MNNLTKKYYSIENSSINQYYKEMFPLKEGIQTTLPLLHNHITNNSNNNHLSYIMTMNEQSNLNSNFKCEQSIGQPGYPLIENQFISSLSSSSSSFTLATSSVSSSASSAASVASSSSSSLSIQIPIVNELKYSNHLDYIQHFNSQMKSPMYDIKPTSIYHHHSNNTCVNNNGNNSKFSKPPNGSTSLTYGSIETVNSKKSALLIHNKQLLMKNDKNIESNDIIHCNSSVEEDDDDGDENDNDDGDEDDINDTVEESEDVSSSNCTDDIQHLCQVCGDRSSGKHYGQYTCEGCKSFFKRSVRKSANYVCRSGGQCPVDAQRRNQCQACRLSRCLLAGMKKSAVQRARANTQTYLCSTTPYSSYPVIAAAAVAAAATAYLHGTVTTTTTTTNTNDTTTNFISNSYIPTTNQYITPSNGNINHLPQTYYEQYEHTLNTSNIPYSRLYNQPIYTRRYISGNSMNKPIESMVTSYLPFNNSNTSSMLPYDYQPPTLHHHNHYATPFNLQQKSPYNNTYYHHYHHHSTSSIPSTSSIPIPMTTPIMTNFHNINMNCMNPYNTTNNTTTDSTSSSTITHTTNTTNNISSSSSIRCDLNQELNSSFRQPDSSSSSVATLPSLNSIIHYENIHSFMIDIQNTIKEWILIIQDTNYLLNTTYYLNYHYHIEFMKLWSNKLLKQMTYILNKLHSFKQIWNQYFKNMAGNSNDPLLLLLRRRHHGNGDDDDDDDDEVEEEYLWINELITQIELYESQDYEMKTTNQLNKSMIPIPDTTQIILCELIDKERELLLMKSLPTLSLMHICQFILLEQFTNGLLLLLSS
					

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	31.4	Very low	33	Very low	203 Å²	203	146.4 Å²	146.4	100%	1	72%	0.715	S	S	*	*				0	-58.5	0	-67.4	-170.4	173.9	0	0	114.8	N3 L4	M1-N3 PolarHBondContact O-N 2.94Å; M1-L4 PolarHBondContact O-N 3.42Å
2	N	33	Very low	33.2	Very low	146 Å²	146	149 Å²	149	78%	0.781	73%	0.725	S	S	*	*	T	Hydrogen-bonded Turn	trans	-51.1	-5.2	-169.7	-71.6	-6.7	0	0	0	120.8
3	N	33.3	Very low	33.3	Very low	140 Å²	140	145.2 Å²	145.2	75%	0.749	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.8	-13	175.9	-82.6	-27.8	0	0	0	114.6	M1	M1-N3 PolarHBondContact O-N 2.94Å
4	L	33	Very low	33.5	Very low	127 Å²	127	142.9 Å²	142.9	67%	0.665	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.6	-37.5	177.7	-83.2	145.6	0	0	0	111.7	M1 K6 K7	M1-L4 PolarHBondContact O-N 3.42Å; L4-K6 VanDerWaalsContact C-N 3.25Å; L4-K6 PolarHBondContact O-N 3.33Å; L4-K7 PolarHBondContact O-N 3.36Å
5	T	34.6	Very low	33.6	Very low	85 Å²	85	141.2 Å²	141.2	52%	0.521	72%	0.723	S	S	.	*	H	α-helix	trans	-58.8	-32.4	177.6	-13.4	0	0	0	0	113.1	K7 Y9	T5-K7 VanDerWaalsContact C-N 3.3Å; T5-K7 PolarHBondContact O-N 3.4Å; T5-Y9 PolarHBondContact O-N 2.87Å
6	K	35.8	Very low	33.8	Very low	153 Å²	153	140.6 Å²	140.6	67%	0.665	72%	0.72	S	S	*	*	H	α-helix	trans	-70.3	-21.7	175.9	-79.6	-177.5	175.3	175.4	0	114.1	L4 S10	L4-K6 VanDerWaalsContact C-N 3.25Å; L4-K6 PolarHBondContact O-N 3.33Å; K6-S10 PolarHBondContact O-OG 3.09Å
7	K	33.1	Very low	33.8	Very low	163 Å²	163	138.6 Å²	138.6	71%	0.709	71%	0.711	S	S	*	*	H	α-helix	trans	-84.8	-34.3	-174.7	-138.8	175.5	-175.9	-177.4	0	112.4	L4 T5	L4-K7 PolarHBondContact O-N 3.36Å; T5-K7 VanDerWaalsContact C-N 3.3Å; T5-K7 PolarHBondContact O-N 3.4Å
8	Y	30	Very low	34	Very low	201 Å²	201	140.5 Å²	140.5	79%	0.788	72%	0.716	S	S	*	*	H	α-helix	trans	-79	-36.4	175.4	-90.4	-84.6	0	0	0	113.4	S10	Y8-S10 PolarHBondContact O-N 3.22Å; Y8-S10 VanDerWaalsContact O-N 3.16Å
9	Y	32.6	Very low	33.8	Very low	164 Å²	164	144.7 Å²	144.7	64%	0.643	72%	0.724	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.8	-10.2	177.8	-98.1	-87.5	0	0	0	115.4	T5	T5-Y9 PolarHBondContact O-N 2.87Å
10	S	33.3	Very low	33.8	Very low	94 Å²	94	146.8 Å²	146.8	66%	0.657	72%	0.724	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.6	-1.9	-173.3	-63.8	0	0	0	0	115	K6 Y8	K6-S10 PolarHBondContact O-OG 3.09Å; Y8-S10 PolarHBondContact O-N 3.22Å; Y8-S10 VanDerWaalsContact O-N 3.16Å
11	I	33.1	Very low	33.9	Very low	134 Å²	134	148.4 Å²	148.4	69%	0.687	73%	0.727	S	S	*	*	S	Bend	trans	-104.7	-24.3	-168	-63.8	179.3	0	0	0	113.9
12	E	35.2	Very low	34.2	Very low	178 Å²	178	147.5 Å²	147.5	83%	0.832	72%	0.721	S	S	*	*	S	Bend	trans	-111.5	-6.8	-174.2	-64.2	-164.5	136.4	0	0	116.2
13	N	34.6	Very low	34.3	Very low	99 Å²	99	148 Å²	148	53%	0.529	72%	0.72	S	S	.	*			trans	-101.7	14.4	-173.6	-86.6	-45.5	0	0	0	116.2	S15	N13-S15 PolarHBondContact O-N 3.27Å
14	S	36.3	Very low	34.3	Very low	113 Å²	113	149 Å²	149	79%	0.79	72%	0.718	S	S	*	*	S	Bend	trans	-76.1	-17.4	-170.9	-166.6	0	0	0	0	115.5
15	S	35.3	Very low	34.2	Very low	118 Å²	118	149 Å²	149	83%	0.825	73%	0.726	S	S	*	*	S	Bend	trans	-120.2	-1.2	-165.1	-51.4	0	0	0	0	116.5	N13	N13-S15 PolarHBondContact O-N 3.27Å
16	I	36.2	Very low	34.1	Very low	131 Å²	131	152.2 Å²	152.2	67%	0.672	74%	0.739	S	S	*	*	S	Bend	trans	-111.5	-12.7	-170.8	-72.5	172.6	0	0	0	112.9
17	N	34.6	Very low	33.9	Very low	107 Å²	107	154.9 Å²	154.9	57%	0.572	75%	0.751	S	S	*	*	S	Bend	trans	-108.8	26.3	-161.3	-133.8	-24.5	0	0	0	115.9
18	Q	36.4	Very low	33.7	Very low	173 Å²	173	156.4 Å²	156.4	81%	0.808	76%	0.76	S	S	*	*	S	Bend	trans	-105.2	-16.4	-179.9	-158.4	158.4	5.6	0	0	114.2
19	Y	30.2	Very low	33.6	Very low	221 Å²	221	150 Å²	150	87%	0.867	76%	0.755	S	S	*	*	S	Bend	trans	-91.5	-20.2	179.1	-122.2	-93.8	0	0	0	114.4
20	Y	34.4	Very low	33.3	Very low	185 Å²	185	150.3 Å²	150.3	73%	0.725	77%	0.766	S	S	*	*	S	Bend	trans	-94.2	-5.8	-177.6	-75	-78.8	0	0	0	114.1
21	K	36.4	Very low	33.2	Very low	181 Å²	181	153.8 Å²	153.8	79%	0.787	77%	0.772	S	S	*	*	S	Bend	trans	-90.5	-6.5	-172.3	-147.2	173.6	-175	178.1	0	114.7
22	E	37.5	Very low	33	Very low	184 Å²	184	154.3 Å²	154.3	86%	0.86	78%	0.782	S	S	*	*	S	Bend	trans	-101.3	-9.6	-178.1	-63.3	-167	157	0	0	114.2
23	M	35	Very low	32.7	Very low	156 Å²	156	151.4 Å²	151.4	77%	0.768	78%	0.776	S	S	*	*	S	Bend	trans	-97	-19.1	-166.8	-151.6	163.9	-177.7	0	0	115.5
24	F	31.7	Very low	32.3	Very low	163 Å²	163	154.6 Å²	154.6	72%	0.715	79%	0.793	S	S	*	*			trans	-148.9	108.4	175.1	-78.1	-80	0	0	0	113.2	L26	F24-L26 PolarHBondContact O-N 3.16Å
25	P	31.9	Very low	32.1	Very low	126 Å²	126	154 Å²	154	82%	0.818	79%	0.786	S	S	*	*			trans	-84.1	88.1	166	32.9	-30.6	0	0	0	109.7
26	L	31.7	Very low	31.8	Very low	152 Å²	152	155.6 Å²	155.6	80%	0.796	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-81.7	130.9	173.4	-79.5	171	0	0	0	111.2	F24 E28	F24-L26 PolarHBondContact O-N 3.16Å; L26-E28 PolarHBondContact O-N 3.21Å
27	K	31.4	Very low	31.5	Very low	210 Å²	210	156.3 Å²	156.3	91%	0.913	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-61.3	121	-178.6	-70.1	173.4	173.6	176.7	0	111.3
28	E	28.9	Very low	31.2	Very low	194 Å²	194	159 Å²	159	91%	0.907	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-72.5	143.4	155.6	-68.7	-176.5	156.6	0	0	110	L26	L26-E28 PolarHBondContact O-N 3.21Å
29	G	28.5	Very low	30.9	Very low	67 Å²	67	156.1 Å²	156.1	69%	0.691	79%	0.788	S	S	*	*			trans	130.4	92.9	166.7	0	0	0	0	0	115
30	I	27.4	Very low	30.8	Very low	170 Å²	170	153 Å²	153	87%	0.872	78%	0.781	S	S	*	*				-153.8	120	114.2	-90.8	144.5	0	0	0	106.8
31	Q	29.7	Very low	30.5	Very low	168 Å²	168	150.2 Å²	150.2	79%	0.785	78%	0.777	S	S	*	*			trans	-81.4	134.2	173.4	-70	170.6	-39.3	0	0	109.5	T33	Q31-T33 PolarHBondContact O-N 3.22Å
32	T	28.7	Very low	30.1	Very low	144 Å²	144	146.6 Å²	146.6	88%	0.883	77%	0.771	S	S	*	*			trans	-84.1	87.5	163.1	49.4	0	0	0	0	109.7
33	T	29.7	Very low	29.7	Very low	117 Å²	117	144.3 Å²	144.3	72%	0.718	76%	0.764	S	S	*	*			trans	-95.6	115.6	168.5	38.6	0	0	0	0	110.9	Q31	Q31-T33 PolarHBondContact O-N 3.22Å
34	L	26.4	Very low	29.5	Very low	167 Å²	167	143.8 Å²	143.8	87%	0.874	76%	0.764	S	S	*	*			trans	-75.8	158	157.9	-122.7	81.7	0	0	0	109.1
35	P	31.4	Very low	29.4	Very low	99 Å²	99	139.5 Å²	139.5	64%	0.643	76%	0.755	S	S	*	*				-118.5	-174.8	-55.5	32.2	-16.2	0	0	0	110.7
36	L	30.2	Very low	29.4	Very low	152 Å²	152	140 Å²	140	80%	0.796	75%	0.75	S	S	*	*			trans	129.8	129	149.5	-68.1	164.4	0	0	0	115.5
37	L	29.8	Very low	29.5	Very low	147 Å²	147	138.5 Å²	138.5	77%	0.77	74%	0.743	S	S	*	*			trans	43.2	106.9	154.8	-84.9	77.4	0	0	0	121.1
38	H	27.7	Very low	29.7	Very low	163 Å²	163	135 Å²	135	76%	0.755	74%	0.735	S	S	*	*				65.6	118.6	115.3	-108.9	52.5	0	0	0	121.2
39	N	30.1	Very low	29.9	Very low	113 Å²	113	133.2 Å²	133.2	60%	0.604	73%	0.726	S	S	*	*			trans	81.6	108.4	137.3	-71	2.2	0	0	0	122.3
40	H	28.9	Very low	30	Very low	154 Å²	154	136.5 Å²	136.5	71%	0.713	73%	0.727	S	S	*	*				88	123.7	119.5	-82.6	-47.8	0	0	0	122.3
41	I	28.1	Very low	30.1	Very low	127 Å²	127	132.9 Å²	132.9	65%	0.651	72%	0.717	S	S	*	*				92.6	89.1	126.2	-70.4	170.1	0	0	0	119.4
42	T	28	Very low	30.2	Very low	106 Å²	106	133.9 Å²	133.9	65%	0.65	72%	0.715	S	S	*	*				66.7	138.9	120.1	77.2	0	0	0	0	124.7
43	N	28.5	Very low	30.2	Very low	135 Å²	135	132.8 Å²	132.8	72%	0.722	70%	0.702	S	S	*	*				97.4	134.7	128.5	-79.5	-10.8	0	0	0	122.2
44	N	30.3	Very low	30.3	Very low	145 Å²	145	134.6 Å²	134.6	78%	0.775	70%	0.704	S	S	*	*			trans	68.5	150.6	153.4	-72.5	-11.2	0	0	0	118.9
45	S	29.5	Very low	30.4	Very low	73 Å²	73	131.4 Å²	131.4	51%	0.51	69%	0.692	S	S	.	*			cis	-179.6	162.7	-21.2	54.4	0	0	0	0	108.8
46	N	31.5	Very low	30.4	Very low	136 Å²	136	134.7 Å²	134.7	73%	0.727	70%	0.701	S	S	*	*			trans	74.1	151.9	163.4	-43.8	-30.7	0	0	0	114.8
47	N	34.9	Very low	30.4	Very low	122 Å²	122	133.5 Å²	133.5	65%	0.652	70%	0.695	S	S	*	*			cis	-162.6	147.7	23.9	-111.7	-33.3	0	0	0	112
48	N	35.3	Very low	30.5	Very low	137 Å²	137	134.8 Å²	134.8	73%	0.733	70%	0.697	S	S	*	*			trans	62	153.3	145.1	-52	-26.9	0	0	0	119.8
49	H	33.3	Very low	30.4	Very low	155 Å²	155	135.8 Å²	135.8	72%	0.718	70%	0.702	S	S	*	*			cis	-159.6	150.8	15.3	-157.7	-120.1	0	0	0	113
50	L	30.8	Very low	30.5	Very low	137 Å²	137	135.9 Å²	135.9	72%	0.717	71%	0.712	S	S	*	*			trans	0.5	161.2	153.6	-85.6	66.2	0	0	0	122.5
51	S	29.6	Very low	30.4	Very low	94 Å²	94	135.2 Å²	135.2	66%	0.657	71%	0.714	S	S	*	*			cis	-175.8	179.7	-0.3	49	0	0	0	0	113.6
52	Y	30.5	Very low	30.5	Very low	189 Å²	189	137.5 Å²	137.5	74%	0.741	73%	0.726	S	S	*	*			trans	90.6	113.1	161.5	-122.3	-90.7	0	0	0	117.3
53	I	29	Very low	30.4	Very low	120 Å²	120	139 Å²	139	62%	0.615	73%	0.73	S	S	*	*			cis	126.5	134.5	8.1	-75	163.6	0	0	0	109
54	M	31.4	Very low	30.6	Very low	156 Å²	156	138.4 Å²	138.4	77%	0.768	74%	0.736	S	S	*	*			trans	110.7	134.6	163.1	-63.7	-147	159.7	0	0	118
55	T	29.9	Very low	30.6	Very low	100 Å²	100	138.5 Å²	138.5	61%	0.613	74%	0.737	S	S	*	*			cis	-175.7	149.1	-38.1	10.2	0	0	0	0	109.6
56	M	31.3	Very low	30.6	Very low	168 Å²	168	145.6 Å²	145.6	83%	0.828	76%	0.759	S	S	*	*			trans	66.4	151.8	151.1	-63.4	-65.8	176.7	0	0	118.4
57	N	29.1	Very low	30.4	Very low	126 Å²	126	147.2 Å²	147.2	67%	0.674	76%	0.759	S	S	*	*			cis	-169.5	-179.2	-19.2	-171.6	25.5	0	0	0	109.5
58	E	32.1	Very low	30.1	Very low	175 Å²	175	146.4 Å²	146.4	82%	0.818	76%	0.762	S	S	*	*			trans	106.3	135.7	153.1	-57.9	-165.6	159	0	0	120.5
59	Q	26.3	Very low	29.9	Very low	184 Å²	184	146.6 Å²	146.6	86%	0.86	76%	0.759	S	S	*	*			trans	-127	144.6	-170.6	-60.9	161.4	-49.6	0	0	109.7
60	S	31.5	Very low	29.7	Very low	115 Å²	115	147.1 Å²	147.1	80%	0.804	76%	0.761	S	S	*	*			trans	-178.1	112.2	150.6	33.5	0	0	0	0	107.4
61	N	26.5	Very low	29.7	Very low	140 Å²	140	145.7 Å²	145.7	75%	0.749	76%	0.763	S	S	*	*			cis	70	101.2	49.4	-156.7	6.6	0	0	0	113.3
62	L	30.7	Very low	29.7	Very low	175 Å²	175	149.5 Å²	149.5	92%	0.916	77%	0.774	S	S	*	*			trans	-161	111.3	157.2	-111.6	166	0	0	0	110.8
63	N	26.7	Very low	29.7	Very low	138 Å²	138	144.2 Å²	144.2	74%	0.738	78%	0.777	S	S	*	*			trans	-76.9	152.3	173.4	-73.5	-48.7	0	0	0	111.9
64	S	32.5	Very low	29.6	Very low	121 Å²	121	147.6 Å²	147.6	85%	0.846	79%	0.791	S	S	*	*			trans	-151.6	134.3	140.1	52	0	0	0	0	111.3
65	N	29.4	Very low	29.6	Very low	147 Å²	147	146.3 Å²	146.3	79%	0.786	79%	0.794	S	S	*	*			trans	-88.7	150.1	-177.9	-68.2	-67.2	0	0	0	111.4
66	F	29.8	Very low	29.7	Very low	223 Å²	223	144.8 Å²	144.8	98%	0.978	80%	0.798	S	S	*	*			trans	-145.1	143.4	139.2	-109.3	-79.9	0	0	0	110.3
67	K	28.3	Very low	29.4	Very low	169 Å²	169	147.7 Å²	147.7	74%	0.735	80%	0.801	S	S	*	*			trans	-146.2	134.3	-165	174.9	-167	175.1	-165.5	0	110.5
68	C	28.9	Very low	29.5	Very low	106 Å²	106	147.4 Å²	147.4	72%	0.716	81%	0.806	S	S	*	*			trans	-160.7	114.9	148.6	-100	0	0	0	0	105.4
69	E	29.9	Very low	29.2	Very low	141 Å²	141	147 Å²	147	66%	0.659	81%	0.809	S	S	*	*				73.4	140	82.7	-75.5	176.7	167.1	0	0	113.2
70	Q	29.2	Very low	29.4	Very low	165 Å²	165	145.2 Å²	145.2	77%	0.771	80%	0.804	S	S	*	*			cis	167.9	128.3	-19	-123.1	-171.4	2.2	0	0	105.2
71	S	31	Very low	29.1	Very low	107 Å²	107	146.7 Å²	146.7	75%	0.748	80%	0.798	S	S	*	*			trans	167.8	103	145.9	51.3	0	0	0	0	110.2
72	I	28.9	Very low	29.4	Very low	175 Å²	175	146.8 Å²	146.8	90%	0.897	80%	0.798	S	S	*	*				87.1	118.1	85.7	-71.2	156.6	0	0	0	113
73	G	31.4	Very low	29.2	Very low	78 Å²	78	144.7 Å²	144.7	80%	0.804	78%	0.784	S	S	*	*			trans	150.4	80.6	166.9	0	0	0	0	0	117.4
74	Q	25.7	Very low	29.3	Very low	191 Å²	191	148 Å²	148	89%	0.893	79%	0.792	S	S	*	*			trans	-102.1	167.9	158.1	-95.6	-163.8	-5.6	0	0	109.3
75	P	32.2	Very low	29.1	Very low	129 Å²	129	148.6 Å²	148.6	84%	0.838	78%	0.784	S	S	*	*			cis	-126.1	-159.8	25.9	45.5	-29	0	0	0	112.9
76	G	31.4	Very low	29.1	Very low	68 Å²	68	146.3 Å²	146.3	70%	0.701	78%	0.78	S	S	*	*			cis	-176.4	-164.1	7.3	0	0	0	0	0	113.9
77	Y	25.5	Very low	28.9	Very low	229 Å²	229	140.6 Å²	140.6	90%	0.898	77%	0.768	S	S	*	*			trans	-112.5	165.8	176.1	-71.1	-87.6	0	0	0	112.1
78	P	32.2	Very low	29	Very low	120 Å²	120	140.2 Å²	140.2	78%	0.779	77%	0.773	S	S	*	*				-142.1	158.5	96.5	38.3	-24.7	0	0	0	116.2
79	L	24.3	Very low	28.9	Very low	167 Å²	167	139.6 Å²	139.6	87%	0.874	77%	0.77	S	S	*	*			trans	-69	146.3	162.1	-75.6	137	0	0	0	111.1
80	I	31.4	Very low	28.8	Very low	146 Å²	146	138.3 Å²	138.3	75%	0.749	78%	0.776	S	S	*	*			trans	-134.2	105.9	153.3	-61.3	-177.6	0	0	0	108.6
81	E	24.8	Very low	28.9	Very low	145 Å²	145	136.6 Å²	136.6	68%	0.678	78%	0.782	S	S	*	*			trans	-81.3	138.2	156.5	179	179.8	-177.8	0	0	107.8	Q83	E81-Q83 PolarHBondContact OE1-NE2 3.23Å
82	N	32	Very low	28.7	Very low	142 Å²	142	137 Å²	137	76%	0.759	79%	0.785	S	S	*	*			trans	-152.3	106.5	160.3	-107.1	-29.8	0	0	0	110.4
83	Q	26.9	Very low	28.8	Very low	131 Å²	131	134.4 Å²	134.4	61%	0.612	78%	0.783	S	S	*	*			trans	-73.5	140.1	167.5	-57.1	170.4	13.8	0	0	108.6	E81	E81-Q83 PolarHBondContact OE1-NE2 3.23Å
84	F	30.1	Very low	28.7	Very low	208 Å²	208	135.3 Å²	135.3	91%	0.912	78%	0.777	S	S	*	*			trans	-129.8	118.8	154.7	-111	-85.8	0	0	0	110.1
85	I	26.8	Very low	28.9	Very low	133 Å²	133	136.5 Å²	136.5	68%	0.682	78%	0.78	S	S	*	*			trans	-90.7	143.8	-175.1	-55	165.4	0	0	0	107.9
86	S	29.9	Very low	28.6	Very low	100 Å²	100	135.7 Å²	135.7	70%	0.699	77%	0.772	S	S	*	*				152.5	113.8	126.9	-67	0	0	0	0	115
87	S	26.1	Very low	28.4	Very low	102 Å²	102	139.3 Å²	139.3	71%	0.713	78%	0.775	S	S	*	*			trans	45.9	127.2	132.9	65.6	0	0	0	0	122.4
88	L	29.3	Very low	28.6	Very low	161 Å²	161	133.5 Å²	133.5	84%	0.843	77%	0.774	S	S	*	*				164.6	81.7	128	-88.5	150.9	0	0	0	107.7
89	S	27	Very low	28.3	Very low	94 Å²	94	133.5 Å²	133.5	66%	0.657	77%	0.772	S	S	*	*				61.8	124.5	80.9	77.8	0	0	0	0	116.5
90	S	27.8	Very low	28.7	Very low	113 Å²	113	131.6 Å²	131.6	79%	0.79	77%	0.773	S	S	*	*			trans	60.9	115	154.4	63.2	0	0	0	0	120.5
91	S	31.4	Very low	28.6	Very low	129 Å²	129	130.2 Å²	130.2	90%	0.902	78%	0.776	S	S	*	*				-159.8	138.5	96.9	60.7	0	0	0	0	112.1
92	S	27	Very low	29	Very low	115 Å²	115	130.3 Å²	130.3	80%	0.804	79%	0.786	S	S	*	*			trans	-115.2	143.9	-177.9	51.4	0	0	0	0	110.5
93	S	31.6	Very low	28.9	Very low	121 Å²	121	128.6 Å²	128.6	85%	0.846	79%	0.785	S	S	*	*			trans	-145.7	103.6	162.7	58.2	0	0	0	0	111.4
94	S	28.9	Very low	29.3	Very low	98 Å²	98	126.8 Å²	126.8	69%	0.685	79%	0.787	S	S	*	*			trans	-77.3	153.3	174.3	-44.8	0	0	0	0	111.7
95	F	29.9	Very low	29.4	Very low	216 Å²	216	122.4 Å²	122.4	95%	0.947	78%	0.782	S	S	*	*			trans	-125.3	134.3	150.8	-100.2	-86.4	0	0	0	109.2
96	T	26.8	Very low	29.7	Very low	111 Å²	111	120 Å²	120	68%	0.681	78%	0.782	S	S	*	*			trans	-133.9	139.3	-167.3	40.3	0	0	0	0	112.4
97	L	26.5	Very low	29.9	Very low	144 Å²	144	120.2 Å²	120.2	75%	0.754	78%	0.784	S	S	*	*			trans	55.9	125.8	155.6	-79.7	92.3	0	0	0	120	T99	L97-T99 HydrophobicContact CD2-CG2 4.1Å
98	A	29.4	Very low	30.2	Very low	108 Å²	108	121.1 Å²	121.1	89%	0.893	79%	0.79	S	S	*	*			trans	-133.9	111.8	131	0	0	0	0	0	109.1
99	T	25.9	Very low	30.3	Very low	119 Å²	119	117.7 Å²	117.7	73%	0.73	79%	0.785	S	S	*	*			trans	-107.4	132.7	171.4	49.2	0	0	0	0	109.7	L97	L97-T99 HydrophobicContact CD2-CG2 4.1Å
100	S	33.2	Very low	30.4	Very low	128 Å²	128	117.2 Å²	117.2	90%	0.895	79%	0.787	S	S	*	*			trans	-131.6	107.9	166.1	45.2	0	0	0	0	110.5
101	S	28.9	Very low	30.4	Very low	116 Å²	116	117 Å²	117	81%	0.811	79%	0.786	S	S	*	*			trans	-93.9	138.4	173.7	55.1	0	0	0	0	110.9
102	V	33.7	Very low	30.5	Very low	148 Å²	148	117.5 Å²	117.5	90%	0.897	78%	0.783	S	S	*	*			trans	-137.2	130.3	157.4	-93.2	0	0	0	0	110.7
103	S	30	Very low	30.5	Very low	105 Å²	105	116.2 Å²	116.2	73%	0.734	78%	0.779	S	S	*	*			trans	-71.9	168.6	174.9	54.4	0	0	0	0	110.9
104	S	35	Very low	30.4	Very low	94 Å²	94	115.4 Å²	115.4	66%	0.657	77%	0.773	S	S	*	*				-179.9	150	70.6	-54.5	0	0	0	0	112.8
105	S	32.5	Very low	30.4	Very low	115 Å²	115	115.6 Å²	115.6	80%	0.804	78%	0.775	S	S	*	*			trans	51	145	140.7	58	0	0	0	0	122.2
106	A	33.2	Very low	30.4	Very low	82 Å²	82	110.4 Å²	110.4	68%	0.678	77%	0.765	S	S	*	*			cis	-174.8	173.7	-9	0	0	0	0	0	110.7
107	S	33.4	Very low	30.5	Very low	105 Å²	105	110.3 Å²	110.3	73%	0.734	77%	0.769	S	S	*	*			trans	63.5	117.8	151.4	44.6	0	0	0	0	118.9
108	S	33	Very low	30.7	Very low	121 Å²	121	109.4 Å²	109.4	85%	0.846	78%	0.775	S	S	*	*				113.5	153.4	71.2	-76	0	0	0	0	109
109	A	30.7	Very low	30.6	Very low	89 Å²	89	109.5 Å²	109.5	74%	0.736	77%	0.769	S	S	*	*			cis	-164.1	149.9	-20	0	0	0	0	0	110.4
110	A	30	Very low	30.7	Very low	85 Å²	85	111.8 Å²	111.8	70%	0.702	78%	0.776	S	S	*	*			trans	65.3	129.4	135.7	0	0	0	0	0	124.8
111	S	28.6	Very low	30.3	Very low	109 Å²	109	110.7 Å²	110.7	76%	0.762	77%	0.768	S	S	*	*			trans	66.6	156.4	142.8	60.9	0	0	0	0	118.4
112	V	32.1	Very low	30.2	Very low	138 Å²	138	111.8 Å²	111.8	84%	0.836	76%	0.763	S	S	*	*			cis	-148	172.6	29.7	-147.6	0	0	0	0	112.3
113	A	26.9	Very low	30	Very low	88 Å²	88	113.1 Å²	113.1	73%	0.727	76%	0.76	S	S	*	*			trans	-58.2	173.4	172.9	0	0	0	0	0	113.9
114	S	30.3	Very low	29.7	Very low	104 Å²	104	114.9 Å²	114.9	73%	0.727	76%	0.76	S	S	*	*				-179.5	159.2	50.2	50.3	0	0	0	0	113.9
115	S	27.6	Very low	29.4	Very low	103 Å²	103	116.4 Å²	116.4	72%	0.72	77%	0.767	S	S	*	*			trans	19.3	138.9	149.3	60.3	0	0	0	0	120.4
116	S	31.7	Very low	28.9	Very low	106 Å²	106	117.9 Å²	117.9	74%	0.741	77%	0.765	S	S	*	*				-177.8	151.7	66.8	40.7	0	0	0	0	114.9
117	S	27.5	Very low	28.7	Very low	109 Å²	109	119.4 Å²	119.4	76%	0.762	77%	0.765	S	S	*	*			trans	-6.5	139.1	156.3	55.3	0	0	0	0	121.3
118	S	32	Very low	28.5	Very low	125 Å²	125	121.7 Å²	121.7	87%	0.874	77%	0.769	S	S	*	*				-167.3	124.7	104.9	32.3	0	0	0	0	113.3
119	S	25.9	Very low	28	Very low	111 Å²	111	122.9 Å²	122.9	78%	0.776	76%	0.762	S	S	*	*			trans	-89.2	141.9	171.1	51.4	0	0	0	0	111.1
120	L	29.5	Very low	28	Very low	167 Å²	167	127 Å²	127	87%	0.874	77%	0.77	S	S	*	*			trans	-149.7	92	159	-107	161.6	0	0	0	110.4
121	S	23.6	Very low	27.8	Very low	104 Å²	104	130.1 Å²	130.1	73%	0.727	77%	0.768	S	S	*	*			trans	-68.6	156.4	159.9	-45.1	0	0	0	0	109.9
122	I	27.8	Very low	27.8	Very low	139 Å²	139	135 Å²	135	71%	0.713	77%	0.771	S	S	*	*			trans	-179.5	138.7	137.7	-98	154.5	0	0	0	112.9
123	Q	29	Very low	27.5	Very low	176 Å²	176	132.8 Å²	132.8	82%	0.822	76%	0.762	S	S	*	*			trans	68.7	100.7	159	-77.7	154.6	8.4	0	0	122.3
124	I	23	Very low	27.7	Very low	143 Å²	143	135.6 Å²	135.6	73%	0.733	77%	0.765	S	S	*	*			trans	-71	154.4	147.3	-60.1	157.6	0	0	0	109.8	I126	I124-I126 HydrophobicContact CG2-CG1 3.82Å
125	P	28.4	Very low	27.9	Very low	126 Å²	126	137.6 Å²	137.6	82%	0.818	76%	0.762	S	S	*	*			trans	-120.4	131.5	133.8	24	-10.2	0	0	0	112.8
126	I	23.7	Very low	28.2	Very low	145 Å²	145	140.1 Å²	140.1	74%	0.744	77%	0.766	S	S	*	*			trans	-78.1	-175.2	171.6	-64.2	159.2	0	0	0	108.3	I124	I124-I126 HydrophobicContact CG2-CG1 3.82Å
127	V	27.9	Very low	28.6	Very low	114 Å²	114	140.9 Å²	140.9	69%	0.691	76%	0.762	S	S	*	*			trans	98.6	98.5	157.9	-172.2	0	0	0	0	112.4
128	N	28.6	Very low	28.8	Very low	153 Å²	153	144 Å²	144	82%	0.818	76%	0.759	S	S	*	*				-160.9	144.9	53.8	-102.7	-35.8	0	0	0	113.7
129	E	24.2	Very low	29	Very low	147 Å²	147	144.1 Å²	144.1	69%	0.687	75%	0.748	S	S	*	*			trans	-73	151.3	157	-76.5	-160.7	155.7	0	0	111	K131	E129-K131 IonicContact OE2-NZ 3.95Å
130	L	30.2	Very low	29.5	Very low	175 Å²	175	146 Å²	146	92%	0.916	75%	0.745	S	S	*	*			trans	-138.8	107.2	144.3	-102.1	167.8	0	0	0	109.7
131	K	26.4	Very low	29.8	Very low	150 Å²	150	145.3 Å²	145.3	65%	0.652	74%	0.737	S	S	*	*			trans	-65.3	155	169.1	-79.1	168.7	174.6	158.8	0	111.6	E129	E129-K131 IonicContact OE2-NZ 3.95Å
132	Y	27	Very low	30.4	Very low	213 Å²	213	148.9 Å²	148.9	84%	0.835	74%	0.739	S	S	*	*				158.8	101.5	129.1	-89.7	-71	0	0	0	106.9
133	S	27.4	Very low	30.8	Very low	91 Å²	91	148.8 Å²	148.8	64%	0.636	74%	0.74	S	S	*	*				67.3	110.4	95.9	-62.1	0	0	0	0	113.9
134	N	30.4	Very low	31.2	Very low	147 Å²	147	145.2 Å²	145.2	79%	0.786	74%	0.735	S	S	*	*			trans	154.2	88.1	140	-78	-6.9	0	0	0	110.1
135	H	33.4	Very low	31.9	Very low	145 Å²	145	145.8 Å²	145.8	67%	0.671	74%	0.735	S	S	*	*			trans	-144.3	21.9	165.5	-140.6	-73.5	0	0	0	113.8	Y138	H135-Y138 AromaticContact CE1-CG 3.83Å
136	L	35.7	Very low	32	Very low	156 Å²	156	148.6 Å²	148.6	82%	0.817	74%	0.739	S	S	*	*	S	Bend	trans	-83.1	-21.1	178	-140.8	73.3	0	0	0	112.9
137	D	38.2	Very low	32.6	Very low	122 Å²	122	151.9 Å²	151.9	65%	0.652	75%	0.748	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.4	-20.2	-176.9	-65.7	-38.7	0	0	0	114.2	I139	D137-I139 PolarHBondContact O-N 2.77Å
138	Y	31.6	Very low	32.8	Very low	175 Å²	175	151.8 Å²	151.8	69%	0.686	75%	0.752	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.1	-11.6	-171.7	-146	-94.7	0	0	0	114.3	H135	H135-Y138 AromaticContact CE1-CG 3.83Å
139	I	36.2	Very low	33.1	Very low	128 Å²	128	149.8 Å²	149.8	66%	0.656	75%	0.747	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.7	-20.4	-176.8	-64	177.9	0	0	0	112.3	D137 N143	D137-I139 PolarHBondContact O-N 2.77Å; I139-N143 PolarHBondContact O-ND2 2.86Å
140	Q	38.3	Very low	33.4	Very low	151 Å²	151	150.2 Å²	150.2	71%	0.706	75%	0.752	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.6	-28.4	178.6	-74.4	-173.5	-18.4	0	0	113.7	F142	Q140-F142 VanDerWaalsContact C-N 3.3Å; Q140-F142 PolarHBondContact O-N 3.36Å
141	H	34.6	Very low	33.3	Very low	151 Å²	151	151.4 Å²	151.4	70%	0.699	75%	0.745	S	S	*	*	G	3₁₀ helix	trans	-71.4	-21.2	-179.3	-160.2	-59.1	0	0	0	113.7
142	F	36.1	Very low	33.5	Very low	179 Å²	179	150.4 Å²	150.4	79%	0.785	75%	0.747	S	S	*	*	G	3₁₀ helix	trans	-85	-11	-174.2	-125.6	-88.8	0	0	0	115	Q140	Q140-F142 VanDerWaalsContact C-N 3.3Å; Q140-F142 PolarHBondContact O-N 3.36Å
143	N	36	Very low	33.6	Very low	137 Å²	137	146.6 Å²	146.6	73%	0.733	74%	0.74	S	S	*	*	G	3₁₀ helix	trans	-99.8	3.1	-170.9	-80.3	-54.4	0	0	0	115.5	I139	I139-N143 PolarHBondContact O-ND2 2.86Å
144	S	38.3	Very low	33.7	Very low	101 Å²	101	151.4 Å²	151.4	71%	0.706	75%	0.749	S	S	*	*	S	Bend	trans	-111.7	4.8	-166	-59.5	0	0	0	0	117
145	Q	36.6	Very low	33.8	Very low	156 Å²	156	149.2 Å²	149.2	73%	0.729	74%	0.743	S	S	*	*	S	Bend	trans	-128.7	3.4	-168.5	-77.4	-145	50.3	0	0	119
146	M	30.5	Very low	33.6	Very low	185 Å²	185	149 Å²	149	91%	0.911	75%	0.752	S	S	*	*			trans	-136.6	79.4	178.1	-70.6	-71.6	166	0	0	112.8
147	K	36.2	Very low	33.2	Very low	213 Å²	213	146.3 Å²	146.3	93%	0.926	75%	0.746	S	S	*	*			trans	-94.9	140	155.7	-96.6	-179.8	174.7	176.6	0	109.3
148	S	32.7	Very low	32.8	Very low	113 Å²	113	147.5 Å²	147.5	79%	0.79	75%	0.751	S	S	*	*			trans	-50.6	174.3	175.3	-42.2	0	0	0	0	114.2
149	P	35.1	Very low	32.6	Very low	110 Å²	110	148.4 Å²	148.4	71%	0.714	76%	0.755	S	S	*	*			cis	-151.2	168.9	22.5	42.4	-20.7	0	0	0	120.9
150	M	30.8	Very low	32.4	Very low	157 Å²	157	149 Å²	149	77%	0.773	75%	0.754	S	S	*	*			trans	51.6	130.9	137.9	-67.8	175.7	61.4	0	0	123.9
151	Y	28.7	Very low	32.1	Very low	199 Å²	199	148.2 Å²	148.2	78%	0.78	75%	0.751	S	S	*	*			trans	27.4	137.8	138	-55.4	-83.2	0	0	0	120.1
152	D	29.4	Very low	32.2	Very low	129 Å²	129	148.8 Å²	148.8	69%	0.69	75%	0.753	S	S	*	*			cis	-161.5	157.9	43.2	-115.5	-26	0	0	0	115.9
153	I	30.6	Very low	32.2	Very low	134 Å²	134	144.8 Å²	144.8	69%	0.687	75%	0.747	S	S	*	*			trans	43.1	108.9	142.5	-59.3	160	0	0	0	121.7
154	K	28.7	Very low	32.1	Very low	192 Å²	192	145 Å²	145	84%	0.835	75%	0.749	S	S	*	*				38.8	160.6	128.8	-77.4	-176.7	177.3	177.2	0	122.9
155	P	32.8	Very low	32	Very low	101 Å²	101	148 Å²	148	66%	0.656	76%	0.756	S	S	*	*			cis	-141.8	-160.1	-48.3	38.5	-16.1	0	0	0	113.1
156	T	28.8	Very low	32	Very low	140 Å²	140	147 Å²	147	86%	0.859	76%	0.761	S	S	*	*			trans	97.7	157.6	161.1	74.4	0	0	0	0	120.3
157	S	27.2	Very low	32.1	Very low	100 Å²	100	144.1 Å²	144.1	70%	0.699	76%	0.758	S	S	*	*			trans	-97.3	164.3	-158.2	49.7	0	0	0	0	115.3
158	I	29	Very low	32	Very low	147 Å²	147	140.9 Å²	140.9	75%	0.754	76%	0.756	S	S	*	*				166.3	116.1	125.1	-85	155.6	0	0	0	113.1
159	Y	27.9	Very low	32.1	Very low	193 Å²	193	141.9 Å²	141.9	76%	0.757	75%	0.752	S	S	*	*			trans	38.4	131.8	140.5	-69.5	-71	0	0	0	127.5
160	H	31.7	Very low	32.1	Very low	141 Å²	141	143.3 Å²	143.3	65%	0.653	75%	0.754	S	S	*	*				85.3	126.6	122.2	-84.3	-44.8	0	0	0	127.4
161	H	32.8	Very low	32.2	Very low	135 Å²	135	143 Å²	143	63%	0.625	76%	0.755	S	S	*	*				109.1	141.7	117.4	-96.7	-57.6	0	0	0	125
162	H	35.4	Very low	32.4	Very low	162 Å²	162	137 Å²	137	75%	0.75	75%	0.754	S	S	*	*			trans	78.4	146.7	157.8	-67.8	-58.8	0	0	0	120.2
163	S	37.6	Very low	32.7	Very low	95 Å²	95	137.9 Å²	137.9	66%	0.664	76%	0.759	S	S	*	*			cis	-170.3	145.4	-6.2	47	0	0	0	0	115.8
164	N	34.3	Very low	32.8	Very low	143 Å²	143	138.2 Å²	138.2	77%	0.765	76%	0.762	S	S	*	*			trans	35	138.6	143.3	-56.9	-0.7	0	0	0	125.9
165	N	34.8	Very low	33.2	Very low	162 Å²	162	134.4 Å²	134.4	87%	0.866	76%	0.759	S	S	*	*				-178.7	160.5	110	-91.1	-17	0	0	0	115.2
166	T	36.3	Very low	33.1	Very low	136 Å²	136	138.7 Å²	138.7	83%	0.834	77%	0.768	S	S	*	*			trans	-137.2	159.6	-160.6	44.7	0	0	0	0	116
167	C	32.9	Very low	33.2	Very low	124 Å²	124	141.3 Å²	141.3	84%	0.838	77%	0.768	S	S	*	*			trans	173.9	173.5	150.9	52.7	0	0	0	0	111
168	V	35.2	Very low	33.6	Very low	146 Å²	146	141.6 Å²	141.6	89%	0.885	77%	0.769	S	S	*	*			cis	-155.6	170.2	-41.2	142.7	0	0	0	0	107.4
169	N	33.6	Very low	33.6	Very low	133 Å²	133	144.2 Å²	144.2	71%	0.711	78%	0.775	S	S	*	*			trans	-120	165.4	-166.9	-161.7	5	0	0	0	114.5
170	N	34.7	Very low	34	Very low	141 Å²	141	140.7 Å²	140.7	75%	0.754	78%	0.776	S	S	*	*			trans	176.3	113.5	144.5	-94.2	-27.6	0	0	0	118.3
171	N	33.9	Very low	34.3	Very low	150 Å²	150	138.9 Å²	138.9	80%	0.802	78%	0.777	S	S	*	*			trans	40.7	137.9	136.2	-61.7	-15.3	0	0	0	126.3
172	G	33.7	Very low	34.2	Very low	72 Å²	72	140.1 Å²	140.1	74%	0.742	79%	0.788	S	S	*	*			trans	159.1	82.4	144.1	0	0	0	0	0	123.2
173	N	35	Very low	34	Very low	149 Å²	149	136.4 Å²	136.4	80%	0.797	79%	0.793	S	S	*	*			trans	60.4	122.6	139.4	-64.7	-10.4	0	0	0	127
174	N	33.5	Very low	33.5	Very low	140 Å²	140	137.4 Å²	137.4	75%	0.749	80%	0.8	S	S	*	*				80.2	117.8	125.5	-67.5	-14.7	0	0	0	126.1
175	S	35.9	Very low	33.3	Very low	112 Å²	112	137.7 Å²	137.7	78%	0.783	81%	0.807	S	S	*	*				126.4	121.1	114.7	70.2	0	0	0	0	121.8
176	K	31.3	Very low	32.8	Very low	191 Å²	191	135.1 Å²	135.1	83%	0.83	80%	0.802	S	S	*	*			trans	30.7	132.1	144.9	-61.8	177	176.9	177.7	0	122.2
177	F	31.1	Very low	32.4	Very low	196 Å²	196	136.7 Å²	136.7	86%	0.86	81%	0.805	S	S	*	*				-177.1	131.5	103.9	-113	-92.3	0	0	0	115.4
178	S	34.2	Very low	32.1	Very low	105 Å²	105	135.9 Å²	135.9	73%	0.734	80%	0.796	S	S	*	*			trans	31.2	136.1	150.7	-53	0	0	0	0	127.9
179	K	30.3	Very low	31.6	Very low	203 Å²	203	138.6 Å²	138.6	88%	0.883	79%	0.791	S	S	*	*			trans	-67.7	-179.2	154.3	-96	179.7	178.5	179.4	0	112.3
180	P	35.7	Very low	31.3	Very low	118 Å²	118	135.9 Å²	135.9	77%	0.766	80%	0.795	S	S	*	*			cis	-151.1	-147.8	36.3	53.6	-30.6	0	0	0	115.1
181	P	39	Very low	30.8	Very low	104 Å²	104	134.1 Å²	134.1	68%	0.675	79%	0.794	S	S	*	*			trans	-136.2	-158.9	-133.2	35.9	-7.5	0	0	0	116.7
182	N	30.5	Very low	30.7	Very low	161 Å²	161	134.6 Å²	134.6	86%	0.861	80%	0.795	S	S	*	*			trans	85.1	137.8	161.6	-58.4	-8.8	0	0	0	119.3
183	G	31.6	Very low	30.5	Very low	83 Å²	83	139.7 Å²	139.7	86%	0.856	80%	0.799	S	S	*	*			trans	160.9	89	173	0	0	0	0	0	113.8
184	S	26.1	Very low	30	Very low	116 Å²	116	138.8 Å²	138.8	81%	0.811	80%	0.8	S	S	*	*			trans	-99.7	132.3	179	53.9	0	0	0	0	112.7
185	T	30.5	Very low	29.9	Very low	149 Å²	149	139.2 Å²	139.2	91%	0.914	81%	0.807	S	S	*	*			trans	-147.8	130	158	36.4	0	0	0	0	111.8
186	S	24.1	Very low	29.5	Very low	108 Å²	108	142 Å²	142	76%	0.755	81%	0.813	S	S	*	*			trans	-95.9	146.8	163.3	114.3	0	0	0	0	108.4
187	L	28.6	Very low	29.5	Very low	170 Å²	170	138.8 Å²	138.8	89%	0.89	82%	0.815	S	S	*	*			trans	-156	152.8	155.1	-109.3	169.9	0	0	0	111.3
188	T	25	Very low	29.6	Very low	106 Å²	106	138.5 Å²	138.5	65%	0.65	81%	0.813	S	S	*	*			trans	-122.9	173.5	-164	46.7	0	0	0	0	112.9
189	Y	25.1	Very low	29.3	Very low	203 Å²	203	143.1 Å²	143.1	80%	0.796	82%	0.82	S	S	*	*			trans	78.8	141.7	160.1	-89.1	-82.7	0	0	0	120.7
190	G	28.7	Very low	29.5	Very low	77 Å²	77	139.4 Å²	139.4	79%	0.794	82%	0.819	S	S	*	*			trans	166	78	174.1	0	0	0	0	0	112.5
191	S	24	Very low	29.3	Very low	104 Å²	104	137.7 Å²	137.7	73%	0.727	82%	0.815	S	S	*	*			trans	-97.3	131	176.4	-56.9	0	0	0	0	111.1
192	I	30.2	Very low	28.8	Very low	160 Å²	160	137.9 Å²	137.9	82%	0.821	81%	0.81	S	S	*	*			trans	-139.5	107.9	160.5	-60.9	-174.5	0	0	0	111.3
193	E	31	Very low	28.8	Very low	179 Å²	179	138.1 Å²	138.1	84%	0.836	81%	0.81	S	S	*	*			trans	43.7	134.8	133.7	-55.7	-176.3	158.5	0	0	124.8
194	T	24.7	Very low	28.8	Very low	130 Å²	130	140.7 Å²	140.7	80%	0.798	80%	0.803	S	S	*	*			trans	-44.8	144.6	168.6	47.3	0	0	0	0	119
195	V	31.3	Very low	29.3	Very low	149 Å²	149	142.9 Å²	142.9	90%	0.903	80%	0.8	S	S	*	*			trans	-147.1	132	135.5	-116.7	0	0	0	0	111.8
196	N	25.8	Very low	29.4	Very low	171 Å²	171	142.3 Å²	142.3	91%	0.914	79%	0.791	S	S	*	*			trans	-82.8	130	169.1	-85.7	-37	0	0	0	110.3
197	S	32.1	Very low	30.1	Very low	123 Å²	123	146.7 Å²	146.7	86%	0.86	80%	0.797	S	S	*	*			trans	-158.3	160.2	144.2	-160.4	0	0	0	0	112.3
198	K	32.9	Very low	30.4	Very low	190 Å²	190	147.2 Å²	147.2	83%	0.826	80%	0.795	S	S	*	*			trans	-89.8	154.4	-170.4	-62.4	167.5	178.6	173.5	0	111.7
199	K	29	Very low	30.7	Very low	201 Å²	201	150 Å²	150	87%	0.874	81%	0.805	S	S	*	*			trans	59.5	122.1	166.7	-66.3	-178.8	173.1	-176.4	0	116.3
200	S	32.9	Very low	31.1	Very low	125 Å²	125	147.4 Å²	147.4	87%	0.874	80%	0.804	S	S	*	*				178.7	156.6	109.4	-76.2	0	0	0	0	110.6
201	A	31.5	Very low	31.5	Very low	82 Å²	82	151.9 Å²	151.9	68%	0.678	81%	0.806	S	S	*	*			trans	-86.1	163.1	-172.9	0	0	0	0	0	113.6
202	L	28.9	Very low	32.2	Very low	109 Å²	109	156.2 Å²	156.2	57%	0.571	81%	0.812	S	S	*	*			trans	60	104.8	144.9	-157.9	118.8	0	0	0	118.5	Y646	L202-Y646 WeakPolarHBondContact CD1-OH 3.43Å
203	L	30.5	Very low	32.4	Very low	165 Å²	165	155.4 Å²	155.4	86%	0.864	81%	0.809	S	S	*	*			trans	-139.3	94.9	146.7	-162.1	71.6	0	0	0	110.5
204	I	31.8	Very low	32.8	Very low	138 Å²	138	154.4 Å²	154.4	71%	0.708	81%	0.81	S	S	*	*			trans	-89.1	119.7	163.4	-63.3	173.4	0	0	0	106.6
205	H	35.9	Very low	33.3	Very low	161 Å²	161	155 Å²	155	75%	0.745	80%	0.801	S	S	*	*			trans	-123.6	117.3	166.1	-164.8	-70.4	0	0	0	110.1
206	N	32.7	Very low	33.4	Very low	137 Å²	137	154.4 Å²	154.4	73%	0.733	79%	0.793	S	S	*	*			trans	-64.8	140.6	174.9	-81.5	-55.9	0	0	0	111.5
207	K	39.9	Very low	33.8	Very low	201 Å²	201	154.7 Å²	154.7	87%	0.874	79%	0.793	S	S	*	*			trans	-154.7	97.7	149.5	-136.3	175.5	-176.7	-179.3	0	111.2
208	Q	34.7	Very low	33.8	Very low	181 Å²	181	155.5 Å²	155.5	85%	0.846	78%	0.783	S	S	*	*			trans	-95.3	163.6	159.1	-78.9	-178.7	-25	0	0	109.5
209	L	31.9	Very low	33.9	Very low	164 Å²	164	151.4 Å²	151.4	86%	0.859	78%	0.778	S	S	*	*			trans	76	102.8	177.4	-56.9	168.8	0	0	0	116.3
210	L	33.4	Very low	34.1	Very low	149 Å²	149	148.2 Å²	148.2	78%	0.78	77%	0.77	S	S	*	*				-167.5	130.1	120.4	-99	154.5	0	0	0	110.2
211	M	36.2	Very low	34.3	Very low	170 Å²	170	149.8 Å²	149.8	84%	0.837	77%	0.769	S	S	*	*			trans	60.5	104.3	159.4	-61.1	162.5	173.6	0	0	116.7
212	K	39.7	Very low	34.3	Very low	195 Å²	195	153.1 Å²	153.1	85%	0.848	77%	0.774	S	S	*	*				56	133.6	65.8	-82.3	-168.6	173.5	-176.1	0	115.1
213	N	34.7	Very low	34.7	Very low	143 Å²	143	154.8 Å²	154.8	77%	0.765	78%	0.782	S	S	*	*			trans	79.6	129	178.6	-51.6	2.5	0	0	0	112.5
214	D	37.4	Very low	34.9	Very low	159 Å²	159	153.3 Å²	153.3	85%	0.85	77%	0.771	S	S	*	*			cis	-131.2	161.1	13.9	-74.1	-58.5	0	0	0	114.1
215	K	37.2	Very low	35	Very low	143 Å²	143	152.1 Å²	152.1	62%	0.622	77%	0.773	S	S	*	*			trans	-107.6	169.4	171.8	-74.3	-170.9	-179.6	-178	0	111.2	E430	K215-E430 IonicContact NZ-OE1 3.51Å; K215-E430 PolarHBondContact NZ-OE1 2.89Å
216	N	32	Very low	34.8	Very low	135 Å²	135	150.9 Å²	150.9	72%	0.722	77%	0.772	S	S	*	*			trans	78.7	110.4	160.1	-55.3	-17.4	0	0	0	116.8
217	I	33.7	Very low	35.2	Very low	178 Å²	178	150 Å²	150	91%	0.913	78%	0.777	S	S	*	*				-142.3	133.2	101.4	-90.2	149.1	0	0	0	107.1
218	E	32	Very low	35	Very low	140 Å²	140	145.5 Å²	145.5	65%	0.654	77%	0.77	S	S	*	*			trans	-114.1	-179.4	-174.2	-147.1	172.9	-157.2	0	0	109.5
219	S	36	Very low	35.3	Very low	104 Å²	104	142.6 Å²	142.6	73%	0.727	77%	0.765	S	S	*	*			trans	93.9	108.3	177.1	-40.4	0	0	0	0	114
220	N	33.4	Very low	35.6	Very low	133 Å²	133	143.1 Å²	143.1	71%	0.711	76%	0.763	S	S	*	*				76.5	97	59.8	-68.5	-28.9	0	0	0	112.9
221	D	36.3	Very low	35.7	Very low	159 Å²	159	144.7 Å²	144.7	85%	0.85	77%	0.766	S	S	*	*			trans	-135.2	109	146.3	-90.5	-45.3	0	0	0	108.7
222	I	33.2	Very low	36.2	Very low	152 Å²	152	144.6 Å²	144.6	78%	0.779	77%	0.769	S	S	*	*			trans	-100.2	107.8	170.8	-66.4	167.2	0	0	0	106.3
223	I	36.5	Very low	36.3	Very low	144 Å²	144	142.9 Å²	142.9	74%	0.738	77%	0.769	S	S	*	*			trans	-112.1	113.1	167.2	-61.8	-178.5	0	0	0	108	C225	I223-C225 VanDerWaalsContact CG2-SG 3.6Å
224	H	34.4	Very low	37	Very low	134 Å²	134	143.9 Å²	143.9	62%	0.62	78%	0.775	S	S	*	*			trans	-110.3	98.5	180	178	-62.4	0	0	0	109
225	C	34.1	Very low	37.3	Very low	113 Å²	113	144 Å²	144	76%	0.764	78%	0.775	S	S	*	*			trans	-106.1	95.4	174.9	-60.5	0	0	0	0	110	I223	I223-C225 VanDerWaalsContact CG2-SG 3.6Å
226	N	32.3	Very low	37.8	Very low	134 Å²	134	140.9 Å²	140.9	72%	0.717	78%	0.784	S	S	*	*			trans	-92.1	123.4	155.5	-87	-4.6	0	0	0	107.1
227	S	40.3	Very low	38.5	Very low	119 Å²	119	142 Å²	142	83%	0.832	79%	0.79	S	S	*	*			trans	-135.8	132.8	150.1	-164.6	0	0	0	0	108.4
228	S	35.2	Very low	39	Very low	106 Å²	106	141.6 Å²	141.6	74%	0.741	78%	0.784	S	S	*	*			trans	-85.7	-166.1	164.2	-56.2	0	0	0	0	109.2
229	V	41.8	Very low	39.6	Very low	121 Å²	121	142 Å²	142	73%	0.733	79%	0.791	S	S	*	*			trans	82.8	127.8	-177.1	-174	0	0	0	0	112.1
230	E	39	Very low	40.2	Very low	175 Å²	175	144.4 Å²	144.4	82%	0.818	80%	0.795	S	S	*	*			cis	-155.1	173.4	-23.1	-119.6	145.3	-132.6	0	0	107.5
231	E	34.2	Very low	41.1	Very low	182 Å²	182	145.9 Å²	145.9	85%	0.85	80%	0.803	S	S	*	*			trans	-86.5	136.6	174.9	-65.7	167.2	168.5	0	0	109.5
232	D	46.4	Very low	41.9	Very low	167 Å²	167	145.3 Å²	145.3	89%	0.893	80%	0.8	S	S	*	*			trans	-145.4	118.5	160.4	-87.9	-43.3	0	0	0	107.9
233	D	42.4	Very low	43	Very low	160 Å²	160	145.3 Å²	145.3	86%	0.856	80%	0.802	S	S	*	*			trans	-86.6	144.4	170.5	-61.8	-59.8	0	0	0	109.5
234	D	49.6	Very low	43.8	Very low	164 Å²	164	141.5 Å²	141.5	88%	0.877	80%	0.798	S	S	*	*			trans	-151.9	125.2	155.2	-144.6	-0.3	0	0	0	111.3
235	D	44.2	Very low	44.9	Very low	162 Å²	162	142.3 Å²	142.3	87%	0.866	81%	0.807	S	S	*	*			trans	-94.3	137.5	175.9	-75.9	-55.3	0	0	0	109.1
236	G	46.3	Very low	46.1	Very low	77 Å²	77	144.7 Å²	144.7	79%	0.794	81%	0.807	S	S	*	*			trans	-159	56.3	-165.4	0	0	0	0	0	118.8
237	D	47.6	Very low	47.3	Very low	159 Å²	159	144.9 Å²	144.9	85%	0.85	81%	0.808	S	S	*	*			trans	63.4	145	146.8	-128.1	-9.2	0	0	0	122.1
238	E	43.7	Very low	48	Very low	168 Å²	168	146.3 Å²	146.3	79%	0.785	81%	0.806	S	S	*	*			trans	-85.3	152.1	176.8	-60.9	173.7	156.6	0	0	110.7
239	N	45.5	Very low	49.1	Very low	150 Å²	150	148.5 Å²	148.5	80%	0.802	81%	0.808	S	S	*	*			trans	-160.5	105.9	153.4	-94.9	-68.7	0	0	0	110.3
240	D	48.7	Very low	49.5	Very low	153 Å²	153	149.6 Å²	149.6	82%	0.818	81%	0.809	S	S	*	*			trans	-63.8	143.7	162.9	-62.9	-55.9	0	0	0	110.3
241	N	52.6	Low	49.8	Very low	165 Å²	165	148.2 Å²	148.2	88%	0.882	81%	0.808	S	S	*	*			trans	-147.5	143.5	148.7	-86.9	-70.9	0	0	0	109.6
242	D	51.8	Low	50.3	Low	146 Å²	146	146.4 Å²	146.4	78%	0.781	81%	0.809	S	S	*	*			trans	-97.1	-168.6	-164.5	-152.2	-15.2	0	0	0	111.9
243	D	57.4	Low	50.4	Low	153 Å²	153	144.7 Å²	144.7	82%	0.818	81%	0.805	S	S	*	*			trans	85.8	125.5	157.2	-54.8	-38.3	0	0	0	119.6
244	G	51.8	Low	50.6	Low	63 Å²	63	146.2 Å²	146.2	65%	0.649	81%	0.807	S	S	*	*			trans	131.7	82.7	147.2	0	0	0	0	0	118.3
245	D	59.1	Low	50.2	Low	152 Å²	152	147.1 Å²	147.1	81%	0.813	81%	0.806	S	S	*	*				24.2	150.1	121.5	-40	-26.9	0	0	0	120
246	E	58.3	Low	50.4	Low	163 Å²	163	144.6 Å²	144.6	76%	0.762	80%	0.801	S	S	*	*			cis	-166.9	-179.1	-12	-111.6	-177.3	162.2	0	0	106.8
247	D	57	Low	50.8	Low	138 Å²	138	149.1 Å²	149.1	74%	0.738	80%	0.801	S	S	*	*			trans	72.3	99.3	157.7	-61	-18.6	0	0	0	123.3
248	D	55.5	Low	50.4	Low	149 Å²	149	149.4 Å²	149.4	80%	0.797	80%	0.803	S	S	*	*				38.8	123	111.7	-97.8	-2.2	0	0	0	121.9
249	I	58.4	Low	50.9	Low	152 Å²	152	147.8 Å²	147.8	78%	0.779	80%	0.804	S	S	*	*				166.4	126.1	119	-85.1	155.7	0	0	0	113.9
250	N	49.5	Very low	50.9	Low	144 Å²	144	145.8 Å²	145.8	77%	0.77	80%	0.801	S	S	*	*			trans	41.2	127.6	154.9	-73.9	-23.3	0	0	0	124.5
251	D	45.2	Very low	50.6	Low	146 Å²	146	144.6 Å²	144.6	78%	0.781	81%	0.805	S	S	*	*			trans	-20.3	134.4	136.3	-61.6	-44.7	0	0	0	116.8
252	T	46.3	Very low	50.2	Low	144 Å²	144	141.3 Å²	141.3	88%	0.883	80%	0.795	S	S	*	*				-159.1	136.3	116.9	-65.4	0	0	0	0	108.9
253	V	48.3	Very low	49.7	Very low	131 Å²	131	141.7 Å²	141.7	79%	0.794	80%	0.797	S	S	*	*			trans	-85.3	132.1	177.3	-158.1	0	0	0	0	109.5
254	E	45.5	Very low	49	Very low	192 Å²	192	139 Å²	139	90%	0.897	79%	0.789	S	S	*	*			trans	-169.6	162.4	139.4	-108	163.6	-145.2	0	0	112.1
255	E	42.3	Very low	49.2	Very low	183 Å²	183	141.3 Å²	141.3	86%	0.855	79%	0.791	S	S	*	*			trans	-69.2	147.3	-162.8	-59.1	165.6	123.8	0	0	114.3
256	S	48.7	Very low	49	Very low	109 Å²	109	138.9 Å²	138.9	76%	0.762	78%	0.778	S	S	*	*				167.8	163.2	113.8	50.3	0	0	0	0	115.5
257	E	52.7	Low	49.1	Very low	171 Å²	171	135.8 Å²	135.8	80%	0.799	77%	0.766	S	S	*	*			trans	78.7	85.4	157.3	-42.9	-153.1	169.6	0	0	120.9
258	D	40.9	Very low	49.4	Very low	166 Å²	166	134.5 Å²	134.5	89%	0.888	76%	0.759	S	S	*	*				27.9	105	123.1	-63.7	-34.7	0	0	0	119.9
259	V	54.5	Low	49.9	Very low	133 Å²	133	131.7 Å²	131.7	81%	0.806	74%	0.741	S	S	*	*			trans	-135.2	121.2	160.8	-178.6	0	0	0	0	112.6
260	S	45.2	Very low	51.1	Low	108 Å²	108	129.5 Å²	129.5	76%	0.755	73%	0.727	S	S	*	*			trans	67.5	85.1	157.5	-62.6	0	0	0	0	119.6
261	S	42.6	Very low	53.4	Low	128 Å²	128	126.4 Å²	126.4	90%	0.895	71%	0.71	S	S	*	*			trans	-80.3	103.7	156.9	43.5	0	0	0	0	112.2
262	S	42.4	Very low	55.9	Low	97 Å²	97	119.6 Å²	119.6	68%	0.678	67%	0.674	S	S	*	*			trans	-164	127.7	158.5	57	0	0	0	0	112.5
263	N	41.8	Very low	58.3	Low	154 Å²	154	117.5 Å²	117.5	82%	0.824	65%	0.654	S	S	*	*			trans	71	90.7	174.5	-54.3	-13.1	0	0	0	117.3
264	C	43.9	Very low	60.6	Low	95 Å²	95	111.7 Å²	111.7	64%	0.642	62%	0.619	S	S	*	*			trans	-141.8	10.3	167.6	66.2	0	0	0	0	115.4
265	T	54.8	Low	63.2	Low	113 Å²	113	102.9 Å²	102.9	69%	0.693	58%	0.578	S	S	*	*	S	Bend	trans	-82.7	-22.7	179.6	46.2	0	0	0	0	114.1
266	D	54.9	Low	65.8	Low	101 Å²	101	96.5 Å²	96.5	54%	0.54	56%	0.561	S	S	.	*	S	Bend	trans	-81.3	-26.9	177	-80.7	-39.9	0	0	0	113.4	I268 Q269 H270	D266-I268 PolarHBondContact O-N 3.36Å; D266-I268 VanDerWaalsContact O-N 3.14Å; D266-Q269 VanDerWaalsContact O-CB 3.31Å; D266-Q269 WeakPolarHBondContact O-CB 3.4Å; D266-Q269 PolarHBondContact O-N 3.36Å; D266-Q269 PolarHBondContact OD1-NE2 3.36Å; D266-Q269 VanDerWaalsContact OD1-NE2 3.11Å; D266-H270 PolarHBondContact O-CD2 3.33Å; D266-H270 VanDerWaalsContact O-CD2 3.29Å
267	D	60	Low	68.1	Low	97 Å²	97	93.5 Å²	93.5	52%	0.519	54%	0.537	S	S	.	.	G	3₁₀ helix	trans	-60.2	-28.5	179.5	-71.5	-47.6	0	0	0	113.3	Q269 H270 L271	D267-Q269 PolarHBondContact O-N 3.22Å; D267-H270 CarbonylContact O-C 3.5Å; D267-H270 WeakPolarHBondContact O-CA 3.4Å; D267-H270 WeakPolarHBondContact O-CB 3.33Å; D267-H270 PolarHBondContact O-N 3.44Å; D267-L271 PolarHBondContact O-N 2.69Å
268	I	64.1	Low	70.1	Confident	112 Å²	112	95.5 Å²	95.5	57%	0.574	54%	0.537	S	S	*	.	G	3₁₀ helix	trans	-62.2	-30.3	175.5	-57	178.4	0	0	0	111.2	D266 H270	D266-I268 PolarHBondContact O-N 3.36Å; D266-I268 VanDerWaalsContact O-N 3.14Å; I268-H270 PolarHBondContact O-N 2.88Å
269	Q	66	Low	72.8	Confident	89 Å²	89	88.3 Å²	88.3	42%	0.416	50%	0.5	S	S	.	.	G	3₁₀ helix	trans	-71.6	-20	173	-50.8	-164.3	46.5	0	0	112.3	D266 D267 Y287	D266-Q269 VanDerWaalsContact O-CB 3.31Å; D266-Q269 WeakPolarHBondContact O-CB 3.4Å; D266-Q269 PolarHBondContact O-N 3.36Å; D266-Q269 PolarHBondContact OD1-NE2 3.36Å; D266-Q269 VanDerWaalsContact OD1-NE2 3.11Å; D267-Q269 PolarHBondContact O-N 3.22Å; Q269-Y287 WeakPolarHBondContact O-CD1 3.44Å; Q269-Y287 VanDerWaalsContact O-CE1 3.24Å; Q269-Y287 WeakPolarHBondContact O-CE1 3.32Å
270	H	84.4	Confident	74.7	Confident	106 Å²	106	84.7 Å²	84.7	49%	0.491	48%	0.48	S	S	.	.	G	3₁₀ helix	trans	-98.9	3.5	-177.8	-63.4	-64.8	0	0	0	114.4	D266 D267 I268 S279	D266-H270 PolarHBondContact O-CD2 3.33Å; D266-H270 VanDerWaalsContact O-CD2 3.29Å; D267-H270 CarbonylContact O-C 3.5Å; D267-H270 WeakPolarHBondContact O-CA 3.4Å; D267-H270 WeakPolarHBondContact O-CB 3.33Å; D267-H270 PolarHBondContact O-N 3.44Å; I268-H270 PolarHBondContact O-N 2.88Å; H270-S279 VanDerWaalsContact C-CB 3.5Å; H270-S279 WeakPolarHBondContact O-CA 3.24Å; H270-S279 WeakPolarHBondContact O-CB 3.24Å; H270-S279 PolarHBondContact O-N 2.95Å
271	L	96.2	Very high	77.1	Confident	80 Å²	80	80.8 Å²	80.8	42%	0.419	46%	0.458	S	S	.	.	B	Isolated β-bridge	trans	-102.2	149.4	175.6	-61.5	-176.8	0	0	0	113.8	D267 Q273	D267-L271 PolarHBondContact O-N 2.69Å; L271-Q273 PolarHBondContact O-N 3Å
272	C	98	Very high	79.7	Confident	3 Å²	3	81.2 Å²	81.2	2%	0.02	44%	0.443	C	S	.	.			trans	-75.2	110.6	178.8	175.7	0	0	0	0	111	V274 C275 G276 D277 C289	C272-V274 PolarHBondContact O-N 2.82Å; C272-C275 PolarHBondContact O-N 3.05Å; C272-C275 VanDerWaalsContact SG-SG 3.68Å; C272-G276 PolarHBondContact O-N 3.5Å; C272-D277 WeakPolarHBondContact CA-O 3.46Å; C272-D277 HydrophobicContact CB-CB 4.34Å; C272-D277 WeakPolarHBondContact CB-O 3.46Å; C272-D277 PolarHBondContact N-O 3.02Å; C272-C289 HydrophobicContact CB-CB 4.11Å; C272-C289 PolarHBondContact SG-N 2.85Å; C272-C289 VanDerWaalsContact SG-N 3.4Å; C272-C289 PolarHBondContact SG-SG 3.12Å
273	Q	96.8	Very high	82.3	Confident	99 Å²	99	78 Å²	78	46%	0.463	42%	0.417	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-5.6	-179.7	-62.3	-63.9	-33.7	0	0	114.7	L271 Y287 A335	L271-Q273 PolarHBondContact O-N 3Å; Q273-Y287 PolarHBondContact N-O 2.8Å; Q273-A335 HydrophobicContact CB-CB 4.31Å
274	V	98.1	Very high	85	Confident	9 Å²	9	72.7 Å²	72.7	6%	0.055	39%	0.386	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.6	-31.2	177.1	179.9	0	0	0	0	113	C272 T288 C292 V316 R331 C332 A335 M337	C272-V274 PolarHBondContact O-N 2.82Å; V274-T288 HydrophobicContact CG2-CG2 3.95Å; V274-C292 HydrophobicContact CB-CB 4.22Å; V274-C292 HydrophobicContact CG1-CB 4.28Å; V274-C292 HydrophobicContact CG2-CB 4.49Å; V274-V316 HydrophobicContact CG1-CG1 4.38Å; V274-V316 WeakPolarHBondContact O-CG1 3.27Å; V274-R331 HydrophobicContact CG1-CB 4.17Å; V274-C332 HydrophobicContact CG2-CB 4.5Å; V274-A335 HydrophobicContact CG2-CB 3.99Å; V274-M337 HydrophobicContact CG2-SD 3.89Å
275	C	98.2	Very high	87.5	Confident	7 Å²	7	70.3 Å²	70.3	5%	0.047	38%	0.378	C	S	.	.	T	Hydrogen-bonded Turn	trans	-152.4	14.3	-170.7	75.8	0	0	0	0	117.1	C272 D277 C292 V316 D317 A318 R321	C272-C275 PolarHBondContact O-N 3.05Å; C272-C275 VanDerWaalsContact SG-SG 3.68Å; C275-D277 PolarHBondContact O-N 3.5Å; C275-C292 VanDerWaalsContact SG-SG 3.68Å; C275-V316 VanDerWaalsContact CA-O 3.22Å; C275-V316 WeakPolarHBondContact CA-O 3.44Å; C275-V316 HydrophobicContact CB-CG1 4.06Å; C275-V316 WeakPolarHBondContact CB-O 3.3Å; C275-D317 CarbonylContact O-C 3.5Å; C275-A318 PolarHBondContact O-N 3.38Å; C275-R321 HydrophobicContact CB-CB 4.37Å; C275-R321 PolarHBondContact SG-NH1 3.42Å
276	G	96.8	Very high	89.5	Confident	49 Å²	49	67.9 Å²	67.9	51%	0.505	36%	0.358	S	S	.	.	S	Bend	trans	71.8	-15.9	177	0	0	0	0	0	116.5	C272	C272-G276 PolarHBondContact O-N 3.5Å
277	D	96.9	Very high	91.5	Very high	47 Å²	47	65.8 Å²	65.8	25%	0.251	34%	0.343	S	S	.	.	S	Bend	trans	-58.4	157.3	176.1	-168.2	10.9	0	0	0	112.7	C272 C275 S279 C289 A318 R321	C272-D277 WeakPolarHBondContact CA-O 3.46Å; C272-D277 HydrophobicContact CB-CB 4.34Å; C272-D277 WeakPolarHBondContact CB-O 3.46Å; C272-D277 PolarHBondContact N-O 3.02Å; C275-D277 PolarHBondContact O-N 3.5Å; D277-S279 PolarHBondContact O-N 3.38Å; D277-C289 HydrophobicContact CB-CB 4.09Å; D277-A318 HydrophobicContact CB-CB 3.89Å; D277-R321 IonicContact OD2-CZ 3.16Å; D277-R321 IonicContact OD2-NH1 2.7Å; D277-R321 PolarHBondContact OD2-NH1 3.3Å; D277-R321 IonicContact OD2-NH2 2.87Å; D277-R321 PolarHBondContact OD2-NH2 2.87Å
278	R	96.1	Very high	93.3	Very high	213 Å²	213	61.2 Å²	61.2	80%	0.804	32%	0.319	S	S	*	.	B	Isolated β-bridge	trans	-59.8	128.3	-179.1	-169.9	171.6	-179.7	164.3	0.5	110.7	C289	R278-C289 VanDerWaalsContact O-CB 3.24Å; R278-C289 WeakPolarHBondContact O-CB 3.14Å
279	S	96.9	Very high	94.9	Very high	15 Å²	15	56 Å²	56	11%	0.105	29%	0.292	C	S	.	.	P	Polyproline II helix	trans	-76.2	137.7	179.9	-173.2	0	0	0	0	110.7	H270 D277 G281 T288	H270-S279 VanDerWaalsContact C-CB 3.5Å; H270-S279 WeakPolarHBondContact O-CA 3.24Å; H270-S279 WeakPolarHBondContact O-CB 3.24Å; H270-S279 PolarHBondContact O-N 2.95Å; D277-S279 PolarHBondContact O-N 3.38Å; S279-G281 VanDerWaalsContact C-N 3.26Å; S279-G281 PolarHBondContact OG-N 2.9Å; S279-G281 VanDerWaalsContact OG-N 3.16Å; S279-G281 PolarHBondContact OG-O 3.11Å; S279-T288 PolarHBondContact OG-N 3.3Å; S279-T288 PolarHBondContact OG-O 3.11Å
280	S	95.5	Very high	96.4	Very high	56 Å²	56	56 Å²	56	39%	0.392	29%	0.293	S	S	.	.			trans	-94.8	22.3	168.1	57.4	0	0	0	0	111.7	H283 T288 E290	S280-H283 PolarHBondContact O-NE2 3.39Å; S280-H283 PolarHBondContact OG-NE2 3.2Å; S280-T288 PolarHBondContact N-O 3.16Å; S280-T288 PolarHBondContact OG-O 3.43Å; S280-E290 WeakPolarHBondContact CB-OE1 3.4Å; S280-E290 PolarHBondContact OG-OE1 3.23Å
281	G	95.3	Very high	97.1	Very high	27 Å²	27	52 Å²	52	28%	0.278	28%	0.28	S	S	.	.	S	Bend	trans	100.7	-165.6	-177.6	0	0	0	0	0	114.2	S279 H283 Y287 T288	S279-G281 VanDerWaalsContact C-N 3.26Å; S279-G281 PolarHBondContact OG-N 2.9Å; S279-G281 VanDerWaalsContact OG-N 3.16Å; S279-G281 PolarHBondContact OG-O 3.11Å; G281-H283 PolarHBondContact O-CD2 2.83Å; G281-H283 VanDerWaalsContact O-CD2 3.25Å; G281-Y287 WeakPolarHBondContact O-CA 3.24Å; G281-T288 PolarHBondContact O-N 2.86Å; G281-T288 VanDerWaalsContact O-N 3.1Å
282	K	96.4	Very high	97.2	Very high	137 Å²	137	48.2 Å²	48.2	60%	0.596	26%	0.26	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.6	119.1	-176.3	-68.7	-179	-176	171.2	0	111.6	Q286 Y287	K282-Q286 CarbonylContact C-O 3.52Å; K282-Q286 WeakPolarHBondContact CA-O 3.27Å; K282-Y287 HydrophobicContact CD-CE2 4.28Å; K282-Y287 WeakPolarHBondContact CE-OH 3.32Å; K282-Y287 HydrophobicContact CG-CD1 3.92Å; K282-Y287 HydrophobicContact CG-CD2 4.17Å; K282-Y287 HydrophobicContact CG-CE1 3.86Å; K282-Y287 HydrophobicContact CG-CE2 4.09Å; K282-Y287 HydrophobicContact CG-CG 4.1Å
283	H	97.7	Very high	97.2	Very high	29 Å²	29	50.7 Å²	50.7	13%	0.134	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	128.8	173.1	-54.4	-72.1	0	0	0	110.5	S280 G281 G285 Q286 T288 E290 K293	S280-H283 PolarHBondContact O-NE2 3.39Å; S280-H283 PolarHBondContact OG-NE2 3.2Å; G281-H283 PolarHBondContact O-CD2 2.83Å; G281-H283 VanDerWaalsContact O-CD2 3.25Å; H283-G285 PolarHBondContact O-N 3.31Å; H283-G285 VanDerWaalsContact O-N 3.09Å; H283-Q286 PolarHBondContact N-O 2.94Å; H283-Q286 PolarHBondContact O-N 2.73Å; H283-T288 WeakPolarHBondContact CB-OG1 3.45Å; H283-T288 PolarHBondContact CD2-O 2.86Å; H283-T288 PolarHBondContact CD2-OG1 3.44Å; H283-E290 IonicContact CE1-OE1 3.9Å; H283-E290 IonicContact NE2-OE1 2.92Å; H283-K293 HydrophobicContact CB-CB 3.98Å; H283-K293 HydrophobicContact CB-CD 4.4Å; H283-K293 HydrophobicContact CB-CG 3.82Å; H283-K293 VanDerWaalsContact CE1-CE 3.43Å; H283-K293 WeakPolarHBondContact CE1-CE 3.38Å; H283-K293 PolarHBondContact CE1-NZ 2.85Å; H283-K293 WeakPolarHBondContact ND1-CD 3.31Å; H283-K293 WeakPolarHBondContact ND1-CE 3.46Å
284	Y	97.5	Very high	97.3	Very high	43 Å²	43	47.5 Å²	47.5	17%	0.169	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	54.7	26.1	-178	-45.7	-71.9	0	0	0	114.6	K293 F296 K297 M337 K338 A341 V342	Y284-K293 HydrophobicContact CE2-CB 4.48Å; Y284-K293 HydrophobicContact CE2-CG 3.95Å; Y284-K293 WeakPolarHBondContact CE2-O 3.45Å; Y284-F296 HydrophobicContact CD1-CD1 4.43Å; Y284-F296 AromaticContact CD2-CD1 3.64Å; Y284-F296 HydrophobicContact CD2-CD1 3.64Å; Y284-F296 HydrophobicContact CD2-CE1 4.3Å; Y284-F296 HydrophobicContact CE2-CD1 4.16Å; Y284-F296 AromaticContact CG-CD1 3.78Å; Y284-F296 HydrophobicContact CG-CD1 3.78Å; Y284-F296 AromaticContact CG-CE1 3.98Å; Y284-F296 HydrophobicContact CG-CE1 3.98Å; Y284-K297 WeakPolarHBondContact OH-CB 3.18Å; Y284-K297 WeakPolarHBondContact OH-CD 3.48Å; Y284-K297 WeakPolarHBondContact OH-CG 3.32Å; Y284-M337 HydrophobicContact CD2-CE 3.63Å; Y284-M337 HydrophobicContact CE2-CE 4.49Å; Y284-M337 HydrophobicContact CG-CE 4.45Å; Y284-K338 PolarHBondContact O-N 2.8Å; Y284-A341 HydrophobicContact CD1-CB 3.98Å; Y284-V342 HydrophobicContact CD1-CB 4.48Å; Y284-V342 HydrophobicContact CD1-CG2 3.63Å; Y284-V342 HydrophobicContact CE1-CB 4.26Å; Y284-V342 HydrophobicContact CE1-CG2 3.64Å; Y284-V342 HydrophobicContact CG-CG2 4.3Å
285	G	96	Very high	97.3	Very high	45 Å²	45	47.4 Å²	47.4	46%	0.464	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	104.9	-6.7	177.2	0	0	0	0	0	115.7	H283	H283-G285 PolarHBondContact O-N 3.31Å; H283-G285 VanDerWaalsContact O-N 3.09Å
286	Q	96.9	Very high	97.3	Very high	61 Å²	61	47.1 Å²	47.1	29%	0.285	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	151.9	-174.1	-62.3	-64	-5.1	0	0	112.8	K282 H283 T288 A335 M337	K282-Q286 CarbonylContact C-O 3.52Å; K282-Q286 WeakPolarHBondContact CA-O 3.27Å; H283-Q286 PolarHBondContact N-O 2.94Å; H283-Q286 PolarHBondContact O-N 2.73Å; Q286-T288 PolarHBondContact O-N 3.45Å; Q286-A335 WeakPolarHBondContact CG-O 3.47Å; Q286-A335 PolarHBondContact NE2-O 2.89Å; Q286-M337 HydrophobicContact CB-CG 4.25Å; Q286-M337 HydrophobicContact CG-CG 4.38Å
287	Y	97.2	Very high	97.3	Very high	58 Å²	58	48.5 Å²	48.5	23%	0.227	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	117	174.4	-70.4	-84	0	0	0	110.4	Q269 Q273 G281 K282	Q269-Y287 WeakPolarHBondContact O-CD1 3.44Å; Q269-Y287 VanDerWaalsContact O-CE1 3.24Å; Q269-Y287 WeakPolarHBondContact O-CE1 3.32Å; Q273-Y287 PolarHBondContact N-O 2.8Å; G281-Y287 WeakPolarHBondContact O-CA 3.24Å; K282-Y287 HydrophobicContact CD-CE2 4.28Å; K282-Y287 WeakPolarHBondContact CE-OH 3.32Å; K282-Y287 HydrophobicContact CG-CD1 3.92Å; K282-Y287 HydrophobicContact CG-CD2 4.17Å; K282-Y287 HydrophobicContact CG-CE1 3.86Å; K282-Y287 HydrophobicContact CG-CE2 4.09Å; K282-Y287 HydrophobicContact CG-CG 4.1Å
288	T	97.9	Very high	97.4	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	26%	0.26	C	S	.	.			trans	-144.6	157.4	-179.7	62.1	0	0	0	0	112.2	V274 S279 S280 G281 H283 Q286 M337	V274-T288 HydrophobicContact CG2-CG2 3.95Å; S279-T288 PolarHBondContact OG-N 3.3Å; S279-T288 PolarHBondContact OG-O 3.11Å; S280-T288 PolarHBondContact N-O 3.16Å; S280-T288 PolarHBondContact OG-O 3.43Å; G281-T288 PolarHBondContact O-N 2.86Å; G281-T288 VanDerWaalsContact O-N 3.1Å; H283-T288 WeakPolarHBondContact CB-OG1 3.45Å; H283-T288 PolarHBondContact CD2-O 2.86Å; H283-T288 PolarHBondContact CD2-OG1 3.44Å; Q286-T288 PolarHBondContact O-N 3.45Å; T288-M337 HydrophobicContact CG2-CE 4Å; T288-M337 HydrophobicContact CG2-CG 4.46Å; T288-M337 HydrophobicContact CG2-SD 3.9Å
289	C	98.5	Very high	97.4	Very high	3 Å²	3	42.5 Å²	42.5	2%	0.02	22%	0.222	C	C	.	.			trans	-74.3	161.2	167.3	60.5	0	0	0	0	112	C272 D277 R278 G291 C292 K293 R321	C272-C289 HydrophobicContact CB-CB 4.11Å; C272-C289 PolarHBondContact SG-N 2.85Å; C272-C289 VanDerWaalsContact SG-N 3.4Å; C272-C289 PolarHBondContact SG-SG 3.12Å; D277-C289 HydrophobicContact CB-CB 4.09Å; R278-C289 VanDerWaalsContact O-CB 3.24Å; R278-C289 WeakPolarHBondContact O-CB 3.14Å; C289-G291 PolarHBondContact O-N 2.94Å; C289-G291 VanDerWaalsContact O-N 3.15Å; C289-C292 PolarHBondContact O-N 3Å; C289-C292 VanDerWaalsContact O-N 3.12Å; C289-C292 PolarHBondContact SG-N 3.26Å; C289-K293 WeakPolarHBondContact O-CB 3.42Å; C289-K293 PolarHBondContact O-N 3.29Å; C289-R321 PolarHBondContact SG-NH1 3.34Å
290	E	98	Very high	97.4	Very high	90 Å²	90	43.2 Å²	43.2	42%	0.421	23%	0.226	S	C	.	.	H	α-helix	trans	-55.6	-32.4	174.7	-70	-58	118.8	0	0	113.3	S280 H283 K293 S294	S280-E290 WeakPolarHBondContact CB-OE1 3.4Å; S280-E290 PolarHBondContact OG-OE1 3.23Å; H283-E290 IonicContact CE1-OE1 3.9Å; H283-E290 IonicContact NE2-OE1 2.92Å; E290-K293 VanDerWaalsContact OE1-CD 3.26Å; E290-K293 WeakPolarHBondContact OE1-CD 3.4Å; E290-K293 IonicContact OE1-NZ 3.73Å; E290-K293 PolarHBondContact OE1-NZ 3.41Å; E290-K293 WeakPolarHBondContact OE2-CD 3.26Å; E290-K293 WeakPolarHBondContact OE2-CE 3.36Å; E290-K293 IonicContact OE2-NZ 2.77Å; E290-K293 PolarHBondContact OE2-NZ 2.93Å; E290-S294 VanDerWaalsContact O-CB 3.26Å; E290-S294 WeakPolarHBondContact O-CB 3.19Å; E290-S294 PolarHBondContact O-N 3.49Å; E290-S294 PolarHBondContact O-OG 3.27Å; E290-S294 VanDerWaalsContact O-OG 3.11Å
291	G	98.1	Very high	97.4	Very high	22 Å²	22	46.1 Å²	46.1	23%	0.227	23%	0.228	C	C	.	.	H	α-helix	trans	-59.4	-50.2	175.6	0	0	0	0	0	112.5	C289 S294 F295 R328	C289-G291 PolarHBondContact O-N 2.94Å; C289-G291 VanDerWaalsContact O-N 3.15Å; G291-S294 PolarHBondContact O-OG 3.4Å; G291-F295 VanDerWaalsContact O-CB 3.25Å; G291-F295 WeakPolarHBondContact O-CB 3.41Å; G291-F295 PolarHBondContact O-N 3.25Å; G291-F295 VanDerWaalsContact O-N 3.08Å; G291-R328 VanDerWaalsContact C-NH2 3.31Å; G291-R328 PolarHBondContact O-NH2 3.06Å
292	C	98.7	Very high	97.3	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-77	-37	-179.3	-70.1	0	0	0	0	112.6	V274 C275 C289 S294 F295 F296 R328	V274-C292 HydrophobicContact CB-CB 4.22Å; V274-C292 HydrophobicContact CG1-CB 4.28Å; V274-C292 HydrophobicContact CG2-CB 4.49Å; C275-C292 VanDerWaalsContact SG-SG 3.68Å; C289-C292 PolarHBondContact O-N 3Å; C289-C292 VanDerWaalsContact O-N 3.12Å; C289-C292 PolarHBondContact SG-N 3.26Å; C292-S294 PolarHBondContact O-N 3.04Å; C292-F295 PolarHBondContact O-N 3.01Å; C292-F296 WeakPolarHBondContact O-CB 3.39Å; C292-F296 PolarHBondContact O-N 3.32Å; C292-R328 PolarHBondContact SG-NH2 3.41Å; C292-R328 VanDerWaalsContact SG-NH2 3.41Å
293	K	98.2	Very high	97.2	Very high	54 Å²	54	51 Å²	51	24%	0.235	25%	0.253	C	S	.	.	H	α-helix	trans	-53.1	-52	168.5	171.6	-160.4	-169.7	179.5	0	112.1	H283 Y284 C289 E290 K297	H283-K293 HydrophobicContact CB-CB 3.98Å; H283-K293 HydrophobicContact CB-CD 4.4Å; H283-K293 HydrophobicContact CB-CG 3.82Å; H283-K293 VanDerWaalsContact CE1-CE 3.43Å; H283-K293 WeakPolarHBondContact CE1-CE 3.38Å; H283-K293 PolarHBondContact CE1-NZ 2.85Å; H283-K293 WeakPolarHBondContact ND1-CD 3.31Å; H283-K293 WeakPolarHBondContact ND1-CE 3.46Å; Y284-K293 HydrophobicContact CE2-CB 4.48Å; Y284-K293 HydrophobicContact CE2-CG 3.95Å; Y284-K293 WeakPolarHBondContact CE2-O 3.45Å; C289-K293 WeakPolarHBondContact O-CB 3.42Å; C289-K293 PolarHBondContact O-N 3.29Å; E290-K293 VanDerWaalsContact OE1-CD 3.26Å; E290-K293 WeakPolarHBondContact OE1-CD 3.4Å; E290-K293 IonicContact OE1-NZ 3.73Å; E290-K293 PolarHBondContact OE1-NZ 3.41Å; E290-K293 WeakPolarHBondContact OE2-CD 3.26Å; E290-K293 WeakPolarHBondContact OE2-CE 3.36Å; E290-K293 IonicContact OE2-NZ 2.77Å; E290-K293 PolarHBondContact OE2-NZ 2.93Å; K293-K297 WeakPolarHBondContact O-CB 3.4Å; K293-K297 PolarHBondContact O-N 2.94Å; K293-K297 VanDerWaalsContact O-N 3.1Å
294	S	97.9	Very high	97	Very high	32 Å²	32	50.6 Å²	50.6	22%	0.224	26%	0.255	C	S	.	.	H	α-helix	trans	-71.5	-37.2	-176.4	76.3	0	0	0	0	112.1	E290 G291 C292 R298	E290-S294 VanDerWaalsContact O-CB 3.26Å; E290-S294 WeakPolarHBondContact O-CB 3.19Å; E290-S294 PolarHBondContact O-N 3.49Å; E290-S294 PolarHBondContact O-OG 3.27Å; E290-S294 VanDerWaalsContact O-OG 3.11Å; G291-S294 PolarHBondContact O-OG 3.4Å; C292-S294 PolarHBondContact O-N 3.04Å; S294-R298 VanDerWaalsContact CB-NH1 3.32Å; S294-R298 WeakPolarHBondContact O-CG 3.34Å; S294-R298 PolarHBondContact O-N 3.14Å; S294-R298 VanDerWaalsContact O-N 3.12Å; S294-R298 PolarHBondContact O-NH1 3.37Å; S294-R298 PolarHBondContact OG-NH1 3.3Å
295	F	98.6	Very high	96.9	Very high	8 Å²	8	56.1 Å²	56.1	4%	0.035	29%	0.288	C	S	.	.	H	α-helix	trans	-59.5	-56.7	172.9	173.9	-100.6	0	0	0	111.4	G291 C292 K297 R298 S299 Y306 Q325 R328 L329	G291-F295 VanDerWaalsContact O-CB 3.25Å; G291-F295 WeakPolarHBondContact O-CB 3.41Å; G291-F295 PolarHBondContact O-N 3.25Å; G291-F295 VanDerWaalsContact O-N 3.08Å; C292-F295 PolarHBondContact O-N 3.01Å; F295-K297 VanDerWaalsContact C-N 3.29Å; F295-K297 PolarHBondContact O-N 2.91Å; F295-R298 PolarHBondContact O-N 2.85Å; F295-S299 PolarHBondContact O-N 2.99Å; F295-S299 PolarHBondContact O-OG 3.31Å; F295-S299 VanDerWaalsContact O-OG 3.08Å; F295-Y306 AromaticContact CE2-CE2 3.96Å; F295-Y306 HydrophobicContact CE2-CE2 3.96Å; F295-Y306 HydrophobicContact CZ-CD2 4.32Å; F295-Y306 AromaticContact CZ-CE2 3.68Å; F295-Y306 HydrophobicContact CZ-CE2 3.68Å; F295-Q325 HydrophobicContact CE2-CB 4.11Å; F295-Q325 HydrophobicContact CE2-CG 4.15Å; F295-Q325 HydrophobicContact CZ-CB 4.19Å; F295-Q325 WeakPolarHBondContact CZ-O 3.42Å; F295-R328 HydrophobicContact CD1-CG 3.9Å; F295-R328 HydrophobicContact CE1-CB 3.92Å; F295-R328 HydrophobicContact CE1-CG 3.7Å; F295-R328 HydrophobicContact CZ-CB 4.1Å; F295-R328 HydrophobicContact CZ-CG 4.25Å; F295-L329 HydrophobicContact CE1-CB 3.87Å; F295-L329 HydrophobicContact CE1-CD1 4.25Å; F295-L329 HydrophobicContact CZ-CB 4.04Å
296	F	98.4	Very high	97	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-55.5	-43.9	179.3	-171.8	-103.2	0	0	0	112.1	Y284 C292 R298 S299 V300 L329 C332 L333 M337 K339 V342	Y284-F296 HydrophobicContact CD1-CD1 4.43Å; Y284-F296 AromaticContact CD2-CD1 3.64Å; Y284-F296 HydrophobicContact CD2-CD1 3.64Å; Y284-F296 HydrophobicContact CD2-CE1 4.3Å; Y284-F296 HydrophobicContact CE2-CD1 4.16Å; Y284-F296 AromaticContact CG-CD1 3.78Å; Y284-F296 HydrophobicContact CG-CD1 3.78Å; Y284-F296 AromaticContact CG-CE1 3.98Å; Y284-F296 HydrophobicContact CG-CE1 3.98Å; C292-F296 WeakPolarHBondContact O-CB 3.39Å; C292-F296 PolarHBondContact O-N 3.32Å; F296-R298 PolarHBondContact O-N 3.44Å; F296-S299 PolarHBondContact O-N 3.31Å; F296-V300 HydrophobicContact CD1-CG2 4.13Å; F296-V300 HydrophobicContact CD2-CG2 4.2Å; F296-V300 HydrophobicContact CE1-CG2 3.84Å; F296-V300 HydrophobicContact CE2-CG2 3.92Å; F296-V300 HydrophobicContact CG-CG2 4.31Å; F296-V300 HydrophobicContact CZ-CG2 3.73Å; F296-V300 WeakPolarHBondContact O-CB 3.15Å; F296-V300 WeakPolarHBondContact O-CG2 3.27Å; F296-V300 PolarHBondContact O-N 2.85Å; F296-L329 HydrophobicContact CD2-CD1 4.09Å; F296-L329 HydrophobicContact CE2-CD1 4.45Å; F296-C332 HydrophobicContact CD2-CB 3.63Å; F296-C332 HydrophobicContact CE2-CB 4.14Å; F296-L333 HydrophobicContact CE2-CD2 3.78Å; F296-L333 HydrophobicContact CE2-CG 4.37Å; F296-L333 HydrophobicContact CZ-CD2 4.23Å; F296-M337 HydrophobicContact CB-CE 3.61Å; F296-M337 HydrophobicContact CB-SD 4.24Å; F296-M337 HydrophobicContact CD1-CB 4.25Å; F296-M337 HydrophobicContact CD1-CE 3.89Å; F296-M337 HydrophobicContact CD2-CB 4.08Å; F296-M337 HydrophobicContact CD2-CE 4.32Å; F296-M337 HydrophobicContact CD2-SD 4.16Å; F296-M337 HydrophobicContact CE1-CB 3.91Å; F296-M337 HydrophobicContact CE2-CB 3.73Å; F296-M337 HydrophobicContact CG-CB 4.32Å; F296-M337 HydrophobicContact CG-CE 3.69Å; F296-M337 HydrophobicContact CG-SD 4.13Å; F296-M337 HydrophobicContact CZ-CB 3.63Å; F296-M337 VanDerWaalsContact CZ-O 3.23Å; F296-M337 WeakPolarHBondContact CZ-O 3.42Å; F296-K339 HydrophobicContact CZ-CG 4.11Å; F296-V342 HydrophobicContact CD1-CG2 3.81Å; F296-V342 HydrophobicContact CE1-CG2 3.63Å
297	K	97.5	Very high	97	Very high	79 Å²	79	60.9 Å²	60.9	34%	0.343	30%	0.304	S	S	.	.	H	α-helix	trans	-55.3	-46.7	175	-167.6	178.6	71.6	-179.2	0	112.7	Y284 K293 F295 R301 V342	Y284-K297 WeakPolarHBondContact OH-CB 3.18Å; Y284-K297 WeakPolarHBondContact OH-CD 3.48Å; Y284-K297 WeakPolarHBondContact OH-CG 3.32Å; K293-K297 WeakPolarHBondContact O-CB 3.4Å; K293-K297 PolarHBondContact O-N 2.94Å; K293-K297 VanDerWaalsContact O-N 3.1Å; F295-K297 VanDerWaalsContact C-N 3.29Å; F295-K297 PolarHBondContact O-N 2.91Å; K297-R301 WeakPolarHBondContact O-CB 3.43Å; K297-R301 WeakPolarHBondContact O-CG 3.43Å; K297-R301 PolarHBondContact O-N 2.98Å; K297-V342 HydrophobicContact CG-CG1 4.4Å
298	R	97.3	Very high	97	Very high	132 Å²	132	59.6 Å²	59.6	50%	0.498	30%	0.303	S	S	.	.	H	α-helix	trans	-68.6	-46.2	179.8	-72	-173.6	-60	-88.1	-2.2	111.2	S294 F295 F296 R301 K302	S294-R298 VanDerWaalsContact CB-NH1 3.32Å; S294-R298 WeakPolarHBondContact O-CG 3.34Å; S294-R298 PolarHBondContact O-N 3.14Å; S294-R298 VanDerWaalsContact O-N 3.12Å; S294-R298 PolarHBondContact O-NH1 3.37Å; S294-R298 PolarHBondContact OG-NH1 3.3Å; F295-R298 PolarHBondContact O-N 2.85Å; F296-R298 PolarHBondContact O-N 3.44Å; R298-R301 PolarHBondContact O-N 2.94Å; R298-K302 PolarHBondContact O-N 2.97Å; R298-K302 VanDerWaalsContact O-N 3.1Å
299	S	97.9	Very high	97	Very high	2 Å²	2	71.4 Å²	71.4	1%	0.014	35%	0.347	C	S	.	.	H	α-helix	trans	-65.6	-42.1	-177.6	-52.3	0	0	0	0	112.3	F295 F296 S303 A304 Y306	F295-S299 PolarHBondContact O-N 2.99Å; F295-S299 PolarHBondContact O-OG 3.31Å; F295-S299 VanDerWaalsContact O-OG 3.08Å; F296-S299 PolarHBondContact O-N 3.31Å; S299-S303 PolarHBondContact O-N 3.15Å; S299-A304 WeakPolarHBondContact O-CB 3.33Å; S299-A304 PolarHBondContact O-N 3.48Å; S299-Y306 VanDerWaalsContact OG-CE2 3.31Å; S299-Y306 WeakPolarHBondContact OG-CE2 3.42Å; S299-Y306 PolarHBondContact OG-OH 3.31Å
300	V	96.6	Very high	96.7	Very high	30 Å²	30	75.2 Å²	75.2	18%	0.182	37%	0.374	C	S	.	.	H	α-helix	trans	-69.4	-40.9	177.2	175	0	0	0	0	111.9	F296 K302 S303 K339 V342	F296-V300 HydrophobicContact CD1-CG2 4.13Å; F296-V300 HydrophobicContact CD2-CG2 4.2Å; F296-V300 HydrophobicContact CE1-CG2 3.84Å; F296-V300 HydrophobicContact CE2-CG2 3.92Å; F296-V300 HydrophobicContact CG-CG2 4.31Å; F296-V300 HydrophobicContact CZ-CG2 3.73Å; F296-V300 WeakPolarHBondContact O-CB 3.15Å; F296-V300 WeakPolarHBondContact O-CG2 3.27Å; F296-V300 PolarHBondContact O-N 2.85Å; V300-K302 VanDerWaalsContact C-N 3.34Å; V300-K302 PolarHBondContact O-N 3.4Å; V300-S303 PolarHBondContact O-N 3.29Å; V300-K339 HydrophobicContact CG1-CB 4.14Å; V300-K339 HydrophobicContact CG2-CB 4.39Å; V300-K339 HydrophobicContact CG2-CG 4.01Å; V300-V342 HydrophobicContact CB-CB 4.25Å; V300-V342 HydrophobicContact CB-CG1 4.26Å; V300-V342 HydrophobicContact CB-CG2 3.92Å; V300-V342 HydrophobicContact CG1-CB 3.79Å; V300-V342 HydrophobicContact CG1-CG1 4.1Å; V300-V342 HydrophobicContact CG1-CG2 3.85Å; V300-V342 HydrophobicContact CG2-CG2 4.17Å
301	R	94.3	Very high	96.6	Very high	117 Å²	117	74.5 Å²	74.5	44%	0.442	39%	0.391	S	S	.	.	H	α-helix	trans	-67.7	-31.6	179.4	-77.9	-174.4	178.3	151.9	3.6	114.3	K297 R298 S303 V342 Q343	K297-R301 WeakPolarHBondContact O-CB 3.43Å; K297-R301 WeakPolarHBondContact O-CG 3.43Å; K297-R301 PolarHBondContact O-N 2.98Å; R298-R301 PolarHBondContact O-N 2.94Å; R301-S303 VanDerWaalsContact C-N 3.33Å; R301-V342 HydrophobicContact CG-CG1 3.83Å; R301-Q343 VanDerWaalsContact CZ-O 3.28Å; R301-Q343 PolarHBondContact NE-O 2.82Å; R301-Q343 PolarHBondContact NH2-O 3.23Å
302	K	94.1	Very high	96.4	Very high	173 Å²	173	75.5 Å²	75.5	75%	0.752	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.9	3.7	175.2	-66	-167.8	173.7	-162.5	0	113.2	R298 V300 A304	R298-K302 PolarHBondContact O-N 2.97Å; R298-K302 VanDerWaalsContact O-N 3.1Å; V300-K302 VanDerWaalsContact C-N 3.34Å; V300-K302 PolarHBondContact O-N 3.4Å; K302-A304 HydrophobicContact CB-CB 4.41Å; K302-A304 PolarHBondContact O-N 2.76Å; K302-A304 VanDerWaalsContact O-N 3.14Å
303	S	93.4	Very high	96.3	Very high	93 Å²	93	83.1 Å²	83.1	65%	0.65	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.1	42.1	-170.5	-61	0	0	0	0	112.5	S299 V300 R301 N305	S299-S303 PolarHBondContact O-N 3.15Å; V300-S303 PolarHBondContact O-N 3.29Å; R301-S303 VanDerWaalsContact C-N 3.33Å; S303-N305 PolarHBondContact O-N 3.41Å
304	A	94.3	Very high	96.3	Very high	21 Å²	21	81.4 Å²	81.4	17%	0.174	43%	0.432	C	S	.	.			trans	-71.3	119.3	-163.6	0	0	0	0	0	112.7	S299 K302 Y306	S299-A304 WeakPolarHBondContact O-CB 3.33Å; S299-A304 PolarHBondContact O-N 3.48Å; K302-A304 HydrophobicContact CB-CB 4.41Å; K302-A304 PolarHBondContact O-N 2.76Å; K302-A304 VanDerWaalsContact O-N 3.14Å; A304-Y306 HydrophobicContact CB-CE1 3.96Å; A304-Y306 HydrophobicContact CB-CE2 4.08Å
305	N	95.2	Very high	96.2	Very high	158 Å²	158	82.9 Å²	82.9	85%	0.845	44%	0.44	S	S	*	.			trans	-97.8	90.5	176.5	-65.2	-39.1	0	0	0	109.9	S303	S303-N305 PolarHBondContact O-N 3.41Å
306	Y	97.6	Very high	96.2	Very high	74 Å²	74	83 Å²	83	29%	0.29	44%	0.442	S	S	.	.	P	Polyproline II helix	trans	-84.2	138.3	177	-55	-57.4	0	0	0	111.7	F295 S299 A304 Q325 A326 L329	F295-Y306 AromaticContact CE2-CE2 3.96Å; F295-Y306 HydrophobicContact CE2-CE2 3.96Å; F295-Y306 HydrophobicContact CZ-CD2 4.32Å; F295-Y306 AromaticContact CZ-CE2 3.68Å; F295-Y306 HydrophobicContact CZ-CE2 3.68Å; S299-Y306 VanDerWaalsContact OG-CE2 3.31Å; S299-Y306 WeakPolarHBondContact OG-CE2 3.42Å; S299-Y306 PolarHBondContact OG-OH 3.31Å; A304-Y306 HydrophobicContact CB-CE1 3.96Å; A304-Y306 HydrophobicContact CB-CE2 4.08Å; Y306-Q325 HydrophobicContact CD1-CB 3.91Å; Y306-Q325 HydrophobicContact CD2-CB 3.79Å; Y306-Q325 HydrophobicContact CE1-CB 4.12Å; Y306-Q325 HydrophobicContact CE2-CB 4Å; Y306-Q325 HydrophobicContact CG-CB 3.75Å; Y306-A326 WeakPolarHBondContact O-CB 3.34Å; Y306-L329 HydrophobicContact CD2-CB 4.08Å; Y306-L329 HydrophobicContact CD2-CD2 3.75Å; Y306-L329 HydrophobicContact CE2-CB 4.36Å; Y306-L329 HydrophobicContact CE2-CD2 3.93Å
307	V	97.3	Very high	96.1	Very high	133 Å²	133	86 Å²	86	81%	0.806	46%	0.458	S	S	*	.	P	Polyproline II helix	trans	-101.3	135.5	173.5	-177.5	0	0	0	0	110
308	C	98.1	Very high	96.1	Very high	30 Å²	30	84.3 Å²	84.3	20%	0.203	46%	0.458	C	S	.	.	P	Polyproline II helix	trans	-84.6	132.5	173.7	-174.1	0	0	0	0	110.7	S310 G312 C314 A326 C327	C308-S310 VanDerWaalsContact C-N 3.32Å; C308-S310 PolarHBondContact SG-N 2.88Å; C308-G312 PolarHBondContact SG-N 3.32Å; C308-C314 VanDerWaalsContact SG-SG 3.65Å; C308-A326 HydrophobicContact CB-CB 3.9Å; C308-C327 PolarHBondContact SG-SG 2.97Å
309	R	96.2	Very high	96	Very high	248 Å²	248	86.6 Å²	86.6	94%	0.936	48%	0.475	S	S	*	.	S	Bend	trans	-83.2	-4.9	174.7	-61.9	-178	-178.9	174.2	-1.2	114.1
310	S	93.8	Very high	95.9	Very high	84 Å²	84	93 Å²	93	59%	0.587	50%	0.499	S	S	*	.	S	Bend	trans	-136.9	42.9	-168.7	-46.2	0	0	0	0	112.1	C308 G312	C308-S310 VanDerWaalsContact C-N 3.32Å; C308-S310 PolarHBondContact SG-N 2.88Å; S310-G312 VanDerWaalsContact C-N 3.3Å; S310-G312 PolarHBondContact O-N 3.41Å
311	G	94.2	Very high	95.9	Very high	74 Å²	74	93.8 Å²	93.8	76%	0.763	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.7	10.4	171.2	0	0	0	0	0	116.9	Q313	G311-Q313 VanDerWaalsContact C-N 3.35Å; G311-Q313 PolarHBondContact O-N 2.84Å
312	G	95.3	Very high	96.1	Very high	43 Å²	43	93.9 Å²	93.9	44%	0.443	51%	0.507	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.3	4	175	0	0	0	0	0	115.8	C308 S310 C327	C308-G312 PolarHBondContact SG-N 3.32Å; S310-G312 VanDerWaalsContact C-N 3.3Å; S310-G312 PolarHBondContact O-N 3.41Å; G312-C327 PolarHBondContact O-SG 2.61Å
313	Q	95.6	Very high	96.2	Very high	160 Å²	160	93.6 Å²	93.6	75%	0.748	51%	0.509	S	S	*	.			trans	-109.9	16.8	-172.5	-61.2	-176.8	0.8	0	0	114.2	G311	G311-Q313 VanDerWaalsContact C-N 3.35Å; G311-Q313 PolarHBondContact O-N 2.84Å
314	C	97.6	Very high	96.4	Very high	19 Å²	19	90 Å²	90	13%	0.128	48%	0.483	C	S	.	.			trans	-60.2	136	-178.5	-51.3	0	0	0	0	111.6	C308 C324 C327	C308-C314 VanDerWaalsContact SG-SG 3.65Å; C314-C324 HydrophobicContact CB-CB 3.79Å; C314-C324 VanDerWaalsContact SG-CB 3.59Å; C314-C327 HydrophobicContact CB-CB 3.81Å; C314-C327 VanDerWaalsContact CB-SG 3.58Å; C314-C327 PolarHBondContact N-SG 3.12Å
315	P	96.7	Very high	96.6	Very high	63 Å²	63	93.9 Å²	93.9	41%	0.409	50%	0.498	S	S	.	.			trans	-64	149.2	172.8	28.3	-34.7	0	0	0	110.9
316	V	97.7	Very high	96.8	Very high	11 Å²	11	87.1 Å²	87.1	7%	0.067	46%	0.464	C	S	.	.			trans	-130.9	82.5	-175.6	-176.4	0	0	0	0	108.2	V274 C275 R321 C327 R328 R331	V274-V316 HydrophobicContact CG1-CG1 4.38Å; V274-V316 WeakPolarHBondContact O-CG1 3.27Å; C275-V316 VanDerWaalsContact CA-O 3.22Å; C275-V316 WeakPolarHBondContact CA-O 3.44Å; C275-V316 HydrophobicContact CB-CG1 4.06Å; C275-V316 WeakPolarHBondContact CB-O 3.3Å; V316-R321 HydrophobicContact CG1-CB 3.93Å; V316-C327 HydrophobicContact CG2-CB 4.25Å; V316-R328 HydrophobicContact CG1-CB 4.28Å; V316-R328 HydrophobicContact CG1-CG 4Å; V316-R331 HydrophobicContact CB-CG 4.21Å; V316-R331 HydrophobicContact CG2-CB 4.45Å; V316-R331 HydrophobicContact CG2-CG 3.85Å
317	D	97.2	Very high	96.8	Very high	63 Å²	63	83.8 Å²	83.8	34%	0.337	45%	0.452	S	S	.	.			trans	-109.6	167	-179.2	-33.3	-55.1	0	0	0	110.1	C275 Q319 R320 R321	C275-D317 CarbonylContact O-C 3.5Å; D317-Q319 VanDerWaalsContact C-N 3.27Å; D317-Q319 PolarHBondContact O-N 3.49Å; D317-Q319 VanDerWaalsContact O-N 3.14Å; D317-R320 PolarHBondContact O-N 3.43Å; D317-R320 VanDerWaalsContact O-N 3.11Å; D317-R320 IonicContact OD2-CZ 3.2Å; D317-R320 IonicContact OD2-NE 2.86Å; D317-R320 PolarHBondContact OD2-NE 2.97Å; D317-R320 IonicContact OD2-NH2 2.7Å; D317-R320 PolarHBondContact OD2-NH2 3.42Å; D317-R321 WeakPolarHBondContact O-CB 3.46Å; D317-R321 PolarHBondContact O-N 3.22Å
318	A	96.8	Very high	96.9	Very high	42 Å²	42	77.9 Å²	77.9	35%	0.347	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.1	-45.2	-177	0	0	0	0	0	113.5	C275 D277 R321	C275-A318 PolarHBondContact O-N 3.38Å; D277-A318 HydrophobicContact CB-CB 3.89Å; A318-R321 VanDerWaalsContact O-CD 3.29Å; A318-R321 WeakPolarHBondContact O-CD 3.43Å; A318-R321 WeakPolarHBondContact O-CG 3.45Å; A318-R321 PolarHBondContact O-NE 2.81Å
319	Q	96.5	Very high	96.9	Very high	181 Å²	181	77.6 Å²	77.6	85%	0.846	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.7	-45	177.1	-66.1	174.6	-23.7	0	0	112.9	D317	D317-Q319 VanDerWaalsContact C-N 3.27Å; D317-Q319 PolarHBondContact O-N 3.49Å; D317-Q319 VanDerWaalsContact O-N 3.14Å
320	R	95.4	Very high	97	Very high	137 Å²	137	68.5 Å²	68.5	52%	0.517	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.5	-5.9	-167	-58.9	-170.8	-61.4	-177.4	-2.7	115.2	D317 N322 Q323	D317-R320 PolarHBondContact O-N 3.43Å; D317-R320 VanDerWaalsContact O-N 3.11Å; D317-R320 IonicContact OD2-CZ 3.2Å; D317-R320 IonicContact OD2-NE 2.86Å; D317-R320 PolarHBondContact OD2-NE 2.97Å; D317-R320 IonicContact OD2-NH2 2.7Å; D317-R320 PolarHBondContact OD2-NH2 3.42Å; R320-N322 PolarHBondContact O-N 2.83Å; R320-Q323 VanDerWaalsContact O-CB 3.24Å; R320-Q323 WeakPolarHBondContact O-CB 3.27Å; R320-Q323 PolarHBondContact O-N 3.5Å
321	R	97.4	Very high	97.2	Very high	45 Å²	45	71 Å²	71	17%	0.17	38%	0.382	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.6	-18.9	-179.3	61.5	-167.3	179.8	-178.2	-11.5	116.1	C275 D277 C289 V316 D317 A318 R328	C275-R321 HydrophobicContact CB-CB 4.37Å; C275-R321 PolarHBondContact SG-NH1 3.42Å; D277-R321 IonicContact OD2-CZ 3.16Å; D277-R321 IonicContact OD2-NH1 2.7Å; D277-R321 PolarHBondContact OD2-NH1 3.3Å; D277-R321 IonicContact OD2-NH2 2.87Å; D277-R321 PolarHBondContact OD2-NH2 2.87Å; C289-R321 PolarHBondContact SG-NH1 3.34Å; V316-R321 HydrophobicContact CG1-CB 3.93Å; D317-R321 WeakPolarHBondContact O-CB 3.46Å; D317-R321 PolarHBondContact O-N 3.22Å; A318-R321 VanDerWaalsContact O-CD 3.29Å; A318-R321 WeakPolarHBondContact O-CD 3.43Å; A318-R321 WeakPolarHBondContact O-CG 3.45Å; A318-R321 PolarHBondContact O-NE 2.81Å; R321-R328 WeakPolarHBondContact O-CD 3.12Å; R321-R328 PolarHBondContact O-NH1 3.22Å
322	N	97.3	Very high	97.4	Very high	119 Å²	119	67.5 Å²	67.5	64%	0.636	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.3	-16.2	176.9	-67.5	-17.6	0	0	0	113.4	R320 C324 R328	R320-N322 PolarHBondContact O-N 2.83Å; N322-C324 VanDerWaalsContact C-N 3.33Å; N322-C324 PolarHBondContact O-N 3.22Å; N322-R328 PolarHBondContact OD1-NH1 3.43Å
323	Q	96.8	Very high	97.5	Very high	167 Å²	167	68.7 Å²	68.7	78%	0.78	34%	0.342	S	S	*	.	S	Bend	trans	-63.8	-33.4	-174.7	-172.2	62.6	18.5	0	0	113.6	R320	R320-Q323 VanDerWaalsContact O-CB 3.24Å; R320-Q323 WeakPolarHBondContact O-CB 3.27Å; R320-Q323 PolarHBondContact O-N 3.5Å
324	C	98.2	Very high	97.6	Very high	17 Å²	17	67.3 Å²	67.3	12%	0.115	34%	0.339	C	S	.	.			trans	-141.5	105.6	177.2	-168.3	0	0	0	0	112.4	C314 N322 A326 C327 R328	C314-C324 HydrophobicContact CB-CB 3.79Å; C314-C324 VanDerWaalsContact SG-CB 3.59Å; N322-C324 VanDerWaalsContact C-N 3.33Å; N322-C324 PolarHBondContact O-N 3.22Å; C324-A326 VanDerWaalsContact C-N 3.31Å; C324-A326 PolarHBondContact O-N 3.42Å; C324-C327 HydrophobicContact CB-CB 4.08Å; C324-C327 PolarHBondContact O-N 2.71Å; C324-C327 PolarHBondContact SG-SG 2.68Å; C324-R328 WeakPolarHBondContact O-CB 3.38Å; C324-R328 PolarHBondContact O-N 2.91Å
325	Q	98.2	Very high	97.5	Very high	103 Å²	103	67.6 Å²	67.6	48%	0.481	34%	0.343	S	S	.	.	H	α-helix	trans	-62.9	-35.2	177.7	-63	179.3	-12.5	0	0	112.4	F295 Y306 L329	F295-Q325 HydrophobicContact CE2-CB 4.11Å; F295-Q325 HydrophobicContact CE2-CG 4.15Å; F295-Q325 HydrophobicContact CZ-CB 4.19Å; F295-Q325 WeakPolarHBondContact CZ-O 3.42Å; Y306-Q325 HydrophobicContact CD1-CB 3.91Å; Y306-Q325 HydrophobicContact CD2-CB 3.79Å; Y306-Q325 HydrophobicContact CE1-CB 4.12Å; Y306-Q325 HydrophobicContact CE2-CB 4Å; Y306-Q325 HydrophobicContact CG-CB 3.75Å; Q325-L329 WeakPolarHBondContact O-CB 3.32Å; Q325-L329 PolarHBondContact O-N 3.5Å
326	A	98.3	Very high	97.6	Very high	17 Å²	17	65.9 Å²	65.9	14%	0.14	34%	0.337	C	S	.	.	H	α-helix	trans	-62.8	-52.2	176.9	0	0	0	0	0	112.2	Y306 C308 C324 R328 L329 S330	Y306-A326 WeakPolarHBondContact O-CB 3.34Å; C308-A326 HydrophobicContact CB-CB 3.9Å; C324-A326 VanDerWaalsContact C-N 3.31Å; C324-A326 PolarHBondContact O-N 3.42Å; A326-R328 VanDerWaalsContact C-N 3.34Å; A326-R328 PolarHBondContact O-N 3.27Å; A326-L329 PolarHBondContact O-N 3.07Å; A326-S330 WeakPolarHBondContact O-CB 3.44Å; A326-S330 PolarHBondContact O-N 3.34Å
327	C	98.4	Very high	97.6	Very high	4 Å²	4	65.6 Å²	65.6	3%	0.027	34%	0.335	C	S	.	.	H	α-helix	trans	-65.1	-38.4	178.7	-58.3	0	0	0	0	111.6	C308 G312 C314 V316 C324 S330 R331	C308-C327 PolarHBondContact SG-SG 2.97Å; G312-C327 PolarHBondContact O-SG 2.61Å; C314-C327 HydrophobicContact CB-CB 3.81Å; C314-C327 VanDerWaalsContact CB-SG 3.58Å; C314-C327 PolarHBondContact N-SG 3.12Å; V316-C327 HydrophobicContact CG2-CB 4.25Å; C324-C327 HydrophobicContact CB-CB 4.08Å; C324-C327 PolarHBondContact O-N 2.71Å; C324-C327 PolarHBondContact SG-SG 2.68Å; C327-S330 PolarHBondContact O-N 3.27Å; C327-R331 WeakPolarHBondContact O-CB 3.4Å; C327-R331 WeakPolarHBondContact O-CG 3.44Å; C327-R331 PolarHBondContact O-N 3.02Å
328	R	98.6	Very high	97.6	Very high	9 Å²	9	68.7 Å²	68.7	3%	0.034	35%	0.345	C	S	.	.	H	α-helix	trans	-62	-44.6	173.8	-168.9	-171.1	-168.3	157.4	0.1	112.3	G291 C292 F295 V316 R321 N322 C324 A326 R331 C332	G291-R328 VanDerWaalsContact C-NH2 3.31Å; G291-R328 PolarHBondContact O-NH2 3.06Å; C292-R328 PolarHBondContact SG-NH2 3.41Å; C292-R328 VanDerWaalsContact SG-NH2 3.41Å; F295-R328 HydrophobicContact CD1-CG 3.9Å; F295-R328 HydrophobicContact CE1-CB 3.92Å; F295-R328 HydrophobicContact CE1-CG 3.7Å; F295-R328 HydrophobicContact CZ-CB 4.1Å; F295-R328 HydrophobicContact CZ-CG 4.25Å; V316-R328 HydrophobicContact CG1-CB 4.28Å; V316-R328 HydrophobicContact CG1-CG 4Å; R321-R328 WeakPolarHBondContact O-CD 3.12Å; R321-R328 PolarHBondContact O-NH1 3.22Å; N322-R328 PolarHBondContact OD1-NH1 3.43Å; C324-R328 WeakPolarHBondContact O-CB 3.38Å; C324-R328 PolarHBondContact O-N 2.91Å; A326-R328 VanDerWaalsContact C-N 3.34Å; A326-R328 PolarHBondContact O-N 3.27Å; R328-R331 PolarHBondContact O-N 3.18Å; R328-C332 PolarHBondContact O-N 3.09Å; R328-C332 PolarHBondContact O-SG 3.26Å
329	L	98.4	Very high	97.5	Very high	23 Å²	23	72.6 Å²	72.6	12%	0.12	35%	0.354	C	S	.	.	H	α-helix	trans	-67.8	-39.1	178.5	-175.3	60.9	0	0	0	111.6	F295 F296 Y306 Q325 A326 C332 L333	F295-L329 HydrophobicContact CE1-CB 3.87Å; F295-L329 HydrophobicContact CE1-CD1 4.25Å; F295-L329 HydrophobicContact CZ-CB 4.04Å; F296-L329 HydrophobicContact CD2-CD1 4.09Å; F296-L329 HydrophobicContact CE2-CD1 4.45Å; Y306-L329 HydrophobicContact CD2-CB 4.08Å; Y306-L329 HydrophobicContact CD2-CD2 3.75Å; Y306-L329 HydrophobicContact CE2-CB 4.36Å; Y306-L329 HydrophobicContact CE2-CD2 3.93Å; Q325-L329 WeakPolarHBondContact O-CB 3.32Å; Q325-L329 PolarHBondContact O-N 3.5Å; A326-L329 PolarHBondContact O-N 3.07Å; L329-C332 WeakPolarHBondContact O-CB 3.41Å; L329-C332 PolarHBondContact O-N 3.13Å; L329-L333 HydrophobicContact CG-CD1 4.45Å; L329-L333 WeakPolarHBondContact O-CG 3.41Å; L329-L333 PolarHBondContact O-N 3.48Å; L329-L333 VanDerWaalsContact O-N 3.08Å
330	S	97.7	Very high	97.4	Very high	57 Å²	57	69.4 Å²	69.4	40%	0.399	35%	0.352	S	S	.	.	H	α-helix	trans	-57.8	-50.2	171.2	-174.2	0	0	0	0	111	A326 C327 C332 L333 L334	A326-S330 WeakPolarHBondContact O-CB 3.44Å; A326-S330 PolarHBondContact O-N 3.34Å; C327-S330 PolarHBondContact O-N 3.27Å; S330-C332 PolarHBondContact O-N 2.91Å; S330-L333 PolarHBondContact O-N 2.91Å; S330-L333 VanDerWaalsContact O-N 3.07Å; S330-L334 WeakPolarHBondContact O-CB 3.49Å; S330-L334 WeakPolarHBondContact O-CG 3.49Å; S330-L334 PolarHBondContact O-N 3.35Å
331	R	97.9	Very high	97.3	Very high	138 Å²	138	65.1 Å²	65.1	52%	0.521	35%	0.345	S	S	.	.	H	α-helix	trans	-60	-38.7	175.3	-73	-71.4	-173.5	141.9	0.7	113.3	V274 V316 C327 R328 L333 L334 A335	V274-R331 HydrophobicContact CG1-CB 4.17Å; V316-R331 HydrophobicContact CB-CG 4.21Å; V316-R331 HydrophobicContact CG2-CB 4.45Å; V316-R331 HydrophobicContact CG2-CG 3.85Å; C327-R331 WeakPolarHBondContact O-CB 3.4Å; C327-R331 WeakPolarHBondContact O-CG 3.44Å; C327-R331 PolarHBondContact O-N 3.02Å; R328-R331 PolarHBondContact O-N 3.18Å; R331-L333 VanDerWaalsContact C-N 3.33Å; R331-L333 PolarHBondContact O-N 3.36Å; R331-L334 PolarHBondContact O-N 3Å; R331-A335 VanDerWaalsContact O-CB 3.29Å; R331-A335 WeakPolarHBondContact O-CB 3.29Å; R331-A335 PolarHBondContact O-N 2.91Å
332	C	98.5	Very high	97	Very high	0 Å²	0	63.5 Å²	63.5	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-58.4	-43.4	172.1	-68.3	0	0	0	0	112.4	V274 F296 R328 L329 S330 M337	V274-C332 HydrophobicContact CG2-CB 4.5Å; F296-C332 HydrophobicContact CD2-CB 3.63Å; F296-C332 HydrophobicContact CE2-CB 4.14Å; R328-C332 PolarHBondContact O-N 3.09Å; R328-C332 PolarHBondContact O-SG 3.26Å; L329-C332 WeakPolarHBondContact O-CB 3.41Å; L329-C332 PolarHBondContact O-N 3.13Å; S330-C332 PolarHBondContact O-N 2.91Å; C332-M337 HydrophobicContact CB-CG 4.45Å; C332-M337 HydrophobicContact CB-SD 3.56Å; C332-M337 VanDerWaalsContact CB-SD 3.56Å; C332-M337 VanDerWaalsContact O-CB 3.23Å; C332-M337 WeakPolarHBondContact O-CB 3.39Å; C332-M337 VanDerWaalsContact O-CG 3.24Å; C332-M337 WeakPolarHBondContact O-CG 3.38Å; C332-M337 PolarHBondContact O-N 3.45Å; C332-M337 VanDerWaalsContact O-N 3.08Å
333	L	97.8	Very high	96.5	Very high	67 Å²	67	63.3 Å²	63.3	35%	0.351	34%	0.336	S	S	.	.	H	α-helix	trans	-72.8	-41.3	-179.9	-67.1	169.4	0	0	0	111.8	F296 L329 S330 R331 G336 K339	F296-L333 HydrophobicContact CE2-CD2 3.78Å; F296-L333 HydrophobicContact CE2-CG 4.37Å; F296-L333 HydrophobicContact CZ-CD2 4.23Å; L329-L333 HydrophobicContact CG-CD1 4.45Å; L329-L333 WeakPolarHBondContact O-CG 3.41Å; L329-L333 PolarHBondContact O-N 3.48Å; L329-L333 VanDerWaalsContact O-N 3.08Å; S330-L333 PolarHBondContact O-N 2.91Å; S330-L333 VanDerWaalsContact O-N 3.07Å; R331-L333 VanDerWaalsContact C-N 3.33Å; R331-L333 PolarHBondContact O-N 3.36Å; L333-G336 WeakPolarHBondContact O-CA 3.45Å; L333-G336 PolarHBondContact O-N 3.17Å; L333-K339 HydrophobicContact CD2-CD 4.29Å; L333-K339 HydrophobicContact CD2-CG 3.89Å
334	L	97.5	Very high	95.4	Very high	131 Å²	131	66.3 Å²	66.3	69%	0.686	34%	0.34	S	S	*	.	H	α-helix	trans	-63.4	-37.8	175.7	-71.3	169.3	0	0	0	112.4	S330 R331 G336	S330-L334 WeakPolarHBondContact O-CB 3.49Å; S330-L334 WeakPolarHBondContact O-CG 3.49Å; S330-L334 PolarHBondContact O-N 3.35Å; R331-L334 PolarHBondContact O-N 3Å; L334-G336 PolarHBondContact O-N 2.77Å
335	A	96.9	Very high	94	Very high	26 Å²	26	69.6 Å²	69.6	22%	0.215	37%	0.368	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-12.5	171.4	0	0	0	0	0	112.9	Q273 V274 Q286 R331	Q273-A335 HydrophobicContact CB-CB 4.31Å; V274-A335 HydrophobicContact CG2-CB 3.99Å; Q286-A335 WeakPolarHBondContact CG-O 3.47Å; Q286-A335 PolarHBondContact NE2-O 2.89Å; R331-A335 VanDerWaalsContact O-CB 3.29Å; R331-A335 WeakPolarHBondContact O-CB 3.29Å; R331-A335 PolarHBondContact O-N 2.91Å
336	G	97.5	Very high	92.5	Very high	27 Å²	27	73.7 Å²	73.7	28%	0.278	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	93.9	21.3	176.7	0	0	0	0	0	115.2	L333 L334 K338	L333-G336 WeakPolarHBondContact O-CA 3.45Å; L333-G336 PolarHBondContact O-N 3.17Å; L334-G336 PolarHBondContact O-N 2.77Å; G336-K338 PolarHBondContact O-N 2.71Å
337	M	98.1	Very high	90.3	Very high	5 Å²	5	76.7 Å²	76.7	3%	0.025	40%	0.404	C	S	.	.			trans	-66.9	122.3	173.8	-61.3	179.6	78.4	0	0	110.6	V274 Y284 Q286 T288 F296 C332 K339	V274-M337 HydrophobicContact CG2-SD 3.89Å; Y284-M337 HydrophobicContact CD2-CE 3.63Å; Y284-M337 HydrophobicContact CE2-CE 4.49Å; Y284-M337 HydrophobicContact CG-CE 4.45Å; Q286-M337 HydrophobicContact CB-CG 4.25Å; Q286-M337 HydrophobicContact CG-CG 4.38Å; T288-M337 HydrophobicContact CG2-CE 4Å; T288-M337 HydrophobicContact CG2-CG 4.46Å; T288-M337 HydrophobicContact CG2-SD 3.9Å; F296-M337 HydrophobicContact CB-CE 3.61Å; F296-M337 HydrophobicContact CB-SD 4.24Å; F296-M337 HydrophobicContact CD1-CB 4.25Å; F296-M337 HydrophobicContact CD1-CE 3.89Å; F296-M337 HydrophobicContact CD2-CB 4.08Å; F296-M337 HydrophobicContact CD2-CE 4.32Å; F296-M337 HydrophobicContact CD2-SD 4.16Å; F296-M337 HydrophobicContact CE1-CB 3.91Å; F296-M337 HydrophobicContact CE2-CB 3.73Å; F296-M337 HydrophobicContact CG-CB 4.32Å; F296-M337 HydrophobicContact CG-CE 3.69Å; F296-M337 HydrophobicContact CG-SD 4.13Å; F296-M337 HydrophobicContact CZ-CB 3.63Å; F296-M337 VanDerWaalsContact CZ-O 3.23Å; F296-M337 WeakPolarHBondContact CZ-O 3.42Å; C332-M337 HydrophobicContact CB-CG 4.45Å; C332-M337 HydrophobicContact CB-SD 3.56Å; C332-M337 VanDerWaalsContact CB-SD 3.56Å; C332-M337 VanDerWaalsContact O-CB 3.23Å; C332-M337 WeakPolarHBondContact O-CB 3.39Å; C332-M337 VanDerWaalsContact O-CG 3.24Å; C332-M337 WeakPolarHBondContact O-CG 3.38Å; C332-M337 PolarHBondContact O-N 3.45Å; C332-M337 VanDerWaalsContact O-N 3.08Å; M337-K339 PolarHBondContact O-N 2.83Å
338	K	96.7	Very high	88	Confident	128 Å²	128	82.9 Å²	82.9	56%	0.557	44%	0.437	S	S	*	.			trans	-84.6	115.2	-171.4	-61.9	-178.3	-178.5	179.7	0	111.4	Y284 G336 S340 A341	Y284-K338 PolarHBondContact O-N 2.8Å; G336-K338 PolarHBondContact O-N 2.71Å; K338-S340 PolarHBondContact O-N 2.85Å; K338-A341 HydrophobicContact CB-CB 4.15Å; K338-A341 WeakPolarHBondContact O-CB 3.23Å; K338-A341 PolarHBondContact O-N 3.14Å
339	K	96.1	Very high	85.4	Confident	123 Å²	123	88.1 Å²	88.1	54%	0.535	47%	0.47	S	S	.	.	G	3₁₀ helix	trans	-54.7	-37.7	174.6	-63.4	-173.5	-179	179	0	112	F296 V300 L333 M337 A341 V342	F296-K339 HydrophobicContact CZ-CG 4.11Å; V300-K339 HydrophobicContact CG1-CB 4.14Å; V300-K339 HydrophobicContact CG2-CB 4.39Å; V300-K339 HydrophobicContact CG2-CG 4.01Å; L333-K339 HydrophobicContact CD2-CD 4.29Å; L333-K339 HydrophobicContact CD2-CG 3.89Å; M337-K339 PolarHBondContact O-N 2.83Å; K339-A341 VanDerWaalsContact C-N 3.27Å; K339-A341 PolarHBondContact O-N 2.83Å; K339-V342 WeakPolarHBondContact O-CB 3.24Å; K339-V342 PolarHBondContact O-N 2.63Å; K339-V342 VanDerWaalsContact O-N 3.1Å
340	S	94	Very high	82.9	Confident	114 Å²	114	94.9 Å²	94.9	80%	0.797	50%	0.501	S	S	*	.	G	3₁₀ helix	trans	-65.4	-22.1	177.8	51.7	0	0	0	0	114.7	K338 V342	K338-S340 PolarHBondContact O-N 2.85Å; S340-V342 PolarHBondContact O-N 2.95Å
341	A	93.2	Very high	80	Confident	47 Å²	47	97.8 Å²	97.8	39%	0.388	52%	0.517	S	S	.	.	G	3₁₀ helix	trans	-77.9	-10.7	174.4	0	0	0	0	0	112.7	Y284 K338 K339 Q343	Y284-A341 HydrophobicContact CD1-CB 3.98Å; K338-A341 HydrophobicContact CB-CB 4.15Å; K338-A341 WeakPolarHBondContact O-CB 3.23Å; K338-A341 PolarHBondContact O-N 3.14Å; K339-A341 VanDerWaalsContact C-N 3.27Å; K339-A341 PolarHBondContact O-N 2.83Å; A341-Q343 PolarHBondContact O-N 3.1Å
342	V	91.7	Very high	77.4	Confident	12 Å²	12	100 Å²	100	7%	0.073	53%	0.527	C	S	.	.	S	Bend	trans	-80.1	101.7	172.6	-174.8	0	0	0	0	108.2	Y284 F296 K297 V300 R301 K339 S340 R344	Y284-V342 HydrophobicContact CD1-CB 4.48Å; Y284-V342 HydrophobicContact CD1-CG2 3.63Å; Y284-V342 HydrophobicContact CE1-CB 4.26Å; Y284-V342 HydrophobicContact CE1-CG2 3.64Å; Y284-V342 HydrophobicContact CG-CG2 4.3Å; F296-V342 HydrophobicContact CD1-CG2 3.81Å; F296-V342 HydrophobicContact CE1-CG2 3.63Å; K297-V342 HydrophobicContact CG-CG1 4.4Å; V300-V342 HydrophobicContact CB-CB 4.25Å; V300-V342 HydrophobicContact CB-CG1 4.26Å; V300-V342 HydrophobicContact CB-CG2 3.92Å; V300-V342 HydrophobicContact CG1-CB 3.79Å; V300-V342 HydrophobicContact CG1-CG1 4.1Å; V300-V342 HydrophobicContact CG1-CG2 3.85Å; V300-V342 HydrophobicContact CG2-CG2 4.17Å; R301-V342 HydrophobicContact CG-CG1 3.83Å; K339-V342 WeakPolarHBondContact O-CB 3.24Å; K339-V342 PolarHBondContact O-N 2.63Å; K339-V342 VanDerWaalsContact O-N 3.1Å; S340-V342 PolarHBondContact O-N 2.95Å; V342-R344 PolarHBondContact O-N 2.93Å
343	Q	85.2	Confident	74.3	Confident	114 Å²	114	106.6 Å²	106.6	53%	0.533	56%	0.561	S	S	.	*	P	Polyproline II helix	trans	-49.8	130.2	170.9	-66.7	177.9	2.3	0	0	109.2	R301 A341	R301-Q343 VanDerWaalsContact CZ-O 3.28Å; R301-Q343 PolarHBondContact NE-O 2.82Å; R301-Q343 PolarHBondContact NH2-O 3.23Å; A341-Q343 PolarHBondContact O-N 3.1Å
344	R	74.4	Confident	71	Confident	231 Å²	231	109.2 Å²	109.2	87%	0.872	58%	0.584	S	S	*	*	P	Polyproline II helix	trans	-54.2	163.7	167.1	-68.3	-177.3	179.8	179.6	-1.3	109.2	V342 R346	V342-R344 PolarHBondContact O-N 2.93Å; R344-R346 PolarHBondContact O-N 2.78Å; R344-R346 VanDerWaalsContact O-N 3.15Å
345	A	68.5	Low	67.8	Low	85 Å²	85	107.6 Å²	107.6	70%	0.702	58%	0.583	S	S	*	*	P	Polyproline II helix	trans	-49.9	128.7	176.1	0	0	0	0	0	108.9	A347	A345-A347 PolarHBondContact O-N 3.07Å
346	R	66.5	Low	65.1	Low	189 Å²	189	112 Å²	112	71%	0.713	61%	0.608	S	S	*	*	P	Polyproline II helix	trans	-61.9	127.1	163.3	-68.3	180	-173.6	151.6	6	104.3	R344 N348	R344-R346 PolarHBondContact O-N 2.78Å; R344-R346 VanDerWaalsContact O-N 3.15Å; R346-N348 PolarHBondContact O-N 3.18Å; R346-N348 VanDerWaalsContact O-N 3.15Å
347	A	52.9	Low	62.3	Low	81 Å²	81	115.4 Å²	115.4	67%	0.669	62%	0.623	S	S	*	*	P	Polyproline II helix	trans	-52.7	125.9	163.8	0	0	0	0	0	105.9	A345 T349	A345-A347 PolarHBondContact O-N 3.07Å; A347-T349 PolarHBondContact O-N 3.41Å
348	N	50.3	Low	59.3	Low	134 Å²	134	120.5 Å²	120.5	72%	0.717	66%	0.657	S	S	*	*			trans	-71.1	83.5	175	-81.8	-1.1	0	0	0	107.2	R346 Q350	R346-N348 PolarHBondContact O-N 3.18Å; R346-N348 VanDerWaalsContact O-N 3.15Å; N348-Q350 PolarHBondContact O-N 3.2Å
349	T	43.7	Very low	56.5	Low	119 Å²	119	120.9 Å²	120.9	73%	0.73	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.5	63.7	161.4	51.5	0	0	0	0	108.6	A347	A347-T349 PolarHBondContact O-N 3.41Å
350	Q	45.1	Very low	53.7	Low	164 Å²	164	116 Å²	116	77%	0.766	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124.1	8	164	-70.8	-173.2	-11	0	0	110.3	N348	N348-Q350 PolarHBondContact O-N 3.2Å
351	T	38.5	Very low	51.3	Low	119 Å²	119	112.1 Å²	112.1	73%	0.73	61%	0.61	S	S	*	*	S	Bend	trans	-60.1	126.3	134.6	42.1	0	0	0	0	107.5	L353	T351-L353 PolarHBondContact O-N 2.87Å; T351-L353 VanDerWaalsContact O-N 3.11Å
352	Y	41.5	Very low	48.7	Very low	185 Å²	185	117 Å²	117	73%	0.725	62%	0.619	S	S	*	*			trans	-66.7	111.7	-165.9	-76.5	-101.1	0	0	0	112.4	M540	Y352-M540 WeakPolarHBondContact OH-CE 3.34Å
353	L	34.9	Very low	46.5	Very low	138 Å²	138	121.2 Å²	121.2	72%	0.723	65%	0.647	S	S	*	*			trans	38.5	99.1	137	-58.8	170.5	0	0	0	117.7	T351 S355	T351-L353 PolarHBondContact O-N 2.87Å; T351-L353 VanDerWaalsContact O-N 3.11Å; L353-S355 WeakPolarHBondContact CD2-OG 3.17Å
354	C	27	Very low	44.9	Very low	122 Å²	122	119.9 Å²	119.9	82%	0.824	65%	0.647	S	S	*	*				-119.3	104.8	120.2	-172.6	0	0	0	0	108.7	T356	C354-T356 PolarHBondContact O-N 3.38Å
355	S	31.9	Very low	43.7	Very low	97 Å²	97	114 Å²	114	68%	0.678	63%	0.631	S	S	*	*			trans	-85.2	99	177.7	-62	0	0	0	0	110.8	L353	L353-S355 WeakPolarHBondContact CD2-OG 3.17Å
356	T	38.6	Very low	42.7	Very low	118 Å²	118	112.8 Å²	112.8	72%	0.724	62%	0.621	S	S	*	*			trans	-127.4	97.5	153.2	53.1	0	0	0	0	109.8	C354	C354-T356 PolarHBondContact O-N 3.38Å
357	T	39.4	Very low	41.8	Very low	99 Å²	99	106.8 Å²	106.8	61%	0.607	61%	0.612	S	S	*	*			trans	23	129.2	145.1	50.8	0	0	0	0	119.1	Y359	T357-Y359 PolarHBondContact O-N 3.41Å
358	P	34.9	Very low	41.8	Very low	112 Å²	112	105.7 Å²	105.7	73%	0.727	60%	0.603	S	S	*	*	S	Bend	trans	-74.8	58.9	159	34.4	-34.3	0	0	0	110.8
359	Y	38.6	Very low	42	Very low	135 Å²	135	102.2 Å²	102.2	53%	0.529	59%	0.593	S	S	.	*			trans	-97.7	112.3	165.5	-107.8	-106.3	0	0	0	107	T357 I448	T357-Y359 PolarHBondContact O-N 3.41Å; Y359-I448 HydrophobicContact CD2-CD1 3.66Å; Y359-I448 HydrophobicContact CE2-CD1 3.58Å
360	S	36.8	Very low	42.8	Very low	20 Å²	20	101.5 Å²	101.5	14%	0.14	59%	0.588	C	S	.	*				69.3	103	93.9	-172.3	0	0	0	0	112.9	Y362 Q446	S360-Y362 VanDerWaalsContact C-N 3.3Å; S360-Y362 VanDerWaalsContact O-CD2 3.26Å; S360-Y362 WeakPolarHBondContact O-CD2 3.21Å; S360-Y362 PolarHBondContact O-N 2.67Å; S360-Q446 VanDerWaalsContact OG-CB 3.3Å; S360-Q446 WeakPolarHBondContact OG-CB 3.4Å
361	S	42.8	Very low	43.3	Very low	33 Å²	33	96.4 Å²	96.4	23%	0.231	57%	0.574	C	S	.	*	S	Bend	trans	61.9	-15.2	146.9	-50.9	0	0	0	0	122.4	P363 N445	S361-P363 VanDerWaalsContact C-CD 3.48Å; S361-N445 WeakPolarHBondContact CB-OD1 3.38Å; S361-N445 PolarHBondContact OG-OD1 2.58Å
362	Y	40	Very low	44.2	Very low	149 Å²	149	93.5 Å²	93.5	58%	0.584	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.1	5.3	-159.4	-81.8	-76.7	0	0	0	121.9	S360 I365	S360-Y362 VanDerWaalsContact C-N 3.3Å; S360-Y362 VanDerWaalsContact O-CD2 3.26Å; S360-Y362 WeakPolarHBondContact O-CD2 3.21Å; S360-Y362 PolarHBondContact O-N 2.67Å; Y362-I365 HydrophobicContact CD1-CD1 3.96Å; Y362-I365 HydrophobicContact CE1-CD1 3.69Å
363	P	45.4	Very low	44.9	Very low	102 Å²	102	87.5 Å²	87.5	66%	0.662	55%	0.551	S	S	*	*	H	α-helix	trans	-77.8	-19.6	173.3	31.2	-33.1	0	0	0	114	S361 A367	S361-P363 VanDerWaalsContact C-CD 3.48Å; P363-A367 PolarHBondContact O-N 3.16Å
364	V	50.6	Low	45.8	Very low	86 Å²	86	83.3 Å²	83.3	52%	0.521	54%	0.536	S	S	.	.	H	α-helix	trans	-72.5	-35.6	-175.4	-173.2	0	0	0	0	112.3	A368	V364-A368 WeakPolarHBondContact O-CB 3Å; V364-A368 PolarHBondContact O-N 3.19Å
365	I	50	Low	47.3	Very low	106 Å²	106	82 Å²	82	54%	0.544	53%	0.525	S	S	.	.	H	α-helix	trans	-77.3	-34.9	-177	-63.6	167.7	0	0	0	111.2	Y362 A368 A369	Y362-I365 HydrophobicContact CD1-CD1 3.96Å; Y362-I365 HydrophobicContact CE1-CD1 3.69Å; I365-A368 PolarHBondContact O-N 2.72Å; I365-A369 WeakPolarHBondContact O-CB 3.45Å; I365-A369 PolarHBondContact O-N 2.93Å
366	A	47	Very low	48.3	Very low	61 Å²	61	80.7 Å²	80.7	50%	0.504	52%	0.52	S	S	.	.	H	α-helix	trans	-66.5	-42.6	173.4	0	0	0	0	0	111.8	A368 A369 V370	A366-A368 PolarHBondContact O-N 3.04Å; A366-A369 PolarHBondContact O-N 3.46Å; A366-V370 WeakPolarHBondContact O-CG2 3.37Å; A366-V370 PolarHBondContact O-N 2.85Å
367	A	47.5	Very low	48.9	Very low	63 Å²	63	85.1 Å²	85.1	52%	0.521	52%	0.524	S	S	.	.	H	α-helix	trans	-62.4	-41.1	173.9	0	0	0	0	0	112.1	P363 V370 A371	P363-A367 PolarHBondContact O-N 3.16Å; A367-V370 PolarHBondContact O-N 2.84Å; A367-A371 WeakPolarHBondContact O-CB 3.03Å; A367-A371 PolarHBondContact O-N 2.84Å
368	A	54	Low	49.5	Very low	58 Å²	58	87.4 Å²	87.4	48%	0.479	53%	0.532	S	S	.	.	H	α-helix	trans	-64	-39.6	174.6	0	0	0	0	0	112.8	V364 I365 A366 A371 A372	V364-A368 WeakPolarHBondContact O-CB 3Å; V364-A368 PolarHBondContact O-N 3.19Å; I365-A368 PolarHBondContact O-N 2.72Å; A366-A368 PolarHBondContact O-N 3.04Å; A368-A371 PolarHBondContact O-N 3.44Å; A368-A372 WeakPolarHBondContact O-CB 3.26Å; A368-A372 PolarHBondContact O-N 3.38Å
369	A	53.4	Low	50.5	Low	60 Å²	60	90.7 Å²	90.7	50%	0.496	54%	0.538	S	S	.	.	H	α-helix	trans	-66.2	-39.6	176.2	0	0	0	0	0	112.4	I365 A366 A372 A373	I365-A369 WeakPolarHBondContact O-CB 3.45Å; I365-A369 PolarHBondContact O-N 2.93Å; A366-A369 PolarHBondContact O-N 3.46Å; A369-A372 PolarHBondContact O-N 2.95Å; A369-A373 WeakPolarHBondContact O-CB 3.28Å; A369-A373 PolarHBondContact O-N 3.47Å
370	V	60.2	Low	50.5	Low	105 Å²	105	87 Å²	87	64%	0.636	54%	0.541	S	S	*	.	H	α-helix	trans	-69	-38.2	174.9	174.8	0	0	0	0	111.4	A366 A367 A373 A374	A366-V370 WeakPolarHBondContact O-CG2 3.37Å; A366-V370 PolarHBondContact O-N 2.85Å; A367-V370 PolarHBondContact O-N 2.84Å; V370-A373 PolarHBondContact O-N 3.3Å; V370-A374 VanDerWaalsContact O-CB 3.32Å; V370-A374 WeakPolarHBondContact O-CB 3.2Å; V370-A374 PolarHBondContact O-N 3.34Å
371	A	56.1	Low	50.5	Low	57 Å²	57	92.5 Å²	92.5	47%	0.471	57%	0.574	S	S	.	*	H	α-helix	trans	-66.8	-37.1	173.7	0	0	0	0	0	112.8	A367 A368 T375	A367-A371 WeakPolarHBondContact O-CB 3.03Å; A367-A371 PolarHBondContact O-N 2.84Å; A368-A371 PolarHBondContact O-N 3.44Å; A371-T375 PolarHBondContact O-N 2.82Å; A371-T375 PolarHBondContact O-OG1 2.9Å
372	A	57.7	Low	50.1	Low	58 Å²	58	97.5 Å²	97.5	48%	0.479	60%	0.602	S	S	.	*	H	α-helix	trans	-67.2	-40.2	172.8	0	0	0	0	0	112	A368 A369 T375 A376	A368-A372 WeakPolarHBondContact O-CB 3.26Å; A368-A372 PolarHBondContact O-N 3.38Å; A369-A372 PolarHBondContact O-N 2.95Å; A372-T375 WeakPolarHBondContact CA-OG1 3.48Å; A372-T375 PolarHBondContact O-N 2.95Å; A372-T375 PolarHBondContact O-OG1 2.88Å; A372-T375 VanDerWaalsContact O-OG1 3.05Å; A372-A376 WeakPolarHBondContact O-CB 3.17Å; A372-A376 PolarHBondContact O-N 2.71Å
373	A	57.1	Low	49.8	Very low	58 Å²	58	96.6 Å²	96.6	48%	0.479	61%	0.612	S	S	.	*	H	α-helix	trans	-66.4	-41.2	174.3	0	0	0	0	0	112.1	A369 V370 T375 A376 Y377	A369-A373 WeakPolarHBondContact O-CB 3.28Å; A369-A373 PolarHBondContact O-N 3.47Å; V370-A373 PolarHBondContact O-N 3.3Å; A373-T375 PolarHBondContact O-N 3.04Å; A373-A376 PolarHBondContact O-N 2.62Å; A373-Y377 PolarHBondContact O-N 2.89Å
374	A	53.6	Low	49.2	Very low	51 Å²	51	98.8 Å²	98.8	42%	0.421	62%	0.624	S	S	.	*	H	α-helix	trans	-65.8	-36.1	177.3	0	0	0	0	0	112.8	V370 L378	V370-A374 VanDerWaalsContact O-CB 3.32Å; V370-A374 WeakPolarHBondContact O-CB 3.2Å; V370-A374 PolarHBondContact O-N 3.34Å; A374-L378 PolarHBondContact O-N 3.41Å
375	T	57.1	Low	48.6	Very low	95 Å²	95	100.6 Å²	100.6	58%	0.583	64%	0.636	S	S	*	*	H	α-helix	trans	-73.2	-34.9	174	43.1	0	0	0	0	112.5	A371 A372 A373 L378	A371-T375 PolarHBondContact O-N 2.82Å; A371-T375 PolarHBondContact O-OG1 2.9Å; A372-T375 WeakPolarHBondContact CA-OG1 3.48Å; A372-T375 PolarHBondContact O-N 2.95Å; A372-T375 PolarHBondContact O-OG1 2.88Å; A372-T375 VanDerWaalsContact O-OG1 3.05Å; A373-T375 PolarHBondContact O-N 3.04Å; T375-L378 PolarHBondContact O-N 2.92Å
376	A	54	Low	47.6	Very low	69 Å²	69	102 Å²	102	57%	0.57	65%	0.649	S	S	*	*	H	α-helix	trans	-64.1	-39.3	170.8	0	0	0	0	0	112.6	A372 A373 L378 H379	A372-A376 WeakPolarHBondContact O-CB 3.17Å; A372-A376 PolarHBondContact O-N 2.71Å; A373-A376 PolarHBondContact O-N 2.62Å; A376-L378 VanDerWaalsContact C-N 3.26Å; A376-L378 PolarHBondContact O-N 2.89Å; A376-H379 PolarHBondContact O-N 3.33Å
377	Y	51.4	Low	47.1	Very low	210 Å²	210	106 Å²	106	82%	0.824	67%	0.668	S	S	*	*	H	α-helix	trans	-71.8	-17.1	179.5	-133.3	-91.4	0	0	0	114	A373	A373-Y377 PolarHBondContact O-N 2.89Å
378	L	51.8	Low	46.3	Very low	148 Å²	148	108.8 Å²	108.8	78%	0.775	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.3	-7.8	178	-94.5	159.6	0	0	0	114.3	A374 T375 A376	A374-L378 PolarHBondContact O-N 3.41Å; T375-L378 PolarHBondContact O-N 2.92Å; A376-L378 VanDerWaalsContact C-N 3.26Å; A376-L378 PolarHBondContact O-N 2.89Å
379	H	54.7	Low	45.5	Very low	181 Å²	181	112.6 Å²	112.6	84%	0.838	70%	0.696	S	S	*	*	S	Bend	trans	-114.2	13.7	-174	-119.6	-89.9	0	0	0	114.7	A376	A376-H379 PolarHBondContact O-N 3.33Å
380	G	38.7	Very low	44.6	Very low	58 Å²	58	116.6 Å²	116.6	60%	0.598	71%	0.709	S	S	*	*	S	Bend	trans	-134.8	27.5	-160	0	0	0	0	0	119
381	T	37.5	Very low	43.5	Very low	135 Å²	135	118.1 Å²	118.1	83%	0.828	72%	0.719	S	S	*	*			trans	-152.3	50	175.2	41.9	0	0	0	0	116.1
382	V	33.8	Very low	42.7	Very low	138 Å²	138	122.1 Å²	122.1	84%	0.836	73%	0.732	S	S	*	*			trans	-141.5	81.3	163.7	-167.4	0	0	0	0	112.9
383	T	33.7	Very low	41.7	Very low	129 Å²	129	127.1 Å²	127.1	79%	0.791	75%	0.751	S	S	*	*			trans	-171.6	109.6	139.8	7.2	0	0	0	0	111.6
384	T	33.4	Very low	40.6	Very low	149 Å²	149	129.8 Å²	129.8	91%	0.914	76%	0.761	S	S	*	*			trans	-143.4	82	154.1	-45.7	0	0	0	0	108.9
385	T	37.2	Very low	39.9	Very low	124 Å²	124	133.2 Å²	133.2	76%	0.761	78%	0.777	S	S	*	*			trans	-108.7	125.2	163.6	29.9	0	0	0	0	109
386	T	30.6	Very low	38.9	Very low	135 Å²	135	133.9 Å²	133.9	83%	0.828	78%	0.781	S	S	*	*			trans	-46.3	132.6	178.2	47.8	0	0	0	0	114.3
387	T	35.5	Very low	37.9	Very low	145 Å²	145	136.9 Å²	136.9	89%	0.89	79%	0.788	S	S	*	*			trans	-156.2	134.5	140.2	0.2	0	0	0	0	111.2
388	T	31.2	Very low	37.1	Very low	122 Å²	122	135.2 Å²	135.2	75%	0.748	79%	0.785	S	S	*	*			trans	-81	141.6	179.4	48.1	0	0	0	0	111.5
389	T	37.1	Very low	36	Very low	138 Å²	138	135.1 Å²	135.1	85%	0.847	78%	0.784	S	S	*	*				-173	141.9	125.7	17.2	0	0	0	0	113.8
390	N	35.2	Very low	34.9	Very low	144 Å²	144	131.4 Å²	131.4	77%	0.77	78%	0.778	S	S	*	*			trans	-51.5	148.2	176.6	-43.2	-42.3	0	0	0	114.6
391	T	36.4	Very low	34.4	Very low	137 Å²	137	136.2 Å²	136.2	84%	0.84	79%	0.79	S	S	*	*				-176.4	159.1	100.1	25	0	0	0	0	112.5
392	N	39.6	Very low	34.2	Very low	141 Å²	141	136.2 Å²	136.2	75%	0.754	80%	0.796	S	S	*	*			trans	-79.1	155.5	-174.7	-38.9	-56.1	0	0	0	111.6
393	D	36.7	Very low	33.8	Very low	163 Å²	163	139.8 Å²	139.8	87%	0.872	80%	0.796	S	S	*	*				-170.4	172.6	104.4	-102	-28.8	0	0	0	114.3
394	T	34	Very low	33.7	Very low	113 Å²	113	140.5 Å²	140.5	69%	0.693	79%	0.793	S	S	*	*			trans	-123.4	179.2	-150.9	-42.6	0	0	0	0	112.1
395	T	37.7	Very low	33.9	Very low	124 Å²	124	138.6 Å²	138.6	76%	0.761	78%	0.783	S	S	*	*			trans	83.3	146.5	165.8	75.8	0	0	0	0	116.9
396	T	36.2	Very low	33.7	Very low	109 Å²	109	138.8 Å²	138.8	67%	0.669	79%	0.785	S	S	*	*			cis	176.5	129.6	-43.4	28.8	0	0	0	0	107.7
397	N	34.1	Very low	33.9	Very low	132 Å²	132	137.7 Å²	137.7	71%	0.706	78%	0.778	S	S	*	*			trans	66	151.4	145.9	-56.2	-20.4	0	0	0	123.9
398	F	33.1	Very low	33.9	Very low	174 Å²	174	137.1 Å²	137.1	76%	0.763	77%	0.769	S	S	*	*			trans	102.8	83.7	150.8	-63.9	-64.3	0	0	0	122.3
399	I	30.4	Very low	34.1	Very low	146 Å²	146	138.1 Å²	138.1	75%	0.749	77%	0.765	S	S	*	*				26.2	124	127	-36.5	171.1	0	0	0	119.3
400	S	31.6	Very low	33.8	Very low	104 Å²	104	140.8 Å²	140.8	73%	0.727	76%	0.761	S	S	*	*				148.8	123.1	122.3	-64.6	0	0	0	0	115.1
401	N	28.1	Very low	33.6	Very low	159 Å²	159	141 Å²	141	85%	0.85	76%	0.761	S	S	*	*			trans	12.6	121.4	151.9	-58.5	-14.3	0	0	0	120.6
402	S	32.7	Very low	33.2	Very low	134 Å²	134	140.3 Å²	140.3	94%	0.937	76%	0.756	S	S	*	*				-177.9	169.6	119.4	39.6	0	0	0	0	113.9
403	Y	26.2	Very low	32.9	Very low	214 Å²	214	139 Å²	139	84%	0.839	76%	0.756	S	S	*	*			trans	-100.1	170.3	-151.7	-154.7	-124.3	0	0	0	113.1
404	I	31	Very low	32.6	Very low	144 Å²	144	135.3 Å²	135.3	74%	0.738	74%	0.743	S	S	*	*			trans	80.8	163.7	155.9	23.7	-173.6	0	0	0	122.7
405	P	36.4	Very low	32.5	Very low	108 Å²	108	137.7 Å²	137.7	70%	0.701	75%	0.751	S	S	*	*				-138.8	-167.9	-122	48.2	-27.6	0	0	0	116.7
406	T	34.5	Very low	32.2	Very low	129 Å²	129	135.2 Å²	135.2	79%	0.791	75%	0.75	S	S	*	*			trans	-153.3	122.4	159.2	41.1	0	0	0	0	109.1
407	T	34	Very low	31.8	Very low	112 Å²	112	137.3 Å²	137.3	69%	0.687	76%	0.758	S	S	*	*				82.4	114	58	60.2	0	0	0	0	116.7
408	N	35.7	Very low	31.6	Very low	132 Å²	132	137 Å²	137	71%	0.706	75%	0.754	S	S	*	*				-176.7	110.9	126.4	-87.7	-15.8	0	0	0	110.3
409	Q	35.3	Very low	31.5	Very low	144 Å²	144	135.2 Å²	135.2	67%	0.673	75%	0.753	S	S	*	*				69.6	128.4	102.9	-65.2	177.6	-1.7	0	0	113.9
410	Y	31.2	Very low	31.5	Very low	193 Å²	193	136.6 Å²	136.6	76%	0.757	76%	0.756	S	S	*	*			cis	-147.9	144	43.6	-89	-100.9	0	0	0	115.8
411	I	31.2	Very low	31.4	Very low	150 Å²	150	138.7 Å²	138.7	77%	0.769	76%	0.758	S	S	*	*			trans	70.2	124.8	144.7	-63	169.4	0	0	0	122
412	T	27.5	Very low	31.6	Very low	121 Å²	121	135.6 Å²	135.6	74%	0.742	75%	0.747	S	S	*	*			trans	-110.6	167	164.9	56.8	0	0	0	0	109.5
413	P	34.4	Very low	31.5	Very low	115 Å²	115	137.4 Å²	137.4	75%	0.747	74%	0.74	S	S	*	*				-138.8	159.4	69.3	19.1	6.2	0	0	0	113.3
414	S	28.7	Very low	31.7	Very low	85 Å²	85	133.5 Å²	133.5	59%	0.594	74%	0.739	S	S	*	*			cis	92.7	128.3	31	86.9	0	0	0	0	116.2
415	N	32.3	Very low	31.5	Very low	162 Å²	162	135.3 Å²	135.3	87%	0.866	74%	0.738	S	S	*	*			trans	79.5	135.8	170.1	-43.4	-26.8	0	0	0	115.9
416	G	31.3	Very low	31.1	Very low	72 Å²	72	138.5 Å²	138.5	74%	0.742	74%	0.737	S	S	*	*			cis	176.5	149.7	-11.6	0	0	0	0	0	114
417	N	28.5	Very low	31	Very low	154 Å²	154	138.7 Å²	138.7	82%	0.824	73%	0.729	S	S	*	*			trans	80	144	134.4	-130.2	5.9	0	0	0	122.1
418	I	29.4	Very low	30.8	Very low	124 Å²	124	141.4 Å²	141.4	64%	0.636	73%	0.734	S	S	*	*			trans	81.1	95.4	152	-64.1	155	0	0	0	119.5
419	N	30.4	Very low	30.4	Very low	137 Å²	137	142 Å²	142	73%	0.733	73%	0.727	S	S	*	*				81.5	137.4	124.6	-63.9	2.3	0	0	0	125.3
420	H	31.8	Very low	30.1	Very low	176 Å²	176	142 Å²	142	82%	0.815	73%	0.727	S	S	*	*			trans	91.7	108	140.3	-99.4	-76.6	0	0	0	123.3
421	L	28.1	Very low	30	Very low	148 Å²	148	140.6 Å²	140.6	78%	0.775	73%	0.727	S	S	*	*			trans	-43.7	171.6	143.8	-102.3	71.1	0	0	0	114.7
422	P	33	Very low	29.9	Very low	94 Å²	94	139.6 Å²	139.6	61%	0.61	73%	0.728	S	S	*	*			cis	-146.1	-178.8	-14.1	36.2	-14.8	0	0	0	117.3
423	Q	30.2	Very low	29.7	Very low	171 Å²	171	141.6 Å²	141.6	80%	0.799	73%	0.734	S	S	*	*			trans	79.2	148.1	134.3	-98.1	176.7	0.9	0	0	124.9
424	T	31.2	Very low	29.3	Very low	132 Å²	132	142.9 Å²	142.9	81%	0.81	73%	0.734	S	S	*	*			trans	71.2	155.5	164.1	64.5	0	0	0	0	119.4
425	Y	27	Very low	29.1	Very low	182 Å²	182	143.9 Å²	143.9	71%	0.714	74%	0.737	S	S	*	*			cis	-170.9	169.9	-34.5	-171.1	-137	0	0	0	107.9
426	Y	28	Very low	28.8	Very low	175 Å²	175	140.9 Å²	140.9	69%	0.686	73%	0.728	S	S	*	*			trans	80.8	140.5	171.5	-90.2	-61.4	0	0	0	123
427	E	31.4	Very low	28.8	Very low	134 Å²	134	144.5 Å²	144.5	63%	0.626	73%	0.731	S	S	*	*			trans	-102.2	167.8	-175.7	-51.3	148.4	110.3	0	0	111.3
428	Q	30.9	Very low	28.8	Very low	169 Å²	169	144.3 Å²	144.3	79%	0.79	73%	0.728	S	S	*	*				-178.3	130.6	103.7	-99.6	-173.8	-61.1	0	0	113.2
429	Y	26.6	Very low	28.8	Very low	145 Å²	145	143.8 Å²	143.8	57%	0.569	73%	0.733	S	S	*	*				32.1	134	128.9	-73.2	-110	0	0	0	119.3
430	E	29.9	Very low	28.6	Very low	143 Å²	143	147.5 Å²	147.5	67%	0.668	74%	0.738	S	S	*	*				-148.3	156.9	52.6	-87.2	-154.4	126	0	0	115.6	K215	K215-E430 IonicContact NZ-OE1 3.51Å; K215-E430 PolarHBondContact NZ-OE1 2.89Å
431	H	29.2	Very low	28.3	Very low	163 Å²	163	144 Å²	144	76%	0.755	73%	0.734	S	S	*	*			trans	-87	124.2	-178.1	-65.3	-96.1	0	0	0	113.3
432	T	27.4	Very low	28.4	Very low	130 Å²	130	148.8 Å²	148.8	80%	0.798	74%	0.741	S	S	*	*			trans	-133.6	130.8	151.8	49.9	0	0	0	0	110.3
433	L	23.9	Very low	28.2	Very low	162 Å²	162	151 Å²	151	85%	0.848	75%	0.747	S	S	*	*			trans	38.8	143.3	148.7	-70.5	160.2	0	0	0	120.9
434	N	25.3	Very low	28	Very low	142 Å²	142	151.1 Å²	151.1	76%	0.759	74%	0.742	S	S	*	*			trans	93	143.3	144	-110.9	-4.2	0	0	0	120.3
435	T	26	Very low	28	Very low	107 Å²	107	149.8 Å²	149.8	66%	0.656	73%	0.73	S	S	*	*			trans	62.6	100	150.2	50.1	0	0	0	0	119
436	S	26.4	Very low	28	Very low	98 Å²	98	146 Å²	146	69%	0.685	72%	0.719	S	S	*	*				34.9	105.6	119	60	0	0	0	0	117.6
437	N	29.4	Very low	28	Very low	149 Å²	149	141.6 Å²	141.6	80%	0.797	71%	0.711	S	S	*	*			trans	-170.8	146.8	140.8	-105.8	-33.6	0	0	0	113.3
438	I	29.9	Very low	27.8	Very low	150 Å²	150	138.8 Å²	138.8	77%	0.769	70%	0.7	S	S	*	*			trans	75.8	129.4	149.7	-62.3	158.4	0	0	0	118.2
439	P	29	Very low	27.6	Very low	112 Å²	112	141 Å²	141	73%	0.727	70%	0.703	S	S	*	*				-136.6	-177.8	-54.8	39.9	-20.3	0	0	0	113.2	S441	P439-S441 PolarHBondContact O-N 3.14Å
440	Y	25.3	Very low	27.6	Very low	215 Å²	215	139.8 Å²	139.8	84%	0.843	71%	0.71	S	S	*	*			trans	-70.1	116.2	171.6	-93.2	-112	0	0	0	113.2	L443	Y440-L443 HydrophobicContact CD1-CD1 4.37Å; Y440-L443 HydrophobicContact CE1-CD1 4.1Å
441	S	27.1	Very low	27.5	Very low	104 Å²	104	142.8 Å²	142.8	73%	0.727	72%	0.715	S	S	*	*			trans	-174.7	79.8	149.4	51.5	0	0	0	0	113.5	P439	P439-S441 PolarHBondContact O-N 3.14Å
442	R	29.9	Very low	27.5	Very low	247 Å²	247	145.5 Å²	145.5	93%	0.932	72%	0.719	S	S	*	*			trans	-179.6	69.3	152.4	-102.6	172.2	-168	-172.6	4.5	109.7
443	L	27.3	Very low	27.4	Very low	140 Å²	140	147.8 Å²	147.8	73%	0.733	71%	0.714	S	S	*	*			trans	-92.9	144	158.8	-79.6	163.7	0	0	0	107.7	Y440	Y440-L443 HydrophobicContact CD1-CD1 4.37Å; Y440-L443 HydrophobicContact CE1-CD1 4.1Å
444	Y	26.6	Very low	27.8	Very low	175 Å²	175	147.4 Å²	147.4	69%	0.686	71%	0.711	S	S	*	*	S	Bend	trans	75.4	138	-168	-69	-93.9	0	0	0	116.9
445	N	31.2	Very low	28	Very low	104 Å²	104	146.4 Å²	146.4	56%	0.556	72%	0.716	S	S	*	*			trans	77.5	84.3	176.6	-58.1	-11.6	0	0	0	118	S361	S361-N445 WeakPolarHBondContact CB-OD1 3.38Å; S361-N445 PolarHBondContact OG-OD1 2.58Å
446	Q	27.7	Very low	27.9	Very low	103 Å²	103	144 Å²	144	48%	0.481	71%	0.712	S	S	.	*				0.7	151.4	121.3	-79.1	-109.9	14.7	0	0	117.8	S360	S360-Q446 VanDerWaalsContact OG-CB 3.3Å; S360-Q446 WeakPolarHBondContact OG-CB 3.4Å
447	P	28.3	Very low	28	Very low	81 Å²	81	147.5 Å²	147.5	53%	0.526	72%	0.723	S	S	.	*				-148.9	171.5	58.9	40.9	-21	0	0	0	119.6
448	I	27	Very low	28	Very low	76 Å²	76	145.4 Å²	145.4	39%	0.39	72%	0.72	S	S	.	*			trans	-23.7	130	149.3	-62.9	150	0	0	0	113.4	Y359	Y359-I448 HydrophobicContact CD2-CD1 3.66Å; Y359-I448 HydrophobicContact CE2-CD1 3.58Å
449	Y	27.1	Very low	28	Very low	216 Å²	216	145.7 Å²	145.7	85%	0.847	72%	0.72	S	S	*	*			trans	-150	114.8	143.1	-105	-72.2	0	0	0	112.9
450	T	26.7	Very low	28.1	Very low	119 Å²	119	146.4 Å²	146.4	73%	0.73	72%	0.718	S	S	*	*			trans	-74.4	119.8	155.1	48.4	0	0	0	0	108.9	R452	T450-R452 PolarHBondContact O-N 3.16Å
451	R	27.2	Very low	28.4	Very low	205 Å²	205	145.3 Å²	145.3	77%	0.774	72%	0.717	S	S	*	*			trans	-88.6	93.3	173.5	-152.7	178	-155	-118	6.7	110.1	Y453	R451-Y453 PolarHBondContact NH1-OH 3.08Å
452	R	30.1	Very low	28.4	Very low	220 Å²	220	146.2 Å²	146.2	83%	0.83	72%	0.721	S	S	*	*			trans	-82.2	138.9	153.5	-80.2	-174.4	179.7	169.3	-0.6	107.8	T450	T450-R452 PolarHBondContact O-N 3.16Å
453	Y	24.8	Very low	28.4	Very low	179 Å²	179	142.8 Å²	142.8	70%	0.702	72%	0.719	S	S	*	*			trans	-81.1	118.1	160.2	-93.5	-88.1	0	0	0	108.3	R451	R451-Y453 PolarHBondContact NH1-OH 3.08Å
454	I	31.4	Very low	28.4	Very low	153 Å²	153	144.7 Å²	144.7	79%	0.785	73%	0.725	S	S	*	*			trans	-141.1	139.3	150.4	-59.4	-173.6	0	0	0	106.1
455	S	28.8	Very low	28.5	Very low	122 Å²	122	141.3 Å²	141.3	85%	0.853	73%	0.726	S	S	*	*			trans	-69.3	165.5	-179.1	-165	0	0	0	0	112.5
456	G	25.5	Very low	28.4	Very low	57 Å²	57	144.4 Å²	144.4	59%	0.588	74%	0.739	S	S	*	*			trans	-96.5	-155.4	-170.4	0	0	0	0	0	116.2
457	N	28.9	Very low	28.2	Very low	171 Å²	171	145.7 Å²	145.7	91%	0.914	75%	0.754	S	S	*	*			trans	82.1	132.7	-164.5	-53	-17.4	0	0	0	112.2
458	S	29.1	Very low	28.2	Very low	104 Å²	104	147.4 Å²	147.4	73%	0.727	76%	0.763	S	S	*	*			cis	-152.7	139.6	3.3	-165.7	0	0	0	0	112.9
459	M	28.7	Very low	28.3	Very low	156 Å²	156	148.2 Å²	148.2	77%	0.768	78%	0.775	S	S	*	*			trans	50.1	125.9	143.7	-67.7	-66.9	176.4	0	0	124.1
460	N	31.4	Very low	28.3	Very low	127 Å²	127	148.3 Å²	148.3	68%	0.679	78%	0.776	S	S	*	*			trans	91.8	98.1	136	-68.3	-31.8	0	0	0	123.9
461	K	31.9	Very low	28.4	Very low	192 Å²	192	150.3 Å²	150.3	84%	0.835	78%	0.781	S	S	*	*				63.5	121.6	128.7	-65.9	-176.7	178.4	179.5	0	121.9
462	P	26.8	Very low	28.4	Very low	124 Å²	124	145.7 Å²	145.7	81%	0.805	78%	0.778	S	S	*	*			trans	-100.4	155.8	162.5	38.3	-31.2	0	0	0	113.4
463	I	30	Very low	28.4	Very low	175 Å²	175	145.4 Å²	145.4	90%	0.897	78%	0.783	S	S	*	*			trans	-138.9	134.8	160.8	-67.6	-176.2	0	0	0	108.6
464	E	26.6	Very low	28.5	Very low	180 Å²	180	144 Å²	144	84%	0.841	79%	0.787	S	S	*	*			trans	-83.5	153.2	176.4	-58.3	173.1	128.4	0	0	112.1
465	S	28.8	Very low	28.5	Very low	103 Å²	103	143.8 Å²	143.8	72%	0.72	79%	0.788	S	S	*	*				154.6	167.6	112.3	62.7	0	0	0	0	114.3
466	M	29.6	Very low	28.5	Very low	169 Å²	169	141.7 Å²	141.7	83%	0.833	77%	0.774	S	S	*	*			trans	77.2	84.9	162	-60.8	-174.8	-179.6	0	0	119
467	V	24.6	Very low	28.7	Very low	130 Å²	130	145.6 Å²	145.6	79%	0.788	78%	0.781	S	S	*	*				-3	127.4	116.6	-172.8	0	0	0	0	114.5
468	T	26.9	Very low	28.7	Very low	117 Å²	117	142.9 Å²	142.9	72%	0.718	77%	0.771	S	S	*	*				175.7	157.2	102.3	-44.9	0	0	0	0	111.7
469	S	30.5	Very low	28.7	Very low	93 Å²	93	143.1 Å²	143.1	65%	0.65	77%	0.772	S	S	*	*			trans	73.6	105.8	146.9	46.3	0	0	0	0	123.2
470	Y	26.4	Very low	28.7	Very low	218 Å²	218	140.2 Å²	140.2	86%	0.855	77%	0.767	S	S	*	*				63.3	123.6	119.6	-74.5	-76.9	0	0	0	123.8
471	L	27.9	Very low	28.7	Very low	161 Å²	161	142 Å²	142	84%	0.843	77%	0.774	S	S	*	*			trans	86.1	133.2	145.6	-66.7	167.8	0	0	0	120.2
472	P	27.5	Very low	28.6	Very low	108 Å²	108	140 Å²	140	70%	0.701	77%	0.771	S	S	*	*			trans	-101.1	156.9	-178.1	39.6	-34.4	0	0	0	113.5
473	F	29.6	Very low	28.9	Very low	215 Å²	215	138.7 Å²	138.7	94%	0.943	76%	0.763	S	S	*	*			trans	-145	133.7	160.4	-106.8	-85.2	0	0	0	111.6
474	N	28.8	Very low	28.9	Very low	148 Å²	148	141.4 Å²	141.4	79%	0.791	76%	0.763	S	S	*	*			trans	-76.8	146.2	170.9	-78.4	-24.5	0	0	0	110.9
475	N	30	Very low	29	Very low	150 Å²	150	139.3 Å²	139.3	80%	0.802	76%	0.758	S	S	*	*				-164.4	119.4	120.8	-115.9	-25.9	0	0	0	115.1
476	S	29	Very low	29.1	Very low	78 Å²	78	145.6 Å²	145.6	55%	0.545	77%	0.768	S	S	.	*				34	156	128.8	59.4	0	0	0	0	124
477	N	29	Very low	29.2	Very low	139 Å²	139	145.7 Å²	145.7	74%	0.743	77%	0.766	S	S	*	*			trans	94.4	134.8	163.1	-52.8	-33	0	0	0	115.8
478	T	29	Very low	30	Very low	114 Å²	114	144.8 Å²	144.8	70%	0.699	76%	0.762	S	S	*	*			cis	-167.6	152.1	-0.8	11.5	0	0	0	0	110.8
479	S	29.9	Very low	30.4	Very low	108 Å²	108	145.3 Å²	145.3	76%	0.755	77%	0.768	S	S	*	*			trans	67.8	148.5	145.4	-62.7	0	0	0	0	120.1
480	S	29.7	Very low	30.4	Very low	95 Å²	95	146.9 Å²	146.9	66%	0.664	77%	0.774	S	S	*	*			cis	-175.2	159	-11.3	48.3	0	0	0	0	112.3
481	M	30.3	Very low	30.6	Very low	165 Å²	165	144.1 Å²	144.1	81%	0.813	77%	0.773	S	S	*	*			trans	77.9	143.2	161	-47.9	-162.4	79.1	0	0	119.5
482	L	30	Very low	30.6	Very low	150 Å²	150	143 Å²	143	79%	0.785	76%	0.763	S	S	*	*			cis	-166.5	151.2	-39.5	-110.6	-178.4	0	0	0	106.6
483	P	32.3	Very low	30.7	Very low	97 Å²	97	144.5 Å²	144.5	63%	0.63	76%	0.761	S	S	*	*			trans	-108.5	179.3	-171.5	41.4	-33.9	0	0	0	114.5
484	Y	30.5	Very low	30.8	Very low	232 Å²	232	142 Å²	142	91%	0.91	75%	0.752	S	S	*	*			trans	-139.4	121	158.5	-102.9	-81.4	0	0	0	111.9
485	D	28.3	Very low	30.9	Very low	136 Å²	136	141.4 Å²	141.4	73%	0.727	75%	0.748	S	S	*	*			trans	-89.8	160.3	170.6	-90.2	-62	0	0	0	111.7
486	Y	32.1	Very low	31	Very low	235 Å²	235	143 Å²	143	92%	0.922	75%	0.751	S	S	*	*			trans	-152.2	134.3	138.8	-124.9	-83.2	0	0	0	112.2
487	Q	30.6	Very low	30.8	Very low	171 Å²	171	149.4 Å²	149.4	80%	0.799	76%	0.764	S	S	*	*			trans	-100.4	164.5	-170.8	-95.8	-169.9	-33.2	0	0	114.6
488	P	42	Very low	30.9	Very low	110 Å²	110	147.6 Å²	147.6	71%	0.714	77%	0.769	S	S	*	*			trans	-95.3	-172.6	177.7	41.1	-37.2	0	0	0	112.8
489	P	34.5	Very low	31	Very low	129 Å²	129	148.6 Å²	148.6	84%	0.838	78%	0.775	S	S	*	*			trans	-134.9	153.7	145.7	35.9	-22.3	0	0	0	116
490	T	30.4	Very low	31.3	Very low	126 Å²	126	148.9 Å²	148.9	77%	0.773	77%	0.774	S	S	*	*			trans	-93.4	158.4	177.4	51.6	0	0	0	0	113.7
491	L	30.3	Very low	31.4	Very low	159 Å²	159	154.3 Å²	154.3	83%	0.832	79%	0.786	S	S	*	*			trans	173.1	152.7	153.6	-91.3	144.4	0	0	0	108
492	H	29	Very low	31.3	Very low	138 Å²	138	152.7 Å²	152.7	64%	0.639	78%	0.781	S	S	*	*			cis	-173.9	143.1	-23.9	-136	47.9	0	0	0	109.5
493	H	29.3	Very low	31.4	Very low	140 Å²	140	153.1 Å²	153.1	65%	0.648	78%	0.783	S	S	*	*			trans	61.7	162.2	157.5	-71.7	41.1	0	0	0	117.2
494	H	32.6	Very low	31.2	Very low	162 Å²	162	155.4 Å²	155.4	75%	0.75	79%	0.785	S	S	*	*			cis	-151.4	169	7.4	-127.5	-35.7	0	0	0	110.9
495	N	29.3	Very low	31.2	Very low	136 Å²	136	151 Å²	151	73%	0.727	77%	0.773	S	S	*	*			trans	-70.7	159.4	176.1	-61.6	-35.9	0	0	0	113.3
496	H	32.6	Very low	31.3	Very low	183 Å²	183	152.4 Å²	152.4	85%	0.847	77%	0.772	S	S	*	*				-169.9	149.4	118.8	-107.4	-75.5	0	0	0	115.1
497	Y	25.7	Very low	31.1	Very low	213 Å²	213	146.3 Å²	146.3	84%	0.835	76%	0.764	S	S	*	*			trans	-59.1	152.1	178.9	-70.4	-111.4	0	0	0	116.3
498	A	31.5	Very low	31.4	Very low	101 Å²	101	143.3 Å²	143.3	84%	0.835	76%	0.759	S	S	*	*				-166.2	151.4	126.9	0	0	0	0	0	112.6
499	T	30.1	Very low	30.8	Very low	135 Å²	135	147.8 Å²	147.8	83%	0.828	76%	0.764	S	S	*	*			trans	-104.6	173.3	-167	24.3	0	0	0	0	114.1
500	P	37.1	Very low	30.7	Very low	113 Å²	113	147.7 Å²	147.7	73%	0.734	76%	0.756	S	S	*	*			trans	-97.6	-179.3	-158.7	40	-37.9	0	0	0	114.6
501	F	30.7	Very low	30.6	Very low	210 Å²	210	148 Å²	148	92%	0.921	75%	0.753	S	S	*	*			trans	-137	145.2	162.9	-116.7	-87.5	0	0	0	114.9
502	N	28.8	Very low	30.5	Very low	131 Å²	131	145.8 Å²	145.8	70%	0.701	75%	0.746	S	S	*	*			trans	-73.3	159.3	-176.2	-103.2	-72.7	0	0	0	114.5
503	L	32	Very low	30.5	Very low	159 Å²	159	148 Å²	148	83%	0.832	75%	0.75	S	S	*	*				-177.9	103.2	116.1	-98.6	149.6	0	0	0	114.8
504	Q	27.3	Very low	30.5	Very low	145 Å²	145	150 Å²	150	68%	0.678	75%	0.753	S	S	*	*			trans	3.5	132.4	135.1	-84.3	-174.8	6.8	0	0	119.9
505	Q	30.7	Very low	30.3	Very low	138 Å²	138	149.2 Å²	149.2	65%	0.645	75%	0.75	S	S	*	*				164.9	143.8	90.3	-116.2	168.9	73.6	0	0	115
506	K	31.5	Very low	30.5	Very low	166 Å²	166	151.7 Å²	151.7	72%	0.722	76%	0.757	S	S	*	*			trans	61.9	100	151.1	-72	166.7	179.3	152.7	0	122.5
507	S	27.7	Very low	30.2	Very low	107 Å²	107	150.7 Å²	150.7	75%	0.748	75%	0.747	S	S	*	*				30.8	159.4	106.4	75.3	0	0	0	0	121.9
508	P	37.1	Very low	30.7	Very low	108 Å²	108	149.2 Å²	149.2	70%	0.701	75%	0.747	S	S	*	*				-131.6	-162.4	-74.2	35.6	-14.2	0	0	0	112
509	Y	29.6	Very low	30.5	Very low	205 Å²	205	151 Å²	151	80%	0.804	74%	0.737	S	S	*	*			trans	106.3	133.6	164.4	-83.2	-83.4	0	0	0	121.2
510	N	31.9	Very low	30.7	Very low	126 Å²	126	152.6 Å²	152.6	67%	0.674	74%	0.735	S	S	*	*			trans	67.6	100.9	147.8	-77.3	-13.4	0	0	0	122.5
511	N	27.5	Very low	30.3	Very low	134 Å²	134	151.2 Å²	151.2	72%	0.717	73%	0.729	S	S	*	*				62.9	124.7	107.6	-89.6	-3.3	0	0	0	121.7
512	T	28.5	Very low	30.2	Very low	112 Å²	112	147.5 Å²	147.5	69%	0.687	72%	0.723	S	S	*	*			trans	83.3	125.1	133.2	51.1	0	0	0	0	122.4
513	Y	28.6	Very low	30.3	Very low	184 Å²	184	146.6 Å²	146.6	72%	0.722	73%	0.727	S	S	*	*				109.5	137.4	126	-103.9	-59.4	0	0	0	120.1
514	Y	30	Very low	30.3	Very low	181 Å²	181	143.8 Å²	143.8	71%	0.71	72%	0.721	S	S	*	*			trans	63.8	107.5	168.9	-67.5	-75.4	0	0	0	118
515	H	28.8	Very low	30.4	Very low	146 Å²	146	144.7 Å²	144.7	68%	0.676	73%	0.729	S	S	*	*				58	105	74.5	-111.1	-71.7	0	0	0	114.2
516	H	32.8	Very low	30.5	Very low	189 Å²	189	143.1 Å²	143.1	88%	0.875	73%	0.73	S	S	*	*				-153.7	147.7	122.4	-122.6	25	0	0	0	112.9
517	Y	27.5	Very low	30.2	Very low	162 Å²	162	139.8 Å²	139.8	64%	0.635	73%	0.728	S	S	*	*			trans	-86.5	156	177.2	-99.9	-108.6	0	0	0	110.1	H519	Y517-H519 AromaticContact CD1-CD2 3.91Å; Y517-H519 AromaticContact CE1-NE2 3.99Å
518	H	34.1	Very low	30.3	Very low	182 Å²	182	140.7 Å²	140.7	84%	0.843	73%	0.729	S	S	*	*			trans	-151.6	131.2	135.2	-116.9	-78.8	0	0	0	111.5
519	H	29	Very low	29.9	Very low	137 Å²	137	140.2 Å²	140.2	63%	0.634	73%	0.728	S	S	*	*			trans	-82.1	153.5	170.9	-90	-113.3	0	0	0	111.1	Y517	Y517-H519 AromaticContact CD1-CD2 3.91Å; Y517-H519 AromaticContact CE1-NE2 3.99Å
520	H	33.6	Very low	29.8	Very low	169 Å²	169	135.5 Å²	135.5	78%	0.782	73%	0.725	S	S	*	*				-171.1	124.2	121.7	-90.4	-63.4	0	0	0	107.3
521	S	29.6	Very low	29.7	Very low	85 Å²	85	137 Å²	137	59%	0.594	73%	0.732	S	S	*	*				66	135.7	77.9	-49.2	0	0	0	0	113.4
522	T	27	Very low	29.5	Very low	132 Å²	132	135.9 Å²	135.9	81%	0.81	73%	0.732	S	S	*	*			cis	-179.5	132.8	-16.3	22.1	0	0	0	0	107.8
523	S	31.8	Very low	29.5	Very low	112 Å²	112	138.4 Å²	138.4	78%	0.783	74%	0.739	S	S	*	*			trans	176.5	107.2	159.9	36	0	0	0	0	110.6
524	S	31.3	Very low	29.4	Very low	100 Å²	100	133.9 Å²	133.9	70%	0.699	73%	0.733	S	S	*	*				67.1	101.8	95.8	63.8	0	0	0	0	114.6
525	I	29.6	Very low	29.2	Very low	164 Å²	164	134.7 Å²	134.7	84%	0.841	75%	0.745	S	S	*	*				77.7	144.4	68.2	-67	168.6	0	0	0	111.6
526	P	33.3	Very low	29	Very low	105 Å²	105	133.1 Å²	133.1	68%	0.682	75%	0.746	S	S	*	*			cis	-131.2	-179.1	0.2	32.4	-10.7	0	0	0	117.3
527	S	25.9	Very low	28.6	Very low	96 Å²	96	129.1 Å²	129.1	67%	0.671	74%	0.735	S	S	*	*			trans	40.7	134.3	142.6	64	0	0	0	0	122
528	T	28.5	Very low	28.6	Very low	125 Å²	125	127.5 Å²	127.5	77%	0.767	74%	0.744	S	S	*	*				-166.8	167.7	65.9	35.8	0	0	0	0	114.6
529	S	29.9	Very low	28.2	Very low	98 Å²	98	125.3 Å²	125.3	69%	0.685	74%	0.738	S	S	*	*			trans	54.4	96.1	153.1	61.8	0	0	0	0	121.4
530	S	26.4	Very low	28	Very low	106 Å²	106	126.1 Å²	126.1	74%	0.741	74%	0.743	S	S	*	*				33.2	123.2	119.8	58.4	0	0	0	0	121.6
531	I	29.6	Very low	27.6	Very low	158 Å²	158	123 Å²	123	81%	0.81	74%	0.736	S	S	*	*				-161.6	139	127.7	-99	148.6	0	0	0	108.6
532	P	24.5	Very low	27.4	Very low	111 Å²	111	125 Å²	125	72%	0.721	74%	0.741	S	S	*	*			trans	-77.9	141.8	-175.2	31	-35.4	0	0	0	112.7	P534	P532-P534 WeakPolarHBondContact O-CD 3.31Å
533	I	28.6	Very low	27.4	Very low	165 Å²	165	129.2 Å²	129.2	85%	0.846	75%	0.748	S	S	*	*			trans	-94.6	107	164.9	-58.2	177.4	0	0	0	108
534	P	26.4	Very low	27.2	Very low	89 Å²	89	131.4 Å²	131.4	58%	0.578	75%	0.745	S	S	*	*			trans	-77	134.2	179.3	31.9	-34.5	0	0	0	110.7	P532 T536	P532-P534 WeakPolarHBondContact O-CD 3.31Å; P534-T536 HydrophobicContact CB-CG2 4.16Å; P534-T536 HydrophobicContact CG-CG2 4.16Å; P534-T536 PolarHBondContact O-N 3.36Å
535	M	24.3	Very low	26.9	Very low	197 Å²	197	133.7 Å²	133.7	97%	0.97	75%	0.75	S	S	*	*			trans	-72.5	92.4	165.6	-71.4	-135.7	179.9	0	0	109.8	T537	M535-T537 PolarHBondContact O-N 3.03Å
536	T	26.4	Very low	26.8	Very low	113 Å²	113	133.3 Å²	133.3	69%	0.693	75%	0.748	S	S	*	*			trans	-92.7	101.4	-179.3	39.9	0	0	0	0	112.6	P534	P534-T536 HydrophobicContact CB-CG2 4.16Å; P534-T536 HydrophobicContact CG-CG2 4.16Å; P534-T536 PolarHBondContact O-N 3.36Å
537	T	24.1	Very low	26.4	Very low	106 Å²	106	134.2 Å²	134.2	65%	0.65	75%	0.747	S	S	*	*			trans	7.6	129.6	144.5	55.1	0	0	0	0	119.4	M535	M535-T537 PolarHBondContact O-N 3.03Å
538	P	27	Very low	26.6	Very low	128 Å²	128	137 Å²	137	83%	0.831	75%	0.751	S	S	*	*			trans	-73.2	126.8	139.7	31.6	-28.2	0	0	0	109.1
539	I	25.5	Very low	26.5	Very low	136 Å²	136	138.2 Å²	138.2	70%	0.697	75%	0.753	S	S	*	*			trans	-67	130.6	-173.7	-70.2	158.6	0	0	0	111.2	T541	I539-T541 HydrophobicContact CG2-CG2 3.8Å
540	M	24.6	Very low	26.2	Very low	154 Å²	154	138.2 Å²	138.2	76%	0.759	75%	0.752	S	S	*	*			trans	-85.4	106.9	161.3	-72.4	-155.2	77.7	0	0	109.8	Y352	Y352-M540 WeakPolarHBondContact OH-CE 3.34Å
541	T	26.1	Very low	26.3	Very low	102 Å²	102	141.6 Å²	141.6	63%	0.626	76%	0.758	S	S	*	*			trans	-143.4	112.5	163.2	46.5	0	0	0	0	111.6	I539	I539-T541 HydrophobicContact CG2-CG2 3.8Å
542	N	24.8	Very low	26.2	Very low	129 Å²	129	141.5 Å²	141.5	69%	0.69	76%	0.759	S	S	*	*			trans	49.3	119.9	143.3	-55.9	-31.6	0	0	0	119.8
543	F	27	Very low	26.4	Very low	220 Å²	220	140.5 Å²	140.5	97%	0.965	75%	0.753	S	S	*	*				-145	148.1	107.5	-101.1	-72.8	0	0	0	111
544	H	27.3	Very low	26.3	Very low	157 Å²	157	141.5 Å²	141.5	73%	0.727	75%	0.747	S	S	*	*			trans	-92.2	154.9	-165.9	-97.9	-4.3	0	0	0	114.4
545	N	25.2	Very low	26.4	Very low	149 Å²	149	145 Å²	145	80%	0.797	76%	0.761	S	S	*	*			trans	11.8	117.3	146.5	-62.6	-16.1	0	0	0	118.2
546	I	27.2	Very low	26.5	Very low	155 Å²	155	141.7 Å²	141.7	80%	0.795	75%	0.752	S	S	*	*			trans	-113	123.8	147.4	-64.3	-178.5	0	0	0	108.7
547	N	26.1	Very low	26.6	Very low	125 Å²	125	142.8 Å²	142.8	67%	0.668	76%	0.759	S	S	*	*			trans	-76.6	134.2	-179	174.1	15	0	0	0	110.7	N549	N547-N549 PolarHBondContact OD1-N 3.39Å
548	M	29.3	Very low	26.8	Very low	154 Å²	154	144.9 Å²	144.9	76%	0.759	77%	0.766	S	S	*	*			trans	-125.6	44.9	173.4	-76.5	-66.6	-176.2	0	0	112.6	C550	M548-C550 PolarHBondContact O-N 3.31Å; M548-C550 VanDerWaalsContact O-N 3.14Å
549	N	25.4	Very low	27	Very low	151 Å²	151	146.5 Å²	146.5	81%	0.807	77%	0.768	S	S	*	*			trans	-81.6	64.7	158	-82.9	-17.5	0	0	0	110.5	N547	N547-N549 PolarHBondContact OD1-N 3.39Å
550	C	25	Very low	27	Very low	97 Å²	97	145.8 Å²	145.8	66%	0.655	77%	0.77	S	S	*	*			trans	-162.8	134.1	177.2	-96.5	0	0	0	0	108.6	M548	M548-C550 PolarHBondContact O-N 3.31Å; M548-C550 VanDerWaalsContact O-N 3.14Å
551	M	28.4	Very low	27.4	Very low	178 Å²	178	144.2 Å²	144.2	88%	0.877	77%	0.769	S	S	*	*			cis	-142.5	-178.8	-9.2	-70.3	-164.6	74.9	0	0	109.9
552	N	27.7	Very low	27.6	Very low	156 Å²	156	144.6 Å²	144.6	83%	0.834	77%	0.772	S	S	*	*			trans	-65.9	155.6	175.6	-108.4	-14	0	0	0	114.3
553	P	28.9	Very low	27.8	Very low	90 Å²	90	145.4 Å²	145.4	58%	0.584	78%	0.776	S	S	*	*			trans	-78.6	170.8	161.5	33.6	-31.7	0	0	0	112.4
554	Y	26.4	Very low	28.1	Very low	186 Å²	186	139.8 Å²	139.8	73%	0.729	76%	0.764	S	S	*	*			trans	72.5	105.4	174.6	-52.6	-78.6	0	0	0	117.9
555	N	28.8	Very low	28.3	Very low	162 Å²	162	138.5 Å²	138.5	87%	0.866	77%	0.767	S	S	*	*				-158.1	114.7	116.2	-113.4	-16.6	0	0	0	111.8
556	T	24.6	Very low	28.6	Very low	127 Å²	127	136.5 Å²	136.5	78%	0.779	77%	0.765	S	S	*	*			trans	-93.2	121.9	171.1	45.1	0	0	0	0	110.1
557	T	30.3	Very low	28.9	Very low	137 Å²	137	134.2 Å²	134.2	84%	0.84	76%	0.762	S	S	*	*			trans	-139.6	117.7	158	37.6	0	0	0	0	109.9
558	N	27	Very low	29.2	Very low	149 Å²	149	133.2 Å²	133.2	80%	0.797	77%	0.765	S	S	*	*			trans	-64.9	149.8	172.2	-58.5	-35.2	0	0	0	110.4
559	N	31.5	Very low	29.3	Very low	163 Å²	163	131.5 Å²	131.5	87%	0.872	76%	0.764	S	S	*	*				-166.4	126.8	125.4	-93.8	-21.3	0	0	0	111.6
560	T	26.3	Very low	29.6	Very low	121 Å²	121	130.7 Å²	130.7	74%	0.742	76%	0.758	S	S	*	*			trans	-74.2	145.7	168.9	46.8	0	0	0	0	111.3
561	T	31.6	Very low	29.9	Very low	120 Å²	120	133 Å²	133	74%	0.736	77%	0.769	S	S	*	*				166.7	132.7	109.4	43	0	0	0	0	114.1
562	T	31.9	Very low	29.9	Very low	111 Å²	111	132.3 Å²	132.3	68%	0.681	76%	0.763	S	S	*	*			trans	59.2	109.9	140.8	61.5	0	0	0	0	122.9
563	D	28.5	Very low	30.1	Very low	145 Å²	145	131.9 Å²	131.9	78%	0.775	77%	0.767	S	S	*	*				73.1	138.7	117	-59.2	-24.7	0	0	0	125.4
564	S	33.1	Very low	30.1	Very low	103 Å²	103	132.6 Å²	132.6	72%	0.72	77%	0.77	S	S	*	*			trans	101	92.1	139.4	71.7	0	0	0	0	121.6
565	T	30.6	Very low	30.3	Very low	129 Å²	129	130.3 Å²	130.3	79%	0.791	77%	0.77	S	S	*	*				63.4	125.6	124.5	55.2	0	0	0	0	123.7
566	S	32.7	Very low	30.3	Very low	108 Å²	108	127.9 Å²	127.9	76%	0.755	76%	0.761	S	S	*	*				115.6	120	121.9	71.6	0	0	0	0	121.8
567	S	32.8	Very low	30.5	Very low	106 Å²	106	127.1 Å²	127.1	74%	0.741	76%	0.757	S	S	*	*			trans	83.2	96.8	131.2	-61.9	0	0	0	0	124
568	S	32	Very low	30.6	Very low	104 Å²	104	128.3 Å²	128.3	73%	0.727	76%	0.758	S	S	*	*				55.3	131	119.6	62.9	0	0	0	0	123
569	T	31.6	Very low	30.7	Very low	118 Å²	118	128.1 Å²	128.1	72%	0.724	76%	0.757	S	S	*	*				169.6	115.6	97.1	-62.8	0	0	0	0	114.8
570	I	31.3	Very low	30.5	Very low	135 Å²	135	127.1 Å²	127.1	69%	0.692	75%	0.75	S	S	*	*			trans	18.6	129.2	136	-48.5	166.3	0	0	0	120.4
571	T	31.2	Very low	30.6	Very low	144 Å²	144	126.3 Å²	126.3	88%	0.883	75%	0.749	S	S	*	*				-172.6	149.2	116.2	19.5	0	0	0	0	114.7
572	H	30	Very low	30.4	Very low	164 Å²	164	125.7 Å²	125.7	76%	0.759	75%	0.75	S	S	*	*			trans	-88.2	160.9	-177	-66.4	-106.8	0	0	0	113.3
573	T	31.7	Very low	30.1	Very low	147 Å²	147	126.4 Å²	126.4	90%	0.902	76%	0.76	S	S	*	*				-163.2	156.2	117.5	10.3	0	0	0	0	113.2
574	T	29.1	Very low	30.1	Very low	106 Å²	106	125.5 Å²	125.5	65%	0.65	76%	0.764	S	S	*	*			trans	-98.9	154	-169.5	50.5	0	0	0	0	112.7
575	N	29.6	Very low	29.7	Very low	138 Å²	138	125.3 Å²	125.3	74%	0.738	76%	0.763	S	S	*	*				164.6	157.8	100.2	-102.8	-23.4	0	0	0	116.5
576	T	29.8	Very low	29.5	Very low	110 Å²	110	126.1 Å²	126.1	68%	0.675	76%	0.761	S	S	*	*			trans	72.7	94.9	147.8	44.7	0	0	0	0	122.3
577	T	29	Very low	29.2	Very low	112 Å²	112	131.7 Å²	131.7	69%	0.687	77%	0.765	S	S	*	*				51.6	113.3	116.6	59.6	0	0	0	0	120.5
578	N	32	Very low	28.7	Very low	161 Å²	161	132.5 Å²	132.5	86%	0.861	77%	0.77	S	S	*	*				-175	132.2	89.1	-97.3	-31	0	0	0	115.1
579	N	28.2	Very low	28.4	Very low	146 Å²	146	134.6 Å²	134.6	78%	0.781	77%	0.773	S	S	*	*			trans	-57.1	161.7	-179.3	-99.3	-9.6	0	0	0	119.5
580	I	28.4	Very low	28.3	Very low	141 Å²	141	136 Å²	136	72%	0.723	78%	0.775	S	S	*	*			trans	93.2	103.1	144.2	-71.5	155.2	0	0	0	119.3
581	S	27.5	Very low	28	Very low	105 Å²	105	137.9 Å²	137.9	73%	0.734	79%	0.787	S	S	*	*				56.1	140.2	128	-50.1	0	0	0	0	121.2
582	S	27.2	Very low	27.8	Very low	107 Å²	107	139 Å²	139	75%	0.748	78%	0.782	S	S	*	*			cis	-171.1	124	-4.6	42	0	0	0	0	110
583	S	25.5	Very low	27.7	Very low	126 Å²	126	139.8 Å²	139.8	88%	0.881	79%	0.786	S	S	*	*			trans	177	60	162.1	33.8	0	0	0	0	111.6	S585	S583-S585 PolarHBondContact O-N 3.09Å; S583-S585 VanDerWaalsContact O-N 3.13Å
584	S	28.6	Very low	27.5	Very low	125 Å²	125	140.3 Å²	140.3	87%	0.874	78%	0.782	S	S	*	*			trans	-78.7	97.3	-179.6	54.9	0	0	0	0	112.3
585	S	25.5	Very low	27.3	Very low	99 Å²	99	143 Å²	143	69%	0.692	79%	0.793	S	S	*	*			trans	-77.4	159.8	146.9	-154.8	0	0	0	0	109.5	S583	S583-S585 PolarHBondContact O-N 3.09Å; S583-S585 VanDerWaalsContact O-N 3.13Å
586	I	25.6	Very low	27.2	Very low	147 Å²	147	141.6 Å²	141.6	75%	0.754	79%	0.794	S	S	*	*			trans	80.3	140.4	160.3	-58.7	155.2	0	0	0	118.3
587	R	26.1	Very low	27.2	Very low	224 Å²	224	141.4 Å²	141.4	85%	0.845	80%	0.797	S	S	*	*			trans	84.3	102.8	165.5	-90.6	170.8	-175.9	168.8	0.8	119.5
588	C	23.8	Very low	27.1	Very low	124 Å²	124	146 Å²	146	84%	0.838	81%	0.808	S	S	*	*			trans	-59.9	128.4	145.9	-48.1	0	0	0	0	110
589	D	25.2	Very low	26.9	Very low	148 Å²	148	148.8 Å²	148.8	79%	0.791	81%	0.806	S	S	*	*			trans	-167.4	110	147.6	-97.5	-35.7	0	0	0	107.2
590	L	28.2	Very low	26.8	Very low	147 Å²	147	149.8 Å²	149.8	77%	0.77	81%	0.806	S	S	*	*			trans	-168	44.9	159.6	-108.5	163.5	0	0	0	111.8	Q592	L590-Q592 PolarHBondContact O-N 3.24Å; L590-Q592 VanDerWaalsContact O-N 3.1Å
591	N	25.3	Very low	26.9	Very low	174 Å²	174	149 Å²	149	93%	0.93	81%	0.81	S	S	*	*			trans	-78.7	61.5	154.6	-87.2	-28.7	0	0	0	108.7
592	Q	27.6	Very low	26.7	Very low	168 Å²	168	150.6 Å²	150.6	79%	0.785	81%	0.81	S	S	*	*			trans	-157.5	43.7	-176.1	-136.6	168.7	33.1	0	0	115.7	L590	L590-Q592 PolarHBondContact O-N 3.24Å; L590-Q592 VanDerWaalsContact O-N 3.1Å
593	E	28.4	Very low	26.7	Very low	181 Å²	181	150.4 Å²	150.4	85%	0.846	81%	0.809	S	S	*	*			trans	-144.6	39.4	161.9	-124.6	167.1	-143.4	0	0	113.7
594	L	27	Very low	26.8	Very low	158 Å²	158	149.8 Å²	149.8	83%	0.827	81%	0.805	S	S	*	*	S	Bend	trans	-98.3	136.7	148.5	-79.5	163.6	0	0	0	107.4
595	N	25.6	Very low	26.8	Very low	163 Å²	163	148.9 Å²	148.9	87%	0.872	80%	0.798	S	S	*	*	S	Bend	trans	79.4	75.9	179.4	-47.3	-45.5	0	0	0	117.7
596	S	27.2	Very low	26.8	Very low	108 Å²	108	149.7 Å²	149.7	76%	0.755	80%	0.804	S	S	*	*			trans	-155.8	141.2	135.5	65.8	0	0	0	0	114.3
597	S	29.2	Very low	26.9	Very low	106 Å²	106	148 Å²	148	74%	0.741	81%	0.805	S	S	*	*			trans	66.7	65.6	157.9	-57.9	0	0	0	0	119.8	R599	S597-R599 PolarHBondContact O-N 3.09Å; S597-R599 VanDerWaalsContact O-N 3.14Å
598	F	26.3	Very low	27	Very low	207 Å²	207	143.7 Å²	143.7	91%	0.908	80%	0.803	S	S	*	*			trans	-63.7	100.8	142.5	-164.7	-90.1	0	0	0	108.9
599	R	28.1	Very low	27.3	Very low	221 Å²	221	142.3 Å²	142.3	83%	0.834	80%	0.801	S	S	*	*			trans	-140.3	124.9	166.6	-87.9	-169.1	174.9	-117.9	-1.1	110.1	S597	S597-R599 PolarHBondContact O-N 3.09Å; S597-R599 VanDerWaalsContact O-N 3.14Å
600	Q	27.4	Very low	27.6	Very low	167 Å²	167	141.7 Å²	141.7	78%	0.78	80%	0.803	S	S	*	*			trans	-67.3	147.8	172.9	-63.8	170.2	-54.8	0	0	111
601	P	28.9	Very low	27.8	Very low	123 Å²	123	141.1 Å²	141.1	80%	0.799	80%	0.8	S	S	*	*			trans	-109.2	135.4	145.3	16.4	1.6	0	0	0	110.4
602	D	24.7	Very low	28.2	Very low	139 Å²	139	136.2 Å²	136.2	74%	0.743	78%	0.778	S	S	*	*			trans	-70.9	150	178.7	-60.3	-71.2	0	0	0	113.4
603	S	27.1	Very low	28.6	Very low	104 Å²	104	132.2 Å²	132.2	73%	0.727	77%	0.768	S	S	*	*	S	Bend	trans	52.5	124.1	147.3	62.4	0	0	0	0	120.7
604	S	26.7	Very low	28.8	Very low	112 Å²	112	130 Å²	130	78%	0.783	76%	0.762	S	S	*	*			trans	84.8	144.9	152.2	82.2	0	0	0	0	119.4
605	S	28.6	Very low	29.4	Very low	106 Å²	106	128 Å²	128	74%	0.741	75%	0.751	S	S	*	*			trans	75.4	91.5	172.9	65.8	0	0	0	0	119
606	S	26.1	Very low	30.1	Very low	116 Å²	116	122.6 Å²	122.6	81%	0.811	73%	0.727	S	S	*	*			trans	-10.6	124.2	145.4	52.9	0	0	0	0	118.4
607	S	27.5	Very low	30.7	Very low	112 Å²	112	121.6 Å²	121.6	78%	0.783	71%	0.712	S	S	*	*			trans	-174.7	130.7	133.5	33.7	0	0	0	0	114.7
608	V	28.6	Very low	31.2	Very low	133 Å²	133	121.1 Å²	121.1	81%	0.806	70%	0.7	S	S	*	*			trans	51.4	105.5	150.2	-170.4	0	0	0	0	118.6	T610	V608-T610 PolarHBondContact O-N 3.34Å
609	A	30.3	Very low	32.4	Very low	96 Å²	96	114.2 Å²	114.2	79%	0.793	67%	0.67	S	S	*	*	P	Polyproline II helix	trans	-71.1	121.9	164.4	0	0	0	0	0	111.5
610	T	30.9	Very low	33.4	Very low	134 Å²	134	105.8 Å²	105.8	82%	0.822	64%	0.639	S	S	*	*	P	Polyproline II helix	trans	-73.3	138.6	176.9	8.3	0	0	0	0	111.8	V608	V608-T610 PolarHBondContact O-N 3.34Å
611	L	33.1	Very low	34.5	Very low	136 Å²	136	104.6 Å²	104.6	71%	0.712	63%	0.633	S	S	*	*	P	Polyproline II helix	trans	-62.9	143.2	-178.7	-85.9	78.2	0	0	0	112.3
612	P	33.3	Very low	35.7	Very low	71 Å²	71	103.6 Å²	103.6	46%	0.461	62%	0.621	S	S	.	*	P	Polyproline II helix	trans	-66.7	143	168.1	30.7	-34.9	0	0	0	110.6
613	S	35.8	Very low	37	Very low	83 Å²	83	98.2 Å²	98.2	58%	0.58	59%	0.592	S	S	*	*	P	Polyproline II helix	trans	-57.2	151.6	-172.4	64.5	0	0	0	0	114	N615 S616	S613-N615 PolarHBondContact O-N 2.92Å; S613-S616 PolarHBondContact O-N 2.84Å; S613-S616 PolarHBondContact O-OG 2.96Å
614	L	32.6	Very low	38.3	Very low	136 Å²	136	97.1 Å²	97.1	71%	0.712	58%	0.575	S	S	*	*	H	α-helix	trans	-44.3	-32.1	179.8	-88	110.4	0	0	0	115.4	S616 I617 I618	L614-S616 VanDerWaalsContact C-N 3.32Å; L614-S616 PolarHBondContact O-N 3.31Å; L614-I617 PolarHBondContact O-N 3.42Å; L614-I618 WeakPolarHBondContact O-CG1 3.29Å; L614-I618 PolarHBondContact O-N 3.02Å
615	N	38.6	Very low	39.8	Very low	114 Å²	114	94.9 Å²	94.9	61%	0.61	56%	0.56	S	S	*	*	H	α-helix	trans	-59	-37.5	178.1	-71.2	-9.1	0	0	0	113.2	S613 I617 I618 H619	S613-N615 PolarHBondContact O-N 2.92Å; N615-I617 VanDerWaalsContact C-N 3.35Å; N615-I617 PolarHBondContact O-N 3.02Å; N615-I618 PolarHBondContact O-N 2.86Å; N615-H619 PolarHBondContact O-CD2 2.76Å; N615-H619 VanDerWaalsContact O-CD2 3.28Å; N615-H619 PolarHBondContact O-N 3.17Å
616	S	41.9	Very low	41.1	Very low	51 Å²	51	91 Å²	91	36%	0.357	53%	0.53	S	S	.	.	H	α-helix	trans	-70.5	-32.6	179.3	63	0	0	0	0	112.5	S613 L614 H619 Y620	S613-S616 PolarHBondContact O-N 2.84Å; S613-S616 PolarHBondContact O-OG 2.96Å; L614-S616 VanDerWaalsContact C-N 3.32Å; L614-S616 PolarHBondContact O-N 3.31Å; S616-H619 PolarHBondContact O-N 2.91Å; S616-Y620 PolarHBondContact O-N 2.87Å
617	I	39.6	Very low	42.5	Very low	87 Å²	87	87 Å²	87	45%	0.446	50%	0.499	S	S	.	.	H	α-helix	trans	-67.9	-41.4	177.4	-57.5	174.8	0	0	0	110.2	L614 N615 H619 Y620 E621	L614-I617 PolarHBondContact O-N 3.42Å; N615-I617 VanDerWaalsContact C-N 3.35Å; N615-I617 PolarHBondContact O-N 3.02Å; I617-H619 VanDerWaalsContact C-N 3.33Å; I617-H619 PolarHBondContact O-N 3.27Å; I617-Y620 WeakPolarHBondContact O-CB 3.18Å; I617-Y620 PolarHBondContact O-N 2.62Å; I617-Y620 VanDerWaalsContact O-N 3.13Å; I617-E621 PolarHBondContact O-N 3.23Å
618	I	40.1	Very low	44.2	Very low	95 Å²	95	84.8 Å²	84.8	49%	0.487	48%	0.477	S	S	.	.	H	α-helix	trans	-63.8	-36.6	177.6	-64.9	165.4	0	0	0	111.5	L614 N615 Y620 N622	L614-I618 WeakPolarHBondContact O-CG1 3.29Å; L614-I618 PolarHBondContact O-N 3.02Å; N615-I618 PolarHBondContact O-N 2.86Å; I618-Y620 VanDerWaalsContact C-N 3.35Å; I618-N622 PolarHBondContact O-ND2 3.08Å
619	H	51.1	Low	45.5	Very low	62 Å²	62	81.5 Å²	81.5	29%	0.287	46%	0.455	S	S	.	.	H	α-helix	trans	-68.7	-31.9	174.1	-82.1	-80.4	0	0	0	113	N615 S616 I617 N622 I623 Y691	N615-H619 PolarHBondContact O-CD2 2.76Å; N615-H619 VanDerWaalsContact O-CD2 3.28Å; N615-H619 PolarHBondContact O-N 3.17Å; S616-H619 PolarHBondContact O-N 2.91Å; I617-H619 VanDerWaalsContact C-N 3.33Å; I617-H619 PolarHBondContact O-N 3.27Å; H619-N622 PolarHBondContact O-N 3.34Å; H619-I623 WeakPolarHBondContact O-CG1 3.37Å; H619-I623 PolarHBondContact O-N 3.42Å; H619-Y691 AromaticContact CD2-CZ 3.99Å; H619-Y691 AromaticContact CE1-CE2 3.71Å; H619-Y691 AromaticContact CE1-CZ 3.7Å; H619-Y691 PolarHBondContact CE1-OH 2.92Å; H619-Y691 AromaticContact ND1-CE2 3.86Å; H619-Y691 AromaticContact NE2-CZ 3.62Å; H619-Y691 PolarHBondContact NE2-OH 3.37Å; H619-Y691 VanDerWaalsContact NE2-OH 3.12Å
620	Y	48.5	Very low	46.7	Very low	44 Å²	44	78.5 Å²	78.5	17%	0.173	43%	0.426	C	S	.	.	H	α-helix	trans	-70.3	-46.4	-176.4	-175.8	-106.8	0	0	0	113.8	S616 I617 I618 N622 I623 H624 L706 R710	S616-Y620 PolarHBondContact O-N 2.87Å; I617-Y620 WeakPolarHBondContact O-CB 3.18Å; I617-Y620 PolarHBondContact O-N 2.62Å; I617-Y620 VanDerWaalsContact O-N 3.13Å; I618-Y620 VanDerWaalsContact C-N 3.35Å; Y620-N622 PolarHBondContact O-N 3.01Å; Y620-I623 PolarHBondContact O-N 2.73Å; Y620-I623 VanDerWaalsContact O-N 3.11Å; Y620-H624 PolarHBondContact O-N 2.92Å; Y620-L706 HydrophobicContact CD2-CB 4.32Å; Y620-L706 HydrophobicContact CD2-CD1 3.74Å; Y620-L706 HydrophobicContact CD2-CD2 4.17Å; Y620-L706 HydrophobicContact CD2-CG 4.31Å; Y620-L706 HydrophobicContact CE2-CB 3.71Å; Y620-L706 HydrophobicContact CE2-CD1 3.99Å; Y620-L706 HydrophobicContact CE2-CD2 4.19Å; Y620-L706 HydrophobicContact CE2-CG 4.18Å; Y620-L706 HydrophobicContact CG-CD1 4.47Å; Y620-L706 HydrophobicContact CG-CD2 4.34Å; Y620-L706 PolarHBondContact OH-O 3.03Å; Y620-R710 PolarHBondContact OH-NE 3.09Å; Y620-R710 PolarHBondContact OH-NH2 3.1Å
621	E	50.7	Low	48	Very low	142 Å²	142	76.4 Å²	76.4	66%	0.664	41%	0.406	S	S	*	.	H	α-helix	trans	-60.1	-35.5	176.3	-69	-164.1	153.1	0	0	112	I617 H624 S625	I617-E621 PolarHBondContact O-N 3.23Å; E621-H624 PolarHBondContact O-N 3.28Å; E621-S625 WeakPolarHBondContact O-CB 3.42Å; E621-S625 PolarHBondContact O-N 2.94Å
622	N	53.5	Low	49.4	Very low	103 Å²	103	73.6 Å²	73.6	55%	0.551	39%	0.392	S	S	*	.	H	α-helix	trans	-65.4	-38.8	176	-76.8	-55.1	0	0	0	112.5	I618 H619 Y620 F626	I618-N622 PolarHBondContact O-ND2 3.08Å; H619-N622 PolarHBondContact O-N 3.34Å; Y620-N622 PolarHBondContact O-N 3.01Å; N622-F626 WeakPolarHBondContact O-CB 3.44Å; N622-F626 PolarHBondContact O-N 2.91Å; N622-F626 VanDerWaalsContact O-N 3.09Å
623	I	52.9	Low	50.5	Low	25 Å²	25	71.5 Å²	71.5	13%	0.128	38%	0.378	C	S	.	.	H	α-helix	trans	-68.7	-46	175.8	-68	166.1	0	0	0	111	H619 Y620 F626 M627 F684 I687 F692	H619-I623 WeakPolarHBondContact O-CG1 3.37Å; H619-I623 PolarHBondContact O-N 3.42Å; Y620-I623 PolarHBondContact O-N 2.73Å; Y620-I623 VanDerWaalsContact O-N 3.11Å; I623-F626 WeakPolarHBondContact O-CB 3.45Å; I623-F626 PolarHBondContact O-N 2.87Å; I623-F626 VanDerWaalsContact O-N 3.14Å; I623-M627 HydrophobicContact CG2-SD 4.07Å; I623-M627 WeakPolarHBondContact O-CG 3.48Å; I623-M627 PolarHBondContact O-N 3.12Å; I623-F684 HydrophobicContact CG2-CD2 4.32Å; I623-F684 HydrophobicContact CG2-CE2 3.84Å; I623-I687 HydrophobicContact CD1-CG2 3.94Å; I623-I687 HydrophobicContact CG1-CG2 4.32Å; I623-F692 HydrophobicContact CD1-CE2 4.04Å; I623-F692 HydrophobicContact CD1-CZ 4.5Å
624	H	53.7	Low	51.5	Low	81 Å²	81	69.5 Å²	69.5	38%	0.375	36%	0.36	S	S	.	.	H	α-helix	trans	-64.6	-45.1	-180	-180	-111.7	0	0	0	112.2	Y620 E621 F626 M627 I628	Y620-H624 PolarHBondContact O-N 2.92Å; E621-H624 PolarHBondContact O-N 3.28Å; H624-F626 PolarHBondContact O-N 2.78Å; H624-M627 PolarHBondContact O-N 2.91Å; H624-I628 VanDerWaalsContact CE1-CD1 3.49Å; H624-I628 WeakPolarHBondContact CE1-CD1 3.38Å; H624-I628 WeakPolarHBondContact O-CG1 3.03Å; H624-I628 PolarHBondContact O-N 2.98Å; H624-I628 VanDerWaalsContact O-N 3.14Å
625	S	57.9	Low	53	Low	65 Å²	65	68.5 Å²	68.5	46%	0.455	35%	0.35	S	S	.	.	H	α-helix	trans	-60.5	-33.4	173	-172.7	0	0	0	0	112.3	E621 D629	E621-S625 WeakPolarHBondContact O-CB 3.42Å; E621-S625 PolarHBondContact O-N 2.94Å; S625-D629 PolarHBondContact O-N 3.37Å
626	F	56.7	Low	54	Low	25 Å²	25	68.6 Å²	68.6	11%	0.11	35%	0.347	C	S	.	.	H	α-helix	trans	-70.7	-40.7	177.7	168.3	-78.4	0	0	0	112.7	N622 I623 H624 I628 D629 I630 K680 F684	N622-F626 WeakPolarHBondContact O-CB 3.44Å; N622-F626 PolarHBondContact O-N 2.91Å; N622-F626 VanDerWaalsContact O-N 3.09Å; I623-F626 WeakPolarHBondContact O-CB 3.45Å; I623-F626 PolarHBondContact O-N 2.87Å; I623-F626 VanDerWaalsContact O-N 3.14Å; H624-F626 PolarHBondContact O-N 2.78Å; F626-I628 VanDerWaalsContact C-N 3.35Å; F626-D629 WeakPolarHBondContact O-CB 3.49Å; F626-D629 PolarHBondContact O-N 3.34Å; F626-I630 HydrophobicContact CD1-CD1 4.05Å; F626-I630 HydrophobicContact CE1-CD1 3.3Å; F626-I630 HydrophobicContact CE1-CG1 4.26Å; F626-I630 HydrophobicContact CZ-CD1 3.57Å; F626-I630 HydrophobicContact CZ-CG1 4.46Å; F626-I630 PolarHBondContact O-N 3.35Å; F626-K680 HydrophobicContact CD2-CB 4.48Å; F626-K680 HydrophobicContact CD2-CD 3.7Å; F626-K680 VanDerWaalsContact CE2-C 3.49Å; F626-K680 HydrophobicContact CE2-CB 3.5Å; F626-K680 VanDerWaalsContact CE2-CB 3.5Å; F626-K680 HydrophobicContact CE2-CD 3.47Å; F626-K680 VanDerWaalsContact CE2-CD 3.47Å; F626-K680 HydrophobicContact CE2-CG 4.09Å; F626-K680 WeakPolarHBondContact CE2-O 3.39Å; F626-K680 HydrophobicContact CZ-CB 3.9Å; F626-K680 WeakPolarHBondContact CZ-O 3.13Å; F626-F684 HydrophobicContact CD1-CB 4.36Å; F626-F684 HydrophobicContact CD1-CD2 4.26Å; F626-F684 HydrophobicContact CE1-CB 3.51Å; F626-F684 HydrophobicContact CE1-CD2 4.02Å; F626-F684 AromaticContact CE1-CG 3.86Å; F626-F684 HydrophobicContact CE1-CG 3.86Å; F626-F684 HydrophobicContact CE2-CB 4.16Å; F626-F684 HydrophobicContact CZ-CB 3.41Å; F626-F684 VanDerWaalsContact CZ-CB 3.41Å; F626-F684 HydrophobicContact CZ-CG 4.26Å
627	M	55.4	Low	54.8	Low	32 Å²	32	68.3 Å²	68.3	16%	0.158	34%	0.338	C	S	.	.	H	α-helix	trans	-62.7	-43.2	175	-69.4	167.9	70.6	0	0	110.9	I623 H624 D629 I630 Q631 W731	I623-M627 HydrophobicContact CG2-SD 4.07Å; I623-M627 WeakPolarHBondContact O-CG 3.48Å; I623-M627 PolarHBondContact O-N 3.12Å; H624-M627 PolarHBondContact O-N 2.91Å; M627-D629 PolarHBondContact O-N 3.3Å; M627-I630 PolarHBondContact O-N 2.97Å; M627-Q631 WeakPolarHBondContact O-CG 3.47Å; M627-Q631 PolarHBondContact O-N 3.26Å; M627-W731 HydrophobicContact CE-CH2 4.42Å; M627-W731 HydrophobicContact CE-CZ3 3.71Å
628	I	62.8	Low	55.8	Low	66 Å²	66	67.9 Å²	67.9	34%	0.338	34%	0.336	S	S	.	.	H	α-helix	trans	-61.1	-42.7	174.3	-69.1	170.8	0	0	0	111.3	H624 F626 I630 Q631 N632	H624-I628 VanDerWaalsContact CE1-CD1 3.49Å; H624-I628 WeakPolarHBondContact CE1-CD1 3.38Å; H624-I628 WeakPolarHBondContact O-CG1 3.03Å; H624-I628 PolarHBondContact O-N 2.98Å; H624-I628 VanDerWaalsContact O-N 3.14Å; F626-I628 VanDerWaalsContact C-N 3.35Å; I628-I630 PolarHBondContact O-N 3.45Å; I628-Q631 PolarHBondContact O-N 3.29Å; I628-N632 WeakPolarHBondContact CG2-ND2 3.4Å; I628-N632 WeakPolarHBondContact O-CB 3.18Å; I628-N632 VanDerWaalsContact O-CG 3.26Å; I628-N632 PolarHBondContact O-N 2.89Å; I628-N632 PolarHBondContact O-ND2 2.96Å; I628-N632 VanDerWaalsContact O-ND2 3.15Å
629	D	56	Low	56.8	Low	63 Å²	63	67.7 Å²	67.7	34%	0.337	34%	0.335	S	S	.	.	H	α-helix	trans	-60.1	-41.8	175.7	-91.1	-1.7	0	0	0	112.2	S625 F626 M627 T633	S625-D629 PolarHBondContact O-N 3.37Å; F626-D629 WeakPolarHBondContact O-CB 3.49Å; F626-D629 PolarHBondContact O-N 3.34Å; M627-D629 PolarHBondContact O-N 3.3Å; D629-T633 WeakPolarHBondContact O-CB 3.32Å; D629-T633 PolarHBondContact O-N 2.96Å; D629-T633 PolarHBondContact O-OG1 3.43Å
630	I	56.1	Low	57.2	Low	34 Å²	34	66 Å²	66	17%	0.174	33%	0.328	C	S	.	.	H	α-helix	trans	-64.2	-50.4	175.2	-72.9	179.1	0	0	0	110.6	F626 M627 I628 N632 T633 I634 L681	F626-I630 HydrophobicContact CD1-CD1 4.05Å; F626-I630 HydrophobicContact CE1-CD1 3.3Å; F626-I630 HydrophobicContact CE1-CG1 4.26Å; F626-I630 HydrophobicContact CZ-CD1 3.57Å; F626-I630 HydrophobicContact CZ-CG1 4.46Å; F626-I630 PolarHBondContact O-N 3.35Å; M627-I630 PolarHBondContact O-N 2.97Å; I628-I630 PolarHBondContact O-N 3.45Å; I630-N632 VanDerWaalsContact C-N 3.3Å; I630-N632 PolarHBondContact O-N 3.44Å; I630-T633 WeakPolarHBondContact O-CB 2.85Å; I630-T633 PolarHBondContact O-N 3.29Å; I630-I634 HydrophobicContact CG2-CD1 3.73Å; I630-I634 HydrophobicContact CG2-CG1 4.42Å; I630-I634 WeakPolarHBondContact O-CG1 3.44Å; I630-I634 PolarHBondContact O-N 2.97Å; I630-L681 HydrophobicContact CD1-CD2 3.82Å; I630-L681 HydrophobicContact CD1-CG 4.4Å
631	Q	57.2	Low	57.6	Low	90 Å²	90	65.2 Å²	65.2	42%	0.421	33%	0.327	S	S	.	.	H	α-helix	trans	-56.9	-43	178.5	-72.3	-178	-1.5	0	0	112.2	M627 I628 I634 K635	M627-Q631 WeakPolarHBondContact O-CG 3.47Å; M627-Q631 PolarHBondContact O-N 3.26Å; I628-Q631 PolarHBondContact O-N 3.29Å; Q631-I634 PolarHBondContact O-N 3.24Å; Q631-K635 VanDerWaalsContact O-CG 3.28Å; Q631-K635 WeakPolarHBondContact O-CG 3.4Å; Q631-K635 PolarHBondContact O-N 3.43Å
632	N	64.1	Low	58	Low	76 Å²	76	63.8 Å²	63.8	41%	0.406	32%	0.32	S	S	.	.	H	α-helix	trans	-67.1	-37.6	176.5	-71.5	-30.9	0	0	0	112.2	I628 I630 K635 E636	I628-N632 WeakPolarHBondContact CG2-ND2 3.4Å; I628-N632 WeakPolarHBondContact O-CB 3.18Å; I628-N632 VanDerWaalsContact O-CG 3.26Å; I628-N632 PolarHBondContact O-N 2.89Å; I628-N632 PolarHBondContact O-ND2 2.96Å; I628-N632 VanDerWaalsContact O-ND2 3.15Å; I630-N632 VanDerWaalsContact C-N 3.3Å; I630-N632 PolarHBondContact O-N 3.44Å; N632-K635 PolarHBondContact O-N 2.98Å; N632-E636 PolarHBondContact O-N 3.49Å
633	T	56.4	Low	58.2	Low	28 Å²	28	64 Å²	64	17%	0.172	32%	0.321	C	S	.	.	H	α-helix	trans	-65.2	-40.4	175.8	-55.8	0	0	0	0	111.5	D629 I630 E636 W637 I677	D629-T633 WeakPolarHBondContact O-CB 3.32Å; D629-T633 PolarHBondContact O-N 2.96Å; D629-T633 PolarHBondContact O-OG1 3.43Å; I630-T633 WeakPolarHBondContact O-CB 2.85Å; I630-T633 PolarHBondContact O-N 3.29Å; T633-E636 PolarHBondContact O-N 3.27Å; T633-W637 WeakPolarHBondContact O-CB 3.34Å; T633-W637 PolarHBondContact O-N 3Å; T633-I677 HydrophobicContact CG2-CD1 3.76Å; T633-I677 HydrophobicContact CG2-CG1 3.89Å
634	I	55.8	Low	58.2	Low	40 Å²	40	63.6 Å²	63.6	21%	0.205	32%	0.32	C	S	.	.	H	α-helix	trans	-65.9	-42.2	175.3	-66.7	168.3	0	0	0	110.8	I630 Q631 W637 I638	I630-I634 HydrophobicContact CG2-CD1 3.73Å; I630-I634 HydrophobicContact CG2-CG1 4.42Å; I630-I634 WeakPolarHBondContact O-CG1 3.44Å; I630-I634 PolarHBondContact O-N 2.97Å; Q631-I634 PolarHBondContact O-N 3.24Å; I634-W637 WeakPolarHBondContact O-CB 3.11Å; I634-W637 PolarHBondContact O-N 3.38Å; I634-W637 VanDerWaalsContact O-N 3.15Å; I634-I638 HydrophobicContact CG2-CD1 4.01Å; I634-I638 WeakPolarHBondContact O-CG1 3.34Å; I634-I638 PolarHBondContact O-N 3.24Å
635	K	63.8	Low	58.2	Low	116 Å²	116	63 Å²	63	50%	0.504	32%	0.32	S	S	.	.	H	α-helix	trans	-60.5	-46.5	175.2	-72.9	166.3	-174.6	169.3	0	112.1	Q631 N632 W637 I638 L639	Q631-K635 VanDerWaalsContact O-CG 3.28Å; Q631-K635 WeakPolarHBondContact O-CG 3.4Å; Q631-K635 PolarHBondContact O-N 3.43Å; N632-K635 PolarHBondContact O-N 2.98Å; K635-W637 VanDerWaalsContact C-N 3.29Å; K635-W637 PolarHBondContact O-N 2.68Å; K635-I638 PolarHBondContact O-N 2.86Å; K635-L639 WeakPolarHBondContact O-CG 3.3Å; K635-L639 PolarHBondContact O-N 2.63Å
636	E	60.4	Low	57.9	Low	115 Å²	115	65.6 Å²	65.6	54%	0.537	32%	0.32	S	S	.	.	H	α-helix	trans	-59.6	-38.6	172.7	-78.8	-81.9	142	0	0	112	N632 T633 L639 I640	N632-E636 PolarHBondContact O-N 3.49Å; T633-E636 PolarHBondContact O-N 3.27Å; E636-L639 PolarHBondContact O-N 2.75Å; E636-I640 WeakPolarHBondContact O-CD1 3.23Å; E636-I640 VanDerWaalsContact O-CG1 3.24Å; E636-I640 WeakPolarHBondContact O-CG1 3.36Å; E636-I640 PolarHBondContact O-N 3.43Å
637	W	57.6	Low	57.7	Low	45 Å²	45	67.8 Å²	67.8	17%	0.17	33%	0.333	C	S	.	.	H	α-helix	trans	-65.8	-44.7	178.3	-169.3	57.5	0	0	0	112.4	T633 I634 K635 L639 I640 I641 L670 F803 L807	T633-W637 WeakPolarHBondContact O-CB 3.34Å; T633-W637 PolarHBondContact O-N 3Å; I634-W637 WeakPolarHBondContact O-CB 3.11Å; I634-W637 PolarHBondContact O-N 3.38Å; I634-W637 VanDerWaalsContact O-N 3.15Å; K635-W637 VanDerWaalsContact C-N 3.29Å; K635-W637 PolarHBondContact O-N 2.68Å; W637-L639 VanDerWaalsContact C-N 3.34Å; W637-L639 PolarHBondContact O-N 3.12Å; W637-I640 PolarHBondContact O-N 3.02Å; W637-I641 HydrophobicContact CD2-CD1 3.87Å; W637-I641 HydrophobicContact CE3-CD1 4.18Å; W637-I641 HydrophobicContact CG-CD1 4.36Å; W637-I641 HydrophobicContact CH2-CD1 4.32Å; W637-I641 HydrophobicContact CZ2-CD1 4.01Å; W637-I641 HydrophobicContact CZ3-CD1 4.39Å; W637-I641 WeakPolarHBondContact O-CG1 3.2Å; W637-I641 PolarHBondContact O-N 3.02Å; W637-L670 HydrophobicContact CZ2-CD1 4.37Å; W637-F803 HydrophobicContact CH2-CD1 4.14Å; W637-L807 HydrophobicContact CZ3-CD2 3.91Å
638	I	60.2	Low	57.5	Low	79 Å²	79	69.2 Å²	69.2	41%	0.405	34%	0.341	S	S	.	.	H	α-helix	trans	-59.1	-45.1	174.1	-68	165.6	0	0	0	110.7	I634 K635 I641 Q642	I634-I638 HydrophobicContact CG2-CD1 4.01Å; I634-I638 WeakPolarHBondContact O-CG1 3.34Å; I634-I638 PolarHBondContact O-N 3.24Å; K635-I638 PolarHBondContact O-N 2.86Å; I638-I641 PolarHBondContact O-N 2.82Å; I638-Q642 HydrophobicContact CG2-CG 4.48Å; I638-Q642 WeakPolarHBondContact O-CG 3.44Å; I638-Q642 PolarHBondContact O-N 2.74Å
639	L	62.2	Low	57	Low	90 Å²	90	72.9 Å²	72.9	47%	0.471	36%	0.361	S	S	.	.	H	α-helix	trans	-62.4	-42.6	177.2	-70.5	171.3	0	0	0	112.2	K635 E636 W637 I641 Q642 D643	K635-L639 WeakPolarHBondContact O-CG 3.3Å; K635-L639 PolarHBondContact O-N 2.63Å; E636-L639 PolarHBondContact O-N 2.75Å; W637-L639 VanDerWaalsContact C-N 3.34Å; W637-L639 PolarHBondContact O-N 3.12Å; L639-I641 VanDerWaalsContact C-N 3.33Å; L639-I641 PolarHBondContact O-N 3.38Å; L639-Q642 PolarHBondContact O-N 3.1Å; L639-D643 WeakPolarHBondContact O-CB 3.43Å; L639-D643 PolarHBondContact O-N 3.03Å
640	I	58.4	Low	56.7	Low	26 Å²	26	73.3 Å²	73.3	13%	0.133	37%	0.366	C	S	.	.	H	α-helix	trans	-61.1	-41.7	176	-70.7	161.2	0	0	0	111.1	E636 W637 T644	E636-I640 WeakPolarHBondContact O-CD1 3.23Å; E636-I640 VanDerWaalsContact O-CG1 3.24Å; E636-I640 WeakPolarHBondContact O-CG1 3.36Å; E636-I640 PolarHBondContact O-N 3.43Å; W637-I640 PolarHBondContact O-N 3.02Å; I640-T644 PolarHBondContact O-N 3.4Å; I640-T644 PolarHBondContact O-OG1 3.36Å
641	I	57.6	Low	56.2	Low	28 Å²	28	74 Å²	74	14%	0.144	37%	0.372	C	S	.	.	H	α-helix	trans	-64.8	-43.9	177.6	-68.4	166.4	0	0	0	110.6	W637 I638 L639 T644 N645	W637-I641 HydrophobicContact CD2-CD1 3.87Å; W637-I641 HydrophobicContact CE3-CD1 4.18Å; W637-I641 HydrophobicContact CG-CD1 4.36Å; W637-I641 HydrophobicContact CH2-CD1 4.32Å; W637-I641 HydrophobicContact CZ2-CD1 4.01Å; W637-I641 HydrophobicContact CZ3-CD1 4.39Å; W637-I641 WeakPolarHBondContact O-CG1 3.2Å; W637-I641 PolarHBondContact O-N 3.02Å; I638-I641 PolarHBondContact O-N 2.82Å; L639-I641 VanDerWaalsContact C-N 3.33Å; L639-I641 PolarHBondContact O-N 3.38Å; I641-T644 WeakPolarHBondContact CA-OG1 3.46Å; I641-T644 PolarHBondContact O-N 3Å; I641-T644 PolarHBondContact O-OG1 3.03Å; I641-N645 PolarHBondContact O-N 3.48Å; I641-N645 PolarHBondContact O-ND2 3.28Å
642	Q	60.1	Low	55.8	Low	112 Å²	112	80.3 Å²	80.3	52%	0.523	39%	0.394	S	S	.	.	H	α-helix	trans	-62.4	-46.7	176.8	-71.9	174.1	-4.7	0	0	112.1	I638 L639 T644 N645 Y646	I638-Q642 HydrophobicContact CG2-CG 4.48Å; I638-Q642 WeakPolarHBondContact O-CG 3.44Å; I638-Q642 PolarHBondContact O-N 2.74Å; L639-Q642 PolarHBondContact O-N 3.1Å; Q642-T644 VanDerWaalsContact C-N 3.35Å; Q642-T644 PolarHBondContact O-N 3.38Å; Q642-N645 PolarHBondContact O-N 3.2Å; Q642-Y646 PolarHBondContact O-N 3.04Å
643	D	56.5	Low	55.1	Low	107 Å²	107	82.9 Å²	82.9	57%	0.572	40%	0.398	S	S	*	.	H	α-helix	trans	-61.4	-40	175.4	-86.8	-7.5	0	0	0	112	L639 Y646 L647	L639-D643 WeakPolarHBondContact O-CB 3.43Å; L639-D643 PolarHBondContact O-N 3.03Å; D643-Y646 WeakPolarHBondContact O-CB 3.44Å; D643-Y646 PolarHBondContact O-N 3.44Å; D643-L647 PolarHBondContact O-N 2.83Å
644	T	53.7	Low	54.9	Low	17 Å²	17	89.3 Å²	89.3	10%	0.104	43%	0.431	C	S	.	.	H	α-helix	trans	-68.1	-38.6	176.4	45.5	0	0	0	0	112.9	I640 I641 Q642 Y646 L647 L648	I640-T644 PolarHBondContact O-N 3.4Å; I640-T644 PolarHBondContact O-OG1 3.36Å; I641-T644 WeakPolarHBondContact CA-OG1 3.46Å; I641-T644 PolarHBondContact O-N 3Å; I641-T644 PolarHBondContact O-OG1 3.03Å; Q642-T644 VanDerWaalsContact C-N 3.35Å; Q642-T644 PolarHBondContact O-N 3.38Å; T644-Y646 PolarHBondContact O-N 3.14Å; T644-L647 PolarHBondContact O-N 3.36Å; T644-L648 WeakPolarHBondContact O-CB 3.42Å; T644-L648 WeakPolarHBondContact O-CD1 3.49Å; T644-L648 PolarHBondContact O-N 2.81Å
645	N	54.2	Low	54.6	Low	70 Å²	70	91.6 Å²	91.6	37%	0.374	44%	0.443	S	S	.	.	H	α-helix	trans	-64.2	-30.3	173	-76.6	-28	0	0	0	112	I641 Q642 N649	I641-N645 PolarHBondContact O-N 3.48Å; I641-N645 PolarHBondContact O-ND2 3.28Å; Q642-N645 PolarHBondContact O-N 3.2Å; N645-N649 WeakPolarHBondContact O-CB 3.29Å; N645-N649 PolarHBondContact O-N 3.2Å; N645-N649 PolarHBondContact O-ND2 3.34Å
646	Y	51.4	Low	53.9	Low	119 Å²	119	94.6 Å²	94.6	47%	0.467	45%	0.453	S	S	.	.	H	α-helix	trans	-72	-46.7	172.7	-169.4	-101.2	0	0	0	112.1	L202 Q642 D643 T644 N649 T650	L202-Y646 WeakPolarHBondContact CD1-OH 3.43Å; Q642-Y646 PolarHBondContact O-N 3.04Å; D643-Y646 WeakPolarHBondContact O-CB 3.44Å; D643-Y646 PolarHBondContact O-N 3.44Å; T644-Y646 PolarHBondContact O-N 3.14Å; Y646-N649 PolarHBondContact O-N 2.88Å; Y646-T650 HydrophobicContact CE1-CG2 4.24Å; Y646-T650 HydrophobicContact CE2-CG2 4.38Å; Y646-T650 WeakPolarHBondContact O-CB 3.36Å; Y646-T650 WeakPolarHBondContact O-CG2 3.37Å; Y646-T650 PolarHBondContact O-N 3.38Å; Y646-T650 VanDerWaalsContact O-N 3.12Å; Y646-T650 PolarHBondContact O-OG1 3.35Å
647	L	50.9	Low	53.5	Low	70 Å²	70	95.1 Å²	95.1	37%	0.366	46%	0.455	S	S	.	.	H	α-helix	trans	-64.9	-40.5	179.3	-94.4	146.3	0	0	0	113.3	D643 T644 N649 T650 T651	D643-L647 PolarHBondContact O-N 2.83Å; T644-L647 PolarHBondContact O-N 3.36Å; L647-N649 VanDerWaalsContact C-N 3.35Å; L647-T650 PolarHBondContact O-N 2.93Å; L647-T651 WeakPolarHBondContact O-CB 3.48Å; L647-T651 PolarHBondContact O-N 2.89Å; L647-T651 VanDerWaalsContact O-N 3.12Å; L647-T651 PolarHBondContact O-OG1 3.08Å
648	L	52.2	Low	53.2	Low	63 Å²	63	100.5 Å²	100.5	33%	0.33	48%	0.476	S	S	.	.	H	α-helix	trans	-64.6	-37.6	175	-96.4	72.5	0	0	0	112	T644 T650 M663	T644-L648 WeakPolarHBondContact O-CB 3.42Å; T644-L648 WeakPolarHBondContact O-CD1 3.49Å; T644-L648 PolarHBondContact O-N 2.81Å; L648-T650 VanDerWaalsContact C-N 3.35Å; L648-M663 HydrophobicContact CD1-CE 4.26Å
649	N	51.6	Low	52.7	Low	142 Å²	142	98.8 Å²	98.8	76%	0.759	47%	0.467	S	S	*	.	H	α-helix	trans	-77.8	-14.7	178.1	-81.2	-50.4	0	0	0	114.4	N645 Y646 L647	N645-N649 WeakPolarHBondContact O-CB 3.29Å; N645-N649 PolarHBondContact O-N 3.2Å; N645-N649 PolarHBondContact O-ND2 3.34Å; Y646-N649 PolarHBondContact O-N 2.88Å; L647-N649 VanDerWaalsContact C-N 3.35Å
650	T	50.3	Low	52.3	Low	72 Å²	72	97.2 Å²	97.2	44%	0.442	46%	0.458	S	S	.	.	H	α-helix	trans	-114.5	-10	-173.6	52	0	0	0	0	115.1	Y646 L647 L648	Y646-T650 HydrophobicContact CE1-CG2 4.24Å; Y646-T650 HydrophobicContact CE2-CG2 4.38Å; Y646-T650 WeakPolarHBondContact O-CB 3.36Å; Y646-T650 WeakPolarHBondContact O-CG2 3.37Å; Y646-T650 PolarHBondContact O-N 3.38Å; Y646-T650 VanDerWaalsContact O-N 3.12Å; Y646-T650 PolarHBondContact O-OG1 3.35Å; L647-T650 PolarHBondContact O-N 2.93Å; L648-T650 VanDerWaalsContact C-N 3.35Å
651	T	46.3	Very low	52.1	Low	50 Å²	50	99.4 Å²	99.4	31%	0.307	47%	0.468	S	S	.	.			trans	-124.1	101.1	-170	-27.4	0	0	0	0	113.6	L647 Y653	L647-T651 WeakPolarHBondContact O-CB 3.48Å; L647-T651 PolarHBondContact O-N 2.89Å; L647-T651 VanDerWaalsContact O-N 3.12Å; L647-T651 PolarHBondContact O-OG1 3.08Å; T651-Y653 VanDerWaalsContact C-N 3.34Å; T651-Y653 VanDerWaalsContact CB-CE2 3.47Å; T651-Y653 HydrophobicContact CG2-CD2 3.74Å; T651-Y653 HydrophobicContact CG2-CE1 4.25Å; T651-Y653 HydrophobicContact CG2-CE2 3.34Å; T651-Y653 HydrophobicContact CG2-CG 4.36Å; T651-Y653 PolarHBondContact O-N 3.27Å
652	Y	48.5	Very low	52	Low	222 Å²	222	102 Å²	102	87%	0.871	48%	0.478	S	S	*	.			trans	-66.7	89.1	164	-86.5	-94.1	0	0	0	110.2	L654	Y652-L654 PolarHBondContact O-N 2.96Å
653	Y	49.3	Very low	51.6	Low	130 Å²	130	98.3 Å²	98.3	51%	0.51	46%	0.461	S	S	.	.			trans	-79.1	92.8	170.7	-79.6	-76.1	0	0	0	110.6	T651 N655	T651-Y653 VanDerWaalsContact C-N 3.34Å; T651-Y653 VanDerWaalsContact CB-CE2 3.47Å; T651-Y653 HydrophobicContact CG2-CD2 3.74Å; T651-Y653 HydrophobicContact CG2-CE1 4.25Å; T651-Y653 HydrophobicContact CG2-CE2 3.34Å; T651-Y653 HydrophobicContact CG2-CG 4.36Å; T651-Y653 PolarHBondContact O-N 3.27Å; Y653-N655 PolarHBondContact O-N 3.46Å
654	L	51.1	Low	51.5	Low	163 Å²	163	98 Å²	98	85%	0.853	46%	0.455	S	S	*	.			trans	-64.7	8.1	178.9	-86.7	92.7	0	0	0	115.6	Y652	Y652-L654 PolarHBondContact O-N 2.96Å
655	N	50.1	Low	51.7	Low	87 Å²	87	103.2 Å²	103.2	47%	0.465	48%	0.481	S	S	.	.			trans	-139.5	102	-173.6	-166.5	-21.6	0	0	0	112.1	Y653 H657 Y658	Y653-N655 PolarHBondContact O-N 3.46Å; N655-H657 PolarHBondContact O-N 3.42Å; N655-H657 VanDerWaalsContact O-N 3.09Å; N655-H657 PolarHBondContact OD1-N 3.02Å; N655-Y658 HydrophobicContact CB-CD2 3.94Å; N655-Y658 PolarHBondContact O-N 2.96Å
656	Y	50.1	Low	51.9	Low	179 Å²	179	103.3 Å²	103.3	70%	0.702	48%	0.477	S	S	*	.	H	α-helix	trans	-49.5	-35.8	-175.8	-67.1	-84.6	0	0	0	114.5	Y658 H659 I660	Y656-Y658 VanDerWaalsContact C-N 3.28Å; Y656-Y658 PolarHBondContact O-N 3.41Å; Y656-H659 WeakPolarHBondContact O-CB 3.13Å; Y656-H659 PolarHBondContact O-N 3.43Å; Y656-H659 VanDerWaalsContact O-N 3.13Å; Y656-I660 PolarHBondContact O-N 2.97Å
657	H	50.6	Low	52.1	Low	127 Å²	127	99.1 Å²	99.1	59%	0.588	46%	0.464	S	S	*	.	H	α-helix	trans	-63.2	-34.5	-179.1	-168.7	-60.4	0	0	0	112.3	N655 E661	N655-H657 PolarHBondContact O-N 3.42Å; N655-H657 VanDerWaalsContact O-N 3.09Å; N655-H657 PolarHBondContact OD1-N 3.02Å; H657-E661 WeakPolarHBondContact O-CG 3.28Å; H657-E661 PolarHBondContact O-N 3.15Å
658	Y	51.2	Low	52.5	Low	157 Å²	157	99.9 Å²	99.9	62%	0.616	47%	0.469	S	S	*	.	H	α-helix	trans	-71.5	-34.6	176.1	-76.2	-89.9	0	0	0	111.8	N655 Y656 F662	N655-Y658 HydrophobicContact CB-CD2 3.94Å; N655-Y658 PolarHBondContact O-N 2.96Å; Y656-Y658 VanDerWaalsContact C-N 3.28Å; Y656-Y658 PolarHBondContact O-N 3.41Å; Y658-F662 WeakPolarHBondContact O-CB 3.48Å; Y658-F662 PolarHBondContact O-N 2.94Å
659	H	51.2	Low	52.8	Low	44 Å²	44	101.8 Å²	101.8	20%	0.204	48%	0.475	C	S	.	.	H	α-helix	trans	-66.3	-46.6	177.5	-156.6	-88.7	0	0	0	111.1	Y656 F662 M663	Y656-H659 WeakPolarHBondContact O-CB 3.13Å; Y656-H659 PolarHBondContact O-N 3.43Å; Y656-H659 VanDerWaalsContact O-N 3.13Å; H659-F662 PolarHBondContact O-N 2.89Å; H659-M663 VanDerWaalsContact CE1-CE 3.42Å; H659-M663 WeakPolarHBondContact CE1-CE 3.45Å; H659-M663 VanDerWaalsContact O-CG 3.29Å; H659-M663 WeakPolarHBondContact O-CG 3.45Å; H659-M663 PolarHBondContact O-N 3.49Å
660	I	53.5	Low	53.1	Low	56 Å²	56	96.7 Å²	96.7	29%	0.287	45%	0.447	S	S	.	.	H	α-helix	trans	-61.1	-48.3	177.5	-67.1	169.9	0	0	0	111.2	Y656 F662 M663 K664	Y656-I660 PolarHBondContact O-N 2.97Å; I660-F662 PolarHBondContact O-N 3.4Å; I660-M663 PolarHBondContact O-N 2.93Å; I660-K664 HydrophobicContact CG2-CD 4.3Å; I660-K664 WeakPolarHBondContact O-CG 3.5Å; I660-K664 PolarHBondContact O-N 3.47Å
661	E	54.8	Low	53.7	Low	73 Å²	73	95.5 Å²	95.5	34%	0.341	44%	0.438	S	S	.	.	H	α-helix	trans	-67.1	-36	179.5	-69.1	-57.1	121.7	0	0	112.5	H657 K664 L665	H657-E661 WeakPolarHBondContact O-CG 3.28Å; H657-E661 PolarHBondContact O-N 3.15Å; E661-K664 PolarHBondContact O-N 3.41Å; E661-K664 WeakPolarHBondContact OE1-CD 3.46Å; E661-K664 IonicContact OE1-NZ 3.92Å; E661-K664 PolarHBondContact OE1-NZ 3.17Å; E661-L665 WeakPolarHBondContact O-CB 3.4Å; E661-L665 WeakPolarHBondContact O-CD1 3.42Å; E661-L665 WeakPolarHBondContact O-CG 3.36Å; E661-L665 PolarHBondContact O-N 2.88Å
662	F	55.6	Low	54.4	Low	82 Å²	82	100.3 Å²	100.3	36%	0.36	46%	0.455	S	S	.	.	H	α-helix	trans	-61.8	-45.2	171.6	-179.6	-89.7	0	0	0	111.5	Y658 H659 I660 L665 W666	Y658-F662 WeakPolarHBondContact O-CB 3.48Å; Y658-F662 PolarHBondContact O-N 2.94Å; H659-F662 PolarHBondContact O-N 2.89Å; I660-F662 PolarHBondContact O-N 3.4Å; F662-L665 PolarHBondContact O-N 3.07Å; F662-W666 WeakPolarHBondContact O-CB 3.37Å; F662-W666 PolarHBondContact O-N 3.27Å
663	M	50.6	Low	54.8	Low	35 Å²	35	91.8 Å²	91.8	17%	0.172	42%	0.423	C	S	.	.	H	α-helix	trans	-67.1	-36.7	178.5	-66.4	-51.6	160.6	0	0	112.5	L648 H659 I660 W666 S667 M792	L648-M663 HydrophobicContact CD1-CE 4.26Å; H659-M663 VanDerWaalsContact CE1-CE 3.42Å; H659-M663 WeakPolarHBondContact CE1-CE 3.45Å; H659-M663 VanDerWaalsContact O-CG 3.29Å; H659-M663 WeakPolarHBondContact O-CG 3.45Å; H659-M663 PolarHBondContact O-N 3.49Å; I660-M663 PolarHBondContact O-N 2.93Å; M663-W666 PolarHBondContact O-N 3.39Å; M663-S667 WeakPolarHBondContact O-CB 3.1Å; M663-S667 PolarHBondContact O-N 3.48Å; M663-S667 PolarHBondContact O-OG 3.03Å; M663-M792 HydrophobicContact CE-CE 3.72Å; M663-M792 HydrophobicContact CE-SD 4.26Å; M663-M792 HydrophobicContact CG-CE 4.18Å; M663-M792 HydrophobicContact CG-SD 4.01Å; M663-M792 HydrophobicContact SD-CE 3.69Å; M663-M792 HydrophobicContact SD-SD 4.31Å
664	K	54.9	Low	55.1	Low	100 Å²	100	87.5 Å²	87.5	44%	0.435	41%	0.408	S	S	.	.	H	α-helix	trans	-62.7	-43	169.9	-71.7	173.9	-172.4	167	0	112.3	I660 E661 W666 S667 N668	I660-K664 HydrophobicContact CG2-CD 4.3Å; I660-K664 WeakPolarHBondContact O-CG 3.5Å; I660-K664 PolarHBondContact O-N 3.47Å; E661-K664 PolarHBondContact O-N 3.41Å; E661-K664 WeakPolarHBondContact OE1-CD 3.46Å; E661-K664 IonicContact OE1-NZ 3.92Å; E661-K664 PolarHBondContact OE1-NZ 3.17Å; K664-W666 VanDerWaalsContact C-N 3.33Å; K664-S667 PolarHBondContact O-OG 2.74Å; K664-N668 VanDerWaalsContact O-CB 3.31Å; K664-N668 WeakPolarHBondContact O-CB 3.24Å; K664-N668 PolarHBondContact O-N 2.82Å; K664-N668 VanDerWaalsContact O-N 3.07Å; K664-N668 PolarHBondContact O-ND2 3.33Å
665	L	58.4	Low	55.6	Low	126 Å²	126	82.6 Å²	82.6	66%	0.66	38%	0.384	S	S	*	.	H	α-helix	trans	-64.7	-39.6	176.9	-81	160.2	0	0	0	111.4	E661 F662 K669	E661-L665 WeakPolarHBondContact O-CB 3.4Å; E661-L665 WeakPolarHBondContact O-CD1 3.42Å; E661-L665 WeakPolarHBondContact O-CG 3.36Å; E661-L665 PolarHBondContact O-N 2.88Å; F662-L665 PolarHBondContact O-N 3.07Å; L665-K669 WeakPolarHBondContact O-CB 3.43Å; L665-K669 PolarHBondContact O-N 3.17Å; L665-K669 VanDerWaalsContact O-N 3.08Å
666	W	58.3	Low	56.2	Low	73 Å²	73	83.6 Å²	83.6	28%	0.277	38%	0.382	S	S	.	.	H	α-helix	trans	-68.1	-49.2	177.3	-177.1	87.4	0	0	0	112.2	F662 M663 K664 N668 K669 L670	F662-W666 WeakPolarHBondContact O-CB 3.37Å; F662-W666 PolarHBondContact O-N 3.27Å; M663-W666 PolarHBondContact O-N 3.39Å; K664-W666 VanDerWaalsContact C-N 3.33Å; W666-N668 VanDerWaalsContact C-N 3.35Å; W666-N668 PolarHBondContact O-N 3.41Å; W666-K669 WeakPolarHBondContact O-CB 3.46Å; W666-K669 PolarHBondContact O-N 3.2Å; W666-L670 HydrophobicContact CH2-CD2 3.73Å; W666-L670 HydrophobicContact CZ2-CD2 4.28Å; W666-L670 HydrophobicContact CZ3-CD2 3.88Å; W666-L670 WeakPolarHBondContact O-CB 3.39Å; W666-L670 PolarHBondContact O-N 3.16Å
667	S	55.1	Low	56.6	Low	30 Å²	30	77 Å²	77	21%	0.21	36%	0.359	C	S	.	.	H	α-helix	trans	-62.4	-40.3	178.5	66.7	0	0	0	0	112.1	M663 K664 K669 L670 L671	M663-S667 WeakPolarHBondContact O-CB 3.1Å; M663-S667 PolarHBondContact O-N 3.48Å; M663-S667 PolarHBondContact O-OG 3.03Å; K664-S667 PolarHBondContact O-OG 2.74Å; S667-K669 VanDerWaalsContact C-N 3.31Å; S667-K669 PolarHBondContact O-N 3.42Å; S667-L670 PolarHBondContact O-N 3.22Å; S667-L671 VanDerWaalsContact O-CB 3.29Å; S667-L671 WeakPolarHBondContact O-CB 3.39Å; S667-L671 PolarHBondContact O-N 3.46Å
668	N	59.3	Low	57.2	Low	86 Å²	86	75.3 Å²	75.3	46%	0.46	35%	0.354	S	S	.	.	H	α-helix	trans	-65.1	-30.8	172.9	-83.1	-73.2	0	0	0	113.4	K664 W666 K672	K664-N668 VanDerWaalsContact O-CB 3.31Å; K664-N668 WeakPolarHBondContact O-CB 3.24Å; K664-N668 PolarHBondContact O-N 2.82Å; K664-N668 VanDerWaalsContact O-N 3.07Å; K664-N668 PolarHBondContact O-ND2 3.33Å; W666-N668 VanDerWaalsContact C-N 3.35Å; W666-N668 PolarHBondContact O-N 3.41Å; N668-K672 WeakPolarHBondContact O-CD 3.45Å; N668-K672 VanDerWaalsContact O-CG 3.23Å; N668-K672 WeakPolarHBondContact O-CG 3.42Å; N668-K672 PolarHBondContact O-N 3Å
669	K	59.1	Low	57.8	Low	104 Å²	104	72.7 Å²	72.7	45%	0.452	35%	0.35	S	S	.	.	H	α-helix	trans	-74.1	-46	174.7	-174	-171.8	174.5	-165.1	0	110.7	L665 W666 S667 K672 Q673	L665-K669 WeakPolarHBondContact O-CB 3.43Å; L665-K669 PolarHBondContact O-N 3.17Å; L665-K669 VanDerWaalsContact O-N 3.08Å; W666-K669 WeakPolarHBondContact O-CB 3.46Å; W666-K669 PolarHBondContact O-N 3.2Å; S667-K669 VanDerWaalsContact C-N 3.31Å; S667-K669 PolarHBondContact O-N 3.42Å; K669-K672 PolarHBondContact O-N 3.35Å; K669-Q673 PolarHBondContact O-N 3.3Å; K669-Q673 VanDerWaalsContact O-N 3.09Å
670	L	58	Low	58.3	Low	35 Å²	35	73.6 Å²	73.6	18%	0.183	35%	0.354	C	S	.	.	H	α-helix	trans	-58.4	-52.5	177.4	-179.6	67.5	0	0	0	110.9	W637 W666 S667 K672 Q673 M674	W637-L670 HydrophobicContact CZ2-CD1 4.37Å; W666-L670 HydrophobicContact CH2-CD2 3.73Å; W666-L670 HydrophobicContact CZ2-CD2 4.28Å; W666-L670 HydrophobicContact CZ3-CD2 3.88Å; W666-L670 WeakPolarHBondContact O-CB 3.39Å; W666-L670 PolarHBondContact O-N 3.16Å; S667-L670 PolarHBondContact O-N 3.22Å; L670-K672 VanDerWaalsContact C-N 3.3Å; L670-K672 PolarHBondContact O-N 3.05Å; L670-Q673 PolarHBondContact O-N 2.84Å; L670-M674 HydrophobicContact CD1-CG 4.48Å; L670-M674 HydrophobicContact CD1-SD 4.36Å; L670-M674 HydrophobicContact CD2-SD 4.45Å; L670-M674 HydrophobicContact CG-CG 4.49Å; L670-M674 HydrophobicContact CG-SD 3.98Å; L670-M674 WeakPolarHBondContact O-CG 3.31Å; L670-M674 PolarHBondContact O-N 3.01Å
671	L	61.5	Low	58.6	Low	47 Å²	47	73 Å²	73	25%	0.246	35%	0.351	C	S	.	.	H	α-helix	trans	-57	-43.2	179.3	-174.7	64.6	0	0	0	111.5	S667 Q673 M674 T675 T766	S667-L671 VanDerWaalsContact O-CB 3.29Å; S667-L671 WeakPolarHBondContact O-CB 3.39Å; S667-L671 PolarHBondContact O-N 3.46Å; L671-Q673 VanDerWaalsContact C-N 3.35Å; L671-Q673 PolarHBondContact O-N 3.25Å; L671-M674 PolarHBondContact O-N 2.68Å; L671-T675 WeakPolarHBondContact O-CB 3.46Å; L671-T675 PolarHBondContact O-N 2.94Å; L671-T675 PolarHBondContact O-OG1 3.47Å; L671-T766 HydrophobicContact CD1-CG2 4.04Å
672	K	61.9	Low	59	Low	151 Å²	151	74.1 Å²	74.1	66%	0.657	36%	0.356	S	S	*	.	H	α-helix	trans	-62.7	-37.6	175.7	-75.7	171.8	-175.1	174.6	0	113.3	N668 K669 L670 Y676	N668-K672 WeakPolarHBondContact O-CD 3.45Å; N668-K672 VanDerWaalsContact O-CG 3.23Å; N668-K672 WeakPolarHBondContact O-CG 3.42Å; N668-K672 PolarHBondContact O-N 3Å; K669-K672 PolarHBondContact O-N 3.35Å; L670-K672 VanDerWaalsContact C-N 3.3Å; L670-K672 PolarHBondContact O-N 3.05Å; K672-Y676 WeakPolarHBondContact O-CB 3.34Å; K672-Y676 PolarHBondContact O-N 3.27Å; K672-Y676 VanDerWaalsContact O-N 3.09Å
673	Q	56	Low	59.4	Low	43 Å²	43	72.8 Å²	72.8	20%	0.201	36%	0.357	C	S	.	.	H	α-helix	trans	-69.7	-44.5	175.2	-71.2	-175.9	-69	0	0	111	K669 L670 L671 Y676 I677	K669-Q673 PolarHBondContact O-N 3.3Å; K669-Q673 VanDerWaalsContact O-N 3.09Å; L670-Q673 PolarHBondContact O-N 2.84Å; L671-Q673 VanDerWaalsContact C-N 3.35Å; L671-Q673 PolarHBondContact O-N 3.25Å; Q673-Y676 WeakPolarHBondContact O-CB 3.23Å; Q673-Y676 PolarHBondContact O-N 3.03Å; Q673-I677 VanDerWaalsContact O-CG1 3.29Å; Q673-I677 WeakPolarHBondContact O-CG1 3.32Å; Q673-I677 PolarHBondContact O-N 2.85Å
674	M	56.8	Low	60	Low	40 Å²	40	71.6 Å²	71.6	20%	0.197	35%	0.351	C	S	.	.	H	α-helix	trans	-59.8	-48.8	175.4	-67.7	176.1	71.5	0	0	111.9	L670 L671 Y676 I677 L678 F803	L670-M674 HydrophobicContact CD1-CG 4.48Å; L670-M674 HydrophobicContact CD1-SD 4.36Å; L670-M674 HydrophobicContact CD2-SD 4.45Å; L670-M674 HydrophobicContact CG-CG 4.49Å; L670-M674 HydrophobicContact CG-SD 3.98Å; L670-M674 WeakPolarHBondContact O-CG 3.31Å; L670-M674 PolarHBondContact O-N 3.01Å; L671-M674 PolarHBondContact O-N 2.68Å; M674-Y676 VanDerWaalsContact C-N 3.29Å; M674-Y676 PolarHBondContact O-N 3.48Å; M674-I677 PolarHBondContact O-N 3.07Å; M674-L678 WeakPolarHBondContact O-CB 3.34Å; M674-L678 WeakPolarHBondContact O-CG 3.29Å; M674-L678 PolarHBondContact O-N 3.27Å; M674-F803 HydrophobicContact CE-CD2 4.24Å; M674-F803 HydrophobicContact CE-CE2 3.58Å; M674-F803 HydrophobicContact CE-CZ 3.8Å
675	T	61.5	Low	60.4	Low	59 Å²	59	67.9 Å²	67.9	36%	0.362	33%	0.334	S	S	.	.	H	α-helix	trans	-59.5	-38.4	176.1	-54.5	0	0	0	0	112	L671 N679	L671-T675 WeakPolarHBondContact O-CB 3.46Å; L671-T675 PolarHBondContact O-N 2.94Å; L671-T675 PolarHBondContact O-OG1 3.47Å; T675-N679 VanDerWaalsContact O-CB 3.32Å; T675-N679 WeakPolarHBondContact O-CB 3.24Å; T675-N679 VanDerWaalsContact O-CG 3.23Å; T675-N679 PolarHBondContact O-N 2.97Å; T675-N679 PolarHBondContact O-ND2 3.37Å; T675-N679 VanDerWaalsContact O-ND2 3.16Å
676	Y	61.8	Low	60.8	Low	108 Å²	108	67.3 Å²	67.3	42%	0.424	33%	0.329	S	S	.	.	H	α-helix	trans	-64	-45.9	175	176.8	-100.2	0	0	0	111.9	K672 Q673 M674 K680	K672-Y676 WeakPolarHBondContact O-CB 3.34Å; K672-Y676 PolarHBondContact O-N 3.27Å; K672-Y676 VanDerWaalsContact O-N 3.09Å; Q673-Y676 WeakPolarHBondContact O-CB 3.23Å; Q673-Y676 PolarHBondContact O-N 3.03Å; M674-Y676 VanDerWaalsContact C-N 3.29Å; M674-Y676 PolarHBondContact O-N 3.48Å; Y676-K680 HydrophobicContact CE1-CG 4.2Å; Y676-K680 HydrophobicContact CE2-CG 4.3Å; Y676-K680 VanDerWaalsContact O-CB 3.31Å; Y676-K680 WeakPolarHBondContact O-CB 3.39Å; Y676-K680 VanDerWaalsContact O-CG 3.24Å; Y676-K680 WeakPolarHBondContact O-CG 3.15Å; Y676-K680 PolarHBondContact O-N 2.99Å; Y676-K680 VanDerWaalsContact OH-CE 3.3Å; Y676-K680 WeakPolarHBondContact OH-CE 3.42Å
677	I	59.2	Low	61.1	Low	42 Å²	42	66.1 Å²	66.1	22%	0.215	33%	0.327	C	S	.	.	H	α-helix	trans	-63.7	-46.7	178	-64.1	164	0	0	0	110.8	T633 Q673 M674 K680 L681	T633-I677 HydrophobicContact CG2-CD1 3.76Å; T633-I677 HydrophobicContact CG2-CG1 3.89Å; Q673-I677 VanDerWaalsContact O-CG1 3.29Å; Q673-I677 WeakPolarHBondContact O-CG1 3.32Å; Q673-I677 PolarHBondContact O-N 2.85Å; M674-I677 PolarHBondContact O-N 3.07Å; I677-K680 WeakPolarHBondContact O-CB 3.31Å; I677-K680 PolarHBondContact O-N 3.32Å; I677-L681 HydrophobicContact CG2-CD1 3.88Å; I677-L681 HydrophobicContact CG2-CG 4.3Å; I677-L681 WeakPolarHBondContact O-CG 3.36Å; I677-L681 PolarHBondContact O-N 2.97Å
678	L	62	Low	61.5	Low	90 Å²	90	65.3 Å²	65.3	47%	0.471	32%	0.319	S	S	.	.	H	α-helix	trans	-62.1	-46.6	179.3	-71.4	169.1	0	0	0	112.2	M674 K680 L681 H682	M674-L678 WeakPolarHBondContact O-CB 3.34Å; M674-L678 WeakPolarHBondContact O-CG 3.29Å; M674-L678 PolarHBondContact O-N 3.27Å; L678-K680 VanDerWaalsContact C-N 3.25Å; L678-K680 PolarHBondContact O-N 3.04Å; L678-L681 PolarHBondContact O-N 3.48Å; L678-H682 WeakPolarHBondContact O-CB 3.19Å; L678-H682 PolarHBondContact O-N 3.42Å
679	N	64.7	Low	61.9	Low	102 Å²	102	64 Å²	64	55%	0.545	31%	0.312	S	S	.	.	H	α-helix	trans	-61	-36.6	175.6	-75.5	-26.9	0	0	0	112	T675 S683	T675-N679 VanDerWaalsContact O-CB 3.32Å; T675-N679 WeakPolarHBondContact O-CB 3.24Å; T675-N679 VanDerWaalsContact O-CG 3.23Å; T675-N679 PolarHBondContact O-N 2.97Å; T675-N679 PolarHBondContact O-ND2 3.37Å; T675-N679 VanDerWaalsContact O-ND2 3.16Å; N679-S683 PolarHBondContact O-N 3.43Å; N679-S683 VanDerWaalsContact O-N 3.1Å; N679-S683 PolarHBondContact O-OG 3.1Å
680	K	61	Low	62.2	Low	64 Å²	64	65.1 Å²	65.1	28%	0.278	32%	0.319	S	S	.	.	H	α-helix	trans	-65.7	-52.5	174.4	-80.4	-79.1	-177.7	162.2	0	110.7	F626 Y676 I677 L678 H682 S683 F684	F626-K680 HydrophobicContact CD2-CB 4.48Å; F626-K680 HydrophobicContact CD2-CD 3.7Å; F626-K680 VanDerWaalsContact CE2-C 3.49Å; F626-K680 HydrophobicContact CE2-CB 3.5Å; F626-K680 VanDerWaalsContact CE2-CB 3.5Å; F626-K680 HydrophobicContact CE2-CD 3.47Å; F626-K680 VanDerWaalsContact CE2-CD 3.47Å; F626-K680 HydrophobicContact CE2-CG 4.09Å; F626-K680 WeakPolarHBondContact CE2-O 3.39Å; F626-K680 HydrophobicContact CZ-CB 3.9Å; F626-K680 WeakPolarHBondContact CZ-O 3.13Å; Y676-K680 HydrophobicContact CE1-CG 4.2Å; Y676-K680 HydrophobicContact CE2-CG 4.3Å; Y676-K680 VanDerWaalsContact O-CB 3.31Å; Y676-K680 WeakPolarHBondContact O-CB 3.39Å; Y676-K680 VanDerWaalsContact O-CG 3.24Å; Y676-K680 WeakPolarHBondContact O-CG 3.15Å; Y676-K680 PolarHBondContact O-N 2.99Å; Y676-K680 VanDerWaalsContact OH-CE 3.3Å; Y676-K680 WeakPolarHBondContact OH-CE 3.42Å; I677-K680 WeakPolarHBondContact O-CB 3.31Å; I677-K680 PolarHBondContact O-N 3.32Å; L678-K680 VanDerWaalsContact C-N 3.25Å; L678-K680 PolarHBondContact O-N 3.04Å; K680-H682 VanDerWaalsContact C-N 3.33Å; K680-H682 PolarHBondContact O-N 2.91Å; K680-S683 WeakPolarHBondContact O-CA 3.38Å; K680-S683 VanDerWaalsContact O-CB 3.31Å; K680-S683 WeakPolarHBondContact O-CB 3.27Å; K680-S683 PolarHBondContact O-N 2.9Å; K680-F684 PolarHBondContact O-N 3.12Å
681	L	60.7	Low	62.3	Low	44 Å²	44	67.5 Å²	67.5	23%	0.23	33%	0.326	C	S	.	.	H	α-helix	trans	-56.9	-43	177.8	-72.4	170.8	0	0	0	112.4	I630 I677 L678 S683 F684 K685 I739	I630-L681 HydrophobicContact CD1-CD2 3.82Å; I630-L681 HydrophobicContact CD1-CG 4.4Å; I677-L681 HydrophobicContact CG2-CD1 3.88Å; I677-L681 HydrophobicContact CG2-CG 4.3Å; I677-L681 WeakPolarHBondContact O-CG 3.36Å; I677-L681 PolarHBondContact O-N 2.97Å; L678-L681 PolarHBondContact O-N 3.48Å; L681-S683 VanDerWaalsContact C-N 3.33Å; L681-S683 PolarHBondContact O-N 2.99Å; L681-F684 PolarHBondContact O-N 2.79Å; L681-K685 PolarHBondContact O-N 2.78Å; L681-I739 HydrophobicContact CD2-CD1 4.37Å
682	H	61.6	Low	62.4	Low	96 Å²	96	66.2 Å²	66.2	44%	0.444	32%	0.319	S	S	.	.	H	α-helix	trans	-62	-39.9	174.5	-175.8	-92	0	0	0	112.2	L678 K680 K685 Q686	L678-H682 WeakPolarHBondContact O-CB 3.19Å; L678-H682 PolarHBondContact O-N 3.42Å; K680-H682 VanDerWaalsContact C-N 3.33Å; K680-H682 PolarHBondContact O-N 2.91Å; H682-K685 PolarHBondContact O-N 3.01Å; H682-Q686 PolarHBondContact CE1-NE2 3.33Å; H682-Q686 VanDerWaalsContact CE1-NE2 3.28Å; H682-Q686 WeakPolarHBondContact O-CG 3.37Å; H682-Q686 PolarHBondContact O-N 3.12Å
683	S	65.2	Low	62.4	Low	53 Å²	53	63.6 Å²	63.6	37%	0.371	31%	0.308	S	S	.	.	H	α-helix	trans	-63.6	-40.7	174.3	-54.1	0	0	0	0	111.8	N679 K680 L681 Q686 I687	N679-S683 PolarHBondContact O-N 3.43Å; N679-S683 VanDerWaalsContact O-N 3.1Å; N679-S683 PolarHBondContact O-OG 3.1Å; K680-S683 WeakPolarHBondContact O-CA 3.38Å; K680-S683 VanDerWaalsContact O-CB 3.31Å; K680-S683 WeakPolarHBondContact O-CB 3.27Å; K680-S683 PolarHBondContact O-N 2.9Å; L681-S683 VanDerWaalsContact C-N 3.33Å; L681-S683 PolarHBondContact O-N 2.99Å; S683-Q686 PolarHBondContact O-N 3.34Å; S683-I687 WeakPolarHBondContact O-CG1 3.42Å; S683-I687 PolarHBondContact O-N 3.11Å; S683-I687 VanDerWaalsContact O-N 3.14Å
684	F	63.2	Low	62.4	Low	11 Å²	11	68.5 Å²	68.5	5%	0.048	34%	0.335	C	S	.	.	H	α-helix	trans	-64.1	-44.2	174.7	170.5	-100	0	0	0	111.8	I623 F626 K680 L681 Q686 I687 W688 I736	I623-F684 HydrophobicContact CG2-CD2 4.32Å; I623-F684 HydrophobicContact CG2-CE2 3.84Å; F626-F684 HydrophobicContact CD1-CB 4.36Å; F626-F684 HydrophobicContact CD1-CD2 4.26Å; F626-F684 HydrophobicContact CE1-CB 3.51Å; F626-F684 HydrophobicContact CE1-CD2 4.02Å; F626-F684 AromaticContact CE1-CG 3.86Å; F626-F684 HydrophobicContact CE1-CG 3.86Å; F626-F684 HydrophobicContact CE2-CB 4.16Å; F626-F684 HydrophobicContact CZ-CB 3.41Å; F626-F684 VanDerWaalsContact CZ-CB 3.41Å; F626-F684 HydrophobicContact CZ-CG 4.26Å; K680-F684 PolarHBondContact O-N 3.12Å; L681-F684 PolarHBondContact O-N 2.79Å; F684-Q686 VanDerWaalsContact C-N 3.31Å; F684-Q686 PolarHBondContact O-N 3.48Å; F684-I687 PolarHBondContact O-N 3.02Å; F684-W688 HydrophobicContact CZ-CE3 4.43Å; F684-W688 PolarHBondContact O-N 3.15Å; F684-I736 HydrophobicContact CE1-CD1 3.76Å; F684-I736 HydrophobicContact CE1-CG1 3.86Å; F684-I736 HydrophobicContact CZ-CD1 3.99Å
685	K	63.7	Low	62.2	Low	21 Å²	21	70.7 Å²	70.7	9%	0.091	35%	0.346	C	S	.	.	H	α-helix	trans	-59.6	-40.7	175.5	-164.9	-163.4	-173.2	-179.2	0	112.3	L681 H682 W688 N689 I739 E743	L681-K685 PolarHBondContact O-N 2.78Å; H682-K685 PolarHBondContact O-N 3.01Å; K685-W688 PolarHBondContact O-N 3.26Å; K685-N689 WeakPolarHBondContact O-CB 3.41Å; K685-N689 VanDerWaalsContact O-CG 3.27Å; K685-N689 PolarHBondContact O-N 3.21Å; K685-I739 HydrophobicContact CB-CG2 4.44Å; K685-I739 HydrophobicContact CD-CG2 3.78Å; K685-I739 HydrophobicContact CG-CG2 4.16Å; K685-E743 WeakPolarHBondContact CD-OE1 3.44Å; K685-E743 WeakPolarHBondContact CE-OE1 3.29Å; K685-E743 IonicContact NZ-OE1 2.77Å; K685-E743 PolarHBondContact NZ-OE1 2.94Å; K685-E743 IonicContact NZ-OE2 3.21Å; K685-E743 PolarHBondContact NZ-OE2 3.4Å
686	Q	65.5	Low	61.8	Low	115 Å²	115	70.3 Å²	70.3	54%	0.537	35%	0.348	S	S	.	.	H	α-helix	trans	-60.8	-45.8	175.2	-75.3	-177.7	-27.2	0	0	111.8	H682 S683 F684 N689 Q690	H682-Q686 PolarHBondContact CE1-NE2 3.33Å; H682-Q686 VanDerWaalsContact CE1-NE2 3.28Å; H682-Q686 WeakPolarHBondContact O-CG 3.37Å; H682-Q686 PolarHBondContact O-N 3.12Å; S683-Q686 PolarHBondContact O-N 3.34Å; F684-Q686 VanDerWaalsContact C-N 3.31Å; F684-Q686 PolarHBondContact O-N 3.48Å; Q686-N689 PolarHBondContact O-N 3.25Å; Q686-Q690 VanDerWaalsContact O-CB 3.29Å; Q686-Q690 WeakPolarHBondContact O-CB 3.24Å; Q686-Q690 PolarHBondContact O-N 3.28Å
687	I	64.8	Low	61.3	Low	48 Å²	48	68.6 Å²	68.6	25%	0.246	36%	0.364	C	S	.	.	H	α-helix	trans	-62.7	-45.7	175.5	-65.1	165.7	0	0	0	110.3	I623 S683 F684 N689 Q690 Y691	I623-I687 HydrophobicContact CD1-CG2 3.94Å; I623-I687 HydrophobicContact CG1-CG2 4.32Å; S683-I687 WeakPolarHBondContact O-CG1 3.42Å; S683-I687 PolarHBondContact O-N 3.11Å; S683-I687 VanDerWaalsContact O-N 3.14Å; F684-I687 PolarHBondContact O-N 3.02Å; I687-N689 PolarHBondContact O-N 3.23Å; I687-Q690 PolarHBondContact O-N 3.11Å; I687-Y691 HydrophobicContact CG2-CD2 3.86Å; I687-Y691 HydrophobicContact CG2-CE2 4.35Å; I687-Y691 VanDerWaalsContact O-CD2 3.26Å; I687-Y691 WeakPolarHBondContact O-CD2 3.4Å; I687-Y691 PolarHBondContact O-N 3.09Å
688	W	64.6	Low	61	Low	13 Å²	13	71.6 Å²	71.6	5%	0.049	38%	0.38	C	S	.	.	H	α-helix	trans	-58.1	-49.7	177.4	-178.9	-94.4	0	0	0	112.8	F684 K685 Q690 Y691 F692 K693 L703 I732 I736	F684-W688 HydrophobicContact CZ-CE3 4.43Å; F684-W688 PolarHBondContact O-N 3.15Å; K685-W688 PolarHBondContact O-N 3.26Å; W688-Q690 PolarHBondContact O-N 3.49Å; W688-Y691 PolarHBondContact O-N 3.04Å; W688-F692 HydrophobicContact CD2-CB 3.7Å; W688-F692 HydrophobicContact CD2-CD2 4.48Å; W688-F692 HydrophobicContact CD2-CG 4.35Å; W688-F692 HydrophobicContact CE3-CB 3.79Å; W688-F692 HydrophobicContact CE3-CD2 4.02Å; W688-F692 AromaticContact CE3-CG 3.97Å; W688-F692 HydrophobicContact CE3-CG 3.97Å; W688-F692 HydrophobicContact CG-CB 4.33Å; W688-F692 HydrophobicContact CH2-CB 4.33Å; W688-F692 HydrophobicContact CZ2-CB 4.21Å; W688-F692 HydrophobicContact CZ3-CB 4.11Å; W688-F692 HydrophobicContact CZ3-CG 4.23Å; W688-F692 WeakPolarHBondContact O-CA 3.42Å; W688-F692 PolarHBondContact O-N 3.3Å; W688-K693 PolarHBondContact O-N 3.14Å; W688-L703 HydrophobicContact CH2-CD2 3.54Å; W688-L703 HydrophobicContact CZ3-CD2 3.68Å; W688-I732 HydrophobicContact CE3-CG2 4.4Å; W688-I732 HydrophobicContact CH2-CG2 3.68Å; W688-I732 HydrophobicContact CZ3-CG2 3.46Å; W688-I732 VanDerWaalsContact CZ3-CG2 3.46Å; W688-I736 HydrophobicContact CB-CD1 4.26Å; W688-I736 HydrophobicContact CD2-CD1 3.15Å; W688-I736 HydrophobicContact CE3-CD1 3.35Å; W688-I736 HydrophobicContact CG-CD1 3.56Å; W688-I736 HydrophobicContact CG-CG2 4.44Å; W688-I736 HydrophobicContact CH2-CD1 3.75Å; W688-I736 HydrophobicContact CZ2-CD1 3.62Å; W688-I736 HydrophobicContact CZ3-CD1 3.63Å
689	N	66.5	Low	60.4	Low	58 Å²	58	72.1 Å²	72.1	31%	0.31	39%	0.392	S	S	.	.	H	α-helix	trans	-62.6	-32.1	179.1	-73.8	-14.2	0	0	0	112.4	K685 Q686 I687 K693	K685-N689 WeakPolarHBondContact O-CB 3.41Å; K685-N689 VanDerWaalsContact O-CG 3.27Å; K685-N689 PolarHBondContact O-N 3.21Å; Q686-N689 PolarHBondContact O-N 3.25Å; I687-N689 PolarHBondContact O-N 3.23Å; N689-K693 WeakPolarHBondContact OD1-CD 3.39Å
690	Q	65.2	Low	59.9	Low	127 Å²	127	73.1 Å²	73.1	59%	0.593	40%	0.397	S	S	*	.	H	α-helix	trans	-76.4	-37	179.5	-174.8	173.8	10.6	0	0	113.3	Q686 I687 W688	Q686-Q690 VanDerWaalsContact O-CB 3.29Å; Q686-Q690 WeakPolarHBondContact O-CB 3.24Å; Q686-Q690 PolarHBondContact O-N 3.28Å; I687-Q690 PolarHBondContact O-N 3.11Å; W688-Q690 PolarHBondContact O-N 3.49Å
691	Y	61.6	Low	60	Low	86 Å²	86	70.1 Å²	70.1	34%	0.337	38%	0.384	S	S	.	.	H	α-helix	trans	-113.3	-25.6	-169.3	-65.8	-76.9	0	0	0	115.3	H619 I687 W688	H619-Y691 AromaticContact CD2-CZ 3.99Å; H619-Y691 AromaticContact CE1-CE2 3.71Å; H619-Y691 AromaticContact CE1-CZ 3.7Å; H619-Y691 PolarHBondContact CE1-OH 2.92Å; H619-Y691 AromaticContact ND1-CE2 3.86Å; H619-Y691 AromaticContact NE2-CZ 3.62Å; H619-Y691 PolarHBondContact NE2-OH 3.37Å; H619-Y691 VanDerWaalsContact NE2-OH 3.12Å; I687-Y691 HydrophobicContact CG2-CD2 3.86Å; I687-Y691 HydrophobicContact CG2-CE2 4.35Å; I687-Y691 VanDerWaalsContact O-CD2 3.26Å; I687-Y691 WeakPolarHBondContact O-CD2 3.4Å; I687-Y691 PolarHBondContact O-N 3.09Å; W688-Y691 PolarHBondContact O-N 3.04Å
692	F	62.5	Low	60.1	Low	19 Å²	19	69.9 Å²	69.9	8%	0.083	39%	0.385	C	S	.	.	T	Hydrogen-bonded Turn	trans	-124.1	-34.3	-167.7	-62	-86.1	0	0	0	114.4	I623 W688 N694 M695 A696 P702 L703	I623-F692 HydrophobicContact CD1-CE2 4.04Å; I623-F692 HydrophobicContact CD1-CZ 4.5Å; W688-F692 HydrophobicContact CD2-CB 3.7Å; W688-F692 HydrophobicContact CD2-CD2 4.48Å; W688-F692 HydrophobicContact CD2-CG 4.35Å; W688-F692 HydrophobicContact CE3-CB 3.79Å; W688-F692 HydrophobicContact CE3-CD2 4.02Å; W688-F692 AromaticContact CE3-CG 3.97Å; W688-F692 HydrophobicContact CE3-CG 3.97Å; W688-F692 HydrophobicContact CG-CB 4.33Å; W688-F692 HydrophobicContact CH2-CB 4.33Å; W688-F692 HydrophobicContact CZ2-CB 4.21Å; W688-F692 HydrophobicContact CZ3-CB 4.11Å; W688-F692 HydrophobicContact CZ3-CG 4.23Å; W688-F692 WeakPolarHBondContact O-CA 3.42Å; W688-F692 PolarHBondContact O-N 3.3Å; F692-N694 PolarHBondContact O-N 3.15Å; F692-M695 PolarHBondContact O-N 3.14Å; F692-A696 PolarHBondContact O-N 3.28Å; F692-P702 HydrophobicContact CE1-CB 4.19Å; F692-L703 HydrophobicContact CD1-CB 4.09Å; F692-L703 HydrophobicContact CE1-CB 4.17Å
693	K	62.1	Low	60.2	Low	97 Å²	97	65.9 Å²	65.9	42%	0.422	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-23.2	-176.5	-174.6	160.7	-174.4	164	0	114.9	W688 N689 E740	W688-K693 PolarHBondContact O-N 3.14Å; N689-K693 WeakPolarHBondContact OD1-CD 3.39Å; K693-E740 IonicContact NZ-OE1 3.1Å; K693-E740 PolarHBondContact NZ-OE1 3.07Å; K693-E740 IonicContact NZ-OE2 2.68Å; K693-E740 PolarHBondContact NZ-OE2 3.08Å
694	N	56.4	Low	60.2	Low	145 Å²	145	65.4 Å²	65.4	78%	0.775	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.4	2	175.9	-65.3	-23	0	0	0	114.1	F692	F692-N694 PolarHBondContact O-N 3.15Å
695	M	52.5	Low	60.3	Low	87 Å²	87	68.9 Å²	68.9	43%	0.429	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-122.5	-15.5	-175.4	-56.2	-165.2	-171	0	0	114	F692 G697 N698 P702	F692-M695 PolarHBondContact O-N 3.14Å; M695-G697 PolarHBondContact O-N 2.93Å; M695-N698 PolarHBondContact O-N 3.19Å; M695-P702 HydrophobicContact SD-CG 3.47Å; M695-P702 WeakPolarHBondContact SD-CG 3.32Å
696	A	52.4	Low	60.2	Low	50 Å²	50	69.9 Å²	69.9	41%	0.413	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.9	128.8	176.3	0	0	0	0	0	112.5	F692 D701	F692-A696 PolarHBondContact O-N 3.28Å; A696-D701 WeakPolarHBondContact CA-OD2 3.33Å
697	G	51.5	Low	60.3	Low	73 Å²	73	64.4 Å²	64.4	75%	0.753	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	98.1	1.8	176.7	0	0	0	0	0	116.2	M695	M695-G697 PolarHBondContact O-N 2.93Å
698	N	53.1	Low	60.4	Low	105 Å²	105	66.9 Å²	66.9	56%	0.561	37%	0.365	S	S	*	.	S	Bend	trans	-96.7	149.3	166.8	-73.9	-51.5	0	0	0	110.9	M695 N700 D701	M695-N698 PolarHBondContact O-N 3.19Å; N698-N700 PolarHBondContact O-N 3.07Å; N698-D701 WeakPolarHBondContact O-CB 3.38Å; N698-D701 PolarHBondContact O-N 3.39Å
699	S	50.2	Low	60.4	Low	101 Å²	101	73.5 Å²	73.5	71%	0.706	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-10.1	169.8	55.6	0	0	0	0	114.1
700	N	53.8	Low	60.4	Low	122 Å²	122	74.6 Å²	74.6	65%	0.652	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.4	19.8	173.4	-61.7	-42.7	0	0	0	112.6	N698 P702	N698-N700 PolarHBondContact O-N 3.07Å; N700-P702 VanDerWaalsContact O-CD 3.3Å; N700-P702 WeakPolarHBondContact O-CD 3.41Å; N700-P702 VanDerWaalsContact O-N 3.12Å
701	D	64	Low	60.2	Low	1 Å²	1	70.7 Å²	70.7	1%	0.005	37%	0.372	C	S	.	.			trans	-55.2	119	176.4	-169.4	-39.4	0	0	0	109.4	A696 N698 L703 L704 L705 Y729	A696-D701 WeakPolarHBondContact CA-OD2 3.33Å; N698-D701 WeakPolarHBondContact O-CB 3.38Å; N698-D701 PolarHBondContact O-N 3.39Å; D701-L703 PolarHBondContact O-N 3.16Å; D701-L703 VanDerWaalsContact O-N 3.16Å; D701-L703 VanDerWaalsContact OD1-CB 3.28Å; D701-L703 WeakPolarHBondContact OD1-CB 3.26Å; D701-L703 PolarHBondContact OD1-N 3.02Å; D701-L704 HydrophobicContact CB-CB 4.15Å; D701-L704 PolarHBondContact O-N 2.7Å; D701-L705 WeakPolarHBondContact O-CG 3.48Å; D701-L705 PolarHBondContact O-N 2.84Å; D701-Y729 HydrophobicContact CB-CE2 4.41Å; D701-Y729 PolarHBondContact OD2-OH 2.79Å; D701-Y729 VanDerWaalsContact OD2-OH 3.04Å
702	P	61.3	Low	60.2	Low	39 Å²	39	71 Å²	71	25%	0.253	38%	0.376	S	S	.	.	H	α-helix	trans	-57.1	-31.4	-179.9	-23.9	33.4	0	0	0	112.7	F692 M695 N700 L706	F692-P702 HydrophobicContact CE1-CB 4.19Å; M695-P702 HydrophobicContact SD-CG 3.47Å; M695-P702 WeakPolarHBondContact SD-CG 3.32Å; N700-P702 VanDerWaalsContact O-CD 3.3Å; N700-P702 WeakPolarHBondContact O-CD 3.41Å; N700-P702 VanDerWaalsContact O-N 3.12Å; P702-L706 WeakPolarHBondContact O-CB 3.33Å; P702-L706 VanDerWaalsContact O-CD1 3.23Å; P702-L706 WeakPolarHBondContact O-CD1 3.49Å; P702-L706 WeakPolarHBondContact O-CG 3.48Å; P702-L706 PolarHBondContact O-N 3.44Å
703	L	63.8	Low	59.5	Low	13 Å²	13	73 Å²	73	7%	0.068	40%	0.402	C	S	.	.	H	α-helix	trans	-66.5	-50.8	177.6	-174.5	70.7	0	0	0	111.1	W688 F692 D701 L705 L706 L707 Y729 I732	W688-L703 HydrophobicContact CH2-CD2 3.54Å; W688-L703 HydrophobicContact CZ3-CD2 3.68Å; F692-L703 HydrophobicContact CD1-CB 4.09Å; F692-L703 HydrophobicContact CE1-CB 4.17Å; D701-L703 PolarHBondContact O-N 3.16Å; D701-L703 VanDerWaalsContact O-N 3.16Å; D701-L703 VanDerWaalsContact OD1-CB 3.28Å; D701-L703 WeakPolarHBondContact OD1-CB 3.26Å; D701-L703 PolarHBondContact OD1-N 3.02Å; L703-L705 VanDerWaalsContact C-N 3.3Å; L703-L705 PolarHBondContact O-N 2.94Å; L703-L706 PolarHBondContact O-N 3.02Å; L703-L706 VanDerWaalsContact O-N 3.07Å; L703-L707 HydrophobicContact CD1-CD1 4.48Å; L703-L707 HydrophobicContact CG-CD1 3.98Å; L703-L707 HydrophobicContact CG-CG 4.4Å; L703-L707 VanDerWaalsContact O-CG 3.28Å; L703-L707 WeakPolarHBondContact O-CG 3.3Å; L703-L707 PolarHBondContact O-N 2.77Å; L703-Y729 HydrophobicContact CB-CD2 4.31Å; L703-Y729 HydrophobicContact CB-CE2 4.26Å; L703-Y729 HydrophobicContact CD2-CD2 3.75Å; L703-Y729 HydrophobicContact CD2-CE2 4.02Å; L703-Y729 HydrophobicContact CG-CD2 4.07Å; L703-Y729 HydrophobicContact CG-CE2 4.44Å; L703-I732 HydrophobicContact CD1-CD1 4.23Å; L703-I732 HydrophobicContact CD2-CB 4.22Å; L703-I732 HydrophobicContact CD2-CD1 4.22Å; L703-I732 HydrophobicContact CD2-CG2 3.86Å
704	L	65.5	Low	58.7	Low	42 Å²	42	76.7 Å²	76.7	22%	0.22	43%	0.427	C	S	.	.	H	α-helix	trans	-60.2	-42.1	178.3	-169.3	70.6	0	0	0	111	D701 L706 L707 R708 V725 Y729	D701-L704 HydrophobicContact CB-CB 4.15Å; D701-L704 PolarHBondContact O-N 2.7Å; L704-L706 VanDerWaalsContact C-N 3.33Å; L704-L706 PolarHBondContact O-N 3.37Å; L704-L707 PolarHBondContact O-N 3.01Å; L704-R708 WeakPolarHBondContact O-CB 3.47Å; L704-R708 PolarHBondContact O-N 3.14Å; L704-V725 HydrophobicContact CD1-CG1 4.27Å; L704-Y729 HydrophobicContact CB-CD2 3.97Å; L704-Y729 HydrophobicContact CB-CE2 4.06Å; L704-Y729 HydrophobicContact CD1-CD1 4.23Å; L704-Y729 HydrophobicContact CD1-CD2 3.98Å; L704-Y729 HydrophobicContact CD1-CG 3.78Å
705	L	65.1	Low	57.8	Low	84 Å²	84	72.5 Å²	72.5	44%	0.44	42%	0.418	S	S	.	.	H	α-helix	trans	-65.4	-32	174.8	-68.7	174.2	0	0	0	113.4	D701 L703 R709	D701-L705 WeakPolarHBondContact O-CG 3.48Å; D701-L705 PolarHBondContact O-N 2.84Å; L703-L705 VanDerWaalsContact C-N 3.3Å; L703-L705 PolarHBondContact O-N 2.94Å; L705-R709 VanDerWaalsContact O-CB 3.27Å; L705-R709 WeakPolarHBondContact O-CB 3.08Å; L705-R709 PolarHBondContact O-N 3.08Å
706	L	62.9	Low	57.4	Low	42 Å²	42	75.7 Å²	75.7	22%	0.22	44%	0.437	C	S	.	.	H	α-helix	trans	-77.9	-35.7	176.6	-78.1	163.8	0	0	0	112.2	Y620 P702 L703 L704 R710	Y620-L706 HydrophobicContact CD2-CB 4.32Å; Y620-L706 HydrophobicContact CD2-CD1 3.74Å; Y620-L706 HydrophobicContact CD2-CD2 4.17Å; Y620-L706 HydrophobicContact CD2-CG 4.31Å; Y620-L706 HydrophobicContact CE2-CB 3.71Å; Y620-L706 HydrophobicContact CE2-CD1 3.99Å; Y620-L706 HydrophobicContact CE2-CD2 4.19Å; Y620-L706 HydrophobicContact CE2-CG 4.18Å; Y620-L706 HydrophobicContact CG-CD1 4.47Å; Y620-L706 HydrophobicContact CG-CD2 4.34Å; Y620-L706 PolarHBondContact OH-O 3.03Å; P702-L706 WeakPolarHBondContact O-CB 3.33Å; P702-L706 VanDerWaalsContact O-CD1 3.23Å; P702-L706 WeakPolarHBondContact O-CD1 3.49Å; P702-L706 WeakPolarHBondContact O-CG 3.48Å; P702-L706 PolarHBondContact O-N 3.44Å; L703-L706 PolarHBondContact O-N 3.02Å; L703-L706 VanDerWaalsContact O-N 3.07Å; L704-L706 VanDerWaalsContact C-N 3.33Å; L704-L706 PolarHBondContact O-N 3.37Å; L706-R710 PolarHBondContact O-N 3.49Å
707	L	66.1	Low	57.3	Low	1 Å²	1	81.1 Å²	81.1	1%	0.005	46%	0.459	C	S	.	.	H	α-helix	trans	-67.5	-49.7	174.5	-68.3	170.5	0	0	0	110.5	L703 L704 R709 R710 H711 V725 E728 Y729 I732	L703-L707 HydrophobicContact CD1-CD1 4.48Å; L703-L707 HydrophobicContact CG-CD1 3.98Å; L703-L707 HydrophobicContact CG-CG 4.4Å; L703-L707 VanDerWaalsContact O-CG 3.28Å; L703-L707 WeakPolarHBondContact O-CG 3.3Å; L703-L707 PolarHBondContact O-N 2.77Å; L704-L707 PolarHBondContact O-N 3.01Å; L707-R709 VanDerWaalsContact C-N 3.27Å; L707-R709 PolarHBondContact O-N 3.09Å; L707-R710 WeakPolarHBondContact O-CA 3.36Å; L707-R710 WeakPolarHBondContact O-CB 3.45Å; L707-R710 PolarHBondContact O-N 3.42Å; L707-H711 PolarHBondContact O-N 3.48Å; L707-H711 VanDerWaalsContact O-N 3.09Å; L707-V725 HydrophobicContact CB-CG1 3.86Å; L707-E728 HydrophobicContact CD1-CB 4.38Å; L707-E728 HydrophobicContact CD2-CB 4.17Å; L707-E728 HydrophobicContact CD2-CG 3.86Å; L707-E728 VanDerWaalsContact CD2-OE2 3.29Å; L707-E728 WeakPolarHBondContact CD2-OE2 3.35Å; L707-Y729 HydrophobicContact CD1-CD2 4.25Å; L707-Y729 HydrophobicContact CD1-CG 4.47Å; L707-I732 HydrophobicContact CD1-CD1 4.48Å
708	R	66.7	Low	57.3	Low	99 Å²	99	83.2 Å²	83.2	37%	0.374	45%	0.453	S	S	.	.	H	α-helix	trans	-58	-38.3	173.7	-172	173.1	-79.7	163	-6.6	112.4	L704 R710 H711 H712 D722 V725	L704-R708 WeakPolarHBondContact O-CB 3.47Å; L704-R708 PolarHBondContact O-N 3.14Å; R708-R710 VanDerWaalsContact C-N 3.29Å; R708-R710 PolarHBondContact O-N 2.85Å; R708-H711 PolarHBondContact O-N 3.23Å; R708-H712 WeakPolarHBondContact O-CB 3.42Å; R708-H712 PolarHBondContact O-N 3.09Å; R708-D722 IonicContact CZ-OD1 3.68Å; R708-D722 IonicContact CZ-OD2 2.67Å; R708-D722 IonicContact NE-OD1 3.56Å; R708-D722 PolarHBondContact NE-OD1 3.18Å; R708-D722 IonicContact NE-OD2 2.76Å; R708-D722 IonicContact NH2-OD1 2.69Å; R708-D722 PolarHBondContact NH2-OD1 3.45Å; R708-D722 IonicContact NH2-OD2 2.66Å; R708-D722 PolarHBondContact NH2-OD2 3.5Å; R708-V725 HydrophobicContact CB-CG1 4.13Å
709	R	66	Low	57.5	Low	152 Å²	152	85.6 Å²	85.6	57%	0.574	47%	0.466	S	S	*	.	H	α-helix	trans	-69.7	-21.6	174.3	-172.1	178.3	-65.3	-168.4	-0.9	113.8	L705 L707	L705-R709 VanDerWaalsContact O-CB 3.27Å; L705-R709 WeakPolarHBondContact O-CB 3.08Å; L705-R709 PolarHBondContact O-N 3.08Å; L707-R709 VanDerWaalsContact C-N 3.27Å; L707-R709 PolarHBondContact O-N 3.09Å
710	R	65.3	Low	57.7	Low	81 Å²	81	87.7 Å²	87.7	31%	0.306	47%	0.469	S	S	.	.	H	α-helix	trans	-78	-43.8	174.5	-174	-166.1	-68.2	165.3	-2.6	111.1	Y620 L706 L707 R708 E728	Y620-R710 PolarHBondContact OH-NE 3.09Å; Y620-R710 PolarHBondContact OH-NH2 3.1Å; L706-R710 PolarHBondContact O-N 3.49Å; L707-R710 WeakPolarHBondContact O-CA 3.36Å; L707-R710 WeakPolarHBondContact O-CB 3.45Å; L707-R710 PolarHBondContact O-N 3.42Å; R708-R710 VanDerWaalsContact C-N 3.29Å; R708-R710 PolarHBondContact O-N 2.85Å; R710-E728 IonicContact CZ-OE1 2.75Å; R710-E728 IonicContact CZ-OE2 3.83Å; R710-E728 IonicContact NH1-OE1 3.97Å; R710-E728 PolarHBondContact NH1-OE1 3.47Å; R710-E728 IonicContact NH1-OE2 3.53Å; R710-E728 PolarHBondContact NH1-OE2 3.28Å; R710-E728 IonicContact NH2-OE1 2.68Å
711	H	62.2	Low	57.9	Low	45 Å²	45	84.9 Å²	84.9	21%	0.208	45%	0.454	C	S	.	.	H	α-helix	trans	-70.9	-47.9	178.8	-77.4	-105.8	0	0	0	111.4	L707 R708 G713 E724 V725	L707-H711 PolarHBondContact O-N 3.48Å; L707-H711 VanDerWaalsContact O-N 3.09Å; R708-H711 PolarHBondContact O-N 3.23Å; H711-G713 PolarHBondContact O-N 2.8Å; H711-E724 IonicContact CE1-OE2 2.67Å; H711-E724 PolarHBondContact CE1-OE2 2.89Å; H711-E724 IonicContact ND1-OE2 2.58Å; H711-V725 HydrophobicContact CB-CG2 3.65Å; H711-V725 VanDerWaalsContact CG-CG2 3.47Å
712	H	60.8	Low	57.8	Low	92 Å²	92	87.7 Å²	87.7	43%	0.426	47%	0.469	S	S	.	.	S	Bend	trans	-75.9	66.4	175.2	-60.9	-8.8	0	0	0	113	R708 N714 D721	R708-H712 WeakPolarHBondContact O-CB 3.42Å; R708-H712 PolarHBondContact O-N 3.09Å; H712-N714 PolarHBondContact O-N 3.15Å; H712-D721 IonicContact ND1-OD2 2.62Å
713	G	47.1	Very low	58	Low	62 Å²	62	92.3 Å²	92.3	64%	0.639	49%	0.491	S	S	*	.			trans	-77.1	79	178.7	0	0	0	0	0	113.9	H711	H711-G713 PolarHBondContact O-N 2.8Å
714	N	45.1	Very low	58	Low	174 Å²	174	97.3 Å²	97.3	93%	0.93	52%	0.515	S	S	*	.	S	Bend	trans	54.4	58.4	169.2	-73	-26.8	0	0	0	115.9	H712	H712-N714 PolarHBondContact O-N 3.15Å
715	G	38	Very low	58	Low	58 Å²	58	95.4 Å²	95.4	60%	0.598	50%	0.504	S	S	*	.	S	Bend	trans	152.4	143.5	160.7	0	0	0	0	0	114.5
716	D	45.3	Very low	58.2	Low	154 Å²	154	96.8 Å²	96.8	82%	0.824	51%	0.509	S	S	*	.			trans	66.9	129.1	163.8	-52.4	-24	0	0	0	117.4	D718	D716-D718 VanDerWaalsContact C-N 3.34Å; D716-D718 PolarHBondContact O-N 2.76Å
717	D	49.2	Very low	58.4	Low	163 Å²	163	101.5 Å²	101.5	87%	0.872	53%	0.529	S	S	*	.			trans	-83.8	62.7	-168	-54.1	-72.9	0	0	0	112.4	D719	D717-D719 PolarHBondContact O-N 3.42Å
718	D	51.8	Low	58.4	Low	118 Å²	118	103.2 Å²	103.2	63%	0.631	54%	0.537	S	S	*	.			trans	-86.9	101.5	173	-73.9	-30.4	0	0	0	110.2	D716 D720	D716-D718 VanDerWaalsContact C-N 3.34Å; D716-D718 PolarHBondContact O-N 2.76Å; D718-D720 PolarHBondContact O-N 3.42Å
719	D	56.6	Low	58.4	Low	155 Å²	155	100.1 Å²	100.1	83%	0.829	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	1.4	-179.5	-71.9	-48.4	0	0	0	114.8	D717	D717-D719 PolarHBondContact O-N 3.42Å
720	D	56	Low	58.6	Low	145 Å²	145	97.9 Å²	97.9	78%	0.775	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.8	-11.9	-174.3	-73.5	-31.9	0	0	0	114.1	D718	D718-D720 PolarHBondContact O-N 3.42Å
721	D	56.8	Low	58.6	Low	62 Å²	62	98.2 Å²	98.2	33%	0.332	53%	0.526	S	S	.	.	S	Bend	trans	-82.7	-12.5	-174.9	-91.2	-4	0	0	0	114.9	H712 D723 E724	H712-D721 IonicContact ND1-OD2 2.62Å; D721-D723 VanDerWaalsContact C-N 3.34Å; D721-D723 PolarHBondContact O-N 3.29Å; D721-E724 PolarHBondContact O-N 3.24Å
722	D	61.3	Low	58.6	Low	60 Å²	60	96.5 Å²	96.5	32%	0.321	52%	0.518	S	S	.	.	H	α-helix	trans	-69.6	-28.1	-172.3	-105.7	-16.5	0	0	0	113.3	R708 E726	R708-D722 IonicContact CZ-OD1 3.68Å; R708-D722 IonicContact CZ-OD2 2.67Å; R708-D722 IonicContact NE-OD1 3.56Å; R708-D722 PolarHBondContact NE-OD1 3.18Å; R708-D722 IonicContact NE-OD2 2.76Å; R708-D722 IonicContact NH2-OD1 2.69Å; R708-D722 PolarHBondContact NH2-OD1 3.45Å; R708-D722 IonicContact NH2-OD2 2.66Å; R708-D722 PolarHBondContact NH2-OD2 3.5Å; D722-E726 PolarHBondContact O-N 3.23Å; D722-E726 VanDerWaalsContact O-N 3.09Å
723	D	65.9	Low	58.8	Low	136 Å²	136	93.9 Å²	93.9	73%	0.727	51%	0.508	S	S	*	.	H	α-helix	trans	-64.5	-41.9	177.7	-84	-11.6	0	0	0	112.1	D721 E726 E727	D721-D723 VanDerWaalsContact C-N 3.34Å; D721-D723 PolarHBondContact O-N 3.29Å; D723-E726 PolarHBondContact O-N 3.36Å; D723-E727 PolarHBondContact O-N 2.94Å
724	E	65.3	Low	59.9	Low	119 Å²	119	94 Å²	94	56%	0.556	49%	0.492	S	S	*	.	H	α-helix	trans	-73.1	-32.7	-178.1	-162.8	175.2	-153.2	0	0	111.3	H711 D721 E727 E728	H711-E724 IonicContact CE1-OE2 2.67Å; H711-E724 PolarHBondContact CE1-OE2 2.89Å; H711-E724 IonicContact ND1-OE2 2.58Å; D721-E724 PolarHBondContact O-N 3.24Å; E724-E727 PolarHBondContact O-N 3.02Å; E724-E728 PolarHBondContact O-N 3.34Å
725	V	65.3	Low	60.4	Low	1 Å²	1	87.6 Å²	87.6	1%	0.006	46%	0.457	C	S	.	.	H	α-helix	trans	-64.9	-42.9	172.6	168.2	0	0	0	0	111.7	L704 L707 R708 H711 Y729	L704-V725 HydrophobicContact CD1-CG1 4.27Å; L707-V725 HydrophobicContact CB-CG1 3.86Å; R708-V725 HydrophobicContact CB-CG1 4.13Å; H711-V725 HydrophobicContact CB-CG2 3.65Å; H711-V725 VanDerWaalsContact CG-CG2 3.47Å; V725-Y729 WeakPolarHBondContact O-CB 3.28Å; V725-Y729 PolarHBondContact O-N 2.94Å; V725-Y729 VanDerWaalsContact O-N 3.08Å
726	E	68.6	Low	61.5	Low	114 Å²	114	85.2 Å²	85.2	53%	0.533	43%	0.431	S	S	.	.	H	α-helix	trans	-71.7	-34.6	178	-167.3	163	-166.2	0	0	111.5	D722 D723 Y729 L730	D722-E726 PolarHBondContact O-N 3.23Å; D722-E726 VanDerWaalsContact O-N 3.09Å; D723-E726 PolarHBondContact O-N 3.36Å; E726-Y729 PolarHBondContact O-N 3.5Å; E726-L730 HydrophobicContact CG-CD1 4.18Å; E726-L730 HydrophobicContact CG-CG 4.47Å; E726-L730 WeakPolarHBondContact O-CB 3.49Å; E726-L730 VanDerWaalsContact O-CG 3.27Å; E726-L730 WeakPolarHBondContact O-CG 3.26Å; E726-L730 PolarHBondContact O-N 3.13Å
727	E	67.7	Low	62.5	Low	140 Å²	140	81.5 Å²	81.5	65%	0.654	41%	0.414	S	S	*	.	H	α-helix	trans	-63.8	-45.8	172.4	-168	168.9	-155.4	0	0	112.2	D723 E724 Y729 L730 W731	D723-E727 PolarHBondContact O-N 2.94Å; E724-E727 PolarHBondContact O-N 3.02Å; E727-Y729 VanDerWaalsContact C-N 3.33Å; E727-Y729 PolarHBondContact O-N 3.33Å; E727-L730 PolarHBondContact O-N 3.45Å; E727-W731 WeakPolarHBondContact O-CB 3.3Å; E727-W731 PolarHBondContact O-N 3.23Å
728	E	64.8	Low	63	Low	37 Å²	37	76.5 Å²	76.5	17%	0.173	39%	0.385	C	S	.	.	H	α-helix	trans	-64.1	-37.6	174.9	-164.2	-177.4	166.4	0	0	111.5	L707 R710 E724 I732	L707-E728 HydrophobicContact CD1-CB 4.38Å; L707-E728 HydrophobicContact CD2-CB 4.17Å; L707-E728 HydrophobicContact CD2-CG 3.86Å; L707-E728 VanDerWaalsContact CD2-OE2 3.29Å; L707-E728 WeakPolarHBondContact CD2-OE2 3.35Å; R710-E728 IonicContact CZ-OE1 2.75Å; R710-E728 IonicContact CZ-OE2 3.83Å; R710-E728 IonicContact NH1-OE1 3.97Å; R710-E728 PolarHBondContact NH1-OE1 3.47Å; R710-E728 IonicContact NH1-OE2 3.53Å; R710-E728 PolarHBondContact NH1-OE2 3.28Å; R710-E728 IonicContact NH2-OE1 2.68Å; E724-E728 PolarHBondContact O-N 3.34Å; E728-I732 HydrophobicContact CG-CD1 4.04Å; E728-I732 WeakPolarHBondContact O-CD1 3.39Å; E728-I732 VanDerWaalsContact O-CG1 3.26Å; E728-I732 WeakPolarHBondContact O-CG1 3.37Å; E728-I732 PolarHBondContact O-N 2.99Å; E728-I732 VanDerWaalsContact O-N 3.12Å
729	Y	68.2	Low	63.1	Low	35 Å²	35	72 Å²	72	14%	0.137	36%	0.361	C	S	.	.	H	α-helix	trans	-65.7	-43.9	177.3	178.2	-97.9	0	0	0	112.8	D701 L703 L704 L707 V725 E726 E727 N733	D701-Y729 HydrophobicContact CB-CE2 4.41Å; D701-Y729 PolarHBondContact OD2-OH 2.79Å; D701-Y729 VanDerWaalsContact OD2-OH 3.04Å; L703-Y729 HydrophobicContact CB-CD2 4.31Å; L703-Y729 HydrophobicContact CB-CE2 4.26Å; L703-Y729 HydrophobicContact CD2-CD2 3.75Å; L703-Y729 HydrophobicContact CD2-CE2 4.02Å; L703-Y729 HydrophobicContact CG-CD2 4.07Å; L703-Y729 HydrophobicContact CG-CE2 4.44Å; L704-Y729 HydrophobicContact CB-CD2 3.97Å; L704-Y729 HydrophobicContact CB-CE2 4.06Å; L704-Y729 HydrophobicContact CD1-CD1 4.23Å; L704-Y729 HydrophobicContact CD1-CD2 3.98Å; L704-Y729 HydrophobicContact CD1-CG 3.78Å; L707-Y729 HydrophobicContact CD1-CD2 4.25Å; L707-Y729 HydrophobicContact CD1-CG 4.47Å; V725-Y729 WeakPolarHBondContact O-CB 3.28Å; V725-Y729 PolarHBondContact O-N 2.94Å; V725-Y729 VanDerWaalsContact O-N 3.08Å; E726-Y729 PolarHBondContact O-N 3.5Å; E727-Y729 VanDerWaalsContact C-N 3.33Å; E727-Y729 PolarHBondContact O-N 3.33Å; Y729-N733 VanDerWaalsContact CE1-ND2 3.3Å; Y729-N733 WeakPolarHBondContact CE1-ND2 3.27Å; Y729-N733 VanDerWaalsContact CZ-ND2 3.25Å; Y729-N733 PolarHBondContact O-N 3.46Å; Y729-N733 PolarHBondContact O-ND2 3.02Å
730	L	69.2	Low	63.4	Low	104 Å²	104	67.3 Å²	67.3	55%	0.545	33%	0.334	S	S	.	.	H	α-helix	trans	-64.3	-45.9	177	-74.8	167.9	0	0	0	111.1	E726 E727 I732 N733 E734	E726-L730 HydrophobicContact CG-CD1 4.18Å; E726-L730 HydrophobicContact CG-CG 4.47Å; E726-L730 WeakPolarHBondContact O-CB 3.49Å; E726-L730 VanDerWaalsContact O-CG 3.27Å; E726-L730 WeakPolarHBondContact O-CG 3.26Å; E726-L730 PolarHBondContact O-N 3.13Å; E727-L730 PolarHBondContact O-N 3.45Å; L730-I732 PolarHBondContact O-N 3.19Å; L730-N733 PolarHBondContact O-N 3.05Å; L730-N733 VanDerWaalsContact O-N 3.17Å; L730-E734 PolarHBondContact O-N 2.88Å
731	W	65.6	Low	63.9	Low	88 Å²	88	64.8 Å²	64.8	33%	0.333	32%	0.32	S	S	.	.	H	α-helix	trans	-61.2	-40.5	179.7	178.6	67.1	0	0	0	113	M627 E727 N733 E734 L735	M627-W731 HydrophobicContact CE-CH2 4.42Å; M627-W731 HydrophobicContact CE-CZ3 3.71Å; E727-W731 WeakPolarHBondContact O-CB 3.3Å; E727-W731 PolarHBondContact O-N 3.23Å; W731-N733 VanDerWaalsContact C-N 3.35Å; W731-N733 PolarHBondContact O-N 3.04Å; W731-E734 PolarHBondContact O-N 3.44Å; W731-L735 WeakPolarHBondContact O-CB 3.41Å; W731-L735 PolarHBondContact O-N 3.17Å
732	I	62	Low	63.7	Low	9 Å²	9	69 Å²	69	5%	0.046	33%	0.332	C	S	.	.	H	α-helix	trans	-64.7	-38.9	176.3	-67	166.8	0	0	0	111.3	W688 L703 L707 E728 L730 I736	W688-I732 HydrophobicContact CE3-CG2 4.4Å; W688-I732 HydrophobicContact CH2-CG2 3.68Å; W688-I732 HydrophobicContact CZ3-CG2 3.46Å; W688-I732 VanDerWaalsContact CZ3-CG2 3.46Å; L703-I732 HydrophobicContact CD1-CD1 4.23Å; L703-I732 HydrophobicContact CD2-CB 4.22Å; L703-I732 HydrophobicContact CD2-CD1 4.22Å; L703-I732 HydrophobicContact CD2-CG2 3.86Å; L707-I732 HydrophobicContact CD1-CD1 4.48Å; E728-I732 HydrophobicContact CG-CD1 4.04Å; E728-I732 WeakPolarHBondContact O-CD1 3.39Å; E728-I732 VanDerWaalsContact O-CG1 3.26Å; E728-I732 WeakPolarHBondContact O-CG1 3.37Å; E728-I732 PolarHBondContact O-N 2.99Å; E728-I732 VanDerWaalsContact O-N 3.12Å; L730-I732 PolarHBondContact O-N 3.19Å; I732-I736 HydrophobicContact CG2-CD1 4.04Å; I732-I736 WeakPolarHBondContact O-CD1 3.45Å; I732-I736 VanDerWaalsContact O-CG1 3.27Å; I732-I736 WeakPolarHBondContact O-CG1 3.32Å; I732-I736 PolarHBondContact O-N 3.09Å
733	N	65.5	Low	63.5	Low	38 Å²	38	70 Å²	70	20%	0.203	34%	0.335	C	S	.	.	H	α-helix	trans	-69.7	-38.7	176.9	-78.3	-60.9	0	0	0	112.7	Y729 L730 W731 I736 T737	Y729-N733 VanDerWaalsContact CE1-ND2 3.3Å; Y729-N733 WeakPolarHBondContact CE1-ND2 3.27Å; Y729-N733 VanDerWaalsContact CZ-ND2 3.25Å; Y729-N733 PolarHBondContact O-N 3.46Å; Y729-N733 PolarHBondContact O-ND2 3.02Å; L730-N733 PolarHBondContact O-N 3.05Å; L730-N733 VanDerWaalsContact O-N 3.17Å; W731-N733 VanDerWaalsContact C-N 3.35Å; W731-N733 PolarHBondContact O-N 3.04Å; N733-I736 PolarHBondContact O-N 2.91Å; N733-T737 PolarHBondContact O-N 2.96Å; N733-T737 PolarHBondContact O-OG1 2.77Å
734	E	68.7	Low	63.1	Low	64 Å²	64	67 Å²	67	30%	0.299	32%	0.324	S	S	.	.	H	α-helix	trans	-63.9	-48.8	175.3	-178.9	55.7	-148.3	0	0	111.1	L730 W731 I736 T737 Q738	L730-E734 PolarHBondContact O-N 2.88Å; W731-E734 PolarHBondContact O-N 3.44Å; E734-I736 PolarHBondContact O-N 3.27Å; E734-I736 VanDerWaalsContact O-N 3.08Å; E734-T737 WeakPolarHBondContact O-CB 3.3Å; E734-T737 PolarHBondContact O-N 3.21Å; E734-T737 VanDerWaalsContact O-N 3.08Å; E734-Q738 WeakPolarHBondContact O-CG 3.47Å; E734-Q738 PolarHBondContact O-N 2.68Å; E734-Q738 WeakPolarHBondContact OE1-CG 3.38Å; E734-Q738 PolarHBondContact OE1-NE2 3.13Å
735	L	56.7	Low	62.3	Low	39 Å²	39	66.5 Å²	66.5	20%	0.204	32%	0.322	C	S	.	.	H	α-helix	trans	-50.9	-38.5	176.2	176.1	62.8	0	0	0	112.4	W731 I739 L810	W731-L735 WeakPolarHBondContact O-CB 3.41Å; W731-L735 PolarHBondContact O-N 3.17Å; L735-I739 HydrophobicContact CD1-CD1 4.46Å; L735-I739 HydrophobicContact CG-CD1 4.27Å; L735-I739 VanDerWaalsContact O-CG1 3.28Å; L735-I739 WeakPolarHBondContact O-CG1 3.49Å; L735-I739 PolarHBondContact O-N 2.87Å; L735-I739 VanDerWaalsContact O-N 3.09Å; L735-L810 HydrophobicContact CD1-CD2 4.02Å
736	I	60.4	Low	61.3	Low	8 Å²	8	68.8 Å²	68.8	4%	0.041	33%	0.334	C	S	.	.	H	α-helix	trans	-81.1	-36.9	-176.8	-67.3	172.1	0	0	0	111.4	F684 W688 I732 N733 E734 Q738 I739 E740	F684-I736 HydrophobicContact CE1-CD1 3.76Å; F684-I736 HydrophobicContact CE1-CG1 3.86Å; F684-I736 HydrophobicContact CZ-CD1 3.99Å; W688-I736 HydrophobicContact CB-CD1 4.26Å; W688-I736 HydrophobicContact CD2-CD1 3.15Å; W688-I736 HydrophobicContact CE3-CD1 3.35Å; W688-I736 HydrophobicContact CG-CD1 3.56Å; W688-I736 HydrophobicContact CG-CG2 4.44Å; W688-I736 HydrophobicContact CH2-CD1 3.75Å; W688-I736 HydrophobicContact CZ2-CD1 3.62Å; W688-I736 HydrophobicContact CZ3-CD1 3.63Å; I732-I736 HydrophobicContact CG2-CD1 4.04Å; I732-I736 WeakPolarHBondContact O-CD1 3.45Å; I732-I736 VanDerWaalsContact O-CG1 3.27Å; I732-I736 WeakPolarHBondContact O-CG1 3.32Å; I732-I736 PolarHBondContact O-N 3.09Å; N733-I736 PolarHBondContact O-N 2.91Å; E734-I736 PolarHBondContact O-N 3.27Å; E734-I736 VanDerWaalsContact O-N 3.08Å; I736-Q738 VanDerWaalsContact C-N 3.27Å; I736-Q738 PolarHBondContact O-N 3.4Å; I736-I739 PolarHBondContact O-N 3.21Å; I736-E740 WeakPolarHBondContact O-CG 3.39Å; I736-E740 PolarHBondContact O-N 2.81Å
737	T	65.9	Low	60	Low	76 Å²	76	70 Å²	70	47%	0.466	34%	0.335	S	S	.	.	H	α-helix	trans	-57.4	-42.9	169.6	-56.9	0	0	0	0	110.6	N733 E734 E740 L741	N733-T737 PolarHBondContact O-N 2.96Å; N733-T737 PolarHBondContact O-OG1 2.77Å; E734-T737 WeakPolarHBondContact O-CB 3.3Å; E734-T737 PolarHBondContact O-N 3.21Å; E734-T737 VanDerWaalsContact O-N 3.08Å; T737-E740 PolarHBondContact O-N 3.28Å; T737-L741 WeakPolarHBondContact O-CB 3.28Å; T737-L741 PolarHBondContact O-N 3.19Å
738	Q	60.2	Low	58.6	Low	59 Å²	59	69.9 Å²	69.9	28%	0.276	33%	0.334	S	S	.	.	H	α-helix	trans	-66.3	-39.7	176	-65.5	-69	-14.8	0	0	113.1	E734 I736 E740 L741 Y742 L810	E734-Q738 WeakPolarHBondContact O-CG 3.47Å; E734-Q738 PolarHBondContact O-N 2.68Å; E734-Q738 WeakPolarHBondContact OE1-CG 3.38Å; E734-Q738 PolarHBondContact OE1-NE2 3.13Å; I736-Q738 VanDerWaalsContact C-N 3.27Å; I736-Q738 PolarHBondContact O-N 3.4Å; Q738-E740 VanDerWaalsContact C-N 3.32Å; Q738-E740 PolarHBondContact O-N 2.75Å; Q738-L741 PolarHBondContact O-N 3.4Å; Q738-Y742 WeakPolarHBondContact O-CB 3.28Å; Q738-Y742 PolarHBondContact O-N 3.45Å; Q738-L810 HydrophobicContact CB-CD2 3.56Å; Q738-L810 HydrophobicContact CG-CD2 3.82Å
739	I	55.1	Low	57.4	Low	23 Å²	23	72.3 Å²	72.3	12%	0.118	35%	0.347	C	S	.	.	H	α-helix	trans	-61.5	-40.9	172.9	-70.4	163.7	0	0	0	111	L681 K685 L735 I736 E743	L681-I739 HydrophobicContact CD2-CD1 4.37Å; K685-I739 HydrophobicContact CB-CG2 4.44Å; K685-I739 HydrophobicContact CD-CG2 3.78Å; K685-I739 HydrophobicContact CG-CG2 4.16Å; L735-I739 HydrophobicContact CD1-CD1 4.46Å; L735-I739 HydrophobicContact CG-CD1 4.27Å; L735-I739 VanDerWaalsContact O-CG1 3.28Å; L735-I739 WeakPolarHBondContact O-CG1 3.49Å; L735-I739 PolarHBondContact O-N 2.87Å; L735-I739 VanDerWaalsContact O-N 3.09Å; I736-I739 PolarHBondContact O-N 3.21Å; I739-E743 PolarHBondContact O-N 3.36Å; I739-E743 VanDerWaalsContact O-N 3.16Å
740	E	62.5	Low	56	Low	56 Å²	56	75.8 Å²	75.8	26%	0.262	36%	0.363	S	S	.	.	H	α-helix	trans	-68.9	-36.1	176.1	-68.9	-167.6	169.5	0	0	112.8	K693 I736 T737 Q738 S744	K693-E740 IonicContact NZ-OE1 3.1Å; K693-E740 PolarHBondContact NZ-OE1 3.07Å; K693-E740 IonicContact NZ-OE2 2.68Å; K693-E740 PolarHBondContact NZ-OE2 3.08Å; I736-E740 WeakPolarHBondContact O-CG 3.39Å; I736-E740 PolarHBondContact O-N 2.81Å; T737-E740 PolarHBondContact O-N 3.28Å; Q738-E740 VanDerWaalsContact C-N 3.32Å; Q738-E740 PolarHBondContact O-N 2.75Å; E740-S744 WeakPolarHBondContact O-CB 3.41Å; E740-S744 PolarHBondContact O-N 3.04Å; E740-S744 PolarHBondContact O-OG 2.91Å
741	L	65.3	Low	54.8	Low	92 Å²	92	73.5 Å²	73.5	48%	0.482	35%	0.353	S	S	.	.	H	α-helix	trans	-64.6	-45.1	174.9	-151.3	95.7	0	0	0	111.6	T737 Q738 S744 Q745	T737-L741 WeakPolarHBondContact O-CB 3.28Å; T737-L741 PolarHBondContact O-N 3.19Å; Q738-L741 PolarHBondContact O-N 3.4Å; L741-S744 WeakPolarHBondContact O-CB 3.33Å; L741-S744 PolarHBondContact O-N 3.12Å; L741-Q745 WeakPolarHBondContact O-CG 3.44Å; L741-Q745 PolarHBondContact O-N 3.1Å
742	Y	53.2	Low	53.7	Low	152 Å²	152	73.4 Å²	73.4	60%	0.596	36%	0.362	S	S	*	.	H	α-helix	trans	-64.5	-44	-179.9	-170.5	-93.7	0	0	0	112.2	Q738 S744 Q745 D746	Q738-Y742 WeakPolarHBondContact O-CB 3.28Å; Q738-Y742 PolarHBondContact O-N 3.45Å; Y742-S744 VanDerWaalsContact C-N 3.29Å; Y742-S744 PolarHBondContact O-N 3.27Å; Y742-Q745 PolarHBondContact O-N 3.18Å; Y742-D746 PolarHBondContact O-N 3.46Å
743	E	57.5	Low	52.5	Low	79 Å²	79	76.8 Å²	76.8	37%	0.369	38%	0.381	S	S	.	.	H	α-helix	trans	-64.3	-33.8	173.1	-81.6	-179	-132.3	0	0	112.7	K685 I739 D746 Y747	K685-E743 WeakPolarHBondContact CD-OE1 3.44Å; K685-E743 WeakPolarHBondContact CE-OE1 3.29Å; K685-E743 IonicContact NZ-OE1 2.77Å; K685-E743 PolarHBondContact NZ-OE1 2.94Å; K685-E743 IonicContact NZ-OE2 3.21Å; K685-E743 PolarHBondContact NZ-OE2 3.4Å; I739-E743 PolarHBondContact O-N 3.36Å; I739-E743 VanDerWaalsContact O-N 3.16Å; E743-D746 PolarHBondContact O-N 2.84Å; E743-Y747 WeakPolarHBondContact O-CB 3.43Å; E743-Y747 PolarHBondContact O-N 3.44Å
744	S	58.3	Low	51.2	Low	73 Å²	73	80.1 Å²	80.1	51%	0.51	40%	0.395	S	S	.	.	H	α-helix	trans	-67	-39.8	176.6	-59.3	0	0	0	0	111.8	E740 L741 Y742 Y747 E748	E740-S744 WeakPolarHBondContact O-CB 3.41Å; E740-S744 PolarHBondContact O-N 3.04Å; E740-S744 PolarHBondContact O-OG 2.91Å; L741-S744 WeakPolarHBondContact O-CB 3.33Å; L741-S744 PolarHBondContact O-N 3.12Å; Y742-S744 VanDerWaalsContact C-N 3.29Å; Y742-S744 PolarHBondContact O-N 3.27Å; S744-Y747 WeakPolarHBondContact O-CB 3.23Å; S744-Y747 PolarHBondContact O-N 3.07Å; S744-E748 PolarHBondContact O-N 3.32Å
745	Q	47.4	Very low	49.9	Very low	109 Å²	109	84.3 Å²	84.3	51%	0.509	42%	0.419	S	S	.	.	H	α-helix	trans	-65.1	-41.7	173.9	-70.8	177.3	-0.8	0	0	112.2	L741 Y742 Y747 E748 M749	L741-Q745 WeakPolarHBondContact O-CG 3.44Å; L741-Q745 PolarHBondContact O-N 3.1Å; Y742-Q745 PolarHBondContact O-N 3.18Å; Q745-Y747 VanDerWaalsContact C-N 3.26Å; Q745-Y747 PolarHBondContact O-N 2.96Å; Q745-E748 PolarHBondContact O-N 2.9Å; Q745-M749 WeakPolarHBondContact O-CB 3.38Å; Q745-M749 PolarHBondContact O-N 3.14Å
746	D	43.8	Very low	49.1	Very low	50 Å²	50	88.6 Å²	88.6	27%	0.267	44%	0.442	S	S	.	.	H	α-helix	trans	-64.4	-32.1	173.8	-172.5	29.9	0	0	0	111.4	Y742 E743 K750	Y742-D746 PolarHBondContact O-N 3.46Å; E743-D746 PolarHBondContact O-N 2.84Å; D746-K750 WeakPolarHBondContact O-CB 3.44Å; D746-K750 WeakPolarHBondContact O-CD 3.48Å; D746-K750 WeakPolarHBondContact O-CG 3.36Å; D746-K750 PolarHBondContact O-N 3.31Å; D746-K750 WeakPolarHBondContact OD1-CE 3.23Å; D746-K750 IonicContact OD1-NZ 3.12Å; D746-K750 PolarHBondContact OD1-NZ 2.97Å; D746-K750 VanDerWaalsContact OD1-NZ 3.12Å; D746-K750 IonicContact OD2-NZ 2.61Å; D746-K750 PolarHBondContact OD2-NZ 2.78Å
747	Y	41.1	Very low	47.7	Very low	139 Å²	139	96.2 Å²	96.2	55%	0.545	47%	0.474	S	S	.	.	H	α-helix	trans	-72.9	-38.6	173.1	-150.4	-89.3	0	0	0	113.3	E743 S744 Q745 K750 T751	E743-Y747 WeakPolarHBondContact O-CB 3.43Å; E743-Y747 PolarHBondContact O-N 3.44Å; S744-Y747 WeakPolarHBondContact O-CB 3.23Å; S744-Y747 PolarHBondContact O-N 3.07Å; Q745-Y747 VanDerWaalsContact C-N 3.26Å; Q745-Y747 PolarHBondContact O-N 2.96Å; Y747-K750 PolarHBondContact O-N 3.49Å; Y747-T751 HydrophobicContact CD1-CG2 3.75Å; Y747-T751 HydrophobicContact CE1-CG2 3.64Å; Y747-T751 WeakPolarHBondContact O-CB 3.49Å; Y747-T751 WeakPolarHBondContact O-CG2 3.04Å; Y747-T751 PolarHBondContact O-N 2.93Å; Y747-T751 PolarHBondContact O-OG1 3.08Å
748	E	39.6	Very low	45.9	Very low	137 Å²	137	97.7 Å²	97.7	64%	0.64	49%	0.488	S	S	*	.	H	α-helix	trans	-63.5	-42.4	171.3	-82.3	-165	137.1	0	0	111.6	S744 Q745 K750 T751 T752	S744-E748 PolarHBondContact O-N 3.32Å; Q745-E748 PolarHBondContact O-N 2.9Å; E748-K750 VanDerWaalsContact C-N 3.29Å; E748-K750 PolarHBondContact O-N 3.42Å; E748-T751 WeakPolarHBondContact CA-OG1 3.18Å; E748-T751 PolarHBondContact O-N 3.46Å; E748-T751 PolarHBondContact O-OG1 2.86Å; E748-T752 WeakPolarHBondContact O-CB 3.27Å; E748-T752 WeakPolarHBondContact O-CG2 3.34Å; E748-T752 PolarHBondContact O-N 3.11Å; E748-T752 PolarHBondContact O-OG1 3.27Å
749	M	39.7	Very low	44.4	Very low	89 Å²	89	102.8 Å²	102.8	44%	0.438	51%	0.514	S	S	.	.	H	α-helix	trans	-66.4	-30.3	175.5	-164.9	168.3	64.2	0	0	112.3	Q745 T752 N753 T765	Q745-M749 WeakPolarHBondContact O-CB 3.38Å; Q745-M749 PolarHBondContact O-N 3.14Å; M749-T752 PolarHBondContact O-OG1 2.92Å; M749-N753 PolarHBondContact O-ND2 3.18Å; M749-T765 HydrophobicContact CE-CG2 3.95Å
750	K	39.1	Very low	43.4	Very low	107 Å²	107	108 Å²	108	47%	0.465	54%	0.541	S	S	.	.	H	α-helix	trans	-77.9	-34.1	173.6	-76.5	164.3	-176.7	165.3	0	113.5	D746 Y747 E748 Q754	D746-K750 WeakPolarHBondContact O-CB 3.44Å; D746-K750 WeakPolarHBondContact O-CD 3.48Å; D746-K750 WeakPolarHBondContact O-CG 3.36Å; D746-K750 PolarHBondContact O-N 3.31Å; D746-K750 WeakPolarHBondContact OD1-CE 3.23Å; D746-K750 IonicContact OD1-NZ 3.12Å; D746-K750 PolarHBondContact OD1-NZ 2.97Å; D746-K750 VanDerWaalsContact OD1-NZ 3.12Å; D746-K750 IonicContact OD2-NZ 2.61Å; D746-K750 PolarHBondContact OD2-NZ 2.78Å; Y747-K750 PolarHBondContact O-N 3.49Å; E748-K750 VanDerWaalsContact C-N 3.29Å; E748-K750 PolarHBondContact O-N 3.42Å; K750-Q754 WeakPolarHBondContact O-CG 3.45Å; K750-Q754 PolarHBondContact O-N 3.23Å; K750-Q754 VanDerWaalsContact O-N 3.11Å
751	T	43.6	Very low	42	Very low	56 Å²	56	111 Å²	111	34%	0.344	57%	0.565	S	S	.	*	H	α-helix	trans	-79.6	-38.8	-179.3	45.7	0	0	0	0	112.8	Y747 E748 N753 Q754	Y747-T751 HydrophobicContact CD1-CG2 3.75Å; Y747-T751 HydrophobicContact CE1-CG2 3.64Å; Y747-T751 WeakPolarHBondContact O-CB 3.49Å; Y747-T751 WeakPolarHBondContact O-CG2 3.04Å; Y747-T751 PolarHBondContact O-N 2.93Å; Y747-T751 PolarHBondContact O-OG1 3.08Å; E748-T751 WeakPolarHBondContact CA-OG1 3.18Å; E748-T751 PolarHBondContact O-N 3.46Å; E748-T751 PolarHBondContact O-OG1 2.86Å; T751-N753 VanDerWaalsContact C-N 3.31Å; T751-N753 PolarHBondContact O-N 3.29Å; T751-Q754 PolarHBondContact O-N 3.16Å; T751-Q754 VanDerWaalsContact O-N 3.16Å
752	T	41.7	Very low	40.3	Very low	86 Å²	86	112 Å²	112	53%	0.528	57%	0.57	S	S	.	*	H	α-helix	trans	-60.1	-39.1	170.3	46.9	0	0	0	0	112.2	E748 M749	E748-T752 WeakPolarHBondContact O-CB 3.27Å; E748-T752 WeakPolarHBondContact O-CG2 3.34Å; E748-T752 PolarHBondContact O-N 3.11Å; E748-T752 PolarHBondContact O-OG1 3.27Å; M749-T752 PolarHBondContact O-OG1 2.92Å
753	N	38.2	Very low	39.6	Very low	80 Å²	80	107.9 Å²	107.9	43%	0.428	56%	0.561	S	S	.	*	H	α-helix	trans	-74.7	-23.5	174.3	-78.2	-57.1	0	0	0	114.2	M749 T751 L755 N756	M749-N753 PolarHBondContact O-ND2 3.18Å; T751-N753 VanDerWaalsContact C-N 3.31Å; T751-N753 PolarHBondContact O-N 3.29Å; N753-L755 PolarHBondContact O-N 2.92Å; N753-N756 PolarHBondContact O-N 3.31Å; N753-N756 VanDerWaalsContact O-N 3.09Å
754	Q	36.3	Very low	39.1	Very low	109 Å²	109	108.5 Å²	108.5	51%	0.509	57%	0.567	S	S	.	*	H	α-helix	trans	-70.1	-14.9	176.6	-87.6	-173.4	55.9	0	0	114.5	K750 T751	K750-Q754 WeakPolarHBondContact O-CG 3.45Å; K750-Q754 PolarHBondContact O-N 3.23Å; K750-Q754 VanDerWaalsContact O-N 3.11Å; T751-Q754 PolarHBondContact O-N 3.16Å; T751-Q754 VanDerWaalsContact O-N 3.16Å
755	L	42.4	Very low	38.4	Very low	151 Å²	151	108 Å²	108	79%	0.791	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.9	-22.2	169.1	-83.9	132.1	0	0	0	112.9	N753 K757	N753-L755 PolarHBondContact O-N 2.92Å; L755-K757 VanDerWaalsContact C-N 3.29Å; L755-K757 PolarHBondContact O-N 3.44Å
756	N	40	Very low	38.1	Very low	129 Å²	129	105.2 Å²	105.2	69%	0.69	55%	0.552	S	S	*	*	S	Bend	trans	-92.1	50.9	176.7	-73	-27.1	0	0	0	111.9	N753 S758	N753-N756 PolarHBondContact O-N 3.31Å; N753-N756 VanDerWaalsContact O-N 3.09Å; N756-S758 VanDerWaalsContact C-N 3.31Å; N756-S758 PolarHBondContact O-N 3.25Å
757	K	31.5	Very low	38.2	Very low	168 Å²	168	107.5 Å²	107.5	73%	0.73	56%	0.561	S	S	*	*			trans	-80.8	56.1	-160.4	-144.2	170.5	-167.9	164	0	115.4	L755	L755-K757 VanDerWaalsContact C-N 3.29Å; L755-K757 PolarHBondContact O-N 3.44Å
758	S	27.4	Very low	38.5	Very low	108 Å²	108	103.4 Å²	103.4	76%	0.755	55%	0.548	S	S	*	.	S	Bend	trans	-153.6	51.3	171	72.9	0	0	0	0	116.1	N756	N756-S758 VanDerWaalsContact C-N 3.31Å; N756-S758 PolarHBondContact O-N 3.25Å
759	M	28.7	Very low	38.8	Very low	166 Å²	166	100.8 Å²	100.8	82%	0.818	54%	0.537	S	S	*	.	S	Bend	trans	-169	118.2	151.5	-113.7	173.6	145.3	0	0	113.3
760	I	33.6	Very low	38.9	Very low	133 Å²	133	99.7 Å²	99.7	68%	0.682	53%	0.533	S	S	*	.			trans	60.3	137.2	148.3	-54.6	171	0	0	0	117.9	I762	I760-I762 PolarHBondContact O-N 3.39Å; I760-I762 VanDerWaalsContact O-N 3.11Å
761	P	32.6	Very low	39.3	Very low	119 Å²	119	98.1 Å²	98.1	77%	0.773	53%	0.534	S	S	*	.			trans	-64.4	115.8	176.2	-17.2	31.1	0	0	0	111.5	P763	P761-P763 VanDerWaalsContact O-CD 3.26Å; P761-P763 WeakPolarHBondContact O-CD 3.49Å
762	I	31.1	Very low	39.9	Very low	112 Å²	112	101 Å²	101	57%	0.574	54%	0.544	S	S	*	.			trans	-64.3	114.7	177	-68.5	176.8	0	0	0	108.8	I760 I768	I760-I762 PolarHBondContact O-N 3.39Å; I760-I762 VanDerWaalsContact O-N 3.11Å; I762-I768 HydrophobicContact CB-CD1 4.31Å; I762-I768 HydrophobicContact CG2-CD1 3.41Å; I762-I768 VanDerWaalsContact CG2-CD1 3.41Å
763	P	37.6	Very low	40.2	Very low	65 Å²	65	99.6 Å²	99.6	42%	0.422	53%	0.533	S	S	.	.			trans	-61.9	156.8	168.6	-19.8	33.4	0	0	0	110.5	P761 T765 Q767 I768	P761-P763 VanDerWaalsContact O-CD 3.26Å; P761-P763 WeakPolarHBondContact O-CD 3.49Å; P763-T765 PolarHBondContact O-N 3.35Å; P763-Q767 HydrophobicContact CB-CB 4.12Å; P763-I768 HydrophobicContact CB-CG1 4.38Å; P763-I768 HydrophobicContact CG-CG1 4.46Å; P763-I768 WeakPolarHBondContact O-CD1 3.38Å
764	D	47.4	Very low	40.9	Very low	93 Å²	93	100.2 Å²	100.2	50%	0.497	54%	0.536	S	S	.	.			trans	-33.4	127.7	172.3	-170.1	-5.1	0	0	0	111.1	T766 Q767 I768	D764-T766 CarbonylContact O-C 3.38Å; D764-T766 PolarHBondContact O-N 3.1Å; D764-Q767 HydrophobicContact CB-CG 4.34Å; D764-Q767 WeakPolarHBondContact O-CA 3.15Å; D764-Q767 WeakPolarHBondContact O-CB 3.2Å; D764-Q767 PolarHBondContact O-N 3.38Å; D764-I768 PolarHBondContact O-N 2.6Å
765	T	43	Very low	41.8	Very low	63 Å²	63	99.1 Å²	99.1	39%	0.387	53%	0.533	S	S	.	.	H	α-helix	trans	-55.1	-30.9	-168.2	25.3	0	0	0	0	112.2	M749 P763 Q767 I768 I769	M749-T765 HydrophobicContact CE-CG2 3.95Å; P763-T765 PolarHBondContact O-N 3.35Å; T765-Q767 PolarHBondContact O-N 2.69Å; T765-I768 PolarHBondContact O-N 2.67Å; T765-I769 VanDerWaalsContact O-CG1 3.32Å; T765-I769 WeakPolarHBondContact O-CG1 3.37Å; T765-I769 PolarHBondContact O-N 3Å
766	T	41.9	Very low	42.3	Very low	50 Å²	50	97.5 Å²	97.5	31%	0.307	52%	0.52	S	S	.	.	H	α-helix	trans	-59.2	-40	171.3	-39.3	0	0	0	0	113.4	L671 D764 L770	L671-T766 HydrophobicContact CD1-CG2 4.04Å; D764-T766 CarbonylContact O-C 3.38Å; D764-T766 PolarHBondContact O-N 3.1Å; T766-L770 WeakPolarHBondContact O-CB 3.49Å; T766-L770 PolarHBondContact O-N 2.89Å
767	Q	45	Very low	42.6	Very low	98 Å²	98	95 Å²	95	46%	0.458	50%	0.504	S	S	.	.	H	α-helix	trans	-70.9	-38.2	175.2	-70.1	-173.5	4	0	0	112.4	P763 D764 T765 L770 C771	P763-Q767 HydrophobicContact CB-CB 4.12Å; D764-Q767 HydrophobicContact CB-CG 4.34Å; D764-Q767 WeakPolarHBondContact O-CA 3.15Å; D764-Q767 WeakPolarHBondContact O-CB 3.2Å; D764-Q767 PolarHBondContact O-N 3.38Å; T765-Q767 PolarHBondContact O-N 2.69Å; Q767-L770 PolarHBondContact O-N 3.49Å; Q767-C771 WeakPolarHBondContact O-CB 3.45Å; Q767-C771 PolarHBondContact O-N 3.12Å; Q767-C771 PolarHBondContact O-SG 2.86Å
768	I	47.9	Very low	43.6	Very low	52 Å²	52	94.7 Å²	94.7	27%	0.267	50%	0.498	S	S	.	.	H	α-helix	trans	-63.8	-48	175.7	-66.2	177.2	0	0	0	110	I762 P763 D764 T765 L770 C771 E772	I762-I768 HydrophobicContact CB-CD1 4.31Å; I762-I768 HydrophobicContact CG2-CD1 3.41Å; I762-I768 VanDerWaalsContact CG2-CD1 3.41Å; P763-I768 HydrophobicContact CB-CG1 4.38Å; P763-I768 HydrophobicContact CG-CG1 4.46Å; P763-I768 WeakPolarHBondContact O-CD1 3.38Å; D764-I768 PolarHBondContact O-N 2.6Å; T765-I768 PolarHBondContact O-N 2.67Å; I768-L770 VanDerWaalsContact C-N 3.29Å; I768-L770 PolarHBondContact O-N 3.1Å; I768-C771 PolarHBondContact O-N 3.15Å; I768-C771 VanDerWaalsContact O-N 3.14Å; I768-E772 HydrophobicContact CG2-CG 4.43Å; I768-E772 PolarHBondContact O-N 3.22Å
769	I	45.6	Very low	44.9	Very low	82 Å²	82	96 Å²	96	42%	0.421	49%	0.492	S	S	.	.	H	α-helix	trans	-58.5	-42.3	175.1	-67.2	165.3	0	0	0	110.4	T765 L773	T765-I769 VanDerWaalsContact O-CG1 3.32Å; T765-I769 WeakPolarHBondContact O-CG1 3.37Å; T765-I769 PolarHBondContact O-N 3Å; I769-L773 HydrophobicContact CG2-CD1 3.78Å; I769-L773 HydrophobicContact CG2-CG 4.32Å; I769-L773 VanDerWaalsContact O-CB 3.27Å; I769-L773 WeakPolarHBondContact O-CB 3.41Å; I769-L773 WeakPolarHBondContact O-CG 3.39Å; I769-L773 PolarHBondContact O-N 2.9Å
770	L	43	Very low	45.9	Very low	67 Å²	67	92.3 Å²	92.3	35%	0.351	48%	0.475	S	S	.	.	H	α-helix	trans	-62.1	-43.9	174.9	-121.1	80.7	0	0	0	112.7	T766 Q767 I768 L773 I774	T766-L770 WeakPolarHBondContact O-CB 3.49Å; T766-L770 PolarHBondContact O-N 2.89Å; Q767-L770 PolarHBondContact O-N 3.49Å; I768-L770 VanDerWaalsContact C-N 3.29Å; I768-L770 PolarHBondContact O-N 3.1Å; L770-L773 PolarHBondContact O-N 2.99Å; L770-I774 WeakPolarHBondContact O-CB 3.37Å; L770-I774 WeakPolarHBondContact O-CD1 3.43Å; L770-I774 WeakPolarHBondContact O-CG1 3.37Å; L770-I774 PolarHBondContact O-N 3.45Å
771	C	46	Very low	46.6	Very low	73 Å²	73	90.6 Å²	90.6	49%	0.493	47%	0.467	S	S	.	.	H	α-helix	trans	-65.9	-47	179.3	-71.3	0	0	0	0	111.5	Q767 I768 L773 I774 D775	Q767-C771 WeakPolarHBondContact O-CB 3.45Å; Q767-C771 PolarHBondContact O-N 3.12Å; Q767-C771 PolarHBondContact O-SG 2.86Å; I768-C771 PolarHBondContact O-N 3.15Å; I768-C771 VanDerWaalsContact O-N 3.14Å; C771-L773 VanDerWaalsContact C-N 3.3Å; C771-L773 PolarHBondContact O-N 3.07Å; C771-I774 PolarHBondContact O-N 3.37Å; C771-D775 PolarHBondContact O-N 3.46Å
772	E	57.7	Low	47.6	Very low	116 Å²	116	91.1 Å²	91.1	54%	0.542	46%	0.463	S	S	.	.	H	α-helix	trans	-61.7	-36.9	175.3	-73.8	-165.8	177.1	0	0	112.5	I768 K776	I768-E772 HydrophobicContact CG2-CG 4.43Å; I768-E772 PolarHBondContact O-N 3.22Å; E772-K776 VanDerWaalsContact O-CB 3.31Å; E772-K776 WeakPolarHBondContact O-CB 3.41Å; E772-K776 WeakPolarHBondContact O-CG 3.33Å; E772-K776 PolarHBondContact O-N 2.86Å
773	L	47	Very low	48.4	Very low	57 Å²	57	92.3 Å²	92.3	30%	0.298	47%	0.467	S	S	.	.	H	α-helix	trans	-69.8	-37.8	175.1	-72.9	174.5	0	0	0	112.1	I769 L770 C771 E777 C795	I769-L773 HydrophobicContact CG2-CD1 3.78Å; I769-L773 HydrophobicContact CG2-CG 4.32Å; I769-L773 VanDerWaalsContact O-CB 3.27Å; I769-L773 WeakPolarHBondContact O-CB 3.41Å; I769-L773 WeakPolarHBondContact O-CG 3.39Å; I769-L773 PolarHBondContact O-N 2.9Å; L770-L773 PolarHBondContact O-N 2.99Å; C771-L773 VanDerWaalsContact C-N 3.3Å; C771-L773 PolarHBondContact O-N 3.07Å; L773-E777 VanDerWaalsContact O-CB 3.24Å; L773-E777 WeakPolarHBondContact O-CB 3.35Å; L773-E777 PolarHBondContact O-N 3.35Å; L773-C795 VanDerWaalsContact CD2-SG 3.54Å
774	I	53.7	Low	48.6	Very low	94 Å²	94	99 Å²	99	48%	0.482	49%	0.49	S	S	.	.	H	α-helix	trans	-68.1	-40	174.5	-71.5	163.6	0	0	0	111	L770 C771 E777 R778	L770-I774 WeakPolarHBondContact O-CB 3.37Å; L770-I774 WeakPolarHBondContact O-CD1 3.43Å; L770-I774 WeakPolarHBondContact O-CG1 3.37Å; L770-I774 PolarHBondContact O-N 3.45Å; C771-I774 PolarHBondContact O-N 3.37Å; I774-E777 PolarHBondContact O-N 3.08Å; I774-R778 VanDerWaalsContact O-CB 3.3Å; I774-R778 WeakPolarHBondContact O-CB 3.4Å; I774-R778 PolarHBondContact O-N 3.08Å
775	D	54.3	Low	48.3	Very low	86 Å²	86	98.9 Å²	98.9	46%	0.46	50%	0.496	S	S	.	.	H	α-helix	trans	-71	-38.7	176.6	-83	-40	0	0	0	111.8	C771 R778 E779	C771-D775 PolarHBondContact O-N 3.46Å; D775-R778 WeakPolarHBondContact O-CB 3.47Å; D775-R778 PolarHBondContact O-N 3.38Å; D775-R778 IonicContact OD1-NH1 3.97Å; D775-E779 PolarHBondContact O-N 2.9Å
776	K	52.7	Low	48.2	Very low	117 Å²	117	103.8 Å²	103.8	51%	0.509	52%	0.519	S	S	.	.	H	α-helix	trans	-65.8	-39.3	169.6	-81.6	-176.7	175	169.2	0	112.6	E772 R778 E779 L780	E772-K776 VanDerWaalsContact O-CB 3.31Å; E772-K776 WeakPolarHBondContact O-CB 3.41Å; E772-K776 WeakPolarHBondContact O-CG 3.33Å; E772-K776 PolarHBondContact O-N 2.86Å; K776-R778 VanDerWaalsContact C-N 3.27Å; K776-R778 PolarHBondContact O-N 3.27Å; K776-E779 PolarHBondContact O-N 2.91Å; K776-L780 VanDerWaalsContact O-CB 3.27Å; K776-L780 WeakPolarHBondContact O-CB 3.16Å; K776-L780 WeakPolarHBondContact O-CD1 3.23Å; K776-L780 VanDerWaalsContact O-CG 3.24Å; K776-L780 WeakPolarHBondContact O-CG 3.24Å; K776-L780 PolarHBondContact O-N 2.94Å
777	E	47	Very low	48.3	Very low	75 Å²	75	105.2 Å²	105.2	35%	0.35	53%	0.529	S	S	.	.	H	α-helix	trans	-60.4	-41.5	172	-171.9	-177.6	-172.3	0	0	109.8	L773 I774 L780 L781	L773-E777 VanDerWaalsContact O-CB 3.24Å; L773-E777 WeakPolarHBondContact O-CB 3.35Å; L773-E777 PolarHBondContact O-N 3.35Å; I774-E777 PolarHBondContact O-N 3.08Å; E777-L780 PolarHBondContact O-N 3.41Å; E777-L781 HydrophobicContact CG-CD1 3.85Å; E777-L781 HydrophobicContact CG-CG 4.24Å; E777-L781 VanDerWaalsContact O-CB 3.24Å; E777-L781 WeakPolarHBondContact O-CB 3.4Å; E777-L781 WeakPolarHBondContact O-CG 3.44Å; E777-L781 PolarHBondContact O-N 2.91Å
778	R	52.2	Low	48.2	Very low	163 Å²	163	103 Å²	103	62%	0.615	52%	0.522	S	S	*	.	H	α-helix	trans	-65.6	-40.1	176.3	-179.5	173.6	167.9	-106.9	-8	113.3	I774 D775 K776 L782	I774-R778 VanDerWaalsContact O-CB 3.3Å; I774-R778 WeakPolarHBondContact O-CB 3.4Å; I774-R778 PolarHBondContact O-N 3.08Å; D775-R778 WeakPolarHBondContact O-CB 3.47Å; D775-R778 PolarHBondContact O-N 3.38Å; D775-R778 IonicContact OD1-NH1 3.97Å; K776-R778 VanDerWaalsContact C-N 3.27Å; K776-R778 PolarHBondContact O-N 3.27Å; R778-L782 WeakPolarHBondContact O-CG 3.33Å; R778-L782 PolarHBondContact O-N 3.46Å
779	E	54.4	Low	47.9	Very low	136 Å²	136	105 Å²	105	64%	0.636	53%	0.534	S	S	*	.	H	α-helix	trans	-66.5	-41.6	172.3	-73.7	-163.2	142.3	0	0	112.2	D775 K776 L782 M783	D775-E779 PolarHBondContact O-N 2.9Å; K776-E779 PolarHBondContact O-N 2.91Å; E779-L782 WeakPolarHBondContact O-CB 3.5Å; E779-L782 PolarHBondContact O-N 3.05Å; E779-M783 PolarHBondContact O-N 3.49Å; E779-M783 VanDerWaalsContact O-N 3.16Å
780	L	49.6	Very low	48.2	Very low	87 Å²	87	104.7 Å²	104.7	46%	0.455	54%	0.538	S	S	.	.	H	α-helix	trans	-72.3	-29.7	178.5	-70.6	163.6	0	0	0	112.3	K776 E777 L782 M783 L791	K776-L780 VanDerWaalsContact O-CB 3.27Å; K776-L780 WeakPolarHBondContact O-CB 3.16Å; K776-L780 WeakPolarHBondContact O-CD1 3.23Å; K776-L780 VanDerWaalsContact O-CG 3.24Å; K776-L780 WeakPolarHBondContact O-CG 3.24Å; K776-L780 PolarHBondContact O-N 2.94Å; E777-L780 PolarHBondContact O-N 3.41Å; L780-L782 VanDerWaalsContact C-N 3.3Å; L780-M783 CarbonylContact O-C 3.41Å; L780-M783 PolarHBondContact O-N 3.29Å; L780-L791 HydrophobicContact CD1-CD1 3.7Å; L780-L791 HydrophobicContact CD1-CD2 4Å; L780-L791 HydrophobicContact CD1-CG 4.5Å
781	L	48.2	Very low	48.4	Very low	97 Å²	97	105.4 Å²	105.4	51%	0.508	54%	0.542	S	S	.	.	H	α-helix	trans	-71.8	-22.8	170.9	-74.6	170.1	0	0	0	112.8	E777	E777-L781 HydrophobicContact CG-CD1 3.85Å; E777-L781 HydrophobicContact CG-CG 4.24Å; E777-L781 VanDerWaalsContact O-CB 3.24Å; E777-L781 WeakPolarHBondContact O-CB 3.4Å; E777-L781 WeakPolarHBondContact O-CG 3.44Å; E777-L781 PolarHBondContact O-N 2.91Å
782	L	54.3	Low	48.5	Very low	131 Å²	131	104.4 Å²	104.4	69%	0.686	53%	0.531	S	S	*	.	H	α-helix	trans	-74.9	-32	168.1	-74.8	161.2	0	0	0	111.6	R778 E779 L780 K784	R778-L782 WeakPolarHBondContact O-CG 3.33Å; R778-L782 PolarHBondContact O-N 3.46Å; E779-L782 WeakPolarHBondContact O-CB 3.5Å; E779-L782 PolarHBondContact O-N 3.05Å; L780-L782 VanDerWaalsContact C-N 3.3Å; L782-K784 PolarHBondContact O-N 3.05Å
783	M	49.2	Very low	48.1	Very low	136 Å²	136	104 Å²	104	67%	0.67	53%	0.529	S	S	*	.	S	Bend	trans	-83.4	87	173.2	-65.3	-69.8	-176.9	0	0	111.1	E779 L780 S785	E779-M783 PolarHBondContact O-N 3.49Å; E779-M783 VanDerWaalsContact O-N 3.16Å; L780-M783 CarbonylContact O-C 3.41Å; L780-M783 PolarHBondContact O-N 3.29Å; M783-S785 VanDerWaalsContact C-N 3.25Å; M783-S785 PolarHBondContact O-N 2.86Å
784	K	40.9	Very low	48.3	Very low	206 Å²	206	105.8 Å²	105.8	90%	0.896	54%	0.537	S	S	*	.			trans	-62.8	62	-174.5	-67.8	-175.9	173.7	-179.3	0	116.3	L782	L782-K784 PolarHBondContact O-N 3.05Å
785	S	41.4	Very low	47.9	Very low	90 Å²	90	102.8 Å²	102.8	63%	0.629	53%	0.525	S	S	*	.			trans	-157.7	124.6	173.6	58.3	0	0	0	0	113.8	M783	M783-S785 VanDerWaalsContact C-N 3.25Å; M783-S785 PolarHBondContact O-N 2.86Å
786	L	40.6	Very low	47.9	Very low	167 Å²	167	101 Å²	101	87%	0.874	51%	0.513	S	S	*	.	S	Bend	trans	76.6	155.3	162.4	-85.5	69.5	0	0	0	117.4
787	P	43.8	Very low	47.7	Very low	80 Å²	80	101.9 Å²	101.9	52%	0.519	52%	0.518	S	S	.	.			trans	-87.2	139.5	-140.4	31.7	-36.1	0	0	0	114.7	L789 S790	P787-L789 PolarHBondContact O-N 3.43Å; P787-S790 PolarHBondContact O-N 3.14Å; P787-S790 VanDerWaalsContact O-N 3.12Å
788	T	42.7	Very low	47.7	Very low	50 Å²	50	102.6 Å²	102.6	31%	0.307	52%	0.523	S	S	.	.	H	α-helix	trans	-52.7	-22.5	174.6	46.2	0	0	0	0	114.5	S790 M792	T788-S790 PolarHBondContact O-N 2.79Å; T788-M792 WeakPolarHBondContact O-CB 3.4Å; T788-M792 PolarHBondContact O-N 3.05Å
789	L	42.4	Very low	47.6	Very low	96 Å²	96	99.6 Å²	99.6	50%	0.503	52%	0.519	S	S	.	.	H	α-helix	trans	-59.4	-37.5	174.9	-102	74.8	0	0	0	113.7	P787 M792 H793	P787-L789 PolarHBondContact O-N 3.43Å; L789-M792 PolarHBondContact O-N 2.79Å; L789-H793 WeakPolarHBondContact O-CB 3.02Å; L789-H793 PolarHBondContact O-CD2 3.3Å; L789-H793 PolarHBondContact O-N 3.31Å
790	S	50.7	Low	47.5	Very low	74 Å²	74	96.1 Å²	96.1	52%	0.517	50%	0.504	S	S	.	.	H	α-helix	trans	-70.2	-44.5	-173.1	-80	0	0	0	0	112.8	P787 T788 H793 I794	P787-S790 PolarHBondContact O-N 3.14Å; P787-S790 VanDerWaalsContact O-N 3.12Å; T788-S790 PolarHBondContact O-N 2.79Å; S790-H793 PolarHBondContact O-N 3.47Å; S790-I794 WeakPolarHBondContact O-CD1 3.39Å; S790-I794 VanDerWaalsContact O-CG1 3.27Å; S790-I794 WeakPolarHBondContact O-CG1 3.24Å; S790-I794 PolarHBondContact O-N 3.29Å
791	L	47.1	Very low	47.3	Very low	83 Å²	83	96 Å²	96	44%	0.435	50%	0.501	S	S	.	.	H	α-helix	trans	-69.5	-36	173.9	-89.4	115.5	0	0	0	112.1	L780 H793 I794 C795	L780-L791 HydrophobicContact CD1-CD1 3.7Å; L780-L791 HydrophobicContact CD1-CD2 4Å; L780-L791 HydrophobicContact CD1-CG 4.5Å; L791-H793 PolarHBondContact O-N 3.08Å; L791-I794 PolarHBondContact O-N 3.46Å; L791-C795 WeakPolarHBondContact O-CB 3.42Å; L791-C795 PolarHBondContact O-N 3.11Å; L791-C795 PolarHBondContact O-SG 3.05Å
792	M	48.8	Very low	47.3	Very low	52 Å²	52	98.1 Å²	98.1	26%	0.256	51%	0.508	S	S	.	.	H	α-helix	trans	-59.4	-45.3	171.7	-94.5	-158.2	60.3	0	0	112.3	M663 T788 L789 I794 C795 Q796	M663-M792 HydrophobicContact CE-CE 3.72Å; M663-M792 HydrophobicContact CE-SD 4.26Å; M663-M792 HydrophobicContact CG-CE 4.18Å; M663-M792 HydrophobicContact CG-SD 4.01Å; M663-M792 HydrophobicContact SD-CE 3.69Å; M663-M792 HydrophobicContact SD-SD 4.31Å; T788-M792 WeakPolarHBondContact O-CB 3.4Å; T788-M792 PolarHBondContact O-N 3.05Å; L789-M792 PolarHBondContact O-N 2.79Å; M792-I794 VanDerWaalsContact C-N 3.35Å; M792-I794 PolarHBondContact O-N 3.4Å; M792-C795 PolarHBondContact O-N 3.26Å; M792-Q796 WeakPolarHBondContact O-CB 3.47Å; M792-Q796 PolarHBondContact O-N 3.41Å
793	H	49.7	Very low	46.9	Very low	107 Å²	107	96.1 Å²	96.1	50%	0.495	49%	0.494	S	S	.	.	H	α-helix	trans	-61.5	-42.1	174.2	-91.9	-120	0	0	0	111.5	L789 S790 L791 Q796 F797	L789-H793 WeakPolarHBondContact O-CB 3.02Å; L789-H793 PolarHBondContact O-CD2 3.3Å; L789-H793 PolarHBondContact O-N 3.31Å; S790-H793 PolarHBondContact O-N 3.47Å; L791-H793 PolarHBondContact O-N 3.08Å; H793-Q796 PolarHBondContact O-N 3.33Å; H793-F797 WeakPolarHBondContact O-CB 3.31Å; H793-F797 PolarHBondContact O-N 3.49Å
794	I	51.6	Low	46.9	Very low	94 Å²	94	92 Å²	92	48%	0.482	48%	0.477	S	S	.	.	H	α-helix	trans	-64.8	-45.2	177.4	-68.8	162.1	0	0	0	111.3	S790 L791 M792 F797 I798	S790-I794 WeakPolarHBondContact O-CD1 3.39Å; S790-I794 VanDerWaalsContact O-CG1 3.27Å; S790-I794 WeakPolarHBondContact O-CG1 3.24Å; S790-I794 PolarHBondContact O-N 3.29Å; L791-I794 PolarHBondContact O-N 3.46Å; M792-I794 VanDerWaalsContact C-N 3.35Å; M792-I794 PolarHBondContact O-N 3.4Å; I794-F797 PolarHBondContact O-N 2.66Å; I794-I798 HydrophobicContact CG2-CD1 3.65Å; I794-I798 HydrophobicContact CG2-CG1 4.4Å; I794-I798 WeakPolarHBondContact O-CB 3.43Å; I794-I798 VanDerWaalsContact O-CG1 3.27Å; I794-I798 WeakPolarHBondContact O-CG1 3.46Å; I794-I798 PolarHBondContact O-N 3.31Å
795	C	45.3	Very low	47	Very low	32 Å²	32	85.9 Å²	85.9	22%	0.216	45%	0.454	C	S	.	.	H	α-helix	trans	-66.2	-39.5	177	-68.1	0	0	0	0	112.1	L773 L791 M792 L799	L773-C795 VanDerWaalsContact CD2-SG 3.54Å; L791-C795 WeakPolarHBondContact O-CB 3.42Å; L791-C795 PolarHBondContact O-N 3.11Å; L791-C795 PolarHBondContact O-SG 3.05Å; M792-C795 PolarHBondContact O-N 3.26Å; C795-L799 VanDerWaalsContact O-CB 3.24Å; C795-L799 WeakPolarHBondContact O-CB 3.17Å; C795-L799 WeakPolarHBondContact O-CG 3.26Å; C795-L799 PolarHBondContact O-N 2.88Å
796	Q	53.6	Low	47.4	Very low	48 Å²	48	83.2 Å²	83.2	22%	0.224	44%	0.44	C	S	.	.	H	α-helix	trans	-68.1	-35.9	174.6	-174.9	168.1	-13.5	0	0	111.3	M792 H793 L800	M792-Q796 WeakPolarHBondContact O-CB 3.47Å; M792-Q796 PolarHBondContact O-N 3.41Å; H793-Q796 PolarHBondContact O-N 3.33Å; Q796-L800 HydrophobicContact CG-CD1 3.67Å; Q796-L800 VanDerWaalsContact O-CB 3.28Å; Q796-L800 WeakPolarHBondContact O-CB 3.26Å; Q796-L800 WeakPolarHBondContact O-CD1 3.29Å; Q796-L800 PolarHBondContact O-N 3.48Å
797	F	47.5	Very low	47.6	Very low	136 Å²	136	77.1 Å²	77.1	60%	0.596	41%	0.409	S	S	*	.	H	α-helix	trans	-69.7	-45.2	174.8	-152.4	-83.2	0	0	0	111.1	H793 I794 E801	H793-F797 WeakPolarHBondContact O-CB 3.31Å; H793-F797 PolarHBondContact O-N 3.49Å; I794-F797 PolarHBondContact O-N 2.66Å; F797-E801 HydrophobicContact CD1-CB 4.34Å; F797-E801 WeakPolarHBondContact O-CA 3.25Å; F797-E801 WeakPolarHBondContact O-CB 3.42Å; F797-E801 PolarHBondContact O-N 3.45Å
798	I	48.8	Very low	47.7	Very low	90 Å²	90	77.9 Å²	77.9	46%	0.462	41%	0.408	S	S	.	.	H	α-helix	trans	-66.1	-43.2	177.7	-67.2	166.6	0	0	0	111.3	I794 Q802	I794-I798 HydrophobicContact CG2-CD1 3.65Å; I794-I798 HydrophobicContact CG2-CG1 4.4Å; I794-I798 WeakPolarHBondContact O-CB 3.43Å; I794-I798 VanDerWaalsContact O-CG1 3.27Å; I794-I798 WeakPolarHBondContact O-CG1 3.46Å; I794-I798 PolarHBondContact O-N 3.31Å; I798-Q802 HydrophobicContact CG2-CG 4.35Å; I798-Q802 WeakPolarHBondContact O-CB 3.4Å; I798-Q802 VanDerWaalsContact O-CG 3.23Å; I798-Q802 WeakPolarHBondContact O-CG 3.44Å; I798-Q802 PolarHBondContact O-N 2.75Å
799	L	49.5	Very low	47.7	Very low	100 Å²	100	80.6 Å²	80.6	52%	0.524	42%	0.42	S	S	.	.	H	α-helix	trans	-74.5	-34.6	179.5	-73.8	166.9	0	0	0	112.9	C795 F803	C795-L799 VanDerWaalsContact O-CB 3.24Å; C795-L799 WeakPolarHBondContact O-CB 3.17Å; C795-L799 WeakPolarHBondContact O-CG 3.26Å; C795-L799 PolarHBondContact O-N 2.88Å; L799-F803 WeakPolarHBondContact O-CB 3.35Å; L799-F803 PolarHBondContact O-N 3.01Å
800	L	51.1	Low	47.7	Very low	62 Å²	62	78.6 Å²	78.6	33%	0.325	41%	0.409	S	S	.	.	H	α-helix	trans	-65.8	-61.5	165.1	-92.6	85.5	0	0	0	109	Q796 Q802 F803 T804	Q796-L800 HydrophobicContact CG-CD1 3.67Å; Q796-L800 VanDerWaalsContact O-CB 3.28Å; Q796-L800 WeakPolarHBondContact O-CB 3.26Å; Q796-L800 WeakPolarHBondContact O-CD1 3.29Å; Q796-L800 PolarHBondContact O-N 3.48Å; L800-Q802 VanDerWaalsContact C-N 3.33Å; L800-Q802 PolarHBondContact O-N 3.45Å; L800-Q802 VanDerWaalsContact O-N 3.14Å; L800-F803 CarbonylContact O-C 3.5Å; L800-F803 PolarHBondContact O-N 3.46Å; L800-T804 HydrophobicContact CB-CG2 4.09Å; L800-T804 HydrophobicContact CD2-CG2 4.28Å; L800-T804 HydrophobicContact CG-CG2 4.15Å; L800-T804 WeakPolarHBondContact O-CA 3.49Å; L800-T804 WeakPolarHBondContact O-CB 3.38Å; L800-T804 WeakPolarHBondContact O-CG2 3.24Å; L800-T804 PolarHBondContact O-N 3.2Å; L800-T804 PolarHBondContact O-OG1 3.03Å
801	E	45.3	Very low	47.2	Very low	86 Å²	86	80.2 Å²	80.2	40%	0.402	41%	0.412	S	S	.	.	H	α-helix	trans	-52.1	-43.7	-172.7	-172.8	170	-147.3	0	0	113.6	F797 N805	F797-E801 HydrophobicContact CD1-CB 4.34Å; F797-E801 WeakPolarHBondContact O-CA 3.25Å; F797-E801 WeakPolarHBondContact O-CB 3.42Å; F797-E801 PolarHBondContact O-N 3.45Å; E801-N805 WeakPolarHBondContact CG-ND2 3.31Å; E801-N805 WeakPolarHBondContact O-CA 3.44Å; E801-N805 WeakPolarHBondContact O-CB 3.37Å; E801-N805 PolarHBondContact O-N 3.49Å; E801-N805 PolarHBondContact O-ND2 3.48Å; E801-N805 VanDerWaalsContact O-ND2 3.1Å
802	Q	48.2	Very low	46.8	Very low	141 Å²	141	80.6 Å²	80.6	66%	0.659	42%	0.421	S	S	*	.	H	α-helix	trans	-65.9	-46.3	174.7	-67	-68.9	-41.3	0	0	112.3	I798 L800 G806	I798-Q802 HydrophobicContact CG2-CG 4.35Å; I798-Q802 WeakPolarHBondContact O-CB 3.4Å; I798-Q802 VanDerWaalsContact O-CG 3.23Å; I798-Q802 WeakPolarHBondContact O-CG 3.44Å; I798-Q802 PolarHBondContact O-N 2.75Å; L800-Q802 VanDerWaalsContact C-N 3.33Å; L800-Q802 PolarHBondContact O-N 3.45Å; L800-Q802 VanDerWaalsContact O-N 3.14Å; Q802-G806 PolarHBondContact O-N 3.4Å
803	F	46.1	Very low	46.1	Very low	88 Å²	88	81.4 Å²	81.4	39%	0.386	43%	0.432	S	S	.	.	H	α-helix	trans	-82.5	-27.2	-174.4	-142.4	-88.7	0	0	0	113.3	W637 M674 L799 L800 L807	W637-F803 HydrophobicContact CH2-CD1 4.14Å; M674-F803 HydrophobicContact CE-CD2 4.24Å; M674-F803 HydrophobicContact CE-CE2 3.58Å; M674-F803 HydrophobicContact CE-CZ 3.8Å; L799-F803 WeakPolarHBondContact O-CB 3.35Å; L799-F803 PolarHBondContact O-N 3.01Å; L800-F803 CarbonylContact O-C 3.5Å; L800-F803 PolarHBondContact O-N 3.46Å; F803-L807 WeakPolarHBondContact O-CB 3.49Å; F803-L807 PolarHBondContact O-N 3.19Å
804	T	49.5	Very low	46	Very low	51 Å²	51	80.2 Å²	80.2	31%	0.313	43%	0.429	S	S	.	.	H	α-helix	trans	-84	-30.5	172	64.7	0	0	0	0	111	L800 L808	L800-T804 HydrophobicContact CB-CG2 4.09Å; L800-T804 HydrophobicContact CD2-CG2 4.28Å; L800-T804 HydrophobicContact CG-CG2 4.15Å; L800-T804 WeakPolarHBondContact O-CA 3.49Å; L800-T804 WeakPolarHBondContact O-CB 3.38Å; L800-T804 WeakPolarHBondContact O-CG2 3.24Å; L800-T804 PolarHBondContact O-N 3.2Å; L800-T804 PolarHBondContact O-OG1 3.03Å; T804-L808 WeakPolarHBondContact O-CA 3.08Å; T804-L808 WeakPolarHBondContact O-CB 3.48Å; T804-L808 PolarHBondContact O-N 3.29Å
805	N	44.2	Very low	45.7	Very low	77 Å²	77	79.4 Å²	79.4	41%	0.412	43%	0.426	S	S	.	.	H	α-helix	trans	-68.9	-42.7	168.5	-68.6	-18.8	0	0	0	109.5	E801 L809	E801-N805 WeakPolarHBondContact CG-ND2 3.31Å; E801-N805 WeakPolarHBondContact O-CA 3.44Å; E801-N805 WeakPolarHBondContact O-CB 3.37Å; E801-N805 PolarHBondContact O-N 3.49Å; E801-N805 PolarHBondContact O-ND2 3.48Å; E801-N805 VanDerWaalsContact O-ND2 3.1Å; N805-L809 WeakPolarHBondContact O-CB 3.47Å; N805-L809 WeakPolarHBondContact O-CD1 3.43Å; N805-L809 WeakPolarHBondContact O-CG 2.94Å; N805-L809 PolarHBondContact O-N 2.93Å
806	G	48.4	Very low	45.7	Very low	33 Å²	33	82.1 Å²	82.1	34%	0.34	44%	0.438	S	S	.	.	H	α-helix	trans	-58.2	-51.4	170.3	0	0	0	0	0	113.1	Q802 L809 L810	Q802-G806 PolarHBondContact O-N 3.4Å; G806-L809 PolarHBondContact O-N 2.99Å; G806-L810 WeakPolarHBondContact O-CB 3.22Å; G806-L810 WeakPolarHBondContact O-CD1 3.24Å; G806-L810 WeakPolarHBondContact O-CG 3.46Å; G806-L810 PolarHBondContact O-N 2.83Å
807	L	45.7	Very low	45.2	Very low	40 Å²	40	84.1 Å²	84.1	21%	0.209	45%	0.45	C	S	.	.	H	α-helix	trans	-74.2	-30.6	-177.2	-164.3	73.3	0	0	0	113.3	W637 F803 L810 L811	W637-L807 HydrophobicContact CZ3-CD2 3.91Å; F803-L807 WeakPolarHBondContact O-CB 3.49Å; F803-L807 PolarHBondContact O-N 3.19Å; L807-L810 CarbonylContact O-C 3.55Å; L807-L810 WeakPolarHBondContact O-CB 3.29Å; L807-L810 PolarHBondContact O-N 3.04Å; L807-L811 HydrophobicContact CD2-CD1 4.31Å; L807-L811 HydrophobicContact CG-CD1 3.93Å; L807-L811 HydrophobicContact CG-CG 4.47Å; L807-L811 VanDerWaalsContact O-CB 3.24Å; L807-L811 WeakPolarHBondContact O-CB 3.22Å; L807-L811 WeakPolarHBondContact O-CD1 3.34Å; L807-L811 WeakPolarHBondContact O-CG 3.47Å; L807-L811 PolarHBondContact O-N 2.86Å
808	L	45.2	Very low	45.1	Very low	96 Å²	96	80.8 Å²	80.8	50%	0.503	44%	0.441	S	S	.	.	H	α-helix	trans	-77.7	-32	175.1	-166.3	76.9	0	0	0	110.7	T804 L811 S812	T804-L808 WeakPolarHBondContact O-CA 3.08Å; T804-L808 WeakPolarHBondContact O-CB 3.48Å; T804-L808 PolarHBondContact O-N 3.29Å; L808-L811 CarbonylContact O-C 3.6Å; L808-L811 PolarHBondContact O-N 2.7Å; L808-S812 VanDerWaalsContact O-CB 3.23Å; L808-S812 WeakPolarHBondContact O-CB 3.44Å; L808-S812 PolarHBondContact O-N 2.92Å; L808-S812 PolarHBondContact O-OG 2.87Å
809	L	43.8	Very low	44.8	Very low	106 Å²	106	80.2 Å²	80.2	56%	0.555	44%	0.44	S	S	*	.	H	α-helix	trans	-61.6	-45.3	165.3	-73.9	166.2	0	0	0	110.2	N805 G806 L811 S812 S813	N805-L809 WeakPolarHBondContact O-CB 3.47Å; N805-L809 WeakPolarHBondContact O-CD1 3.43Å; N805-L809 WeakPolarHBondContact O-CG 2.94Å; N805-L809 PolarHBondContact O-N 2.93Å; G806-L809 PolarHBondContact O-N 2.99Å; L809-L811 PolarHBondContact O-N 2.9Å; L809-S812 PolarHBondContact O-N 3.14Å; L809-S813 WeakPolarHBondContact O-CB 3.32Å; L809-S813 PolarHBondContact O-N 3.11Å; L809-S813 PolarHBondContact O-OG 3.34Å
810	L	42.1	Very low	44.5	Very low	55 Å²	55	78.8 Å²	78.8	29%	0.288	43%	0.434	S	S	.	.	H	α-helix	trans	-67.9	-6.4	172.3	-78.1	162.6	0	0	0	115.9	L735 Q738 G806 L807	L735-L810 HydrophobicContact CD1-CD2 4.02Å; Q738-L810 HydrophobicContact CB-CD2 3.56Å; Q738-L810 HydrophobicContact CG-CD2 3.82Å; G806-L810 WeakPolarHBondContact O-CB 3.22Å; G806-L810 WeakPolarHBondContact O-CD1 3.24Å; G806-L810 WeakPolarHBondContact O-CG 3.46Å; G806-L810 PolarHBondContact O-N 2.83Å; L807-L810 CarbonylContact O-C 3.55Å; L807-L810 WeakPolarHBondContact O-CB 3.29Å; L807-L810 PolarHBondContact O-N 3.04Å
811	L	39.8	Very low	44	Very low	108 Å²	108	80.1 Å²	80.1	57%	0.565	44%	0.442	S	S	*	.	H	α-helix	trans	-122	-0.2	178.7	-72.1	169.6	0	0	0	112.6	L807 L808 L809	L807-L811 HydrophobicContact CD2-CD1 4.31Å; L807-L811 HydrophobicContact CG-CD1 3.93Å; L807-L811 HydrophobicContact CG-CG 4.47Å; L807-L811 VanDerWaalsContact O-CB 3.24Å; L807-L811 WeakPolarHBondContact O-CB 3.22Å; L807-L811 WeakPolarHBondContact O-CD1 3.34Å; L807-L811 WeakPolarHBondContact O-CG 3.47Å; L807-L811 PolarHBondContact O-N 2.86Å; L808-L811 CarbonylContact O-C 3.6Å; L808-L811 PolarHBondContact O-N 2.7Å; L809-L811 PolarHBondContact O-N 2.9Å
812	S	38.9	Very low	43.9	Very low	90 Å²	90	79.6 Å²	79.6	63%	0.629	45%	0.446	S	S	*	.	H	α-helix	trans	-119.4	-7.4	173.2	60.4	0	0	0	0	113	L808 L809	L808-S812 VanDerWaalsContact O-CB 3.23Å; L808-S812 WeakPolarHBondContact O-CB 3.44Å; L808-S812 PolarHBondContact O-N 2.92Å; L808-S812 PolarHBondContact O-OG 2.87Å; L809-S812 PolarHBondContact O-N 3.14Å
813	S	34.8	Very low	43.5	Very low	70 Å²	70	74 Å²	74	49%	0.49	43%	0.426	S	S	.	.			trans	-106.8	0	160.7	-31.8	0	0	0	0	107.7	L809	L809-S813 WeakPolarHBondContact O-CB 3.32Å; L809-S813 PolarHBondContact O-N 3.11Å; L809-S813 PolarHBondContact O-OG 3.34Å

Retrieved 813 of 813 residues in 984.6 ms (Link to these results)

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