A0A5K4F9Q1_SCHMA Loading...

Tyrosine-protein kinase

AlphaFold DB , UniProt , Accession A0A5K4F9Q1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,249 aa.

						>A0A5K4F9Q1_SCHMA|A0A5K4F9Q1
MGNHTVNEVSNYFERGSDVEDDINTLASNNTHITENNQSVLVSSTSDTFLVPPLPPHSLGHDKSLSSSSISTPNVDNINTKRYTDSVMLRSDHKESSQVIVSAIDAQMKSINEMLSYFSKLVKAEKTVQQALSDLLDDQKESSTVGSVDGGQRSNTTAMRNLFKSNYSRGRRRRLTMNILNKNLSNSPTDNELNKLLQNLVISTNHQVRMFSTRALFHKLITAGQLDSLNNCEHCLRRTYLECEEELKSQARQYMLSLKAYEKKYFKYIGQLSNIQSKLTNLCLINNRKIIDSLMNNLEYSTKKLHLLHNEYCLALITANHYQQWLYTHLRPCLLKGVERTMQLASEVVWHLLVFGGENIHHFQSNWLKEFQSELDLTIKFPGPVYHTFNQALNNNTTLGGNLSPGSLIVNDLTGQSLIELTQLHKNKELLHRETVNQLTKECLQWEEALSQWRAVFANPGPNPWSSNLFNIHSSGVSPIVNTPQDNNSNGFHHVDNSSHLALPDIQDLWHDDRARPVNLCEVSFRLAICEFELCFANCLADSEAQLVNVLTDAQCRLNWLSLKLLTNDSTTSYPNTTPITFSRDPCDITTTTTTITNGNSNNNNHEDIDIQNGTDDNCSQALNGHDNSIPLCNLSDSYSTDPPKFIEQISNSPFALSTSNTSDMSSSIEHQQQQRPERNRLWQSVRQSMSKFRSHFIRNNNIRSSTSSIPNTRTYQCRLRETIITTIPLLNTINDNNNNSNNNSNNKPLHNPTINGLKQQNHLGMDTPFYHQNRKFNHQNHIQSNRESQDSTSILTSFPICDMDINKEPWFHGVLPRAEVERLLQNQGDFLVRQTSKRSSGRDTIGHWNGTNGDLINGNHNETILNKDHNMDGTVLRMVLSVFWHGHRHFILYGGPETGEGWHLEDGHFSTIRELIEYHMKTQTPVTAKSGACLVTPISRPDWELDNRDVQLLQKIGQGNFGDVYRGVYNGCEVAVKTCRVDMTASDLRRKFLQGETTALNFNHPNIVKLVGIAVQSYPIMIVMEYVPGGSLLNHLRKSKNALPVMKLLQMSLDAANGMMYLEARNCIHRDLAARNCLISDDGQLKIADFGMSREEHIYELSDKRGQIPIKWTAPEALRTGRYTIKCDVWSYGVLLWEIFTFGDVPYRNWSNQQTRDMIESGYRLPAPDLMPVWLRTLMNHCWHDEPMNRPSFSKISNEIQIPNVNSFTPNLNRSIDNAQLKKSAIDNLSTTPLHLSVSVKDRRTRED
					

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	29.4	Very low	29.6	Very low	251 Å²	251	143.9 Å²	143.9	100%	1.236	81%	0.811	S	S	*	*				0	154.5	0	-67.1	177	176.7	0	0	107.7
2	G	31.8	Very low	29.5	Very low	78 Å²	78	145.4 Å²	145.4	80%	0.804	80%	0.797	S	S	*	*			trans	96.4	121.4	-177.7	0	0	0	0	0	113.1
3	N	28.1	Very low	29.3	Very low	147 Å²	147	149.8 Å²	149.8	79%	0.786	80%	0.803	S	S	*	*			trans	-105.3	-177.6	171.1	-82	-20.5	0	0	0	109.6
4	H	29.6	Very low	29.3	Very low	160 Å²	160	148.1 Å²	148.1	74%	0.741	79%	0.788	S	S	*	*			trans	85	104.3	161	-51.8	-78.5	0	0	0	118.7	V6	H4-V6 HydrophobicContact CB-CG2 3.98Å
5	T	32.7	Very low	29.2	Very low	145 Å²	145	154.2 Å²	154.2	89%	0.89	80%	0.796	S	S	*	*				-140.9	122	114.5	25.3	0	0	0	0	105.4
6	V	31.8	Very low	29.4	Very low	115 Å²	115	149.8 Å²	149.8	70%	0.697	80%	0.8	S	S	*	*			cis	85.5	126.5	35.1	-175.6	0	0	0	0	112.6	H4	H4-V6 HydrophobicContact CB-CG2 3.98Å
7	N	28.6	Very low	29.3	Very low	152 Å²	152	147.2 Å²	147.2	81%	0.813	80%	0.797	S	S	*	*			trans	-62.4	149.1	-177.5	-51.4	-31.1	0	0	0	112.2
8	E	29.8	Very low	29.4	Very low	191 Å²	191	148 Å²	148	89%	0.893	80%	0.8	S	S	*	*			trans	-146	83.1	154.1	-140	170.2	-125.1	0	0	112.2
9	V	28	Very low	29.6	Very low	142 Å²	142	147.8 Å²	147.8	86%	0.861	81%	0.805	S	S	*	*			trans	-95.4	106.7	160.6	175.5	0	0	0	0	106.5
10	S	28	Very low	29.5	Very low	75 Å²	75	149 Å²	149	52%	0.524	80%	0.804	S	S	.	*			trans	-155.9	123	178.2	-88.8	0	0	0	0	116.2
11	N	28.1	Very low	29.6	Very low	127 Å²	127	149.2 Å²	149.2	68%	0.679	81%	0.805	S	S	*	*			trans	60.5	92.3	132.4	-54.8	-22.5	0	0	0	120	R1106	N11-R1106 PolarHBondContact O-NH2 3.43Å
12	Y	28.3	Very low	29.8	Very low	162 Å²	162	143.6 Å²	143.6	64%	0.635	78%	0.78	S	S	*	*			trans	-119.5	71.1	149.6	-78.1	-103.6	0	0	0	110.4	R1106	Y12-R1106 HydrophobicContact CE1-CB 3.66Å; Y12-R1106 VanDerWaalsContact CE1-CD 3.47Å; Y12-R1106 HydrophobicContact CE1-CG 4.03Å; Y12-R1106 VanDerWaalsContact CZ-CZ 3.44Å; Y12-R1106 WeakPolarHBondContact OH-CB 3.47Å; Y12-R1106 PolarHBondContact OH-NE 3.24Å; Y12-R1106 VanDerWaalsContact OH-NE 3.17Å
13	F	27.2	Very low	29.7	Very low	202 Å²	202	145.9 Å²	145.9	89%	0.886	77%	0.773	S	S	*	*			trans	-112.7	112	153.6	-108.6	-79.6	0	0	0	106.7
14	E	28.4	Very low	29.8	Very low	127 Å²	127	145.5 Å²	145.5	59%	0.593	77%	0.77	S	S	*	*			trans	-113.1	121.4	168.2	-82.3	174.9	-168.6	0	0	108.7	R1106	E14-R1106 WeakPolarHBondContact OE1-CD 3.27Å; E14-R1106 IonicContact OE1-CZ 3.17Å; E14-R1106 IonicContact OE1-NE 2.73Å; E14-R1106 IonicContact OE1-NH1 3.72Å; E14-R1106 PolarHBondContact OE1-NH1 2.98Å
15	R	28.7	Very low	29.9	Very low	239 Å²	239	143.3 Å²	143.3	90%	0.902	77%	0.768	S	S	*	*			trans	-101.7	113.8	155	-75	-171.9	178.4	-162.6	2.5	106.8
16	G	31.9	Very low	29.8	Very low	84 Å²	84	144.1 Å²	144.1	87%	0.866	77%	0.767	S	S	*	*			trans	-84.6	124.3	149.5	0	0	0	0	0	107.6
17	S	28.3	Very low	29.9	Very low	106 Å²	106	143 Å²	143	74%	0.741	77%	0.769	S	S	*	*			trans	-96.7	149.3	173.8	49.9	0	0	0	0	110.3
18	D	30.4	Very low	30	Very low	161 Å²	161	140.1 Å²	140.1	86%	0.861	76%	0.761	S	S	*	*			trans	-156.6	155.4	149.2	-97.1	-36.5	0	0	0	109.8
19	V	34.2	Very low	30.2	Very low	145 Å²	145	138.8 Å²	138.8	88%	0.879	76%	0.76	S	S	*	*			trans	69.5	112.4	180	-166.9	0	0	0	0	115.7
20	E	27.3	Very low	30.3	Very low	171 Å²	171	138.5 Å²	138.5	80%	0.799	75%	0.754	S	S	*	*			trans	-82.6	153.5	169.2	-62.1	158.7	118.8	0	0	110.2
21	D	31.1	Very low	30.6	Very low	153 Å²	153	141.9 Å²	141.9	82%	0.818	77%	0.771	S	S	*	*				177	167	106.9	-102.9	-36.2	0	0	0	114.3
22	D	33.4	Very low	30.7	Very low	133 Å²	133	143.2 Å²	143.2	71%	0.711	77%	0.773	S	S	*	*			trans	69.6	98.3	163.8	-79.1	-19.9	0	0	0	122.5
23	I	30.9	Very low	30.9	Very low	127 Å²	127	143.5 Å²	143.5	65%	0.651	78%	0.784	S	S	*	*				76.6	102.9	121.5	-65.8	169.2	0	0	0	118.7
24	N	28.6	Very low	30.9	Very low	138 Å²	138	138.9 Å²	138.9	74%	0.738	77%	0.773	S	S	*	*				50.4	142.8	121.1	-56	-37	0	0	0	120.2
25	T	31.5	Very low	31.1	Very low	114 Å²	114	141.5 Å²	141.5	70%	0.699	79%	0.785	S	S	*	*			cis	-167	164	20.7	-10.7	0	0	0	0	111
26	L	32	Very low	31.1	Very low	163 Å²	163	137.1 Å²	137.1	85%	0.853	78%	0.779	S	S	*	*			trans	66.2	141.3	153.4	-68	162.6	0	0	0	118.1
27	A	34.1	Very low	31.1	Very low	91 Å²	91	140.4 Å²	140.4	75%	0.752	78%	0.777	S	S	*	*			cis	-147.5	154.4	-6.3	0	0	0	0	0	111.4
28	S	29.4	Very low	31.4	Very low	92 Å²	92	143.8 Å²	143.8	64%	0.643	78%	0.781	S	S	*	*			trans	-78.3	162.4	176.9	53.5	0	0	0	0	113.6
29	N	34.9	Very low	31.1	Very low	162 Å²	162	141.4 Å²	141.4	87%	0.866	78%	0.777	S	S	*	*				-157.9	134.3	119.9	-96.6	-19.4	0	0	0	111.3
30	N	30.7	Very low	31	Very low	136 Å²	136	141.1 Å²	141.1	73%	0.727	78%	0.776	S	S	*	*			trans	-97.1	156.2	180	-66.2	-25.6	0	0	0	111.2
31	T	33.4	Very low	30.9	Very low	146 Å²	146	141 Å²	141	90%	0.896	78%	0.78	S	S	*	*			trans	-141.4	121.9	139.5	27	0	0	0	0	109.9
32	H	29.8	Very low	31	Very low	155 Å²	155	140.6 Å²	140.6	72%	0.718	78%	0.782	S	S	*	*			trans	-82.1	145.3	166.2	-87.5	-110	0	0	0	109.9
33	I	32.9	Very low	30.6	Very low	168 Å²	168	139 Å²	139	86%	0.862	78%	0.781	S	S	*	*			trans	-136.1	139.8	142.1	-61.3	-174.8	0	0	0	107.4
34	T	27.4	Very low	30.6	Very low	106 Å²	106	138 Å²	138	65%	0.65	79%	0.786	S	S	*	*			trans	-141.6	121.9	-179	49.2	0	0	0	0	110.5
35	E	31.5	Very low	30.6	Very low	181 Å²	181	137.6 Å²	137.6	85%	0.846	79%	0.788	S	S	*	*			trans	-162.9	126.5	162.5	-104.8	148.4	-147.2	0	0	106.7
36	N	29.4	Very low	30.5	Very low	147 Å²	147	136.8 Å²	136.8	79%	0.786	79%	0.788	S	S	*	*				67.1	111.3	63.8	-84.1	-13.3	0	0	0	115
37	N	33.1	Very low	30.4	Very low	154 Å²	154	136.6 Å²	136.6	82%	0.824	79%	0.787	S	S	*	*			trans	166.4	106.9	144.6	-83.9	-30.6	0	0	0	107.3
38	Q	32.7	Very low	30.1	Very low	176 Å²	176	137.5 Å²	137.5	82%	0.822	78%	0.784	S	S	*	*				61.7	91.9	72.8	-68.5	-157.4	-6.2	0	0	116
39	S	25.9	Very low	30.2	Very low	112 Å²	112	141.7 Å²	141.7	78%	0.783	79%	0.791	S	S	*	*			trans	11.8	124.9	140.7	56.8	0	0	0	0	121
40	V	31	Very low	30	Very low	139 Å²	139	140.9 Å²	140.9	84%	0.842	79%	0.785	S	S	*	*			trans	-137.4	141.9	146.3	177.7	0	0	0	0	109.1
41	L	26	Very low	30.1	Very low	169 Å²	169	140.3 Å²	140.3	89%	0.885	79%	0.787	S	S	*	*			trans	-90.7	136.2	169	-67.6	111.9	0	0	0	110.8
42	V	31.9	Very low	30.2	Very low	144 Å²	144	138.9 Å²	138.9	87%	0.873	78%	0.78	S	S	*	*			trans	-138.4	145.7	149.3	-174.7	0	0	0	0	108.4
43	S	26	Very low	30.5	Very low	99 Å²	99	137.1 Å²	137.1	69%	0.692	78%	0.782	S	S	*	*			trans	-118	-174.2	-178.9	58.5	0	0	0	0	111
44	S	31	Very low	30.5	Very low	106 Å²	106	137.3 Å²	137.3	74%	0.741	78%	0.784	S	S	*	*			trans	71.9	153.8	173.6	86.8	0	0	0	0	115.4
45	T	29.2	Very low	30.8	Very low	129 Å²	129	137.8 Å²	137.8	79%	0.791	79%	0.789	S	S	*	*			cis	-158.1	172.7	-35.4	12.5	0	0	0	0	106.9
46	S	27.9	Very low	31.1	Very low	98 Å²	98	134.6 Å²	134.6	69%	0.685	78%	0.784	S	S	*	*			trans	-38	142.7	164.4	-36.4	0	0	0	0	114.8
47	D	30.9	Very low	31.3	Very low	158 Å²	158	137 Å²	137	85%	0.845	79%	0.79	S	S	*	*				-171.6	165.7	95.9	-93.6	-19.4	0	0	0	114.3
48	T	27.4	Very low	31.1	Very low	111 Å²	111	134.7 Å²	134.7	68%	0.681	79%	0.786	S	S	*	*			trans	-77.1	156	-171.8	-33.5	0	0	0	0	114
49	F	30.6	Very low	31.1	Very low	179 Å²	179	134.6 Å²	134.6	79%	0.785	79%	0.79	S	S	*	*				156.2	133.2	123.7	-82.5	-62.4	0	0	0	115.5
50	L	31.8	Very low	31.3	Very low	145 Å²	145	132 Å²	132	76%	0.759	78%	0.781	S	S	*	*			trans	49.6	121.2	145.1	-61.2	162.2	0	0	0	120.8
51	V	32.4	Very low	31.5	Very low	125 Å²	125	134.3 Å²	134.3	76%	0.758	78%	0.782	S	S	*	*				80.6	136.9	59.4	163.5	0	0	0	0	113.8
52	P	34.6	Very low	31.6	Very low	116 Å²	116	133.2 Å²	133.2	75%	0.753	78%	0.777	S	S	*	*			cis	-134	-167.4	-22.2	37.8	-16	0	0	0	114.2
53	P	37.6	Very low	31.7	Very low	117 Å²	117	136.6 Å²	136.6	76%	0.76	78%	0.78	S	S	*	*			trans	-114.7	175.4	-173.2	42.1	-33.8	0	0	0	117.5
54	L	31.4	Very low	31.8	Very low	173 Å²	173	137 Å²	137	91%	0.906	78%	0.783	S	S	*	*			trans	-153.6	161.5	162.5	-97.1	125	0	0	0	112.6
55	P	34.3	Very low	31.9	Very low	116 Å²	116	140.2 Å²	140.2	75%	0.753	79%	0.791	S	S	*	*			trans	-122.1	-139.4	-157.1	39.5	-19.1	0	0	0	115.9
56	P	37.4	Very low	31.8	Very low	113 Å²	113	139.1 Å²	139.1	73%	0.734	79%	0.789	S	S	*	*				-122.7	-180	-118	39	-19.1	0	0	0	116.4
57	H	34.3	Very low	32	Very low	199 Å²	199	139.6 Å²	139.6	92%	0.921	79%	0.792	S	S	*	*			trans	-142.7	157.9	172.5	-94.5	-78.2	0	0	0	114
58	S	29	Very low	31.9	Very low	105 Å²	105	137 Å²	137	73%	0.734	79%	0.787	S	S	*	*			trans	-129.8	152.6	-174.5	55.8	0	0	0	0	113
59	L	33	Very low	32.1	Very low	174 Å²	174	136.7 Å²	136.7	91%	0.911	79%	0.789	S	S	*	*			trans	162.7	145.9	164.6	-91.7	151.2	0	0	0	107.3
60	G	28.7	Very low	31.9	Very low	57 Å²	57	135.7 Å²	135.7	59%	0.588	79%	0.79	S	S	*	*			cis	133.5	117.5	-6.1	0	0	0	0	0	112.6
61	H	35.7	Very low	31.8	Very low	188 Å²	188	134.3 Å²	134.3	87%	0.87	79%	0.792	S	S	*	*			trans	168.8	143.9	147.1	-95.7	-54.4	0	0	0	115.5
62	D	29.1	Very low	31.5	Very low	146 Å²	146	134.8 Å²	134.8	78%	0.781	80%	0.796	S	S	*	*			trans	-90.3	168	174.6	-44.2	-97	0	0	0	114.7
63	K	33.9	Very low	31.5	Very low	214 Å²	214	134.9 Å²	134.9	93%	0.93	80%	0.796	S	S	*	*				-166.3	146.8	128.5	-106.7	153	-171.3	170.3	0	114.1
64	S	28.7	Very low	31.1	Very low	109 Å²	109	136.9 Å²	136.9	76%	0.762	80%	0.801	S	S	*	*			trans	-113.1	168.3	177.9	57.2	0	0	0	0	111.6
65	L	31.3	Very low	31	Very low	172 Å²	172	134.3 Å²	134.3	90%	0.901	79%	0.792	S	S	*	*			trans	-172.5	170.5	144.8	-104.5	163.7	0	0	0	111.7
66	S	28	Very low	30.7	Very low	106 Å²	106	135.2 Å²	135.2	74%	0.741	79%	0.79	S	S	*	*			trans	-148	158.6	-161.9	57.2	0	0	0	0	113.5
67	S	31.9	Very low	30.2	Very low	108 Å²	108	136.9 Å²	136.9	76%	0.755	79%	0.793	S	S	*	*			trans	164.8	125.6	132.4	63.1	0	0	0	0	116
68	S	28.5	Very low	29.9	Very low	105 Å²	105	134.9 Å²	134.9	73%	0.734	79%	0.787	S	S	*	*			trans	15	137.1	142.6	56.1	0	0	0	0	123.5
69	S	31.3	Very low	29.9	Very low	104 Å²	104	137 Å²	137	73%	0.727	79%	0.791	S	S	*	*				174.5	122.7	102	-74.5	0	0	0	0	116.9
70	I	26.3	Very low	29.7	Very low	157 Å²	157	135.6 Å²	135.6	81%	0.805	79%	0.789	S	S	*	*			trans	28	114.8	138.5	-54.3	160.1	0	0	0	120
71	S	30.9	Very low	29.7	Very low	116 Å²	116	141.8 Å²	141.8	81%	0.811	80%	0.8	S	S	*	*				170.2	155.7	115	45.4	0	0	0	0	113.5
72	T	26.5	Very low	29.4	Very low	135 Å²	135	143.7 Å²	143.7	83%	0.828	80%	0.8	S	S	*	*			trans	-141.2	174.4	-179.1	53.4	0	0	0	0	109.5
73	P	33.9	Very low	29.3	Very low	118 Å²	118	148 Å²	148	77%	0.766	81%	0.806	S	S	*	*			cis	-124.2	173.1	-32.9	35.6	-22	0	0	0	112
74	N	29.4	Very low	29	Very low	160 Å²	160	143.5 Å²	143.5	86%	0.856	80%	0.798	S	S	*	*			trans	-153.8	162.5	136.3	-142.8	-11.3	0	0	0	112.7
75	V	28.9	Very low	29	Very low	119 Å²	119	144.5 Å²	144.5	72%	0.721	79%	0.794	S	S	*	*			trans	-92.9	131.5	-176.7	179.6	0	0	0	0	110.5
76	D	27.9	Very low	28.8	Very low	135 Å²	135	142.3 Å²	142.3	72%	0.722	79%	0.793	S	S	*	*			trans	179.1	148.5	133.4	-98	-22.6	0	0	0	113.8
77	N	28	Very low	28.8	Very low	148 Å²	148	143.1 Å²	143.1	79%	0.791	79%	0.794	S	S	*	*			trans	45	75	156.5	-66.9	-54.7	0	0	0	119.6
78	I	28	Very low	28.6	Very low	156 Å²	156	146.1 Å²	146.1	80%	0.8	80%	0.798	S	S	*	*			trans	-98.8	108.1	159.7	-63.8	-179.7	0	0	0	110.7	T80	I78-T80 PolarHBondContact O-N 3.47Å
79	N	28.9	Very low	28.7	Very low	151 Å²	151	145.4 Å²	145.4	81%	0.807	79%	0.785	S	S	*	*			trans	-66.5	115.9	164.2	-89.6	-72.2	0	0	0	109.8	K81	N79-K81 PolarHBondContact O-N 3.38Å
80	T	28.8	Very low	28.7	Very low	143 Å²	143	151.8 Å²	151.8	88%	0.877	79%	0.793	S	S	*	*			trans	-77.9	63.7	-177.4	43.1	0	0	0	0	113.7	I78	I78-T80 PolarHBondContact O-N 3.47Å
81	K	28.9	Very low	29	Very low	188 Å²	188	147 Å²	147	82%	0.817	77%	0.774	S	S	*	*			trans	-110.7	138.5	155.6	-81.5	-177.5	174.5	177	0	108.7	N79	N79-K81 PolarHBondContact O-N 3.38Å
82	R	27.6	Very low	30	Very low	227 Å²	227	145.5 Å²	145.5	86%	0.857	76%	0.757	S	S	*	*			trans	78.3	85.9	-171.8	-53.4	176	178	171.9	-1.4	115
83	Y	28.2	Very low	31.4	Very low	236 Å²	236	141.5 Å²	141.5	93%	0.925	73%	0.729	S	S	*	*			trans	-143.8	74.1	136.9	-114	-78.5	0	0	0	107
84	T	28.2	Very low	32.6	Very low	121 Å²	121	143.9 Å²	143.9	74%	0.742	73%	0.727	S	S	*	*			trans	-120.7	36.5	-173.1	48.4	0	0	0	0	111.4
85	D	27	Very low	34.3	Very low	130 Å²	130	142 Å²	142	70%	0.695	71%	0.713	S	S	*	*			trans	-132.9	102.4	177.3	-78.4	-64.3	0	0	0	110.8
86	S	28.6	Very low	36.2	Very low	126 Å²	126	137.5 Å²	137.5	88%	0.881	69%	0.687	S	S	*	*			trans	-143.6	66.5	154.3	-170	0	0	0	0	106.5	M88	S86-M88 PolarHBondContact O-N 3.3Å
87	V	28.2	Very low	38.6	Very low	123 Å²	123	131.8 Å²	131.8	75%	0.745	66%	0.657	S	S	*	*			trans	-87	103.1	-176.9	176.5	0	0	0	0	108.4
88	M	26.7	Very low	41	Very low	171 Å²	171	130.9 Å²	130.9	84%	0.842	65%	0.648	S	S	*	*	S	Bend	trans	-162.9	-5.8	157	-121.7	177	-176.2	0	0	117.3	S86	S86-M88 PolarHBondContact O-N 3.3Å
89	L	30.3	Very low	43.3	Very low	90 Å²	90	125.3 Å²	125.3	47%	0.471	62%	0.621	S	S	.	*	S	Bend	trans	-126.1	38.8	-175.2	-76.8	163.2	0	0	0	113.3	P382	L89-P382 HydrophobicContact CD1-CB 3.59Å; L89-P382 HydrophobicContact CD2-CB 3.97Å; L89-P382 HydrophobicContact CG-CB 4.44Å
90	R	31.2	Very low	45.9	Very low	237 Å²	237	118.3 Å²	118.3	89%	0.894	58%	0.584	S	S	*	*	S	Bend	trans	-126.2	-4.2	-176.4	-73.9	-167.8	176.3	-162.2	0.5	116.2
91	S	32.4	Very low	48.7	Very low	57 Å²	57	112.3 Å²	112.3	40%	0.399	55%	0.547	S	S	.	.	S	Bend	trans	-79.3	-69.4	172.8	33	0	0	0	0	111.1	H93 K94	S91-H93 PolarHBondContact O-N 3.34Å; S91-H93 VanDerWaalsContact O-N 3.12Å; S91-K94 PolarHBondContact O-N 2.82Å
92	D	52	Low	51.3	Low	84 Å²	84	106.1 Å²	106.1	45%	0.449	53%	0.528	S	S	.	.	H	α-helix	trans	-60.9	-39.4	-152.4	-49.2	11.8	0	0	0	113.2	K94 E95 S96	D92-K94 PolarHBondContact O-N 3.05Å; D92-K94 VanDerWaalsContact O-N 3.14Å; D92-E95 PolarHBondContact O-N 2.89Å; D92-S96 PolarHBondContact O-N 3.24Å; D92-S96 PolarHBondContact O-OG 3.18Å; D92-S96 VanDerWaalsContact O-OG 3.09Å
93	H	56.5	Low	53.9	Low	52 Å²	52	96 Å²	96	24%	0.241	49%	0.492	C	S	.	.	H	α-helix	trans	-65.4	-21.6	-172.6	-56.1	-28.9	0	0	0	114.7	S91 S97 Y327	S91-H93 PolarHBondContact O-N 3.34Å; S91-H93 VanDerWaalsContact O-N 3.12Å; H93-S97 PolarHBondContact O-OG 3.03Å; H93-Y327 AromaticContact CE1-CE1 3.63Å; H93-Y327 AromaticContact CE1-CZ 3.88Å; H93-Y327 PolarHBondContact CE1-OH 2.65Å; H93-Y327 PolarHBondContact NE2-OH 3.33Å; H93-Y327 VanDerWaalsContact NE2-OH 3.14Å
94	K	59	Low	56.8	Low	168 Å²	168	84.7 Å²	84.7	73%	0.73	45%	0.448	S	S	*	.	H	α-helix	trans	-77.4	-42.1	170.8	-79.8	-170.4	172.6	-172.6	0	111.1	S91 D92 Q98	S91-K94 PolarHBondContact O-N 2.82Å; D92-K94 PolarHBondContact O-N 3.05Å; D92-K94 VanDerWaalsContact O-N 3.14Å; K94-Q98 VanDerWaalsContact O-CB 3.27Å; K94-Q98 WeakPolarHBondContact O-CB 3.28Å; K94-Q98 PolarHBondContact O-N 3.15Å
95	E	64.3	Low	59.7	Low	120 Å²	120	81.6 Å²	81.6	56%	0.561	43%	0.427	S	S	*	.	H	α-helix	trans	-65.9	-47.2	-177.6	-68.1	161.3	-159.8	0	0	110.4	D92 S97 Q98 V99	D92-E95 PolarHBondContact O-N 2.89Å; E95-S97 PolarHBondContact O-N 3.38Å; E95-Q98 PolarHBondContact O-N 3.41Å; E95-V99 WeakPolarHBondContact O-CG2 3.39Å; E95-V99 PolarHBondContact O-N 3.31Å
96	S	69.7	Low	62.4	Low	24 Å²	24	78.1 Å²	78.1	17%	0.168	42%	0.416	C	S	.	.	H	α-helix	trans	-59.5	-45.1	177.4	-39.5	0	0	0	0	113.1	D92 Q98 I100	D92-S96 PolarHBondContact O-N 3.24Å; D92-S96 PolarHBondContact O-OG 3.18Å; D92-S96 VanDerWaalsContact O-OG 3.09Å; S96-Q98 VanDerWaalsContact C-N 3.29Å; S96-Q98 PolarHBondContact O-N 2.84Å; S96-I100 WeakPolarHBondContact O-CD1 3.16Å; S96-I100 WeakPolarHBondContact O-CG1 3.35Å; S96-I100 PolarHBondContact O-N 3.33Å
97	S	79	Confident	65.2	Low	15 Å²	15	72.3 Å²	72.3	11%	0.105	38%	0.375	C	S	.	.	H	α-helix	trans	-65.5	-33.4	175.8	-69.5	0	0	0	0	112.2	H93 E95 V101	H93-S97 PolarHBondContact O-OG 3.03Å; E95-S97 PolarHBondContact O-N 3.38Å; S97-V101 WeakPolarHBondContact O-CB 3.45Å; S97-V101 VanDerWaalsContact O-CG2 3.26Å; S97-V101 WeakPolarHBondContact O-CG2 3.24Å; S97-V101 PolarHBondContact O-N 3Å
98	Q	78.8	Confident	68.2	Low	130 Å²	130	67.1 Å²	67.1	61%	0.607	34%	0.342	S	S	*	.	H	α-helix	trans	-74	-39.8	179.6	-177.5	170.4	-26.7	0	0	112	K94 E95 S96 V101 S102	K94-Q98 VanDerWaalsContact O-CB 3.27Å; K94-Q98 WeakPolarHBondContact O-CB 3.28Å; K94-Q98 PolarHBondContact O-N 3.15Å; E95-Q98 PolarHBondContact O-N 3.41Å; S96-Q98 VanDerWaalsContact C-N 3.29Å; S96-Q98 PolarHBondContact O-N 2.84Å; Q98-V101 PolarHBondContact O-N 3.36Å; Q98-S102 VanDerWaalsContact O-CB 3.27Å; Q98-S102 WeakPolarHBondContact O-CB 3.29Å; Q98-S102 PolarHBondContact O-N 3.28Å; Q98-S102 PolarHBondContact O-OG 2.82Å
99	V	75.9	Confident	71.1	Confident	38 Å²	38	65.1 Å²	65.1	23%	0.23	33%	0.329	C	S	.	.	H	α-helix	trans	-55.8	-55.6	172.1	164	0	0	0	0	110.7	E95 V101 S102 A103 E374 L375	E95-V99 WeakPolarHBondContact O-CG2 3.39Å; E95-V99 PolarHBondContact O-N 3.31Å; V99-V101 VanDerWaalsContact C-N 3.32Å; V99-V101 PolarHBondContact O-N 2.95Å; V99-S102 PolarHBondContact O-N 3.4Å; V99-S102 VanDerWaalsContact O-N 3.07Å; V99-A103 PolarHBondContact O-N 2.94Å; V99-E374 HydrophobicContact CG1-CB 3.73Å; V99-L375 HydrophobicContact CG1-CD1 4.36Å
100	I	83.1	Confident	73.7	Confident	5 Å²	5	62.7 Å²	62.7	3%	0.026	32%	0.32	C	S	.	.	H	α-helix	trans	-59.6	-42.4	-177.8	-66.7	158.7	0	0	0	111.5	S96 I104 Y240 L335 V338 L375	S96-I100 WeakPolarHBondContact O-CD1 3.16Å; S96-I100 WeakPolarHBondContact O-CG1 3.35Å; S96-I100 PolarHBondContact O-N 3.33Å; I100-I104 HydrophobicContact CG2-CD1 4.25Å; I100-I104 WeakPolarHBondContact O-CG1 3.33Å; I100-I104 PolarHBondContact O-N 3.25Å; I100-Y240 HydrophobicContact CB-CE1 4.09Å; I100-Y240 HydrophobicContact CD1-CE2 4.23Å; I100-Y240 VanDerWaalsContact CD1-OH 3.27Å; I100-Y240 WeakPolarHBondContact CD1-OH 3.31Å; I100-Y240 HydrophobicContact CG2-CD1 4.05Å; I100-Y240 HydrophobicContact CG2-CD2 4.35Å; I100-Y240 HydrophobicContact CG2-CE1 3.78Å; I100-Y240 HydrophobicContact CG2-CE2 4.1Å; I100-Y240 HydrophobicContact CG2-CG 4.35Å; I100-L335 HydrophobicContact CD1-CD1 3.53Å; I100-L335 HydrophobicContact CG1-CD1 3.92Å; I100-V338 HydrophobicContact CG2-CG1 4.25Å; I100-L375 HydrophobicContact CG1-CD1 4.3Å
101	V	87.9	Confident	76.4	Confident	17 Å²	17	51.5 Å²	51.5	10%	0.103	28%	0.277	C	S	.	.	H	α-helix	trans	-68.1	-37.8	177	169.8	0	0	0	0	112.2	S97 Q98 V99 A103 I104 D105 R237 Y240 L241	S97-V101 WeakPolarHBondContact O-CB 3.45Å; S97-V101 VanDerWaalsContact O-CG2 3.26Å; S97-V101 WeakPolarHBondContact O-CG2 3.24Å; S97-V101 PolarHBondContact O-N 3Å; Q98-V101 PolarHBondContact O-N 3.36Å; V99-V101 VanDerWaalsContact C-N 3.32Å; V99-V101 PolarHBondContact O-N 2.95Å; V101-A103 VanDerWaalsContact C-N 3.34Å; V101-I104 PolarHBondContact O-N 3.46Å; V101-D105 WeakPolarHBondContact O-CB 3.22Å; V101-D105 PolarHBondContact O-N 3.47Å; V101-R237 HydrophobicContact CG1-CG 4.41Å; V101-R237 VanDerWaalsContact CG1-CZ 3.44Å; V101-R237 VanDerWaalsContact CG1-NH2 3.3Å; V101-Y240 HydrophobicContact CG2-CD1 4.01Å; V101-Y240 HydrophobicContact CG2-CE1 4.11Å; V101-L241 HydrophobicContact CG2-CD1 4.17Å; V101-L241 HydrophobicContact CG2-CD2 3.95Å; V101-L241 HydrophobicContact CG2-CG 4.01Å
102	S	83.8	Confident	79.2	Confident	58 Å²	58	52.1 Å²	52.1	41%	0.406	28%	0.277	S	S	.	.	H	α-helix	trans	-66.9	-36.3	178.9	-58.6	0	0	0	0	111.7	Q98 V99 D105 A106	Q98-S102 VanDerWaalsContact O-CB 3.27Å; Q98-S102 WeakPolarHBondContact O-CB 3.29Å; Q98-S102 PolarHBondContact O-N 3.28Å; Q98-S102 PolarHBondContact O-OG 2.82Å; V99-S102 PolarHBondContact O-N 3.4Å; V99-S102 VanDerWaalsContact O-N 3.07Å; S102-D105 PolarHBondContact O-N 2.93Å; S102-A106 WeakPolarHBondContact O-CB 3.45Å; S102-A106 PolarHBondContact O-N 2.99Å
103	A	82	Confident	80.8	Confident	13 Å²	13	53.2 Å²	53.2	11%	0.107	28%	0.279	C	S	.	.	H	α-helix	trans	-66.7	-42.9	174.4	0	0	0	0	0	112.7	V99 V101 A106 Q107 M342 F371	V99-A103 PolarHBondContact O-N 2.94Å; V101-A103 VanDerWaalsContact C-N 3.34Å; A103-A106 PolarHBondContact O-N 3.04Å; A103-Q107 PolarHBondContact O-N 2.93Å; A103-M342 HydrophobicContact CB-CE 4.05Å; A103-F371 HydrophobicContact CB-CD2 3.31Å; A103-F371 HydrophobicContact CB-CE2 3.62Å; A103-F371 HydrophobicContact CB-CG 4.36Å
104	I	88.2	Confident	82.3	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-64.2	-42.6	174.4	-59	162.3	0	0	0	110.3	I100 V101 A106 Q107 M108 E233 R237 V338 M342	I100-I104 HydrophobicContact CG2-CD1 4.25Å; I100-I104 WeakPolarHBondContact O-CG1 3.33Å; I100-I104 PolarHBondContact O-N 3.25Å; V101-I104 PolarHBondContact O-N 3.46Å; I104-A106 VanDerWaalsContact C-N 3.32Å; I104-A106 PolarHBondContact O-N 2.99Å; I104-Q107 PolarHBondContact O-N 3Å; I104-M108 HydrophobicContact CG2-CG 4.42Å; I104-M108 HydrophobicContact CG2-SD 3.91Å; I104-M108 WeakPolarHBondContact O-CB 3.46Å; I104-M108 VanDerWaalsContact O-CG 3.3Å; I104-M108 WeakPolarHBondContact O-CG 3.45Å; I104-M108 PolarHBondContact O-N 3.42Å; I104-E233 HydrophobicContact CG2-CB 4.32Å; I104-R237 HydrophobicContact CD1-CB 4.49Å; I104-R237 HydrophobicContact CG2-CB 3.84Å; I104-R237 HydrophobicContact CG2-CG 4.28Å; I104-V338 HydrophobicContact CD1-CG1 4.1Å; I104-M342 HydrophobicContact CB-CE 4.46Å; I104-M342 HydrophobicContact CD1-SD 4.47Å; I104-M342 HydrophobicContact CG1-CE 3.85Å; I104-M342 HydrophobicContact CG1-CG 4.43Å; I104-M342 HydrophobicContact CG1-SD 3.57Å; I104-M342 VanDerWaalsContact CG1-SD 3.57Å
105	D	89.4	Confident	83.7	Confident	56 Å²	56	44.6 Å²	44.6	30%	0.299	24%	0.242	S	C	.	.	H	α-helix	trans	-62.5	-35.6	174.7	-80	-34.4	0	0	0	112.6	V101 S102 K109 R237	V101-D105 WeakPolarHBondContact O-CB 3.22Å; V101-D105 PolarHBondContact O-N 3.47Å; S102-D105 PolarHBondContact O-N 2.93Å; D105-K109 WeakPolarHBondContact O-CB 3.39Å; D105-K109 PolarHBondContact O-N 2.93Å; D105-R237 WeakPolarHBondContact OD1-CD 3.47Å; D105-R237 IonicContact OD1-CZ 2.72Å; D105-R237 IonicContact OD1-NE 2.75Å; D105-R237 PolarHBondContact OD1-NE 3.16Å; D105-R237 IonicContact OD1-NH2 3.14Å; D105-R237 IonicContact OD2-CZ 3.17Å; D105-R237 VanDerWaalsContact OD2-CZ 3.31Å; D105-R237 IonicContact OD2-NE 3.81Å; D105-R237 PolarHBondContact OD2-NE 3.41Å; D105-R237 VanDerWaalsContact OD2-NE 3.09Å; D105-R237 IonicContact OD2-NH2 3.11Å; D105-R237 PolarHBondContact OD2-NH2 2.91Å
106	A	84.6	Confident	84.8	Confident	56 Å²	56	41.4 Å²	41.4	46%	0.463	23%	0.233	S	C	.	.	H	α-helix	trans	-68.7	-42.6	174.8	0	0	0	0	0	112.4	S102 A103 I104 K109 S110	S102-A106 WeakPolarHBondContact O-CB 3.45Å; S102-A106 PolarHBondContact O-N 2.99Å; A103-A106 PolarHBondContact O-N 3.04Å; I104-A106 VanDerWaalsContact C-N 3.32Å; I104-A106 PolarHBondContact O-N 2.99Å; A106-K109 WeakPolarHBondContact O-CB 3.26Å; A106-K109 PolarHBondContact O-N 3.16Å; A106-S110 PolarHBondContact O-N 2.9Å
107	Q	86.3	Confident	85.7	Confident	5 Å²	5	45.9 Å²	45.9	2%	0.023	25%	0.247	C	C	.	.	H	α-helix	trans	-65.3	-44.1	175.2	-172.9	166.8	13.8	0	0	111.3	A103 I104 K109 S110 I111 M342	A103-Q107 PolarHBondContact O-N 2.93Å; I104-Q107 PolarHBondContact O-N 3Å; Q107-K109 VanDerWaalsContact C-N 3.33Å; Q107-K109 PolarHBondContact O-N 3.41Å; Q107-S110 WeakPolarHBondContact O-CB 3.1Å; Q107-S110 PolarHBondContact O-N 3.3Å; Q107-I111 HydrophobicContact CG-CD1 4.19Å; Q107-I111 WeakPolarHBondContact O-CG1 3.48Å; Q107-I111 PolarHBondContact O-N 3Å; Q107-M342 HydrophobicContact CB-CE 4.47Å; Q107-M342 PolarHBondContact NE2-O 3.29Å; Q107-M342 VanDerWaalsContact OE1-CB 3.26Å; Q107-M342 VanDerWaalsContact OE1-CE 3.29Å
108	M	90.4	Very high	86.2	Confident	13 Å²	13	45.2 Å²	45.2	6%	0.064	24%	0.242	C	C	.	.	H	α-helix	trans	-56	-45.2	171	-76.9	169	33.9	0	0	111.8	I104 S110 I111 N112 E233 H234	I104-M108 HydrophobicContact CG2-CG 4.42Å; I104-M108 HydrophobicContact CG2-SD 3.91Å; I104-M108 WeakPolarHBondContact O-CB 3.46Å; I104-M108 VanDerWaalsContact O-CG 3.3Å; I104-M108 WeakPolarHBondContact O-CG 3.45Å; I104-M108 PolarHBondContact O-N 3.42Å; M108-S110 VanDerWaalsContact C-N 3.33Å; M108-S110 PolarHBondContact O-N 3.46Å; M108-I111 PolarHBondContact O-N 2.96Å; M108-N112 PolarHBondContact O-N 3.09Å; M108-N112 PolarHBondContact O-ND2 3.44Å; M108-E233 HydrophobicContact CG-CB 3.39Å; M108-E233 HydrophobicContact CG-CG 4.26Å; M108-E233 HydrophobicContact SD-CB 3.93Å; M108-H234 WeakPolarHBondContact CE-CE1 3.45Å; M108-H234 WeakPolarHBondContact CE-ND1 3.46Å
109	K	88.3	Confident	86.6	Confident	129 Å²	129	41.7 Å²	41.7	56%	0.561	23%	0.232	S	C	*	.	H	α-helix	trans	-57.2	-45.3	175.8	-178.7	179.5	178	-76.6	0	111.5	D105 A106 Q107 N112 E113	D105-K109 WeakPolarHBondContact O-CB 3.39Å; D105-K109 PolarHBondContact O-N 2.93Å; A106-K109 WeakPolarHBondContact O-CB 3.26Å; A106-K109 PolarHBondContact O-N 3.16Å; Q107-K109 VanDerWaalsContact C-N 3.33Å; Q107-K109 PolarHBondContact O-N 3.41Å; K109-N112 PolarHBondContact O-N 3.31Å; K109-E113 WeakPolarHBondContact CE-OE1 3.46Å; K109-E113 IonicContact NZ-OE1 2.69Å; K109-E113 PolarHBondContact NZ-OE1 3.08Å; K109-E113 WeakPolarHBondContact O-CG 3.35Å; K109-E113 PolarHBondContact O-N 3.42Å
110	S	85.1	Confident	87.3	Confident	39 Å²	39	46 Å²	46	27%	0.273	25%	0.247	S	C	.	.	H	α-helix	trans	-61.6	-43.7	176.4	-170.1	0	0	0	0	112.5	A106 Q107 M108 N112 E113 M114	A106-S110 PolarHBondContact O-N 2.9Å; Q107-S110 WeakPolarHBondContact O-CB 3.1Å; Q107-S110 PolarHBondContact O-N 3.3Å; M108-S110 VanDerWaalsContact C-N 3.33Å; M108-S110 PolarHBondContact O-N 3.46Å; S110-N112 VanDerWaalsContact C-N 3.32Å; S110-N112 PolarHBondContact O-N 2.93Å; S110-E113 PolarHBondContact O-N 3.37Å; S110-M114 WeakPolarHBondContact O-CE 3.45Å; S110-M114 PolarHBondContact O-N 2.89Å
111	I	88.5	Confident	87.5	Confident	2 Å²	2	47.4 Å²	47.4	1%	0.01	26%	0.255	C	S	.	.	H	α-helix	trans	-61.6	-40.4	176	-63.5	161.1	0	0	0	111	Q107 M108 M114 L115 L226 L229 N230 E233 V349	Q107-I111 HydrophobicContact CG-CD1 4.19Å; Q107-I111 WeakPolarHBondContact O-CG1 3.48Å; Q107-I111 PolarHBondContact O-N 3Å; M108-I111 PolarHBondContact O-N 2.96Å; I111-M114 HydrophobicContact CG1-CE 4.36Å; I111-M114 PolarHBondContact O-N 3.4Å; I111-L115 HydrophobicContact CG2-CD1 4.35Å; I111-L115 WeakPolarHBondContact O-CG 3.45Å; I111-L115 PolarHBondContact O-N 3.25Å; I111-L226 HydrophobicContact CG2-CB 4.39Å; I111-L226 HydrophobicContact CG2-CD2 4.33Å; I111-L226 WeakPolarHBondContact CG2-O 3.34Å; I111-L229 HydrophobicContact CD1-CD2 3.84Å; I111-L229 HydrophobicContact CD1-CG 3.99Å; I111-L229 HydrophobicContact CG1-CD2 4.24Å; I111-N230 HydrophobicContact CG2-CB 3.9Å; I111-E233 HydrophobicContact CD1-CG 3.97Å; I111-V349 HydrophobicContact CG1-CG2 4.35Å
112	N	89.7	Confident	87.5	Confident	71 Å²	71	47.2 Å²	47.2	38%	0.38	25%	0.254	S	S	.	.	H	α-helix	trans	-68.3	-33.6	175.6	-76.5	-77.1	0	0	0	113.2	M108 K109 S110 L115 S116 N230	M108-N112 PolarHBondContact O-N 3.09Å; M108-N112 PolarHBondContact O-ND2 3.44Å; K109-N112 PolarHBondContact O-N 3.31Å; S110-N112 VanDerWaalsContact C-N 3.32Å; S110-N112 PolarHBondContact O-N 2.93Å; N112-L115 PolarHBondContact O-N 3.04Å; N112-S116 WeakPolarHBondContact O-CB 3.31Å; N112-S116 PolarHBondContact O-N 2.83Å; N112-N230 PolarHBondContact ND2-OD1 3.21Å
113	E	87.1	Confident	87.8	Confident	106 Å²	106	51.2 Å²	51.2	50%	0.495	26%	0.264	S	S	.	.	H	α-helix	trans	-66.1	-39.3	172.2	-74	171.6	-169.1	0	0	111.4	K109 S110 S116 Y117	K109-E113 WeakPolarHBondContact CE-OE1 3.46Å; K109-E113 IonicContact NZ-OE1 2.69Å; K109-E113 PolarHBondContact NZ-OE1 3.08Å; K109-E113 WeakPolarHBondContact O-CG 3.35Å; K109-E113 PolarHBondContact O-N 3.42Å; S110-E113 PolarHBondContact O-N 3.37Å; E113-S116 WeakPolarHBondContact O-CB 3.4Å; E113-S116 PolarHBondContact O-N 3.44Å; E113-Y117 PolarHBondContact O-N 3.21Å
114	M	86.9	Confident	88.2	Confident	19 Å²	19	53.1 Å²	53.1	9%	0.094	28%	0.279	C	S	.	.	H	α-helix	trans	-68.6	-38.8	172.7	-71.4	-178.2	-75.1	0	0	113	S110 I111 S116 Y117 F118 L226 V349 F363	S110-M114 WeakPolarHBondContact O-CE 3.45Å; S110-M114 PolarHBondContact O-N 2.89Å; I111-M114 HydrophobicContact CG1-CE 4.36Å; I111-M114 PolarHBondContact O-N 3.4Å; M114-S116 VanDerWaalsContact C-N 3.29Å; M114-S116 PolarHBondContact O-N 3.24Å; M114-Y117 WeakPolarHBondContact O-CB 3.45Å; M114-Y117 PolarHBondContact O-N 3.34Å; M114-Y117 VanDerWaalsContact O-N 3.16Å; M114-F118 WeakPolarHBondContact O-CD2 3.49Å; M114-F118 PolarHBondContact O-N 3.13Å; M114-L226 HydrophobicContact CB-CD1 4.07Å; M114-V349 HydrophobicContact CE-CB 4.38Å; M114-V349 HydrophobicContact CE-CG1 3.62Å; M114-V349 HydrophobicContact CE-CG2 3.77Å; M114-V349 HydrophobicContact SD-CG1 3.52Å; M114-V349 VanDerWaalsContact SD-CG1 3.52Å; M114-F363 HydrophobicContact CE-CZ 4.34Å; M114-F363 HydrophobicContact SD-CE1 4.27Å; M114-F363 HydrophobicContact SD-CE2 4.27Å; M114-F363 HydrophobicContact SD-CZ 3.62Å
115	L	88.2	Confident	88.2	Confident	21 Å²	21	53.6 Å²	53.6	11%	0.11	28%	0.282	C	S	.	.	H	α-helix	trans	-58.2	-41.7	169.8	-80.8	165.9	0	0	0	111.7	I111 N112 S119 A223 L226 D227 N230	I111-L115 HydrophobicContact CG2-CD1 4.35Å; I111-L115 WeakPolarHBondContact O-CG 3.45Å; I111-L115 PolarHBondContact O-N 3.25Å; N112-L115 PolarHBondContact O-N 3.04Å; L115-S119 WeakPolarHBondContact O-CB 3.44Å; L115-S119 PolarHBondContact O-N 3.31Å; L115-S119 PolarHBondContact O-OG 3.18Å; L115-A223 HydrophobicContact CD2-CB 4.27Å; L115-A223 VanDerWaalsContact CD2-O 3.27Å; L115-A223 WeakPolarHBondContact CD2-O 3.19Å; L115-L226 HydrophobicContact CD1-CB 4.45Å; L115-L226 HydrophobicContact CD2-CB 3.57Å; L115-L226 HydrophobicContact CG-CB 3.76Å; L115-D227 HydrophobicContact CD2-CB 4.23Å; L115-N230 HydrophobicContact CD1-CB 4.41Å
116	S	88.1	Confident	88.2	Confident	53 Å²	53	55.1 Å²	55.1	37%	0.371	29%	0.285	S	S	.	.	H	α-helix	trans	-65.2	-37.9	174.8	-170.6	0	0	0	0	112.1	N112 E113 M114 K120	N112-S116 WeakPolarHBondContact O-CB 3.31Å; N112-S116 PolarHBondContact O-N 2.83Å; E113-S116 WeakPolarHBondContact O-CB 3.4Å; E113-S116 PolarHBondContact O-N 3.44Å; M114-S116 VanDerWaalsContact C-N 3.29Å; M114-S116 PolarHBondContact O-N 3.24Å; S116-K120 VanDerWaalsContact O-CD 3.29Å; S116-K120 WeakPolarHBondContact O-CD 3.38Å; S116-K120 VanDerWaalsContact O-CG 3.23Å; S116-K120 WeakPolarHBondContact O-CG 3.46Å; S116-K120 PolarHBondContact O-N 2.91Å; S116-K120 WeakPolarHBondContact OG-CE 3.42Å; S116-K120 PolarHBondContact OG-NZ 3.19Å
117	Y	89.2	Confident	88.4	Confident	118 Å²	118	57.2 Å²	57.2	46%	0.463	29%	0.293	S	S	.	.	H	α-helix	trans	-63.5	-55.8	173.4	175	-92.1	0	0	0	112	E113 M114 S119 K120 L121	E113-Y117 PolarHBondContact O-N 3.21Å; M114-Y117 WeakPolarHBondContact O-CB 3.45Å; M114-Y117 PolarHBondContact O-N 3.34Å; M114-Y117 VanDerWaalsContact O-N 3.16Å; Y117-S119 VanDerWaalsContact C-N 3.27Å; Y117-S119 PolarHBondContact O-N 3.49Å; Y117-K120 WeakPolarHBondContact O-CA 3.26Å; Y117-K120 WeakPolarHBondContact O-CB 3.26Å; Y117-K120 PolarHBondContact O-N 2.85Å; Y117-L121 HydrophobicContact CE1-CD2 4.27Å; Y117-L121 PolarHBondContact O-N 2.86Å
118	F	87.8	Confident	88.5	Confident	1 Å²	1	59.8 Å²	59.8	0%	0.004	31%	0.309	C	S	.	.	H	α-helix	trans	-64.1	-33.1	-179.9	-77.6	-69.2	0	0	0	112.5	M114 K120 L121 V122 H218 T222 L226 L353 E358	M114-F118 WeakPolarHBondContact O-CD2 3.49Å; M114-F118 PolarHBondContact O-N 3.13Å; F118-K120 PolarHBondContact O-N 3.24Å; F118-L121 HydrophobicContact CD1-CD2 3.87Å; F118-L121 HydrophobicContact CE1-CD2 3.83Å; F118-L121 PolarHBondContact O-N 3.42Å; F118-V122 WeakPolarHBondContact O-CB 3.46Å; F118-V122 VanDerWaalsContact O-CG2 3.3Å; F118-V122 WeakPolarHBondContact O-CG2 3.48Å; F118-V122 PolarHBondContact O-N 2.81Å; F118-H218 HydrophobicContact CD1-CB 4.12Å; F118-H218 AromaticContact CD1-CE1 3.53Å; F118-H218 AromaticContact CD1-CG 3.9Å; F118-H218 AromaticContact CD1-ND1 3.64Å; F118-H218 AromaticContact CE1-CE1 3.45Å; F118-H218 VanDerWaalsContact CE1-CE1 3.45Å; F118-H218 WeakPolarHBondContact CE1-CE1 3.37Å; F118-H218 AromaticContact CE1-ND1 3.53Å; F118-H218 AromaticContact CE1-NE2 3.83Å; F118-T222 HydrophobicContact CD1-CG2 3.89Å; F118-T222 HydrophobicContact CD2-CG2 3.65Å; F118-T222 HydrophobicContact CE1-CG2 3.88Å; F118-T222 HydrophobicContact CE2-CG2 3.63Å; F118-T222 HydrophobicContact CG-CG2 3.8Å; F118-T222 HydrophobicContact CZ-CG2 3.76Å; F118-L226 HydrophobicContact CD2-CD1 3.75Å; F118-L226 HydrophobicContact CE2-CD1 4.23Å; F118-L353 HydrophobicContact CE2-CD2 3.61Å; F118-L353 HydrophobicContact CZ-CD2 3.58Å; F118-E358 HydrophobicContact CE1-CG 4.42Å; F118-E358 HydrophobicContact CZ-CG 4.32Å
119	S	88.2	Confident	88.4	Confident	55 Å²	55	61.1 Å²	61.1	39%	0.385	32%	0.315	S	S	.	.	H	α-helix	trans	-65.6	-18.9	171.4	-64.1	0	0	0	0	114.4	L115 Y117 K123	L115-S119 WeakPolarHBondContact O-CB 3.44Å; L115-S119 PolarHBondContact O-N 3.31Å; L115-S119 PolarHBondContact O-OG 3.18Å; Y117-S119 VanDerWaalsContact C-N 3.27Å; Y117-S119 PolarHBondContact O-N 3.49Å; S119-K123 VanDerWaalsContact O-CD 3.31Å; S119-K123 WeakPolarHBondContact O-CD 3.28Å; S119-K123 VanDerWaalsContact O-CE 3.32Å; S119-K123 WeakPolarHBondContact O-CE 3.38Å; S119-K123 WeakPolarHBondContact O-CG 3.43Å
120	K	89.7	Confident	88.3	Confident	129 Å²	129	59.6 Å²	59.6	56%	0.561	31%	0.31	S	S	*	.	H	α-helix	trans	-89	-42.1	169.9	-66.9	158.3	-169.4	165.3	0	110.9	S116 Y117 F118 V122 K123 A124	S116-K120 VanDerWaalsContact O-CD 3.29Å; S116-K120 WeakPolarHBondContact O-CD 3.38Å; S116-K120 VanDerWaalsContact O-CG 3.23Å; S116-K120 WeakPolarHBondContact O-CG 3.46Å; S116-K120 PolarHBondContact O-N 2.91Å; S116-K120 WeakPolarHBondContact OG-CE 3.42Å; S116-K120 PolarHBondContact OG-NZ 3.19Å; Y117-K120 WeakPolarHBondContact O-CA 3.26Å; Y117-K120 WeakPolarHBondContact O-CB 3.26Å; Y117-K120 PolarHBondContact O-N 2.85Å; F118-K120 PolarHBondContact O-N 3.24Å; K120-V122 PolarHBondContact O-N 2.96Å; K120-K123 WeakPolarHBondContact O-CB 3.47Å; K120-K123 PolarHBondContact O-N 3.23Å; K120-A124 PolarHBondContact O-N 3.1Å
121	L	87.4	Confident	88.3	Confident	34 Å²	34	60.5 Å²	60.5	18%	0.178	32%	0.319	C	S	.	.	H	α-helix	trans	-57.2	-50.3	177.5	-175.7	60.3	0	0	0	111.5	Y117 F118 K123 A124 E125	Y117-L121 HydrophobicContact CE1-CD2 4.27Å; Y117-L121 PolarHBondContact O-N 2.86Å; F118-L121 HydrophobicContact CD1-CD2 3.87Å; F118-L121 HydrophobicContact CE1-CD2 3.83Å; F118-L121 PolarHBondContact O-N 3.42Å; L121-K123 PolarHBondContact O-N 3.49Å; L121-K123 VanDerWaalsContact O-N 3.08Å; L121-A124 PolarHBondContact O-N 3.25Å; L121-E125 HydrophobicContact CD1-CG 4.1Å; L121-E125 HydrophobicContact CG-CG 4.31Å; L121-E125 WeakPolarHBondContact O-CG 3.34Å; L121-E125 PolarHBondContact O-N 3.5Å
122	V	89.6	Confident	88	Confident	13 Å²	13	61.8 Å²	61.8	8%	0.079	33%	0.326	C	S	.	.	H	α-helix	trans	-56.3	-28	175.3	168.9	0	0	0	0	113	F118 K120 K126 H218 K219	F118-V122 WeakPolarHBondContact O-CB 3.46Å; F118-V122 VanDerWaalsContact O-CG2 3.3Å; F118-V122 WeakPolarHBondContact O-CG2 3.48Å; F118-V122 PolarHBondContact O-N 2.81Å; K120-V122 PolarHBondContact O-N 2.96Å; V122-K126 WeakPolarHBondContact O-CB 3.47Å; V122-K126 WeakPolarHBondContact O-CD 3.38Å; V122-K126 VanDerWaalsContact O-CG 3.23Å; V122-K126 WeakPolarHBondContact O-CG 3.47Å; V122-K126 PolarHBondContact O-N 3.21Å; V122-H218 HydrophobicContact CG2-CB 3.55Å; V122-K219 HydrophobicContact CG1-CB 3.99Å; V122-K219 HydrophobicContact CG1-CG 4.36Å; V122-K219 HydrophobicContact CG2-CB 4.03Å
123	K	90.2	Very high	87.7	Confident	143 Å²	143	59.9 Å²	59.9	62%	0.622	32%	0.318	S	S	*	.	H	α-helix	trans	-78.8	-46.2	174.5	-67.2	171.3	-174.4	173.4	0	110.9	S119 K120 L121 K126 T127	S119-K123 VanDerWaalsContact O-CD 3.31Å; S119-K123 WeakPolarHBondContact O-CD 3.28Å; S119-K123 VanDerWaalsContact O-CE 3.32Å; S119-K123 WeakPolarHBondContact O-CE 3.38Å; S119-K123 WeakPolarHBondContact O-CG 3.43Å; K120-K123 WeakPolarHBondContact O-CB 3.47Å; K120-K123 PolarHBondContact O-N 3.23Å; L121-K123 PolarHBondContact O-N 3.49Å; L121-K123 VanDerWaalsContact O-N 3.08Å; K123-K126 PolarHBondContact O-N 2.89Å; K123-T127 PolarHBondContact O-N 3.37Å; K123-T127 PolarHBondContact O-OG1 2.98Å
124	A	89.3	Confident	87.4	Confident	52 Å²	52	58.8 Å²	58.8	43%	0.43	32%	0.316	S	S	.	.	H	α-helix	trans	-60.6	-47.5	179	0	0	0	0	0	112	K120 L121 K126 T127 V128	K120-A124 PolarHBondContact O-N 3.1Å; L121-A124 PolarHBondContact O-N 3.25Å; A124-K126 VanDerWaalsContact C-N 3.29Å; A124-K126 PolarHBondContact O-N 2.66Å; A124-T127 WeakPolarHBondContact O-CB 3.48Å; A124-T127 PolarHBondContact O-N 3Å; A124-T127 VanDerWaalsContact O-N 3.08Å; A124-V128 WeakPolarHBondContact O-CG2 3.29Å; A124-V128 PolarHBondContact O-N 2.98Å
125	E	88.7	Confident	87	Confident	11 Å²	11	62.3 Å²	62.3	5%	0.051	34%	0.335	C	S	.	.	H	α-helix	trans	-60.2	-38.7	176.9	-67.4	177.9	147.5	0	0	111.8	L121 V128 Q129 F211 R214 A215 H218	L121-E125 HydrophobicContact CD1-CG 4.1Å; L121-E125 HydrophobicContact CG-CG 4.31Å; L121-E125 WeakPolarHBondContact O-CG 3.34Å; L121-E125 PolarHBondContact O-N 3.5Å; E125-V128 PolarHBondContact O-N 2.99Å; E125-Q129 VanDerWaalsContact O-CB 3.27Å; E125-Q129 WeakPolarHBondContact O-CB 3.33Å; E125-Q129 PolarHBondContact O-N 3.21Å; E125-F211 HydrophobicContact CB-CD1 4.26Å; E125-F211 HydrophobicContact CG-CD1 4.23Å; E125-R214 WeakPolarHBondContact OE1-CD 3.4Å; E125-R214 VanDerWaalsContact OE1-CG 3.23Å; E125-R214 WeakPolarHBondContact OE1-CG 3.39Å; E125-R214 IonicContact OE1-NE 2.74Å; E125-R214 PolarHBondContact OE1-NE 3.15Å; E125-A215 HydrophobicContact CB-CB 3.88Å; E125-A215 WeakPolarHBondContact OE2-CA 3.3Å; E125-A215 PolarHBondContact OE2-N 2.96Å; E125-H218 IonicContact OE1-CD2 3.53Å; E125-H218 IonicContact OE2-CD2 3.05Å
126	K	88.4	Confident	86.4	Confident	87 Å²	87	62.1 Å²	62.1	38%	0.378	33%	0.334	S	S	.	.	H	α-helix	trans	-67.5	-36.2	173.2	-75.6	-178.1	178.7	-154.8	0	113.5	V122 K123 A124 V128 Q129 Q130 A215	V122-K126 WeakPolarHBondContact O-CB 3.47Å; V122-K126 WeakPolarHBondContact O-CD 3.38Å; V122-K126 VanDerWaalsContact O-CG 3.23Å; V122-K126 WeakPolarHBondContact O-CG 3.47Å; V122-K126 PolarHBondContact O-N 3.21Å; K123-K126 PolarHBondContact O-N 2.89Å; A124-K126 VanDerWaalsContact C-N 3.29Å; A124-K126 PolarHBondContact O-N 2.66Å; K126-V128 VanDerWaalsContact C-N 3.35Å; K126-Q129 PolarHBondContact O-N 2.97Å; K126-Q130 WeakPolarHBondContact O-CB 3.44Å; K126-Q130 PolarHBondContact O-N 3.42Å; K126-A215 HydrophobicContact CG-CB 3.9Å
127	T	89.9	Confident	85.4	Confident	100 Å²	100	63 Å²	63	61%	0.613	33%	0.334	S	S	*	.	H	α-helix	trans	-64.3	-40.3	172.9	-59.2	0	0	0	0	111.4	K123 A124 Q130 A131	K123-T127 PolarHBondContact O-N 3.37Å; K123-T127 PolarHBondContact O-OG1 2.98Å; A124-T127 WeakPolarHBondContact O-CB 3.48Å; A124-T127 PolarHBondContact O-N 3Å; A124-T127 VanDerWaalsContact O-N 3.08Å; T127-Q130 PolarHBondContact O-N 3.21Å; T127-A131 WeakPolarHBondContact O-CB 3.39Å; T127-A131 PolarHBondContact O-N 3.38Å
128	V	87.9	Confident	83.8	Confident	60 Å²	60	60.3 Å²	60.3	36%	0.364	33%	0.328	S	S	.	.	H	α-helix	trans	-66.3	-46	173.9	177.5	0	0	0	0	111.1	A124 E125 K126 Q130 A131 L132 F211	A124-V128 WeakPolarHBondContact O-CG2 3.29Å; A124-V128 PolarHBondContact O-N 2.98Å; E125-V128 PolarHBondContact O-N 2.99Å; K126-V128 VanDerWaalsContact C-N 3.35Å; V128-Q130 VanDerWaalsContact C-N 3.29Å; V128-Q130 PolarHBondContact O-N 3.33Å; V128-A131 PolarHBondContact O-N 3.15Å; V128-L132 HydrophobicContact CG1-CD1 3.82Å; V128-L132 HydrophobicContact CG1-CG 4.32Å; V128-L132 WeakPolarHBondContact O-CB 3.49Å; V128-L132 VanDerWaalsContact O-CG 3.32Å; V128-L132 WeakPolarHBondContact O-CG 3.32Å; V128-L132 PolarHBondContact O-N 2.89Å; V128-F211 HydrophobicContact CB-CD1 4.48Å; V128-F211 HydrophobicContact CB-CD2 4.45Å; V128-F211 HydrophobicContact CB-CG 4.39Å; V128-F211 HydrophobicContact CG1-CD1 4.3Å; V128-F211 HydrophobicContact CG1-CD2 3.61Å; V128-F211 HydrophobicContact CG1-CE1 4.23Å; V128-F211 HydrophobicContact CG1-CE2 3.53Å; V128-F211 HydrophobicContact CG1-CG 4.02Å; V128-F211 HydrophobicContact CG1-CZ 3.86Å
129	Q	87.7	Confident	82.2	Confident	40 Å²	40	64.4 Å²	64.4	19%	0.187	35%	0.347	C	S	.	.	H	α-helix	trans	-57.6	-38.7	175.9	179.3	-94.4	-83.5	0	0	112.6	E125 K126 S133 V208 F211	E125-Q129 VanDerWaalsContact O-CB 3.27Å; E125-Q129 WeakPolarHBondContact O-CB 3.33Å; E125-Q129 PolarHBondContact O-N 3.21Å; K126-Q129 PolarHBondContact O-N 2.97Å; Q129-S133 PolarHBondContact O-N 3.35Å; Q129-V208 HydrophobicContact CG-CG1 4.27Å; Q129-V208 WeakPolarHBondContact CG-O 3.19Å; Q129-F211 HydrophobicContact CB-CB 3.9Å
130	Q	86.9	Confident	80.3	Confident	97 Å²	97	68.3 Å²	68.3	45%	0.453	36%	0.357	S	S	.	.	H	α-helix	trans	-70.5	-49.8	175.3	-172	62.9	50.9	0	0	111.2	K126 T127 V128 L132 S133 D134	K126-Q130 WeakPolarHBondContact O-CB 3.44Å; K126-Q130 PolarHBondContact O-N 3.42Å; T127-Q130 PolarHBondContact O-N 3.21Å; V128-Q130 VanDerWaalsContact C-N 3.29Å; V128-Q130 PolarHBondContact O-N 3.33Å; Q130-L132 PolarHBondContact O-N 3.2Å; Q130-S133 CarbonylContact O-C 3.58Å; Q130-S133 WeakPolarHBondContact O-CA 3.48Å; Q130-S133 WeakPolarHBondContact O-CB 3.41Å; Q130-S133 PolarHBondContact O-N 3.07Å; Q130-D134 PolarHBondContact NE2-OD1 2.92Å; Q130-D134 VanDerWaalsContact O-CG 3.25Å; Q130-D134 PolarHBondContact O-N 3.27Å
131	A	84.4	Confident	78	Confident	58 Å²	58	68.8 Å²	68.8	48%	0.479	36%	0.361	S	S	.	.	H	α-helix	trans	-60.3	-32.3	-178.8	0	0	0	0	0	113.3	T127 V128 L135	T127-A131 WeakPolarHBondContact O-CB 3.39Å; T127-A131 PolarHBondContact O-N 3.38Å; V128-A131 PolarHBondContact O-N 3.15Å; A131-L135 PolarHBondContact O-N 3.16Å
132	L	83.7	Confident	75.8	Confident	30 Å²	30	70.4 Å²	70.4	16%	0.157	38%	0.375	C	S	.	.	H	α-helix	trans	-75.8	-28	172.4	-66.9	170.6	0	0	0	112.9	V128 Q130 T204 Q207 V208 F211	V128-L132 HydrophobicContact CG1-CD1 3.82Å; V128-L132 HydrophobicContact CG1-CG 4.32Å; V128-L132 WeakPolarHBondContact O-CB 3.49Å; V128-L132 VanDerWaalsContact O-CG 3.32Å; V128-L132 WeakPolarHBondContact O-CG 3.32Å; V128-L132 PolarHBondContact O-N 2.89Å; Q130-L132 PolarHBondContact O-N 3.2Å; L132-T204 HydrophobicContact CB-CG2 4.2Å; L132-T204 HydrophobicContact CD2-CG2 4.24Å; L132-T204 WeakPolarHBondContact O-CG2 3.43Å; L132-Q207 HydrophobicContact CD1-CB 3.85Å; L132-V208 HydrophobicContact CB-CG2 3.44Å; L132-V208 VanDerWaalsContact CB-CG2 3.44Å; L132-F211 HydrophobicContact CD1-CD2 3.89Å; L132-F211 HydrophobicContact CD1-CE2 4.09Å
133	S	83.2	Confident	73.5	Confident	30 Å²	30	74.4 Å²	74.4	21%	0.21	40%	0.404	C	S	.	.	H	α-helix	trans	-73.5	-43.6	173.1	-162	0	0	0	0	111.5	Q129 Q130 L135 L136 D137	Q129-S133 PolarHBondContact O-N 3.35Å; Q130-S133 CarbonylContact O-C 3.58Å; Q130-S133 WeakPolarHBondContact O-CA 3.48Å; Q130-S133 WeakPolarHBondContact O-CB 3.41Å; Q130-S133 PolarHBondContact O-N 3.07Å; S133-L135 PolarHBondContact O-N 3.21Å; S133-L136 WeakPolarHBondContact O-CA 3.47Å; S133-L136 WeakPolarHBondContact O-CB 3.47Å; S133-L136 PolarHBondContact O-N 2.98Å; S133-D137 PolarHBondContact O-N 2.97Å; S133-D137 VanDerWaalsContact O-N 3.14Å
134	D	80.5	Confident	70.9	Confident	83 Å²	83	73.1 Å²	73.1	44%	0.444	41%	0.409	S	S	.	.	H	α-helix	trans	-56.4	-36.2	176.5	-59.8	-17.5	0	0	0	111.1	Q130 L136 D138	Q130-D134 PolarHBondContact NE2-OD1 2.92Å; Q130-D134 VanDerWaalsContact O-CG 3.25Å; Q130-D134 PolarHBondContact O-N 3.27Å; D134-L136 VanDerWaalsContact C-N 3.28Å; D134-L136 PolarHBondContact O-N 3.37Å; D134-D138 PolarHBondContact O-N 3.25Å
135	L	77.4	Confident	68.6	Low	94 Å²	94	77.5 Å²	77.5	49%	0.492	43%	0.429	S	S	.	.	H	α-helix	trans	-66	-25.9	176.3	-164.3	73	0	0	0	113.6	A131 S133 T204	A131-L135 PolarHBondContact O-N 3.16Å; S133-L135 PolarHBondContact O-N 3.21Å; L135-T204 HydrophobicContact CD2-CG2 4.36Å
136	L	75.5	Confident	66	Low	17 Å²	17	80.7 Å²	80.7	9%	0.089	47%	0.466	C	S	.	.	H	α-helix	trans	-86.8	-36.1	179	-70.1	168.7	0	0	0	112.3	S133 D134 Q139 V201 T204 N205 V208	S133-L136 WeakPolarHBondContact O-CA 3.47Å; S133-L136 WeakPolarHBondContact O-CB 3.47Å; S133-L136 PolarHBondContact O-N 2.98Å; D134-L136 VanDerWaalsContact C-N 3.28Å; D134-L136 PolarHBondContact O-N 3.37Å; L136-Q139 WeakPolarHBondContact O-CB 3.23Å; L136-Q139 PolarHBondContact O-N 3.21Å; L136-V201 HydrophobicContact CD2-CB 4.42Å; L136-V201 HydrophobicContact CD2-CG1 4.07Å; L136-V201 HydrophobicContact CD2-CG2 4.36Å; L136-T204 HydrophobicContact CD1-CG2 4.02Å; L136-T204 HydrophobicContact CD2-CG2 4Å; L136-T204 HydrophobicContact CG-CG2 3.82Å; L136-N205 HydrophobicContact CD1-CB 4.48Å; L136-N205 WeakPolarHBondContact CD1-ND2 3.29Å; L136-N205 WeakPolarHBondContact CD2-ND2 3.49Å; L136-V208 HydrophobicContact CD1-CG2 4.06Å
137	D	67.4	Low	63.4	Low	72 Å²	72	82.4 Å²	82.4	39%	0.385	49%	0.488	S	S	.	.	H	α-helix	trans	-78.8	-28.1	180	-67.5	-41.9	0	0	0	112.4	S133 Q139 K140	S133-D137 PolarHBondContact O-N 2.97Å; S133-D137 VanDerWaalsContact O-N 3.14Å; D137-Q139 PolarHBondContact O-N 3.43Å; D137-K140 PolarHBondContact O-N 2.91Å; D137-K140 IonicContact OD1-NZ 3.6Å; D137-K140 PolarHBondContact OD1-NZ 3.2Å
138	D	56.9	Low	61	Low	61 Å²	61	84.9 Å²	84.9	33%	0.326	50%	0.503	S	S	.	.	H	α-helix	trans	-55.4	-16.4	167.4	-122.8	2.7	0	0	0	112.9	D134 R172	D134-D138 PolarHBondContact O-N 3.25Å; D138-R172 IonicContact OD2-CZ 3.73Å; D138-R172 IonicContact OD2-NH1 3.82Å; D138-R172 PolarHBondContact OD2-NH1 3.48Å
139	Q	53.5	Low	58.6	Low	86 Å²	86	89.6 Å²	89.6	40%	0.402	53%	0.526	S	S	.	.	H	α-helix	trans	-87.7	-39	173.4	-59.2	-74.7	-17.5	0	0	113	L136 D137 S142	L136-Q139 WeakPolarHBondContact O-CB 3.23Å; L136-Q139 PolarHBondContact O-N 3.21Å; D137-Q139 PolarHBondContact O-N 3.43Å; Q139-S142 VanDerWaalsContact O-CB 3.28Å; Q139-S142 WeakPolarHBondContact O-CB 3.38Å; Q139-S142 PolarHBondContact O-N 3.14Å; Q139-S142 PolarHBondContact O-OG 3.4Å
140	K	47.7	Very low	56.1	Low	137 Å²	137	91 Å²	91	60%	0.596	55%	0.551	S	S	*	*	H	α-helix	trans	-74.6	-30.8	-169.8	-69.4	179.7	-166.1	144.6	0	114	D137 S142 S143	D137-K140 PolarHBondContact O-N 2.91Å; D137-K140 IonicContact OD1-NZ 3.6Å; D137-K140 PolarHBondContact OD1-NZ 3.2Å; K140-S142 PolarHBondContact O-N 3.18Å; K140-S143 PolarHBondContact O-OG 2.99Å
141	E	42.1	Very low	53.5	Low	139 Å²	139	90.3 Å²	90.3	65%	0.65	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.7	-0.6	175.3	-63.2	-163.3	143.6	0	0	113.4	R169	E141-R169 IonicContact OE2-NH2 3.62Å
142	S	42.1	Very low	51.1	Low	68 Å²	68	96.3 Å²	96.3	48%	0.476	59%	0.588	S	S	.	*	T	Hydrogen-bonded Turn	trans	-86.6	-15.2	-174.5	72.7	0	0	0	0	115.8	Q139 K140 R173	Q139-S142 VanDerWaalsContact O-CB 3.28Å; Q139-S142 WeakPolarHBondContact O-CB 3.38Å; Q139-S142 PolarHBondContact O-N 3.14Å; Q139-S142 PolarHBondContact O-OG 3.4Å; K140-S142 PolarHBondContact O-N 3.18Å; S142-R173 VanDerWaalsContact CB-NH2 3.33Å
143	S	40.2	Very low	48.7	Very low	98 Å²	98	106 Å²	106	69%	0.685	62%	0.623	S	S	*	*	S	Bend	trans	-119.1	11.2	-161.4	59.6	0	0	0	0	116	K140	K140-S143 PolarHBondContact O-OG 2.99Å
144	T	36.6	Very low	46.3	Very low	116 Å²	116	109.6 Å²	109.6	71%	0.712	65%	0.648	S	S	*	*	S	Bend	trans	-123.7	23	-167.6	47.8	0	0	0	0	115.3
145	V	39.2	Very low	44.1	Very low	143 Å²	143	113.5 Å²	113.5	87%	0.867	67%	0.669	S	S	*	*			trans	-129.9	114.4	179.3	-176.6	0	0	0	0	112
146	G	35.9	Very low	41.9	Very low	79 Å²	79	115.1 Å²	115.1	81%	0.814	68%	0.683	S	S	*	*			trans	121.7	87.5	162	0	0	0	0	0	116.1
147	S	32.3	Very low	40.1	Very low	122 Å²	122	119.8 Å²	119.8	85%	0.853	71%	0.712	S	S	*	*			trans	-151.2	80.9	164.3	178.3	0	0	0	0	111
148	V	39.3	Very low	38.5	Very low	153 Å²	153	120.5 Å²	120.5	93%	0.927	73%	0.728	S	S	*	*			trans	-135.3	146.6	163.9	-177.8	0	0	0	0	107.6
149	D	37.4	Very low	37.3	Very low	159 Å²	159	125.4 Å²	125.4	85%	0.85	75%	0.751	S	S	*	*			trans	-94	163.2	-155.9	-170.3	21	0	0	0	114.9
150	G	36	Very low	36.4	Very low	68 Å²	68	130.8 Å²	130.8	70%	0.701	77%	0.767	S	S	*	*			trans	89.4	125.9	147	0	0	0	0	0	119.2
151	G	32.4	Very low	35.9	Very low	83 Å²	83	131.2 Å²	131.2	86%	0.856	78%	0.776	S	S	*	*			trans	114.5	114.2	145.3	0	0	0	0	0	117.2
152	Q	34	Very low	35.4	Very low	184 Å²	184	132.2 Å²	132.2	86%	0.86	79%	0.785	S	S	*	*			trans	-71.8	129	168.2	-60.8	174.7	-7.7	0	0	111.3
153	R	32.8	Very low	35	Very low	235 Å²	235	137.6 Å²	137.6	89%	0.887	80%	0.8	S	S	*	*				-179	153.6	108.3	-98.6	170.2	178.3	179.9	-1	113.1
154	S	32.8	Very low	34.7	Very low	105 Å²	105	142.2 Å²	142.2	73%	0.734	81%	0.808	S	S	*	*			trans	-68.6	134.8	177.5	51.6	0	0	0	0	112.9
155	N	34.8	Very low	34.5	Very low	165 Å²	165	141.3 Å²	141.3	88%	0.882	81%	0.806	S	S	*	*			trans	-156.1	116.9	132.4	-103.8	-26.7	0	0	0	112	T157	N155-T157 PolarHBondContact O-N 2.74Å
156	T	31.3	Very low	34.2	Very low	128 Å²	128	141.7 Å²	141.7	79%	0.785	80%	0.804	S	S	*	*			trans	-75.6	114.3	179.8	46.2	0	0	0	0	111.5
157	T	37.3	Very low	34	Very low	114 Å²	114	149.6 Å²	149.6	70%	0.699	81%	0.81	S	S	*	*	S	Bend	trans	-167.7	-44.7	150.5	-83.9	0	0	0	0	112.3	N155 M159	N155-T157 PolarHBondContact O-N 2.74Å; T157-M159 VanDerWaalsContact C-N 3.3Å; T157-M159 PolarHBondContact O-N 3.39Å; T157-M159 VanDerWaalsContact O-N 3.13Å
158	A	33.5	Very low	34.4	Very low	87 Å²	87	148.1 Å²	148.1	72%	0.719	80%	0.8	S	S	*	*	G	3₁₀ helix	trans	-60.3	-30.5	-167.7	0	0	0	0	0	115.6	R160	A158-R160 VanDerWaalsContact C-N 3.26Å; A158-R160 PolarHBondContact O-N 3.49Å
159	M	32.2	Very low	34.5	Very low	164 Å²	164	149.6 Å²	149.6	81%	0.808	79%	0.789	S	S	*	*	G	3₁₀ helix	trans	-74.7	-4.9	-169.6	-145.7	-177.8	-70.6	0	0	115.2	T157	T157-M159 VanDerWaalsContact C-N 3.3Å; T157-M159 PolarHBondContact O-N 3.39Å; T157-M159 VanDerWaalsContact O-N 3.13Å
160	R	34.1	Very low	34.5	Very low	200 Å²	200	145.1 Å²	145.1	76%	0.755	78%	0.78	S	S	*	*	G	3₁₀ helix	trans	-81.4	-19.2	179.8	-82	-170.5	178.9	105.1	2.8	115.2	A158	A158-R160 VanDerWaalsContact C-N 3.26Å; A158-R160 PolarHBondContact O-N 3.49Å
161	N	37.3	Very low	34.6	Very low	146 Å²	146	151.8 Å²	151.8	78%	0.781	78%	0.784	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.8	-6.3	-168.4	-72.7	-7.3	0	0	0	115.4
162	L	32.9	Very low	35.3	Very low	159 Å²	159	155.8 Å²	155.8	83%	0.832	77%	0.773	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.1	-6.6	173.5	-80.4	161.5	0	0	0	113.9	K164	L162-K164 VanDerWaalsContact C-N 3.28Å; L162-K164 PolarHBondContact O-N 3.42Å
163	F	33.2	Very low	35.7	Very low	181 Å²	181	154.4 Å²	154.4	79%	0.794	76%	0.76	S	S	*	*	S	Bend	trans	-85.7	28.6	-177.5	-85.9	-84.1	0	0	0	114.7
164	K	33.7	Very low	36.2	Very low	196 Å²	196	152 Å²	152	85%	0.852	75%	0.751	S	S	*	*	S	Bend	trans	-136.6	47.2	-173.5	-74.9	-167.1	174.7	-177.3	0	115.9	L162	L162-K164 VanDerWaalsContact C-N 3.28Å; L162-K164 PolarHBondContact O-N 3.42Å
165	S	32.7	Very low	37	Very low	96 Å²	96	152.1 Å²	152.1	67%	0.671	74%	0.743	S	S	*	*	S	Bend	trans	-153.7	164.4	156.7	58.1	0	0	0	0	111.9
166	N	32.8	Very low	37.7	Very low	152 Å²	152	146.8 Å²	146.8	81%	0.813	72%	0.716	S	S	*	*			trans	63	67.8	171.9	-59.8	-13	0	0	0	116.9	S168	N166-S168 PolarHBondContact O-N 3.07Å; N166-S168 VanDerWaalsContact O-N 3.15Å
167	Y	30.7	Very low	38.4	Very low	244 Å²	244	144.8 Å²	144.8	96%	0.957	70%	0.699	S	S	*	*			trans	-59.5	102.7	164.5	-98.1	-111.2	0	0	0	112.6
168	S	41	Very low	39.2	Very low	91 Å²	91	143.8 Å²	143.8	64%	0.636	69%	0.689	S	S	*	*	S	Bend	trans	-172.8	-53.8	153.6	55.5	0	0	0	0	112.7	N166 G170 R171	N166-S168 PolarHBondContact O-N 3.07Å; N166-S168 VanDerWaalsContact O-N 3.15Å; S168-G170 PolarHBondContact O-N 3.36Å; S168-R171 PolarHBondContact O-N 2.89Å
169	R	41.8	Very low	40.2	Very low	185 Å²	185	144.5 Å²	144.5	70%	0.698	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.7	-25.8	-166.6	-78.2	174.8	152.4	154.7	-13.6	115.1	E141 R171	E141-R169 IonicContact OE2-NH2 3.62Å; R169-R171 VanDerWaalsContact C-N 3.34Å; R169-R171 PolarHBondContact O-N 2.93Å
170	G	37.8	Very low	41.1	Very low	64 Å²	64	138.2 Å²	138.2	66%	0.66	65%	0.65	S	S	*	*	H	α-helix	trans	-69.1	-17.4	-179.8	0	0	0	0	0	116.6	S168	S168-G170 PolarHBondContact O-N 3.36Å
171	R	38.8	Very low	42	Very low	209 Å²	209	133.7 Å²	133.7	79%	0.789	64%	0.64	S	S	*	*	H	α-helix	trans	-82.7	-36.1	-177.5	-103.5	-175.9	178	-177.7	-0.4	114.2	S168 R169 R174 L175	S168-R171 PolarHBondContact O-N 2.89Å; R169-R171 VanDerWaalsContact C-N 3.34Å; R169-R171 PolarHBondContact O-N 2.93Å; R171-R174 PolarHBondContact O-N 3.41Å; R171-L175 PolarHBondContact O-N 3.4Å
172	R	46.4	Very low	42.8	Very low	166 Å²	166	135.1 Å²	135.1	63%	0.626	64%	0.64	S	S	*	*	H	α-helix	trans	-64.5	-53	-174.3	-76	-173.9	177.3	175.7	-2.1	112.7	D138 R174 L175 T176	D138-R172 IonicContact OD2-CZ 3.73Å; D138-R172 IonicContact OD2-NH1 3.82Å; D138-R172 PolarHBondContact OD2-NH1 3.48Å; R172-R174 PolarHBondContact O-N 2.91Å; R172-L175 WeakPolarHBondContact O-CA 3.47Å; R172-L175 WeakPolarHBondContact O-CB 3.37Å; R172-L175 PolarHBondContact O-N 2.95Å; R172-T176 PolarHBondContact O-N 2.78Å; R172-T176 VanDerWaalsContact O-N 3.08Å; R172-T176 PolarHBondContact O-OG1 3.36Å
173	R	42.5	Very low	43.8	Very low	155 Å²	155	132.6 Å²	132.6	59%	0.585	63%	0.627	S	S	*	*	H	α-helix	trans	-59.4	-33.5	176.5	-68	-171.1	-175.3	167.9	7.4	112.5	S142 M177	S142-R173 VanDerWaalsContact CB-NH2 3.33Å; R173-M177 WeakPolarHBondContact O-CB 3.43Å; R173-M177 VanDerWaalsContact O-CG 3.26Å; R173-M177 WeakPolarHBondContact O-CG 3.03Å; R173-M177 PolarHBondContact O-N 3.25Å
174	R	42.7	Very low	44.7	Very low	186 Å²	186	127 Å²	127	70%	0.702	61%	0.605	S	S	*	*	H	α-helix	trans	-66.5	-36.5	171.3	-103.5	-174.7	179.4	-177.5	1.1	113	R171 R172 N178	R171-R174 PolarHBondContact O-N 3.41Å; R172-R174 PolarHBondContact O-N 2.91Å; R174-N178 WeakPolarHBondContact O-CB 3.42Å; R174-N178 PolarHBondContact O-N 2.91Å; R174-N178 PolarHBondContact O-ND2 3Å; R174-N178 PolarHBondContact O-OD1 2.71Å
175	L	49.4	Very low	45.5	Very low	106 Å²	106	123.5 Å²	123.5	56%	0.555	61%	0.605	S	S	*	*	H	α-helix	trans	-64	-50	173.5	-110.3	80	0	0	0	111.3	R171 R172 M177 N178 I179	R171-L175 PolarHBondContact O-N 3.4Å; R172-L175 WeakPolarHBondContact O-CA 3.47Å; R172-L175 WeakPolarHBondContact O-CB 3.37Å; R172-L175 PolarHBondContact O-N 2.95Å; L175-M177 PolarHBondContact O-N 3.12Å; L175-N178 PolarHBondContact O-N 2.75Å; L175-N178 VanDerWaalsContact O-N 3.16Å; L175-I179 WeakPolarHBondContact O-CG1 3.27Å; L175-I179 PolarHBondContact O-N 3.19Å
176	T	48.7	Very low	46.6	Very low	53 Å²	53	125.4 Å²	125.4	33%	0.325	61%	0.608	S	S	.	*	H	α-helix	trans	-60.8	-46.6	-179.4	-43.4	0	0	0	0	111.5	R172 N178 I179 L180	R172-T176 PolarHBondContact O-N 2.78Å; R172-T176 VanDerWaalsContact O-N 3.08Å; R172-T176 PolarHBondContact O-OG1 3.36Å; T176-N178 VanDerWaalsContact C-N 3.35Å; T176-N178 PolarHBondContact O-N 2.94Å; T176-I179 PolarHBondContact O-N 3.34Å; T176-L180 HydrophobicContact CG2-CD1 4.19Å; T176-L180 WeakPolarHBondContact O-CG 3.36Å; T176-L180 PolarHBondContact O-N 3.05Å
177	M	47	Very low	47.5	Very low	87 Å²	87	123.6 Å²	123.6	43%	0.429	61%	0.607	S	S	.	*	H	α-helix	trans	-66.5	-33.1	175.6	-65.6	-64.6	-83.4	0	0	112.6	R173 L175 I179 N181	R173-M177 WeakPolarHBondContact O-CB 3.43Å; R173-M177 VanDerWaalsContact O-CG 3.26Å; R173-M177 WeakPolarHBondContact O-CG 3.03Å; R173-M177 PolarHBondContact O-N 3.25Å; L175-M177 PolarHBondContact O-N 3.12Å; M177-I179 VanDerWaalsContact C-N 3.35Å; M177-N181 WeakPolarHBondContact O-CB 3.4Å; M177-N181 PolarHBondContact O-N 2.83Å
178	N	53.7	Low	48.7	Very low	92 Å²	92	113.7 Å²	113.7	49%	0.492	57%	0.573	S	S	.	*	H	α-helix	trans	-73.2	-23.9	175.2	-75.1	-3.1	0	0	0	113.4	R174 L175 T176 K182	R174-N178 WeakPolarHBondContact O-CB 3.42Å; R174-N178 PolarHBondContact O-N 2.91Å; R174-N178 PolarHBondContact O-ND2 3Å; R174-N178 PolarHBondContact O-OD1 2.71Å; L175-N178 PolarHBondContact O-N 2.75Å; L175-N178 VanDerWaalsContact O-N 3.16Å; T176-N178 VanDerWaalsContact C-N 3.35Å; T176-N178 PolarHBondContact O-N 2.94Å; N178-K182 VanDerWaalsContact O-CB 3.31Å; N178-K182 WeakPolarHBondContact O-CB 3.49Å; N178-K182 VanDerWaalsContact O-CG 3.24Å; N178-K182 WeakPolarHBondContact O-CG 3.44Å; N178-K182 PolarHBondContact O-N 3.43Å
179	I	54.7	Low	49.7	Very low	102 Å²	102	113 Å²	113	52%	0.523	57%	0.565	S	S	.	*	H	α-helix	trans	-77	-45	173	-70.1	162.9	0	0	0	109.5	L175 T176 M177 K182	L175-I179 WeakPolarHBondContact O-CG1 3.27Å; L175-I179 PolarHBondContact O-N 3.19Å; T176-I179 PolarHBondContact O-N 3.34Å; M177-I179 VanDerWaalsContact C-N 3.35Å; I179-K182 PolarHBondContact O-N 3.49Å
180	L	51	Low	50.7	Low	32 Å²	32	110.2 Å²	110.2	17%	0.168	56%	0.564	C	S	.	*	H	α-helix	trans	-63.7	-50.2	176.2	-69.4	162.1	0	0	0	111.4	T176 K182 N183 L184 L193 L197	T176-L180 HydrophobicContact CG2-CD1 4.19Å; T176-L180 WeakPolarHBondContact O-CG 3.36Å; T176-L180 PolarHBondContact O-N 3.05Å; L180-K182 PolarHBondContact O-N 3.26Å; L180-K182 VanDerWaalsContact O-N 3.15Å; L180-N183 PolarHBondContact O-N 3.34Å; L180-L184 PolarHBondContact O-N 3.34Å; L180-L193 HydrophobicContact CD1-CD1 4.03Å; L180-L197 HydrophobicContact CD1-CD2 4.35Å
181	N	52.8	Low	52.2	Low	105 Å²	105	113 Å²	113	56%	0.561	56%	0.564	S	S	*	*	H	α-helix	trans	-70.1	-6.7	179.3	-68.1	0.5	0	0	0	114.6	M177	M177-N181 WeakPolarHBondContact O-CB 3.4Å; M177-N181 PolarHBondContact O-N 2.83Å
182	K	55.5	Low	53.7	Low	177 Å²	177	107.8 Å²	107.8	77%	0.77	55%	0.548	S	S	*	.	H	α-helix	trans	-92.1	-21	172.5	-89.5	-172.6	170.4	-162.2	0	113.8	N178 I179 L180	N178-K182 VanDerWaalsContact O-CB 3.31Å; N178-K182 WeakPolarHBondContact O-CB 3.49Å; N178-K182 VanDerWaalsContact O-CG 3.24Å; N178-K182 WeakPolarHBondContact O-CG 3.44Å; N178-K182 PolarHBondContact O-N 3.43Å; I179-K182 PolarHBondContact O-N 3.49Å; L180-K182 PolarHBondContact O-N 3.26Å; L180-K182 VanDerWaalsContact O-N 3.15Å
183	N	53	Low	54.5	Low	106 Å²	106	101.4 Å²	101.4	57%	0.567	53%	0.526	S	S	*	.	H	α-helix	trans	-111.8	-0.2	-171.3	-65.7	-6.2	0	0	0	113.3	L180	L180-N183 PolarHBondContact O-N 3.34Å
184	L	51.3	Low	55.8	Low	64 Å²	64	98 Å²	98	34%	0.335	52%	0.52	S	S	.	.			trans	-118.9	105.3	177.9	-73.7	158.4	0	0	0	109	L180 P188 L196	L180-L184 PolarHBondContact O-N 3.34Å; L184-P188 HydrophobicContact CD1-CB 4.29Å; L184-P188 HydrophobicContact CD1-CG 4.05Å; L184-L196 HydrophobicContact CD1-CD1 3.92Å
185	S	51.4	Low	57.2	Low	122 Å²	122	95.7 Å²	95.7	85%	0.853	52%	0.515	S	S	*	.	S	Bend	trans	-78.2	-21.9	-176.7	49.1	0	0	0	0	114
186	N	55.3	Low	58.3	Low	135 Å²	135	94.2 Å²	94.2	72%	0.722	51%	0.507	S	S	*	.	S	Bend	trans	-104.8	147.7	167	-66.2	-33.2	0	0	0	108.5	P188	N186-P188 VanDerWaalsContact O-CD 3.28Å; N186-P188 WeakPolarHBondContact O-CD 3.44Å; N186-P188 VanDerWaalsContact O-N 3.11Å
187	S	52.5	Low	59.2	Low	115 Å²	115	94.2 Å²	94.2	80%	0.804	51%	0.505	S	S	*	.			trans	-60.7	113.4	172.3	52.6	0	0	0	0	109.3
188	P	55.5	Low	60.4	Low	35 Å²	35	96 Å²	96	23%	0.227	51%	0.512	C	S	.	.			trans	-63.3	141.2	178.5	29.3	-36.5	0	0	0	108.9	L184 N186 E192 L193	L184-P188 HydrophobicContact CD1-CB 4.29Å; L184-P188 HydrophobicContact CD1-CG 4.05Å; N186-P188 VanDerWaalsContact O-CD 3.28Å; N186-P188 WeakPolarHBondContact O-CD 3.44Å; N186-P188 VanDerWaalsContact O-N 3.11Å; P188-E192 HydrophobicContact CB-CB 4.08Å; P188-L193 HydrophobicContact CG-CB 4.43Å
189	T	61.7	Low	61.3	Low	78 Å²	78	96.5 Å²	96.5	48%	0.479	52%	0.515	S	S	.	.			trans	-61.1	152.3	164.5	61	0	0	0	0	109.3	N191 E192 L193	T189-N191 PolarHBondContact O-N 2.86Å; T189-E192 WeakPolarHBondContact CB-OE2 3.49Å; T189-E192 WeakPolarHBondContact CG2-OE2 3.47Å; T189-E192 PolarHBondContact N-OE2 2.89Å; T189-E192 PolarHBondContact O-N 2.89Å; T189-E192 WeakPolarHBondContact OG1-CG 3.11Å; T189-E192 PolarHBondContact OG1-N 2.76Å; T189-E192 PolarHBondContact OG1-OE2 3.22Å; T189-L193 PolarHBondContact O-N 2.89Å
190	D	62.8	Low	62.2	Low	126 Å²	126	96.2 Å²	96.2	67%	0.674	51%	0.514	S	S	*	.	H	α-helix	trans	-55.1	-29.1	176.5	-69.6	-45.9	0	0	0	111.7	N194	D190-N194 WeakPolarHBondContact O-CB 3.14Å; D190-N194 VanDerWaalsContact O-CG 3.23Å; D190-N194 PolarHBondContact O-N 3.08Å; D190-N194 PolarHBondContact O-ND2 3Å
191	N	70.2	Confident	63.3	Low	123 Å²	123	97.4 Å²	97.4	66%	0.658	52%	0.522	S	S	*	.	H	α-helix	trans	-65.9	-40.1	172.9	-80.6	-24.2	0	0	0	113.7	T189 K195	T189-N191 PolarHBondContact O-N 2.86Å; N191-K195 WeakPolarHBondContact O-CB 3.13Å; N191-K195 VanDerWaalsContact O-CG 3.29Å; N191-K195 WeakPolarHBondContact O-CG 3.46Å; N191-K195 PolarHBondContact O-N 3.48Å
192	E	69.5	Low	64.4	Low	98 Å²	98	97.2 Å²	97.2	46%	0.458	52%	0.521	S	S	.	.	H	α-helix	trans	-71.9	-41.6	177.3	-71.7	161.1	120.1	0	0	111.5	P188 T189 K195 L196	P188-E192 HydrophobicContact CB-CB 4.08Å; T189-E192 WeakPolarHBondContact CB-OE2 3.49Å; T189-E192 WeakPolarHBondContact CG2-OE2 3.47Å; T189-E192 PolarHBondContact N-OE2 2.89Å; T189-E192 PolarHBondContact O-N 2.89Å; T189-E192 WeakPolarHBondContact OG1-CG 3.11Å; T189-E192 PolarHBondContact OG1-N 2.76Å; T189-E192 PolarHBondContact OG1-OE2 3.22Å; E192-K195 PolarHBondContact O-N 2.74Å; E192-L196 WeakPolarHBondContact O-CG 3.47Å; E192-L196 PolarHBondContact O-N 3.26Å
193	L	63.6	Low	65.4	Low	32 Å²	32	90.1 Å²	90.1	17%	0.168	49%	0.493	C	S	.	.	H	α-helix	trans	-62.1	-43.9	175	-174.4	61.7	0	0	0	111.2	L180 P188 T189 L196 L197	L180-L193 HydrophobicContact CD1-CD1 4.03Å; P188-L193 HydrophobicContact CG-CB 4.43Å; T189-L193 PolarHBondContact O-N 2.89Å; L193-L196 PolarHBondContact O-N 3.27Å; L193-L197 HydrophobicContact CG-CD1 4.25Å; L193-L197 WeakPolarHBondContact O-CG 3.43Å; L193-L197 PolarHBondContact O-N 2.97Å
194	N	68.9	Low	66.6	Low	85 Å²	85	85.5 Å²	85.5	46%	0.455	47%	0.469	S	S	.	.	H	α-helix	trans	-63.6	-40.3	174.7	-79.5	-47.8	0	0	0	112.6	D190 L197 Q198	D190-N194 WeakPolarHBondContact O-CB 3.14Å; D190-N194 VanDerWaalsContact O-CG 3.23Å; D190-N194 PolarHBondContact O-N 3.08Å; D190-N194 PolarHBondContact O-ND2 3Å; N194-L197 PolarHBondContact O-N 3.3Å; N194-Q198 WeakPolarHBondContact O-CB 3.36Å; N194-Q198 WeakPolarHBondContact O-CG 3.45Å; N194-Q198 PolarHBondContact O-N 2.66Å
195	K	73.3	Confident	68	Low	136 Å²	136	85.3 Å²	85.3	59%	0.591	47%	0.468	S	S	*	.	H	α-helix	trans	-61.7	-44.1	174	-79.3	174.2	178.2	-177.9	0	112.3	N191 E192 Q198 N199	N191-K195 WeakPolarHBondContact O-CB 3.13Å; N191-K195 VanDerWaalsContact O-CG 3.29Å; N191-K195 WeakPolarHBondContact O-CG 3.46Å; N191-K195 PolarHBondContact O-N 3.48Å; E192-K195 PolarHBondContact O-N 2.74Å; K195-Q198 PolarHBondContact O-N 3.3Å; K195-N199 WeakPolarHBondContact O-CB 3.38Å; K195-N199 VanDerWaalsContact O-CG 3.31Å; K195-N199 PolarHBondContact O-N 3.08Å
196	L	71.1	Confident	69.5	Low	75 Å²	75	81.3 Å²	81.3	39%	0.393	44%	0.436	S	S	.	.	H	α-helix	trans	-63.4	-42.2	177.1	-73.7	170.5	0	0	0	112	L184 E192 L193 N199 L200	L184-L196 HydrophobicContact CD1-CD1 3.92Å; E192-L196 WeakPolarHBondContact O-CG 3.47Å; E192-L196 PolarHBondContact O-N 3.26Å; L193-L196 PolarHBondContact O-N 3.27Å; L196-N199 PolarHBondContact O-N 3.07Å; L196-L200 WeakPolarHBondContact O-CB 3.26Å; L196-L200 PolarHBondContact O-N 3.3Å
197	L	68.9	Low	70.9	Confident	53 Å²	53	76.5 Å²	76.5	28%	0.277	41%	0.409	S	S	.	.	H	α-helix	trans	-65.4	-41.3	175.7	-70.9	169.6	0	0	0	112.1	L180 L193 N194 L200 V201	L180-L197 HydrophobicContact CD1-CD2 4.35Å; L193-L197 HydrophobicContact CG-CD1 4.25Å; L193-L197 WeakPolarHBondContact O-CG 3.43Å; L193-L197 PolarHBondContact O-N 2.97Å; N194-L197 PolarHBondContact O-N 3.3Å; L197-L200 PolarHBondContact O-N 3.47Å; L197-V201 WeakPolarHBondContact O-CB 3.35Å; L197-V201 VanDerWaalsContact O-CG2 3.31Å; L197-V201 WeakPolarHBondContact O-CG2 3.36Å; L197-V201 PolarHBondContact O-N 2.79Å
198	Q	70.8	Confident	72.4	Confident	124 Å²	124	71.9 Å²	71.9	58%	0.579	38%	0.376	S	S	*	.	H	α-helix	trans	-62.4	-46.5	174.3	-76	179.8	3.6	0	0	111.9	N194 K195 L200 V201 I202	N194-Q198 WeakPolarHBondContact O-CB 3.36Å; N194-Q198 WeakPolarHBondContact O-CG 3.45Å; N194-Q198 PolarHBondContact O-N 2.66Å; K195-Q198 PolarHBondContact O-N 3.3Å; Q198-L200 VanDerWaalsContact C-N 3.34Å; Q198-L200 PolarHBondContact O-N 3.2Å; Q198-V201 PolarHBondContact O-N 2.92Å; Q198-I202 WeakPolarHBondContact O-CB 3.21Å; Q198-I202 VanDerWaalsContact O-CG1 3.26Å; Q198-I202 WeakPolarHBondContact O-CG1 3.48Å; Q198-I202 PolarHBondContact O-N 3.46Å
199	N	74.1	Confident	73.8	Confident	104 Å²	104	77.7 Å²	77.7	56%	0.556	39%	0.393	S	S	*	.	H	α-helix	trans	-60.9	-41.6	177.7	-73.7	-7.6	0	0	0	112.1	K195 L196 I202 S203	K195-N199 WeakPolarHBondContact O-CB 3.38Å; K195-N199 VanDerWaalsContact O-CG 3.31Å; K195-N199 PolarHBondContact O-N 3.08Å; L196-N199 PolarHBondContact O-N 3.07Å; N199-I202 PolarHBondContact O-N 2.96Å; N199-S203 WeakPolarHBondContact O-CB 2.91Å; N199-S203 PolarHBondContact O-N 3.22Å
200	L	73.6	Confident	75	Confident	95 Å²	95	74.9 Å²	74.9	50%	0.497	38%	0.375	S	S	.	.	H	α-helix	trans	-62	-47.8	174.5	-178.7	62.9	0	0	0	111.5	L196 L197 Q198 I202 S203 T204	L196-L200 WeakPolarHBondContact O-CB 3.26Å; L196-L200 PolarHBondContact O-N 3.3Å; L197-L200 PolarHBondContact O-N 3.47Å; Q198-L200 VanDerWaalsContact C-N 3.34Å; Q198-L200 PolarHBondContact O-N 3.2Å; L200-I202 VanDerWaalsContact C-N 3.33Å; L200-I202 PolarHBondContact O-N 3.3Å; L200-S203 PolarHBondContact O-N 2.9Å; L200-T204 PolarHBondContact O-N 3.3Å; L200-T204 PolarHBondContact O-OG1 3.26Å
201	V	73.3	Confident	76.1	Confident	57 Å²	57	71.5 Å²	71.5	35%	0.345	35%	0.354	S	S	.	.	H	α-helix	trans	-60.5	-40.8	177.5	165.4	0	0	0	0	111.6	L136 L197 Q198 N205	L136-V201 HydrophobicContact CD2-CB 4.42Å; L136-V201 HydrophobicContact CD2-CG1 4.07Å; L136-V201 HydrophobicContact CD2-CG2 4.36Å; L197-V201 WeakPolarHBondContact O-CB 3.35Å; L197-V201 VanDerWaalsContact O-CG2 3.31Å; L197-V201 WeakPolarHBondContact O-CG2 3.36Å; L197-V201 PolarHBondContact O-N 2.79Å; Q198-V201 PolarHBondContact O-N 2.92Å; V201-N205 WeakPolarHBondContact O-CB 3.15Å; V201-N205 PolarHBondContact O-N 2.84Å; V201-N205 PolarHBondContact O-ND2 3.41Å
202	I	76.2	Confident	77	Confident	102 Å²	102	67.6 Å²	67.6	52%	0.523	34%	0.337	S	S	.	.	H	α-helix	trans	-64.4	-46.4	175.7	-69	163.2	0	0	0	110.5	Q198 N199 L200 N205 H206	Q198-I202 WeakPolarHBondContact O-CB 3.21Å; Q198-I202 VanDerWaalsContact O-CG1 3.26Å; Q198-I202 WeakPolarHBondContact O-CG1 3.48Å; Q198-I202 PolarHBondContact O-N 3.46Å; N199-I202 PolarHBondContact O-N 2.96Å; L200-I202 VanDerWaalsContact C-N 3.33Å; L200-I202 PolarHBondContact O-N 3.3Å; I202-N205 PolarHBondContact O-N 3.09Å; I202-H206 WeakPolarHBondContact O-CB 3.23Å; I202-H206 PolarHBondContact O-N 3.33Å
203	S	76.3	Confident	77.8	Confident	28 Å²	28	64 Å²	64	20%	0.196	32%	0.321	C	S	.	.	H	α-helix	trans	-61.2	-45.4	178.1	-173.7	0	0	0	0	112.3	N199 L200 H206 Q207	N199-S203 WeakPolarHBondContact O-CB 2.91Å; N199-S203 PolarHBondContact O-N 3.22Å; L200-S203 PolarHBondContact O-N 2.9Å; S203-H206 WeakPolarHBondContact O-CB 3.48Å; S203-H206 PolarHBondContact O-N 2.89Å; S203-Q207 WeakPolarHBondContact O-CG 3.37Å; S203-Q207 PolarHBondContact O-N 3.14Å
204	T	78.6	Confident	79	Confident	9 Å²	9	63.3 Å²	63.3	6%	0.055	32%	0.317	C	S	.	.	H	α-helix	trans	-66.3	-40.8	176.6	-58.2	0	0	0	0	111.4	L132 L135 L136 L200 H206 Q207 V208	L132-T204 HydrophobicContact CB-CG2 4.2Å; L132-T204 HydrophobicContact CD2-CG2 4.24Å; L132-T204 WeakPolarHBondContact O-CG2 3.43Å; L135-T204 HydrophobicContact CD2-CG2 4.36Å; L136-T204 HydrophobicContact CD1-CG2 4.02Å; L136-T204 HydrophobicContact CD2-CG2 4Å; L136-T204 HydrophobicContact CG-CG2 3.82Å; L200-T204 PolarHBondContact O-N 3.3Å; L200-T204 PolarHBondContact O-OG1 3.26Å; T204-H206 VanDerWaalsContact C-N 3.29Å; T204-H206 PolarHBondContact O-N 3.44Å; T204-Q207 PolarHBondContact O-N 3.08Å; T204-V208 WeakPolarHBondContact O-CG2 3.46Å; T204-V208 PolarHBondContact O-N 3.36Å
205	N	80.1	Confident	79.9	Confident	60 Å²	60	59.3 Å²	59.3	32%	0.321	30%	0.295	S	S	.	.	H	α-helix	trans	-60	-38.9	173	-89.4	-87.4	0	0	0	112.3	L136 V201 I202 R209	L136-N205 HydrophobicContact CD1-CB 4.48Å; L136-N205 WeakPolarHBondContact CD1-ND2 3.29Å; L136-N205 WeakPolarHBondContact CD2-ND2 3.49Å; V201-N205 WeakPolarHBondContact O-CB 3.15Å; V201-N205 PolarHBondContact O-N 2.84Å; V201-N205 PolarHBondContact O-ND2 3.41Å; I202-N205 PolarHBondContact O-N 3.09Å; N205-R209 WeakPolarHBondContact O-CG 3.4Å; N205-R209 PolarHBondContact O-N 3Å; N205-R209 VanDerWaalsContact O-N 3.16Å
206	H	83.4	Confident	80.6	Confident	37 Å²	37	55.7 Å²	55.7	17%	0.171	28%	0.282	C	S	.	.	H	α-helix	trans	-63.4	-47.1	175.4	-176.2	-102.7	0	0	0	111.1	I202 S203 T204 R209 M210	I202-H206 WeakPolarHBondContact O-CB 3.23Å; I202-H206 PolarHBondContact O-N 3.33Å; S203-H206 WeakPolarHBondContact O-CB 3.48Å; S203-H206 PolarHBondContact O-N 2.89Å; T204-H206 VanDerWaalsContact C-N 3.29Å; T204-H206 PolarHBondContact O-N 3.44Å; H206-R209 PolarHBondContact O-N 3Å; H206-M210 VanDerWaalsContact CE1-CE 3.48Å; H206-M210 WeakPolarHBondContact CE1-CE 3Å; H206-M210 WeakPolarHBondContact NE2-CE 3.32Å; H206-M210 WeakPolarHBondContact O-CG 3.24Å; H206-M210 PolarHBondContact O-N 3.26Å
207	Q	84.1	Confident	81.6	Confident	35 Å²	35	52.1 Å²	52.1	16%	0.164	26%	0.263	C	S	.	.	H	α-helix	trans	-62.1	-42.2	175.9	-69.8	173.1	-22.1	0	0	113	L132 S203 T204 R209 M210 F211 H473	L132-Q207 HydrophobicContact CD1-CB 3.85Å; S203-Q207 WeakPolarHBondContact O-CG 3.37Å; S203-Q207 PolarHBondContact O-N 3.14Å; T204-Q207 PolarHBondContact O-N 3.08Å; Q207-R209 VanDerWaalsContact C-N 3.27Å; Q207-R209 PolarHBondContact O-N 2.12Å; Q207-M210 WeakPolarHBondContact O-CB 3.16Å; Q207-M210 PolarHBondContact O-N 3.09Å; Q207-F211 VanDerWaalsContact O-CD2 3.29Å; Q207-F211 WeakPolarHBondContact O-CD2 3.24Å; Q207-F211 PolarHBondContact O-N 3.01Å; Q207-F211 VanDerWaalsContact O-N 3.07Å; Q207-H473 PolarHBondContact NE2-CD2 3.24Å; Q207-H473 PolarHBondContact NE2-NE2 3.27Å
208	V	84.3	Confident	82.6	Confident	18 Å²	18	49.6 Å²	49.6	11%	0.109	25%	0.25	C	S	.	.	H	α-helix	trans	-54.4	-45.3	173.3	168.1	0	0	0	0	110.9	Q129 L132 L136 T204 S212	Q129-V208 HydrophobicContact CG-CG1 4.27Å; Q129-V208 WeakPolarHBondContact CG-O 3.19Å; L132-V208 HydrophobicContact CB-CG2 3.44Å; L132-V208 VanDerWaalsContact CB-CG2 3.44Å; L136-V208 HydrophobicContact CD1-CG2 4.06Å; T204-V208 WeakPolarHBondContact O-CG2 3.46Å; T204-V208 PolarHBondContact O-N 3.36Å; V208-S212 WeakPolarHBondContact O-CB 3.32Å; V208-S212 PolarHBondContact O-N 3.3Å; V208-S212 VanDerWaalsContact O-N 3.12Å
209	R	85.3	Confident	83.4	Confident	156 Å²	156	49.5 Å²	49.5	59%	0.589	25%	0.248	S	C	*	.	H	α-helix	trans	-70.1	-39.2	178.8	-64	173.8	-176.8	-167.4	1.1	112.2	N205 H206 Q207 S212 T213 L503	N205-R209 WeakPolarHBondContact O-CG 3.4Å; N205-R209 PolarHBondContact O-N 3Å; N205-R209 VanDerWaalsContact O-N 3.16Å; H206-R209 PolarHBondContact O-N 3Å; Q207-R209 VanDerWaalsContact C-N 3.27Å; Q207-R209 PolarHBondContact O-N 2.12Å; R209-S212 WeakPolarHBondContact O-CB 3.39Å; R209-S212 PolarHBondContact O-N 2.91Å; R209-T213 PolarHBondContact O-N 3.5Å; R209-T213 PolarHBondContact O-OG1 3.08Å; R209-L503 HydrophobicContact CB-CD1 3.48Å; R209-L503 VanDerWaalsContact CB-CD1 3.48Å
210	M	85.9	Confident	84	Confident	19 Å²	19	47.9 Å²	47.9	9%	0.094	24%	0.239	C	C	.	.	H	α-helix	trans	-54.6	-56	174.5	-73.6	-66.2	149	0	0	112.3	H206 Q207 S212 T213 R214 L469 L503	H206-M210 VanDerWaalsContact CE1-CE 3.48Å; H206-M210 WeakPolarHBondContact CE1-CE 3Å; H206-M210 WeakPolarHBondContact NE2-CE 3.32Å; H206-M210 WeakPolarHBondContact O-CG 3.24Å; H206-M210 PolarHBondContact O-N 3.26Å; Q207-M210 WeakPolarHBondContact O-CB 3.16Å; Q207-M210 PolarHBondContact O-N 3.09Å; M210-S212 VanDerWaalsContact C-N 3.27Å; M210-S212 PolarHBondContact O-N 2.98Å; M210-T213 PolarHBondContact O-N 2.92Å; M210-R214 WeakPolarHBondContact O-CB 3.44Å; M210-R214 PolarHBondContact O-N 3.25Å; M210-L469 HydrophobicContact CE-CB 4.42Å; M210-L469 HydrophobicContact CE-CD1 4.21Å; M210-L469 HydrophobicContact CE-CD2 3.65Å; M210-L469 HydrophobicContact CE-CG 4.3Å; M210-L469 HydrophobicContact SD-CB 4Å; M210-L469 HydrophobicContact SD-CD1 3.9Å; M210-L469 HydrophobicContact SD-CD2 4.26Å; M210-L469 HydrophobicContact SD-CG 4.26Å; M210-L503 HydrophobicContact CE-CD1 4.31Å; M210-L503 HydrophobicContact CE-CD2 3.33Å; M210-L503 HydrophobicContact CE-CG 3.52Å; M210-L503 HydrophobicContact CG-CD2 4.47Å; M210-L503 HydrophobicContact SD-CD2 3.47Å; M210-L503 WeakPolarHBondContact SD-CD2 2.99Å; M210-L503 HydrophobicContact SD-CG 4.33Å
211	F	87.3	Confident	84.6	Confident	56 Å²	56	43.3 Å²	43.3	25%	0.246	22%	0.215	C	C	.	.	H	α-helix	trans	-65.7	-30.6	179.5	-72.4	-69.4	0	0	0	112.5	E125 V128 Q129 L132 Q207 A215	E125-F211 HydrophobicContact CB-CD1 4.26Å; E125-F211 HydrophobicContact CG-CD1 4.23Å; V128-F211 HydrophobicContact CB-CD1 4.48Å; V128-F211 HydrophobicContact CB-CD2 4.45Å; V128-F211 HydrophobicContact CB-CG 4.39Å; V128-F211 HydrophobicContact CG1-CD1 4.3Å; V128-F211 HydrophobicContact CG1-CD2 3.61Å; V128-F211 HydrophobicContact CG1-CE1 4.23Å; V128-F211 HydrophobicContact CG1-CE2 3.53Å; V128-F211 HydrophobicContact CG1-CG 4.02Å; V128-F211 HydrophobicContact CG1-CZ 3.86Å; Q129-F211 HydrophobicContact CB-CB 3.9Å; L132-F211 HydrophobicContact CD1-CD2 3.89Å; L132-F211 HydrophobicContact CD1-CE2 4.09Å; Q207-F211 VanDerWaalsContact O-CD2 3.29Å; Q207-F211 WeakPolarHBondContact O-CD2 3.24Å; Q207-F211 PolarHBondContact O-N 3.01Å; Q207-F211 VanDerWaalsContact O-N 3.07Å; F211-A215 WeakPolarHBondContact O-CB 3.49Å; F211-A215 PolarHBondContact O-N 3.24Å
212	S	87.6	Confident	85.4	Confident	41 Å²	41	40.6 Å²	40.6	29%	0.287	20%	0.198	S	C	.	.	H	α-helix	trans	-65	-51.1	173.3	-165.4	0	0	0	0	112.3	V208 R209 M210 A215 L216	V208-S212 WeakPolarHBondContact O-CB 3.32Å; V208-S212 PolarHBondContact O-N 3.3Å; V208-S212 VanDerWaalsContact O-N 3.12Å; R209-S212 WeakPolarHBondContact O-CB 3.39Å; R209-S212 PolarHBondContact O-N 2.91Å; M210-S212 VanDerWaalsContact C-N 3.27Å; M210-S212 PolarHBondContact O-N 2.98Å; S212-A215 PolarHBondContact O-N 3.01Å; S212-L216 WeakPolarHBondContact O-CG 3.22Å; S212-L216 PolarHBondContact O-N 2.95Å
213	T	87.8	Confident	86	Confident	22 Å²	22	36.5 Å²	36.5	14%	0.135	18%	0.18	C	C	.	.	H	α-helix	trans	-67.8	-38.3	-179.4	-55.1	0	0	0	0	111.8	R209 M210 L216 F217 W465 L503	R209-T213 PolarHBondContact O-N 3.5Å; R209-T213 PolarHBondContact O-OG1 3.08Å; M210-T213 PolarHBondContact O-N 2.92Å; T213-L216 PolarHBondContact O-N 3.38Å; T213-F217 PolarHBondContact O-N 2.98Å; T213-W465 HydrophobicContact CG2-CH2 4.19Å; T213-L503 HydrophobicContact CG2-CD2 4.28Å
214	R	88.5	Confident	86.5	Confident	18 Å²	18	36.4 Å²	36.4	7%	0.068	18%	0.183	C	C	.	.	H	α-helix	trans	-66.1	-43.2	175.6	-166.1	176.6	170.8	82.4	0.7	112.2	E125 M210 L216 F217 H218 G356 E358 W465	E125-R214 WeakPolarHBondContact OE1-CD 3.4Å; E125-R214 VanDerWaalsContact OE1-CG 3.23Å; E125-R214 WeakPolarHBondContact OE1-CG 3.39Å; E125-R214 IonicContact OE1-NE 2.74Å; E125-R214 PolarHBondContact OE1-NE 3.15Å; M210-R214 WeakPolarHBondContact O-CB 3.44Å; M210-R214 PolarHBondContact O-N 3.25Å; R214-L216 PolarHBondContact O-N 3.05Å; R214-F217 WeakPolarHBondContact O-CB 3.31Å; R214-F217 PolarHBondContact O-N 3.48Å; R214-F217 VanDerWaalsContact O-N 3.14Å; R214-H218 PolarHBondContact NH2-NE2 2.95Å; R214-H218 PolarHBondContact O-N 2.95Å; R214-G356 VanDerWaalsContact CZ-O 3.27Å; R214-G356 PolarHBondContact NH1-O 2.94Å; R214-G356 PolarHBondContact NH2-O 2.95Å; R214-E358 IonicContact CZ-OE1 3.57Å; R214-E358 IonicContact NH2-OE1 3.24Å; R214-E358 PolarHBondContact NH2-OE1 3.35Å; R214-W465 HydrophobicContact CB-CE3 4.4Å; R214-W465 HydrophobicContact CB-CH2 4.01Å; R214-W465 HydrophobicContact CB-CZ3 3.76Å; R214-W465 HydrophobicContact CG-CE3 4.31Å; R214-W465 HydrophobicContact CG-CH2 4.29Å; R214-W465 HydrophobicContact CG-CZ3 4.08Å
215	A	88.4	Confident	87.1	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-66.1	-25.6	174.1	0	0	0	0	0	113.4	E125 K126 F211 S212 K219	E125-A215 HydrophobicContact CB-CB 3.88Å; E125-A215 WeakPolarHBondContact OE2-CA 3.3Å; E125-A215 PolarHBondContact OE2-N 2.96Å; K126-A215 HydrophobicContact CG-CB 3.9Å; F211-A215 WeakPolarHBondContact O-CB 3.49Å; F211-A215 PolarHBondContact O-N 3.24Å; S212-A215 PolarHBondContact O-N 3.01Å; A215-K219 VanDerWaalsContact O-CB 3.24Å; A215-K219 WeakPolarHBondContact O-CB 3.24Å; A215-K219 PolarHBondContact O-N 2.93Å
216	L	88.1	Confident	87.6	Confident	61 Å²	61	33.8 Å²	33.8	32%	0.319	17%	0.168	S	C	.	.	H	α-helix	trans	-74.9	-43.7	170.1	-74.7	168.6	0	0	0	111.4	S212 T213 R214 K219 L220 I506	S212-L216 WeakPolarHBondContact O-CG 3.22Å; S212-L216 PolarHBondContact O-N 2.95Å; T213-L216 PolarHBondContact O-N 3.38Å; R214-L216 PolarHBondContact O-N 3.05Å; L216-K219 PolarHBondContact O-N 3.18Å; L216-L220 HydrophobicContact CD2-CD1 4.48Å; L216-L220 VanDerWaalsContact O-CB 3.31Å; L216-L220 WeakPolarHBondContact O-CB 3.46Å; L216-L220 VanDerWaalsContact O-CG 3.3Å; L216-L220 WeakPolarHBondContact O-CG 3.3Å; L216-L220 PolarHBondContact O-N 3.04Å; L216-I506 HydrophobicContact CB-CG1 4.36Å
217	F	90.5	Very high	88	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-58.3	-54.1	175	177.1	-85.6	0	0	0	112.2	T213 R214 K219 L220 I221 T222 F355 G356 W465 I506 L509	T213-F217 PolarHBondContact O-N 2.98Å; R214-F217 WeakPolarHBondContact O-CB 3.31Å; R214-F217 PolarHBondContact O-N 3.48Å; R214-F217 VanDerWaalsContact O-N 3.14Å; F217-K219 PolarHBondContact O-N 3.19Å; F217-L220 PolarHBondContact O-N 3.28Å; F217-I221 HydrophobicContact CD2-CB 4.2Å; F217-I221 HydrophobicContact CD2-CD1 3.55Å; F217-I221 HydrophobicContact CD2-CG1 4.4Å; F217-I221 HydrophobicContact CE2-CB 4.12Å; F217-I221 HydrophobicContact CE2-CD1 3.68Å; F217-I221 HydrophobicContact CE2-CG1 4.49Å; F217-I221 HydrophobicContact CE2-CG2 3.99Å; F217-I221 HydrophobicContact CG-CD1 4.5Å; F217-I221 HydrophobicContact CZ-CB 4.36Å; F217-I221 HydrophobicContact CZ-CG2 3.97Å; F217-I221 WeakPolarHBondContact O-CA 3.3Å; F217-I221 WeakPolarHBondContact O-CB 3.48Å; F217-I221 PolarHBondContact O-N 2.97Å; F217-T222 VanDerWaalsContact CE1-OG1 3.26Å; F217-T222 WeakPolarHBondContact CE1-OG1 3.49Å; F217-T222 PolarHBondContact O-N 3.14Å; F217-F355 AromaticContact CE2-CD1 3.89Å; F217-F355 HydrophobicContact CE2-CD1 3.89Å; F217-F355 AromaticContact CE2-CE1 3.73Å; F217-F355 HydrophobicContact CE2-CE1 3.73Å; F217-F355 AromaticContact CZ-CD1 3.6Å; F217-F355 HydrophobicContact CZ-CD1 3.6Å; F217-F355 AromaticContact CZ-CE1 3.95Å; F217-F355 HydrophobicContact CZ-CE1 3.95Å; F217-F355 HydrophobicContact CZ-CG 4.36Å; F217-F355 WeakPolarHBondContact CZ-O 3.47Å; F217-G356 VanDerWaalsContact CE1-CA 3.43Å; F217-W465 HydrophobicContact CB-CH2 3.97Å; F217-W465 HydrophobicContact CB-CZ2 3.52Å; F217-W465 HydrophobicContact CD1-CZ2 4.01Å; F217-W465 AromaticContact CD2-CZ2 3.68Å; F217-W465 HydrophobicContact CD2-CZ2 3.68Å; F217-W465 HydrophobicContact CE2-CZ2 4.38Å; F217-W465 HydrophobicContact CG-CH2 4.4Å; F217-W465 AromaticContact CG-CZ2 3.46Å; F217-W465 HydrophobicContact CG-CZ2 3.46Å; F217-W465 VanDerWaalsContact CG-CZ2 3.46Å; F217-I506 HydrophobicContact CB-CD1 4.06Å; F217-I506 HydrophobicContact CD2-CD1 4.46Å; F217-L509 HydrophobicContact CD2-CD1 3.82Å; F217-L509 HydrophobicContact CE2-CD1 4.21Å
218	H	89.9	Confident	88.2	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	18%	0.175	C	C	.	.	I	π-helix	trans	-65.1	-28.4	-178.8	-71.4	-48.7	0	0	0	112.7	F118 V122 E125 R214 T222 A223 G356 E358	F118-H218 HydrophobicContact CD1-CB 4.12Å; F118-H218 AromaticContact CD1-CE1 3.53Å; F118-H218 AromaticContact CD1-CG 3.9Å; F118-H218 AromaticContact CD1-ND1 3.64Å; F118-H218 AromaticContact CE1-CE1 3.45Å; F118-H218 VanDerWaalsContact CE1-CE1 3.45Å; F118-H218 WeakPolarHBondContact CE1-CE1 3.37Å; F118-H218 AromaticContact CE1-ND1 3.53Å; F118-H218 AromaticContact CE1-NE2 3.83Å; V122-H218 HydrophobicContact CG2-CB 3.55Å; E125-H218 IonicContact OE1-CD2 3.53Å; E125-H218 IonicContact OE2-CD2 3.05Å; R214-H218 PolarHBondContact NH2-NE2 2.95Å; R214-H218 PolarHBondContact O-N 2.95Å; H218-T222 WeakPolarHBondContact CE1-CB 3.47Å; H218-T222 WeakPolarHBondContact CE1-CG2 3.28Å; H218-T222 PolarHBondContact CE1-OG1 3.5Å; H218-T222 PolarHBondContact ND1-OG1 3.4Å; H218-T222 VanDerWaalsContact ND1-OG1 3.09Å; H218-A223 VanDerWaalsContact O-CB 3.28Å; H218-A223 WeakPolarHBondContact O-CB 3.31Å; H218-A223 PolarHBondContact O-N 2.81Å; H218-G356 WeakPolarHBondContact NE2-CA 3.41Å; H218-G356 PolarHBondContact NE2-O 3.1Å; H218-E358 IonicContact NE2-OE1 3.91Å
219	K	88.1	Confident	88.6	Confident	121 Å²	121	33.4 Å²	33.4	53%	0.526	17%	0.169	S	C	.	.	I	π-helix	trans	-75.1	-45.6	174.7	-168.4	-165.8	172.4	-161.7	0	112.7	V122 A215 L216 F217	V122-K219 HydrophobicContact CG1-CB 3.99Å; V122-K219 HydrophobicContact CG1-CG 4.36Å; V122-K219 HydrophobicContact CG2-CB 4.03Å; A215-K219 VanDerWaalsContact O-CB 3.24Å; A215-K219 WeakPolarHBondContact O-CB 3.24Å; A215-K219 PolarHBondContact O-N 2.93Å; L216-K219 PolarHBondContact O-N 3.18Å; F217-K219 PolarHBondContact O-N 3.19Å
220	L	85.9	Confident	88.9	Confident	70 Å²	70	26.5 Å²	26.5	37%	0.366	14%	0.144	S	C	.	.	I	π-helix	trans	-88.3	-50.5	-170.5	-63.6	174	0	0	0	111.6	L216 F217 I506 W510	L216-L220 HydrophobicContact CD2-CD1 4.48Å; L216-L220 VanDerWaalsContact O-CB 3.31Å; L216-L220 WeakPolarHBondContact O-CB 3.46Å; L216-L220 VanDerWaalsContact O-CG 3.3Å; L216-L220 WeakPolarHBondContact O-CG 3.3Å; L216-L220 PolarHBondContact O-N 3.04Å; F217-L220 PolarHBondContact O-N 3.28Å; L220-I506 HydrophobicContact CD1-CG1 4.04Å; L220-W510 WeakPolarHBondContact O-CZ3 3.36Å
221	I	87.4	Confident	89	Confident	0 Å²	0	27.4 Å²	27.4	0%	0	15%	0.149	C	C	.	.	I	π-helix	trans	-85.5	-69.1	-177.6	-66.3	166	0	0	0	109.4	F217 A223 G224 Q225 I506 L509 W510 A515	F217-I221 HydrophobicContact CD2-CB 4.2Å; F217-I221 HydrophobicContact CD2-CD1 3.55Å; F217-I221 HydrophobicContact CD2-CG1 4.4Å; F217-I221 HydrophobicContact CE2-CB 4.12Å; F217-I221 HydrophobicContact CE2-CD1 3.68Å; F217-I221 HydrophobicContact CE2-CG1 4.49Å; F217-I221 HydrophobicContact CE2-CG2 3.99Å; F217-I221 HydrophobicContact CG-CD1 4.5Å; F217-I221 HydrophobicContact CZ-CB 4.36Å; F217-I221 HydrophobicContact CZ-CG2 3.97Å; F217-I221 WeakPolarHBondContact O-CA 3.3Å; F217-I221 WeakPolarHBondContact O-CB 3.48Å; F217-I221 PolarHBondContact O-N 2.97Å; I221-A223 PolarHBondContact O-N 2.94Å; I221-G224 PolarHBondContact O-N 3.29Å; I221-Q225 VanDerWaalsContact O-CB 3.28Å; I221-Q225 WeakPolarHBondContact O-CB 3.37Å; I221-Q225 WeakPolarHBondContact O-CG 3.42Å; I221-Q225 PolarHBondContact O-N 3.08Å; I221-I506 HydrophobicContact CD1-CD1 4.03Å; I221-L509 HydrophobicContact CD1-CB 3.91Å; I221-W510 HydrophobicContact CG1-CE3 3.76Å; I221-W510 HydrophobicContact CG1-CZ3 4.21Å; I221-A515 HydrophobicContact CD1-CB 4.09Å; I221-A515 HydrophobicContact CG1-CB 4.33Å; I221-A515 HydrophobicContact CG2-CB 3.99Å
222	T	89.1	Confident	89.1	Confident	0 Å²	0	24.7 Å²	24.7	0%	0	14%	0.137	C	C	.	.	I	π-helix	trans	-58.5	-54.5	-170.7	-43.8	0	0	0	0	112.7	F118 F217 H218 L226 L352	F118-T222 HydrophobicContact CD1-CG2 3.89Å; F118-T222 HydrophobicContact CD2-CG2 3.65Å; F118-T222 HydrophobicContact CE1-CG2 3.88Å; F118-T222 HydrophobicContact CE2-CG2 3.63Å; F118-T222 HydrophobicContact CG-CG2 3.8Å; F118-T222 HydrophobicContact CZ-CG2 3.76Å; F217-T222 VanDerWaalsContact CE1-OG1 3.26Å; F217-T222 WeakPolarHBondContact CE1-OG1 3.49Å; F217-T222 PolarHBondContact O-N 3.14Å; H218-T222 WeakPolarHBondContact CE1-CB 3.47Å; H218-T222 WeakPolarHBondContact CE1-CG2 3.28Å; H218-T222 PolarHBondContact CE1-OG1 3.5Å; H218-T222 PolarHBondContact ND1-OG1 3.4Å; H218-T222 VanDerWaalsContact ND1-OG1 3.09Å; T222-L226 HydrophobicContact CG2-CD1 4.23Å; T222-L226 WeakPolarHBondContact O-CB 3.47Å; T222-L226 VanDerWaalsContact O-CG 3.31Å; T222-L226 WeakPolarHBondContact O-CG 3.15Å; T222-L226 PolarHBondContact O-N 3.41Å; T222-L352 HydrophobicContact CG2-CB 4.44Å
223	A	89.2	Confident	89.2	Confident	16 Å²	16	22.8 Å²	22.8	13%	0.132	12%	0.124	C	C	.	.	H	α-helix	trans	-70.4	-34.4	-180	0	0	0	0	0	113.3	L115 H218 I221 D227	L115-A223 HydrophobicContact CD2-CB 4.27Å; L115-A223 VanDerWaalsContact CD2-O 3.27Å; L115-A223 WeakPolarHBondContact CD2-O 3.19Å; H218-A223 VanDerWaalsContact O-CB 3.28Å; H218-A223 WeakPolarHBondContact O-CB 3.31Å; H218-A223 PolarHBondContact O-N 2.81Å; I221-A223 PolarHBondContact O-N 2.94Å; A223-D227 WeakPolarHBondContact O-CB 3.46Å; A223-D227 PolarHBondContact O-N 3.46Å
224	G	87.1	Confident	89.3	Confident	25 Å²	25	25.8 Å²	25.8	26%	0.258	14%	0.136	S	C	.	.	H	α-helix	trans	-68.2	-36	177.4	0	0	0	0	0	113.4	I221 S228	I221-G224 PolarHBondContact O-N 3.29Å; G224-S228 WeakPolarHBondContact O-CB 3.46Å; G224-S228 PolarHBondContact O-N 3.44Å; G224-S228 PolarHBondContact O-OG 3.24Å
225	Q	91	Very high	89.2	Confident	12 Å²	12	26.4 Å²	26.4	6%	0.056	14%	0.143	C	C	.	.	H	α-helix	trans	-74.4	-41.1	175.7	-68.2	-68.7	-47.1	0	0	111.9	I221 D227 S228 L229 L352 A515	I221-Q225 VanDerWaalsContact O-CB 3.28Å; I221-Q225 WeakPolarHBondContact O-CB 3.37Å; I221-Q225 WeakPolarHBondContact O-CG 3.42Å; I221-Q225 PolarHBondContact O-N 3.08Å; Q225-D227 VanDerWaalsContact C-N 3.34Å; Q225-D227 PolarHBondContact O-N 2.88Å; Q225-S228 PolarHBondContact O-N 3.28Å; Q225-L229 WeakPolarHBondContact O-CB 3.37Å; Q225-L229 PolarHBondContact O-N 3.22Å; Q225-L352 HydrophobicContact CB-CD1 3.61Å; Q225-L352 HydrophobicContact CB-CD2 3.55Å; Q225-L352 HydrophobicContact CB-CG 4.23Å; Q225-L352 HydrophobicContact CG-CD2 3.89Å; Q225-A515 VanDerWaalsContact CD-O 3.26Å; Q225-A515 VanDerWaalsContact CG-O 3.31Å; Q225-A515 WeakPolarHBondContact CG-O 3.43Å; Q225-A515 PolarHBondContact NE2-O 3.46Å
226	L	91.4	Very high	89.3	Confident	3 Å²	3	26.6 Å²	26.6	2%	0.016	14%	0.144	C	C	.	.	H	α-helix	trans	-63.6	-36.8	173.2	-72.3	172.2	0	0	0	112.5	I111 M114 L115 F118 T222 L229 N230 V349 L352	I111-L226 HydrophobicContact CG2-CB 4.39Å; I111-L226 HydrophobicContact CG2-CD2 4.33Å; I111-L226 WeakPolarHBondContact CG2-O 3.34Å; M114-L226 HydrophobicContact CB-CD1 4.07Å; L115-L226 HydrophobicContact CD1-CB 4.45Å; L115-L226 HydrophobicContact CD2-CB 3.57Å; L115-L226 HydrophobicContact CG-CB 3.76Å; F118-L226 HydrophobicContact CD2-CD1 3.75Å; F118-L226 HydrophobicContact CE2-CD1 4.23Å; T222-L226 HydrophobicContact CG2-CD1 4.23Å; T222-L226 WeakPolarHBondContact O-CB 3.47Å; T222-L226 VanDerWaalsContact O-CG 3.31Å; T222-L226 WeakPolarHBondContact O-CG 3.15Å; T222-L226 PolarHBondContact O-N 3.41Å; L226-L229 PolarHBondContact O-N 2.99Å; L226-N230 PolarHBondContact O-N 3.23Å; L226-V349 HydrophobicContact CD2-CG2 4.01Å; L226-L352 HydrophobicContact CD2-CD1 3.93Å; L226-L352 HydrophobicContact CG-CD1 3.97Å
227	D	90.9	Very high	89.4	Confident	65 Å²	65	27 Å²	27	35%	0.348	14%	0.141	S	C	.	.	H	α-helix	trans	-67.6	-43.3	174.7	-179	73.4	0	0	0	111	L115 A223 Q225 L229 N230 N231	L115-D227 HydrophobicContact CD2-CB 4.23Å; A223-D227 WeakPolarHBondContact O-CB 3.46Å; A223-D227 PolarHBondContact O-N 3.46Å; Q225-D227 VanDerWaalsContact C-N 3.34Å; Q225-D227 PolarHBondContact O-N 2.88Å; D227-L229 PolarHBondContact O-N 3.43Å; D227-N230 PolarHBondContact O-N 3.44Å; D227-N231 PolarHBondContact O-N 3.02Å; D227-N231 PolarHBondContact O-ND2 3.32Å; D227-N231 PolarHBondContact OD2-ND2 2.88Å
228	S	89.2	Confident	89.2	Confident	17 Å²	17	33.6 Å²	33.6	12%	0.119	17%	0.166	C	C	.	.	H	α-helix	trans	-60.4	-36	173.4	-58.2	0	0	0	0	112	G224 Q225 N231 C232	G224-S228 WeakPolarHBondContact O-CB 3.46Å; G224-S228 PolarHBondContact O-N 3.44Å; G224-S228 PolarHBondContact O-OG 3.24Å; Q225-S228 PolarHBondContact O-N 3.28Å; S228-N231 PolarHBondContact O-N 3.37Å; S228-C232 PolarHBondContact O-N 3.39Å
229	L	91.5	Very high	88.9	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-70.4	-44.1	176.4	-173.6	67.9	0	0	0	112.1	I111 Q225 L226 D227 N231 C232 E233 A345 V348 V349 V518 C521	I111-L229 HydrophobicContact CD1-CD2 3.84Å; I111-L229 HydrophobicContact CD1-CG 3.99Å; I111-L229 HydrophobicContact CG1-CD2 4.24Å; Q225-L229 WeakPolarHBondContact O-CB 3.37Å; Q225-L229 PolarHBondContact O-N 3.22Å; L226-L229 PolarHBondContact O-N 2.99Å; D227-L229 PolarHBondContact O-N 3.43Å; L229-N231 PolarHBondContact O-N 3.25Å; L229-C232 WeakPolarHBondContact O-CA 3.32Å; L229-C232 VanDerWaalsContact O-CB 3.23Å; L229-C232 WeakPolarHBondContact O-CB 3.3Å; L229-C232 PolarHBondContact O-N 2.82Å; L229-E233 PolarHBondContact O-N 3.3Å; L229-A345 HydrophobicContact CD1-CB 3.8Å; L229-A345 HydrophobicContact CD2-CB 4.27Å; L229-A345 WeakPolarHBondContact CD2-O 3.41Å; L229-A345 HydrophobicContact CG-CB 4.36Å; L229-V348 HydrophobicContact CD1-CB 4.48Å; L229-V348 HydrophobicContact CD1-CG1 4.19Å; L229-V348 HydrophobicContact CD2-CB 4.39Å; L229-V348 HydrophobicContact CD2-CG1 3.99Å; L229-V349 HydrophobicContact CD2-CG2 3.78Å; L229-V518 HydrophobicContact CB-CG2 4.02Å; L229-V518 HydrophobicContact CD1-CG2 4.13Å; L229-C521 HydrophobicContact CD1-CB 3.95Å; L229-C521 VanDerWaalsContact CD1-SG 3.55Å
230	N	91.3	Very high	88.9	Confident	11 Å²	11	28.6 Å²	28.6	6%	0.059	15%	0.145	C	C	.	.	H	α-helix	trans	-58.6	-38	173.1	-178.2	64.4	0	0	0	111.7	I111 N112 L115 L226 D227 C232 E233 H234	I111-N230 HydrophobicContact CG2-CB 3.9Å; N112-N230 PolarHBondContact ND2-OD1 3.21Å; L115-N230 HydrophobicContact CD1-CB 4.41Å; L226-N230 PolarHBondContact O-N 3.23Å; D227-N230 PolarHBondContact O-N 3.44Å; N230-C232 VanDerWaalsContact C-N 3.35Å; N230-E233 PolarHBondContact O-N 3.46Å; N230-H234 PolarHBondContact ND2-CD2 3.35Å; N230-H234 WeakPolarHBondContact O-CB 3.31Å; N230-H234 PolarHBondContact O-CD2 3.26Å; N230-H234 VanDerWaalsContact O-CD2 3.25Å; N230-H234 PolarHBondContact O-N 2.87Å
231	N	89.4	Confident	89	Confident	37 Å²	37	28.3 Å²	28.3	20%	0.198	14%	0.143	C	C	.	.	H	α-helix	trans	-68.4	-30.6	172.7	-75.2	-69.1	0	0	0	113	D227 S228 L229 C235 H696	D227-N231 PolarHBondContact O-N 3.02Å; D227-N231 PolarHBondContact O-ND2 3.32Å; D227-N231 PolarHBondContact OD2-ND2 2.88Å; S228-N231 PolarHBondContact O-N 3.37Å; L229-N231 PolarHBondContact O-N 3.25Å; N231-C235 PolarHBondContact O-N 3.06Å; N231-C235 PolarHBondContact O-SG 2.94Å; N231-C235 VanDerWaalsContact O-SG 3.41Å; N231-H696 VanDerWaalsContact CG-CE1 3.48Å
232	C	89.2	Confident	88.9	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-64.8	-50.1	171.3	-166.3	0	0	0	0	111.3	S228 L229 N230 H234 C235 L236 F693	S228-C232 PolarHBondContact O-N 3.39Å; L229-C232 WeakPolarHBondContact O-CA 3.32Å; L229-C232 VanDerWaalsContact O-CB 3.23Å; L229-C232 WeakPolarHBondContact O-CB 3.3Å; L229-C232 PolarHBondContact O-N 2.82Å; N230-C232 VanDerWaalsContact C-N 3.35Å; C232-H234 PolarHBondContact O-N 3.49Å; C232-C235 CarbonylContact O-C 3.59Å; C232-C235 WeakPolarHBondContact O-CA 3.42Å; C232-C235 WeakPolarHBondContact O-CB 3.37Å; C232-C235 PolarHBondContact O-N 3.41Å; C232-L236 PolarHBondContact O-N 3.07Å; C232-F693 HydrophobicContact CB-CE2 4.49Å; C232-F693 HydrophobicContact CB-CZ 4.13Å
233	E	88.7	Confident	88.5	Confident	0 Å²	0	30.6 Å²	30.6	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-62.8	-41.5	177.7	-66.1	-53.1	141.6	0	0	112.7	I104 M108 I111 L229 N230 C235 L236 R237 A345	I104-E233 HydrophobicContact CG2-CB 4.32Å; M108-E233 HydrophobicContact CG-CB 3.39Å; M108-E233 HydrophobicContact CG-CG 4.26Å; M108-E233 HydrophobicContact SD-CB 3.93Å; I111-E233 HydrophobicContact CD1-CG 3.97Å; L229-E233 PolarHBondContact O-N 3.3Å; N230-E233 PolarHBondContact O-N 3.46Å; E233-C235 PolarHBondContact O-N 3.05Å; E233-L236 PolarHBondContact O-N 2.92Å; E233-L236 VanDerWaalsContact O-N 3.17Å; E233-L236 WeakPolarHBondContact OE2-CD2 3.43Å; E233-R237 WeakPolarHBondContact O-CB 3.5Å; E233-R237 PolarHBondContact O-N 3.45Å; E233-A345 WeakPolarHBondContact OE1-CB 3.49Å
234	H	90.3	Very high	88.3	Confident	86 Å²	86	30 Å²	30	40%	0.398	15%	0.149	S	C	.	.	H	α-helix	trans	-56	-34.4	171.6	-90.1	-61.6	0	0	0	112.9	M108 N230 C232 R238	M108-H234 WeakPolarHBondContact CE-CE1 3.45Å; M108-H234 WeakPolarHBondContact CE-ND1 3.46Å; N230-H234 PolarHBondContact ND2-CD2 3.35Å; N230-H234 WeakPolarHBondContact O-CB 3.31Å; N230-H234 PolarHBondContact O-CD2 3.26Å; N230-H234 VanDerWaalsContact O-CD2 3.25Å; N230-H234 PolarHBondContact O-N 2.87Å; C232-H234 PolarHBondContact O-N 3.49Å; H234-R238 PolarHBondContact O-N 2.85Å
235	C	87.5	Confident	88.1	Confident	30 Å²	30	33 Å²	33	20%	0.203	16%	0.156	C	C	.	.	H	α-helix	trans	-79.6	-38.1	176.2	-72.4	0	0	0	0	112.7	N231 C232 E233 R238 T239 F525 F693	N231-C235 PolarHBondContact O-N 3.06Å; N231-C235 PolarHBondContact O-SG 2.94Å; N231-C235 VanDerWaalsContact O-SG 3.41Å; C232-C235 CarbonylContact O-C 3.59Å; C232-C235 WeakPolarHBondContact O-CA 3.42Å; C232-C235 WeakPolarHBondContact O-CB 3.37Å; C232-C235 PolarHBondContact O-N 3.41Å; E233-C235 PolarHBondContact O-N 3.05Å; C235-R238 PolarHBondContact O-N 2.94Å; C235-T239 WeakPolarHBondContact O-CB 3.42Å; C235-T239 PolarHBondContact O-N 3.03Å; C235-T239 PolarHBondContact O-OG1 3.03Å; C235-F525 HydrophobicContact CB-CE1 4.14Å; C235-F525 HydrophobicContact CB-CZ 4.14Å; C235-F693 HydrophobicContact CB-CD2 3.8Å; C235-F693 HydrophobicContact CB-CE2 3.83Å; C235-F693 VanDerWaalsContact SG-CD2 3.51Å
236	L	88.8	Confident	87.3	Confident	5 Å²	5	33.9 Å²	33.9	3%	0.026	16%	0.16	C	C	.	.	H	α-helix	trans	-56.9	-51.7	171.9	-172.8	66.7	0	0	0	111	C232 E233 R238 T239 Y240 V338 T341 M342 F525	C232-L236 PolarHBondContact O-N 3.07Å; E233-L236 PolarHBondContact O-N 2.92Å; E233-L236 VanDerWaalsContact O-N 3.17Å; E233-L236 WeakPolarHBondContact OE2-CD2 3.43Å; L236-R238 VanDerWaalsContact C-N 3.34Å; L236-R238 PolarHBondContact O-N 3.37Å; L236-T239 PolarHBondContact O-N 2.84Å; L236-Y240 WeakPolarHBondContact O-CB 3.23Å; L236-Y240 PolarHBondContact O-N 2.87Å; L236-V338 HydrophobicContact CD1-CG2 4.11Å; L236-V338 HydrophobicContact CD2-CG1 4.23Å; L236-V338 HydrophobicContact CG-CG2 4.46Å; L236-T341 HydrophobicContact CD1-CG2 4.27Å; L236-T341 HydrophobicContact CD2-CG2 3.99Å; L236-M342 HydrophobicContact CD2-CG 3.85Å; L236-F525 HydrophobicContact CD1-CD2 3.66Å; L236-F525 HydrophobicContact CD1-CE2 4.06Å
237	R	90.4	Very high	86.8	Confident	68 Å²	68	33.9 Å²	33.9	26%	0.257	16%	0.16	S	C	.	.	H	α-helix	trans	-55.2	-44.5	176.4	-167.3	-166.1	-175.6	-71.1	3.5	112.8	V101 I104 D105 E233 L241	V101-R237 HydrophobicContact CG1-CG 4.41Å; V101-R237 VanDerWaalsContact CG1-CZ 3.44Å; V101-R237 VanDerWaalsContact CG1-NH2 3.3Å; I104-R237 HydrophobicContact CD1-CB 4.49Å; I104-R237 HydrophobicContact CG2-CB 3.84Å; I104-R237 HydrophobicContact CG2-CG 4.28Å; D105-R237 WeakPolarHBondContact OD1-CD 3.47Å; D105-R237 IonicContact OD1-CZ 2.72Å; D105-R237 IonicContact OD1-NE 2.75Å; D105-R237 PolarHBondContact OD1-NE 3.16Å; D105-R237 IonicContact OD1-NH2 3.14Å; D105-R237 IonicContact OD2-CZ 3.17Å; D105-R237 VanDerWaalsContact OD2-CZ 3.31Å; D105-R237 IonicContact OD2-NE 3.81Å; D105-R237 PolarHBondContact OD2-NE 3.41Å; D105-R237 VanDerWaalsContact OD2-NE 3.09Å; D105-R237 IonicContact OD2-NH2 3.11Å; D105-R237 PolarHBondContact OD2-NH2 2.91Å; E233-R237 WeakPolarHBondContact O-CB 3.5Å; E233-R237 PolarHBondContact O-N 3.45Å; R237-L241 PolarHBondContact O-N 3.17Å
238	R	87.1	Confident	86.4	Confident	139 Å²	139	33 Å²	33	53%	0.525	15%	0.153	S	C	.	.	H	α-helix	trans	-65	-50.9	177	166.1	175	-90.1	130.8	-0.7	110.9	H234 C235 L236 L241 E242	H234-R238 PolarHBondContact O-N 2.85Å; C235-R238 PolarHBondContact O-N 2.94Å; L236-R238 VanDerWaalsContact C-N 3.34Å; L236-R238 PolarHBondContact O-N 3.37Å; R238-L241 PolarHBondContact O-N 3.27Å; R238-E242 WeakPolarHBondContact CD-OE1 3.09Å; R238-E242 HydrophobicContact CG-CG 4.28Å; R238-E242 WeakPolarHBondContact CG-OE1 3.49Å; R238-E242 IonicContact NE-OE1 3.92Å; R238-E242 WeakPolarHBondContact O-CG 3.4Å; R238-E242 PolarHBondContact O-N 2.74Å
239	T	83.6	Confident	85.8	Confident	5 Å²	5	33.3 Å²	33.3	3%	0.031	16%	0.156	C	C	.	.	H	α-helix	trans	-68.4	-36.7	-174.1	-62.3	0	0	0	0	111.9	C235 L236 L241 E242 C243 F525 I529	C235-T239 WeakPolarHBondContact O-CB 3.42Å; C235-T239 PolarHBondContact O-N 3.03Å; C235-T239 PolarHBondContact O-OG1 3.03Å; L236-T239 PolarHBondContact O-N 2.84Å; T239-L241 VanDerWaalsContact C-N 3.35Å; T239-L241 PolarHBondContact O-N 3.43Å; T239-E242 PolarHBondContact O-N 2.92Å; T239-C243 WeakPolarHBondContact O-CB 3.4Å; T239-C243 PolarHBondContact O-N 3.21Å; T239-C243 PolarHBondContact O-SG 2.96Å; T239-C243 VanDerWaalsContact O-SG 3.34Å; T239-F525 HydrophobicContact CG2-CE2 4.29Å; T239-F525 HydrophobicContact CG2-CZ 4.48Å; T239-I529 HydrophobicContact CG2-CD1 4.14Å; T239-I529 HydrophobicContact CG2-CG1 4.16Å
240	Y	88.4	Confident	85.1	Confident	12 Å²	12	34.3 Å²	34.3	5%	0.047	16%	0.16	C	C	.	.	H	α-helix	trans	-55.4	-48.5	170.6	173.6	-103.6	0	0	0	111.8	I100 V101 L236 C243 E244 L334 V338	I100-Y240 HydrophobicContact CB-CE1 4.09Å; I100-Y240 HydrophobicContact CD1-CE2 4.23Å; I100-Y240 VanDerWaalsContact CD1-OH 3.27Å; I100-Y240 WeakPolarHBondContact CD1-OH 3.31Å; I100-Y240 HydrophobicContact CG2-CD1 4.05Å; I100-Y240 HydrophobicContact CG2-CD2 4.35Å; I100-Y240 HydrophobicContact CG2-CE1 3.78Å; I100-Y240 HydrophobicContact CG2-CE2 4.1Å; I100-Y240 HydrophobicContact CG2-CG 4.35Å; V101-Y240 HydrophobicContact CG2-CD1 4.01Å; V101-Y240 HydrophobicContact CG2-CE1 4.11Å; L236-Y240 WeakPolarHBondContact O-CB 3.23Å; L236-Y240 PolarHBondContact O-N 2.87Å; Y240-C243 PolarHBondContact O-N 3.05Å; Y240-E244 HydrophobicContact CE1-CG 4.24Å; Y240-E244 HydrophobicContact CE2-CG 3.96Å; Y240-E244 WeakPolarHBondContact O-CB 3.45Å; Y240-E244 PolarHBondContact O-N 3.14Å; Y240-L334 HydrophobicContact CD2-CD2 3.81Å; Y240-L334 HydrophobicContact CD2-CG 3.95Å; Y240-L334 HydrophobicContact CE2-CD2 3.9Å; Y240-L334 HydrophobicContact CE2-CG 4.25Å; Y240-V338 HydrophobicContact CD2-CG2 4.01Å; Y240-V338 HydrophobicContact CG-CG2 4.46Å
241	L	88.3	Confident	84.5	Confident	64 Å²	64	35.1 Å²	35.1	34%	0.335	17%	0.168	S	C	.	.	H	α-helix	trans	-66.7	-38.1	178.1	-76.6	169.3	0	0	0	113.3	V101 R237 R238 T239 E245	V101-L241 HydrophobicContact CG2-CD1 4.17Å; V101-L241 HydrophobicContact CG2-CD2 3.95Å; V101-L241 HydrophobicContact CG2-CG 4.01Å; R237-L241 PolarHBondContact O-N 3.17Å; R238-L241 PolarHBondContact O-N 3.27Å; T239-L241 VanDerWaalsContact C-N 3.35Å; T239-L241 PolarHBondContact O-N 3.43Å; L241-E245 PolarHBondContact O-N 3.28Å; L241-E245 VanDerWaalsContact O-N 3.08Å
242	E	83.8	Confident	84.1	Confident	44 Å²	44	38.4 Å²	38.4	21%	0.206	18%	0.178	C	C	.	.	H	α-helix	trans	-63.8	-44	174.7	-74.2	175.9	-163.6	0	0	111.3	R238 T239 E246 S685 S689	R238-E242 WeakPolarHBondContact CD-OE1 3.09Å; R238-E242 HydrophobicContact CG-CG 4.28Å; R238-E242 WeakPolarHBondContact CG-OE1 3.49Å; R238-E242 IonicContact NE-OE1 3.92Å; R238-E242 WeakPolarHBondContact O-CG 3.4Å; R238-E242 PolarHBondContact O-N 2.74Å; T239-E242 PolarHBondContact O-N 2.92Å; E242-E246 PolarHBondContact O-N 3.41Å; E242-S685 VanDerWaalsContact CD-OG 3.23Å; E242-S685 PolarHBondContact OE2-OG 3.19Å; E242-S689 PolarHBondContact OE2-OG 3.23Å
243	C	82	Confident	83.6	Confident	4 Å²	4	39.5 Å²	39.5	3%	0.027	18%	0.183	C	C	.	.	H	α-helix	trans	-65.4	-46	175.6	-69.1	0	0	0	0	112.3	T239 Y240 E245 E246 L247 L334 F532	T239-C243 WeakPolarHBondContact O-CB 3.4Å; T239-C243 PolarHBondContact O-N 3.21Å; T239-C243 PolarHBondContact O-SG 2.96Å; T239-C243 VanDerWaalsContact O-SG 3.34Å; Y240-C243 PolarHBondContact O-N 3.05Å; C243-E245 PolarHBondContact O-N 2.98Å; C243-E246 PolarHBondContact O-N 2.92Å; C243-L247 WeakPolarHBondContact O-CB 3.42Å; C243-L247 WeakPolarHBondContact O-CG 3.22Å; C243-L247 PolarHBondContact O-N 3.3Å; C243-L334 HydrophobicContact CB-CD1 4.06Å; C243-L334 HydrophobicContact CB-CD2 3.81Å; C243-F532 HydrophobicContact CB-CE1 4.23Å; C243-F532 HydrophobicContact CB-CZ 4.29Å
244	E	84.3	Confident	83.2	Confident	3 Å²	3	41.6 Å²	41.6	1%	0.014	19%	0.191	C	C	.	.	H	α-helix	trans	-61.9	-40.8	179.2	-98.6	-66.2	130.1	0	0	113	Y240 L247 K248 R331 L334	Y240-E244 HydrophobicContact CE1-CG 4.24Å; Y240-E244 HydrophobicContact CE2-CG 3.96Å; Y240-E244 WeakPolarHBondContact O-CB 3.45Å; Y240-E244 PolarHBondContact O-N 3.14Å; E244-L247 PolarHBondContact O-N 3.42Å; E244-K248 VanDerWaalsContact O-CD 3.26Å; E244-K248 WeakPolarHBondContact O-CD 3.5Å; E244-K248 VanDerWaalsContact O-CG 3.25Å; E244-K248 WeakPolarHBondContact O-CG 3.34Å; E244-K248 PolarHBondContact O-N 2.94Å; E244-K248 VanDerWaalsContact O-N 3.1Å; E244-K248 WeakPolarHBondContact OE2-CE 3.43Å; E244-K248 IonicContact OE2-NZ 3.7Å; E244-K248 PolarHBondContact OE2-NZ 3.28Å; E244-R331 WeakPolarHBondContact OE1-CG 3.38Å; E244-R331 IonicContact OE1-CZ 2.65Å; E244-R331 IonicContact OE1-NE 3.84Å; E244-R331 PolarHBondContact OE1-NE 3.45Å; E244-R331 IonicContact OE1-NH2 2.74Å; E244-R331 PolarHBondContact OE1-NH2 3.24Å; E244-R331 IonicContact OE2-CZ 2.82Å; E244-R331 IonicContact OE2-NE 2.82Å; E244-R331 IonicContact OE2-NH2 3.31Å; E244-R331 PolarHBondContact OE2-NH2 2.68Å; E244-L334 HydrophobicContact CG-CD2 4.43Å
245	E	82.7	Confident	82.7	Confident	87 Å²	87	41.7 Å²	41.7	41%	0.407	19%	0.193	S	C	.	.	H	α-helix	trans	-74	-28.9	177	-80.1	-51.9	133.4	0	0	114.2	L241 C243 K248 S249 R252	L241-E245 PolarHBondContact O-N 3.28Å; L241-E245 VanDerWaalsContact O-N 3.08Å; C243-E245 PolarHBondContact O-N 2.98Å; E245-K248 WeakPolarHBondContact OE1-CD 3.2Å; E245-K248 WeakPolarHBondContact OE1-CE 3.28Å; E245-K248 IonicContact OE1-NZ 2.74Å; E245-K248 PolarHBondContact OE1-NZ 2.75Å; E245-S249 WeakPolarHBondContact O-CB 3.48Å; E245-S249 PolarHBondContact O-N 3.1Å; E245-R252 PolarHBondContact O-NH2 3.03Å; E245-R252 IonicContact OE2-CZ 2.89Å; E245-R252 IonicContact OE2-NH1 2.81Å; E245-R252 PolarHBondContact OE2-NH1 3.11Å; E245-R252 IonicContact OE2-NH2 3.21Å
246	E	75.4	Confident	82.4	Confident	31 Å²	31	45.5 Å²	45.5	15%	0.145	21%	0.211	C	C	.	.	H	α-helix	trans	-70.6	-41.9	168.4	-164.5	91.7	129.5	0	0	111.3	E242 C243 K248 S249 Q250 L682	E242-E246 PolarHBondContact O-N 3.41Å; C243-E246 PolarHBondContact O-N 2.92Å; E246-K248 PolarHBondContact O-N 2.76Å; E246-S249 CarbonylContact O-C 3.48Å; E246-S249 WeakPolarHBondContact O-CA 3.42Å; E246-S249 WeakPolarHBondContact O-CB 3.31Å; E246-S249 PolarHBondContact O-N 3.03Å; E246-Q250 PolarHBondContact O-N 3.45Å; E246-L682 HydrophobicContact CB-CB 4.01Å; E246-L682 HydrophobicContact CB-CD1 3.94Å; E246-L682 HydrophobicContact CB-CD2 4.29Å; E246-L682 HydrophobicContact CB-CG 4.31Å; E246-L682 HydrophobicContact CG-CB 3.63Å; E246-L682 HydrophobicContact CG-CD1 4.5Å; E246-L682 HydrophobicContact CG-CD2 4.23Å; E246-L682 HydrophobicContact CG-CG 4.34Å; E246-L682 VanDerWaalsContact OE1-CB 3.26Å; E246-L682 WeakPolarHBondContact OE1-CB 3.48Å; E246-L682 PolarHBondContact OE1-N 2.87Å
247	L	81.1	Confident	81.9	Confident	3 Å²	3	45.8 Å²	45.8	2%	0.016	21%	0.213	C	C	.	.	H	α-helix	trans	-56.2	-40.8	176.8	-76.1	175.7	0	0	0	111.4	C243 E244 A251 Y322 L326 L330 R331 F532 F536	C243-L247 WeakPolarHBondContact O-CB 3.42Å; C243-L247 WeakPolarHBondContact O-CG 3.22Å; C243-L247 PolarHBondContact O-N 3.3Å; E244-L247 PolarHBondContact O-N 3.42Å; L247-A251 PolarHBondContact O-N 2.78Å; L247-Y322 WeakPolarHBondContact CA-OH 3.24Å; L247-Y322 WeakPolarHBondContact CD2-OH 3.18Å; L247-Y322 PolarHBondContact O-OH 3.2Å; L247-L326 HydrophobicContact CB-CD1 3.84Å; L247-L326 HydrophobicContact CD1-CD1 4.06Å; L247-L326 HydrophobicContact CD2-CD1 4.08Å; L247-L326 HydrophobicContact CG-CD1 4.22Å; L247-L330 HydrophobicContact CD2-CB 4.16Å; L247-L330 HydrophobicContact CD2-CD1 3.78Å; L247-R331 HydrophobicContact CD1-CG 4.26Å; L247-F532 HydrophobicContact CD1-CE2 4.1Å; L247-F532 HydrophobicContact CD1-CZ 4.03Å; L247-F532 HydrophobicContact CD2-CE2 4.5Å; L247-F532 HydrophobicContact CD2-CZ 4.06Å; L247-F532 HydrophobicContact CG-CZ 4.14Å; L247-F536 HydrophobicContact CD2-CE2 4.46Å
248	K	80.9	Confident	81.5	Confident	46 Å²	46	42.7 Å²	42.7	20%	0.2	20%	0.202	C	C	.	.	H	α-helix	trans	-68.6	-36.9	170	-65.4	157.2	-172.3	148.9	0	112.2	E244 E245 E246 A251 R252	E244-K248 VanDerWaalsContact O-CD 3.26Å; E244-K248 WeakPolarHBondContact O-CD 3.5Å; E244-K248 VanDerWaalsContact O-CG 3.25Å; E244-K248 WeakPolarHBondContact O-CG 3.34Å; E244-K248 PolarHBondContact O-N 2.94Å; E244-K248 VanDerWaalsContact O-N 3.1Å; E244-K248 WeakPolarHBondContact OE2-CE 3.43Å; E244-K248 IonicContact OE2-NZ 3.7Å; E244-K248 PolarHBondContact OE2-NZ 3.28Å; E245-K248 WeakPolarHBondContact OE1-CD 3.2Å; E245-K248 WeakPolarHBondContact OE1-CE 3.28Å; E245-K248 IonicContact OE1-NZ 2.74Å; E245-K248 PolarHBondContact OE1-NZ 2.75Å; E246-K248 PolarHBondContact O-N 2.76Å; K248-A251 PolarHBondContact O-N 3.15Å; K248-R252 VanDerWaalsContact O-CG 3.23Å; K248-R252 WeakPolarHBondContact O-CG 3.09Å; K248-R252 PolarHBondContact O-N 2.87Å; K248-R252 PolarHBondContact O-NE 3.37Å
249	S	77.4	Confident	81.3	Confident	25 Å²	25	40.9 Å²	40.9	18%	0.175	20%	0.198	C	C	.	.	H	α-helix	trans	-64.3	-46.3	177.7	-132.4	0	0	0	0	112.7	E245 E246 A251 R252 Q253	E245-S249 WeakPolarHBondContact O-CB 3.48Å; E245-S249 PolarHBondContact O-N 3.1Å; E246-S249 CarbonylContact O-C 3.48Å; E246-S249 WeakPolarHBondContact O-CA 3.42Å; E246-S249 WeakPolarHBondContact O-CB 3.31Å; E246-S249 PolarHBondContact O-N 3.03Å; S249-A251 VanDerWaalsContact C-N 3.32Å; S249-A251 PolarHBondContact O-N 3.39Å; S249-R252 VanDerWaalsContact CB-NH2 3.27Å; S249-R252 CarbonylContact O-C 3.46Å; S249-R252 WeakPolarHBondContact O-CA 3.45Å; S249-R252 WeakPolarHBondContact O-CB 3.26Å; S249-R252 PolarHBondContact O-N 2.94Å; S249-R252 VanDerWaalsContact O-N 3.08Å; S249-R252 PolarHBondContact OG-NH2 3.43Å; S249-Q253 WeakPolarHBondContact O-CG 3.49Å; S249-Q253 PolarHBondContact O-N 3Å
250	Q	77.1	Confident	81.3	Confident	21 Å²	21	42.8 Å²	42.8	10%	0.098	21%	0.214	C	C	.	.	H	α-helix	trans	-63.1	-38.5	176.7	-169.2	63.1	74.6	0	0	111.1	E246 Q253 Y254 Y322	E246-Q250 PolarHBondContact O-N 3.45Å; Q250-Q253 VanDerWaalsContact NE2-OE1 3.09Å; Q250-Q253 WeakPolarHBondContact O-CB 3.37Å; Q250-Q253 PolarHBondContact O-N 3.02Å; Q250-Y254 HydrophobicContact CG-CD2 4.26Å; Q250-Y254 HydrophobicContact CG-CE2 3.74Å; Q250-Y254 WeakPolarHBondContact O-CD2 3.19Å; Q250-Y254 PolarHBondContact O-N 2.91Å; Q250-Y254 VanDerWaalsContact O-N 3.08Å; Q250-Y322 HydrophobicContact CB-CE1 4.27Å; Q250-Y322 HydrophobicContact CB-CE2 4.27Å; Q250-Y322 HydrophobicContact CG-CD2 4.3Å; Q250-Y322 HydrophobicContact CG-CE1 4.27Å; Q250-Y322 HydrophobicContact CG-CE2 3.75Å
251	A	77.7	Confident	81	Confident	28 Å²	28	42.4 Å²	42.4	23%	0.231	21%	0.212	C	C	.	.	H	α-helix	trans	-60.9	-44.7	169.5	0	0	0	0	0	112.5	L247 K248 S249 Q253 Y254 M255 Y322	L247-A251 PolarHBondContact O-N 2.78Å; K248-A251 PolarHBondContact O-N 3.15Å; S249-A251 VanDerWaalsContact C-N 3.32Å; S249-A251 PolarHBondContact O-N 3.39Å; A251-Q253 VanDerWaalsContact C-N 3.32Å; A251-Q253 PolarHBondContact O-N 2.88Å; A251-Y254 PolarHBondContact O-N 3.3Å; A251-M255 PolarHBondContact O-N 3.29Å; A251-Y322 HydrophobicContact CB-CE1 4.01Å
252	R	81.4	Confident	80.4	Confident	106 Å²	106	40.9 Å²	40.9	40%	0.4	20%	0.204	S	C	.	.	H	α-helix	trans	-60.5	-39.4	174.5	-69.2	174.8	-58.8	-124.1	4.1	111.2	E245 K248 S249 L256	E245-R252 PolarHBondContact O-NH2 3.03Å; E245-R252 IonicContact OE2-CZ 2.89Å; E245-R252 IonicContact OE2-NH1 2.81Å; E245-R252 PolarHBondContact OE2-NH1 3.11Å; E245-R252 IonicContact OE2-NH2 3.21Å; K248-R252 VanDerWaalsContact O-CG 3.23Å; K248-R252 WeakPolarHBondContact O-CG 3.09Å; K248-R252 PolarHBondContact O-N 2.87Å; K248-R252 PolarHBondContact O-NE 3.37Å; S249-R252 VanDerWaalsContact CB-NH2 3.27Å; S249-R252 CarbonylContact O-C 3.46Å; S249-R252 WeakPolarHBondContact O-CA 3.45Å; S249-R252 WeakPolarHBondContact O-CB 3.26Å; S249-R252 PolarHBondContact O-N 2.94Å; S249-R252 VanDerWaalsContact O-N 3.08Å; S249-R252 PolarHBondContact OG-NH2 3.43Å; R252-L256 WeakPolarHBondContact O-CB 3.4Å; R252-L256 VanDerWaalsContact O-CG 3.27Å; R252-L256 WeakPolarHBondContact O-CG 3.41Å; R252-L256 PolarHBondContact O-N 3.16Å
253	Q	79.3	Confident	80.3	Confident	22 Å²	22	46.8 Å²	46.8	10%	0.103	23%	0.229	C	C	.	.	H	α-helix	trans	-62.2	-49.1	176.3	-71	-157.5	-26.5	0	0	112.6	S249 Q250 A251 M255 L256 S257 E678	S249-Q253 WeakPolarHBondContact O-CG 3.49Å; S249-Q253 PolarHBondContact O-N 3Å; Q250-Q253 VanDerWaalsContact NE2-OE1 3.09Å; Q250-Q253 WeakPolarHBondContact O-CB 3.37Å; Q250-Q253 PolarHBondContact O-N 3.02Å; A251-Q253 VanDerWaalsContact C-N 3.32Å; A251-Q253 PolarHBondContact O-N 2.88Å; Q253-M255 VanDerWaalsContact C-N 3.34Å; Q253-M255 PolarHBondContact O-N 3.35Å; Q253-L256 PolarHBondContact O-N 3.29Å; Q253-L256 VanDerWaalsContact O-N 3.14Å; Q253-S257 WeakPolarHBondContact O-CB 3.49Å; Q253-S257 PolarHBondContact O-N 3.07Å; Q253-E678 PolarHBondContact NE2-OE2 3.41Å
254	Y	80.5	Confident	80.3	Confident	44 Å²	44	48 Å²	48	17%	0.173	23%	0.233	C	C	.	.	H	α-helix	trans	-59.1	-44.8	178.9	-75.1	-62.2	0	0	0	111.5	Q250 A251 L256 S257 L258 T318 A319 Y322	Q250-Y254 HydrophobicContact CG-CD2 4.26Å; Q250-Y254 HydrophobicContact CG-CE2 3.74Å; Q250-Y254 WeakPolarHBondContact O-CD2 3.19Å; Q250-Y254 PolarHBondContact O-N 2.91Å; Q250-Y254 VanDerWaalsContact O-N 3.08Å; A251-Y254 PolarHBondContact O-N 3.3Å; Y254-L256 PolarHBondContact O-N 2.92Å; Y254-S257 WeakPolarHBondContact O-CB 3.49Å; Y254-S257 PolarHBondContact O-N 3.01Å; Y254-L258 WeakPolarHBondContact O-CG 3.37Å; Y254-L258 PolarHBondContact O-N 3.37Å; Y254-T318 HydrophobicContact CE1-CG2 3.53Å; Y254-A319 HydrophobicContact CD1-CB 4.25Å; Y254-A319 HydrophobicContact CG-CB 4.2Å; Y254-Y322 AromaticContact CD2-CD1 3.72Å; Y254-Y322 HydrophobicContact CD2-CD1 3.72Å; Y254-Y322 HydrophobicContact CD2-CE1 4.43Å; Y254-Y322 AromaticContact CD2-CG 3.8Å; Y254-Y322 HydrophobicContact CD2-CG 3.8Å; Y254-Y322 AromaticContact CE2-CD1 3.79Å; Y254-Y322 HydrophobicContact CE2-CD1 3.79Å; Y254-Y322 AromaticContact CE2-CD2 3.78Å; Y254-Y322 HydrophobicContact CE2-CD2 3.78Å; Y254-Y322 HydrophobicContact CE2-CE1 4.49Å; Y254-Y322 HydrophobicContact CE2-CE2 4.48Å; Y254-Y322 AromaticContact CE2-CG 3.4Å; Y254-Y322 HydrophobicContact CE2-CG 3.4Å
255	M	79	Confident	80.1	Confident	89 Å²	89	48 Å²	48	44%	0.438	23%	0.233	S	C	.	.	H	α-helix	trans	-60.4	-41.4	174.3	-178.5	-169	56.3	0	0	112.7	A251 Q253 K259	A251-M255 PolarHBondContact O-N 3.29Å; Q253-M255 VanDerWaalsContact C-N 3.34Å; Q253-M255 PolarHBondContact O-N 3.35Å; M255-K259 HydrophobicContact CG-CD 4.4Å; M255-K259 WeakPolarHBondContact O-CG 3.37Å; M255-K259 PolarHBondContact O-N 3.32Å
256	L	82.4	Confident	79.7	Confident	109 Å²	109	49 Å²	49	57%	0.571	24%	0.236	S	C	*	.	H	α-helix	trans	-68.9	-36.3	178	-73.2	170.1	0	0	0	112.1	R252 Q253 Y254 A260	R252-L256 WeakPolarHBondContact O-CB 3.4Å; R252-L256 VanDerWaalsContact O-CG 3.27Å; R252-L256 WeakPolarHBondContact O-CG 3.41Å; R252-L256 PolarHBondContact O-N 3.16Å; Q253-L256 PolarHBondContact O-N 3.29Å; Q253-L256 VanDerWaalsContact O-N 3.14Å; Y254-L256 PolarHBondContact O-N 2.92Å; L256-A260 PolarHBondContact O-N 3.4Å
257	S	78.3	Confident	80	Confident	12 Å²	12	53.3 Å²	53.3	8%	0.084	26%	0.255	C	S	.	.	H	α-helix	trans	-60.8	-53.9	173.9	-168.6	0	0	0	0	110.5	Q253 Y254 K259 A260 Y261	Q253-S257 WeakPolarHBondContact O-CB 3.49Å; Q253-S257 PolarHBondContact O-N 3.07Å; Y254-S257 WeakPolarHBondContact O-CB 3.49Å; Y254-S257 PolarHBondContact O-N 3.01Å; S257-K259 VanDerWaalsContact C-N 3.29Å; S257-K259 PolarHBondContact O-N 2.86Å; S257-A260 WeakPolarHBondContact O-CA 3.41Å; S257-A260 WeakPolarHBondContact O-CB 3.44Å; S257-A260 PolarHBondContact O-N 3.27Å; S257-Y261 VanDerWaalsContact O-CD2 3.3Å; S257-Y261 WeakPolarHBondContact O-CD2 3.45Å; S257-Y261 PolarHBondContact O-N 3.48Å
258	L	82	Confident	79.8	Confident	3 Å²	3	53.5 Å²	53.5	2%	0.016	26%	0.255	C	S	.	.	H	α-helix	trans	-56.1	-41	179.1	-66.9	172.8	0	0	0	112.7	Y254 A260 Y261 E262 Y312 A315 L316 A319	Y254-L258 WeakPolarHBondContact O-CG 3.37Å; Y254-L258 PolarHBondContact O-N 3.37Å; L258-A260 VanDerWaalsContact C-N 3.35Å; L258-A260 PolarHBondContact O-N 2.87Å; L258-Y261 PolarHBondContact O-N 2.97Å; L258-E262 WeakPolarHBondContact O-CB 3.39Å; L258-E262 PolarHBondContact O-N 2.88Å; L258-Y312 HydrophobicContact CB-CE2 4.4Å; L258-Y312 HydrophobicContact CD2-CD2 4.01Å; L258-Y312 HydrophobicContact CD2-CE2 3.7Å; L258-A315 HydrophobicContact CD2-CB 4Å; L258-L316 HydrophobicContact CD1-CD1 3.98Å; L258-L316 HydrophobicContact CD2-CB 4.01Å; L258-L316 HydrophobicContact CD2-CD1 4.26Å; L258-A319 HydrophobicContact CD1-CB 3.91Å
259	K	82.6	Confident	79.6	Confident	100 Å²	100	52.8 Å²	52.8	44%	0.435	25%	0.253	S	S	.	.	H	α-helix	trans	-66.2	-31.9	174.4	-72.3	177.3	178.4	179.6	0	113.7	M255 S257 K263	M255-K259 HydrophobicContact CG-CD 4.4Å; M255-K259 WeakPolarHBondContact O-CG 3.37Å; M255-K259 PolarHBondContact O-N 3.32Å; S257-K259 VanDerWaalsContact C-N 3.29Å; S257-K259 PolarHBondContact O-N 2.86Å; K259-K263 WeakPolarHBondContact O-CB 3.27Å; K259-K263 PolarHBondContact O-N 2.91Å
260	A	83.4	Confident	79.7	Confident	45 Å²	45	53.7 Å²	53.7	37%	0.372	27%	0.267	S	S	.	.	H	α-helix	trans	-69.3	-37	172.9	0	0	0	0	0	111.7	L256 S257 L258 K264	L256-A260 PolarHBondContact O-N 3.4Å; S257-A260 WeakPolarHBondContact O-CA 3.41Å; S257-A260 WeakPolarHBondContact O-CB 3.44Å; S257-A260 PolarHBondContact O-N 3.27Å; L258-A260 VanDerWaalsContact C-N 3.35Å; L258-A260 PolarHBondContact O-N 2.87Å; A260-K264 WeakPolarHBondContact O-CD 3.43Å; A260-K264 VanDerWaalsContact O-CG 3.25Å; A260-K264 WeakPolarHBondContact O-CG 3.44Å; A260-K264 PolarHBondContact O-N 3.05Å; A260-K264 VanDerWaalsContact O-N 3.1Å
261	Y	81.8	Confident	79.8	Confident	4 Å²	4	56.6 Å²	56.6	2%	0.016	28%	0.28	C	S	.	.	H	α-helix	trans	-67.6	-47	172.7	-81.1	-83.6	0	0	0	112.4	S257 L258 K263 K264 Y265 L308 E311 Q672	S257-Y261 VanDerWaalsContact O-CD2 3.3Å; S257-Y261 WeakPolarHBondContact O-CD2 3.45Å; S257-Y261 PolarHBondContact O-N 3.48Å; L258-Y261 PolarHBondContact O-N 2.97Å; Y261-K263 VanDerWaalsContact C-N 3.33Å; Y261-K263 PolarHBondContact O-N 3.31Å; Y261-K264 WeakPolarHBondContact O-CB 3.31Å; Y261-K264 PolarHBondContact O-N 3.4Å; Y261-K264 VanDerWaalsContact O-N 3.1Å; Y261-Y265 WeakPolarHBondContact O-CB 3.35Å; Y261-Y265 PolarHBondContact O-N 2.86Å; Y261-L308 HydrophobicContact CD1-CD1 3.5Å; Y261-L308 VanDerWaalsContact CD1-CD1 3.5Å; Y261-L308 HydrophobicContact CD1-CG 4.23Å; Y261-L308 HydrophobicContact CE1-CD1 3.63Å; Y261-E311 HydrophobicContact CD1-CB 4.12Å; Y261-E311 HydrophobicContact CE1-CB 3.41Å; Y261-E311 VanDerWaalsContact CE1-CB 3.41Å; Y261-E311 HydrophobicContact CE1-CG 4.16Å; Y261-E311 WeakPolarHBondContact CE1-OE2 3.37Å; Y261-E311 PolarHBondContact OH-OE1 3.01Å; Y261-Q672 HydrophobicContact CE2-CG 4.01Å; Y261-Q672 VanDerWaalsContact CE2-NE2 3.26Å; Y261-Q672 VanDerWaalsContact OH-CD 3.27Å; Y261-Q672 VanDerWaalsContact OH-CG 3.29Å; Y261-Q672 WeakPolarHBondContact OH-CG 3.38Å; Y261-Q672 PolarHBondContact OH-NE2 2.86Å
262	E	74.8	Confident	79.9	Confident	33 Å²	33	55.7 Å²	55.7	15%	0.154	27%	0.272	C	S	.	.	H	α-helix	trans	-51.3	-49.7	172.8	174.4	172.9	-125.1	0	0	111.6	L258 K264 Y265 F266 H387 T388 F389	L258-E262 WeakPolarHBondContact O-CB 3.39Å; L258-E262 PolarHBondContact O-N 2.88Å; E262-K264 PolarHBondContact O-N 3.38Å; E262-Y265 PolarHBondContact O-N 2.99Å; E262-F266 HydrophobicContact CG-CD2 4Å; E262-F266 HydrophobicContact CG-CE2 3.59Å; E262-F266 WeakPolarHBondContact O-CD2 3.47Å; E262-F266 PolarHBondContact O-N 2.93Å; E262-F266 VanDerWaalsContact O-N 3.14Å; E262-H387 IonicContact OE1-CE1 3.59Å; E262-H387 IonicContact OE2-CE1 2.92Å; E262-H387 PolarHBondContact OE2-CE1 3.17Å; E262-T388 PolarHBondContact OE1-OG1 3.28Å; E262-F389 HydrophobicContact CB-CD2 4.15Å; E262-F389 HydrophobicContact CG-CB 4.39Å; E262-F389 HydrophobicContact CG-CD2 3.85Å; E262-F389 HydrophobicContact CG-CG 4.47Å; E262-F389 WeakPolarHBondContact OE1-CB 3.42Å
263	K	82.5	Confident	79.8	Confident	168 Å²	168	53.8 Å²	53.8	73%	0.73	28%	0.275	S	S	*	.	H	α-helix	trans	-63	-38.5	177.1	-174.3	176.2	179.7	180	0	113.4	K259 Y261	K259-K263 WeakPolarHBondContact O-CB 3.27Å; K259-K263 PolarHBondContact O-N 2.91Å; Y261-K263 VanDerWaalsContact C-N 3.33Å; Y261-K263 PolarHBondContact O-N 3.31Å
264	K	83.1	Confident	79.9	Confident	29 Å²	29	56.6 Å²	56.6	13%	0.126	29%	0.291	C	S	.	.	H	α-helix	trans	-65.5	-41.4	173.7	-72	163.2	178.3	172.4	0	110.8	A260 Y261 E262 K267 Y268 L308 S668	A260-K264 WeakPolarHBondContact O-CD 3.43Å; A260-K264 VanDerWaalsContact O-CG 3.25Å; A260-K264 WeakPolarHBondContact O-CG 3.44Å; A260-K264 PolarHBondContact O-N 3.05Å; A260-K264 VanDerWaalsContact O-N 3.1Å; Y261-K264 WeakPolarHBondContact O-CB 3.31Å; Y261-K264 PolarHBondContact O-N 3.4Å; Y261-K264 VanDerWaalsContact O-N 3.1Å; E262-K264 PolarHBondContact O-N 3.38Å; K264-K267 VanDerWaalsContact O-CB 3.31Å; K264-K267 WeakPolarHBondContact O-CB 3.36Å; K264-K267 PolarHBondContact O-N 2.99Å; K264-Y268 HydrophobicContact CB-CE2 4.25Å; K264-Y268 WeakPolarHBondContact O-CD2 3.44Å; K264-Y268 WeakPolarHBondContact O-CE2 3.32Å; K264-Y268 PolarHBondContact O-N 3.34Å; K264-L308 HydrophobicContact CB-CD1 3.99Å; K264-L308 HydrophobicContact CB-CD2 3.65Å; K264-L308 HydrophobicContact CB-CG 4.45Å; K264-L308 HydrophobicContact CD-CD1 3.77Å; K264-S668 PolarHBondContact NZ-O 3.43Å
265	Y	78.3	Confident	79.9	Confident	3 Å²	3	55.4 Å²	55.4	1%	0.012	29%	0.287	C	S	.	.	H	α-helix	trans	-65.7	-46.3	-174.5	-163.4	-92.3	0	0	0	112.4	Y261 E262 K267 Y268 I269 L305 L308 H309 F389 L393	Y261-Y265 WeakPolarHBondContact O-CB 3.35Å; Y261-Y265 PolarHBondContact O-N 2.86Å; E262-Y265 PolarHBondContact O-N 2.99Å; Y265-K267 PolarHBondContact O-N 3.18Å; Y265-Y268 PolarHBondContact O-N 3.42Å; Y265-Y268 VanDerWaalsContact O-N 3.11Å; Y265-I269 HydrophobicContact CD1-CD1 3.58Å; Y265-I269 HydrophobicContact CD1-CG1 4.3Å; Y265-I269 HydrophobicContact CE1-CD1 3.31Å; Y265-I269 HydrophobicContact CE1-CG1 4.23Å; Y265-I269 PolarHBondContact O-N 3.32Å; Y265-L305 HydrophobicContact CD1-CD1 4.29Å; Y265-L305 HydrophobicContact CD2-CD1 3.7Å; Y265-L305 HydrophobicContact CE1-CD1 4.21Å; Y265-L305 HydrophobicContact CE2-CD1 3.56Å; Y265-L305 HydrophobicContact CE2-CG 4.28Å; Y265-L305 HydrophobicContact CG-CD1 4.08Å; Y265-L308 HydrophobicContact CD2-CD2 4.27Å; Y265-H309 HydrophobicContact CE2-CB 3.94Å; Y265-H309 AromaticContact CE2-CE1 2.8Å; Y265-H309 WeakPolarHBondContact CE2-CE1 3.34Å; Y265-H309 AromaticContact CE2-ND1 3.64Å; Y265-H309 AromaticContact CZ-CE1 2.78Å; Y265-H309 AromaticContact CZ-ND1 3.78Å; Y265-H309 PolarHBondContact OH-CE1 2.9Å; Y265-H309 PolarHBondContact OH-ND1 3.46Å; Y265-H309 VanDerWaalsContact OH-ND1 3.09Å; Y265-F389 AromaticContact CD1-CE2 3.4Å; Y265-F389 HydrophobicContact CD1-CE2 3.4Å; Y265-F389 VanDerWaalsContact CD1-CE2 3.4Å; Y265-F389 AromaticContact CD1-CZ 3.3Å; Y265-F389 HydrophobicContact CD1-CZ 3.3Å; Y265-F389 AromaticContact CD2-CZ 3.81Å; Y265-F389 HydrophobicContact CD2-CZ 3.81Å; Y265-F389 AromaticContact CE1-CE2 3.93Å; Y265-F389 HydrophobicContact CE1-CE2 3.93Å; Y265-F389 AromaticContact CE1-CZ 3.49Å; Y265-F389 HydrophobicContact CE1-CZ 3.49Å; Y265-F389 VanDerWaalsContact CE1-CZ 3.49Å; Y265-F389 HydrophobicContact CE2-CZ 4.02Å; Y265-F389 AromaticContact CG-CE2 3.72Å; Y265-F389 HydrophobicContact CG-CE2 3.72Å; Y265-F389 AromaticContact CG-CZ 3.43Å; Y265-F389 HydrophobicContact CG-CZ 3.43Å; Y265-F389 VanDerWaalsContact CG-CZ 3.43Å; Y265-F389 AromaticContact CZ-CZ 3.85Å; Y265-L393 HydrophobicContact CE1-CD1 4.42Å; Y265-L393 HydrophobicContact CE1-CD2 4.08Å; Y265-L393 HydrophobicContact CE1-CG 4.43Å
266	F	75.6	Confident	79.9	Confident	107 Å²	107	55.7 Å²	55.7	47%	0.469	29%	0.287	S	S	.	.	H	α-helix	trans	-57.7	-33.7	173.5	-74.5	-60.5	0	0	0	112.7	E262 G270 F389	E262-F266 HydrophobicContact CG-CD2 4Å; E262-F266 HydrophobicContact CG-CE2 3.59Å; E262-F266 WeakPolarHBondContact O-CD2 3.47Å; E262-F266 PolarHBondContact O-N 2.93Å; E262-F266 VanDerWaalsContact O-N 3.14Å; F266-G270 PolarHBondContact O-N 2.94Å; F266-G270 VanDerWaalsContact O-N 3.1Å; F266-F389 HydrophobicContact CE2-CD2 4.47Å
267	K	80.9	Confident	79.8	Confident	123 Å²	123	53.5 Å²	53.5	54%	0.535	28%	0.281	S	S	.	.	H	α-helix	trans	-63.2	-45.4	174.5	-176.2	-175.1	174.3	-175.3	0	112	K264 Y265 G270 Q271	K264-K267 VanDerWaalsContact O-CB 3.31Å; K264-K267 WeakPolarHBondContact O-CB 3.36Å; K264-K267 PolarHBondContact O-N 2.99Å; Y265-K267 PolarHBondContact O-N 3.18Å; K267-G270 PolarHBondContact O-N 2.91Å; K267-Q271 WeakPolarHBondContact O-CG 3.37Å; K267-Q271 PolarHBondContact O-N 3.05Å
268	Y	78.1	Confident	80	Confident	6 Å²	6	58 Å²	58	2%	0.024	30%	0.299	C	S	.	.	H	α-helix	trans	-75.5	-33.2	-177.4	-62.7	-62.3	0	0	0	113.3	K264 Y265 G270 Q271 L272 K304 L308	K264-Y268 HydrophobicContact CB-CE2 4.25Å; K264-Y268 WeakPolarHBondContact O-CD2 3.44Å; K264-Y268 WeakPolarHBondContact O-CE2 3.32Å; K264-Y268 PolarHBondContact O-N 3.34Å; Y265-Y268 PolarHBondContact O-N 3.42Å; Y265-Y268 VanDerWaalsContact O-N 3.11Å; Y268-G270 VanDerWaalsContact C-N 3.34Å; Y268-Q271 PolarHBondContact O-N 3.29Å; Y268-L272 WeakPolarHBondContact O-CB 3.22Å; Y268-L272 WeakPolarHBondContact O-CG 3.44Å; Y268-L272 PolarHBondContact O-N 3.26Å; Y268-K304 HydrophobicContact CD1-CB 4.47Å; Y268-K304 HydrophobicContact CD1-CD 4.25Å; Y268-K304 HydrophobicContact CD2-CD 4.25Å; Y268-K304 HydrophobicContact CE1-CD 3.77Å; Y268-K304 VanDerWaalsContact CE1-NZ 3.32Å; Y268-K304 HydrophobicContact CE2-CD 3.72Å; Y268-K304 VanDerWaalsContact CZ-CD 3.49Å; Y268-K304 VanDerWaalsContact CZ-NZ 3.26Å; Y268-K304 PolarHBondContact OH-NZ 2.88Å; Y268-L308 HydrophobicContact CD2-CD2 3.6Å; Y268-L308 HydrophobicContact CE2-CD2 3.99Å
269	I	76.7	Confident	79.7	Confident	31 Å²	31	59.2 Å²	59.2	16%	0.159	31%	0.306	C	S	.	.	H	α-helix	trans	-60	-44.6	168.1	-78.3	176.6	0	0	0	111.2	Y265 Q271 L272 S273 L305 L399	Y265-I269 HydrophobicContact CD1-CD1 3.58Å; Y265-I269 HydrophobicContact CD1-CG1 4.3Å; Y265-I269 HydrophobicContact CE1-CD1 3.31Å; Y265-I269 HydrophobicContact CE1-CG1 4.23Å; Y265-I269 PolarHBondContact O-N 3.32Å; I269-Q271 VanDerWaalsContact C-N 3.31Å; I269-Q271 PolarHBondContact O-N 2.95Å; I269-L272 PolarHBondContact O-N 3.23Å; I269-S273 WeakPolarHBondContact O-CB 3.32Å; I269-S273 PolarHBondContact O-N 3.41Å; I269-L305 HydrophobicContact CG1-CD1 4.11Å; I269-L305 HydrophobicContact CG1-CD2 4.15Å; I269-L399 HydrophobicContact CD1-CD1 4.09Å; I269-L399 HydrophobicContact CG1-CD1 4.47Å; I269-L399 HydrophobicContact CG2-CD1 3.72Å; I269-L399 HydrophobicContact CG2-CD2 4.19Å
270	G	78.1	Confident	79.4	Confident	45 Å²	45	59.4 Å²	59.4	46%	0.464	32%	0.315	S	S	.	.	H	α-helix	trans	-61.2	-36.9	175.7	0	0	0	0	0	113.4	F266 K267 Y268 N274	F266-G270 PolarHBondContact O-N 2.94Å; F266-G270 VanDerWaalsContact O-N 3.1Å; K267-G270 PolarHBondContact O-N 2.91Å; Y268-G270 VanDerWaalsContact C-N 3.34Å; G270-N274 WeakPolarHBondContact O-CB 3.14Å; G270-N274 PolarHBondContact O-N 2.86Å
271	Q	79.1	Confident	79	Confident	81 Å²	81	62.6 Å²	62.6	38%	0.379	33%	0.326	S	S	.	.	H	α-helix	trans	-69.3	-44.1	174.6	-72.4	-178.6	-54.8	0	0	112.2	K267 Y268 I269 N274 I275	K267-Q271 WeakPolarHBondContact O-CG 3.37Å; K267-Q271 PolarHBondContact O-N 3.05Å; Y268-Q271 PolarHBondContact O-N 3.29Å; I269-Q271 VanDerWaalsContact C-N 3.31Å; I269-Q271 PolarHBondContact O-N 2.95Å; Q271-N274 WeakPolarHBondContact O-CB 3.4Å; Q271-N274 PolarHBondContact O-N 2.77Å; Q271-I275 WeakPolarHBondContact O-CG1 3.45Å; Q271-I275 PolarHBondContact O-N 2.98Å
272	L	80.1	Confident	78.4	Confident	9 Å²	9	64.2 Å²	64.2	5%	0.047	33%	0.334	C	S	.	.	H	α-helix	trans	-63.3	-44.3	178.3	-78.3	162.6	0	0	0	112.4	Y268 I269 N274 I275 Q276 L298 L305	Y268-L272 WeakPolarHBondContact O-CB 3.22Å; Y268-L272 WeakPolarHBondContact O-CG 3.44Å; Y268-L272 PolarHBondContact O-N 3.26Å; I269-L272 PolarHBondContact O-N 3.23Å; L272-N274 VanDerWaalsContact C-N 3.28Å; L272-N274 PolarHBondContact O-N 2.74Å; L272-I275 PolarHBondContact O-N 3.37Å; L272-Q276 WeakPolarHBondContact O-CB 3.49Å; L272-Q276 WeakPolarHBondContact O-CG 3.32Å; L272-Q276 PolarHBondContact O-N 2.86Å; L272-L298 HydrophobicContact CD2-CD1 3.78Å; L272-L305 HydrophobicContact CD1-CB 3.92Å; L272-L305 HydrophobicContact CD1-CD2 3.56Å; L272-L305 HydrophobicContact CD1-CG 4.29Å
273	S	79.1	Confident	77.7	Confident	66 Å²	66	68 Å²	68	46%	0.462	36%	0.363	S	S	.	.	H	α-helix	trans	-58.6	-39.3	174.7	179.6	0	0	0	0	112.2	I269 S277	I269-S273 WeakPolarHBondContact O-CB 3.32Å; I269-S273 PolarHBondContact O-N 3.41Å; S273-S277 WeakPolarHBondContact O-CB 3.5Å; S273-S277 PolarHBondContact O-N 3.1Å
274	N	82	Confident	76.6	Confident	82 Å²	82	67.8 Å²	67.8	44%	0.439	37%	0.369	S	S	.	.	H	α-helix	trans	-65.9	-42.7	175.6	-168.3	-60.5	0	0	0	112.3	G270 Q271 L272 K278	G270-N274 WeakPolarHBondContact O-CB 3.14Å; G270-N274 PolarHBondContact O-N 2.86Å; Q271-N274 WeakPolarHBondContact O-CB 3.4Å; Q271-N274 PolarHBondContact O-N 2.77Å; L272-N274 VanDerWaalsContact C-N 3.28Å; L272-N274 PolarHBondContact O-N 2.74Å; N274-K278 WeakPolarHBondContact O-CG 3.31Å; N274-K278 PolarHBondContact O-N 2.99Å; N274-K278 VanDerWaalsContact O-N 3.08Å; N274-K278 WeakPolarHBondContact OD1-CE 3.32Å; N274-K278 PolarHBondContact OD1-NZ 3.17Å
275	I	80.7	Confident	75.6	Confident	18 Å²	18	71.3 Å²	71.3	9%	0.092	39%	0.388	C	S	.	.	H	α-helix	trans	-67.2	-44.1	177.5	-65.3	162.8	0	0	0	110.9	Q271 L272 K278 L279 N297 L298 S301	Q271-I275 WeakPolarHBondContact O-CG1 3.45Å; Q271-I275 PolarHBondContact O-N 2.98Å; L272-I275 PolarHBondContact O-N 3.37Å; I275-K278 PolarHBondContact O-N 2.94Å; I275-L279 HydrophobicContact CG2-CD1 4.06Å; I275-L279 PolarHBondContact O-N 3.28Å; I275-N297 HydrophobicContact CD1-CB 4.46Å; I275-L298 HydrophobicContact CG2-CB 3.86Å; I275-L298 HydrophobicContact CG2-CD1 4.08Å; I275-S301 VanDerWaalsContact CD1-OG 3.27Å; I275-S301 WeakPolarHBondContact CD1-OG 3.2Å
276	Q	77.8	Confident	74.8	Confident	96 Å²	96	78.8 Å²	78.8	45%	0.449	43%	0.429	S	S	.	.	H	α-helix	trans	-58.9	-48.7	175.2	-73.9	172.6	-21.5	0	0	111.4	L272 K278 L279 T280 L298	L272-Q276 WeakPolarHBondContact O-CB 3.49Å; L272-Q276 WeakPolarHBondContact O-CG 3.32Å; L272-Q276 PolarHBondContact O-N 2.86Å; Q276-K278 VanDerWaalsContact C-N 3.32Å; Q276-K278 PolarHBondContact O-N 2.92Å; Q276-L279 PolarHBondContact O-N 3.38Å; Q276-L279 VanDerWaalsContact O-N 3.13Å; Q276-T280 PolarHBondContact O-N 3.45Å; Q276-T280 PolarHBondContact O-OG1 3.46Å; Q276-T280 VanDerWaalsContact O-OG1 3.1Å; Q276-L298 HydrophobicContact CG-CD1 4.4Å
277	S	81.5	Confident	74.7	Confident	63 Å²	63	77 Å²	77	44%	0.441	42%	0.424	S	S	.	.	H	α-helix	trans	-57.6	-41.8	176	180	0	0	0	0	112.5	S273 T280 N281	S273-S277 WeakPolarHBondContact O-CB 3.5Å; S273-S277 PolarHBondContact O-N 3.1Å; S277-T280 PolarHBondContact O-N 2.95Å; S277-N281 PolarHBondContact O-N 2.97Å; S277-N281 VanDerWaalsContact O-N 3.14Å; S277-N281 PolarHBondContact O-ND2 3.35Å
278	K	81.4	Confident	74.6	Confident	105 Å²	105	80 Å²	80	46%	0.457	43%	0.432	S	S	.	.	H	α-helix	trans	-62.7	-43.4	174.6	-76.9	166	173.4	160.1	0	112.6	N274 I275 Q276 N281 L282 L294	N274-K278 WeakPolarHBondContact O-CG 3.31Å; N274-K278 PolarHBondContact O-N 2.99Å; N274-K278 VanDerWaalsContact O-N 3.08Å; N274-K278 WeakPolarHBondContact OD1-CE 3.32Å; N274-K278 PolarHBondContact OD1-NZ 3.17Å; I275-K278 PolarHBondContact O-N 2.94Å; Q276-K278 VanDerWaalsContact C-N 3.32Å; Q276-K278 PolarHBondContact O-N 2.92Å; K278-N281 PolarHBondContact O-N 2.72Å; K278-L282 WeakPolarHBondContact O-CB 3.4Å; K278-L282 WeakPolarHBondContact O-CG 3.49Å; K278-L282 PolarHBondContact O-N 3.11Å; K278-L282 VanDerWaalsContact O-N 3.14Å; K278-L294 HydrophobicContact CB-CD1 4.21Å; K278-L294 HydrophobicContact CB-CD2 4.39Å; K278-L294 HydrophobicContact CD-CD2 4.37Å
279	L	76	Confident	74.8	Confident	30 Å²	30	88 Å²	88	16%	0.157	47%	0.467	C	S	.	.	H	α-helix	trans	-62.7	-47.2	177.1	-76.8	164.1	0	0	0	111.6	I275 Q276 N281 L282 C283 L294 M295 L298	I275-L279 HydrophobicContact CG2-CD1 4.06Å; I275-L279 PolarHBondContact O-N 3.28Å; Q276-L279 PolarHBondContact O-N 3.38Å; Q276-L279 VanDerWaalsContact O-N 3.13Å; L279-N281 VanDerWaalsContact C-N 3.3Å; L279-N281 PolarHBondContact O-N 2.89Å; L279-L282 PolarHBondContact O-N 2.94Å; L279-C283 PolarHBondContact O-N 3.29Å; L279-C283 PolarHBondContact O-SG 3.41Å; L279-C283 VanDerWaalsContact O-SG 3.38Å; L279-L294 HydrophobicContact CD2-CB 3.67Å; L279-L294 HydrophobicContact CD2-CD1 4.2Å; L279-L294 HydrophobicContact CG-CB 4.09Å; L279-L294 HydrophobicContact CG-CD1 4.42Å; L279-M295 HydrophobicContact CD1-SD 4.2Å; L279-M295 HydrophobicContact CD2-SD 4.17Å; L279-L298 HydrophobicContact CD1-CB 4.4Å; L279-L298 HydrophobicContact CD1-CD2 3.77Å
280	T	77.1	Confident	74.9	Confident	103 Å²	103	90.2 Å²	90.2	63%	0.632	48%	0.478	S	S	*	.	H	α-helix	trans	-57.3	-41.9	177.3	-53.9	0	0	0	0	112.3	Q276 S277 L282	Q276-T280 PolarHBondContact O-N 3.45Å; Q276-T280 PolarHBondContact O-OG1 3.46Å; Q276-T280 VanDerWaalsContact O-OG1 3.1Å; S277-T280 PolarHBondContact O-N 2.95Å; T280-L282 VanDerWaalsContact C-N 3.32Å; T280-L282 PolarHBondContact O-N 2.96Å
281	N	74.8	Confident	75	Confident	113 Å²	113	90.7 Å²	90.7	60%	0.604	47%	0.47	S	S	*	.	H	α-helix	trans	-70.7	-25.2	177.7	-76	-67.9	0	0	0	113.5	S277 K278 L279	S277-N281 PolarHBondContact O-N 2.97Å; S277-N281 VanDerWaalsContact O-N 3.14Å; S277-N281 PolarHBondContact O-ND2 3.35Å; K278-N281 PolarHBondContact O-N 2.72Å; L279-N281 VanDerWaalsContact C-N 3.3Å; L279-N281 PolarHBondContact O-N 2.89Å
282	L	68.2	Low	75.1	Confident	37 Å²	37	90.3 Å²	90.3	19%	0.194	47%	0.47	C	S	.	.	H	α-helix	trans	-89.6	-7	-177.5	-79.6	165.1	0	0	0	114.6	K278 L279 T280 L284 I285 I290 L294	K278-L282 WeakPolarHBondContact O-CB 3.4Å; K278-L282 WeakPolarHBondContact O-CG 3.49Å; K278-L282 PolarHBondContact O-N 3.11Å; K278-L282 VanDerWaalsContact O-N 3.14Å; L279-L282 PolarHBondContact O-N 2.94Å; T280-L282 VanDerWaalsContact C-N 3.32Å; T280-L282 PolarHBondContact O-N 2.96Å; L282-L284 PolarHBondContact O-N 2.85Å; L282-I285 HydrophobicContact CD2-CB 4.33Å; L282-I285 PolarHBondContact O-N 3.06Å; L282-I290 HydrophobicContact CD1-CG2 3.7Å; L282-L294 HydrophobicContact CD1-CD1 3.3Å
283	C	60.3	Low	75.3	Confident	112 Å²	112	93 Å²	93	76%	0.757	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	-11.5	172.9	-66.2	0	0	0	0	114.4	L279	L279-C283 PolarHBondContact O-N 3.29Å; L279-C283 PolarHBondContact O-SG 3.41Å; L279-C283 VanDerWaalsContact O-SG 3.38Å
284	L	59.4	Low	75.4	Confident	164 Å²	164	90.9 Å²	90.9	86%	0.859	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96	-8.7	175.7	-63.1	174.2	0	0	0	114.3	L282	L282-L284 PolarHBondContact O-N 2.85Å
285	I	62.1	Low	75.4	Confident	103 Å²	103	91.3 Å²	91.3	53%	0.528	47%	0.474	S	S	.	.	S	Bend	trans	-127.2	111.4	-173.4	-56.5	-179.8	0	0	0	109.8	L282 N287	L282-I285 HydrophobicContact CD2-CB 4.33Å; L282-I285 PolarHBondContact O-N 3.06Å; I285-N287 HydrophobicContact CG2-CB 4.37Å; I285-N287 PolarHBondContact O-N 3.04Å
286	N	62.8	Low	75.6	Confident	160 Å²	160	95.1 Å²	95.1	86%	0.856	49%	0.494	S	S	*	.			trans	-77.8	44.4	-169.5	-153.1	0.7	0	0	0	114.1	R288	N286-R288 PolarHBondContact O-N 2.8Å
287	N	72.9	Confident	75.9	Confident	69 Å²	69	94 Å²	94	37%	0.369	49%	0.491	S	S	.	.			trans	-93.4	82.7	179.4	-169.9	-18.1	0	0	0	110.9	I285 K289 I290 I291	I285-N287 HydrophobicContact CG2-CB 4.37Å; I285-N287 PolarHBondContact O-N 3.04Å; N287-K289 VanDerWaalsContact C-N 3.26Å; N287-K289 PolarHBondContact O-N 2.87Å; N287-K289 VanDerWaalsContact O-N 3.12Å; N287-I290 HydrophobicContact CB-CD1 4.23Å; N287-I290 HydrophobicContact CB-CG1 4.37Å; N287-I290 VanDerWaalsContact ND2-CD1 3.29Å; N287-I290 WeakPolarHBondContact ND2-CD1 3.46Å; N287-I290 PolarHBondContact O-N 3.06Å; N287-I291 PolarHBondContact O-N 3.19Å
288	R	78.5	Confident	76	Confident	186 Å²	186	92.7 Å²	92.7	70%	0.702	48%	0.479	S	S	*	.	H	α-helix	trans	-46.5	-42.4	-177.4	-175.5	172.7	177.9	172.1	2.8	114.1	N286 I290 I291 D292	N286-R288 PolarHBondContact O-N 2.8Å; R288-I290 VanDerWaalsContact C-N 3.3Å; R288-I290 PolarHBondContact O-N 2.65Å; R288-I291 PolarHBondContact O-N 2.82Å; R288-I291 VanDerWaalsContact O-N 3.13Å; R288-D292 WeakPolarHBondContact CG-OD2 3.23Å; R288-D292 IonicContact NE-OD2 2.64Å; R288-D292 WeakPolarHBondContact O-CB 3.44Å; R288-D292 PolarHBondContact O-N 3.05Å
289	K	81.5	Confident	76.1	Confident	176 Å²	176	93.2 Å²	93.2	77%	0.765	48%	0.483	S	S	*	.	H	α-helix	trans	-61.3	-34.6	179.6	-70	-171.9	176.6	-174.7	0	113.7	N287 S293	N287-K289 VanDerWaalsContact C-N 3.26Å; N287-K289 PolarHBondContact O-N 2.87Å; N287-K289 VanDerWaalsContact O-N 3.12Å; K289-S293 WeakPolarHBondContact O-CB 3.4Å; K289-S293 PolarHBondContact O-N 3.22Å
290	I	79.8	Confident	76.5	Confident	76 Å²	76	93.1 Å²	93.1	39%	0.39	48%	0.481	S	S	.	.	H	α-helix	trans	-75.6	-39.2	177	-60.3	-179.5	0	0	0	109.9	L282 N287 R288 S293 L294	L282-I290 HydrophobicContact CD1-CG2 3.7Å; N287-I290 HydrophobicContact CB-CD1 4.23Å; N287-I290 HydrophobicContact CB-CG1 4.37Å; N287-I290 VanDerWaalsContact ND2-CD1 3.29Å; N287-I290 WeakPolarHBondContact ND2-CD1 3.46Å; N287-I290 PolarHBondContact O-N 3.06Å; R288-I290 VanDerWaalsContact C-N 3.3Å; R288-I290 PolarHBondContact O-N 2.65Å; I290-S293 PolarHBondContact O-N 3.21Å; I290-L294 HydrophobicContact CG2-CD1 4.02Å; I290-L294 HydrophobicContact CG2-CG 4.46Å; I290-L294 WeakPolarHBondContact O-CB 3.47Å; I290-L294 WeakPolarHBondContact O-CG 3.44Å; I290-L294 PolarHBondContact O-N 2.77Å
291	I	79	Confident	76.8	Confident	56 Å²	56	88.6 Å²	88.6	29%	0.287	45%	0.454	S	S	.	.	H	α-helix	trans	-63.2	-51.9	177	-61.4	169.9	0	0	0	110.2	N287 R288 S293 L294 M295	N287-I291 PolarHBondContact O-N 3.19Å; R288-I291 PolarHBondContact O-N 2.82Å; R288-I291 VanDerWaalsContact O-N 3.13Å; I291-S293 VanDerWaalsContact C-N 3.29Å; I291-S293 PolarHBondContact O-N 2.98Å; I291-L294 PolarHBondContact O-N 3.06Å; I291-L294 VanDerWaalsContact O-N 3.11Å; I291-M295 HydrophobicContact CG2-CG 4.29Å; I291-M295 WeakPolarHBondContact O-CG 3.3Å; I291-M295 PolarHBondContact O-N 2.96Å
292	D	82.3	Confident	77.3	Confident	73 Å²	73	84.9 Å²	84.9	39%	0.39	44%	0.435	S	S	.	.	H	α-helix	trans	-55.5	-44.3	177.3	-61.1	-19.7	0	0	0	110.9	R288 M295 N296	R288-D292 WeakPolarHBondContact CG-OD2 3.23Å; R288-D292 IonicContact NE-OD2 2.64Å; R288-D292 WeakPolarHBondContact O-CB 3.44Å; R288-D292 PolarHBondContact O-N 3.05Å; D292-M295 PolarHBondContact O-N 3.39Å; D292-N296 VanDerWaalsContact O-CG 3.23Å; D292-N296 PolarHBondContact O-N 3.33Å; D292-N296 PolarHBondContact O-OD1 2.99Å
293	S	84.2	Confident	78.2	Confident	64 Å²	64	87.6 Å²	87.6	45%	0.448	45%	0.445	S	S	.	.	H	α-helix	trans	-63.5	-42.4	176.2	-176.9	0	0	0	0	113.1	K289 I290 I291 N297	K289-S293 WeakPolarHBondContact O-CB 3.4Å; K289-S293 PolarHBondContact O-N 3.22Å; I290-S293 PolarHBondContact O-N 3.21Å; I291-S293 VanDerWaalsContact C-N 3.29Å; I291-S293 PolarHBondContact O-N 2.98Å; S293-N297 PolarHBondContact O-N 3.45Å; S293-N297 VanDerWaalsContact O-N 3.1Å; S293-N297 PolarHBondContact O-ND2 3.06Å
294	L	81.9	Confident	79.4	Confident	23 Å²	23	82.8 Å²	82.8	12%	0.12	41%	0.411	C	S	.	.	H	α-helix	trans	-71.1	-33.6	177.6	-74.5	172.5	0	0	0	112.9	K278 L279 L282 I290 I291 N297 L298	K278-L294 HydrophobicContact CB-CD1 4.21Å; K278-L294 HydrophobicContact CB-CD2 4.39Å; K278-L294 HydrophobicContact CD-CD2 4.37Å; L279-L294 HydrophobicContact CD2-CB 3.67Å; L279-L294 HydrophobicContact CD2-CD1 4.2Å; L279-L294 HydrophobicContact CG-CB 4.09Å; L279-L294 HydrophobicContact CG-CD1 4.42Å; L282-L294 HydrophobicContact CD1-CD1 3.3Å; I290-L294 HydrophobicContact CG2-CD1 4.02Å; I290-L294 HydrophobicContact CG2-CG 4.46Å; I290-L294 WeakPolarHBondContact O-CB 3.47Å; I290-L294 WeakPolarHBondContact O-CG 3.44Å; I290-L294 PolarHBondContact O-N 2.77Å; I291-L294 PolarHBondContact O-N 3.06Å; I291-L294 VanDerWaalsContact O-N 3.11Å; L294-N297 PolarHBondContact O-N 3.4Å; L294-L298 WeakPolarHBondContact O-CB 3.37Å; L294-L298 PolarHBondContact O-N 3.27Å
295	M	81.5	Confident	80.7	Confident	91 Å²	91	75.3 Å²	75.3	45%	0.448	37%	0.372	S	S	.	.	H	α-helix	trans	-65.8	-45.7	174.5	-72	-57.4	-60.5	0	0	111.4	L279 I291 D292 N297 L298 E299	L279-M295 HydrophobicContact CD1-SD 4.2Å; L279-M295 HydrophobicContact CD2-SD 4.17Å; I291-M295 HydrophobicContact CG2-CG 4.29Å; I291-M295 WeakPolarHBondContact O-CG 3.3Å; I291-M295 PolarHBondContact O-N 2.96Å; D292-M295 PolarHBondContact O-N 3.39Å; M295-N297 VanDerWaalsContact C-N 3.3Å; M295-N297 PolarHBondContact O-N 3.32Å; M295-L298 HydrophobicContact CE-CD2 4.41Å; M295-L298 WeakPolarHBondContact O-CB 3.38Å; M295-L298 PolarHBondContact O-N 2.97Å; M295-L298 VanDerWaalsContact O-N 3.09Å; M295-L298 HydrophobicContact SD-CD2 4.31Å; M295-E299 PolarHBondContact O-N 2.97Å
296	N	85.1	Confident	81.9	Confident	97 Å²	97	71.4 Å²	71.4	52%	0.519	35%	0.352	S	S	.	.	H	α-helix	trans	-58.5	-43.4	173.7	-66.7	-3.4	0	0	0	111.2	D292 L298 Y300	D292-N296 VanDerWaalsContact O-CG 3.23Å; D292-N296 PolarHBondContact O-N 3.33Å; D292-N296 PolarHBondContact O-OD1 2.99Å; N296-L298 VanDerWaalsContact C-N 3.34Å; N296-L298 PolarHBondContact O-N 3.34Å; N296-Y300 WeakPolarHBondContact O-CB 3.43Å; N296-Y300 PolarHBondContact O-N 2.97Å
297	N	84.6	Confident	83.2	Confident	74 Å²	74	65.3 Å²	65.3	40%	0.396	32%	0.319	S	S	.	.	H	α-helix	trans	-65.9	-32.6	175.8	-80.3	-67.6	0	0	0	113.4	I275 S293 L294 M295 S301	I275-N297 HydrophobicContact CD1-CB 4.46Å; S293-N297 PolarHBondContact O-N 3.45Å; S293-N297 VanDerWaalsContact O-N 3.1Å; S293-N297 PolarHBondContact O-ND2 3.06Å; L294-N297 PolarHBondContact O-N 3.4Å; M295-N297 VanDerWaalsContact C-N 3.3Å; M295-N297 PolarHBondContact O-N 3.32Å; N297-S301 VanDerWaalsContact O-CB 3.24Å; N297-S301 WeakPolarHBondContact O-CB 3.48Å; N297-S301 PolarHBondContact O-N 3.42Å; N297-S301 PolarHBondContact O-OG 2.75Å
298	L	83.6	Confident	83.9	Confident	35 Å²	35	62 Å²	62	18%	0.183	30%	0.301	C	S	.	.	H	α-helix	trans	-69.6	-51	176.6	177.8	64.5	0	0	0	111.4	L272 I275 Q276 L279 L294 M295 N296 Y300 S301 T302	L272-L298 HydrophobicContact CD2-CD1 3.78Å; I275-L298 HydrophobicContact CG2-CB 3.86Å; I275-L298 HydrophobicContact CG2-CD1 4.08Å; Q276-L298 HydrophobicContact CG-CD1 4.4Å; L279-L298 HydrophobicContact CD1-CB 4.4Å; L279-L298 HydrophobicContact CD1-CD2 3.77Å; L294-L298 WeakPolarHBondContact O-CB 3.37Å; L294-L298 PolarHBondContact O-N 3.27Å; M295-L298 HydrophobicContact CE-CD2 4.41Å; M295-L298 WeakPolarHBondContact O-CB 3.38Å; M295-L298 PolarHBondContact O-N 2.97Å; M295-L298 VanDerWaalsContact O-N 3.09Å; M295-L298 HydrophobicContact SD-CD2 4.31Å; N296-L298 VanDerWaalsContact C-N 3.34Å; N296-L298 PolarHBondContact O-N 3.34Å; L298-Y300 VanDerWaalsContact C-N 3.31Å; L298-Y300 PolarHBondContact O-N 2.86Å; L298-S301 PolarHBondContact O-N 2.78Å; L298-T302 WeakPolarHBondContact O-CB 3.35Å; L298-T302 PolarHBondContact O-N 3.22Å; L298-T302 PolarHBondContact O-OG1 2.88Å
299	E	82.6	Confident	84.2	Confident	115 Å²	115	53.2 Å²	53.2	54%	0.537	27%	0.268	S	S	.	.	H	α-helix	trans	-56.8	-48.1	176.3	-176.6	-175.2	166.1	0	0	110.4	M295 T302 K303 L413	M295-E299 PolarHBondContact O-N 2.97Å; E299-T302 WeakPolarHBondContact O-CB 3.46Å; E299-T302 PolarHBondContact O-N 3.3Å; E299-K303 PolarHBondContact O-N 2.94Å; E299-L413 HydrophobicContact CG-CD2 4.34Å
300	Y	84.7	Confident	84.6	Confident	28 Å²	28	45 Å²	45	11%	0.11	23%	0.232	C	C	.	.	H	α-helix	trans	-60.7	-48.6	179.2	-168.8	-120	0	0	0	112.6	N296 L298 T302 K303 K304 T662 S663 D664 M665	N296-Y300 WeakPolarHBondContact O-CB 3.43Å; N296-Y300 PolarHBondContact O-N 2.97Å; L298-Y300 VanDerWaalsContact C-N 3.31Å; L298-Y300 PolarHBondContact O-N 2.86Å; Y300-T302 VanDerWaalsContact C-N 3.28Å; Y300-T302 PolarHBondContact O-N 3.48Å; Y300-K303 WeakPolarHBondContact O-CB 3.08Å; Y300-K303 PolarHBondContact O-N 3.45Å; Y300-K303 VanDerWaalsContact O-N 3.12Å; Y300-K304 PolarHBondContact O-N 3.41Å; Y300-T662 HydrophobicContact CD2-CG2 4.16Å; Y300-T662 WeakPolarHBondContact CD2-OG1 3.31Å; Y300-T662 HydrophobicContact CE2-CG2 4.39Å; Y300-T662 WeakPolarHBondContact CE2-O 3.3Å; Y300-T662 WeakPolarHBondContact CE2-OG1 3.4Å; Y300-T662 HydrophobicContact CG-CG2 4.28Å; Y300-T662 VanDerWaalsContact CZ-O 3.26Å; Y300-T662 PolarHBondContact OH-O 3.29Å; Y300-S663 WeakPolarHBondContact CE1-O 3.44Å; Y300-S663 VanDerWaalsContact CZ-C 3.5Å; Y300-S663 WeakPolarHBondContact OH-CA 3.27Å; Y300-S663 PolarHBondContact OH-N 2.81Å; Y300-S663 PolarHBondContact OH-O 3.25Å; Y300-D664 HydrophobicContact CE1-CB 4.3Å; Y300-D664 PolarHBondContact OH-N 2.99Å; Y300-D664 VanDerWaalsContact OH-N 3.1Å; Y300-M665 HydrophobicContact CD1-CE 3.41Å; Y300-M665 VanDerWaalsContact CD1-CE 3.41Å; Y300-M665 HydrophobicContact CD1-CG 3.83Å; Y300-M665 HydrophobicContact CD1-SD 4.1Å; Y300-M665 HydrophobicContact CD2-CG 3.88Å; Y300-M665 HydrophobicContact CE1-CB 4.37Å; Y300-M665 HydrophobicContact CE1-CE 3.47Å; Y300-M665 VanDerWaalsContact CE1-CE 3.47Å; Y300-M665 HydrophobicContact CE1-CG 3.2Å; Y300-M665 HydrophobicContact CE1-SD 3.99Å; Y300-M665 HydrophobicContact CE2-CB 4.16Å; Y300-M665 HydrophobicContact CE2-CG 3.31Å; Y300-M665 HydrophobicContact CE2-SD 4.47Å; Y300-M665 HydrophobicContact CG-CE 4.12Å; Y300-M665 HydrophobicContact CG-CG 4.12Å; Y300-M665 HydrophobicContact CG-SD 4.35Å; Y300-M665 WeakPolarHBondContact OH-CB 3.49Å; Y300-M665 WeakPolarHBondContact OH-CG 3.47Å; Y300-M665 PolarHBondContact OH-N 3.23Å
301	S	83.5	Confident	85	Confident	9 Å²	9	42 Å²	42	6%	0.063	22%	0.217	C	C	.	.	H	α-helix	trans	-63.5	-34.7	176.6	-60.2	0	0	0	0	112.7	I275 N297 L298 K303 K304 L305	I275-S301 VanDerWaalsContact CD1-OG 3.27Å; I275-S301 WeakPolarHBondContact CD1-OG 3.2Å; N297-S301 VanDerWaalsContact O-CB 3.24Å; N297-S301 WeakPolarHBondContact O-CB 3.48Å; N297-S301 PolarHBondContact O-N 3.42Å; N297-S301 PolarHBondContact O-OG 2.75Å; L298-S301 PolarHBondContact O-N 2.78Å; S301-K303 VanDerWaalsContact C-N 3.35Å; S301-K304 PolarHBondContact O-N 3.49Å; S301-L305 PolarHBondContact O-N 2.96Å
302	T	84.9	Confident	85.4	Confident	35 Å²	35	39.5 Å²	39.5	22%	0.215	20%	0.204	C	C	.	.	H	α-helix	trans	-65.2	-40.8	174.3	-57.3	0	0	0	0	110.5	L298 E299 Y300 K304 L305 H306 L413	L298-T302 WeakPolarHBondContact O-CB 3.35Å; L298-T302 PolarHBondContact O-N 3.22Å; L298-T302 PolarHBondContact O-OG1 2.88Å; E299-T302 WeakPolarHBondContact O-CB 3.46Å; E299-T302 PolarHBondContact O-N 3.3Å; Y300-T302 VanDerWaalsContact C-N 3.28Å; Y300-T302 PolarHBondContact O-N 3.48Å; T302-K304 PolarHBondContact O-N 3.38Å; T302-L305 PolarHBondContact O-N 3.26Å; T302-L305 VanDerWaalsContact O-N 3.12Å; T302-H306 VanDerWaalsContact CG2-CE1 3.49Å; T302-H306 WeakPolarHBondContact CG2-CE1 3.37Å; T302-H306 PolarHBondContact O-N 2.66Å; T302-L413 HydrophobicContact CG2-CD1 4.13Å
303	K	86.7	Confident	85.6	Confident	93 Å²	93	36.1 Å²	36.1	40%	0.404	19%	0.186	S	C	.	.	H	α-helix	trans	-59.5	-42.4	176	-167.6	168.3	-176.9	172.3	0	112.5	E299 Y300 S301 L307 L413	E299-K303 PolarHBondContact O-N 2.94Å; Y300-K303 WeakPolarHBondContact O-CB 3.08Å; Y300-K303 PolarHBondContact O-N 3.45Å; Y300-K303 VanDerWaalsContact O-N 3.12Å; S301-K303 VanDerWaalsContact C-N 3.35Å; K303-L307 HydrophobicContact CG-CD1 4.05Å; K303-L307 WeakPolarHBondContact O-CB 3.2Å; K303-L307 VanDerWaalsContact O-CG 3.24Å; K303-L307 WeakPolarHBondContact O-CG 3.39Å; K303-L307 PolarHBondContact O-N 3.07Å; K303-L413 WeakPolarHBondContact CE-O 3.47Å; K303-L413 HydrophobicContact CG-CB 4.37Å
304	K	86.7	Confident	85.9	Confident	11 Å²	11	33.5 Å²	33.5	5%	0.048	17%	0.167	C	C	.	.	H	α-helix	trans	-63.8	-45.2	170.6	-119.1	-167.7	-67.3	-150.6	0	112.8	Y268 Y300 S301 T302 H306 L307 L308 D664 M665	Y268-K304 HydrophobicContact CD1-CB 4.47Å; Y268-K304 HydrophobicContact CD1-CD 4.25Å; Y268-K304 HydrophobicContact CD2-CD 4.25Å; Y268-K304 HydrophobicContact CE1-CD 3.77Å; Y268-K304 VanDerWaalsContact CE1-NZ 3.32Å; Y268-K304 HydrophobicContact CE2-CD 3.72Å; Y268-K304 VanDerWaalsContact CZ-CD 3.49Å; Y268-K304 VanDerWaalsContact CZ-NZ 3.26Å; Y268-K304 PolarHBondContact OH-NZ 2.88Å; Y300-K304 PolarHBondContact O-N 3.41Å; S301-K304 PolarHBondContact O-N 3.49Å; T302-K304 PolarHBondContact O-N 3.38Å; K304-H306 PolarHBondContact O-N 2.88Å; K304-L307 PolarHBondContact O-N 2.83Å; K304-L308 WeakPolarHBondContact O-CB 3.28Å; K304-L308 PolarHBondContact O-N 2.91Å; K304-D664 WeakPolarHBondContact CE-O 3.45Å; K304-D664 PolarHBondContact NZ-O 3.22Å; K304-M665 HydrophobicContact CB-CE 4.27Å; K304-M665 HydrophobicContact CB-SD 3.21Å; K304-M665 WeakPolarHBondContact CB-SD 3.45Å; K304-M665 HydrophobicContact CD-CB 4.46Å; K304-M665 WeakPolarHBondContact CD-O 3.38Å; K304-M665 HydrophobicContact CD-SD 3.93Å; K304-M665 WeakPolarHBondContact CE-SD 3.45Å; K304-M665 HydrophobicContact CG-CB 4.11Å; K304-M665 HydrophobicContact CG-CG 4.27Å; K304-M665 HydrophobicContact CG-SD 3.38Å; K304-M665 WeakPolarHBondContact CG-SD 3.47Å
305	L	86	Confident	86.1	Confident	7 Å²	7	32.8 Å²	32.8	4%	0.037	17%	0.165	C	C	.	.	H	α-helix	trans	-59.7	-40	-173.9	-171.6	67.8	0	0	0	109.7	Y265 I269 L272 S301 T302 H309 L403	Y265-L305 HydrophobicContact CD1-CD1 4.29Å; Y265-L305 HydrophobicContact CD2-CD1 3.7Å; Y265-L305 HydrophobicContact CE1-CD1 4.21Å; Y265-L305 HydrophobicContact CE2-CD1 3.56Å; Y265-L305 HydrophobicContact CE2-CG 4.28Å; Y265-L305 HydrophobicContact CG-CD1 4.08Å; I269-L305 HydrophobicContact CG1-CD1 4.11Å; I269-L305 HydrophobicContact CG1-CD2 4.15Å; L272-L305 HydrophobicContact CD1-CB 3.92Å; L272-L305 HydrophobicContact CD1-CD2 3.56Å; L272-L305 HydrophobicContact CD1-CG 4.29Å; S301-L305 PolarHBondContact O-N 2.96Å; T302-L305 PolarHBondContact O-N 3.26Å; T302-L305 VanDerWaalsContact O-N 3.12Å; L305-H309 WeakPolarHBondContact O-CB 3.49Å; L305-H309 PolarHBondContact O-N 2.88Å; L305-L403 HydrophobicContact CD2-CD1 3.82Å
306	H	88	Confident	86.3	Confident	22 Å²	22	29 Å²	29	10%	0.102	15%	0.146	C	C	.	.	H	α-helix	trans	-65.5	-48.3	174.6	-63.7	-180	0	0	0	113.2	T302 K304 H309 N310 I409 N411 T414	T302-H306 VanDerWaalsContact CG2-CE1 3.49Å; T302-H306 WeakPolarHBondContact CG2-CE1 3.37Å; T302-H306 PolarHBondContact O-N 2.66Å; K304-H306 PolarHBondContact O-N 2.88Å; H306-H309 PolarHBondContact O-N 3.45Å; H306-N310 PolarHBondContact O-N 3.11Å; H306-N310 VanDerWaalsContact O-N 3.1Å; H306-I409 HydrophobicContact CB-CD1 4.23Å; H306-I409 HydrophobicContact CB-CG2 4.07Å; H306-N411 PolarHBondContact CE1-ND2 3.46Å; H306-N411 PolarHBondContact ND1-ND2 2.99Å; H306-T414 HydrophobicContact CB-CG2 3.53Å
307	L	89	Confident	86.3	Confident	31 Å²	31	25.9 Å²	25.9	16%	0.162	13%	0.129	C	C	.	.	H	α-helix	trans	-62.9	-45.9	179.4	-67.9	172.3	0	0	0	112.1	K303 K304 H309 N310 E311 T414 S417	K303-L307 HydrophobicContact CG-CD1 4.05Å; K303-L307 WeakPolarHBondContact O-CB 3.2Å; K303-L307 VanDerWaalsContact O-CG 3.24Å; K303-L307 WeakPolarHBondContact O-CG 3.39Å; K303-L307 PolarHBondContact O-N 3.07Å; K304-L307 PolarHBondContact O-N 2.83Å; L307-H309 VanDerWaalsContact C-N 3.35Å; L307-H309 PolarHBondContact O-N 3Å; L307-N310 WeakPolarHBondContact O-CB 3.41Å; L307-N310 PolarHBondContact O-N 2.9Å; L307-E311 PolarHBondContact O-N 3.24Å; L307-T414 HydrophobicContact CD2-CG2 4.48Å; L307-S417 WeakPolarHBondContact CD2-OG 3.22Å
308	L	87.5	Confident	86.4	Confident	1 Å²	1	23.4 Å²	23.4	1%	0.005	12%	0.117	C	C	.	.	H	α-helix	trans	-66.6	-34.5	179	-175.6	75.6	0	0	0	112.3	Y261 K264 Y265 Y268 K304 Y312	Y261-L308 HydrophobicContact CD1-CD1 3.5Å; Y261-L308 VanDerWaalsContact CD1-CD1 3.5Å; Y261-L308 HydrophobicContact CD1-CG 4.23Å; Y261-L308 HydrophobicContact CE1-CD1 3.63Å; K264-L308 HydrophobicContact CB-CD1 3.99Å; K264-L308 HydrophobicContact CB-CD2 3.65Å; K264-L308 HydrophobicContact CB-CG 4.45Å; K264-L308 HydrophobicContact CD-CD1 3.77Å; Y265-L308 HydrophobicContact CD2-CD2 4.27Å; Y268-L308 HydrophobicContact CD2-CD2 3.6Å; Y268-L308 HydrophobicContact CE2-CD2 3.99Å; K304-L308 WeakPolarHBondContact O-CB 3.28Å; K304-L308 PolarHBondContact O-N 2.91Å; L308-Y312 WeakPolarHBondContact O-CB 3.46Å; L308-Y312 PolarHBondContact O-N 3.21Å
309	H	86.1	Confident	86.3	Confident	0 Å²	0	22 Å²	22	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-63.1	-43.7	172	-172.6	99.6	0	0	0	111	Y265 L305 H306 L307 Y312 C313 S404 S407 I409	Y265-H309 HydrophobicContact CE2-CB 3.94Å; Y265-H309 AromaticContact CE2-CE1 2.8Å; Y265-H309 WeakPolarHBondContact CE2-CE1 3.34Å; Y265-H309 AromaticContact CE2-ND1 3.64Å; Y265-H309 AromaticContact CZ-CE1 2.78Å; Y265-H309 AromaticContact CZ-ND1 3.78Å; Y265-H309 PolarHBondContact OH-CE1 2.9Å; Y265-H309 PolarHBondContact OH-ND1 3.46Å; Y265-H309 VanDerWaalsContact OH-ND1 3.09Å; L305-H309 WeakPolarHBondContact O-CB 3.49Å; L305-H309 PolarHBondContact O-N 2.88Å; H306-H309 PolarHBondContact O-N 3.45Å; L307-H309 VanDerWaalsContact C-N 3.35Å; L307-H309 PolarHBondContact O-N 3Å; H309-Y312 PolarHBondContact O-N 3.16Å; H309-C313 PolarHBondContact O-N 3.32Å; H309-C313 PolarHBondContact O-SG 3.04Å; H309-S404 PolarHBondContact NE2-O 3.24Å; H309-S407 PolarHBondContact CD2-O 3.26Å; H309-I409 HydrophobicContact CB-CD1 3.62Å
310	N	89.8	Confident	86.3	Confident	3 Å²	3	18.6 Å²	18.6	2%	0.016	10%	0.096	C	C	.	.	H	α-helix	trans	-64.8	-45.4	177.4	-71.7	-0	0	0	0	111.1	H306 L307 Y312 C313 L314 L408 I409	H306-N310 PolarHBondContact O-N 3.11Å; H306-N310 VanDerWaalsContact O-N 3.1Å; L307-N310 WeakPolarHBondContact O-CB 3.41Å; L307-N310 PolarHBondContact O-N 2.9Å; N310-Y312 VanDerWaalsContact C-N 3.33Å; N310-Y312 PolarHBondContact O-N 3.41Å; N310-C313 PolarHBondContact O-N 3.43Å; N310-L314 WeakPolarHBondContact O-CG 3.42Å; N310-L314 PolarHBondContact O-N 3.3Å; N310-L408 HydrophobicContact CB-CD2 3.87Å; N310-I409 PolarHBondContact ND2-O 2.86Å; N310-I409 PolarHBondContact OD1-N 3.16Å
311	E	87.9	Confident	86.3	Confident	15 Å²	15	18.7 Å²	18.7	7%	0.07	10%	0.097	C	C	.	.	H	α-helix	trans	-56.2	-44.5	171.8	-70.9	-172	90.6	0	0	112.6	Y261 L307 L314 A315 I669	Y261-E311 HydrophobicContact CD1-CB 4.12Å; Y261-E311 HydrophobicContact CE1-CB 3.41Å; Y261-E311 VanDerWaalsContact CE1-CB 3.41Å; Y261-E311 HydrophobicContact CE1-CG 4.16Å; Y261-E311 WeakPolarHBondContact CE1-OE2 3.37Å; Y261-E311 PolarHBondContact OH-OE1 3.01Å; L307-E311 PolarHBondContact O-N 3.24Å; E311-L314 PolarHBondContact O-N 3.44Å; E311-A315 WeakPolarHBondContact O-CB 3.47Å; E311-A315 PolarHBondContact O-N 2.84Å; E311-I669 WeakPolarHBondContact OE1-CA 3.44Å
312	Y	86.5	Confident	86.4	Confident	3 Å²	3	18.6 Å²	18.6	1%	0.012	10%	0.095	C	C	.	.	H	α-helix	trans	-62.7	-43	178.2	171.8	-99.6	0	0	0	111.9	L258 L308 H309 N310 A315 L316 H387 F389 N390	L258-Y312 HydrophobicContact CB-CE2 4.4Å; L258-Y312 HydrophobicContact CD2-CD2 4.01Å; L258-Y312 HydrophobicContact CD2-CE2 3.7Å; L308-Y312 WeakPolarHBondContact O-CB 3.46Å; L308-Y312 PolarHBondContact O-N 3.21Å; H309-Y312 PolarHBondContact O-N 3.16Å; N310-Y312 VanDerWaalsContact C-N 3.33Å; N310-Y312 PolarHBondContact O-N 3.41Å; Y312-A315 PolarHBondContact O-N 2.82Å; Y312-L316 HydrophobicContact CE1-CD2 4.08Å; Y312-L316 WeakPolarHBondContact O-CB 3.22Å; Y312-L316 PolarHBondContact O-N 3.08Å; Y312-H387 WeakPolarHBondContact OH-CB 3.4Å; Y312-F389 HydrophobicContact CD1-CD1 4.04Å; Y312-F389 AromaticContact CD1-CE1 3.67Å; Y312-F389 HydrophobicContact CD1-CE1 3.67Å; Y312-F389 AromaticContact CE1-CD1 3.33Å; Y312-F389 HydrophobicContact CE1-CD1 3.33Å; Y312-F389 AromaticContact CE1-CE1 3.44Å; Y312-F389 HydrophobicContact CE1-CE1 3.44Å; Y312-F389 VanDerWaalsContact CE1-CE1 3.44Å; Y312-F389 HydrophobicContact CE1-CG 4.5Å; Y312-F389 HydrophobicContact CE2-CD1 4Å; Y312-F389 HydrophobicContact CE2-CE1 4.37Å; Y312-F389 HydrophobicContact CG-CE1 4.25Å; Y312-F389 AromaticContact CZ-CD1 3.3Å; Y312-F389 AromaticContact CZ-CE1 3.82Å; Y312-F389 WeakPolarHBondContact OH-CD1 3.46Å; Y312-N390 PolarHBondContact OH-OD1 3.46Å; Y312-N390 VanDerWaalsContact OH-OD1 3.12Å
313	C	86.7	Confident	86.2	Confident	1 Å²	1	19 Å²	19	1%	0.007	10%	0.095	C	C	.	.	H	α-helix	trans	-64.4	-44.8	178.3	-67	0	0	0	0	111.7	H309 N310 A315 L316 I317 L408	H309-C313 PolarHBondContact O-N 3.32Å; H309-C313 PolarHBondContact O-SG 3.04Å; N310-C313 PolarHBondContact O-N 3.43Å; C313-A315 VanDerWaalsContact C-N 3.33Å; C313-A315 PolarHBondContact O-N 3.12Å; C313-L316 PolarHBondContact O-N 3.09Å; C313-I317 WeakPolarHBondContact O-CD1 3.46Å; C313-I317 VanDerWaalsContact O-CG1 3.26Å; C313-I317 WeakPolarHBondContact O-CG1 3.24Å; C313-I317 PolarHBondContact O-N 2.8Å; C313-L408 HydrophobicContact CB-CD2 3.92Å
314	L	90	Very high	86	Confident	9 Å²	9	20 Å²	20	5%	0.047	10%	0.101	C	C	.	.	H	α-helix	trans	-62	-40.2	175.1	-62.7	169.5	0	0	0	111.7	N310 E311 T318 L408 L421 L547 L551	N310-L314 WeakPolarHBondContact O-CG 3.42Å; N310-L314 PolarHBondContact O-N 3.3Å; E311-L314 PolarHBondContact O-N 3.44Å; L314-T318 WeakPolarHBondContact O-CB 3.4Å; L314-T318 PolarHBondContact O-N 3.06Å; L314-T318 PolarHBondContact O-OG1 2.82Å; L314-L408 HydrophobicContact CD2-CD1 4.48Å; L314-L408 HydrophobicContact CD2-CD2 4.42Å; L314-L408 HydrophobicContact CG-CD2 4.31Å; L314-L421 HydrophobicContact CD1-CD1 4.05Å; L314-L421 HydrophobicContact CD1-CD2 4.43Å; L314-L547 HydrophobicContact CB-CD2 4.17Å; L314-L547 HydrophobicContact CD2-CD2 3.71Å; L314-L551 HydrophobicContact CD1-CD1 4.49Å; L314-L551 HydrophobicContact CD1-CD2 4.21Å; L314-L551 HydrophobicContact CD2-CD1 4.2Å; L314-L551 HydrophobicContact CD2-CD2 4.07Å; L314-L551 HydrophobicContact CD2-CG 4Å
315	A	87	Confident	86	Confident	9 Å²	9	20.4 Å²	20.4	7%	0.074	10%	0.102	C	C	.	.	H	α-helix	trans	-64.5	-38.5	174.7	0	0	0	0	0	112.5	L258 E311 Y312 C313 A319	L258-A315 HydrophobicContact CD2-CB 4Å; E311-A315 WeakPolarHBondContact O-CB 3.47Å; E311-A315 PolarHBondContact O-N 2.84Å; Y312-A315 PolarHBondContact O-N 2.82Å; C313-A315 VanDerWaalsContact C-N 3.33Å; C313-A315 PolarHBondContact O-N 3.12Å; A315-A319 VanDerWaalsContact O-CB 3.31Å; A315-A319 WeakPolarHBondContact O-CB 3.32Å; A315-A319 PolarHBondContact O-N 2.75Å
316	L	84.4	Confident	85.8	Confident	10 Å²	10	20.3 Å²	20.3	5%	0.052	10%	0.102	C	C	.	.	H	α-helix	trans	-70.1	-41.4	178.6	-176.7	64.4	0	0	0	111.9	L258 Y312 C313 A319 N320 H387 N390	L258-L316 HydrophobicContact CD1-CD1 3.98Å; L258-L316 HydrophobicContact CD2-CB 4.01Å; L258-L316 HydrophobicContact CD2-CD1 4.26Å; Y312-L316 HydrophobicContact CE1-CD2 4.08Å; Y312-L316 WeakPolarHBondContact O-CB 3.22Å; Y312-L316 PolarHBondContact O-N 3.08Å; C313-L316 PolarHBondContact O-N 3.09Å; L316-A319 PolarHBondContact O-N 3.33Å; L316-N320 WeakPolarHBondContact O-CB 3.38Å; L316-N320 PolarHBondContact O-N 3.32Å; L316-N320 PolarHBondContact O-ND2 3.24Å; L316-H387 HydrophobicContact CD1-CB 4.29Å; L316-N390 WeakPolarHBondContact CD2-ND2 3.32Å
317	I	85.8	Confident	85.4	Confident	33 Å²	33	20.1 Å²	20.1	17%	0.169	10%	0.1	C	C	.	.	H	α-helix	trans	-57.3	-52.9	171.9	-69.3	163.4	0	0	0	109.6	C313 A319 N320 H321 L547 V550	C313-I317 WeakPolarHBondContact O-CD1 3.46Å; C313-I317 VanDerWaalsContact O-CG1 3.26Å; C313-I317 WeakPolarHBondContact O-CG1 3.24Å; C313-I317 PolarHBondContact O-N 2.8Å; I317-A319 VanDerWaalsContact C-N 3.32Å; I317-A319 PolarHBondContact O-N 3.49Å; I317-N320 PolarHBondContact O-N 2.8Å; I317-H321 WeakPolarHBondContact CG2-CE1 3.48Å; I317-H321 PolarHBondContact O-CD2 3.04Å; I317-H321 PolarHBondContact O-N 3.29Å; I317-L547 HydrophobicContact CB-CD2 4.1Å; I317-L547 HydrophobicContact CG2-CD2 3.75Å; I317-V550 HydrophobicContact CD1-CG1 4.14Å
318	T	86.2	Confident	85	Confident	22 Å²	22	20.7 Å²	20.7	14%	0.135	11%	0.105	C	C	.	.	H	α-helix	trans	-57.2	-43.4	178.4	-48.4	0	0	0	0	112.3	Y254 L314 Y322	Y254-T318 HydrophobicContact CE1-CG2 3.53Å; L314-T318 WeakPolarHBondContact O-CB 3.4Å; L314-T318 PolarHBondContact O-N 3.06Å; L314-T318 PolarHBondContact O-OG1 2.82Å; T318-Y322 WeakPolarHBondContact O-CB 3.24Å; T318-Y322 PolarHBondContact O-N 3.48Å
319	A	83.2	Confident	85	Confident	6 Å²	6	24.6 Å²	24.6	5%	0.05	12%	0.123	C	C	.	.	H	α-helix	trans	-66.7	-38.6	179.5	0	0	0	0	0	112.9	Y254 L258 A315 L316 I317 Q323	Y254-A319 HydrophobicContact CD1-CB 4.25Å; Y254-A319 HydrophobicContact CG-CB 4.2Å; L258-A319 HydrophobicContact CD1-CB 3.91Å; A315-A319 VanDerWaalsContact O-CB 3.31Å; A315-A319 WeakPolarHBondContact O-CB 3.32Å; A315-A319 PolarHBondContact O-N 2.75Å; L316-A319 PolarHBondContact O-N 3.33Å; I317-A319 VanDerWaalsContact C-N 3.32Å; I317-A319 PolarHBondContact O-N 3.49Å; A319-Q323 WeakPolarHBondContact O-CB 3.38Å; A319-Q323 PolarHBondContact O-N 2.83Å
320	N	82.4	Confident	85	Confident	43 Å²	43	24.7 Å²	24.7	23%	0.23	12%	0.123	C	C	.	.	H	α-helix	trans	-66.4	-45.4	175.8	-81.7	-40.7	0	0	0	111.8	L316 I317 Y322 Q323 Q324 V385	L316-N320 WeakPolarHBondContact O-CB 3.38Å; L316-N320 PolarHBondContact O-N 3.32Å; L316-N320 PolarHBondContact O-ND2 3.24Å; I317-N320 PolarHBondContact O-N 2.8Å; N320-Y322 PolarHBondContact O-N 2.94Å; N320-Q323 PolarHBondContact O-N 3.31Å; N320-Q324 PolarHBondContact O-N 2.85Å; N320-V385 WeakPolarHBondContact OD1-CA 3.32Å; N320-V385 VanDerWaalsContact OD1-CB 3.31Å; N320-V385 WeakPolarHBondContact OD1-CB 3.49Å; N320-V385 PolarHBondContact OD1-N 3.48Å
321	H	85.1	Confident	84.8	Confident	29 Å²	29	25.9 Å²	25.9	13%	0.134	13%	0.128	C	C	.	.	H	α-helix	trans	-62.6	-44.7	177.9	-59.6	176.7	0	0	0	111.2	I317 Q323 Q324 W325 Q546	I317-H321 WeakPolarHBondContact CG2-CE1 3.48Å; I317-H321 PolarHBondContact O-CD2 3.04Å; I317-H321 PolarHBondContact O-N 3.29Å; H321-Q323 VanDerWaalsContact C-N 3.34Å; H321-Q323 PolarHBondContact O-N 2.73Å; H321-Q324 WeakPolarHBondContact O-CB 3.42Å; H321-Q324 PolarHBondContact O-N 2.72Å; H321-W325 VanDerWaalsContact C-CE3 3.49Å; H321-W325 HydrophobicContact CB-CD2 4.26Å; H321-W325 HydrophobicContact CB-CE3 3.98Å; H321-W325 HydrophobicContact CB-CH2 3.44Å; H321-W325 VanDerWaalsContact CB-CH2 3.44Å; H321-W325 HydrophobicContact CB-CZ2 3.79Å; H321-W325 HydrophobicContact CB-CZ3 3.54Å; H321-W325 VanDerWaalsContact O-CG 3.24Å; H321-W325 PolarHBondContact O-N 2.79Å; H321-Q546 PolarHBondContact CE1-OE1 3.22Å
322	Y	84.4	Confident	84.6	Confident	7 Å²	7	28.1 Å²	28.1	3%	0.027	14%	0.143	C	C	.	.	H	α-helix	trans	-59.2	-43.6	174.8	-177.2	-94.1	0	0	0	112.6	L247 Q250 A251 Y254 T318 N320 Q324 W325 L326 L330 F536	L247-Y322 WeakPolarHBondContact CA-OH 3.24Å; L247-Y322 WeakPolarHBondContact CD2-OH 3.18Å; L247-Y322 PolarHBondContact O-OH 3.2Å; Q250-Y322 HydrophobicContact CB-CE1 4.27Å; Q250-Y322 HydrophobicContact CB-CE2 4.27Å; Q250-Y322 HydrophobicContact CG-CD2 4.3Å; Q250-Y322 HydrophobicContact CG-CE1 4.27Å; Q250-Y322 HydrophobicContact CG-CE2 3.75Å; A251-Y322 HydrophobicContact CB-CE1 4.01Å; Y254-Y322 AromaticContact CD2-CD1 3.72Å; Y254-Y322 HydrophobicContact CD2-CD1 3.72Å; Y254-Y322 HydrophobicContact CD2-CE1 4.43Å; Y254-Y322 AromaticContact CD2-CG 3.8Å; Y254-Y322 HydrophobicContact CD2-CG 3.8Å; Y254-Y322 AromaticContact CE2-CD1 3.79Å; Y254-Y322 HydrophobicContact CE2-CD1 3.79Å; Y254-Y322 AromaticContact CE2-CD2 3.78Å; Y254-Y322 HydrophobicContact CE2-CD2 3.78Å; Y254-Y322 HydrophobicContact CE2-CE1 4.49Å; Y254-Y322 HydrophobicContact CE2-CE2 4.48Å; Y254-Y322 AromaticContact CE2-CG 3.4Å; Y254-Y322 HydrophobicContact CE2-CG 3.4Å; T318-Y322 WeakPolarHBondContact O-CB 3.24Å; T318-Y322 PolarHBondContact O-N 3.48Å; N320-Y322 PolarHBondContact O-N 2.94Å; Y322-Q324 VanDerWaalsContact C-N 3.32Å; Y322-Q324 PolarHBondContact O-N 3.38Å; Y322-W325 PolarHBondContact O-N 3.07Å; Y322-L326 WeakPolarHBondContact O-CB 3.5Å; Y322-L326 PolarHBondContact O-N 3.37Å; Y322-L330 HydrophobicContact CE2-CD1 4.02Å; Y322-F536 HydrophobicContact CE2-CE2 4.15Å
323	Q	81	Confident	84.7	Confident	44 Å²	44	29 Å²	29	21%	0.206	15%	0.149	C	C	.	.	H	α-helix	trans	-61.9	-38.6	176.5	-179.6	70.9	1.6	0	0	111.9	A319 N320 H321 Y327 V385	A319-Q323 WeakPolarHBondContact O-CB 3.38Å; A319-Q323 PolarHBondContact O-N 2.83Å; N320-Q323 PolarHBondContact O-N 3.31Å; H321-Q323 VanDerWaalsContact C-N 3.34Å; H321-Q323 PolarHBondContact O-N 2.73Å; Q323-Y327 WeakPolarHBondContact O-CD2 3.45Å; Q323-V385 HydrophobicContact CB-CG2 3.82Å; Q323-V385 HydrophobicContact CG-CG2 3.72Å
324	Q	81.8	Confident	84.7	Confident	114 Å²	114	29.7 Å²	29.7	53%	0.533	15%	0.153	S	C	.	.	H	α-helix	trans	-65.6	-54.6	175.4	-179.2	177.1	-7.8	0	0	111.2	N320 H321 Y322 L326 Y327 T328	N320-Q324 PolarHBondContact O-N 2.85Å; H321-Q324 WeakPolarHBondContact O-CB 3.42Å; H321-Q324 PolarHBondContact O-N 2.72Å; Y322-Q324 VanDerWaalsContact C-N 3.32Å; Y322-Q324 PolarHBondContact O-N 3.38Å; Q324-L326 VanDerWaalsContact C-N 3.27Å; Q324-L326 PolarHBondContact O-N 2.84Å; Q324-Y327 PolarHBondContact O-N 3.4Å; Q324-T328 HydrophobicContact CG-CG2 4.14Å; Q324-T328 PolarHBondContact O-N 2.99Å; Q324-T328 PolarHBondContact O-OG1 3.47Å
325	W	87.5	Confident	84.6	Confident	20 Å²	20	31 Å²	31	8%	0.076	16%	0.16	C	C	.	.	H	α-helix	trans	-63.1	-29.3	-177.1	-61.4	-32.8	0	0	0	114.4	H321 Y322 Y327 T328 H329 L330 C539 D542	H321-W325 VanDerWaalsContact C-CE3 3.49Å; H321-W325 HydrophobicContact CB-CD2 4.26Å; H321-W325 HydrophobicContact CB-CE3 3.98Å; H321-W325 HydrophobicContact CB-CH2 3.44Å; H321-W325 VanDerWaalsContact CB-CH2 3.44Å; H321-W325 HydrophobicContact CB-CZ2 3.79Å; H321-W325 HydrophobicContact CB-CZ3 3.54Å; H321-W325 VanDerWaalsContact O-CG 3.24Å; H321-W325 PolarHBondContact O-N 2.79Å; Y322-W325 PolarHBondContact O-N 3.07Å; W325-Y327 PolarHBondContact O-N 2.89Å; W325-T328 WeakPolarHBondContact CA-OG1 3.26Å; W325-T328 PolarHBondContact O-N 3.17Å; W325-H329 AromaticContact CD1-CD2 3.3Å; W325-H329 AromaticContact CD1-NE2 3.57Å; W325-H329 AromaticContact CG-CD2 3.92Å; W325-H329 PolarHBondContact O-N 3.38Å; W325-L330 HydrophobicContact CB-CG 4.46Å; W325-L330 PolarHBondContact O-N 2.65Å; W325-C539 HydrophobicContact CB-CB 4.49Å; W325-C539 HydrophobicContact CD2-CB 3.86Å; W325-C539 HydrophobicContact CE3-CB 3.7Å; W325-C539 HydrophobicContact CG-CB 4.26Å; W325-C539 WeakPolarHBondContact CH2-O 3.35Å; W325-C539 HydrophobicContact CZ3-CB 4.21Å; W325-C539 WeakPolarHBondContact CZ3-O 3.46Å; W325-D542 HydrophobicContact CH2-CB 4.35Å; W325-D542 HydrophobicContact CZ2-CB 3.97Å
326	L	82.5	Confident	84.6	Confident	5 Å²	5	36 Å²	36	3%	0.026	18%	0.18	C	C	.	.	I	π-helix	trans	-52	-35.9	172.9	178.6	59	0	0	0	112	L247 Y322 Q324 R331	L247-L326 HydrophobicContact CB-CD1 3.84Å; L247-L326 HydrophobicContact CD1-CD1 4.06Å; L247-L326 HydrophobicContact CD2-CD1 4.08Å; L247-L326 HydrophobicContact CG-CD1 4.22Å; Y322-L326 WeakPolarHBondContact O-CB 3.5Å; Y322-L326 PolarHBondContact O-N 3.37Å; Q324-L326 VanDerWaalsContact C-N 3.27Å; Q324-L326 PolarHBondContact O-N 2.84Å; L326-R331 HydrophobicContact CD1-CG 4.17Å; L326-R331 VanDerWaalsContact O-CB 3.26Å; L326-R331 WeakPolarHBondContact O-CB 3.27Å; L326-R331 WeakPolarHBondContact O-CD 3.44Å; L326-R331 VanDerWaalsContact O-CG 3.26Å; L326-R331 WeakPolarHBondContact O-CG 3.41Å; L326-R331 PolarHBondContact O-N 3.06Å
327	Y	79.4	Confident	84.8	Confident	18 Å²	18	35.6 Å²	35.6	7%	0.071	18%	0.178	C	C	.	.	I	π-helix	trans	-102.3	-32.6	179.4	-58.9	-80.3	0	0	0	113.5	H93 Q323 Q324 W325 R331 P332 I379 P382	H93-Y327 AromaticContact CE1-CE1 3.63Å; H93-Y327 AromaticContact CE1-CZ 3.88Å; H93-Y327 PolarHBondContact CE1-OH 2.65Å; H93-Y327 PolarHBondContact NE2-OH 3.33Å; H93-Y327 VanDerWaalsContact NE2-OH 3.14Å; Q323-Y327 WeakPolarHBondContact O-CD2 3.45Å; Q324-Y327 PolarHBondContact O-N 3.4Å; W325-Y327 PolarHBondContact O-N 2.89Å; Y327-R331 PolarHBondContact OH-NH1 3.4Å; Y327-P332 VanDerWaalsContact O-CD 3.32Å; Y327-P332 WeakPolarHBondContact O-CD 3.39Å; Y327-P332 VanDerWaalsContact O-CG 3.24Å; Y327-P332 WeakPolarHBondContact O-CG 3.2Å; Y327-I379 HydrophobicContact CD1-CG2 3.96Å; Y327-P382 HydrophobicContact CD2-CG 3.76Å; Y327-P382 HydrophobicContact CE2-CG 3.47Å; Y327-P382 VanDerWaalsContact CE2-CG 3.47Å
328	T	80.3	Confident	84.9	Confident	42 Å²	42	34.1 Å²	34.1	26%	0.258	17%	0.171	S	C	.	.	I	π-helix	trans	-81.8	-27.9	-177.8	59.4	0	0	0	0	114.4	Q324 W325 F381	Q324-T328 HydrophobicContact CG-CG2 4.14Å; Q324-T328 PolarHBondContact O-N 2.99Å; Q324-T328 PolarHBondContact O-OG1 3.47Å; W325-T328 WeakPolarHBondContact CA-OG1 3.26Å; W325-T328 PolarHBondContact O-N 3.17Å; T328-F381 HydrophobicContact CG2-CD1 4.31Å; T328-F381 HydrophobicContact CG2-CE1 3.49Å; T328-F381 VanDerWaalsContact CG2-CE1 3.49Å; T328-F381 HydrophobicContact CG2-CZ 3.94Å
329	H	86.7	Confident	84.9	Confident	84 Å²	84	35.2 Å²	35.2	39%	0.389	17%	0.174	S	C	.	.	I	π-helix	trans	-134.8	-50.3	-174	-46.5	-55.4	0	0	0	113.9	W325 C333	W325-H329 AromaticContact CD1-CD2 3.3Å; W325-H329 AromaticContact CD1-NE2 3.57Å; W325-H329 AromaticContact CG-CD2 3.92Å; W325-H329 PolarHBondContact O-N 3.38Å; H329-C333 WeakPolarHBondContact O-CB 3.42Å; H329-C333 PolarHBondContact O-N 3.24Å
330	L	87.3	Confident	85.2	Confident	1 Å²	1	36.4 Å²	36.4	1%	0.005	18%	0.177	C	C	.	.	I	π-helix	trans	-67.1	-51.5	-168	-59.1	179.9	0	0	0	112.2	L247 Y322 W325 L334 F532 F536	L247-L330 HydrophobicContact CD2-CB 4.16Å; L247-L330 HydrophobicContact CD2-CD1 3.78Å; Y322-L330 HydrophobicContact CE2-CD1 4.02Å; W325-L330 HydrophobicContact CB-CG 4.46Å; W325-L330 PolarHBondContact O-N 2.65Å; L330-L334 WeakPolarHBondContact O-CB 3.29Å; L330-L334 PolarHBondContact O-N 3.2Å; L330-L334 VanDerWaalsContact O-N 3.07Å; L330-F532 HydrophobicContact CB-CE2 4.33Å; L330-F536 HydrophobicContact CD1-CD2 3.96Å; L330-F536 HydrophobicContact CD1-CE2 4.28Å; L330-F536 HydrophobicContact CD2-CB 4.12Å; L330-F536 HydrophobicContact CD2-CD2 3.89Å; L330-F536 HydrophobicContact CD2-CG 4.49Å
331	R	84.5	Confident	85.6	Confident	29 Å²	29	34.3 Å²	34.3	11%	0.109	17%	0.166	C	C	.	.	H	α-helix	trans	-67.7	-46.4	176.3	-78.6	173.4	157.7	167.3	-10.2	113.5	E244 L247 L326 Y327 C333 L334 L335	E244-R331 WeakPolarHBondContact OE1-CG 3.38Å; E244-R331 IonicContact OE1-CZ 2.65Å; E244-R331 IonicContact OE1-NE 3.84Å; E244-R331 PolarHBondContact OE1-NE 3.45Å; E244-R331 IonicContact OE1-NH2 2.74Å; E244-R331 PolarHBondContact OE1-NH2 3.24Å; E244-R331 IonicContact OE2-CZ 2.82Å; E244-R331 IonicContact OE2-NE 2.82Å; E244-R331 IonicContact OE2-NH2 3.31Å; E244-R331 PolarHBondContact OE2-NH2 2.68Å; L247-R331 HydrophobicContact CD1-CG 4.26Å; L326-R331 HydrophobicContact CD1-CG 4.17Å; L326-R331 VanDerWaalsContact O-CB 3.26Å; L326-R331 WeakPolarHBondContact O-CB 3.27Å; L326-R331 WeakPolarHBondContact O-CD 3.44Å; L326-R331 VanDerWaalsContact O-CG 3.26Å; L326-R331 WeakPolarHBondContact O-CG 3.41Å; L326-R331 PolarHBondContact O-N 3.06Å; Y327-R331 PolarHBondContact OH-NH1 3.4Å; R331-C333 VanDerWaalsContact C-N 3.29Å; R331-C333 PolarHBondContact O-N 3.35Å; R331-L334 PolarHBondContact O-N 3.41Å; R331-L335 WeakPolarHBondContact O-CB 3.48Å; R331-L335 PolarHBondContact O-N 2.85Å
332	P	84.9	Confident	85.8	Confident	61 Å²	61	33 Å²	33	40%	0.396	16%	0.16	S	C	.	.	H	α-helix	trans	-56.1	-40.9	173.6	-29	36.3	0	0	0	113.4	Y327 L335 K336	Y327-P332 VanDerWaalsContact O-CD 3.32Å; Y327-P332 WeakPolarHBondContact O-CD 3.39Å; Y327-P332 VanDerWaalsContact O-CG 3.24Å; Y327-P332 WeakPolarHBondContact O-CG 3.2Å; P332-L335 PolarHBondContact O-N 2.91Å; P332-K336 WeakPolarHBondContact O-CB 3.25Å; P332-K336 PolarHBondContact O-N 3.15Å
333	C	88.4	Confident	85.9	Confident	21 Å²	21	35.2 Å²	35.2	14%	0.142	17%	0.171	C	C	.	.	H	α-helix	trans	-65.4	-45	177.3	-170.8	0	0	0	0	112.2	H329 R331 L335 G337 E531 C535	H329-C333 WeakPolarHBondContact O-CB 3.42Å; H329-C333 PolarHBondContact O-N 3.24Å; R331-C333 VanDerWaalsContact C-N 3.29Å; R331-C333 PolarHBondContact O-N 3.35Å; C333-L335 VanDerWaalsContact C-N 3.34Å; C333-L335 PolarHBondContact O-N 2.97Å; C333-G337 PolarHBondContact O-N 3.11Å; C333-E531 VanDerWaalsContact SG-C 3.56Å; C333-E531 PolarHBondContact SG-O 3.48Å; C333-C535 HydrophobicContact CB-CB 4.2Å
334	L	86.5	Confident	86.3	Confident	16 Å²	16	33.1 Å²	33.1	8%	0.084	16%	0.161	C	C	.	.	H	α-helix	trans	-60.8	-43.6	175.6	-177	62.4	0	0	0	111.4	Y240 C243 E244 L330 R331 G337 V338 F532	Y240-L334 HydrophobicContact CD2-CD2 3.81Å; Y240-L334 HydrophobicContact CD2-CG 3.95Å; Y240-L334 HydrophobicContact CE2-CD2 3.9Å; Y240-L334 HydrophobicContact CE2-CG 4.25Å; C243-L334 HydrophobicContact CB-CD1 4.06Å; C243-L334 HydrophobicContact CB-CD2 3.81Å; E244-L334 HydrophobicContact CG-CD2 4.43Å; L330-L334 WeakPolarHBondContact O-CB 3.29Å; L330-L334 PolarHBondContact O-N 3.2Å; L330-L334 VanDerWaalsContact O-N 3.07Å; R331-L334 PolarHBondContact O-N 3.41Å; L334-G337 PolarHBondContact O-N 3.49Å; L334-V338 WeakPolarHBondContact O-CG2 3.44Å; L334-V338 PolarHBondContact O-N 3.35Å; L334-V338 VanDerWaalsContact O-N 3.1Å; L334-F532 HydrophobicContact CB-CD2 3.83Å; L334-F532 HydrophobicContact CB-CE2 4.06Å; L334-F532 HydrophobicContact CD1-CD2 4.32Å; L334-F532 HydrophobicContact CD1-CG 4.46Å
335	L	86.7	Confident	86.7	Confident	37 Å²	37	27.7 Å²	27.7	19%	0.194	14%	0.136	C	C	.	.	H	α-helix	trans	-67.5	-45.1	-178.4	-171.7	56.2	0	0	0	112.4	I100 R331 P332 C333 G337 V338 E339 L375 L377	I100-L335 HydrophobicContact CD1-CD1 3.53Å; I100-L335 HydrophobicContact CG1-CD1 3.92Å; R331-L335 WeakPolarHBondContact O-CB 3.48Å; R331-L335 PolarHBondContact O-N 2.85Å; P332-L335 PolarHBondContact O-N 2.91Å; C333-L335 VanDerWaalsContact C-N 3.34Å; C333-L335 PolarHBondContact O-N 2.97Å; L335-G337 VanDerWaalsContact C-N 3.26Å; L335-G337 PolarHBondContact O-N 3.18Å; L335-V338 PolarHBondContact O-N 2.93Å; L335-V338 VanDerWaalsContact O-N 3.13Å; L335-E339 PolarHBondContact O-N 3.13Å; L335-L375 HydrophobicContact CD1-CD2 4.02Å; L335-L375 HydrophobicContact CD2-CD2 4.04Å; L335-L375 HydrophobicContact CD2-CG 4.31Å; L335-L375 HydrophobicContact CG-CD2 4.12Å; L335-L377 HydrophobicContact CD2-CD1 4.35Å
336	K	86.8	Confident	86.5	Confident	115 Å²	115	27.8 Å²	27.8	50%	0.5	14%	0.139	S	C	.	.	H	α-helix	trans	-55.3	-41.1	173.4	-179.3	-163.9	173	-142.8	0	111.8	P332 R340 E531	P332-K336 WeakPolarHBondContact O-CB 3.25Å; P332-K336 PolarHBondContact O-N 3.15Å; K336-R340 WeakPolarHBondContact O-CB 3.27Å; K336-R340 PolarHBondContact O-N 3.36Å; K336-E531 IonicContact NZ-OE1 3.88Å; K336-E531 PolarHBondContact NZ-OE1 3.27Å
337	G	88.6	Confident	86.7	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-67.9	-36.5	177.4	0	0	0	0	0	113.8	C333 L334 L335 T341 A528	C333-G337 PolarHBondContact O-N 3.11Å; L334-G337 PolarHBondContact O-N 3.49Å; L335-G337 VanDerWaalsContact C-N 3.26Å; L335-G337 PolarHBondContact O-N 3.18Å; G337-T341 WeakPolarHBondContact O-CB 3.06Å; G337-T341 PolarHBondContact O-N 3.37Å; G337-T341 PolarHBondContact O-OG1 2.79Å; G337-A528 VanDerWaalsContact CA-CB 3.46Å
338	V	88	Confident	87.1	Confident	3 Å²	3	30.8 Å²	30.8	2%	0.018	15%	0.154	C	C	.	.	H	α-helix	trans	-66.9	-53.7	172	170.6	0	0	0	0	110.6	I100 I104 L236 Y240 L334 L335 R340 T341 M342	I100-V338 HydrophobicContact CG2-CG1 4.25Å; I104-V338 HydrophobicContact CD1-CG1 4.1Å; L236-V338 HydrophobicContact CD1-CG2 4.11Å; L236-V338 HydrophobicContact CD2-CG1 4.23Å; L236-V338 HydrophobicContact CG-CG2 4.46Å; Y240-V338 HydrophobicContact CD2-CG2 4.01Å; Y240-V338 HydrophobicContact CG-CG2 4.46Å; L334-V338 WeakPolarHBondContact O-CG2 3.44Å; L334-V338 PolarHBondContact O-N 3.35Å; L334-V338 VanDerWaalsContact O-N 3.1Å; L335-V338 PolarHBondContact O-N 2.93Å; L335-V338 VanDerWaalsContact O-N 3.13Å; V338-R340 PolarHBondContact O-N 2.87Å; V338-T341 PolarHBondContact O-N 3.14Å; V338-M342 HydrophobicContact CG1-CG 4.3Å; V338-M342 HydrophobicContact CG1-SD 3.68Å; V338-M342 WeakPolarHBondContact O-CG 3.49Å; V338-M342 PolarHBondContact O-N 3.03Å
339	E	86.1	Confident	87.4	Confident	45 Å²	45	29.1 Å²	29.1	21%	0.21	14%	0.144	C	C	.	.	H	α-helix	trans	-55	-51.5	-178.7	-174.7	-172.5	-174.1	0	0	111.4	L335 T341 M342 Q343 F371 Q372	L335-E339 PolarHBondContact O-N 3.13Å; E339-T341 PolarHBondContact O-N 3.1Å; E339-M342 PolarHBondContact O-N 3.32Å; E339-Q343 VanDerWaalsContact CD-NE2 3.34Å; E339-Q343 HydrophobicContact CG-CG 4.21Å; E339-Q343 WeakPolarHBondContact O-CB 3.44Å; E339-Q343 VanDerWaalsContact O-CG 3.26Å; E339-Q343 WeakPolarHBondContact O-CG 3.32Å; E339-Q343 PolarHBondContact O-N 2.79Å; E339-Q343 PolarHBondContact OE1-NE2 2.95Å; E339-F371 HydrophobicContact CB-CE1 4.08Å; E339-F371 HydrophobicContact CG-CD1 4.46Å; E339-F371 HydrophobicContact CG-CE1 3.99Å; E339-Q372 PolarHBondContact OE1-NE2 3.29Å
340	R	90.5	Very high	87.3	Confident	30 Å²	30	31.8 Å²	31.8	11%	0.113	15%	0.15	C	C	.	.	H	α-helix	trans	-56.1	-38.7	178.6	-176	-176.4	63.8	-131.5	-11.8	112.1	K336 V338 L344 S524 A528 E531	K336-R340 WeakPolarHBondContact O-CB 3.27Å; K336-R340 PolarHBondContact O-N 3.36Å; V338-R340 PolarHBondContact O-N 2.87Å; R340-L344 HydrophobicContact CG-CD1 4.01Å; R340-L344 WeakPolarHBondContact O-CB 3.32Å; R340-L344 WeakPolarHBondContact O-CD1 3.47Å; R340-L344 WeakPolarHBondContact O-CG 3.44Å; R340-L344 PolarHBondContact O-N 3.41Å; R340-S524 PolarHBondContact NE-OG 3.04Å; R340-S524 PolarHBondContact NH2-O 3.24Å; R340-A528 VanDerWaalsContact NH2-N 3.17Å; R340-E531 IonicContact CZ-OE2 3.65Å; R340-E531 VanDerWaalsContact NH1-CD 3.26Å; R340-E531 IonicContact NH1-OE1 2.66Å; R340-E531 PolarHBondContact NH1-OE1 3.48Å; R340-E531 VanDerWaalsContact NH1-OE1 3.11Å; R340-E531 IonicContact NH1-OE2 3.26Å; R340-E531 PolarHBondContact NH1-OE2 3.41Å; R340-E531 IonicContact NH2-OE2 3.99Å; R340-E531 PolarHBondContact NH2-OE2 3.38Å
341	T	91	Very high	87.2	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-72.6	-41.9	-178.1	-54.5	0	0	0	0	111.3	L236 G337 V338 E339 L344 A345 S524 F525	L236-T341 HydrophobicContact CD1-CG2 4.27Å; L236-T341 HydrophobicContact CD2-CG2 3.99Å; G337-T341 WeakPolarHBondContact O-CB 3.06Å; G337-T341 PolarHBondContact O-N 3.37Å; G337-T341 PolarHBondContact O-OG1 2.79Å; V338-T341 PolarHBondContact O-N 3.14Å; E339-T341 PolarHBondContact O-N 3.1Å; T341-L344 PolarHBondContact O-N 2.9Å; T341-A345 WeakPolarHBondContact O-CB 3.41Å; T341-A345 PolarHBondContact O-N 2.89Å; T341-S524 PolarHBondContact OG1-OG 2.74Å; T341-F525 HydrophobicContact CG2-CB 4.11Å
342	M	89.1	Confident	87.2	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-64.9	-41.1	174.4	-68.8	179	74.3	0	0	112.6	A103 I104 Q107 L236 V338 E339 A345 S346 W367 F371	A103-M342 HydrophobicContact CB-CE 4.05Å; I104-M342 HydrophobicContact CB-CE 4.46Å; I104-M342 HydrophobicContact CD1-SD 4.47Å; I104-M342 HydrophobicContact CG1-CE 3.85Å; I104-M342 HydrophobicContact CG1-CG 4.43Å; I104-M342 HydrophobicContact CG1-SD 3.57Å; I104-M342 VanDerWaalsContact CG1-SD 3.57Å; Q107-M342 HydrophobicContact CB-CE 4.47Å; Q107-M342 PolarHBondContact NE2-O 3.29Å; Q107-M342 VanDerWaalsContact OE1-CB 3.26Å; Q107-M342 VanDerWaalsContact OE1-CE 3.29Å; L236-M342 HydrophobicContact CD2-CG 3.85Å; V338-M342 HydrophobicContact CG1-CG 4.3Å; V338-M342 HydrophobicContact CG1-SD 3.68Å; V338-M342 WeakPolarHBondContact O-CG 3.49Å; V338-M342 PolarHBondContact O-N 3.03Å; E339-M342 PolarHBondContact O-N 3.32Å; M342-A345 WeakPolarHBondContact O-CB 3.27Å; M342-A345 PolarHBondContact O-N 3.24Å; M342-S346 PolarHBondContact O-N 3.17Å; M342-W367 HydrophobicContact CB-CH2 3.8Å; M342-W367 HydrophobicContact CB-CZ3 4.16Å; M342-W367 HydrophobicContact CE-CE3 4.42Å; M342-W367 HydrophobicContact CE-CZ3 3.86Å; M342-W367 WeakPolarHBondContact O-CH2 3.28Å; M342-W367 WeakPolarHBondContact O-CZ2 3.49Å; M342-F371 HydrophobicContact CE-CE2 4.4Å; M342-F371 HydrophobicContact SD-CE1 4.24Å; M342-F371 HydrophobicContact SD-CE2 4.23Å; M342-F371 HydrophobicContact SD-CZ 3.89Å
343	Q	86.5	Confident	87.1	Confident	55 Å²	55	29.2 Å²	29.2	26%	0.257	14%	0.135	S	C	.	.	H	α-helix	trans	-56.9	-53.7	172.7	-73.2	173.8	-3.6	0	0	110.4	E339 A345 S346 E347 L368	E339-Q343 VanDerWaalsContact CD-NE2 3.34Å; E339-Q343 HydrophobicContact CG-CG 4.21Å; E339-Q343 WeakPolarHBondContact O-CB 3.44Å; E339-Q343 VanDerWaalsContact O-CG 3.26Å; E339-Q343 WeakPolarHBondContact O-CG 3.32Å; E339-Q343 PolarHBondContact O-N 2.79Å; E339-Q343 PolarHBondContact OE1-NE2 2.95Å; Q343-A345 VanDerWaalsContact C-N 3.27Å; Q343-A345 PolarHBondContact O-N 3.37Å; Q343-S346 PolarHBondContact O-N 3.44Å; Q343-E347 PolarHBondContact O-N 3.29Å; Q343-L368 HydrophobicContact CG-CD1 4.2Å; Q343-L368 HydrophobicContact CG-CD2 4.4Å
344	L	89.8	Confident	86.7	Confident	0 Å²	0	30.6 Å²	30.6	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-60.2	-34.2	178	-73.5	168.8	0	0	0	112.5	R340 T341 S346 E347 V348 L450 L520 C521	R340-L344 HydrophobicContact CG-CD1 4.01Å; R340-L344 WeakPolarHBondContact O-CB 3.32Å; R340-L344 WeakPolarHBondContact O-CD1 3.47Å; R340-L344 WeakPolarHBondContact O-CG 3.44Å; R340-L344 PolarHBondContact O-N 3.41Å; T341-L344 PolarHBondContact O-N 2.9Å; L344-S346 PolarHBondContact O-N 3.21Å; L344-E347 VanDerWaalsContact CD2-CD 3.45Å; L344-E347 HydrophobicContact CD2-CG 4.46Å; L344-E347 WeakPolarHBondContact CD2-OE1 3.14Å; L344-E347 VanDerWaalsContact CD2-OE2 3.22Å; L344-E347 WeakPolarHBondContact CD2-OE2 3.24Å; L344-E347 WeakPolarHBondContact O-CA 3.37Å; L344-E347 WeakPolarHBondContact O-CB 3.25Å; L344-E347 PolarHBondContact O-N 3.47Å; L344-V348 WeakPolarHBondContact O-CG2 3.1Å; L344-V348 PolarHBondContact O-N 3.12Å; L344-L450 HydrophobicContact CD1-CD1 3.99Å; L344-L520 HydrophobicContact CB-CG 4.42Å; L344-L520 HydrophobicContact CD1-CG 4.37Å; L344-L520 HydrophobicContact CD2-CD1 4.13Å; L344-L520 HydrophobicContact CD2-CD2 3.56Å; L344-L520 HydrophobicContact CD2-CG 3.64Å; L344-L520 HydrophobicContact CG-CG 4.37Å; L344-C521 VanDerWaalsContact C-SG 3.52Å
345	A	89	Confident	86.4	Confident	0 Å²	0	30.3 Å²	30.3	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-61.8	-29.3	175.2	0	0	0	0	0	113	L229 E233 T341 M342 Q343 V349 C521	L229-A345 HydrophobicContact CD1-CB 3.8Å; L229-A345 HydrophobicContact CD2-CB 4.27Å; L229-A345 WeakPolarHBondContact CD2-O 3.41Å; L229-A345 HydrophobicContact CG-CB 4.36Å; E233-A345 WeakPolarHBondContact OE1-CB 3.49Å; T341-A345 WeakPolarHBondContact O-CB 3.41Å; T341-A345 PolarHBondContact O-N 2.89Å; M342-A345 WeakPolarHBondContact O-CB 3.27Å; M342-A345 PolarHBondContact O-N 3.24Å; Q343-A345 VanDerWaalsContact C-N 3.27Å; Q343-A345 PolarHBondContact O-N 3.37Å; A345-V349 WeakPolarHBondContact O-CG2 3.48Å; A345-V349 PolarHBondContact O-N 3.48Å; A345-C521 WeakPolarHBondContact CA-SG 3.32Å; A345-C521 PolarHBondContact N-SG 2.87Å; A345-C521 VanDerWaalsContact N-SG 3.35Å
346	S	85.1	Confident	85.9	Confident	22 Å²	22	28.6 Å²	28.6	15%	0.154	13%	0.131	C	C	.	.	H	α-helix	trans	-79.3	-32.9	169.6	-74	0	0	0	0	113.8	M342 Q343 L344 V348 V349 W350 W367	M342-S346 PolarHBondContact O-N 3.17Å; Q343-S346 PolarHBondContact O-N 3.44Å; L344-S346 PolarHBondContact O-N 3.21Å; S346-V348 VanDerWaalsContact C-N 3.27Å; S346-V348 PolarHBondContact O-N 2.79Å; S346-V349 PolarHBondContact O-N 3.31Å; S346-W350 WeakPolarHBondContact O-CB 3.45Å; S346-W350 PolarHBondContact O-N 3.2Å; S346-W367 VanDerWaalsContact OG-CE2 3.26Å; S346-W367 WeakPolarHBondContact OG-CZ2 3.46Å; S346-W367 PolarHBondContact OG-NE1 3.08Å
347	E	85.1	Confident	85.1	Confident	85 Å²	85	24 Å²	24	40%	0.397	12%	0.117	S	C	.	.	H	α-helix	trans	-58.2	-42.9	168.1	-62.9	179.2	-153.5	0	0	110.5	Q343 L344 W350 H351 R454	Q343-E347 PolarHBondContact O-N 3.29Å; L344-E347 VanDerWaalsContact CD2-CD 3.45Å; L344-E347 HydrophobicContact CD2-CG 4.46Å; L344-E347 WeakPolarHBondContact CD2-OE1 3.14Å; L344-E347 VanDerWaalsContact CD2-OE2 3.22Å; L344-E347 WeakPolarHBondContact CD2-OE2 3.24Å; L344-E347 WeakPolarHBondContact O-CA 3.37Å; L344-E347 WeakPolarHBondContact O-CB 3.25Å; L344-E347 PolarHBondContact O-N 3.47Å; E347-W350 PolarHBondContact O-N 3.46Å; E347-H351 WeakPolarHBondContact O-CB 3.4Å; E347-H351 PolarHBondContact O-N 2.73Å; E347-R454 IonicContact OE1-NH2 3.58Å; E347-R454 PolarHBondContact OE1-NH2 3.17Å
348	V	88.4	Confident	84.1	Confident	1 Å²	1	26.4 Å²	26.4	1%	0.006	13%	0.128	C	C	.	.	H	α-helix	trans	-64.1	-47	176.9	169.8	0	0	0	0	112.2	L229 L344 S346 W350 H351 L352 P517 L520 C521	L229-V348 HydrophobicContact CD1-CB 4.48Å; L229-V348 HydrophobicContact CD1-CG1 4.19Å; L229-V348 HydrophobicContact CD2-CB 4.39Å; L229-V348 HydrophobicContact CD2-CG1 3.99Å; L344-V348 WeakPolarHBondContact O-CG2 3.1Å; L344-V348 PolarHBondContact O-N 3.12Å; S346-V348 VanDerWaalsContact C-N 3.27Å; S346-V348 PolarHBondContact O-N 2.79Å; V348-W350 PolarHBondContact O-N 3.09Å; V348-H351 PolarHBondContact O-N 3.44Å; V348-L352 HydrophobicContact CG1-CD1 4.09Å; V348-L352 VanDerWaalsContact O-CG 3.3Å; V348-L352 WeakPolarHBondContact O-CG 3.23Å; V348-L352 PolarHBondContact O-N 3.09Å; V348-P517 HydrophobicContact CB-CB 4.32Å; V348-P517 HydrophobicContact CG1-CB 3.93Å; V348-P517 HydrophobicContact CG1-CG 4.02Å; V348-P517 HydrophobicContact CG2-CB 4.08Å; V348-P517 WeakPolarHBondContact CG2-O 3.48Å; V348-L520 HydrophobicContact CG2-CB 4.13Å; V348-L520 HydrophobicContact CG2-CD2 4.25Å; V348-C521 VanDerWaalsContact CG2-SG 3.52Å
349	V	86.8	Confident	82.8	Confident	7 Å²	7	33.1 Å²	33.1	4%	0.042	16%	0.164	C	C	.	.	H	α-helix	trans	-56.1	-50.5	173.5	161.8	0	0	0	0	110.7	I111 M114 L226 L229 A345 S346 H351 L352 L353 F363	I111-V349 HydrophobicContact CG1-CG2 4.35Å; M114-V349 HydrophobicContact CE-CB 4.38Å; M114-V349 HydrophobicContact CE-CG1 3.62Å; M114-V349 HydrophobicContact CE-CG2 3.77Å; M114-V349 HydrophobicContact SD-CG1 3.52Å; M114-V349 VanDerWaalsContact SD-CG1 3.52Å; L226-V349 HydrophobicContact CD2-CG2 4.01Å; L229-V349 HydrophobicContact CD2-CG2 3.78Å; A345-V349 WeakPolarHBondContact O-CG2 3.48Å; A345-V349 PolarHBondContact O-N 3.48Å; S346-V349 PolarHBondContact O-N 3.31Å; V349-H351 VanDerWaalsContact C-N 3.35Å; V349-H351 PolarHBondContact O-N 2.98Å; V349-L352 PolarHBondContact O-N 2.93Å; V349-L353 HydrophobicContact CG1-CD1 4.09Å; V349-L353 WeakPolarHBondContact O-CG 3.48Å; V349-L353 PolarHBondContact O-N 2.86Å; V349-L353 VanDerWaalsContact O-N 3.08Å; V349-F363 HydrophobicContact CG1-CE1 4.37Å
350	W	83.8	Confident	81.3	Confident	139 Å²	139	33.4 Å²	33.4	53%	0.527	17%	0.166	S	C	.	.	H	α-helix	trans	-60.8	-44.2	-179.1	-176.9	92	0	0	0	111.4	S346 E347 V348 L352 L353 V354 I360	S346-W350 WeakPolarHBondContact O-CB 3.45Å; S346-W350 PolarHBondContact O-N 3.2Å; E347-W350 PolarHBondContact O-N 3.46Å; V348-W350 PolarHBondContact O-N 3.09Å; W350-L352 PolarHBondContact O-N 3.24Å; W350-L353 PolarHBondContact O-N 3.45Å; W350-V354 HydrophobicContact CD2-CG2 3.98Å; W350-V354 HydrophobicContact CE3-CG2 4.16Å; W350-V354 HydrophobicContact CH2-CG2 3.99Å; W350-V354 HydrophobicContact CZ2-CG2 3.79Å; W350-V354 HydrophobicContact CZ3-CG2 4.16Å; W350-V354 WeakPolarHBondContact O-CG2 3.44Å; W350-V354 PolarHBondContact O-N 3.07Å; W350-I360 HydrophobicContact CG-CD1 4.46Å
351	H	85.7	Confident	79.3	Confident	18 Å²	18	39.6 Å²	39.6	8%	0.083	20%	0.196	C	C	.	.	H	α-helix	trans	-60.8	-42.4	176.8	-162.4	90.3	0	0	0	112.2	E347 V348 V349 L353 V354 F355 F457 R514 P517	E347-H351 WeakPolarHBondContact O-CB 3.4Å; E347-H351 PolarHBondContact O-N 2.73Å; V348-H351 PolarHBondContact O-N 3.44Å; V349-H351 VanDerWaalsContact C-N 3.35Å; V349-H351 PolarHBondContact O-N 2.98Å; H351-L353 VanDerWaalsContact C-N 3.35Å; H351-L353 PolarHBondContact O-N 3.09Å; H351-V354 PolarHBondContact O-N 2.91Å; H351-F355 WeakPolarHBondContact O-CB 3.15Å; H351-F355 PolarHBondContact O-N 2.89Å; H351-F457 AromaticContact CE1-CD1 3.71Å; H351-F457 AromaticContact NE2-CD1 3.74Å; H351-R514 PolarHBondContact NE2-O 3.46Å; H351-P517 HydrophobicContact CB-CB 4.36Å
352	L	85.8	Confident	77.1	Confident	2 Å²	2	48.2 Å²	48.2	1%	0.01	24%	0.236	C	C	.	.	H	α-helix	trans	-64.4	-36.6	177.8	-71.9	170.5	0	0	0	113.2	T222 Q225 L226 V348 V349 W350 G356 P517	T222-L352 HydrophobicContact CG2-CB 4.44Å; Q225-L352 HydrophobicContact CB-CD1 3.61Å; Q225-L352 HydrophobicContact CB-CD2 3.55Å; Q225-L352 HydrophobicContact CB-CG 4.23Å; Q225-L352 HydrophobicContact CG-CD2 3.89Å; L226-L352 HydrophobicContact CD2-CD1 3.93Å; L226-L352 HydrophobicContact CG-CD1 3.97Å; V348-L352 HydrophobicContact CG1-CD1 4.09Å; V348-L352 VanDerWaalsContact O-CG 3.3Å; V348-L352 WeakPolarHBondContact O-CG 3.23Å; V348-L352 PolarHBondContact O-N 3.09Å; V349-L352 PolarHBondContact O-N 2.93Å; W350-L352 PolarHBondContact O-N 3.24Å; L352-G356 PolarHBondContact O-N 2.69Å; L352-G356 VanDerWaalsContact O-N 3.09Å; L352-P517 HydrophobicContact CD1-CG 4.28Å; L352-P517 HydrophobicContact CD2-CG 3.46Å; L352-P517 VanDerWaalsContact CD2-CG 3.46Å; L352-P517 HydrophobicContact CG-CG 3.59Å
353	L	81.9	Confident	75	Confident	18 Å²	18	53.3 Å²	53.3	9%	0.094	26%	0.258	C	S	.	.	H	α-helix	trans	-67.7	-48.4	175.3	-67.6	175.7	0	0	0	111.1	F118 V349 W350 H351 G356 G357 E358 I360 F363	F118-L353 HydrophobicContact CE2-CD2 3.61Å; F118-L353 HydrophobicContact CZ-CD2 3.58Å; V349-L353 HydrophobicContact CG1-CD1 4.09Å; V349-L353 WeakPolarHBondContact O-CG 3.48Å; V349-L353 PolarHBondContact O-N 2.86Å; V349-L353 VanDerWaalsContact O-N 3.08Å; W350-L353 PolarHBondContact O-N 3.45Å; H351-L353 VanDerWaalsContact C-N 3.35Å; H351-L353 PolarHBondContact O-N 3.09Å; L353-G356 PolarHBondContact O-N 3.39Å; L353-G357 PolarHBondContact O-N 3.38Å; L353-E358 PolarHBondContact O-N 2.85Å; L353-I360 HydrophobicContact CB-CD1 3.33Å; L353-I360 HydrophobicContact CB-CG1 3.92Å; L353-I360 HydrophobicContact CD1-CD1 4.03Å; L353-I360 HydrophobicContact CG-CD1 4.32Å; L353-F363 HydrophobicContact CD1-CD2 4.23Å; L353-F363 HydrophobicContact CD1-CE2 4.47Å; L353-F363 HydrophobicContact CD1-CG 4.34Å
354	V	78.9	Confident	73.1	Confident	50 Å²	50	56.8 Å²	56.8	30%	0.303	28%	0.275	S	S	.	.	H	α-helix	trans	-65.1	-44.8	178.6	175.8	0	0	0	0	111.7	W350 H351 G356 G357 I360	W350-V354 HydrophobicContact CD2-CG2 3.98Å; W350-V354 HydrophobicContact CE3-CG2 4.16Å; W350-V354 HydrophobicContact CH2-CG2 3.99Å; W350-V354 HydrophobicContact CZ2-CG2 3.79Å; W350-V354 HydrophobicContact CZ3-CG2 4.16Å; W350-V354 WeakPolarHBondContact O-CG2 3.44Å; W350-V354 PolarHBondContact O-N 3.07Å; H351-V354 PolarHBondContact O-N 2.91Å; V354-G356 PolarHBondContact O-N 2.99Å; V354-G357 WeakPolarHBondContact O-CA 3.46Å; V354-G357 PolarHBondContact O-N 3.39Å; V354-I360 HydrophobicContact CG2-CD1 3.51Å; V354-I360 HydrophobicContact CG2-CG1 4.41Å
355	F	81.9	Confident	71	Confident	10 Å²	10	59 Å²	59	4%	0.044	29%	0.291	C	S	.	.	H	α-helix	trans	-68.6	-24.2	179.3	-169.9	-118.7	0	0	0	112.4	F217 H351 G357 P464 W465 L509 R514 A515	F217-F355 AromaticContact CE2-CD1 3.89Å; F217-F355 HydrophobicContact CE2-CD1 3.89Å; F217-F355 AromaticContact CE2-CE1 3.73Å; F217-F355 HydrophobicContact CE2-CE1 3.73Å; F217-F355 AromaticContact CZ-CD1 3.6Å; F217-F355 HydrophobicContact CZ-CD1 3.6Å; F217-F355 AromaticContact CZ-CE1 3.95Å; F217-F355 HydrophobicContact CZ-CE1 3.95Å; F217-F355 HydrophobicContact CZ-CG 4.36Å; F217-F355 WeakPolarHBondContact CZ-O 3.47Å; H351-F355 WeakPolarHBondContact O-CB 3.15Å; H351-F355 PolarHBondContact O-N 2.89Å; F355-G357 PolarHBondContact O-N 3.2Å; F355-P464 HydrophobicContact CE2-CG 4.16Å; F355-W465 PolarHBondContact O-NE1 3.25Å; F355-L509 HydrophobicContact CZ-CD2 4.28Å; F355-R514 HydrophobicContact CD2-CB 4.4Å; F355-R514 HydrophobicContact CE2-CB 3.99Å; F355-R514 HydrophobicContact CZ-CB 4.16Å; F355-A515 HydrophobicContact CE1-CB 3.73Å; F355-A515 HydrophobicContact CZ-CB 4.37Å
356	G	74.9	Confident	69.3	Low	0 Å²	0	63.3 Å²	63.3	0%	0	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-3.6	166.3	0	0	0	0	0	115.2	R214 F217 H218 L352 L353 V354 E358 W465	R214-G356 VanDerWaalsContact CZ-O 3.27Å; R214-G356 PolarHBondContact NH1-O 2.94Å; R214-G356 PolarHBondContact NH2-O 2.95Å; F217-G356 VanDerWaalsContact CE1-CA 3.43Å; H218-G356 WeakPolarHBondContact NE2-CA 3.41Å; H218-G356 PolarHBondContact NE2-O 3.1Å; L352-G356 PolarHBondContact O-N 2.69Å; L352-G356 VanDerWaalsContact O-N 3.09Å; L353-G356 PolarHBondContact O-N 3.39Å; V354-G356 PolarHBondContact O-N 2.99Å; G356-E358 VanDerWaalsContact C-N 3.26Å; G356-E358 PolarHBondContact O-N 3.36Å; G356-W465 VanDerWaalsContact C-CD1 3.44Å
357	G	70.2	Confident	67.5	Low	19 Å²	19	64.3 Å²	64.3	20%	0.196	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	65.5	27.4	-178	0	0	0	0	0	113.9	L353 V354 F355	L353-G357 PolarHBondContact O-N 3.38Å; V354-G357 WeakPolarHBondContact O-CA 3.46Å; V354-G357 PolarHBondContact O-N 3.39Å; F355-G357 PolarHBondContact O-N 3.2Å
358	E	68.6	Low	65.4	Low	50 Å²	50	61.9 Å²	61.9	23%	0.234	30%	0.304	C	S	.	.			trans	-78.7	131.4	166.8	-63.7	-59.3	155.6	0	0	109.5	F118 R214 H218 L353 G356 I360	F118-E358 HydrophobicContact CE1-CG 4.42Å; F118-E358 HydrophobicContact CZ-CG 4.32Å; R214-E358 IonicContact CZ-OE1 3.57Å; R214-E358 IonicContact NH2-OE1 3.24Å; R214-E358 PolarHBondContact NH2-OE1 3.35Å; H218-E358 IonicContact NE2-OE1 3.91Å; L353-E358 PolarHBondContact O-N 2.85Å; G356-E358 VanDerWaalsContact C-N 3.26Å; G356-E358 PolarHBondContact O-N 3.36Å; E358-I360 PolarHBondContact O-N 3.01Å
359	N	59.9	Low	63.6	Low	144 Å²	144	66.8 Å²	66.8	77%	0.77	33%	0.325	S	S	*	.			trans	-78.8	87.4	-179.7	-79.1	-26.5	0	0	0	111	H361	N359-H361 PolarHBondContact O-N 3.06Å
360	I	55.2	Low	61.9	Low	51 Å²	51	72.1 Å²	72.1	26%	0.262	35%	0.349	S	S	.	.			trans	-73.7	89.7	-179	-44.4	174.6	0	0	0	111.5	W350 L353 V354 E358 F363	W350-I360 HydrophobicContact CG-CD1 4.46Å; L353-I360 HydrophobicContact CB-CD1 3.33Å; L353-I360 HydrophobicContact CB-CG1 3.92Å; L353-I360 HydrophobicContact CD1-CD1 4.03Å; L353-I360 HydrophobicContact CG-CD1 4.32Å; V354-I360 HydrophobicContact CG2-CD1 3.51Å; V354-I360 HydrophobicContact CG2-CG1 4.41Å; E358-I360 PolarHBondContact O-N 3.01Å; I360-F363 HydrophobicContact CG2-CB 3.47Å; I360-F363 VanDerWaalsContact CG2-CB 3.47Å
361	H	48	Very low	59.9	Low	160 Å²	160	65.7 Å²	65.7	74%	0.741	33%	0.325	S	S	*	.	S	Bend	trans	-94.2	-4.3	169.9	-78.5	-70.4	0	0	0	114.7	N359	N359-H361 PolarHBondContact O-N 3.06Å
362	H	45.3	Very low	58	Low	182 Å²	182	69.4 Å²	69.4	84%	0.843	34%	0.342	S	S	*	.	S	Bend	trans	-141.8	5.1	-170.8	-89.2	-58.3	0	0	0	118.6	Q364	H362-Q364 PolarHBondContact O-N 3.24Å
363	F	44.7	Very low	56.2	Low	106 Å²	106	73.4 Å²	73.4	47%	0.465	37%	0.371	S	S	.	.			trans	-82.8	77.3	179	-129.4	-89	0	0	0	111.9	M114 V349 L353 I360	M114-F363 HydrophobicContact CE-CZ 4.34Å; M114-F363 HydrophobicContact SD-CE1 4.27Å; M114-F363 HydrophobicContact SD-CE2 4.27Å; M114-F363 HydrophobicContact SD-CZ 3.62Å; V349-F363 HydrophobicContact CG1-CE1 4.37Å; L353-F363 HydrophobicContact CD1-CD2 4.23Å; L353-F363 HydrophobicContact CD1-CE2 4.47Å; L353-F363 HydrophobicContact CD1-CG 4.34Å; I360-F363 HydrophobicContact CG2-CB 3.47Å; I360-F363 VanDerWaalsContact CG2-CB 3.47Å
364	Q	45.7	Very low	54.6	Low	128 Å²	128	78 Å²	78	60%	0.598	39%	0.392	S	S	*	.			trans	-89	120.8	161.1	-75.8	-170.8	-15.2	0	0	109.4	H362 N366	H362-Q364 PolarHBondContact O-N 3.24Å; Q364-N366 VanDerWaalsContact C-N 3.33Å; Q364-N366 PolarHBondContact O-N 2.71Å
365	S	47.2	Very low	53	Low	48 Å²	48	77.1 Å²	77.1	34%	0.336	39%	0.385	S	S	.	.			trans	-76.9	74.5	-178.4	37.9	0	0	0	0	112.4	W367 L368	S365-W367 PolarHBondContact O-N 3.08Å; S365-L368 WeakPolarHBondContact O-CB 3.43Å; S365-L368 PolarHBondContact O-N 2.97Å; S365-L368 VanDerWaalsContact O-N 3.14Å
366	N	51.5	Low	51.1	Low	90 Å²	90	82.6 Å²	82.6	48%	0.481	42%	0.415	S	S	.	.	H	α-helix	trans	-56.6	-29.5	177.4	-78.6	-9	0	0	0	113.7	Q364 L368 K369 E370	Q364-N366 VanDerWaalsContact C-N 3.33Å; Q364-N366 PolarHBondContact O-N 2.71Å; N366-L368 PolarHBondContact O-N 3.25Å; N366-K369 WeakPolarHBondContact O-CA 3.49Å; N366-K369 WeakPolarHBondContact O-CB 3.38Å; N366-K369 PolarHBondContact O-N 2.88Å; N366-E370 PolarHBondContact O-N 3.38Å
367	W	47.3	Very low	49.5	Very low	42 Å²	42	85.5 Å²	85.5	16%	0.159	43%	0.43	C	S	.	.	H	α-helix	trans	-53	-30.2	177.1	78.2	-100	0	0	0	113	M342 S346 S365 E370 F371	M342-W367 HydrophobicContact CB-CH2 3.8Å; M342-W367 HydrophobicContact CB-CZ3 4.16Å; M342-W367 HydrophobicContact CE-CE3 4.42Å; M342-W367 HydrophobicContact CE-CZ3 3.86Å; M342-W367 WeakPolarHBondContact O-CH2 3.28Å; M342-W367 WeakPolarHBondContact O-CZ2 3.49Å; S346-W367 VanDerWaalsContact OG-CE2 3.26Å; S346-W367 WeakPolarHBondContact OG-CZ2 3.46Å; S346-W367 PolarHBondContact OG-NE1 3.08Å; S365-W367 PolarHBondContact O-N 3.08Å; W367-E370 WeakPolarHBondContact CA-OE2 3.36Å; W367-E370 PolarHBondContact O-N 3.22Å; W367-F371 HydrophobicContact CE3-CB 4.29Å; W367-F371 HydrophobicContact CZ3-CB 4.24Å; W367-F371 HydrophobicContact CZ3-CG 4.48Å; W367-F371 WeakPolarHBondContact O-CB 3.43Å; W367-F371 PolarHBondContact O-N 2.86Å
368	L	41.4	Very low	47.9	Very low	35 Å²	35	90.1 Å²	90.1	18%	0.183	46%	0.455	C	S	.	.	H	α-helix	trans	-75	-33.1	-178.2	-147.8	162.3	0	0	0	110.8	Q343 S365 N366 Q372	Q343-L368 HydrophobicContact CG-CD1 4.2Å; Q343-L368 HydrophobicContact CG-CD2 4.4Å; S365-L368 WeakPolarHBondContact O-CB 3.43Å; S365-L368 PolarHBondContact O-N 2.97Å; S365-L368 VanDerWaalsContact O-N 3.14Å; N366-L368 PolarHBondContact O-N 3.25Å; L368-Q372 HydrophobicContact CD2-CG 4.32Å; L368-Q372 WeakPolarHBondContact O-CB 3.49Å; L368-Q372 WeakPolarHBondContact O-CG 3.41Å; L368-Q372 PolarHBondContact O-N 3.27Å
369	K	51	Low	46.6	Very low	103 Å²	103	91 Å²	91	45%	0.448	46%	0.461	S	S	.	.	H	α-helix	trans	-72.1	-39.2	170.8	-67.1	176.3	173.4	174.9	0	111.6	N366 S373 N732	N366-K369 WeakPolarHBondContact O-CA 3.49Å; N366-K369 WeakPolarHBondContact O-CB 3.38Å; N366-K369 PolarHBondContact O-N 2.88Å; K369-S373 VanDerWaalsContact O-CB 3.3Å; K369-S373 WeakPolarHBondContact O-CB 3.48Å; K369-S373 PolarHBondContact O-N 3.28Å; K369-S373 PolarHBondContact O-OG 2.81Å; K369-N732 WeakPolarHBondContact CE-OD1 3.17Å; K369-N732 PolarHBondContact NZ-OD1 3.12Å
370	E	51.9	Low	45.6	Very low	120 Å²	120	93.1 Å²	93.1	56%	0.561	46%	0.463	S	S	*	.	H	α-helix	trans	-59.7	-52.5	172.8	-68	169.5	163.8	0	0	109.8	N366 W367 Q372 S373 E374	N366-E370 PolarHBondContact O-N 3.38Å; W367-E370 WeakPolarHBondContact CA-OE2 3.36Å; W367-E370 PolarHBondContact O-N 3.22Å; E370-Q372 PolarHBondContact O-N 3.17Å; E370-S373 WeakPolarHBondContact CA-OG 3.45Å; E370-S373 PolarHBondContact O-N 2.86Å; E370-S373 PolarHBondContact O-OG 3.05Å; E370-E374 PolarHBondContact O-N 3.48Å
371	F	41.6	Very low	44.6	Very low	3 Å²	3	96.9 Å²	96.9	1%	0.013	48%	0.477	C	S	.	.	H	α-helix	trans	-54.9	-49.5	177	-170.4	-120.1	0	0	0	112.3	A103 E339 M342 W367 S373 E374 L375	A103-F371 HydrophobicContact CB-CD2 3.31Å; A103-F371 HydrophobicContact CB-CE2 3.62Å; A103-F371 HydrophobicContact CB-CG 4.36Å; E339-F371 HydrophobicContact CB-CE1 4.08Å; E339-F371 HydrophobicContact CG-CD1 4.46Å; E339-F371 HydrophobicContact CG-CE1 3.99Å; M342-F371 HydrophobicContact CE-CE2 4.4Å; M342-F371 HydrophobicContact SD-CE1 4.24Å; M342-F371 HydrophobicContact SD-CE2 4.23Å; M342-F371 HydrophobicContact SD-CZ 3.89Å; W367-F371 HydrophobicContact CE3-CB 4.29Å; W367-F371 HydrophobicContact CZ3-CB 4.24Å; W367-F371 HydrophobicContact CZ3-CG 4.48Å; W367-F371 WeakPolarHBondContact O-CB 3.43Å; W367-F371 PolarHBondContact O-N 2.86Å; F371-S373 VanDerWaalsContact C-N 3.3Å; F371-S373 PolarHBondContact O-N 3.47Å; F371-E374 PolarHBondContact O-N 2.05Å; F371-L375 HydrophobicContact CD1-CD2 4.18Å; F371-L375 HydrophobicContact CD2-CD1 3.91Å; F371-L375 HydrophobicContact CE1-CD1 4.36Å; F371-L375 HydrophobicContact CE1-CD2 3.65Å; F371-L375 HydrophobicContact CE2-CD1 3.63Å; F371-L375 HydrophobicContact CE2-CD2 4.37Å; F371-L375 HydrophobicContact CG-CD1 4.42Å; F371-L375 HydrophobicContact CZ-CD1 3.89Å; F371-L375 HydrophobicContact CZ-CD2 3.77Å; F371-L375 VanDerWaalsContact O-CB 3.31Å; F371-L375 WeakPolarHBondContact O-CB 3.09Å; F371-L375 PolarHBondContact O-N 3.14Å
372	Q	45.3	Very low	44.5	Very low	96 Å²	96	90.1 Å²	90.1	45%	0.449	45%	0.448	S	S	.	.	H	α-helix	trans	-67.7	-26.6	178.1	-73.1	179.8	-23.4	0	0	113.5	E339 L368 E370	E339-Q372 PolarHBondContact OE1-NE2 3.29Å; L368-Q372 HydrophobicContact CD2-CG 4.32Å; L368-Q372 WeakPolarHBondContact O-CB 3.49Å; L368-Q372 WeakPolarHBondContact O-CG 3.41Å; L368-Q372 PolarHBondContact O-N 3.27Å; E370-Q372 PolarHBondContact O-N 3.17Å
373	S	48	Very low	44.5	Very low	87 Å²	87	83.8 Å²	83.8	61%	0.608	43%	0.432	S	S	*	.	H	α-helix	trans	-77.7	-29.9	175	70.5	0	0	0	0	113.9	K369 E370 F371	K369-S373 VanDerWaalsContact O-CB 3.3Å; K369-S373 WeakPolarHBondContact O-CB 3.48Å; K369-S373 PolarHBondContact O-N 3.28Å; K369-S373 PolarHBondContact O-OG 2.81Å; E370-S373 WeakPolarHBondContact CA-OG 3.45Å; E370-S373 PolarHBondContact O-N 2.86Å; E370-S373 PolarHBondContact O-OG 3.05Å; F371-S373 VanDerWaalsContact C-N 3.3Å; F371-S373 PolarHBondContact O-N 3.47Å
374	E	48.6	Very low	44.9	Very low	114 Å²	114	82.4 Å²	82.4	53%	0.533	43%	0.433	S	S	.	.	H	α-helix	trans	-84.9	-14.6	172.4	-62.3	-168.9	145.5	0	0	112.6	V99 E370 F371	V99-E374 HydrophobicContact CG1-CB 3.73Å; E370-E374 PolarHBondContact O-N 3.48Å; F371-E374 PolarHBondContact O-N 2.05Å
375	L	45.3	Very low	45.2	Very low	31 Å²	31	78.7 Å²	78.7	16%	0.162	42%	0.419	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.4	12.8	176.2	-105.4	66.1	0	0	0	115.1	V99 I100 L335 F371 L377	V99-L375 HydrophobicContact CG1-CD1 4.36Å; I100-L375 HydrophobicContact CG1-CD1 4.3Å; L335-L375 HydrophobicContact CD1-CD2 4.02Å; L335-L375 HydrophobicContact CD2-CD2 4.04Å; L335-L375 HydrophobicContact CD2-CG 4.31Å; L335-L375 HydrophobicContact CG-CD2 4.12Å; F371-L375 HydrophobicContact CD1-CD2 4.18Å; F371-L375 HydrophobicContact CD2-CD1 3.91Å; F371-L375 HydrophobicContact CE1-CD1 4.36Å; F371-L375 HydrophobicContact CE1-CD2 3.65Å; F371-L375 HydrophobicContact CE2-CD1 3.63Å; F371-L375 HydrophobicContact CE2-CD2 4.37Å; F371-L375 HydrophobicContact CG-CD1 4.42Å; F371-L375 HydrophobicContact CZ-CD1 3.89Å; F371-L375 HydrophobicContact CZ-CD2 3.77Å; F371-L375 VanDerWaalsContact O-CB 3.31Å; F371-L375 WeakPolarHBondContact O-CB 3.09Å; F371-L375 PolarHBondContact O-N 3.14Å; L375-L377 PolarHBondContact O-N 3.41Å
376	D	41.4	Very low	45.4	Very low	126 Å²	126	85.5 Å²	85.5	67%	0.674	44%	0.439	S	S	*	.			trans	-73.2	52.4	167	-161.7	1.4	0	0	0	111.5	T378	D376-T378 PolarHBondContact O-N 3.25Å; D376-T378 PolarHBondContact O-OG1 2.88Å
377	L	41.6	Very low	45.6	Very low	60 Å²	60	81.9 Å²	81.9	31%	0.314	42%	0.419	S	S	.	.			trans	-72.4	75.9	174.3	-69.2	171.6	0	0	0	108.1	L335 L375 I379	L335-L377 HydrophobicContact CD2-CD1 4.35Å; L375-L377 PolarHBondContact O-N 3.41Å; L377-I379 HydrophobicContact CB-CD1 4.37Å; L377-I379 HydrophobicContact CB-CG1 3.9Å; L377-I379 WeakPolarHBondContact O-CG1 3.32Å; L377-I379 PolarHBondContact O-N 2.9Å
378	T	35.5	Very low	46.1	Very low	117 Å²	117	84 Å²	84	72%	0.718	44%	0.437	S	S	*	.			trans	-69.1	65.1	162.2	29	0	0	0	0	109.7	D376 K380	D376-T378 PolarHBondContact O-N 3.25Å; D376-T378 PolarHBondContact O-OG1 2.88Å; T378-K380 PolarHBondContact O-N 2.91Å
379	I	42.1	Very low	46.8	Very low	69 Å²	69	82.5 Å²	82.5	35%	0.354	43%	0.429	S	S	.	.			trans	-61	103.4	-177.1	-54.9	179.6	0	0	0	108.6	Y327 L377 F381	Y327-I379 HydrophobicContact CD1-CG2 3.96Å; L377-I379 HydrophobicContact CB-CD1 4.37Å; L377-I379 HydrophobicContact CB-CG1 3.9Å; L377-I379 WeakPolarHBondContact O-CG1 3.32Å; L377-I379 PolarHBondContact O-N 2.9Å; I379-F381 PolarHBondContact O-N 2.93Å; I379-F381 VanDerWaalsContact O-N 3.12Å
380	K	37.9	Very low	47.1	Very low	187 Å²	187	79.4 Å²	79.4	81%	0.813	42%	0.417	S	S	*	.			trans	-63.4	115.4	166.3	-70.9	-178	179.9	175.2	0	107.8	T378	T378-K380 PolarHBondContact O-N 2.91Å
381	F	35.3	Very low	47.4	Very low	130 Å²	130	79.3 Å²	79.3	57%	0.57	42%	0.417	S	S	*	.	P	Polyproline II helix	trans	-55	130.1	178.5	-69.6	-79.8	0	0	0	110.2	T328 I379 G383	T328-F381 HydrophobicContact CG2-CD1 4.31Å; T328-F381 HydrophobicContact CG2-CE1 3.49Å; T328-F381 VanDerWaalsContact CG2-CE1 3.49Å; T328-F381 HydrophobicContact CG2-CZ 3.94Å; I379-F381 PolarHBondContact O-N 2.93Å; I379-F381 VanDerWaalsContact O-N 3.12Å; F381-G383 PolarHBondContact O-N 3.17Å
382	P	46.3	Very low	48.1	Very low	19 Å²	19	80.6 Å²	80.6	12%	0.123	43%	0.428	C	S	.	.	P	Polyproline II helix	trans	-60.6	139.1	165.8	27.3	-33	0	0	0	108.6	L89 Y327	L89-P382 HydrophobicContact CD1-CB 3.59Å; L89-P382 HydrophobicContact CD2-CB 3.97Å; L89-P382 HydrophobicContact CG-CB 4.44Å; Y327-P382 HydrophobicContact CD2-CG 3.76Å; Y327-P382 HydrophobicContact CE2-CG 3.47Å; Y327-P382 VanDerWaalsContact CE2-CG 3.47Å
383	G	44.8	Very low	48.6	Very low	49 Å²	49	77.2 Å²	77.2	51%	0.505	41%	0.413	S	S	.	.	P	Polyproline II helix	trans	-58.4	163.8	173.5	0	0	0	0	0	112.4	F381	F381-G383 PolarHBondContact O-N 3.17Å
384	P	52.8	Low	49	Very low	76 Å²	76	77.9 Å²	77.9	49%	0.494	41%	0.409	S	S	.	.	P	Polyproline II helix	trans	-57	156.5	179	24.8	-33.8	0	0	0	111.6	Y386	P384-Y386 VanDerWaalsContact C-N 3.3Å; P384-Y386 HydrophobicContact CG-CD2 4.48Å; P384-Y386 HydrophobicContact CG-CE2 3.76Å; P384-Y386 WeakPolarHBondContact O-CD2 3.46Å; P384-Y386 PolarHBondContact O-N 2.85Å
385	V	52.9	Low	49.3	Very low	51 Å²	51	78.6 Å²	78.6	31%	0.309	42%	0.417	S	S	.	.			trans	-76.4	82.2	-171.4	-170.1	0	0	0	0	110.3	N320 Q323 H387	N320-V385 WeakPolarHBondContact OD1-CA 3.32Å; N320-V385 VanDerWaalsContact OD1-CB 3.31Å; N320-V385 WeakPolarHBondContact OD1-CB 3.49Å; N320-V385 PolarHBondContact OD1-N 3.48Å; Q323-V385 HydrophobicContact CB-CG2 3.82Å; Q323-V385 HydrophobicContact CG-CG2 3.72Å; V385-H387 VanDerWaalsContact C-N 3.31Å; V385-H387 PolarHBondContact O-N 3.35Å
386	Y	51	Low	49.5	Very low	190 Å²	190	81.3 Å²	81.3	75%	0.745	43%	0.432	S	S	*	.			trans	-64.9	87.7	171	-66.9	-72.7	0	0	0	110.5	P384	P384-Y386 VanDerWaalsContact C-N 3.3Å; P384-Y386 HydrophobicContact CG-CD2 4.48Å; P384-Y386 HydrophobicContact CG-CE2 3.76Å; P384-Y386 WeakPolarHBondContact O-CD2 3.46Å; P384-Y386 PolarHBondContact O-N 2.85Å
387	H	55	Low	49.8	Very low	14 Å²	14	81 Å²	81	7%	0.065	43%	0.434	C	S	.	.			trans	-68.4	131.7	175.7	-154.6	-97.3	0	0	0	110.1	E262 Y312 L316 V385 F389 N390	E262-H387 IonicContact OE1-CE1 3.59Å; E262-H387 IonicContact OE2-CE1 2.92Å; E262-H387 PolarHBondContact OE2-CE1 3.17Å; Y312-H387 WeakPolarHBondContact OH-CB 3.4Å; L316-H387 HydrophobicContact CD1-CB 4.29Å; V385-H387 VanDerWaalsContact C-N 3.31Å; V385-H387 PolarHBondContact O-N 3.35Å; H387-F389 VanDerWaalsContact ND1-CB 3.34Å; H387-F389 WeakPolarHBondContact ND1-CB 3.41Å; H387-F389 PolarHBondContact O-N 3.29Å; H387-N390 PolarHBondContact O-N 3.48Å
388	T	57.7	Low	50	Low	88 Å²	88	84.3 Å²	84.3	54%	0.54	46%	0.458	S	S	.	.	H	α-helix	trans	-51	-33.4	-179.1	41.4	0	0	0	0	113.1	E262 N390 Q391 A392	E262-T388 PolarHBondContact OE1-OG1 3.28Å; T388-N390 VanDerWaalsContact C-N 3.32Å; T388-N390 PolarHBondContact O-N 3.29Å; T388-Q391 WeakPolarHBondContact O-CB 3.41Å; T388-Q391 PolarHBondContact O-N 3.1Å; T388-Q391 VanDerWaalsContact O-N 3.16Å; T388-A392 PolarHBondContact O-N 2.94Å
389	F	56.7	Low	50.6	Low	3 Å²	3	81.4 Å²	81.4	1%	0.013	44%	0.437	C	S	.	.	H	α-helix	trans	-53.6	-39.1	174.8	-177.8	-103.7	0	0	0	114.7	E262 Y265 F266 Y312 H387 Q391 A392 L393	E262-F389 HydrophobicContact CB-CD2 4.15Å; E262-F389 HydrophobicContact CG-CB 4.39Å; E262-F389 HydrophobicContact CG-CD2 3.85Å; E262-F389 HydrophobicContact CG-CG 4.47Å; E262-F389 WeakPolarHBondContact OE1-CB 3.42Å; Y265-F389 AromaticContact CD1-CE2 3.4Å; Y265-F389 HydrophobicContact CD1-CE2 3.4Å; Y265-F389 VanDerWaalsContact CD1-CE2 3.4Å; Y265-F389 AromaticContact CD1-CZ 3.3Å; Y265-F389 HydrophobicContact CD1-CZ 3.3Å; Y265-F389 AromaticContact CD2-CZ 3.81Å; Y265-F389 HydrophobicContact CD2-CZ 3.81Å; Y265-F389 AromaticContact CE1-CE2 3.93Å; Y265-F389 HydrophobicContact CE1-CE2 3.93Å; Y265-F389 AromaticContact CE1-CZ 3.49Å; Y265-F389 HydrophobicContact CE1-CZ 3.49Å; Y265-F389 VanDerWaalsContact CE1-CZ 3.49Å; Y265-F389 HydrophobicContact CE2-CZ 4.02Å; Y265-F389 AromaticContact CG-CE2 3.72Å; Y265-F389 HydrophobicContact CG-CE2 3.72Å; Y265-F389 AromaticContact CG-CZ 3.43Å; Y265-F389 HydrophobicContact CG-CZ 3.43Å; Y265-F389 VanDerWaalsContact CG-CZ 3.43Å; Y265-F389 AromaticContact CZ-CZ 3.85Å; F266-F389 HydrophobicContact CE2-CD2 4.47Å; Y312-F389 HydrophobicContact CD1-CD1 4.04Å; Y312-F389 AromaticContact CD1-CE1 3.67Å; Y312-F389 HydrophobicContact CD1-CE1 3.67Å; Y312-F389 AromaticContact CE1-CD1 3.33Å; Y312-F389 HydrophobicContact CE1-CD1 3.33Å; Y312-F389 AromaticContact CE1-CE1 3.44Å; Y312-F389 HydrophobicContact CE1-CE1 3.44Å; Y312-F389 VanDerWaalsContact CE1-CE1 3.44Å; Y312-F389 HydrophobicContact CE1-CG 4.5Å; Y312-F389 HydrophobicContact CE2-CD1 4Å; Y312-F389 HydrophobicContact CE2-CE1 4.37Å; Y312-F389 HydrophobicContact CG-CE1 4.25Å; Y312-F389 AromaticContact CZ-CD1 3.3Å; Y312-F389 AromaticContact CZ-CE1 3.82Å; Y312-F389 WeakPolarHBondContact OH-CD1 3.46Å; H387-F389 VanDerWaalsContact ND1-CB 3.34Å; H387-F389 WeakPolarHBondContact ND1-CB 3.41Å; H387-F389 PolarHBondContact O-N 3.29Å; F389-Q391 VanDerWaalsContact C-N 3.33Å; F389-Q391 PolarHBondContact O-N 2.84Å; F389-A392 CarbonylContact O-C 3.43Å; F389-A392 PolarHBondContact O-N 3.09Å; F389-L393 HydrophobicContact CD1-CD1 3.97Å; F389-L393 HydrophobicContact CE1-CD1 3.38Å; F389-L393 HydrophobicContact CE1-CG 4.29Å; F389-L393 HydrophobicContact CZ-CD1 3.75Å; F389-L393 HydrophobicContact CZ-CG 4.32Å; F389-L393 PolarHBondContact O-N 2.88Å
390	N	57.6	Low	50.3	Low	38 Å²	38	81.4 Å²	81.4	20%	0.203	45%	0.454	C	S	.	.	H	α-helix	trans	-69.3	-34.5	179.8	-72.4	13.4	0	0	0	111.3	Y312 L316 H387 T388 N394 P405	Y312-N390 PolarHBondContact OH-OD1 3.46Å; Y312-N390 VanDerWaalsContact OH-OD1 3.12Å; L316-N390 WeakPolarHBondContact CD2-ND2 3.32Å; H387-N390 PolarHBondContact O-N 3.48Å; T388-N390 VanDerWaalsContact C-N 3.32Å; T388-N390 PolarHBondContact O-N 3.29Å; N390-N394 PolarHBondContact O-N 2.94Å; N390-N394 VanDerWaalsContact O-N 3.12Å; N390-P405 HydrophobicContact CB-CB 4.13Å
391	Q	57.8	Low	50.5	Low	118 Å²	118	76.3 Å²	76.3	55%	0.551	46%	0.455	S	S	*	.	H	α-helix	trans	-68.7	-40.8	170.8	-63.3	176.6	-16.3	0	0	110.9	T388 F389 L393 N394 N395	T388-Q391 WeakPolarHBondContact O-CB 3.41Å; T388-Q391 PolarHBondContact O-N 3.1Å; T388-Q391 VanDerWaalsContact O-N 3.16Å; F389-Q391 VanDerWaalsContact C-N 3.33Å; F389-Q391 PolarHBondContact O-N 2.84Å; Q391-L393 VanDerWaalsContact C-N 3.33Å; Q391-L393 PolarHBondContact O-N 3.3Å; Q391-N394 PolarHBondContact O-N 3.47Å; Q391-N395 WeakPolarHBondContact O-CB 3.26Å; Q391-N395 PolarHBondContact O-N 3.09Å; Q391-N395 PolarHBondContact O-ND2 3.47Å
392	A	55.7	Low	51.3	Low	29 Å²	29	76.4 Å²	76.4	24%	0.24	46%	0.462	C	S	.	.	H	α-helix	trans	-64.2	-34.2	176.1	0	0	0	0	0	112.9	T388 F389 N396	T388-A392 PolarHBondContact O-N 2.94Å; F389-A392 CarbonylContact O-C 3.43Å; F389-A392 PolarHBondContact O-N 3.09Å; A392-N396 WeakPolarHBondContact O-CB 3.26Å; A392-N396 PolarHBondContact O-N 3.43Å; A392-N396 PolarHBondContact O-ND2 3.19Å
393	L	56	Low	51.8	Low	25 Å²	25	77.1 Å²	77.1	13%	0.131	46%	0.464	C	S	.	.	H	α-helix	trans	-66	-52.7	172	-98.2	168.3	0	0	0	111.5	Y265 F389 Q391 N395 N396 P405	Y265-L393 HydrophobicContact CE1-CD1 4.42Å; Y265-L393 HydrophobicContact CE1-CD2 4.08Å; Y265-L393 HydrophobicContact CE1-CG 4.43Å; F389-L393 HydrophobicContact CD1-CD1 3.97Å; F389-L393 HydrophobicContact CE1-CD1 3.38Å; F389-L393 HydrophobicContact CE1-CG 4.29Å; F389-L393 HydrophobicContact CZ-CD1 3.75Å; F389-L393 HydrophobicContact CZ-CG 4.32Å; F389-L393 PolarHBondContact O-N 2.88Å; Q391-L393 VanDerWaalsContact C-N 3.33Å; Q391-L393 PolarHBondContact O-N 3.3Å; L393-N395 PolarHBondContact O-N 3.35Å; L393-N395 VanDerWaalsContact O-N 3.14Å; L393-N396 PolarHBondContact O-N 2.91Å; L393-P405 HydrophobicContact CB-CB 4.2Å; L393-P405 HydrophobicContact CB-CG 4.25Å; L393-P405 HydrophobicContact CD1-CB 3.93Å
394	N	56	Low	52.4	Low	101 Å²	101	78.3 Å²	78.3	54%	0.54	47%	0.465	S	S	.	.	H	α-helix	trans	-59.1	-26.4	178.4	-77.7	-13.4	0	0	0	113.5	N390 Q391 T397 P405	N390-N394 PolarHBondContact O-N 2.94Å; N390-N394 VanDerWaalsContact O-N 3.12Å; Q391-N394 PolarHBondContact O-N 3.47Å; N394-T397 WeakPolarHBondContact O-CG2 3.44Å; N394-P405 WeakPolarHBondContact OD1-CG 3.49Å
395	N	55.3	Low	52.5	Low	130 Å²	130	76 Å²	76	70%	0.695	45%	0.45	S	S	*	.	H	α-helix	trans	-88.1	-13.3	178.5	-67.8	-13.3	0	0	0	114.2	Q391 L393	Q391-N395 WeakPolarHBondContact O-CB 3.26Å; Q391-N395 PolarHBondContact O-N 3.09Å; Q391-N395 PolarHBondContact O-ND2 3.47Å; L393-N395 PolarHBondContact O-N 3.35Å; L393-N395 VanDerWaalsContact O-N 3.14Å
396	N	50.4	Low	52.9	Low	88 Å²	88	75.6 Å²	75.6	47%	0.471	46%	0.455	S	S	.	.			trans	-107.5	50.3	-178.1	-77.4	-71	0	0	0	112.3	A392 L393 T398 L399	A392-N396 WeakPolarHBondContact O-CB 3.26Å; A392-N396 PolarHBondContact O-N 3.43Å; A392-N396 PolarHBondContact O-ND2 3.19Å; L393-N396 PolarHBondContact O-N 2.91Å; N396-T398 PolarHBondContact O-N 3.21Å; N396-L399 PolarHBondContact O-N 3.05Å
397	T	46.5	Very low	54.1	Low	119 Å²	119	68.7 Å²	68.7	73%	0.73	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	4	-176.7	43.7	0	0	0	0	115.9	N394	N394-T397 WeakPolarHBondContact O-CG2 3.44Å
398	T	47.3	Very low	55.6	Low	130 Å²	130	68.7 Å²	68.7	80%	0.798	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.4	-13.6	174.9	49.9	0	0	0	0	113.9	N396 G400	N396-T398 PolarHBondContact O-N 3.21Å; T398-G400 PolarHBondContact O-N 3.32Å
399	L	47.9	Very low	57	Low	55 Å²	55	65.1 Å²	65.1	29%	0.288	41%	0.413	S	S	.	.	S	Bend	trans	-86.9	105	169.2	-78.3	137.7	0	0	0	109.4	I269 N396 G401	I269-L399 HydrophobicContact CD1-CD1 4.09Å; I269-L399 HydrophobicContact CG1-CD1 4.47Å; I269-L399 HydrophobicContact CG2-CD1 3.72Å; I269-L399 HydrophobicContact CG2-CD2 4.19Å; N396-L399 PolarHBondContact O-N 3.05Å; L399-G401 PolarHBondContact O-N 3.03Å
400	G	35.4	Very low	58.5	Low	69 Å²	69	66 Å²	66	71%	0.711	42%	0.418	S	S	*	.			trans	-58.5	124	-158.1	0	0	0	0	0	117.8	T398 N402	T398-G400 PolarHBondContact O-N 3.32Å; G400-N402 PolarHBondContact O-N 3.46Å
401	G	41.6	Very low	59.7	Low	81 Å²	81	66 Å²	66	84%	0.835	42%	0.419	S	S	*	.	S	Bend	trans	86.1	-47.7	140.5	0	0	0	0	0	118.5	L399	L399-G401 PolarHBondContact O-N 3.03Å
402	N	53.4	Low	60.9	Low	132 Å²	132	66.1 Å²	66.1	71%	0.706	42%	0.423	S	S	*	.			trans	-115.5	1.5	-157.5	-73.5	-15.8	0	0	0	116.8	G400	G400-N402 PolarHBondContact O-N 3.46Å
403	L	57	Low	62.2	Low	34 Å²	34	66.9 Å²	66.9	18%	0.178	42%	0.423	C	S	.	.			trans	-107.4	68.4	-171.5	-62.6	174.5	0	0	0	112.7	L305 I409	L305-L403 HydrophobicContact CD2-CD1 3.82Å; L403-I409 HydrophobicContact CD2-CD1 3.41Å; L403-I409 VanDerWaalsContact CD2-CD1 3.41Å; L403-I409 HydrophobicContact CD2-CG1 4.38Å
404	S	56.2	Low	63.7	Low	74 Å²	74	65.8 Å²	65.8	52%	0.517	42%	0.417	S	S	.	.			trans	-76.8	119.1	176.3	-176.7	0	0	0	0	111.5	H309 G406 S407	H309-S404 PolarHBondContact NE2-O 3.24Å; S404-G406 PolarHBondContact O-N 2.82Å; S404-S407 WeakPolarHBondContact CB-OG 3.46Å; S404-S407 PolarHBondContact O-N 3.17Å; S404-S407 PolarHBondContact O-OG 3.07Å
405	P	54.7	Low	65.1	Low	28 Å²	28	61.1 Å²	61.1	18%	0.182	39%	0.393	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	127.7	-174.3	23.4	-31.3	0	0	0	112.5	N390 L393 N394	N390-P405 HydrophobicContact CB-CB 4.13Å; L393-P405 HydrophobicContact CB-CB 4.2Å; L393-P405 HydrophobicContact CB-CG 4.25Å; L393-P405 HydrophobicContact CD1-CB 3.93Å; N394-P405 WeakPolarHBondContact OD1-CG 3.49Å
406	G	61.8	Low	66.6	Low	41 Å²	41	60.7 Å²	60.7	42%	0.423	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	95.2	-13.4	-179.6	0	0	0	0	0	114.4	S404	S404-G406 PolarHBondContact O-N 2.82Å
407	S	76.8	Confident	68.4	Low	46 Å²	46	57.8 Å²	57.8	32%	0.322	37%	0.373	S	S	.	.	S	Bend	trans	-92	140.1	174.1	72.6	0	0	0	0	111.8	H309 S404	H309-S407 PolarHBondContact CD2-O 3.26Å; S404-S407 WeakPolarHBondContact CB-OG 3.46Å; S404-S407 PolarHBondContact O-N 3.17Å; S404-S407 PolarHBondContact O-OG 3.07Å
408	L	86.5	Confident	70.6	Confident	13 Å²	13	52.1 Å²	52.1	7%	0.068	34%	0.338	C	S	.	.			trans	-71.7	137.3	169.9	-66.1	-178.6	0	0	0	110.8	N310 C313 L314 V410 L418 V550 L551 A554	N310-L408 HydrophobicContact CB-CD2 3.87Å; C313-L408 HydrophobicContact CB-CD2 3.92Å; L314-L408 HydrophobicContact CD2-CD1 4.48Å; L314-L408 HydrophobicContact CD2-CD2 4.42Å; L314-L408 HydrophobicContact CG-CD2 4.31Å; L408-V410 PolarHBondContact O-N 3.3Å; L408-L418 HydrophobicContact CD1-CD2 4.2Å; L408-V550 HydrophobicContact CD1-CG1 3.81Å; L408-V550 HydrophobicContact CG-CG1 4.35Å; L408-L551 HydrophobicContact CD1-CD2 3.84Å; L408-A554 HydrophobicContact CD1-CB 3.99Å
409	I	86.6	Confident	72.5	Confident	14 Å²	14	49.8 Å²	49.8	7%	0.072	32%	0.32	C	S	.	.			trans	-80.6	115.9	173.5	-62.7	164.8	0	0	0	108.4	H306 H309 N310 L403 N411 T414	H306-I409 HydrophobicContact CB-CD1 4.23Å; H306-I409 HydrophobicContact CB-CG2 4.07Å; H309-I409 HydrophobicContact CB-CD1 3.62Å; N310-I409 PolarHBondContact ND2-O 2.86Å; N310-I409 PolarHBondContact OD1-N 3.16Å; L403-I409 HydrophobicContact CD2-CD1 3.41Å; L403-I409 VanDerWaalsContact CD2-CD1 3.41Å; L403-I409 HydrophobicContact CD2-CG1 4.38Å; I409-N411 WeakPolarHBondContact CG2-ND2 3.45Å; I409-T414 HydrophobicContact CG2-CG2 4.27Å; I409-T414 WeakPolarHBondContact O-CB 3.31Å; I409-T414 PolarHBondContact O-OG1 3.42Å
410	V	87.6	Confident	74.5	Confident	20 Å²	20	52.2 Å²	52.2	12%	0.121	33%	0.33	C	S	.	.			trans	-113.6	106.2	-179.8	-175.2	0	0	0	0	108.8	L408 L418 A554 R557 L558 L561	L408-V410 PolarHBondContact O-N 3.3Å; V410-L418 HydrophobicContact CG1-CD1 4.39Å; V410-L418 HydrophobicContact CG2-CD1 4.17Å; V410-A554 VanDerWaalsContact CG1-O 3.27Å; V410-A554 WeakPolarHBondContact CG1-O 3.39Å; V410-A554 HydrophobicContact CG2-CB 3.74Å; V410-R557 HydrophobicContact CG1-CB 4.3Å; V410-L558 HydrophobicContact CG1-CB 3.78Å; V410-L558 HydrophobicContact CG1-CD1 3.96Å; V410-L561 HydrophobicContact CG1-CD1 4.27Å
411	N	84.2	Confident	77.2	Confident	40 Å²	40	50.4 Å²	50.4	21%	0.214	30%	0.304	C	S	.	.	S	Bend	trans	-159.6	177.5	172.5	53.9	48.9	0	0	0	110.1	H306 I409 L413 T414 G415	H306-N411 PolarHBondContact CE1-ND2 3.46Å; H306-N411 PolarHBondContact ND1-ND2 2.99Å; I409-N411 WeakPolarHBondContact CG2-ND2 3.45Å; N411-L413 PolarHBondContact O-N 3Å; N411-L413 VanDerWaalsContact O-N 3.08Å; N411-L413 WeakPolarHBondContact OD1-CB 3.04Å; N411-L413 PolarHBondContact OD1-N 3.17Å; N411-T414 PolarHBondContact N-OG1 2.89Å; N411-T414 VanDerWaalsContact N-OG1 3.15Å; N411-T414 PolarHBondContact O-N 3.06Å; N411-T414 PolarHBondContact O-OG1 2.93Å; N411-T414 VanDerWaalsContact O-OG1 3.14Å; N411-G415 PolarHBondContact O-N 3.34Å
412	D	82.2	Confident	79.6	Confident	119 Å²	119	47 Å²	47	64%	0.636	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-23.9	-174.9	-46.9	-48	0	0	0	113.2
413	L	83.4	Confident	81.3	Confident	46 Å²	46	45.5 Å²	45.5	24%	0.241	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-24	175.5	-58.1	177.4	0	0	0	113.3	E299 T302 K303 N411	E299-L413 HydrophobicContact CG-CD2 4.34Å; T302-L413 HydrophobicContact CG2-CD1 4.13Å; K303-L413 WeakPolarHBondContact CE-O 3.47Å; K303-L413 HydrophobicContact CG-CB 4.37Å; N411-L413 PolarHBondContact O-N 3Å; N411-L413 VanDerWaalsContact O-N 3.08Å; N411-L413 WeakPolarHBondContact OD1-CB 3.04Å; N411-L413 PolarHBondContact OD1-N 3.17Å
414	T	87.1	Confident	83	Confident	1 Å²	1	47.2 Å²	47.2	1%	0.006	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.8	-19.5	-178.7	59.3	0	0	0	0	114.3	H306 L307 I409 N411 Q416 S417 L418	H306-T414 HydrophobicContact CB-CG2 3.53Å; L307-T414 HydrophobicContact CD2-CG2 4.48Å; I409-T414 HydrophobicContact CG2-CG2 4.27Å; I409-T414 WeakPolarHBondContact O-CB 3.31Å; I409-T414 PolarHBondContact O-OG1 3.42Å; N411-T414 PolarHBondContact N-OG1 2.89Å; N411-T414 VanDerWaalsContact N-OG1 3.15Å; N411-T414 PolarHBondContact O-N 3.06Å; N411-T414 PolarHBondContact O-OG1 2.93Å; N411-T414 VanDerWaalsContact O-OG1 3.14Å; T414-Q416 PolarHBondContact O-N 3.26Å; T414-S417 WeakPolarHBondContact O-CB 3.43Å; T414-S417 PolarHBondContact O-N 2.93Å; T414-L418 PolarHBondContact O-N 3.24Å
415	G	85.6	Confident	84.6	Confident	4 Å²	4	44.4 Å²	44.4	4%	0.041	24%	0.243	C	C	.	.	H	α-helix	trans	-50.2	-51.9	-170.4	0	0	0	0	0	115.4	N411 S417 L418 I419 L558	N411-G415 PolarHBondContact O-N 3.34Å; G415-S417 VanDerWaalsContact C-N 3.32Å; G415-S417 PolarHBondContact O-N 2.91Å; G415-L418 WeakPolarHBondContact O-CB 3.32Å; G415-L418 PolarHBondContact O-N 3.3Å; G415-I419 PolarHBondContact O-N 3.44Å; G415-I419 VanDerWaalsContact O-N 3.13Å; G415-L558 VanDerWaalsContact CA-CD2 3.47Å
416	Q	87	Confident	86.4	Confident	121 Å²	121	48.4 Å²	48.4	57%	0.565	26%	0.258	S	S	*	.	H	α-helix	trans	-60	-39.9	177.6	178	58.9	25	0	0	112.6	T414 I419 E420	T414-Q416 PolarHBondContact O-N 3.26Å; Q416-I419 WeakPolarHBondContact O-CB 3.48Å; Q416-I419 PolarHBondContact O-N 3.32Å; Q416-E420 WeakPolarHBondContact CG-OE1 3.43Å; Q416-E420 PolarHBondContact NE2-OE1 2.9Å; Q416-E420 WeakPolarHBondContact O-CG 3.29Å; Q416-E420 PolarHBondContact O-N 3.03Å
417	S	88.5	Confident	87.8	Confident	26 Å²	26	50.9 Å²	50.9	18%	0.182	26%	0.261	C	S	.	.	H	α-helix	trans	-70.1	-33.5	178.1	-177.4	0	0	0	0	112	L307 T414 G415 I419 E420 L421	L307-S417 WeakPolarHBondContact CD2-OG 3.22Å; T414-S417 WeakPolarHBondContact O-CB 3.43Å; T414-S417 PolarHBondContact O-N 2.93Å; G415-S417 VanDerWaalsContact C-N 3.32Å; G415-S417 PolarHBondContact O-N 2.91Å; S417-I419 VanDerWaalsContact C-N 3.29Å; S417-I419 PolarHBondContact O-N 2.7Å; S417-E420 PolarHBondContact O-N 3.47Å; S417-L421 VanDerWaalsContact O-CB 3.25Å; S417-L421 WeakPolarHBondContact O-CB 3.42Å; S417-L421 WeakPolarHBondContact O-CD1 3.49Å; S417-L421 WeakPolarHBondContact O-CG 3.49Å; S417-L421 PolarHBondContact O-N 3.48Å
418	L	91	Very high	88.4	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-64.2	-35.2	172.3	-67.8	168.1	0	0	0	111.5	L408 V410 T414 G415 T422 L551 A554	L408-L418 HydrophobicContact CD1-CD2 4.2Å; V410-L418 HydrophobicContact CG1-CD1 4.39Å; V410-L418 HydrophobicContact CG2-CD1 4.17Å; T414-L418 PolarHBondContact O-N 3.24Å; G415-L418 WeakPolarHBondContact O-CB 3.32Å; G415-L418 PolarHBondContact O-N 3.3Å; L418-T422 WeakPolarHBondContact O-CB 3.49Å; L418-T422 PolarHBondContact O-N 2.97Å; L418-T422 PolarHBondContact O-OG1 2.92Å; L418-L551 HydrophobicContact CD2-CD2 3.74Å; L418-A554 HydrophobicContact CD1-CB 4.16Å; L418-A554 HydrophobicContact CD2-CB 4.16Å
419	I	89	Confident	88.6	Confident	81 Å²	81	52 Å²	52	42%	0.415	26%	0.261	S	S	.	.	H	α-helix	trans	-65.3	-51.9	173.3	-65.8	164.3	0	0	0	110.8	G415 Q416 S417 L421 T422 Q423	G415-I419 PolarHBondContact O-N 3.44Å; G415-I419 VanDerWaalsContact O-N 3.13Å; Q416-I419 WeakPolarHBondContact O-CB 3.48Å; Q416-I419 PolarHBondContact O-N 3.32Å; S417-I419 VanDerWaalsContact C-N 3.29Å; S417-I419 PolarHBondContact O-N 2.7Å; I419-L421 PolarHBondContact O-N 3.39Å; I419-T422 PolarHBondContact O-N 2.85Å; I419-Q423 PolarHBondContact O-N 3.17Å; I419-Q423 VanDerWaalsContact O-N 3.11Å
420	E	89.9	Confident	88.8	Confident	107 Å²	107	56.4 Å²	56.4	50%	0.5	28%	0.284	S	S	.	.	H	α-helix	trans	-59.6	-44.5	178.7	-70.6	163	-175.7	0	0	112.5	Q416 S417 Q423 L424	Q416-E420 WeakPolarHBondContact CG-OE1 3.43Å; Q416-E420 PolarHBondContact NE2-OE1 2.9Å; Q416-E420 WeakPolarHBondContact O-CG 3.29Å; Q416-E420 PolarHBondContact O-N 3.03Å; S417-E420 PolarHBondContact O-N 3.47Å; E420-Q423 PolarHBondContact O-N 2.74Å; E420-L424 VanDerWaalsContact O-CB 3.27Å; E420-L424 WeakPolarHBondContact O-CB 3.08Å; E420-L424 PolarHBondContact O-N 3.23Å
421	L	90.6	Very high	88.6	Confident	30 Å²	30	60 Å²	60	16%	0.157	30%	0.302	C	S	.	.	H	α-helix	trans	-62.6	-42.8	175.9	-73.9	166.9	0	0	0	111.5	L314 S417 I419 Q423 L424 H425 L551	L314-L421 HydrophobicContact CD1-CD1 4.05Å; L314-L421 HydrophobicContact CD1-CD2 4.43Å; S417-L421 VanDerWaalsContact O-CB 3.25Å; S417-L421 WeakPolarHBondContact O-CB 3.42Å; S417-L421 WeakPolarHBondContact O-CD1 3.49Å; S417-L421 WeakPolarHBondContact O-CG 3.49Å; S417-L421 PolarHBondContact O-N 3.48Å; I419-L421 PolarHBondContact O-N 3.39Å; L421-Q423 PolarHBondContact O-N 3.37Å; L421-L424 HydrophobicContact CD2-CD2 4.49Å; L421-L424 PolarHBondContact O-N 2.75Å; L421-H425 WeakPolarHBondContact O-CB 3.18Å; L421-H425 PolarHBondContact O-CD2 2.98Å; L421-H425 PolarHBondContact O-N 3.39Å; L421-L551 HydrophobicContact CB-CD1 3.96Å; L421-L551 HydrophobicContact CB-CD2 4.1Å
422	T	91.6	Very high	88.6	Confident	11 Å²	11	58.8 Å²	58.8	7%	0.067	30%	0.295	C	S	.	.	H	α-helix	trans	-61.5	-46.5	179.4	-54	0	0	0	0	111	L418 I419 H425 K426 V548 L551 Q555	L418-T422 WeakPolarHBondContact O-CB 3.49Å; L418-T422 PolarHBondContact O-N 2.97Å; L418-T422 PolarHBondContact O-OG1 2.92Å; I419-T422 PolarHBondContact O-N 2.85Å; T422-H425 PolarHBondContact O-N 3.08Å; T422-K426 VanDerWaalsContact O-CB 3.24Å; T422-K426 WeakPolarHBondContact O-CB 3.2Å; T422-K426 PolarHBondContact O-N 3.17Å; T422-V548 HydrophobicContact CG2-CG1 4.49Å; T422-L551 HydrophobicContact CG2-CB 4.49Å; T422-L551 VanDerWaalsContact OG1-CB 3.31Å; T422-L551 WeakPolarHBondContact OG1-CB 3.45Å; T422-Q555 PolarHBondContact OG1-NE2 3.08Å
423	Q	90.4	Very high	89	Confident	99 Å²	99	59.4 Å²	59.4	46%	0.463	29%	0.288	S	S	.	.	H	α-helix	trans	-67.1	-37.5	177.8	-170.3	60.8	40.2	0	0	111.9	I419 E420 L421 N427	I419-Q423 PolarHBondContact O-N 3.17Å; I419-Q423 VanDerWaalsContact O-N 3.11Å; E420-Q423 PolarHBondContact O-N 2.74Å; L421-Q423 PolarHBondContact O-N 3.37Å; Q423-N427 PolarHBondContact NE2-OD1 3.43Å; Q423-N427 WeakPolarHBondContact O-CB 3.36Å; Q423-N427 PolarHBondContact O-N 2.91Å; Q423-N427 PolarHBondContact O-ND2 3.36Å; Q423-N427 PolarHBondContact O-OD1 2.89Å
424	L	91.3	Very high	89.2	Confident	70 Å²	70	62.4 Å²	62.4	37%	0.366	30%	0.301	S	S	.	.	H	α-helix	trans	-60.7	-48.3	174.6	173.6	62.1	0	0	0	111.9	E420 L421 N427 K428	E420-L424 VanDerWaalsContact O-CB 3.27Å; E420-L424 WeakPolarHBondContact O-CB 3.08Å; E420-L424 PolarHBondContact O-N 3.23Å; L421-L424 HydrophobicContact CD2-CD2 4.49Å; L421-L424 PolarHBondContact O-N 2.75Å; L424-N427 PolarHBondContact O-N 3.38Å; L424-K428 WeakPolarHBondContact O-CG 3.21Å; L424-K428 PolarHBondContact O-N 3.12Å
425	H	91.2	Very high	88.9	Confident	15 Å²	15	64.6 Å²	64.6	7%	0.069	31%	0.314	C	S	.	.	H	α-helix	trans	-69.6	-38.8	179.7	-77.8	-84.1	0	0	0	111.7	L421 T422 N427 K428 E429 E544 V548 L551	L421-H425 WeakPolarHBondContact O-CB 3.18Å; L421-H425 PolarHBondContact O-CD2 2.98Å; L421-H425 PolarHBondContact O-N 3.39Å; T422-H425 PolarHBondContact O-N 3.08Å; H425-N427 VanDerWaalsContact C-N 3.34Å; H425-N427 PolarHBondContact O-N 3.29Å; H425-K428 PolarHBondContact CE1-NZ 3.47Å; H425-K428 PolarHBondContact ND1-NZ 2.75Å; H425-K428 PolarHBondContact NE2-NZ 2.86Å; H425-K428 WeakPolarHBondContact O-CB 3.34Å; H425-K428 PolarHBondContact O-N 2.88Å; H425-K428 VanDerWaalsContact O-N 3.1Å; H425-E429 PolarHBondContact O-N 3.47Å; H425-E544 IonicContact CE1-OE2 2.82Å; H425-E544 IonicContact CG-OE2 2.71Å; H425-E544 IonicContact ND1-OE2 2.74Å; H425-E544 PolarHBondContact ND1-OE2 3.46Å; H425-V548 HydrophobicContact CB-CG2 3.82Å; H425-L551 HydrophobicContact CB-CD1 4.41Å
426	K	93.1	Very high	89	Confident	113 Å²	113	65.2 Å²	65.2	49%	0.491	32%	0.317	S	S	.	.	H	α-helix	trans	-60.4	-39.2	172.9	-172.6	174.8	-176.8	175.7	0	113	T422 E429 L430 V548	T422-K426 VanDerWaalsContact O-CB 3.24Å; T422-K426 WeakPolarHBondContact O-CB 3.2Å; T422-K426 PolarHBondContact O-N 3.17Å; K426-E429 PolarHBondContact O-N 3.39Å; K426-L430 PolarHBondContact O-N 3.4Å; K426-L430 VanDerWaalsContact O-N 3.11Å; K426-V548 HydrophobicContact CB-CG2 3.97Å; K426-V548 VanDerWaalsContact N-CG2 3.31Å
427	N	91.1	Very high	89.1	Confident	92 Å²	92	64.1 Å²	64.1	49%	0.492	32%	0.315	S	S	.	.	H	α-helix	trans	-66.5	-34.8	174.3	-71.6	-6.6	0	0	0	112.4	Q423 L424 H425 L431	Q423-N427 PolarHBondContact NE2-OD1 3.43Å; Q423-N427 WeakPolarHBondContact O-CB 3.36Å; Q423-N427 PolarHBondContact O-N 2.91Å; Q423-N427 PolarHBondContact O-ND2 3.36Å; Q423-N427 PolarHBondContact O-OD1 2.89Å; L424-N427 PolarHBondContact O-N 3.38Å; H425-N427 VanDerWaalsContact C-N 3.34Å; H425-N427 PolarHBondContact O-N 3.29Å; N427-L431 PolarHBondContact O-N 3.12Å
428	K	87.4	Confident	88.8	Confident	58 Å²	58	67.3 Å²	67.3	25%	0.252	33%	0.327	S	S	.	.	H	α-helix	trans	-71.5	-39.4	174.1	-64	171.4	-160.8	158.4	0	111.9	L424 H425 L430 L431 H432 E544	L424-K428 WeakPolarHBondContact O-CG 3.21Å; L424-K428 PolarHBondContact O-N 3.12Å; H425-K428 PolarHBondContact CE1-NZ 3.47Å; H425-K428 PolarHBondContact ND1-NZ 2.75Å; H425-K428 PolarHBondContact NE2-NZ 2.86Å; H425-K428 WeakPolarHBondContact O-CB 3.34Å; H425-K428 PolarHBondContact O-N 2.88Å; H425-K428 VanDerWaalsContact O-N 3.1Å; K428-L430 VanDerWaalsContact C-N 3.35Å; K428-L431 PolarHBondContact O-N 2.99Å; K428-H432 WeakPolarHBondContact O-CB 3.48Å; K428-H432 PolarHBondContact O-CD2 3.35Å; K428-H432 VanDerWaalsContact O-CD2 3.31Å; K428-H432 PolarHBondContact O-N 3.12Å; K428-E544 HydrophobicContact CB-CB 4.42Å; K428-E544 HydrophobicContact CB-CG 3.77Å; K428-E544 VanDerWaalsContact CD-CD 3.44Å; K428-E544 WeakPolarHBondContact CD-OE1 3.14Å; K428-E544 WeakPolarHBondContact CD-OE2 3.35Å; K428-E544 IonicContact NZ-OE2 2.66Å
429	E	90.9	Very high	88.4	Confident	26 Å²	26	67.9 Å²	67.9	12%	0.121	33%	0.33	C	S	.	.	H	α-helix	trans	-58	-47.7	176.3	-166.8	-159.6	151.5	0	0	110.8	H425 K426 L431 H432 R433 E544 A545	H425-E429 PolarHBondContact O-N 3.47Å; K426-E429 PolarHBondContact O-N 3.39Å; E429-L431 PolarHBondContact O-N 3.47Å; E429-H432 PolarHBondContact O-N 3.3Å; E429-H432 VanDerWaalsContact O-N 3.17Å; E429-R433 WeakPolarHBondContact O-CG 3.33Å; E429-R433 PolarHBondContact O-N 2.89Å; E429-R433 IonicContact OE1-CZ 2.7Å; E429-R433 IonicContact OE1-NE 2.67Å; E429-R433 PolarHBondContact OE1-NE 2.74Å; E429-R433 IonicContact OE1-NH2 3.53Å; E429-R433 PolarHBondContact OE1-NH2 2.99Å; E429-E544 HydrophobicContact CB-CB 3.76Å; E429-E544 HydrophobicContact CG-CB 4.26Å; E429-A545 HydrophobicContact CG-CB 4.03Å
430	L	90.7	Very high	88.6	Confident	106 Å²	106	66.6 Å²	66.6	56%	0.555	33%	0.326	S	S	*	.	H	α-helix	trans	-56	-51.5	176.7	-167	85.6	0	0	0	111.6	K426 K428 H432 R433 E434	K426-L430 PolarHBondContact O-N 3.4Å; K426-L430 VanDerWaalsContact O-N 3.11Å; K428-L430 VanDerWaalsContact C-N 3.35Å; L430-H432 VanDerWaalsContact C-N 3.26Å; L430-H432 PolarHBondContact O-N 3.14Å; L430-R433 PolarHBondContact O-N 3.25Å; L430-R433 VanDerWaalsContact O-N 3.14Å; L430-E434 WeakPolarHBondContact O-CG 3.41Å; L430-E434 PolarHBondContact O-N 3.35Å
431	L	84.6	Confident	88.4	Confident	95 Å²	95	67 Å²	67	50%	0.497	33%	0.326	S	S	.	.	H	α-helix	trans	-59.8	-35.6	178.2	-178.2	66.6	0	0	0	112.4	N427 K428 E429 T435	N427-L431 PolarHBondContact O-N 3.12Å; K428-L431 PolarHBondContact O-N 2.99Å; E429-L431 PolarHBondContact O-N 3.47Å; L431-T435 PolarHBondContact O-N 2.98Å; L431-T435 VanDerWaalsContact O-N 3.1Å; L431-T435 PolarHBondContact O-OG1 2.92Å
432	H	84.1	Confident	88.1	Confident	15 Å²	15	69.2 Å²	69.2	7%	0.069	34%	0.336	C	S	.	.	H	α-helix	trans	-72.4	-40.5	174.9	-84.4	-58.7	0	0	0	112.5	K428 E429 L430 E434 T435 V436 A541 R679	K428-H432 WeakPolarHBondContact O-CB 3.48Å; K428-H432 PolarHBondContact O-CD2 3.35Å; K428-H432 VanDerWaalsContact O-CD2 3.31Å; K428-H432 PolarHBondContact O-N 3.12Å; E429-H432 PolarHBondContact O-N 3.3Å; E429-H432 VanDerWaalsContact O-N 3.17Å; L430-H432 VanDerWaalsContact C-N 3.26Å; L430-H432 PolarHBondContact O-N 3.14Å; H432-E434 PolarHBondContact O-N 3.13Å; H432-T435 WeakPolarHBondContact O-CB 3.24Å; H432-T435 PolarHBondContact O-N 2.77Å; H432-V436 WeakPolarHBondContact O-CG2 3.28Å; H432-V436 PolarHBondContact O-N 2.95Å; H432-A541 HydrophobicContact CB-CB 3.91Å; H432-R679 PolarHBondContact CE1-NH1 3.15Å; H432-R679 PolarHBondContact NE2-NH1 3.08Å; H432-R679 PolarHBondContact NE2-NH2 3.23Å; H432-R679 VanDerWaalsContact NE2-NH2 3.13Å
433	R	91.2	Very high	88	Confident	131 Å²	131	69 Å²	69	49%	0.494	33%	0.334	S	S	.	.	H	α-helix	trans	-63.7	-36.8	172	-70	-176.5	-174.4	-109.4	7.6	112.4	E429 L430 V436 N437 A541	E429-R433 WeakPolarHBondContact O-CG 3.33Å; E429-R433 PolarHBondContact O-N 2.89Å; E429-R433 IonicContact OE1-CZ 2.7Å; E429-R433 IonicContact OE1-NE 2.67Å; E429-R433 PolarHBondContact OE1-NE 2.74Å; E429-R433 IonicContact OE1-NH2 3.53Å; E429-R433 PolarHBondContact OE1-NH2 2.99Å; L430-R433 PolarHBondContact O-N 3.25Å; L430-R433 VanDerWaalsContact O-N 3.14Å; R433-V436 PolarHBondContact O-N 2.98Å; R433-N437 WeakPolarHBondContact O-CB 3.45Å; R433-N437 VanDerWaalsContact O-CG 3.24Å; R433-N437 PolarHBondContact O-N 3.02Å; R433-N437 PolarHBondContact O-ND2 3.22Å; R433-N437 VanDerWaalsContact O-ND2 3.14Å; R433-A541 HydrophobicContact CG-CB 4.25Å
434	E	86.2	Confident	88	Confident	110 Å²	110	69.1 Å²	69.1	51%	0.514	34%	0.338	S	S	.	.	H	α-helix	trans	-61.6	-42.7	171.5	-74	176.5	173.1	0	0	111.8	L430 H432 N437 Q438	L430-E434 WeakPolarHBondContact O-CG 3.41Å; L430-E434 PolarHBondContact O-N 3.35Å; H432-E434 PolarHBondContact O-N 3.13Å; E434-N437 PolarHBondContact O-N 3.29Å; E434-Q438 PolarHBondContact O-N 3.31Å; E434-Q438 VanDerWaalsContact O-N 3.08Å
435	T	80.6	Confident	87.9	Confident	47 Å²	47	71.6 Å²	71.6	29%	0.288	35%	0.348	S	S	.	.	H	α-helix	trans	-62.5	-45.1	175.6	-54.1	0	0	0	0	111.5	L431 H432 N437 Q438 L439 A537	L431-T435 PolarHBondContact O-N 2.98Å; L431-T435 VanDerWaalsContact O-N 3.1Å; L431-T435 PolarHBondContact O-OG1 2.92Å; H432-T435 WeakPolarHBondContact O-CB 3.24Å; H432-T435 PolarHBondContact O-N 2.77Å; T435-N437 PolarHBondContact O-N 3.08Å; T435-Q438 PolarHBondContact O-N 3.28Å; T435-L439 HydrophobicContact CG2-CD1 3.89Å; T435-L439 WeakPolarHBondContact O-CG 3.39Å; T435-L439 PolarHBondContact O-N 3.33Å; T435-A537 HydrophobicContact CG2-CB 4.21Å
436	V	87.7	Confident	87.8	Confident	17 Å²	17	73.7 Å²	73.7	10%	0.103	36%	0.355	C	S	.	.	H	α-helix	trans	-57.7	-45.3	173.1	164.8	0	0	0	0	111.6	H432 R433 Q438 L439 T440 L534 A537 N538	H432-V436 WeakPolarHBondContact O-CG2 3.28Å; H432-V436 PolarHBondContact O-N 2.95Å; R433-V436 PolarHBondContact O-N 2.98Å; V436-Q438 PolarHBondContact O-N 3.47Å; V436-L439 PolarHBondContact O-N 3.37Å; V436-T440 WeakPolarHBondContact O-CB 3.16Å; V436-T440 PolarHBondContact O-N 3.12Å; V436-T440 PolarHBondContact O-OG1 2.7Å; V436-L534 HydrophobicContact CB-CD1 4.4Å; V436-L534 HydrophobicContact CG1-CD1 3.98Å; V436-A537 HydrophobicContact CG2-CB 3.69Å; V436-N538 WeakPolarHBondContact CG1-OD1 3.3Å; V436-N538 HydrophobicContact CG2-CB 4.48Å; V436-N538 VanDerWaalsContact CG2-OD1 3.26Å; V436-N538 WeakPolarHBondContact CG2-OD1 3.39Å
437	N	89.7	Confident	87.7	Confident	97 Å²	97	72.3 Å²	72.3	52%	0.519	35%	0.35	S	S	.	.	H	α-helix	trans	-65.3	-25.8	179.5	-77.8	-34.8	0	0	0	113.3	R433 E434 T435 K441	R433-N437 WeakPolarHBondContact O-CB 3.45Å; R433-N437 VanDerWaalsContact O-CG 3.24Å; R433-N437 PolarHBondContact O-N 3.02Å; R433-N437 PolarHBondContact O-ND2 3.22Å; R433-N437 VanDerWaalsContact O-ND2 3.14Å; E434-N437 PolarHBondContact O-N 3.29Å; T435-N437 PolarHBondContact O-N 3.08Å; N437-K441 WeakPolarHBondContact O-CD 3.47Å; N437-K441 WeakPolarHBondContact O-CE 3.44Å; N437-K441 WeakPolarHBondContact O-CG 3.48Å
438	Q	82	Confident	87.6	Confident	93 Å²	93	73.6 Å²	73.6	44%	0.435	35%	0.353	S	S	.	.	H	α-helix	trans	-80.2	-52.2	172.8	179.9	56.4	24.7	0	0	111.2	E434 T435 V436 T440 K441 E442	E434-Q438 PolarHBondContact O-N 3.31Å; E434-Q438 VanDerWaalsContact O-N 3.08Å; T435-Q438 PolarHBondContact O-N 3.28Å; V436-Q438 PolarHBondContact O-N 3.47Å; Q438-T440 VanDerWaalsContact C-N 3.3Å; Q438-T440 PolarHBondContact O-N 2.91Å; Q438-K441 WeakPolarHBondContact O-CB 3.3Å; Q438-K441 PolarHBondContact O-N 2.8Å; Q438-E442 PolarHBondContact NE2-OE1 2.76Å; Q438-E442 PolarHBondContact O-N 3.18Å
439	L	83.7	Confident	87.6	Confident	12 Å²	12	71.8 Å²	71.8	6%	0.063	35%	0.349	C	S	.	.	H	α-helix	trans	-60.3	-38.9	-179.1	-69.4	167.1	0	0	0	112.1	T435 V436 K441 E442 C443 E533 L534 A537 W683	T435-L439 HydrophobicContact CG2-CD1 3.89Å; T435-L439 WeakPolarHBondContact O-CG 3.39Å; T435-L439 PolarHBondContact O-N 3.33Å; V436-L439 PolarHBondContact O-N 3.37Å; L439-K441 VanDerWaalsContact C-N 3.25Å; L439-K441 PolarHBondContact O-N 3.25Å; L439-E442 PolarHBondContact O-N 2.98Å; L439-E442 VanDerWaalsContact O-N 3.08Å; L439-C443 PolarHBondContact O-N 3.15Å; L439-C443 PolarHBondContact O-SG 3.49Å; L439-E533 HydrophobicContact CD1-CB 4.22Å; L439-E533 HydrophobicContact CD2-CB 4.19Å; L439-L534 HydrophobicContact CB-CB 4.1Å; L439-L534 HydrophobicContact CB-CD1 3.99Å; L439-A537 HydrophobicContact CD1-CB 3.79Å; L439-W683 HydrophobicContact CD1-CH2 4.16Å; L439-W683 HydrophobicContact CD2-CH2 4.44Å
440	T	92.2	Very high	87.6	Confident	54 Å²	54	71.1 Å²	71.1	33%	0.331	35%	0.346	S	S	.	.	H	α-helix	trans	-53.9	-41.2	174.4	-58.1	0	0	0	0	112.3	V436 Q438 L444 L534	V436-T440 WeakPolarHBondContact O-CB 3.16Å; V436-T440 PolarHBondContact O-N 3.12Å; V436-T440 PolarHBondContact O-OG1 2.7Å; Q438-T440 VanDerWaalsContact C-N 3.3Å; Q438-T440 PolarHBondContact O-N 2.91Å; T440-L444 HydrophobicContact CG2-CD1 4.18Å; T440-L444 WeakPolarHBondContact O-CD1 3.48Å; T440-L444 VanDerWaalsContact O-CG 3.28Å; T440-L444 WeakPolarHBondContact O-CG 3.38Å; T440-L444 PolarHBondContact O-N 2.93Å; T440-L444 VanDerWaalsContact O-N 3.12Å; T440-L534 WeakPolarHBondContact OG1-CD1 3.26Å
441	K	87.1	Confident	87.5	Confident	116 Å²	116	69.6 Å²	69.6	50%	0.504	35%	0.345	S	S	.	.	H	α-helix	trans	-70.2	-37.9	178.7	-63.3	165.1	-171	161.8	0	111.8	N437 Q438 L439 Q445	N437-K441 WeakPolarHBondContact O-CD 3.47Å; N437-K441 WeakPolarHBondContact O-CE 3.44Å; N437-K441 WeakPolarHBondContact O-CG 3.48Å; Q438-K441 WeakPolarHBondContact O-CB 3.3Å; Q438-K441 PolarHBondContact O-N 2.8Å; L439-K441 VanDerWaalsContact C-N 3.25Å; L439-K441 PolarHBondContact O-N 3.25Å; K441-Q445 WeakPolarHBondContact O-CG 3.41Å; K441-Q445 PolarHBondContact O-N 3.1Å
442	E	83.7	Confident	87.6	Confident	76 Å²	76	70.2 Å²	70.2	36%	0.355	35%	0.345	S	S	.	.	H	α-helix	trans	-70.4	-38.6	178.1	-67.3	-173.9	-139.6	0	0	111.3	Q438 L439 Q445 W446	Q438-E442 PolarHBondContact NE2-OE1 2.76Å; Q438-E442 PolarHBondContact O-N 3.18Å; L439-E442 PolarHBondContact O-N 2.98Å; L439-E442 VanDerWaalsContact O-N 3.08Å; E442-Q445 WeakPolarHBondContact O-CB 3.36Å; E442-Q445 PolarHBondContact O-N 2.88Å; E442-W446 PolarHBondContact O-N 2.98Å; E442-W446 VanDerWaalsContact O-N 3.09Å
443	C	88.6	Confident	87.7	Confident	6 Å²	6	72 Å²	72	4%	0.041	35%	0.351	C	S	.	.	H	α-helix	trans	-69	-41.5	178.7	-53.6	0	0	0	0	111.1	L439 Q445 W446 E447 L527 C530 L534	L439-C443 PolarHBondContact O-N 3.15Å; L439-C443 PolarHBondContact O-SG 3.49Å; C443-Q445 VanDerWaalsContact C-N 3.27Å; C443-Q445 PolarHBondContact O-N 3.38Å; C443-W446 CarbonylContact O-C 3.58Å; C443-W446 PolarHBondContact O-N 2.85Å; C443-E447 WeakPolarHBondContact O-CG 3.26Å; C443-E447 PolarHBondContact O-N 3.02Å; C443-L527 HydrophobicContact CB-CD1 4.22Å; C443-C530 WeakPolarHBondContact CA-SG 3.49Å; C443-C530 HydrophobicContact CB-CB 4.07Å; C443-C530 WeakPolarHBondContact CB-SG 3.32Å; C443-C530 PolarHBondContact N-SG 2.92Å; C443-C530 WeakPolarHBondContact SG-CB 3.23Å; C443-C530 PolarHBondContact SG-O 2.75Å; C443-C530 CovalentContact SG-SG 2.05Å; C443-C530 PolarHBondContact SG-SG 2.71Å; C443-L534 HydrophobicContact CB-CD2 4.44Å
444	L	92	Very high	87.6	Confident	102 Å²	102	70.6 Å²	70.6	53%	0.534	35%	0.346	S	S	.	.	H	α-helix	trans	-57	-38.1	171.8	-74.5	167.4	0	0	0	112.4	T440 E447 E448	T440-L444 HydrophobicContact CG2-CD1 4.18Å; T440-L444 WeakPolarHBondContact O-CD1 3.48Å; T440-L444 VanDerWaalsContact O-CG 3.28Å; T440-L444 WeakPolarHBondContact O-CG 3.38Å; T440-L444 PolarHBondContact O-N 2.93Å; T440-L444 VanDerWaalsContact O-N 3.12Å; L444-E447 PolarHBondContact O-N 3.05Å; L444-E448 WeakPolarHBondContact O-CB 3.17Å; L444-E448 PolarHBondContact O-N 2.89Å
445	Q	87.9	Confident	87.5	Confident	122 Å²	122	68 Å²	68	57%	0.57	34%	0.344	S	S	*	.	H	α-helix	trans	-66.5	-36.9	174.6	-72.3	169.2	17.7	0	0	112.5	K441 E442 C443 A449	K441-Q445 WeakPolarHBondContact O-CG 3.41Å; K441-Q445 PolarHBondContact O-N 3.1Å; E442-Q445 WeakPolarHBondContact O-CB 3.36Å; E442-Q445 PolarHBondContact O-N 2.88Å; C443-Q445 VanDerWaalsContact C-N 3.27Å; C443-Q445 PolarHBondContact O-N 3.38Å; Q445-A449 VanDerWaalsContact O-CB 3.32Å; Q445-A449 WeakPolarHBondContact O-CB 3.4Å; Q445-A449 PolarHBondContact O-N 3.42Å
446	W	89.7	Confident	87.5	Confident	60 Å²	60	68.3 Å²	68.3	23%	0.227	35%	0.345	C	S	.	.	H	α-helix	trans	-74.6	-31.9	175.1	-64.2	117.8	0	0	0	112.8	E442 C443 L450 V523 R526 L527	E442-W446 PolarHBondContact O-N 2.98Å; E442-W446 VanDerWaalsContact O-N 3.09Å; C443-W446 CarbonylContact O-C 3.58Å; C443-W446 PolarHBondContact O-N 2.85Å; W446-L450 VanDerWaalsContact O-CB 3.31Å; W446-L450 WeakPolarHBondContact O-CB 3.45Å; W446-L450 PolarHBondContact O-N 2.9Å; W446-V523 HydrophobicContact CE3-CG1 4.26Å; W446-V523 WeakPolarHBondContact O-CG1 3.19Å; W446-R526 HydrophobicContact CD2-CB 3.93Å; W446-R526 HydrophobicContact CE3-CB 4.04Å; W446-R526 HydrophobicContact CG-CB 4.43Å; W446-R526 VanDerWaalsContact CH2-CD 3.49Å; W446-R526 HydrophobicContact CZ2-CB 4.43Å; W446-R526 HydrophobicContact CZ3-CB 4.35Å; W446-L527 HydrophobicContact CB-CB 3.89Å; W446-L527 HydrophobicContact CB-CD1 3.95Å; W446-L527 HydrophobicContact CB-CG 4.44Å
447	E	91.7	Very high	87	Confident	84 Å²	84	68.7 Å²	68.7	39%	0.393	35%	0.346	S	S	.	.	H	α-helix	trans	-65.8	-43.7	170.4	-72.1	-178.7	153.7	0	0	111.9	C443 L444 L450 S451 L527	C443-E447 WeakPolarHBondContact O-CG 3.26Å; C443-E447 PolarHBondContact O-N 3.02Å; L444-E447 PolarHBondContact O-N 3.05Å; E447-L450 PolarHBondContact O-N 2.86Å; E447-S451 WeakPolarHBondContact O-CB 3.49Å; E447-S451 PolarHBondContact O-N 3.48Å; E447-S451 PolarHBondContact O-OG 3.27Å; E447-L527 HydrophobicContact CG-CD1 3.67Å; E447-L527 HydrophobicContact CG-CD2 3.74Å; E447-L527 HydrophobicContact CG-CG 4.37Å
448	E	89	Confident	86.4	Confident	119 Å²	119	67.6 Å²	67.6	56%	0.556	35%	0.35	S	S	*	.	H	α-helix	trans	-61.9	-48.3	174.5	-162.8	-165.4	147.7	0	0	110.4	L444 L450 S451 Q452	L444-E448 WeakPolarHBondContact O-CB 3.17Å; L444-E448 PolarHBondContact O-N 2.89Å; E448-L450 VanDerWaalsContact C-N 3.33Å; E448-L450 PolarHBondContact O-N 3.4Å; E448-S451 WeakPolarHBondContact O-CB 3.3Å; E448-S451 PolarHBondContact O-N 3.04Å; E448-S451 VanDerWaalsContact O-N 3.17Å; E448-Q452 WeakPolarHBondContact O-CG 3.41Å; E448-Q452 PolarHBondContact O-N 2.87Å; E448-Q452 PolarHBondContact OE1-NE2 3.44Å
449	A	86.4	Confident	85.9	Confident	20 Å²	20	68.8 Å²	68.8	17%	0.165	36%	0.359	C	S	.	.	H	α-helix	trans	-60.6	-38.9	176.4	0	0	0	0	0	112.6	Q445 S451 Q452 W453 V523	Q445-A449 VanDerWaalsContact O-CB 3.32Å; Q445-A449 WeakPolarHBondContact O-CB 3.4Å; Q445-A449 PolarHBondContact O-N 3.42Å; A449-S451 VanDerWaalsContact C-N 3.32Å; A449-Q452 PolarHBondContact O-N 3.48Å; A449-W453 VanDerWaalsContact O-CD1 3.24Å; A449-W453 PolarHBondContact O-N 2.9Å; A449-V523 HydrophobicContact CB-CG1 3.91Å
450	L	90.2	Very high	84.9	Confident	11 Å²	11	72.9 Å²	72.9	6%	0.058	39%	0.387	C	S	.	.	H	α-helix	trans	-65.5	-39.9	177.1	-171	64.1	0	0	0	110.9	L344 W446 E447 E448 W453 R454 L520 V523 L527	L344-L450 HydrophobicContact CD1-CD1 3.99Å; W446-L450 VanDerWaalsContact O-CB 3.31Å; W446-L450 WeakPolarHBondContact O-CB 3.45Å; W446-L450 PolarHBondContact O-N 2.9Å; E447-L450 PolarHBondContact O-N 2.86Å; E448-L450 VanDerWaalsContact C-N 3.33Å; E448-L450 PolarHBondContact O-N 3.4Å; L450-W453 PolarHBondContact O-N 3.38Å; L450-R454 WeakPolarHBondContact O-CG 3.33Å; L450-R454 PolarHBondContact O-N 2.94Å; L450-L520 HydrophobicContact CD1-CD1 3.9Å; L450-L520 WeakPolarHBondContact CD1-O 3.44Å; L450-V523 HydrophobicContact CB-CG1 3.82Å; L450-V523 HydrophobicContact CD1-CB 4.38Å; L450-V523 HydrophobicContact CD1-CG1 4.13Å; L450-L527 HydrophobicContact CD2-CD2 3.91Å
451	S	89.9	Confident	83.7	Confident	75 Å²	75	71.8 Å²	71.8	52%	0.524	39%	0.386	S	S	.	.	H	α-helix	trans	-67	-41.2	177.4	-55.8	0	0	0	0	111.7	E447 E448 A449 R454 A455	E447-S451 WeakPolarHBondContact O-CB 3.49Å; E447-S451 PolarHBondContact O-N 3.48Å; E447-S451 PolarHBondContact O-OG 3.27Å; E448-S451 WeakPolarHBondContact O-CB 3.3Å; E448-S451 PolarHBondContact O-N 3.04Å; E448-S451 VanDerWaalsContact O-N 3.17Å; A449-S451 VanDerWaalsContact C-N 3.32Å; S451-R454 PolarHBondContact O-N 3.17Å; S451-A455 WeakPolarHBondContact O-CB 3.4Å; S451-A455 PolarHBondContact O-N 3.27Å
452	Q	86.4	Confident	82.9	Confident	108 Å²	108	71.8 Å²	71.8	51%	0.505	40%	0.398	S	S	.	.	H	α-helix	trans	-60.4	-47.2	173.4	-70.4	173.5	17.1	0	0	111.5	E448 A449 A455 V456	E448-Q452 WeakPolarHBondContact O-CG 3.41Å; E448-Q452 PolarHBondContact O-N 2.87Å; E448-Q452 PolarHBondContact OE1-NE2 3.44Å; A449-Q452 PolarHBondContact O-N 3.48Å; Q452-A455 PolarHBondContact O-N 2.78Å; Q452-V456 PolarHBondContact O-N 3.47Å
453	W	86.8	Confident	82.4	Confident	52 Å²	52	71 Å²	71	20%	0.197	40%	0.396	C	S	.	.	H	α-helix	trans	-64	-41.6	175.9	-80.7	109.7	0	0	0	112.6	A449 L450 A455 V456 F457 D513 N519 L520	A449-W453 VanDerWaalsContact O-CD1 3.24Å; A449-W453 PolarHBondContact O-N 2.9Å; L450-W453 PolarHBondContact O-N 3.38Å; W453-A455 VanDerWaalsContact C-N 3.3Å; W453-A455 PolarHBondContact O-N 3.41Å; W453-V456 WeakPolarHBondContact O-CB 3.37Å; W453-V456 PolarHBondContact O-N 2.74Å; W453-F457 HydrophobicContact CB-CE2 4.15Å; W453-F457 HydrophobicContact CD2-CE2 4.36Å; W453-F457 AromaticContact CE3-CE2 3.57Å; W453-F457 HydrophobicContact CE3-CE2 3.57Å; W453-F457 AromaticContact CE3-CZ 3.48Å; W453-F457 HydrophobicContact CE3-CZ 3.48Å; W453-F457 VanDerWaalsContact CE3-CZ 3.48Å; W453-F457 HydrophobicContact CZ3-CE2 4.4Å; W453-F457 AromaticContact CZ3-CZ 3.85Å; W453-F457 HydrophobicContact CZ3-CZ 3.85Å; W453-F457 WeakPolarHBondContact O-CD2 3.33Å; W453-F457 WeakPolarHBondContact O-CE2 3.23Å; W453-F457 PolarHBondContact O-N 3.49Å; W453-D513 HydrophobicContact CH2-CB 4.21Å; W453-D513 HydrophobicContact CZ3-CB 3.96Å; W453-N519 HydrophobicContact CD2-CB 3.92Å; W453-N519 HydrophobicContact CE3-CB 4.21Å; W453-N519 HydrophobicContact CH2-CB 4.12Å; W453-N519 WeakPolarHBondContact CH2-ND2 3.5Å; W453-N519 HydrophobicContact CZ2-CB 3.8Å; W453-N519 WeakPolarHBondContact CZ2-ND2 3.34Å; W453-N519 HydrophobicContact CZ3-CB 4.28Å; W453-L520 HydrophobicContact CB-CD1 3.89Å
454	R	87.3	Confident	81.7	Confident	101 Å²	101	71.8 Å²	71.8	38%	0.381	40%	0.401	S	S	.	.	H	α-helix	trans	-59.1	-40	173	-78.5	-172.4	153.5	164.2	-10	112.3	E347 L450 S451 V456 F457 A458 L520	E347-R454 IonicContact OE1-NH2 3.58Å; E347-R454 PolarHBondContact OE1-NH2 3.17Å; L450-R454 WeakPolarHBondContact O-CG 3.33Å; L450-R454 PolarHBondContact O-N 2.94Å; S451-R454 PolarHBondContact O-N 3.17Å; R454-V456 VanDerWaalsContact C-N 3.31Å; R454-V456 PolarHBondContact O-N 3.22Å; R454-F457 PolarHBondContact O-N 3.49Å; R454-A458 VanDerWaalsContact O-CB 3.24Å; R454-A458 WeakPolarHBondContact O-CB 3.39Å; R454-A458 PolarHBondContact O-N 3.17Å; R454-L520 HydrophobicContact CG-CD1 3.68Å
455	A	84.8	Confident	80.9	Confident	57 Å²	57	67.4 Å²	67.4	47%	0.471	38%	0.377	S	S	.	.	H	α-helix	trans	-64.7	-31.2	177.3	0	0	0	0	0	113.7	S451 Q452 W453 N459	S451-A455 WeakPolarHBondContact O-CB 3.4Å; S451-A455 PolarHBondContact O-N 3.27Å; Q452-A455 PolarHBondContact O-N 2.78Å; W453-A455 VanDerWaalsContact C-N 3.3Å; W453-A455 PolarHBondContact O-N 3.41Å; A455-N459 PolarHBondContact O-ND2 2.79Å
456	V	80.7	Confident	79.6	Confident	53 Å²	53	64.8 Å²	64.8	32%	0.321	37%	0.372	S	S	.	.	H	α-helix	trans	-66.1	-48.1	172.4	172.9	0	0	0	0	110.9	Q452 W453 R454 D513	Q452-V456 PolarHBondContact O-N 3.47Å; W453-V456 WeakPolarHBondContact O-CB 3.37Å; W453-V456 PolarHBondContact O-N 2.74Å; R454-V456 VanDerWaalsContact C-N 3.31Å; R454-V456 PolarHBondContact O-N 3.22Å; V456-D513 HydrophobicContact CG1-CB 4.09Å
457	F	77.4	Confident	77.8	Confident	25 Å²	25	65.9 Å²	65.9	11%	0.11	39%	0.39	C	S	.	.	H	α-helix	trans	-79.2	-22.3	-177	-54.7	-59.1	0	0	0	114	H351 W453 R454 N459 P517 L520	H351-F457 AromaticContact CE1-CD1 3.71Å; H351-F457 AromaticContact NE2-CD1 3.74Å; W453-F457 HydrophobicContact CB-CE2 4.15Å; W453-F457 HydrophobicContact CD2-CE2 4.36Å; W453-F457 AromaticContact CE3-CE2 3.57Å; W453-F457 HydrophobicContact CE3-CE2 3.57Å; W453-F457 AromaticContact CE3-CZ 3.48Å; W453-F457 HydrophobicContact CE3-CZ 3.48Å; W453-F457 VanDerWaalsContact CE3-CZ 3.48Å; W453-F457 HydrophobicContact CZ3-CE2 4.4Å; W453-F457 AromaticContact CZ3-CZ 3.85Å; W453-F457 HydrophobicContact CZ3-CZ 3.85Å; W453-F457 WeakPolarHBondContact O-CD2 3.33Å; W453-F457 WeakPolarHBondContact O-CE2 3.23Å; W453-F457 PolarHBondContact O-N 3.49Å; R454-F457 PolarHBondContact O-N 3.49Å; F457-N459 PolarHBondContact O-N 2.67Å; F457-P517 HydrophobicContact CD1-CB 4.43Å; F457-P517 HydrophobicContact CE1-CB 3.9Å; F457-P517 VanDerWaalsContact CZ-CA 3.45Å; F457-P517 HydrophobicContact CZ-CB 4.05Å; F457-L520 HydrophobicContact CD2-CB 4.48Å; F457-L520 HydrophobicContact CD2-CD1 4.39Å; F457-L520 HydrophobicContact CD2-CD2 4.04Å; F457-L520 HydrophobicContact CE2-CB 4.07Å; F457-L520 HydrophobicContact CE2-CD2 4.44Å
458	A	77.4	Confident	75.7	Confident	73 Å²	73	67.6 Å²	67.6	60%	0.603	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-18.3	174.1	0	0	0	0	0	113.7	R454 P460	R454-A458 VanDerWaalsContact O-CB 3.24Å; R454-A458 WeakPolarHBondContact O-CB 3.39Å; R454-A458 PolarHBondContact O-N 3.17Å; A458-P460 VanDerWaalsContact C-CD 3.41Å; A458-P460 WeakPolarHBondContact O-CD 3.43Å
459	N	72.2	Confident	73.9	Confident	119 Å²	119	63 Å²	63	64%	0.636	38%	0.38	S	S	*	.	S	Bend	trans	-108.3	81.2	174	-72.5	-74.1	0	0	0	110.5	A455 F457 G461	A455-N459 PolarHBondContact O-ND2 2.79Å; F457-N459 PolarHBondContact O-N 2.67Å; N459-G461 VanDerWaalsContact C-N 3.27Å; N459-G461 PolarHBondContact O-N 2.9Å
460	P	62.7	Low	72	Confident	98 Å²	98	67.5 Å²	67.5	64%	0.636	40%	0.397	S	S	*	.			trans	-68.5	87	173.8	29.9	-35.1	0	0	0	110	A458	A458-P460 VanDerWaalsContact C-CD 3.41Å; A458-P460 WeakPolarHBondContact O-CD 3.43Å
461	G	66.6	Low	69.6	Low	31 Å²	31	72.2 Å²	72.2	32%	0.32	42%	0.422	S	S	.	.	P	Polyproline II helix	trans	-55.9	168.2	169.2	0	0	0	0	0	111.8	N459 N463 R514	N459-G461 VanDerWaalsContact C-N 3.27Å; N459-G461 PolarHBondContact O-N 2.9Å; G461-N463 PolarHBondContact O-N 3.07Å; G461-R514 PolarHBondContact O-NH1 3.44Å
462	P	70.6	Confident	67.1	Low	115 Å²	115	72 Å²	72	75%	0.747	41%	0.414	S	S	*	.	P	Polyproline II helix	trans	-51.8	137.5	-169.2	20.9	-33.5	0	0	0	112.9	R514	P462-R514 PolarHBondContact O-NH1 2.98Å
463	N	72.2	Confident	64.6	Low	59 Å²	59	73.9 Å²	73.9	32%	0.316	42%	0.422	S	S	.	.	P	Polyproline II helix	trans	-65.9	120.5	177.7	180	-20.8	0	0	0	109.5	G461 W465 S466	G461-N463 PolarHBondContact O-N 3.07Å; N463-W465 PolarHBondContact O-N 3.15Å; N463-W465 WeakPolarHBondContact OD1-CB 3.47Å; N463-W465 PolarHBondContact OD1-N 3.37Å; N463-S466 WeakPolarHBondContact O-CB 3.48Å; N463-S466 PolarHBondContact O-N 3.15Å
464	P	74.1	Confident	61.9	Low	23 Å²	23	76.2 Å²	76.2	15%	0.149	45%	0.447	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66	-10.9	-176.1	26	-33.1	0	0	0	114.1	F355 P504 L509	F355-P464 HydrophobicContact CE2-CG 4.16Å; P464-P504 HydrophobicContact CB-CB 4.28Å; P464-P504 HydrophobicContact CB-CG 4.23Å; P464-L509 HydrophobicContact CB-CD1 4.36Å; P464-L509 HydrophobicContact CB-CD2 3.84Å; P464-L509 HydrophobicContact CG-CD2 4.02Å
465	W	74.7	Confident	59.3	Low	10 Å²	10	77 Å²	77	4%	0.038	47%	0.468	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.6	13.8	179.9	-52	102.2	0	0	0	114	T213 R214 F217 F355 G356 N463 P504 L509	T213-W465 HydrophobicContact CG2-CH2 4.19Å; R214-W465 HydrophobicContact CB-CE3 4.4Å; R214-W465 HydrophobicContact CB-CH2 4.01Å; R214-W465 HydrophobicContact CB-CZ3 3.76Å; R214-W465 HydrophobicContact CG-CE3 4.31Å; R214-W465 HydrophobicContact CG-CH2 4.29Å; R214-W465 HydrophobicContact CG-CZ3 4.08Å; F217-W465 HydrophobicContact CB-CH2 3.97Å; F217-W465 HydrophobicContact CB-CZ2 3.52Å; F217-W465 HydrophobicContact CD1-CZ2 4.01Å; F217-W465 AromaticContact CD2-CZ2 3.68Å; F217-W465 HydrophobicContact CD2-CZ2 3.68Å; F217-W465 HydrophobicContact CE2-CZ2 4.38Å; F217-W465 HydrophobicContact CG-CH2 4.4Å; F217-W465 AromaticContact CG-CZ2 3.46Å; F217-W465 HydrophobicContact CG-CZ2 3.46Å; F217-W465 VanDerWaalsContact CG-CZ2 3.46Å; F355-W465 PolarHBondContact O-NE1 3.25Å; G356-W465 VanDerWaalsContact C-CD1 3.44Å; N463-W465 PolarHBondContact O-N 3.15Å; N463-W465 WeakPolarHBondContact OD1-CB 3.47Å; N463-W465 PolarHBondContact OD1-N 3.37Å; W465-P504 HydrophobicContact CH2-CG 4.47Å; W465-L509 HydrophobicContact CZ2-CD1 4.33Å
466	S	62	Low	56.8	Low	67 Å²	67	77.3 Å²	77.3	47%	0.469	48%	0.476	S	S	.	.			trans	-53.7	152.9	-169.3	65.6	0	0	0	0	115.7	N463 N468 L469	N463-S466 WeakPolarHBondContact O-CB 3.48Å; N463-S466 PolarHBondContact O-N 3.15Å; S466-N468 PolarHBondContact O-N 3.09Å; S466-L469 PolarHBondContact O-N 3.08Å
467	S	50	Low	54.2	Low	84 Å²	84	81.1 Å²	81.1	59%	0.587	50%	0.499	S	S	*	.	G	3₁₀ helix	trans	-55.2	-20.6	-152.1	-41.1	0	0	0	0	117.8	L469 F470	S467-L469 PolarHBondContact O-N 3.48Å; S467-F470 PolarHBondContact O-N 3.24Å
468	N	48.2	Very low	51.9	Low	120 Å²	120	84.7 Å²	84.7	64%	0.642	53%	0.527	S	S	*	.	G	3₁₀ helix	trans	-62.1	-24.3	178.6	-69.7	-15.3	0	0	0	112.7	S466 F470 L501	S466-N468 PolarHBondContact O-N 3.09Å; N468-F470 VanDerWaalsContact C-N 3.35Å; N468-F470 PolarHBondContact O-N 3.19Å; N468-L501 HydrophobicContact CB-CD2 3.92Å; N468-L501 VanDerWaalsContact O-CD2 3.26Å; N468-L501 WeakPolarHBondContact O-CD2 3.2Å
469	L	50.5	Low	49.8	Very low	21 Å²	21	86.9 Å²	86.9	11%	0.11	54%	0.535	C	S	.	.	G	3₁₀ helix	trans	-71.5	-25.5	179.5	-57.4	-174.1	0	0	0	113.8	M210 S466 S467 L501	M210-L469 HydrophobicContact CE-CB 4.42Å; M210-L469 HydrophobicContact CE-CD1 4.21Å; M210-L469 HydrophobicContact CE-CD2 3.65Å; M210-L469 HydrophobicContact CE-CG 4.3Å; M210-L469 HydrophobicContact SD-CB 4Å; M210-L469 HydrophobicContact SD-CD1 3.9Å; M210-L469 HydrophobicContact SD-CD2 4.26Å; M210-L469 HydrophobicContact SD-CG 4.26Å; S466-L469 PolarHBondContact O-N 3.08Å; S467-L469 PolarHBondContact O-N 3.48Å; L469-L501 HydrophobicContact CD2-CB 4.07Å; L469-L501 HydrophobicContact CD2-CD2 3.99Å
470	F	47.1	Very low	47.6	Very low	116 Å²	116	89.4 Å²	89.4	51%	0.509	55%	0.547	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.8	-22.9	-172.8	-73.3	-84.6	0	0	0	114.6	S467 N468 I472	S467-F470 PolarHBondContact O-N 3.24Å; N468-F470 VanDerWaalsContact C-N 3.35Å; N468-F470 PolarHBondContact O-N 3.19Å; F470-I472 VanDerWaalsContact C-N 3.29Å; F470-I472 PolarHBondContact O-N 2.99Å; F470-I472 VanDerWaalsContact O-N 3.1Å
471	N	39.6	Very low	46.1	Very low	109 Å²	109	90 Å²	90	58%	0.583	55%	0.549	S	S	*	.	G	3₁₀ helix	trans	-80.2	15	-165.7	-91.7	-14.5	0	0	0	117.2	H473	N471-H473 PolarHBondContact O-N 2.8Å; N471-H473 VanDerWaalsContact O-N 3.09Å
472	I	38.3	Very low	44.4	Very low	71 Å²	71	95.4 Å²	95.4	36%	0.364	57%	0.57	S	S	.	*	G	3₁₀ helix	trans	-69.7	-8.7	-171.5	-64.4	174	0	0	0	113.9	F470	F470-I472 VanDerWaalsContact C-N 3.29Å; F470-I472 PolarHBondContact O-N 2.99Å; F470-I472 VanDerWaalsContact O-N 3.1Å
473	H	33.3	Very low	42.6	Very low	147 Å²	147	95.9 Å²	95.9	68%	0.681	57%	0.571	S	S	*	*	G	3₁₀ helix	trans	-103	5	-173.1	-85.7	-61.5	0	0	0	117.1	Q207 N471	Q207-H473 PolarHBondContact NE2-CD2 3.24Å; Q207-H473 PolarHBondContact NE2-NE2 3.27Å; N471-H473 PolarHBondContact O-N 2.8Å; N471-H473 VanDerWaalsContact O-N 3.09Å
474	S	31.4	Very low	40.7	Very low	102 Å²	102	98.6 Å²	98.6	71%	0.713	59%	0.592	S	S	*	*	S	Bend	trans	-116	5.3	-166.4	-56.7	0	0	0	0	116.6
475	S	32.4	Very low	38.9	Very low	117 Å²	117	105.7 Å²	105.7	82%	0.818	62%	0.623	S	S	*	*			trans	-149.4	148.4	168.9	61.7	0	0	0	0	111
476	G	30.8	Very low	37	Very low	63 Å²	63	110.4 Å²	110.4	65%	0.649	65%	0.649	S	S	*	*			cis	179.7	108	-9.1	0	0	0	0	0	108.8	S478	G476-S478 PolarHBondContact O-N 3.22Å
477	V	27.5	Very low	35.6	Very low	133 Å²	133	113.3 Å²	113.3	81%	0.806	66%	0.66	S	S	*	*			trans	-81.5	103.9	-174.1	180	0	0	0	0	110.4
478	S	29.1	Very low	34.8	Very low	100 Å²	100	117 Å²	117	70%	0.699	67%	0.673	S	S	*	*			trans	-145.9	131.5	168	43.1	0	0	0	0	110.8	G476	G476-S478 PolarHBondContact O-N 3.22Å
479	P	32.9	Very low	34	Very low	119 Å²	119	115.4 Å²	115.4	77%	0.773	67%	0.671	S	S	*	*			trans	-83.5	148.3	-176.5	33	-34.9	0	0	0	112.8	V481	P479-V481 PolarHBondContact O-N 3.03Å
480	I	26.3	Very low	33.1	Very low	173 Å²	173	122 Å²	122	89%	0.887	71%	0.706	S	S	*	*			trans	-82.3	112.1	179.8	-59.6	170.1	0	0	0	110.2
481	V	30.6	Very low	32.3	Very low	110 Å²	110	119.8 Å²	119.8	67%	0.667	72%	0.717	S	S	*	*			trans	-147.4	121.1	169.1	176.8	0	0	0	0	110.2	P479	P479-V481 PolarHBondContact O-N 3.03Å
482	N	31.2	Very low	31.6	Very low	144 Å²	144	124.9 Å²	124.9	77%	0.77	73%	0.734	S	S	*	*			trans	63.5	145.9	165.1	-61.1	-8.8	0	0	0	117.8
483	T	32.1	Very low	31.2	Very low	125 Å²	125	129.8 Å²	129.8	77%	0.767	76%	0.755	S	S	*	*			cis	-155.4	161.8	-12.7	12.1	0	0	0	0	108.5
484	P	33.5	Very low	31	Very low	116 Å²	116	130.6 Å²	130.6	75%	0.753	76%	0.759	S	S	*	*			trans	-96.9	160.2	-165.9	37.7	-36	0	0	0	115.1
485	Q	34.8	Very low	31	Very low	172 Å²	172	132.9 Å²	132.9	80%	0.804	77%	0.768	S	S	*	*			trans	-155.6	147.6	147.5	-119.5	180	-73.1	0	0	114.1
486	D	34.5	Very low	30.7	Very low	109 Å²	109	132.5 Å²	132.5	58%	0.583	76%	0.757	S	S	*	*			trans	60.7	98.6	153.8	-56.9	-35.3	0	0	0	123.3
487	N	33	Very low	30.5	Very low	129 Å²	129	135.6 Å²	135.6	69%	0.69	76%	0.759	S	S	*	*				52.2	108	117.5	-48.8	-38.3	0	0	0	119.9
488	N	32.9	Very low	30.6	Very low	160 Å²	160	133.9 Å²	133.9	86%	0.856	75%	0.752	S	S	*	*				-168.3	160.1	91.8	-101.2	-41.7	0	0	0	115.2
489	S	32.1	Very low	30.6	Very low	87 Å²	87	134.7 Å²	134.7	61%	0.608	76%	0.758	S	S	*	*			trans	-64	133.1	-176.5	54.4	0	0	0	0	115.6
490	N	32	Very low	31.1	Very low	159 Å²	159	136.7 Å²	136.7	85%	0.85	76%	0.757	S	S	*	*				161.5	150.6	112.6	-83.1	-38.6	0	0	0	112.9
491	G	29.6	Very low	32.4	Very low	71 Å²	71	132.1 Å²	132.1	73%	0.732	73%	0.734	S	S	*	*			trans	95.5	89	165	0	0	0	0	0	116	H493	G491-H493 PolarHBondContact O-N 3.19Å
492	F	25.3	Very low	33.9	Very low	215 Å²	215	130.9 Å²	130.9	94%	0.943	74%	0.735	S	S	*	*			trans	-71	111.3	160.3	-102.2	-97.5	0	0	0	109.4
493	H	30.8	Very low	35.9	Very low	174 Å²	174	126.5 Å²	126.5	81%	0.806	71%	0.711	S	S	*	*			trans	-131.9	131.9	160.8	-96.4	-83.9	0	0	0	109.8	G491 V495	G491-H493 PolarHBondContact O-N 3.19Å; H493-V495 PolarHBondContact O-N 2.76Å
494	H	29.1	Very low	38	Very low	165 Å²	165	121.8 Å²	121.8	76%	0.764	68%	0.683	S	S	*	*			trans	-62.7	121.8	169.9	-105.1	-117.8	0	0	0	109.6	D496	H494-D496 IonicContact ND1-OD2 2.66Å; H494-D496 PolarHBondContact O-N 3.42Å
495	V	30.9	Very low	40.3	Very low	150 Å²	150	120.6 Å²	120.6	91%	0.909	67%	0.67	S	S	*	*			trans	-89.3	83	166.6	-177.8	0	0	0	0	107.8	H493	H493-V495 PolarHBondContact O-N 2.76Å
496	D	26.3	Very low	42.5	Very low	109 Å²	109	114.1 Å²	114.1	58%	0.583	64%	0.641	S	S	*	*			trans	-80.9	125.7	173.3	-94.4	-50.2	0	0	0	111.4	H494	H494-D496 IonicContact ND1-OD2 2.66Å; H494-D496 PolarHBondContact O-N 3.42Å
497	N	26.3	Very low	44.6	Very low	128 Å²	128	111.2 Å²	111.2	68%	0.684	62%	0.624	S	S	*	*	S	Bend	trans	59.7	148	144.9	-60	-60	0	0	0	122.3
498	S	28.9	Very low	46.9	Very low	96 Å²	96	110.3 Å²	110.3	67%	0.671	62%	0.619	S	S	*	*			trans	71.9	35.3	137.5	65.8	0	0	0	0	120.5	H500	S498-H500 PolarHBondContact O-N 3.23Å
499	S	30.4	Very low	49.2	Very low	118 Å²	118	103.2 Å²	103.2	83%	0.825	58%	0.581	S	S	*	*			trans	-71.6	53.6	155.4	69.2	0	0	0	0	112	L501	S499-L501 PolarHBondContact O-N 2.8Å
500	H	41.7	Very low	51.4	Low	160 Å²	160	102.2 Å²	102.2	74%	0.741	56%	0.564	S	S	*	*			trans	-65.7	128.3	170.2	-81.1	-67.2	0	0	0	108.8	S498 A502	S498-H500 PolarHBondContact O-N 3.23Å; H500-A502 PolarHBondContact O-N 2.82Å
501	L	53.5	Low	53.6	Low	77 Å²	77	99.2 Å²	99.2	40%	0.403	55%	0.545	S	S	.	.			trans	-64.9	106.8	170.4	-70.1	83.5	0	0	0	107.7	N468 L469 S499 L503	N468-L501 HydrophobicContact CB-CD2 3.92Å; N468-L501 VanDerWaalsContact O-CD2 3.26Å; N468-L501 WeakPolarHBondContact O-CD2 3.2Å; L469-L501 HydrophobicContact CD2-CB 4.07Å; L469-L501 HydrophobicContact CD2-CD2 3.99Å; S499-L501 PolarHBondContact O-N 2.8Å; L501-L503 PolarHBondContact O-N 2.87Å
502	A	63.3	Low	56.1	Low	84 Å²	84	98 Å²	98	69%	0.694	52%	0.521	S	S	*	.	P	Polyproline II helix	trans	-70.6	126.3	-178.6	0	0	0	0	0	109.7	H500	H500-A502 PolarHBondContact O-N 2.82Å
503	L	72.8	Confident	58.8	Low	52 Å²	52	91 Å²	91	27%	0.272	49%	0.494	S	S	.	.	P	Polyproline II helix	trans	-65.8	137.9	161.8	-84.5	158.6	0	0	0	108.9	R209 M210 T213 L501 D505	R209-L503 HydrophobicContact CB-CD1 3.48Å; R209-L503 VanDerWaalsContact CB-CD1 3.48Å; M210-L503 HydrophobicContact CE-CD1 4.31Å; M210-L503 HydrophobicContact CE-CD2 3.33Å; M210-L503 HydrophobicContact CE-CG 3.52Å; M210-L503 HydrophobicContact CG-CD2 4.47Å; M210-L503 HydrophobicContact SD-CD2 3.47Å; M210-L503 WeakPolarHBondContact SD-CD2 2.99Å; M210-L503 HydrophobicContact SD-CG 4.33Å; T213-L503 HydrophobicContact CG2-CD2 4.28Å; L501-L503 PolarHBondContact O-N 2.87Å; L503-D505 PolarHBondContact O-N 3.25Å
504	P	76.2	Confident	61.2	Low	27 Å²	27	84.7 Å²	84.7	18%	0.175	46%	0.463	C	S	.	.	P	Polyproline II helix	trans	-64.4	135.4	167.2	29.7	-34.5	0	0	0	109.2	P464 W465 I506 L509	P464-P504 HydrophobicContact CB-CB 4.28Å; P464-P504 HydrophobicContact CB-CG 4.23Å; W465-P504 HydrophobicContact CH2-CG 4.47Å; P504-I506 PolarHBondContact O-N 3.31Å; P504-L509 HydrophobicContact CB-CD1 3.81Å; P504-L509 HydrophobicContact CB-CD2 4.27Å; P504-L509 HydrophobicContact CB-CG 4.02Å; P504-L509 HydrophobicContact CG-CD1 3.95Å
505	D	81.2	Confident	63.7	Low	90 Å²	90	76.9 Å²	76.9	48%	0.481	43%	0.427	S	S	.	.	P	Polyproline II helix	trans	-70.7	130.1	172.3	-162.9	-41.3	0	0	0	109.1	L503 Q507 D508 L509	L503-D505 PolarHBondContact O-N 3.25Å; D505-Q507 PolarHBondContact O-N 2.95Å; D505-Q507 WeakPolarHBondContact OD1-CB 3.44Å; D505-Q507 PolarHBondContact OD1-N 3.06Å; D505-D508 HydrophobicContact CB-CB 4.24Å; D505-D508 PolarHBondContact O-N 2.83Å; D505-L509 WeakPolarHBondContact O-CG 3.36Å; D505-L509 PolarHBondContact O-N 3.16Å
506	I	81.4	Confident	66.4	Low	37 Å²	37	72.3 Å²	72.3	19%	0.19	39%	0.393	C	S	.	.	H	α-helix	trans	-64	-26	177.4	-170.7	58.7	0	0	0	112.1	L216 F217 L220 I221 P504 W510	L216-I506 HydrophobicContact CB-CG1 4.36Å; F217-I506 HydrophobicContact CB-CD1 4.06Å; F217-I506 HydrophobicContact CD2-CD1 4.46Å; L220-I506 HydrophobicContact CD1-CG1 4.04Å; I221-I506 HydrophobicContact CD1-CD1 4.03Å; P504-I506 PolarHBondContact O-N 3.31Å; I506-W510 WeakPolarHBondContact O-CB 3.4Å; I506-W510 PolarHBondContact O-N 3.36Å
507	Q	79.9	Confident	69.4	Low	48 Å²	48	67.1 Å²	67.1	22%	0.224	37%	0.366	C	S	.	.	H	α-helix	trans	-73.1	-38.2	175.7	-175.1	61.5	98.9	0	0	111.8	D505 W510 H511	D505-Q507 PolarHBondContact O-N 2.95Å; D505-Q507 WeakPolarHBondContact OD1-CB 3.44Å; D505-Q507 PolarHBondContact OD1-N 3.06Å; Q507-W510 PolarHBondContact O-N 3.07Å; Q507-H511 PolarHBondContact NE2-CD2 3.12Å; Q507-H511 PolarHBondContact O-CD2 3.07Å; Q507-H511 PolarHBondContact O-N 3.11Å; Q507-H511 VanDerWaalsContact O-N 3.14Å
508	D	81.3	Confident	72.4	Confident	109 Å²	109	61.1 Å²	61.1	58%	0.583	33%	0.333	S	S	*	.	H	α-helix	trans	-72	-43.9	176.2	-66.9	-16.5	0	0	0	110.4	D505 W510 H511 D512	D505-D508 HydrophobicContact CB-CB 4.24Å; D505-D508 PolarHBondContact O-N 2.83Å; D508-W510 PolarHBondContact O-N 3.45Å; D508-H511 WeakPolarHBondContact O-CA 3.35Å; D508-H511 PolarHBondContact O-N 3.34Å; D508-D512 PolarHBondContact O-N 3.47Å
509	L	80.9	Confident	75.4	Confident	12 Å²	12	58 Å²	58	6%	0.063	31%	0.31	C	S	.	.	H	α-helix	trans	-59.1	-32.9	171.6	-69.8	-177.1	0	0	0	112.6	F217 I221 F355 P464 W465 P504 D505 H511 A515	F217-L509 HydrophobicContact CD2-CD1 3.82Å; F217-L509 HydrophobicContact CE2-CD1 4.21Å; I221-L509 HydrophobicContact CD1-CB 3.91Å; F355-L509 HydrophobicContact CZ-CD2 4.28Å; P464-L509 HydrophobicContact CB-CD1 4.36Å; P464-L509 HydrophobicContact CB-CD2 3.84Å; P464-L509 HydrophobicContact CG-CD2 4.02Å; W465-L509 HydrophobicContact CZ2-CD1 4.33Å; P504-L509 HydrophobicContact CB-CD1 3.81Å; P504-L509 HydrophobicContact CB-CD2 4.27Å; P504-L509 HydrophobicContact CB-CG 4.02Å; P504-L509 HydrophobicContact CG-CD1 3.95Å; D505-L509 WeakPolarHBondContact O-CG 3.36Å; D505-L509 PolarHBondContact O-N 3.16Å; L509-H511 VanDerWaalsContact C-N 3.32Å; L509-A515 WeakPolarHBondContact O-CB 3.31Å
510	W	77.2	Confident	78.2	Confident	66 Å²	66	52.6 Å²	52.6	25%	0.25	27%	0.271	C	S	.	.	H	α-helix	trans	-73.2	-24.9	173.5	-177.6	-93.4	0	0	0	113	L220 I221 I506 Q507 D508 R516	L220-W510 WeakPolarHBondContact O-CZ3 3.36Å; I221-W510 HydrophobicContact CG1-CE3 3.76Å; I221-W510 HydrophobicContact CG1-CZ3 4.21Å; I506-W510 WeakPolarHBondContact O-CB 3.4Å; I506-W510 PolarHBondContact O-N 3.36Å; Q507-W510 PolarHBondContact O-N 3.07Å; D508-W510 PolarHBondContact O-N 3.45Å; W510-R516 PolarHBondContact O-NH2 3.1Å
511	H	79.5	Confident	80.6	Confident	96 Å²	96	45 Å²	45	44%	0.444	24%	0.236	S	C	.	.	H	α-helix	trans	-84.6	-25.4	177.8	-76.7	-51.7	0	0	0	113.7	Q507 D508 L509 D513 R516	Q507-H511 PolarHBondContact NE2-CD2 3.12Å; Q507-H511 PolarHBondContact O-CD2 3.07Å; Q507-H511 PolarHBondContact O-N 3.11Å; Q507-H511 VanDerWaalsContact O-N 3.14Å; D508-H511 WeakPolarHBondContact O-CA 3.35Å; D508-H511 PolarHBondContact O-N 3.34Å; L509-H511 VanDerWaalsContact C-N 3.32Å; H511-D513 PolarHBondContact O-N 3.03Å; H511-R516 VanDerWaalsContact CA-NH2 3.3Å; H511-R516 PolarHBondContact CE1-NH2 3.45Å; H511-R516 PolarHBondContact O-NH2 3.07Å; H511-R516 VanDerWaalsContact O-NH2 3.1Å
512	D	80.4	Confident	82.2	Confident	45 Å²	45	42.6 Å²	42.6	24%	0.241	22%	0.223	C	C	.	.	S	Bend	trans	-58.6	126.8	170.2	-162.1	-43	0	0	0	111.9	D508 R514 A515	D508-D512 PolarHBondContact O-N 3.47Å; D512-R514 PolarHBondContact O-N 3.35Å; D512-R514 WeakPolarHBondContact OD1-CB 3.36Å; D512-R514 VanDerWaalsContact OD1-CG 3.24Å; D512-R514 WeakPolarHBondContact OD1-CG 3.44Å; D512-R514 PolarHBondContact OD1-N 3.09Å; D512-R514 IonicContact OD1-NE 3.87Å; D512-R514 PolarHBondContact OD1-NE 3.17Å; D512-R514 VanDerWaalsContact OD1-NE 3.08Å; D512-R514 IonicContact OD2-CZ 2.75Å; D512-R514 VanDerWaalsContact OD2-CZ 3.26Å; D512-R514 IonicContact OD2-NE 2.71Å; D512-R514 PolarHBondContact OD2-NE 2.96Å; D512-R514 IonicContact OD2-NH2 3.67Å; D512-R514 PolarHBondContact OD2-NH2 2.91Å; D512-A515 WeakPolarHBondContact O-CB 3.16Å; D512-A515 PolarHBondContact O-N 3.48Å
513	D	82.3	Confident	83.5	Confident	69 Å²	69	39.1 Å²	39.1	37%	0.369	19%	0.193	S	C	.	.	G	3₁₀ helix	trans	-67.6	-20.5	179.8	-73.5	-52	0	0	0	112.9	W453 V456 H511 A515 R516	W453-D513 HydrophobicContact CH2-CB 4.21Å; W453-D513 HydrophobicContact CZ3-CB 3.96Å; V456-D513 HydrophobicContact CG1-CB 4.09Å; H511-D513 PolarHBondContact O-N 3.03Å; D513-A515 PolarHBondContact O-N 3.34Å; D513-R516 PolarHBondContact O-N 3.18Å; D513-R516 IonicContact OD1-CZ 3.74Å; D513-R516 IonicContact OD1-NH1 3.46Å; D513-R516 PolarHBondContact OD1-NH1 2.92Å
514	R	81	Confident	84.4	Confident	40 Å²	40	36.7 Å²	36.7	15%	0.151	18%	0.18	C	C	.	.	G	3₁₀ helix	trans	-61.9	-22.7	169.9	-60.9	178.5	-64.9	154.3	-2.3	112.7	H351 F355 G461 P462 D512 R516	H351-R514 PolarHBondContact NE2-O 3.46Å; F355-R514 HydrophobicContact CD2-CB 4.4Å; F355-R514 HydrophobicContact CE2-CB 3.99Å; F355-R514 HydrophobicContact CZ-CB 4.16Å; G461-R514 PolarHBondContact O-NH1 3.44Å; P462-R514 PolarHBondContact O-NH1 2.98Å; D512-R514 PolarHBondContact O-N 3.35Å; D512-R514 WeakPolarHBondContact OD1-CB 3.36Å; D512-R514 VanDerWaalsContact OD1-CG 3.24Å; D512-R514 WeakPolarHBondContact OD1-CG 3.44Å; D512-R514 PolarHBondContact OD1-N 3.09Å; D512-R514 IonicContact OD1-NE 3.87Å; D512-R514 PolarHBondContact OD1-NE 3.17Å; D512-R514 VanDerWaalsContact OD1-NE 3.08Å; D512-R514 IonicContact OD2-CZ 2.75Å; D512-R514 VanDerWaalsContact OD2-CZ 3.26Å; D512-R514 IonicContact OD2-NE 2.71Å; D512-R514 PolarHBondContact OD2-NE 2.96Å; D512-R514 IonicContact OD2-NH2 3.67Å; D512-R514 PolarHBondContact OD2-NH2 2.91Å; R514-R516 VanDerWaalsContact C-N 3.26Å; R514-R516 PolarHBondContact O-N 3.26Å
515	A	82.9	Confident	85.1	Confident	1 Å²	1	35.6 Å²	35.6	1%	0.008	17%	0.173	C	C	.	.	G	3₁₀ helix	trans	-81.6	0.6	175.2	0	0	0	0	0	114.1	I221 Q225 F355 L509 D512 D513	I221-A515 HydrophobicContact CD1-CB 4.09Å; I221-A515 HydrophobicContact CG1-CB 4.33Å; I221-A515 HydrophobicContact CG2-CB 3.99Å; Q225-A515 VanDerWaalsContact CD-O 3.26Å; Q225-A515 VanDerWaalsContact CG-O 3.31Å; Q225-A515 WeakPolarHBondContact CG-O 3.43Å; Q225-A515 PolarHBondContact NE2-O 3.46Å; F355-A515 HydrophobicContact CE1-CB 3.73Å; F355-A515 HydrophobicContact CZ-CB 4.37Å; L509-A515 WeakPolarHBondContact O-CB 3.31Å; D512-A515 WeakPolarHBondContact O-CB 3.16Å; D512-A515 PolarHBondContact O-N 3.48Å; D513-A515 PolarHBondContact O-N 3.34Å
516	R	87.5	Confident	85.5	Confident	54 Å²	54	31.8 Å²	31.8	20%	0.204	15%	0.152	C	C	.	.			trans	-121.5	43.9	-178.3	-51.1	-172	-163.7	119.1	9	114.8	W510 H511 D513 R514 V518 N519	W510-R516 PolarHBondContact O-NH2 3.1Å; H511-R516 VanDerWaalsContact CA-NH2 3.3Å; H511-R516 PolarHBondContact CE1-NH2 3.45Å; H511-R516 PolarHBondContact O-NH2 3.07Å; H511-R516 VanDerWaalsContact O-NH2 3.1Å; D513-R516 PolarHBondContact O-N 3.18Å; D513-R516 IonicContact OD1-CZ 3.74Å; D513-R516 IonicContact OD1-NH1 3.46Å; D513-R516 PolarHBondContact OD1-NH1 2.92Å; R514-R516 VanDerWaalsContact C-N 3.26Å; R514-R516 PolarHBondContact O-N 3.26Å; R516-V518 PolarHBondContact O-N 2.72Å; R516-V518 VanDerWaalsContact O-N 3.11Å; R516-N519 WeakPolarHBondContact O-CB 3.45Å; R516-N519 PolarHBondContact O-N 2.7Å; R516-N519 VanDerWaalsContact O-N 3.16Å
517	P	88.8	Confident	85.9	Confident	1 Å²	1	30.2 Å²	30.2	1%	0.006	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-23.3	-172.6	27.6	-34.7	0	0	0	114.1	V348 H351 L352 F457 N519 L520	V348-P517 HydrophobicContact CB-CB 4.32Å; V348-P517 HydrophobicContact CG1-CB 3.93Å; V348-P517 HydrophobicContact CG1-CG 4.02Å; V348-P517 HydrophobicContact CG2-CB 4.08Å; V348-P517 WeakPolarHBondContact CG2-O 3.48Å; H351-P517 HydrophobicContact CB-CB 4.36Å; L352-P517 HydrophobicContact CD1-CG 4.28Å; L352-P517 HydrophobicContact CD2-CG 3.46Å; L352-P517 VanDerWaalsContact CD2-CG 3.46Å; L352-P517 HydrophobicContact CG-CG 3.59Å; F457-P517 HydrophobicContact CD1-CB 4.43Å; F457-P517 HydrophobicContact CE1-CB 3.9Å; F457-P517 VanDerWaalsContact CZ-CA 3.45Å; F457-P517 HydrophobicContact CZ-CB 4.05Å; P517-N519 PolarHBondContact O-N 3.17Å; P517-L520 WeakPolarHBondContact O-CB 3.35Å; P517-L520 PolarHBondContact O-N 3.08Å
518	V	90.5	Very high	86.4	Confident	1 Å²	1	28.4 Å²	28.4	1%	0.006	14%	0.137	C	C	.	.	H	α-helix	trans	-55.8	-24.7	175.9	77.2	0	0	0	0	114	L229 R516 L520 C521 E522 F697	L229-V518 HydrophobicContact CB-CG2 4.02Å; L229-V518 HydrophobicContact CD1-CG2 4.13Å; R516-V518 PolarHBondContact O-N 2.72Å; R516-V518 VanDerWaalsContact O-N 3.11Å; V518-L520 PolarHBondContact O-N 2.73Å; V518-C521 PolarHBondContact O-N 2.86Å; V518-E522 PolarHBondContact O-N 3.14Å; V518-F697 HydrophobicContact CG1-CE1 4.12Å
519	N	90	Very high	86.7	Confident	32 Å²	32	23.8 Å²	23.8	17%	0.171	11%	0.112	C	C	.	.	H	α-helix	trans	-58.9	-29.5	177.1	-65.8	-7.2	0	0	0	112.2	W453 R516 P517 E522 V523	W453-N519 HydrophobicContact CD2-CB 3.92Å; W453-N519 HydrophobicContact CE3-CB 4.21Å; W453-N519 HydrophobicContact CH2-CB 4.12Å; W453-N519 WeakPolarHBondContact CH2-ND2 3.5Å; W453-N519 HydrophobicContact CZ2-CB 3.8Å; W453-N519 WeakPolarHBondContact CZ2-ND2 3.34Å; W453-N519 HydrophobicContact CZ3-CB 4.28Å; R516-N519 WeakPolarHBondContact O-CB 3.45Å; R516-N519 PolarHBondContact O-N 2.7Å; R516-N519 VanDerWaalsContact O-N 3.16Å; P517-N519 PolarHBondContact O-N 3.17Å; N519-E522 PolarHBondContact O-N 3.1Å; N519-V523 WeakPolarHBondContact O-CB 3.48Å; N519-V523 VanDerWaalsContact O-CG2 3.32Å; N519-V523 WeakPolarHBondContact O-CG2 3.39Å; N519-V523 PolarHBondContact O-N 2.89Å
520	L	90	Very high	87.1	Confident	3 Å²	3	23.4 Å²	23.4	2%	0.016	11%	0.11	C	C	.	.	H	α-helix	trans	-61.6	-43.2	175.3	-170.2	64.3	0	0	0	111.6	L344 V348 L450 W453 R454 F457 P517 V518 S524	L344-L520 HydrophobicContact CB-CG 4.42Å; L344-L520 HydrophobicContact CD1-CG 4.37Å; L344-L520 HydrophobicContact CD2-CD1 4.13Å; L344-L520 HydrophobicContact CD2-CD2 3.56Å; L344-L520 HydrophobicContact CD2-CG 3.64Å; L344-L520 HydrophobicContact CG-CG 4.37Å; V348-L520 HydrophobicContact CG2-CB 4.13Å; V348-L520 HydrophobicContact CG2-CD2 4.25Å; L450-L520 HydrophobicContact CD1-CD1 3.9Å; L450-L520 WeakPolarHBondContact CD1-O 3.44Å; W453-L520 HydrophobicContact CB-CD1 3.89Å; R454-L520 HydrophobicContact CG-CD1 3.68Å; F457-L520 HydrophobicContact CD2-CB 4.48Å; F457-L520 HydrophobicContact CD2-CD1 4.39Å; F457-L520 HydrophobicContact CD2-CD2 4.04Å; F457-L520 HydrophobicContact CE2-CB 4.07Å; F457-L520 HydrophobicContact CE2-CD2 4.44Å; P517-L520 WeakPolarHBondContact O-CB 3.35Å; P517-L520 PolarHBondContact O-N 3.08Å; V518-L520 PolarHBondContact O-N 2.73Å; L520-S524 WeakPolarHBondContact O-CB 3.21Å; L520-S524 PolarHBondContact O-N 2.81Å
521	C	91.9	Very high	87.8	Confident	0 Å²	0	21.1 Å²	21.1	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-72.7	-42.7	176.3	-61.5	0	0	0	0	112	L229 L344 A345 V348 V518 V523 S524 F525	L229-C521 HydrophobicContact CD1-CB 3.95Å; L229-C521 VanDerWaalsContact CD1-SG 3.55Å; L344-C521 VanDerWaalsContact C-SG 3.52Å; A345-C521 WeakPolarHBondContact CA-SG 3.32Å; A345-C521 PolarHBondContact N-SG 2.87Å; A345-C521 VanDerWaalsContact N-SG 3.35Å; V348-C521 VanDerWaalsContact CG2-SG 3.52Å; V518-C521 PolarHBondContact O-N 2.86Å; C521-V523 VanDerWaalsContact C-N 3.32Å; C521-V523 PolarHBondContact O-N 3.49Å; C521-S524 PolarHBondContact O-N 2.72Å; C521-F525 VanDerWaalsContact O-CB 3.32Å; C521-F525 WeakPolarHBondContact O-CB 3.38Å; C521-F525 PolarHBondContact O-N 2.89Å
522	E	87.4	Confident	88.3	Confident	28 Å²	28	16.9 Å²	16.9	13%	0.131	8%	0.083	C	C	.	.	H	α-helix	trans	-57.2	-46.2	174.6	163.1	158.7	-154.3	0	0	110.9	V518 N519 F525 R526 F693	V518-E522 PolarHBondContact O-N 3.14Å; N519-E522 PolarHBondContact O-N 3.1Å; E522-F525 PolarHBondContact O-N 3.28Å; E522-R526 VanDerWaalsContact O-CG 3.24Å; E522-R526 WeakPolarHBondContact O-CG 3.42Å; E522-R526 PolarHBondContact O-N 2.53Å; E522-R526 IonicContact OE1-CZ 2.85Å; E522-R526 IonicContact OE1-NE 2.68Å; E522-R526 PolarHBondContact OE1-NE 2.98Å; E522-R526 IonicContact OE1-NH2 3.82Å; E522-R526 PolarHBondContact OE1-NH2 2.81Å; E522-F693 HydrophobicContact CB-CE1 4.04Å; E522-F693 HydrophobicContact CG-CE1 3.83Å
523	V	90.5	Very high	88.6	Confident	11 Å²	11	16.3 Å²	16.3	7%	0.067	8%	0.079	C	C	.	.	H	α-helix	trans	-67.9	-39.9	179.7	173	0	0	0	0	111.6	W446 A449 L450 N519 C521 F525 R526 L527	W446-V523 HydrophobicContact CE3-CG1 4.26Å; W446-V523 WeakPolarHBondContact O-CG1 3.19Å; A449-V523 HydrophobicContact CB-CG1 3.91Å; L450-V523 HydrophobicContact CB-CG1 3.82Å; L450-V523 HydrophobicContact CD1-CB 4.38Å; L450-V523 HydrophobicContact CD1-CG1 4.13Å; N519-V523 WeakPolarHBondContact O-CB 3.48Å; N519-V523 VanDerWaalsContact O-CG2 3.32Å; N519-V523 WeakPolarHBondContact O-CG2 3.39Å; N519-V523 PolarHBondContact O-N 2.89Å; C521-V523 VanDerWaalsContact C-N 3.32Å; C521-V523 PolarHBondContact O-N 3.49Å; V523-F525 PolarHBondContact O-N 2.85Å; V523-R526 PolarHBondContact O-N 3.19Å; V523-L527 WeakPolarHBondContact O-CB 3.43Å; V523-L527 PolarHBondContact O-N 3.05Å
524	S	92.3	Very high	89	Confident	0 Å²	0	14.4 Å²	14.4	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-62.9	-39.3	173.8	177.7	0	0	0	0	113.3	R340 T341 L520 C521 L527 A528	R340-S524 PolarHBondContact NE-OG 3.04Å; R340-S524 PolarHBondContact NH2-O 3.24Å; T341-S524 PolarHBondContact OG1-OG 2.74Å; L520-S524 WeakPolarHBondContact O-CB 3.21Å; L520-S524 PolarHBondContact O-N 2.81Å; C521-S524 PolarHBondContact O-N 2.72Å; S524-L527 PolarHBondContact O-N 2.73Å; S524-A528 VanDerWaalsContact O-CB 3.32Å; S524-A528 WeakPolarHBondContact O-CB 3.25Å; S524-A528 PolarHBondContact O-N 2.85Å
525	F	90.7	Very high	89.5	Confident	4 Å²	4	13.6 Å²	13.6	2%	0.018	7%	0.068	C	C	.	.	H	α-helix	trans	-65.5	-41.3	176.3	174.2	-126.2	0	0	0	111.5	C235 L236 T239 T341 C521 E522 V523 A528 I529 F693	C235-F525 HydrophobicContact CB-CE1 4.14Å; C235-F525 HydrophobicContact CB-CZ 4.14Å; L236-F525 HydrophobicContact CD1-CD2 3.66Å; L236-F525 HydrophobicContact CD1-CE2 4.06Å; T239-F525 HydrophobicContact CG2-CE2 4.29Å; T239-F525 HydrophobicContact CG2-CZ 4.48Å; T341-F525 HydrophobicContact CG2-CB 4.11Å; C521-F525 VanDerWaalsContact O-CB 3.32Å; C521-F525 WeakPolarHBondContact O-CB 3.38Å; C521-F525 PolarHBondContact O-N 2.89Å; E522-F525 PolarHBondContact O-N 3.28Å; V523-F525 PolarHBondContact O-N 2.85Å; F525-A528 PolarHBondContact O-N 2.79Å; F525-I529 HydrophobicContact CD2-CD1 4.28Å; F525-I529 HydrophobicContact CE1-CD1 4.14Å; F525-I529 HydrophobicContact CE2-CD1 3.82Å; F525-I529 HydrophobicContact CE2-CG1 4.36Å; F525-I529 HydrophobicContact CZ-CD1 3.75Å; F525-I529 WeakPolarHBondContact O-CG1 3.26Å; F525-I529 PolarHBondContact O-N 3.15Å; F525-I529 VanDerWaalsContact O-N 3.17Å; F525-F693 HydrophobicContact CD1-CD1 4.16Å; F525-F693 AromaticContact CD1-CE1 3.88Å; F525-F693 HydrophobicContact CD1-CE1 3.88Å; F525-F693 HydrophobicContact CD1-CZ 4.2Å; F525-F693 HydrophobicContact CE1-CD1 4.15Å; F525-F693 HydrophobicContact CE1-CE1 4.25Å; F525-F693 HydrophobicContact CE1-CG 4.31Å; F525-F693 HydrophobicContact CE1-CZ 4.48Å
526	R	88.2	Confident	89.8	Confident	11 Å²	11	14.4 Å²	14.4	4%	0.042	7%	0.072	C	C	.	.	H	α-helix	trans	-64.5	-42.9	173.8	-70	177.8	178.5	-61.4	-9.2	112.1	W446 E522 V523 I529 C530 M690 R694	W446-R526 HydrophobicContact CD2-CB 3.93Å; W446-R526 HydrophobicContact CE3-CB 4.04Å; W446-R526 HydrophobicContact CG-CB 4.43Å; W446-R526 VanDerWaalsContact CH2-CD 3.49Å; W446-R526 HydrophobicContact CZ2-CB 4.43Å; W446-R526 HydrophobicContact CZ3-CB 4.35Å; E522-R526 VanDerWaalsContact O-CG 3.24Å; E522-R526 WeakPolarHBondContact O-CG 3.42Å; E522-R526 PolarHBondContact O-N 2.53Å; E522-R526 IonicContact OE1-CZ 2.85Å; E522-R526 IonicContact OE1-NE 2.68Å; E522-R526 PolarHBondContact OE1-NE 2.98Å; E522-R526 IonicContact OE1-NH2 3.82Å; E522-R526 PolarHBondContact OE1-NH2 2.81Å; V523-R526 PolarHBondContact O-N 3.19Å; R526-I529 PolarHBondContact O-N 3.49Å; R526-C530 PolarHBondContact O-N 3.4Å; R526-C530 VanDerWaalsContact O-N 3.09Å; R526-M690 HydrophobicContact CB-CE 4.33Å; R526-M690 HydrophobicContact CG-CE 4.08Å; R526-M690 HydrophobicContact CG-SD 4.19Å; R526-M690 PolarHBondContact NH1-SD 3.13Å; R526-R694 VanDerWaalsContact NH2-CG 3.31Å
527	L	91.6	Very high	89.7	Confident	3 Å²	3	12 Å²	12	2%	0.016	6%	0.063	C	C	.	.	H	α-helix	trans	-62.5	-43.1	174.1	179.5	57	0	0	0	111.6	C443 W446 E447 L450 V523 S524 I529 C530 E531	C443-L527 HydrophobicContact CB-CD1 4.22Å; W446-L527 HydrophobicContact CB-CB 3.89Å; W446-L527 HydrophobicContact CB-CD1 3.95Å; W446-L527 HydrophobicContact CB-CG 4.44Å; E447-L527 HydrophobicContact CG-CD1 3.67Å; E447-L527 HydrophobicContact CG-CD2 3.74Å; E447-L527 HydrophobicContact CG-CG 4.37Å; L450-L527 HydrophobicContact CD2-CD2 3.91Å; V523-L527 WeakPolarHBondContact O-CB 3.43Å; V523-L527 PolarHBondContact O-N 3.05Å; S524-L527 PolarHBondContact O-N 2.73Å; L527-I529 VanDerWaalsContact C-N 3.32Å; L527-I529 PolarHBondContact O-N 2.84Å; L527-C530 CarbonylContact O-C 3.59Å; L527-C530 WeakPolarHBondContact O-CB 3.32Å; L527-C530 PolarHBondContact O-N 2.9Å; L527-C530 VanDerWaalsContact O-N 3.07Å; L527-E531 HydrophobicContact CD1-CG 4.01Å; L527-E531 HydrophobicContact CG-CG 4.24Å; L527-E531 WeakPolarHBondContact O-CG 3.3Å; L527-E531 PolarHBondContact O-N 3Å
528	A	89.7	Confident	89.8	Confident	10 Å²	10	14.8 Å²	14.8	8%	0.083	8%	0.078	C	C	.	.	H	α-helix	trans	-59.9	-40.6	179.6	0	0	0	0	0	112.6	G337 R340 S524 F525 F532	G337-A528 VanDerWaalsContact CA-CB 3.46Å; R340-A528 VanDerWaalsContact NH2-N 3.17Å; S524-A528 VanDerWaalsContact O-CB 3.32Å; S524-A528 WeakPolarHBondContact O-CB 3.25Å; S524-A528 PolarHBondContact O-N 2.85Å; F525-A528 PolarHBondContact O-N 2.79Å; A528-F532 WeakPolarHBondContact O-CB 3.36Å; A528-F532 PolarHBondContact O-N 2.85Å
529	I	88.2	Confident	89.8	Confident	12 Å²	12	15 Å²	15	6%	0.062	8%	0.08	C	C	.	.	H	α-helix	trans	-65.5	-45.5	173.2	-67.7	167	0	0	0	110.3	T239 F525 R526 L527 F532 E533 V686 M690	T239-I529 HydrophobicContact CG2-CD1 4.14Å; T239-I529 HydrophobicContact CG2-CG1 4.16Å; F525-I529 HydrophobicContact CD2-CD1 4.28Å; F525-I529 HydrophobicContact CE1-CD1 4.14Å; F525-I529 HydrophobicContact CE2-CD1 3.82Å; F525-I529 HydrophobicContact CE2-CG1 4.36Å; F525-I529 HydrophobicContact CZ-CD1 3.75Å; F525-I529 WeakPolarHBondContact O-CG1 3.26Å; F525-I529 PolarHBondContact O-N 3.15Å; F525-I529 VanDerWaalsContact O-N 3.17Å; R526-I529 PolarHBondContact O-N 3.49Å; L527-I529 VanDerWaalsContact C-N 3.32Å; L527-I529 PolarHBondContact O-N 2.84Å; I529-F532 PolarHBondContact O-N 3.44Å; I529-E533 HydrophobicContact CG2-CG 4.38Å; I529-E533 WeakPolarHBondContact O-CG 3.01Å; I529-E533 PolarHBondContact O-N 3.14Å; I529-V686 HydrophobicContact CG2-CG1 3.47Å; I529-V686 VanDerWaalsContact CG2-CG1 3.47Å; I529-M690 HydrophobicContact CB-CE 4.25Å; I529-M690 HydrophobicContact CD1-CE 3.91Å; I529-M690 HydrophobicContact CD1-CG 4.03Å; I529-M690 HydrophobicContact CD1-SD 3.8Å; I529-M690 HydrophobicContact CG2-CE 4.15Å
530	C	88.8	Confident	89.7	Confident	5 Å²	5	14.2 Å²	14.2	3%	0.034	8%	0.076	C	C	.	.	H	α-helix	trans	-62	-47.9	179.3	-167.9	0	0	0	0	112.5	C443 R526 L527 F532 E533 L534	C443-C530 WeakPolarHBondContact CA-SG 3.49Å; C443-C530 HydrophobicContact CB-CB 4.07Å; C443-C530 WeakPolarHBondContact CB-SG 3.32Å; C443-C530 PolarHBondContact N-SG 2.92Å; C443-C530 WeakPolarHBondContact SG-CB 3.23Å; C443-C530 PolarHBondContact SG-O 2.75Å; C443-C530 CovalentContact SG-SG 2.05Å; C443-C530 PolarHBondContact SG-SG 2.71Å; R526-C530 PolarHBondContact O-N 3.4Å; R526-C530 VanDerWaalsContact O-N 3.09Å; L527-C530 CarbonylContact O-C 3.59Å; L527-C530 WeakPolarHBondContact O-CB 3.32Å; L527-C530 PolarHBondContact O-N 2.9Å; L527-C530 VanDerWaalsContact O-N 3.07Å; C530-F532 VanDerWaalsContact C-N 3.27Å; C530-F532 PolarHBondContact O-N 2.85Å; C530-E533 PolarHBondContact O-N 3.49Å; C530-L534 VanDerWaalsContact O-CB 3.25Å; C530-L534 WeakPolarHBondContact O-CB 3.41Å; C530-L534 PolarHBondContact O-N 2.87Å
531	E	91.4	Very high	89.7	Confident	18 Å²	18	14.3 Å²	14.3	8%	0.084	8%	0.077	C	C	.	.	H	α-helix	trans	-55.2	-44.1	175.4	-76.1	170	113.4	0	0	110.9	C333 K336 R340 L527 C535	C333-E531 VanDerWaalsContact SG-C 3.56Å; C333-E531 PolarHBondContact SG-O 3.48Å; K336-E531 IonicContact NZ-OE1 3.88Å; K336-E531 PolarHBondContact NZ-OE1 3.27Å; R340-E531 IonicContact CZ-OE2 3.65Å; R340-E531 VanDerWaalsContact NH1-CD 3.26Å; R340-E531 IonicContact NH1-OE1 2.66Å; R340-E531 PolarHBondContact NH1-OE1 3.48Å; R340-E531 VanDerWaalsContact NH1-OE1 3.11Å; R340-E531 IonicContact NH1-OE2 3.26Å; R340-E531 PolarHBondContact NH1-OE2 3.41Å; R340-E531 IonicContact NH2-OE2 3.99Å; R340-E531 PolarHBondContact NH2-OE2 3.38Å; L527-E531 HydrophobicContact CD1-CG 4.01Å; L527-E531 HydrophobicContact CG-CG 4.24Å; L527-E531 WeakPolarHBondContact O-CG 3.3Å; L527-E531 PolarHBondContact O-N 3Å; E531-C535 WeakPolarHBondContact O-CB 3.43Å; E531-C535 PolarHBondContact O-N 2.77Å
532	F	90.5	Very high	89.7	Confident	6 Å²	6	18.1 Å²	18.1	3%	0.026	10%	0.097	C	C	.	.	H	α-helix	trans	-68.2	-44.1	178.4	178.8	-100.4	0	0	0	112.8	C243 L247 L330 L334 A528 I529 C530 C535 F536 L682	C243-F532 HydrophobicContact CB-CE1 4.23Å; C243-F532 HydrophobicContact CB-CZ 4.29Å; L247-F532 HydrophobicContact CD1-CE2 4.1Å; L247-F532 HydrophobicContact CD1-CZ 4.03Å; L247-F532 HydrophobicContact CD2-CE2 4.5Å; L247-F532 HydrophobicContact CD2-CZ 4.06Å; L247-F532 HydrophobicContact CG-CZ 4.14Å; L330-F532 HydrophobicContact CB-CE2 4.33Å; L334-F532 HydrophobicContact CB-CD2 3.83Å; L334-F532 HydrophobicContact CB-CE2 4.06Å; L334-F532 HydrophobicContact CD1-CD2 4.32Å; L334-F532 HydrophobicContact CD1-CG 4.46Å; A528-F532 WeakPolarHBondContact O-CB 3.36Å; A528-F532 PolarHBondContact O-N 2.85Å; I529-F532 PolarHBondContact O-N 3.44Å; C530-F532 VanDerWaalsContact C-N 3.27Å; C530-F532 PolarHBondContact O-N 2.85Å; F532-C535 PolarHBondContact O-N 3.07Å; F532-F536 WeakPolarHBondContact O-CB 3.4Å; F532-F536 PolarHBondContact O-N 2.69Å; F532-L682 HydrophobicContact CE1-CD2 4.28Å
533	E	85.6	Confident	89.7	Confident	34 Å²	34	17 Å²	17	16%	0.159	9%	0.092	C	C	.	.	H	α-helix	trans	-62.4	-41.4	175.2	-76.4	-178.5	178.8	0	0	111.6	L439 I529 C530 F536 A537 W683 V686	L439-E533 HydrophobicContact CD1-CB 4.22Å; L439-E533 HydrophobicContact CD2-CB 4.19Å; I529-E533 HydrophobicContact CG2-CG 4.38Å; I529-E533 WeakPolarHBondContact O-CG 3.01Å; I529-E533 PolarHBondContact O-N 3.14Å; C530-E533 PolarHBondContact O-N 3.49Å; E533-F536 PolarHBondContact O-N 2.77Å; E533-A537 WeakPolarHBondContact O-CB 3.27Å; E533-A537 PolarHBondContact O-N 2.92Å; E533-W683 HydrophobicContact CB-CH2 3.82Å; E533-W683 HydrophobicContact CB-CZ2 4.34Å; E533-W683 VanDerWaalsContact CD-CZ3 3.44Å; E533-W683 HydrophobicContact CG-CH2 3.77Å; E533-W683 HydrophobicContact CG-CZ2 4.21Å; E533-W683 HydrophobicContact CG-CZ3 4.09Å; E533-W683 WeakPolarHBondContact OE2-CZ3 3.44Å; E533-V686 WeakPolarHBondContact OE1-CG1 3.49Å
534	L	90.9	Very high	89.8	Confident	29 Å²	29	17.3 Å²	17.3	15%	0.152	9%	0.093	C	C	.	.	H	α-helix	trans	-65.4	-44.6	175.1	176.6	57.9	0	0	0	111.7	V436 L439 T440 C443 C530 F536 A537 N538	V436-L534 HydrophobicContact CB-CD1 4.4Å; V436-L534 HydrophobicContact CG1-CD1 3.98Å; L439-L534 HydrophobicContact CB-CB 4.1Å; L439-L534 HydrophobicContact CB-CD1 3.99Å; T440-L534 WeakPolarHBondContact OG1-CD1 3.26Å; C443-L534 HydrophobicContact CB-CD2 4.44Å; C530-L534 VanDerWaalsContact O-CB 3.25Å; C530-L534 WeakPolarHBondContact O-CB 3.41Å; C530-L534 PolarHBondContact O-N 2.87Å; L534-F536 VanDerWaalsContact C-N 3.34Å; L534-F536 PolarHBondContact O-N 2.85Å; L534-A537 PolarHBondContact O-N 2.8Å; L534-N538 WeakPolarHBondContact O-CB 3.4Å; L534-N538 PolarHBondContact O-N 3.19Å; L534-N538 PolarHBondContact O-ND2 2.83Å; L534-N538 VanDerWaalsContact O-ND2 3.1Å
535	C	91.9	Very high	89.8	Confident	23 Å²	23	18 Å²	18	16%	0.155	10%	0.099	C	C	.	.	H	α-helix	trans	-58.6	-45.4	174.6	-175.8	0	0	0	0	111.3	C333 E531 F532 N538 C539	C333-C535 HydrophobicContact CB-CB 4.2Å; E531-C535 WeakPolarHBondContact O-CB 3.43Å; E531-C535 PolarHBondContact O-N 2.77Å; F532-C535 PolarHBondContact O-N 3.07Å; C535-N538 PolarHBondContact O-N 3.1Å; C535-C539 PolarHBondContact O-N 3.39Å; C535-C539 PolarHBondContact O-SG 3.13Å
536	F	88.8	Confident	89.9	Confident	17 Å²	17	21.4 Å²	21.4	8%	0.075	12%	0.115	C	C	.	.	H	α-helix	trans	-65.6	-40.2	176	-166.3	-99	0	0	0	112.4	L247 Y322 L330 F532 E533 L534 L540	L247-F536 HydrophobicContact CD2-CE2 4.46Å; Y322-F536 HydrophobicContact CE2-CE2 4.15Å; L330-F536 HydrophobicContact CD1-CD2 3.96Å; L330-F536 HydrophobicContact CD1-CE2 4.28Å; L330-F536 HydrophobicContact CD2-CB 4.12Å; L330-F536 HydrophobicContact CD2-CD2 3.89Å; L330-F536 HydrophobicContact CD2-CG 4.49Å; F532-F536 WeakPolarHBondContact O-CB 3.4Å; F532-F536 PolarHBondContact O-N 2.69Å; E533-F536 PolarHBondContact O-N 2.77Å; L534-F536 VanDerWaalsContact C-N 3.34Å; L534-F536 PolarHBondContact O-N 2.85Å; F536-L540 HydrophobicContact CD1-CD1 3.64Å; F536-L540 HydrophobicContact CD1-CG 4.41Å; F536-L540 HydrophobicContact CE1-CD1 3.5Å; F536-L540 VanDerWaalsContact CE1-CD1 3.5Å; F536-L540 HydrophobicContact CE1-CG 4.36Å; F536-L540 HydrophobicContact CZ-CD1 4.34Å; F536-L540 VanDerWaalsContact O-CG 3.27Å; F536-L540 WeakPolarHBondContact O-CG 3.39Å; F536-L540 PolarHBondContact O-N 2.92Å; F536-L540 VanDerWaalsContact O-N 3.08Å
537	A	85.9	Confident	90.1	Very high	3 Å²	3	21 Å²	21	3%	0.025	11%	0.113	C	C	.	.	H	α-helix	trans	-65.8	-38.9	176.2	0	0	0	0	0	112.7	T435 V436 L439 E533 L534 L540 A541	T435-A537 HydrophobicContact CG2-CB 4.21Å; V436-A537 HydrophobicContact CG2-CB 3.69Å; L439-A537 HydrophobicContact CD1-CB 3.79Å; E533-A537 WeakPolarHBondContact O-CB 3.27Å; E533-A537 PolarHBondContact O-N 2.92Å; L534-A537 PolarHBondContact O-N 2.8Å; A537-L540 PolarHBondContact O-N 2.78Å; A537-A541 PolarHBondContact O-N 2.72Å
538	N	91.6	Very high	90.2	Very high	60 Å²	60	21.5 Å²	21.5	32%	0.321	12%	0.116	S	C	.	.	H	α-helix	trans	-62.8	-52.4	173.6	-78.5	-45.3	0	0	0	111.4	V436 L534 C535 L540 A541 D542	V436-N538 WeakPolarHBondContact CG1-OD1 3.3Å; V436-N538 HydrophobicContact CG2-CB 4.48Å; V436-N538 VanDerWaalsContact CG2-OD1 3.26Å; V436-N538 WeakPolarHBondContact CG2-OD1 3.39Å; L534-N538 WeakPolarHBondContact O-CB 3.4Å; L534-N538 PolarHBondContact O-N 3.19Å; L534-N538 PolarHBondContact O-ND2 2.83Å; L534-N538 VanDerWaalsContact O-ND2 3.1Å; C535-N538 PolarHBondContact O-N 3.1Å; N538-L540 PolarHBondContact O-N 2.77Å; N538-L540 VanDerWaalsContact O-N 3.14Å; N538-A541 WeakPolarHBondContact O-CA 3.39Å; N538-A541 WeakPolarHBondContact O-CB 3.44Å; N538-A541 PolarHBondContact O-N 3.29Å; N538-D542 PolarHBondContact O-N 3.2Å
539	C	90.2	Very high	90.3	Very high	6 Å²	6	26.2 Å²	26.2	4%	0.041	14%	0.14	C	C	.	.	H	α-helix	trans	-53	-39.5	176	-65.8	0	0	0	0	111.8	W325 C535 S543	W325-C539 HydrophobicContact CB-CB 4.49Å; W325-C539 HydrophobicContact CD2-CB 3.86Å; W325-C539 HydrophobicContact CE3-CB 3.7Å; W325-C539 HydrophobicContact CG-CB 4.26Å; W325-C539 WeakPolarHBondContact CH2-O 3.35Å; W325-C539 HydrophobicContact CZ3-CB 4.21Å; W325-C539 WeakPolarHBondContact CZ3-O 3.46Å; C535-C539 PolarHBondContact O-N 3.39Å; C535-C539 PolarHBondContact O-SG 3.13Å; C539-S543 PolarHBondContact O-N 3.3Å
540	L	88	Confident	90.5	Very high	16 Å²	16	28.2 Å²	28.2	8%	0.084	15%	0.153	C	C	.	.	H	α-helix	trans	-70.2	-38.8	176.5	-69.8	173.8	0	0	0	113.3	F536 A537 N538 S543 E544 R679	F536-L540 HydrophobicContact CD1-CD1 3.64Å; F536-L540 HydrophobicContact CD1-CG 4.41Å; F536-L540 HydrophobicContact CE1-CD1 3.5Å; F536-L540 VanDerWaalsContact CE1-CD1 3.5Å; F536-L540 HydrophobicContact CE1-CG 4.36Å; F536-L540 HydrophobicContact CZ-CD1 4.34Å; F536-L540 VanDerWaalsContact O-CG 3.27Å; F536-L540 WeakPolarHBondContact O-CG 3.39Å; F536-L540 PolarHBondContact O-N 2.92Å; F536-L540 VanDerWaalsContact O-N 3.08Å; A537-L540 PolarHBondContact O-N 2.78Å; N538-L540 PolarHBondContact O-N 2.77Å; N538-L540 VanDerWaalsContact O-N 3.14Å; L540-S543 WeakPolarHBondContact O-CB 3.37Å; L540-S543 PolarHBondContact O-N 2.98Å; L540-E544 WeakPolarHBondContact O-CG 3.43Å; L540-E544 PolarHBondContact O-N 3.06Å; L540-E544 VanDerWaalsContact O-N 3.17Å; L540-R679 VanDerWaalsContact CD2-NH2 3.32Å
541	A	89	Confident	90.7	Very high	5 Å²	5	28 Å²	28	4%	0.041	15%	0.152	C	C	.	.	H	α-helix	trans	-61.5	-46.8	172.4	0	0	0	0	0	111.2	H432 R433 A537 N538 S543 E544 A545	H432-A541 HydrophobicContact CB-CB 3.91Å; R433-A541 HydrophobicContact CG-CB 4.25Å; A537-A541 PolarHBondContact O-N 2.72Å; N538-A541 WeakPolarHBondContact O-CA 3.39Å; N538-A541 WeakPolarHBondContact O-CB 3.44Å; N538-A541 PolarHBondContact O-N 3.29Å; A541-S543 PolarHBondContact O-N 3.33Å; A541-E544 PolarHBondContact O-N 3.22Å; A541-A545 WeakPolarHBondContact O-CB 3.26Å; A541-A545 PolarHBondContact O-N 3.36Å
542	D	91.7	Very high	90.6	Very high	79 Å²	79	29.6 Å²	29.6	42%	0.422	16%	0.163	S	C	.	.	H	α-helix	trans	-63.2	-29.4	177.8	-65	-27.1	0	0	0	112.3	W325 N538 Q546	W325-D542 HydrophobicContact CH2-CB 4.35Å; W325-D542 HydrophobicContact CZ2-CB 3.97Å; N538-D542 PolarHBondContact O-N 3.2Å; D542-Q546 WeakPolarHBondContact O-CB 3.48Å; D542-Q546 VanDerWaalsContact O-CG 3.26Å; D542-Q546 WeakPolarHBondContact O-CG 3.49Å; D542-Q546 PolarHBondContact O-N 3.07Å; D542-Q546 PolarHBondContact O-NE2 3.43Å
543	S	89.3	Confident	90.6	Very high	4 Å²	4	33.3 Å²	33.3	3%	0.028	18%	0.183	C	C	.	.	H	α-helix	trans	-68.1	-49.1	173.6	-161.6	0	0	0	0	112	C539 L540 A541 Q546 L547	C539-S543 PolarHBondContact O-N 3.3Å; L540-S543 WeakPolarHBondContact O-CB 3.37Å; L540-S543 PolarHBondContact O-N 2.98Å; A541-S543 PolarHBondContact O-N 3.33Å; S543-Q546 PolarHBondContact O-N 2.87Å; S543-L547 WeakPolarHBondContact O-CD1 3.3Å; S543-L547 VanDerWaalsContact O-CG 3.23Å; S543-L547 WeakPolarHBondContact O-CG 3.39Å; S543-L547 PolarHBondContact O-N 2.97Å
544	E	91.6	Very high	90.7	Very high	19 Å²	19	31.8 Å²	31.8	9%	0.089	18%	0.176	C	C	.	.	H	α-helix	trans	-67.8	-39.6	-179.2	-58.4	-67.5	-178	0	0	110.2	H425 K428 E429 L540 A541 Q546 L547 V548	H425-E544 IonicContact CE1-OE2 2.82Å; H425-E544 IonicContact CG-OE2 2.71Å; H425-E544 IonicContact ND1-OE2 2.74Å; H425-E544 PolarHBondContact ND1-OE2 3.46Å; K428-E544 HydrophobicContact CB-CB 4.42Å; K428-E544 HydrophobicContact CB-CG 3.77Å; K428-E544 VanDerWaalsContact CD-CD 3.44Å; K428-E544 WeakPolarHBondContact CD-OE1 3.14Å; K428-E544 WeakPolarHBondContact CD-OE2 3.35Å; K428-E544 IonicContact NZ-OE2 2.66Å; E429-E544 HydrophobicContact CB-CB 3.76Å; E429-E544 HydrophobicContact CG-CB 4.26Å; L540-E544 WeakPolarHBondContact O-CG 3.43Å; L540-E544 PolarHBondContact O-N 3.06Å; L540-E544 VanDerWaalsContact O-N 3.17Å; A541-E544 PolarHBondContact O-N 3.22Å; E544-Q546 PolarHBondContact O-N 2.92Å; E544-L547 PolarHBondContact O-N 2.97Å; E544-V548 VanDerWaalsContact O-CG2 3.31Å; E544-V548 WeakPolarHBondContact O-CG2 3.42Å; E544-V548 PolarHBondContact O-N 3.06Å
545	A	92.6	Very high	90.4	Very high	15 Å²	15	32.7 Å²	32.7	12%	0.124	18%	0.179	C	C	.	.	H	α-helix	trans	-60.2	-43.9	174.5	0	0	0	0	0	112.8	E429 A541 V548 N549	E429-A545 HydrophobicContact CG-CB 4.03Å; A541-A545 WeakPolarHBondContact O-CB 3.26Å; A541-A545 PolarHBondContact O-N 3.36Å; A545-V548 PolarHBondContact O-N 2.98Å; A545-N549 PolarHBondContact O-N 3.17Å
546	Q	92	Very high	90.1	Very high	74 Å²	74	35.3 Å²	35.3	35%	0.346	20%	0.197	S	C	.	.	H	α-helix	trans	-67.8	-36.5	176.5	-75.6	173.7	85.2	0	0	112.5	H321 D542 S543 E544 N549 V550	H321-Q546 PolarHBondContact CE1-OE1 3.22Å; D542-Q546 WeakPolarHBondContact O-CB 3.48Å; D542-Q546 VanDerWaalsContact O-CG 3.26Å; D542-Q546 WeakPolarHBondContact O-CG 3.49Å; D542-Q546 PolarHBondContact O-N 3.07Å; D542-Q546 PolarHBondContact O-NE2 3.43Å; S543-Q546 PolarHBondContact O-N 2.87Å; E544-Q546 PolarHBondContact O-N 2.92Å; Q546-N549 PolarHBondContact O-N 3.14Å; Q546-V550 WeakPolarHBondContact O-CG2 3.38Å; Q546-V550 PolarHBondContact O-N 3.08Å
547	L	93.5	Very high	89.8	Confident	2 Å²	2	40 Å²	40	1%	0.01	21%	0.214	C	C	.	.	H	α-helix	trans	-66.4	-39.3	173.2	-65.8	166.3	0	0	0	111.2	L314 I317 S543 E544 V550 L551	L314-L547 HydrophobicContact CB-CD2 4.17Å; L314-L547 HydrophobicContact CD2-CD2 3.71Å; I317-L547 HydrophobicContact CB-CD2 4.1Å; I317-L547 HydrophobicContact CG2-CD2 3.75Å; S543-L547 WeakPolarHBondContact O-CD1 3.3Å; S543-L547 VanDerWaalsContact O-CG 3.23Å; S543-L547 WeakPolarHBondContact O-CG 3.39Å; S543-L547 PolarHBondContact O-N 2.97Å; E544-L547 PolarHBondContact O-N 2.97Å; L547-V550 PolarHBondContact O-N 3.45Å; L547-L551 VanDerWaalsContact O-CB 3.31Å; L547-L551 WeakPolarHBondContact O-CB 3.27Å; L547-L551 WeakPolarHBondContact O-CD1 3.28Å; L547-L551 VanDerWaalsContact O-CG 3.22Å; L547-L551 WeakPolarHBondContact O-CG 3.01Å; L547-L551 PolarHBondContact O-N 3.24Å
548	V	93.3	Very high	89.4	Confident	14 Å²	14	40.7 Å²	40.7	9%	0.085	22%	0.217	C	C	.	.	H	α-helix	trans	-59.9	-44.1	172	168.6	0	0	0	0	111.2	T422 H425 K426 E544 A545 L551 T552	T422-V548 HydrophobicContact CG2-CG1 4.49Å; H425-V548 HydrophobicContact CB-CG2 3.82Å; K426-V548 HydrophobicContact CB-CG2 3.97Å; K426-V548 VanDerWaalsContact N-CG2 3.31Å; E544-V548 VanDerWaalsContact O-CG2 3.31Å; E544-V548 WeakPolarHBondContact O-CG2 3.42Å; E544-V548 PolarHBondContact O-N 3.06Å; A545-V548 PolarHBondContact O-N 2.98Å; V548-L551 PolarHBondContact O-N 3.02Å; V548-T552 VanDerWaalsContact O-CB 3.29Å; V548-T552 WeakPolarHBondContact O-CB 3.17Å; V548-T552 PolarHBondContact O-N 2.8Å; V548-T552 PolarHBondContact O-OG1 3.18Å
549	N	92.8	Very high	88.4	Confident	110 Å²	110	42.5 Å²	42.5	59%	0.588	23%	0.227	S	C	*	.	H	α-helix	trans	-62	-48.5	177.2	-71.5	-19	0	0	0	112	A545 Q546 L551 T552 D553	A545-N549 PolarHBondContact O-N 3.17Å; Q546-N549 PolarHBondContact O-N 3.14Å; N549-L551 VanDerWaalsContact C-N 3.32Å; N549-L551 PolarHBondContact O-N 3.38Å; N549-T552 PolarHBondContact O-N 3.38Å; N549-D553 PolarHBondContact O-N 3.28Å
550	V	91.8	Very high	87.3	Confident	54 Å²	54	49.5 Å²	49.5	33%	0.327	25%	0.253	S	S	.	.	H	α-helix	trans	-62.4	-38.5	178.3	170.5	0	0	0	0	111.9	I317 L408 Q546 L547 A554	I317-V550 HydrophobicContact CD1-CG1 4.14Å; L408-V550 HydrophobicContact CD1-CG1 3.81Å; L408-V550 HydrophobicContact CG-CG1 4.35Å; Q546-V550 WeakPolarHBondContact O-CG2 3.38Å; Q546-V550 PolarHBondContact O-N 3.08Å; L547-V550 PolarHBondContact O-N 3.45Å; V550-A554 PolarHBondContact O-N 3.41Å
551	L	92.7	Very high	86.1	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-73.1	-31.6	175.9	-71.3	164.6	0	0	0	112.6	L314 L408 L418 L421 T422 H425 L547 V548 N549 A554 Q555	L314-L551 HydrophobicContact CD1-CD1 4.49Å; L314-L551 HydrophobicContact CD1-CD2 4.21Å; L314-L551 HydrophobicContact CD2-CD1 4.2Å; L314-L551 HydrophobicContact CD2-CD2 4.07Å; L314-L551 HydrophobicContact CD2-CG 4Å; L408-L551 HydrophobicContact CD1-CD2 3.84Å; L418-L551 HydrophobicContact CD2-CD2 3.74Å; L421-L551 HydrophobicContact CB-CD1 3.96Å; L421-L551 HydrophobicContact CB-CD2 4.1Å; T422-L551 HydrophobicContact CG2-CB 4.49Å; T422-L551 VanDerWaalsContact OG1-CB 3.31Å; T422-L551 WeakPolarHBondContact OG1-CB 3.45Å; H425-L551 HydrophobicContact CB-CD1 4.41Å; L547-L551 VanDerWaalsContact O-CB 3.31Å; L547-L551 WeakPolarHBondContact O-CB 3.27Å; L547-L551 WeakPolarHBondContact O-CD1 3.28Å; L547-L551 VanDerWaalsContact O-CG 3.22Å; L547-L551 WeakPolarHBondContact O-CG 3.01Å; L547-L551 PolarHBondContact O-N 3.24Å; V548-L551 PolarHBondContact O-N 3.02Å; N549-L551 VanDerWaalsContact C-N 3.32Å; N549-L551 PolarHBondContact O-N 3.38Å; L551-A554 WeakPolarHBondContact O-CB 3.47Å; L551-A554 PolarHBondContact O-N 3.02Å; L551-Q555 WeakPolarHBondContact O-CG 3.34Å; L551-Q555 PolarHBondContact O-N 2.82Å
552	T	90.1	Very high	84.7	Confident	52 Å²	52	54 Å²	54	32%	0.319	28%	0.279	S	S	.	.	H	α-helix	trans	-70.5	-39.8	176.6	-56.4	0	0	0	0	111.5	V548 N549 A554 Q555 C556	V548-T552 VanDerWaalsContact O-CB 3.29Å; V548-T552 WeakPolarHBondContact O-CB 3.17Å; V548-T552 PolarHBondContact O-N 2.8Å; V548-T552 PolarHBondContact O-OG1 3.18Å; N549-T552 PolarHBondContact O-N 3.38Å; T552-A554 VanDerWaalsContact C-N 3.3Å; T552-A554 PolarHBondContact O-N 3.33Å; T552-Q555 WeakPolarHBondContact O-CB 3.35Å; T552-Q555 PolarHBondContact O-N 3.17Å; T552-C556 PolarHBondContact O-N 3.4Å; T552-C556 PolarHBondContact O-SG 3.06Å; T552-C556 VanDerWaalsContact O-SG 3.39Å
553	D	89.3	Confident	82.7	Confident	84 Å²	84	55.4 Å²	55.4	45%	0.449	29%	0.287	S	S	.	.	H	α-helix	trans	-56.1	-46.7	168.4	172.3	73.2	0	0	0	111.3	N549 Q555 C556 R557	N549-D553 PolarHBondContact O-N 3.28Å; D553-Q555 VanDerWaalsContact C-N 3.29Å; D553-Q555 PolarHBondContact O-N 3.17Å; D553-C556 PolarHBondContact O-N 3.18Å; D553-C556 VanDerWaalsContact O-N 3.13Å; D553-R557 WeakPolarHBondContact O-CG 3.44Å; D553-R557 PolarHBondContact O-N 2.96Å; D553-R557 WeakPolarHBondContact OD2-CD 2.99Å; D553-R557 IonicContact OD2-NH1 3.54Å; D553-R557 PolarHBondContact OD2-NH1 3.44Å
554	A	88.3	Confident	81.1	Confident	1 Å²	1	60.4 Å²	60.4	1%	0.008	31%	0.308	C	S	.	.	H	α-helix	trans	-60.1	-36.7	178.1	0	0	0	0	0	112.5	L408 V410 L418 V550 L551 T552 L558	L408-A554 HydrophobicContact CD1-CB 3.99Å; V410-A554 VanDerWaalsContact CG1-O 3.27Å; V410-A554 WeakPolarHBondContact CG1-O 3.39Å; V410-A554 HydrophobicContact CG2-CB 3.74Å; L418-A554 HydrophobicContact CD1-CB 4.16Å; L418-A554 HydrophobicContact CD2-CB 4.16Å; V550-A554 PolarHBondContact O-N 3.41Å; L551-A554 WeakPolarHBondContact O-CB 3.47Å; L551-A554 PolarHBondContact O-N 3.02Å; T552-A554 VanDerWaalsContact C-N 3.3Å; T552-A554 PolarHBondContact O-N 3.33Å; A554-L558 PolarHBondContact O-N 3.34Å; A554-L558 VanDerWaalsContact O-N 3.12Å
555	Q	85.2	Confident	79.2	Confident	49 Å²	49	65.4 Å²	65.4	23%	0.229	34%	0.335	C	S	.	.	H	α-helix	trans	-67.3	-45.2	171.3	-70.3	-177.3	1.1	0	0	113	T422 L551 T552 D553 R557 L558 N559	T422-Q555 PolarHBondContact OG1-NE2 3.08Å; L551-Q555 WeakPolarHBondContact O-CG 3.34Å; L551-Q555 PolarHBondContact O-N 2.82Å; T552-Q555 WeakPolarHBondContact O-CB 3.35Å; T552-Q555 PolarHBondContact O-N 3.17Å; D553-Q555 VanDerWaalsContact C-N 3.29Å; D553-Q555 PolarHBondContact O-N 3.17Å; Q555-R557 PolarHBondContact O-N 2.76Å; Q555-L558 WeakPolarHBondContact O-CB 2.74Å; Q555-L558 PolarHBondContact O-N 2.81Å; Q555-L558 VanDerWaalsContact O-N 3.08Å; Q555-N559 PolarHBondContact O-N 3.21Å
556	C	83.8	Confident	76.8	Confident	77 Å²	77	71.7 Å²	71.7	52%	0.52	37%	0.365	S	S	.	.	H	α-helix	trans	-58.7	-39.6	177.8	-71	0	0	0	0	111.5	T552 D553 N559 W560	T552-C556 PolarHBondContact O-N 3.4Å; T552-C556 PolarHBondContact O-SG 3.06Å; T552-C556 VanDerWaalsContact O-SG 3.39Å; D553-C556 PolarHBondContact O-N 3.18Å; D553-C556 VanDerWaalsContact O-N 3.13Å; C556-N559 PolarHBondContact O-N 3.3Å; C556-W560 PolarHBondContact O-N 3.03Å
557	R	82.4	Confident	74.5	Confident	115 Å²	115	73.2 Å²	73.2	43%	0.434	38%	0.38	S	S	.	.	H	α-helix	trans	-68.2	-33.4	175	-70.2	166.5	60.5	-161.1	-4.6	113	V410 D553 Q555 L561	V410-R557 HydrophobicContact CG1-CB 4.3Å; D553-R557 WeakPolarHBondContact O-CG 3.44Å; D553-R557 PolarHBondContact O-N 2.96Å; D553-R557 WeakPolarHBondContact OD2-CD 2.99Å; D553-R557 IonicContact OD2-NH1 3.54Å; D553-R557 PolarHBondContact OD2-NH1 3.44Å; Q555-R557 PolarHBondContact O-N 2.76Å; R557-L561 WeakPolarHBondContact O-CG 3.07Å; R557-L561 PolarHBondContact O-N 2.84Å
558	L	78.6	Confident	71.7	Confident	18 Å²	18	80 Å²	80	9%	0.094	42%	0.416	C	S	.	.	H	α-helix	trans	-64.1	-49.5	172.9	-170.8	77.4	0	0	0	111.2	V410 G415 A554 Q555 W560 L561 S562	V410-L558 HydrophobicContact CG1-CB 3.78Å; V410-L558 HydrophobicContact CG1-CD1 3.96Å; G415-L558 VanDerWaalsContact CA-CD2 3.47Å; A554-L558 PolarHBondContact O-N 3.34Å; A554-L558 VanDerWaalsContact O-N 3.12Å; Q555-L558 WeakPolarHBondContact O-CB 2.74Å; Q555-L558 PolarHBondContact O-N 2.81Å; Q555-L558 VanDerWaalsContact O-N 3.08Å; L558-W560 PolarHBondContact O-N 3.41Å; L558-L561 WeakPolarHBondContact O-CB 3.26Å; L558-L561 PolarHBondContact O-N 3.01Å; L558-S562 PolarHBondContact O-N 2.99Å; L558-S562 PolarHBondContact O-OG 3.48Å
559	N	70.1	Confident	68.8	Low	99 Å²	99	86.4 Å²	86.4	53%	0.529	45%	0.45	S	S	.	.	H	α-helix	trans	-58.4	-36.4	179.8	-71.1	-14.6	0	0	0	112.2	Q555 C556 S562 L563	Q555-N559 PolarHBondContact O-N 3.21Å; C556-N559 PolarHBondContact O-N 3.3Å; N559-S562 PolarHBondContact O-N 3.49Å; N559-L563 WeakPolarHBondContact O-CG 3.44Å; N559-L563 PolarHBondContact O-N 2.84Å
560	W	67	Low	65.8	Low	152 Å²	152	85.5 Å²	85.5	58%	0.576	45%	0.452	S	S	*	.	H	α-helix	trans	-68	-34.1	175.3	-173.1	81.5	0	0	0	113.5	C556 L558 K564	C556-W560 PolarHBondContact O-N 3.03Å; L558-W560 PolarHBondContact O-N 3.41Å; W560-K564 HydrophobicContact CD2-CD 4.5Å; W560-K564 HydrophobicContact CE3-CD 4.29Å; W560-K564 HydrophobicContact CH2-CD 4.17Å; W560-K564 HydrophobicContact CZ2-CD 4.28Å; W560-K564 VanDerWaalsContact CZ2-CE 3.48Å; W560-K564 HydrophobicContact CZ3-CD 4.13Å; W560-K564 PolarHBondContact O-N 3.24Å
561	L	63.1	Low	62.8	Low	67 Å²	67	89.1 Å²	89.1	35%	0.351	47%	0.474	S	S	.	.	H	α-helix	trans	-66.7	-45.6	172.5	-71.2	163.4	0	0	0	111	V410 R557 L558 L563 K564 L565	V410-L561 HydrophobicContact CG1-CD1 4.27Å; R557-L561 WeakPolarHBondContact O-CG 3.07Å; R557-L561 PolarHBondContact O-N 2.84Å; L558-L561 WeakPolarHBondContact O-CB 3.26Å; L558-L561 PolarHBondContact O-N 3.01Å; L561-L563 VanDerWaalsContact C-N 3.35Å; L561-L563 PolarHBondContact O-N 2.78Å; L561-K564 PolarHBondContact O-N 3.02Å; L561-L565 PolarHBondContact O-N 3.25Å
562	S	59.7	Low	59.8	Low	48 Å²	48	95.1 Å²	95.1	34%	0.336	51%	0.511	S	S	.	.	H	α-helix	trans	-61.2	-41.3	176.8	-51	0	0	0	0	112.4	L558 N559 K564 L565 L566	L558-S562 PolarHBondContact O-N 2.99Å; L558-S562 PolarHBondContact O-OG 3.48Å; N559-S562 PolarHBondContact O-N 3.49Å; S562-K564 VanDerWaalsContact C-N 3.34Å; S562-K564 PolarHBondContact O-N 2.74Å; S562-L565 PolarHBondContact O-N 2.84Å; S562-L566 PolarHBondContact O-N 2.91Å
563	L	50.3	Low	56.9	Low	110 Å²	110	97.9 Å²	97.9	58%	0.576	53%	0.533	S	S	*	.	H	α-helix	trans	-61.9	-38.5	175.6	-76.1	167.7	0	0	0	112.6	N559 L561 L565 L566	N559-L563 WeakPolarHBondContact O-CG 3.44Å; N559-L563 PolarHBondContact O-N 2.84Å; L561-L563 VanDerWaalsContact C-N 3.35Å; L561-L563 PolarHBondContact O-N 2.78Å; L563-L565 VanDerWaalsContact C-N 3.35Å; L563-L565 PolarHBondContact O-N 3.24Å; L563-L566 PolarHBondContact O-N 3.08Å
564	K	54.5	Low	53.8	Low	108 Å²	108	104.2 Å²	104.2	47%	0.47	55%	0.552	S	S	.	*	H	α-helix	trans	-67.1	-30.8	177	-89.4	-174.4	164.8	-174.9	0	114.2	W560 L561 S562 L566 T567	W560-K564 HydrophobicContact CD2-CD 4.5Å; W560-K564 HydrophobicContact CE3-CD 4.29Å; W560-K564 HydrophobicContact CH2-CD 4.17Å; W560-K564 HydrophobicContact CZ2-CD 4.28Å; W560-K564 VanDerWaalsContact CZ2-CE 3.48Å; W560-K564 HydrophobicContact CZ3-CD 4.13Å; W560-K564 PolarHBondContact O-N 3.24Å; L561-K564 PolarHBondContact O-N 3.02Å; S562-K564 VanDerWaalsContact C-N 3.34Å; S562-K564 PolarHBondContact O-N 2.74Å; K564-L566 VanDerWaalsContact C-N 3.32Å; K564-T567 PolarHBondContact O-OG1 3.37Å; K564-T567 VanDerWaalsContact O-OG1 3.06Å
565	L	51.4	Low	50.9	Low	125 Å²	125	109.2 Å²	109.2	65%	0.654	58%	0.584	S	S	*	*	H	α-helix	trans	-71.5	-30.4	176.7	-69.9	167	0	0	0	111.7	L561 S562 L563 T567	L561-L565 PolarHBondContact O-N 3.25Å; S562-L565 PolarHBondContact O-N 2.84Å; L563-L565 VanDerWaalsContact C-N 3.35Å; L563-L565 PolarHBondContact O-N 3.24Å; L565-T567 VanDerWaalsContact C-N 3.35Å
566	L	42.2	Very low	48.2	Very low	147 Å²	147	114.2 Å²	114.2	77%	0.77	61%	0.612	S	S	*	*	H	α-helix	trans	-77	-14.4	179	-72.5	163.9	0	0	0	114.3	S562 L563 K564	S562-L566 PolarHBondContact O-N 2.91Å; L563-L566 PolarHBondContact O-N 3.08Å; K564-L566 VanDerWaalsContact C-N 3.32Å
567	T	45	Very low	45.5	Very low	105 Å²	105	116.6 Å²	116.6	64%	0.644	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.8	-5.6	-175.7	50.4	0	0	0	0	115.5	K564 L565 D569	K564-T567 PolarHBondContact O-OG1 3.37Å; K564-T567 VanDerWaalsContact O-OG1 3.06Å; L565-T567 VanDerWaalsContact C-N 3.35Å; T567-D569 PolarHBondContact O-N 3.31Å
568	N	34.9	Very low	42.8	Very low	144 Å²	144	117.5 Å²	117.5	77%	0.77	64%	0.643	S	S	*	*			trans	-100.4	77.6	-176.1	-78.8	0.8	0	0	0	111.8
569	D	31.7	Very low	40.4	Very low	149 Å²	149	122 Å²	122	80%	0.797	67%	0.673	S	S	*	*			trans	-90.1	149.5	177.3	-149.3	-16	0	0	0	112.4	T567	T567-D569 PolarHBondContact O-N 3.31Å
570	S	29.1	Very low	38.4	Very low	92 Å²	92	124 Å²	124	64%	0.643	68%	0.682	S	S	*	*	S	Bend	trans	62.3	107.1	170.3	69.1	0	0	0	0	121.1
571	T	28.9	Very low	36.4	Very low	129 Å²	129	123.2 Å²	123.2	79%	0.791	70%	0.695	S	S	*	*			trans	80.6	148	140.1	68.2	0	0	0	0	122.5
572	T	30.1	Very low	34.7	Very low	126 Å²	126	129.4 Å²	129.4	77%	0.773	72%	0.719	S	S	*	*			trans	79.2	106.2	169.3	67.4	0	0	0	0	119.9
573	S	29.6	Very low	33	Very low	110 Å²	110	131.9 Å²	131.9	77%	0.769	74%	0.736	S	S	*	*			trans	38.4	111.4	144.2	55.7	0	0	0	0	121.7
574	Y	23.6	Very low	32	Very low	218 Å²	218	138.2 Å²	138.2	86%	0.855	75%	0.753	S	S	*	*			trans	-48.9	148.8	141.6	-76.6	-78.2	0	0	0	111.3
575	P	28.4	Very low	30.5	Very low	106 Å²	106	139.6 Å²	139.6	69%	0.688	77%	0.765	S	S	*	*			cis	-139.6	179.3	49.7	41.5	-24.3	0	0	0	117.8
576	N	28.3	Very low	29.5	Very low	153 Å²	153	139.7 Å²	139.7	82%	0.818	77%	0.774	S	S	*	*			trans	68.9	96.8	167.9	-64.3	-9.9	0	0	0	117.6	T578	N576-T578 PolarHBondContact O-N 2.73Å
577	T	25.7	Very low	28.7	Very low	128 Å²	128	137.7 Å²	137.7	79%	0.785	77%	0.77	S	S	*	*			trans	-76.4	106.3	173.3	47.4	0	0	0	0	113.2
578	T	26.2	Very low	27.8	Very low	134 Å²	134	139.8 Å²	139.8	82%	0.822	78%	0.778	S	S	*	*			trans	-141.8	124.4	142.1	45.5	0	0	0	0	108.4	N576	N576-T578 PolarHBondContact O-N 2.73Å
579	P	28.5	Very low	27.5	Very low	111 Å²	111	141 Å²	141	72%	0.721	78%	0.782	S	S	*	*			trans	-146.5	137.4	133.2	27	-7.3	0	0	0	115.6
580	I	28.5	Very low	27.2	Very low	141 Å²	141	140.1 Å²	140.1	72%	0.723	78%	0.783	S	S	*	*			trans	68.5	101.3	143	-56.6	166.6	0	0	0	117.2	F582	I580-F582 HydrophobicContact CG2-CD2 3.64Å; I580-F582 HydrophobicContact CG2-CE2 3.64Å
581	T	25.1	Very low	26.9	Very low	136 Å²	136	142.3 Å²	142.3	83%	0.834	79%	0.792	S	S	*	*			trans	-72.6	147.1	153.4	40.5	0	0	0	0	111.3
582	F	26	Very low	26.9	Very low	198 Å²	198	143 Å²	143	87%	0.868	80%	0.796	S	S	*	*			trans	-131.4	110.4	153.1	-94.5	-79.8	0	0	0	108.5	I580	I580-F582 HydrophobicContact CG2-CD2 3.64Å; I580-F582 HydrophobicContact CG2-CE2 3.64Å
583	S	25.2	Very low	26.6	Very low	99 Å²	99	143 Å²	143	69%	0.692	80%	0.796	S	S	*	*			trans	-98.2	138.7	167.7	-170.9	0	0	0	0	109.3
584	R	28.3	Very low	26.6	Very low	243 Å²	243	143.9 Å²	143.9	92%	0.917	80%	0.798	S	S	*	*			trans	-161.3	118.9	158.5	-114.1	174	-174.9	-178.9	0.3	109.3
585	D	24.6	Very low	26.6	Very low	138 Å²	138	139 Å²	139	74%	0.738	79%	0.79	S	S	*	*			trans	-66	167.6	171.3	-46.2	-88	0	0	0	110.9
586	P	29.5	Very low	26.6	Very low	127 Å²	127	141 Å²	141	83%	0.825	79%	0.794	S	S	*	*				-137.2	125.8	110.2	34.5	-23.2	0	0	0	114
587	C	25.4	Very low	26.6	Very low	104 Å²	104	138.9 Å²	138.9	70%	0.703	79%	0.787	S	S	*	*			trans	-89.1	171.1	143.7	-77.9	0	0	0	0	109.6
588	D	25.2	Very low	26.8	Very low	150 Å²	150	140.4 Å²	140.4	80%	0.802	79%	0.79	S	S	*	*			trans	60.5	85.2	157.9	-52.5	-22	0	0	0	118.2
589	I	28.7	Very low	27	Very low	168 Å²	168	137.8 Å²	137.8	86%	0.862	79%	0.79	S	S	*	*			trans	-130.2	99.9	133.5	-56.5	-177.7	0	0	0	109.2
590	T	25.6	Very low	27	Very low	131 Å²	131	140.6 Å²	140.6	80%	0.804	80%	0.799	S	S	*	*			trans	-99.5	149.4	148.7	42.4	0	0	0	0	108.8
591	T	24.2	Very low	27.2	Very low	138 Å²	138	138.3 Å²	138.3	85%	0.847	80%	0.795	S	S	*	*			trans	-73.3	135	-171.2	24.8	0	0	0	0	113.2
592	T	28.3	Very low	27.5	Very low	143 Å²	143	138.6 Å²	138.6	88%	0.877	79%	0.792	S	S	*	*			trans	-143.2	138.5	154.7	-34.4	0	0	0	0	111.1
593	T	23.7	Very low	27.9	Very low	126 Å²	126	135.6 Å²	135.6	77%	0.773	79%	0.785	S	S	*	*			trans	-83.2	136.8	-171.4	-42.4	0	0	0	0	112.8
594	T	28.7	Very low	28.2	Very low	130 Å²	130	136.6 Å²	136.6	80%	0.798	78%	0.782	S	S	*	*				-173	129.2	124.5	19.6	0	0	0	0	114.3
595	T	24.1	Very low	28.4	Very low	114 Å²	114	131 Å²	131	70%	0.699	77%	0.771	S	S	*	*			trans	-4.4	139.9	149.1	56.8	0	0	0	0	120.4
596	I	28.9	Very low	28.8	Very low	148 Å²	148	130.9 Å²	130.9	76%	0.759	77%	0.765	S	S	*	*				-174.5	119.5	107.1	-95.7	162.4	0	0	0	113.3
597	T	28.6	Very low	29	Very low	109 Å²	109	131.9 Å²	131.9	67%	0.669	76%	0.759	S	S	*	*			trans	48.3	133.4	151.7	66.1	0	0	0	0	124.4
598	N	29.9	Very low	29.4	Very low	161 Å²	161	133 Å²	133	86%	0.861	76%	0.758	S	S	*	*			trans	68.8	133.7	140.4	-57.7	-5.9	0	0	0	119.4
599	G	29.6	Very low	29.7	Very low	79 Å²	79	132.9 Å²	132.9	81%	0.814	76%	0.756	S	S	*	*			cis	171.4	133.3	-6.3	0	0	0	0	0	111.1
600	N	28.4	Very low	29.7	Very low	169 Å²	169	131.5 Å²	131.5	90%	0.904	75%	0.75	S	S	*	*			trans	-115.7	140.5	-178.5	-158.5	13.8	0	0	0	110.3
601	S	32.4	Very low	30.1	Very low	94 Å²	94	131 Å²	131	66%	0.657	74%	0.742	S	S	*	*			trans	-101.2	126.4	-163.4	62.5	0	0	0	0	114.9
602	N	32.5	Very low	30.3	Very low	141 Å²	141	132 Å²	132	75%	0.754	74%	0.736	S	S	*	*			trans	81.7	142.9	142.5	-61.7	1.2	0	0	0	120.9
603	N	33.3	Very low	30.4	Very low	136 Å²	136	132.2 Å²	132.2	73%	0.727	73%	0.732	S	S	*	*			trans	77.3	125.5	162.7	-53.4	-15.6	0	0	0	117.8
604	N	32.7	Very low	30.6	Very low	119 Å²	119	129.4 Å²	129.4	64%	0.636	73%	0.728	S	S	*	*			cis	-164.3	143.9	-10.1	-110.2	-12.3	0	0	0	110.6
605	N	32.6	Very low	30.6	Very low	126 Å²	126	129.4 Å²	129.4	67%	0.674	73%	0.728	S	S	*	*			trans	66.1	148.3	147	-61.1	8.5	0	0	0	119
606	H	33.4	Very low	30.7	Very low	135 Å²	135	131 Å²	131	63%	0.625	73%	0.733	S	S	*	*			cis	-157.3	151.1	-6.7	-118.4	-70.7	0	0	0	108.5
607	E	33.4	Very low	30.7	Very low	149 Å²	149	131 Å²	131	70%	0.696	73%	0.734	S	S	*	*			trans	59.3	149.6	146	-74.7	156.1	-154.6	0	0	122
608	D	32.8	Very low	30.6	Very low	127 Å²	127	131 Å²	131	68%	0.679	73%	0.73	S	S	*	*			cis	-172.9	155.9	-31.1	-118	5.3	0	0	0	110.9
609	I	32.6	Very low	30.5	Very low	148 Å²	148	128.6 Å²	128.6	76%	0.759	73%	0.725	S	S	*	*			trans	59.4	145	143.6	-66.1	167.6	0	0	0	120
610	D	28.8	Very low	30.3	Very low	138 Å²	138	126.6 Å²	126.6	74%	0.738	70%	0.698	S	S	*	*			cis	-177	-176.6	-23.9	-167.7	3.3	0	0	0	107.9
611	I	32.2	Very low	30.2	Very low	122 Å²	122	126.7 Å²	126.7	63%	0.626	69%	0.693	S	S	*	*			trans	86.7	100	152.7	-62.9	158	0	0	0	120.6
612	Q	30.2	Very low	29.9	Very low	158 Å²	158	126.2 Å²	126.2	74%	0.738	70%	0.695	S	S	*	*				72	132.3	128.2	-66	-177.8	19.9	0	0	126.3
613	N	29.9	Very low	29.6	Very low	147 Å²	147	126.7 Å²	126.7	79%	0.786	70%	0.697	S	S	*	*			trans	70.1	117.5	138.2	-60.1	-16.8	0	0	0	123.2
614	G	27.6	Very low	29.4	Very low	67 Å²	67	127.2 Å²	127.2	69%	0.691	70%	0.7	S	S	*	*				120.7	89.9	119.8	0	0	0	0	0	120.9
615	T	28.1	Very low	29.2	Very low	130 Å²	130	124.9 Å²	124.9	80%	0.798	70%	0.704	S	S	*	*			trans	62.5	140.3	148.3	41.1	0	0	0	0	122.4
616	D	26.9	Very low	29	Very low	149 Å²	149	128 Å²	128	80%	0.797	71%	0.714	S	S	*	*			trans	79.8	139.8	157.4	-54.4	-15.2	0	0	0	121.8
617	D	28.5	Very low	28.7	Very low	146 Å²	146	127.9 Å²	127.9	78%	0.781	72%	0.718	S	S	*	*			trans	62.2	130.4	166.7	-75.4	-4.7	0	0	0	124.9
618	N	26.6	Very low	28.5	Very low	109 Å²	109	128.8 Å²	128.8	58%	0.583	73%	0.727	S	S	*	*			trans	57	92.9	144.9	-63.9	-41.4	0	0	0	122.7
619	C	27.2	Very low	28.1	Very low	112 Å²	112	127.7 Å²	127.7	76%	0.757	73%	0.73	S	S	*	*			trans	-163	142.6	141.8	-116.2	0	0	0	0	109.1
620	S	26	Very low	27.9	Very low	37 Å²	37	128.5 Å²	128.5	26%	0.259	73%	0.734	S	S	.	*			cis	92.7	124	21.4	-62.5	0	0	0	0	116.9	I725	S620-I725 WeakPolarHBondContact OG-CG2 3.21Å
621	Q	25.7	Very low	27.8	Very low	170 Å²	170	126.8 Å²	126.8	79%	0.794	73%	0.73	S	S	*	*			trans	78	170.6	162.3	-60.7	-171.3	-5.7	0	0	120.7	I725	Q621-I725 HydrophobicContact CG-CD1 4.17Å
622	A	26.9	Very low	27.4	Very low	84 Å²	84	129 Å²	129	69%	0.694	74%	0.743	S	S	*	*			trans	69.2	143.6	-169.9	0	0	0	0	0	115.3
623	L	26.3	Very low	27.2	Very low	152 Å²	152	127 Å²	127	80%	0.796	74%	0.744	S	S	*	*			cis	-122.1	132	10.6	-69.3	160.2	0	0	0	110.1
624	N	28.1	Very low	27	Very low	147 Å²	147	127.4 Å²	127.4	79%	0.786	75%	0.746	S	S	*	*				57.9	125.6	90.9	-53.5	-2.1	0	0	0	114.3
625	G	28.7	Very low	27	Very low	70 Å²	70	132.6 Å²	132.6	72%	0.722	76%	0.758	S	S	*	*			cis	160.5	167.5	-6.8	0	0	0	0	0	112.4
626	H	29.2	Very low	26.8	Very low	192 Å²	192	130.6 Å²	130.6	89%	0.889	75%	0.749	S	S	*	*			trans	-163.1	135.8	142.1	-123.7	-52.5	0	0	0	110.9
627	D	27.1	Very low	27	Very low	132 Å²	132	130 Å²	130	71%	0.706	75%	0.745	S	S	*	*			trans	-77	153.6	-175.7	-52.6	-91.7	0	0	0	114.3
628	N	29	Very low	26.8	Very low	168 Å²	168	127.6 Å²	127.6	90%	0.898	74%	0.74	S	S	*	*				-159	104.4	124.2	-102.3	-47.5	0	0	0	110
629	S	25.5	Very low	26.9	Very low	104 Å²	104	133 Å²	133	73%	0.727	75%	0.754	S	S	*	*			trans	-92.9	136.9	174.6	52.7	0	0	0	0	110.9
630	I	28.1	Very low	26.8	Very low	164 Å²	164	133 Å²	133	84%	0.841	76%	0.756	S	S	*	*			trans	-130.4	124.9	158.1	-61.1	-176.5	0	0	0	106.1
631	P	26.5	Very low	27	Very low	102 Å²	102	137.6 Å²	137.6	66%	0.662	78%	0.782	S	S	*	*			trans	-85.9	160.3	-161.5	33.1	-36.9	0	0	0	114.2
632	L	23.3	Very low	27	Very low	170 Å²	170	137.1 Å²	137.1	89%	0.89	79%	0.785	S	S	*	*			trans	-68.1	126.3	160.9	-125.5	74.2	0	0	0	109.3
633	C	27.2	Very low	27.3	Very low	114 Å²	114	138.3 Å²	138.3	77%	0.77	79%	0.786	S	S	*	*			trans	-114.5	131.2	166.1	-78.6	0	0	0	0	109.8
634	N	25.1	Very low	27.2	Very low	156 Å²	156	135.6 Å²	135.6	83%	0.834	78%	0.777	S	S	*	*			trans	-71.9	131.9	172.6	-66	-39	0	0	0	110.2
635	L	28	Very low	27.1	Very low	177 Å²	177	138.4 Å²	138.4	93%	0.927	78%	0.783	S	S	*	*			trans	-137.3	110.5	147.9	-90.1	176.5	0	0	0	108.8
636	S	24	Very low	26.9	Very low	88 Å²	88	143 Å²	143	62%	0.615	78%	0.783	S	S	*	*			trans	-79.8	-178.9	161.4	47.3	0	0	0	0	110.5
637	D	29.5	Very low	26.7	Very low	135 Å²	135	139.1 Å²	139.1	72%	0.722	77%	0.767	S	S	*	*			trans	82.7	89.5	157.4	-48.1	-45.7	0	0	0	118.6
638	S	26	Very low	26.5	Very low	96 Å²	96	141.9 Å²	141.9	67%	0.671	78%	0.776	S	S	*	*			trans	50.4	102.4	130.6	63.9	0	0	0	0	120.5
639	Y	28.4	Very low	26.3	Very low	223 Å²	223	141.5 Å²	141.5	88%	0.875	77%	0.769	S	S	*	*				-166.1	114.7	126.9	-84.4	-68.5	0	0	0	105.7
640	S	25.3	Very low	26.3	Very low	113 Å²	113	144.3 Å²	144.3	79%	0.79	77%	0.774	S	S	*	*			cis	73.9	46.1	46	-165.1	0	0	0	0	115.6
641	T	29.9	Very low	26	Very low	133 Å²	133	140.3 Å²	140.3	82%	0.816	76%	0.761	S	S	*	*			trans	-146.8	113.5	158.8	48	0	0	0	0	112
642	D	25.2	Very low	25.8	Very low	159 Å²	159	142.9 Å²	142.9	85%	0.85	77%	0.769	S	S	*	*			trans	-79.3	166.2	157.9	-70	-62.4	0	0	0	110.6
643	P	33.1	Very low	26	Very low	110 Å²	110	139.8 Å²	139.8	71%	0.714	76%	0.761	S	S	*	*			cis	-124.7	-164.3	-38.7	34.9	-16.9	0	0	0	109.7
644	P	24.5	Very low	25.9	Very low	95 Å²	95	139.4 Å²	139.4	62%	0.617	76%	0.758	S	S	*	*				-142.5	156.9	92.2	39.2	-26.8	0	0	0	114.6	F646	P644-F646 HydrophobicContact CB-CD2 4.03Å; P644-F646 HydrophobicContact CG-CD2 3.77Å; P644-F646 HydrophobicContact CG-CE2 4.4Å; P644-F646 PolarHBondContact O-N 2.8Å
645	K	25.2	Very low	25.7	Very low	206 Å²	206	140.5 Å²	140.5	90%	0.896	76%	0.755	S	S	*	*			trans	-67.9	116.5	154.6	-67.5	-177.3	-179	-176.1	0	107.7
646	F	25.4	Very low	25.5	Very low	166 Å²	166	136 Å²	136	73%	0.728	74%	0.743	S	S	*	*			trans	-123.3	113.2	172.8	-118.3	-111.1	0	0	0	110.6	P644	P644-F646 HydrophobicContact CB-CD2 4.03Å; P644-F646 HydrophobicContact CG-CD2 3.77Å; P644-F646 HydrophobicContact CG-CE2 4.4Å; P644-F646 PolarHBondContact O-N 2.8Å
647	I	24.7	Very low	25.4	Very low	110 Å²	110	138.9 Å²	138.9	56%	0.564	75%	0.751	S	S	*	*			trans	65.7	84.7	155.9	-51.4	179.6	0	0	0	115.7	Q649 I650	I647-Q649 VanDerWaalsContact CG2-C 3.46Å; I647-I650 HydrophobicContact CG2-CG1 4.16Å
648	E	23.3	Very low	25	Very low	190 Å²	190	136.8 Å²	136.8	89%	0.888	75%	0.747	S	S	*	*	S	Bend		-59.8	148.8	122.4	-65.5	174.2	120.3	0	0	108
649	Q	24.1	Very low	24.9	Very low	161 Å²	161	137.8 Å²	137.8	75%	0.752	75%	0.749	S	S	*	*			trans	79.6	63.1	-178.7	-60.5	-167.3	-7.3	0	0	118.3	I647 S651	I647-Q649 VanDerWaalsContact CG2-C 3.46Å; Q649-S651 WeakPolarHBondContact O-CB 3.15Å; Q649-S651 PolarHBondContact O-OG 3.11Å
650	I	25.3	Very low	24.6	Very low	163 Å²	163	131.4 Å²	131.4	84%	0.836	74%	0.737	S	S	*	*				-99.2	69.3	126.2	-53.3	179.2	0	0	0	105.7	I647	I647-I650 HydrophobicContact CG2-CG1 4.16Å
651	S	22.1	Very low	24.5	Very low	79 Å²	79	132.9 Å²	132.9	55%	0.552	74%	0.736	S	S	*	*				57.1	130.4	65.7	73.6	0	0	0	0	114.5	Q649	Q649-S651 WeakPolarHBondContact O-CB 3.15Å; Q649-S651 PolarHBondContact O-OG 3.11Å
652	N	22.9	Very low	24.3	Very low	157 Å²	157	130.8 Å²	130.8	84%	0.84	72%	0.724	S	S	*	*	S	Bend	trans	-75.1	150.5	-169.9	-66.9	-40.8	0	0	0	112.5
653	S	27.2	Very low	24.3	Very low	104 Å²	104	127.7 Å²	127.7	73%	0.727	71%	0.714	S	S	*	*			trans	69.9	173	167.8	92.4	0	0	0	0	113.3
654	P	24.2	Very low	24	Very low	107 Å²	107	128.6 Å²	128.6	70%	0.695	71%	0.713	S	S	*	*			cis	-110.4	146.1	28.1	38.5	-30.1	0	0	0	115.9
655	F	22.5	Very low	24.1	Very low	178 Å²	178	125.5 Å²	125.5	78%	0.781	69%	0.691	S	S	*	*			trans	58.9	117.7	138.1	-74.8	-120.4	0	0	0	117.8
656	A	22	Very low	24.2	Very low	82 Å²	82	119.7 Å²	119.7	68%	0.678	68%	0.676	S	S	*	*				57.7	113.2	62	0	0	0	0	0	113.6
657	L	22.6	Very low	24.3	Very low	150 Å²	150	115.5 Å²	115.5	79%	0.785	67%	0.668	S	S	*	*				-173.9	113.3	120.2	-91.7	159	0	0	0	105
658	S	21.4	Very low	24.5	Very low	91 Å²	91	110.5 Å²	110.5	64%	0.636	64%	0.642	S	S	*	*				54.3	128.4	103.1	82	0	0	0	0	113.4
659	T	22.9	Very low	24.9	Very low	116 Å²	116	105 Å²	105	71%	0.712	62%	0.618	S	S	*	*			cis	-149.5	146.1	39	49.4	0	0	0	0	114
660	S	23	Very low	25.1	Very low	89 Å²	89	102.7 Å²	102.7	62%	0.622	61%	0.607	S	S	*	*			trans	53.7	134.3	137.7	70.4	0	0	0	0	121.6
661	N	23	Very low	25.4	Very low	145 Å²	145	100.7 Å²	100.7	78%	0.775	59%	0.594	S	S	*	*			trans	64.2	97.5	143.5	-54.4	-10.9	0	0	0	117.3
662	T	25.8	Very low	25.8	Very low	89 Å²	89	100.5 Å²	100.5	55%	0.546	59%	0.585	S	S	.	*				-165.8	139.1	96.1	21.3	0	0	0	0	110.2	Y300	Y300-T662 HydrophobicContact CD2-CG2 4.16Å; Y300-T662 WeakPolarHBondContact CD2-OG1 3.31Å; Y300-T662 HydrophobicContact CE2-CG2 4.39Å; Y300-T662 WeakPolarHBondContact CE2-O 3.3Å; Y300-T662 WeakPolarHBondContact CE2-OG1 3.4Å; Y300-T662 HydrophobicContact CG-CG2 4.28Å; Y300-T662 VanDerWaalsContact CZ-O 3.26Å; Y300-T662 PolarHBondContact OH-O 3.29Å
663	S	24.6	Very low	26.1	Very low	94 Å²	94	98.9 Å²	98.9	66%	0.657	57%	0.572	S	S	*	*			trans	-106.4	148.9	-172.7	51.6	0	0	0	0	112.4	Y300	Y300-S663 WeakPolarHBondContact CE1-O 3.44Å; Y300-S663 VanDerWaalsContact CZ-C 3.5Å; Y300-S663 WeakPolarHBondContact OH-CA 3.27Å; Y300-S663 PolarHBondContact OH-N 2.81Å; Y300-S663 PolarHBondContact OH-O 3.25Å
664	D	26.2	Very low	26.2	Very low	129 Å²	129	99.8 Å²	99.8	69%	0.69	57%	0.565	S	S	*	*	S	Bend	trans	102.1	22.5	-177.1	-55.7	-19.1	0	0	0	118.3	Y300 K304	Y300-D664 HydrophobicContact CE1-CB 4.3Å; Y300-D664 PolarHBondContact OH-N 2.99Å; Y300-D664 VanDerWaalsContact OH-N 3.1Å; K304-D664 WeakPolarHBondContact CE-O 3.45Å; K304-D664 PolarHBondContact NZ-O 3.22Å
665	M	27.2	Very low	26.7	Very low	29 Å²	29	98.3 Å²	98.3	14%	0.143	55%	0.549	C	S	.	.			trans	-113.2	-27.3	-179.8	-63	-85.5	130.2	0	0	118.5	Y300 K304 S667	Y300-M665 HydrophobicContact CD1-CE 3.41Å; Y300-M665 VanDerWaalsContact CD1-CE 3.41Å; Y300-M665 HydrophobicContact CD1-CG 3.83Å; Y300-M665 HydrophobicContact CD1-SD 4.1Å; Y300-M665 HydrophobicContact CD2-CG 3.88Å; Y300-M665 HydrophobicContact CE1-CB 4.37Å; Y300-M665 HydrophobicContact CE1-CE 3.47Å; Y300-M665 VanDerWaalsContact CE1-CE 3.47Å; Y300-M665 HydrophobicContact CE1-CG 3.2Å; Y300-M665 HydrophobicContact CE1-SD 3.99Å; Y300-M665 HydrophobicContact CE2-CB 4.16Å; Y300-M665 HydrophobicContact CE2-CG 3.31Å; Y300-M665 HydrophobicContact CE2-SD 4.47Å; Y300-M665 HydrophobicContact CG-CE 4.12Å; Y300-M665 HydrophobicContact CG-CG 4.12Å; Y300-M665 HydrophobicContact CG-SD 4.35Å; Y300-M665 WeakPolarHBondContact OH-CB 3.49Å; Y300-M665 WeakPolarHBondContact OH-CG 3.47Å; Y300-M665 PolarHBondContact OH-N 3.23Å; K304-M665 HydrophobicContact CB-CE 4.27Å; K304-M665 HydrophobicContact CB-SD 3.21Å; K304-M665 WeakPolarHBondContact CB-SD 3.45Å; K304-M665 HydrophobicContact CD-CB 4.46Å; K304-M665 WeakPolarHBondContact CD-O 3.38Å; K304-M665 HydrophobicContact CD-SD 3.93Å; K304-M665 WeakPolarHBondContact CE-SD 3.45Å; K304-M665 HydrophobicContact CG-CB 4.11Å; K304-M665 HydrophobicContact CG-CG 4.27Å; K304-M665 HydrophobicContact CG-SD 3.38Å; K304-M665 WeakPolarHBondContact CG-SD 3.47Å; M665-S667 PolarHBondContact O-N 3.2Å
666	S	26.8	Very low	27	Very low	84 Å²	84	99.2 Å²	99.2	59%	0.587	55%	0.547	S	S	*	.			trans	-74.1	-24.8	-169.1	43.7	0	0	0	0	116.6	S668 I669	S666-S668 PolarHBondContact O-N 2.85Å; S666-I669 PolarHBondContact O-N 3.25Å
667	S	27.8	Very low	27.5	Very low	79 Å²	79	99.1 Å²	99.1	55%	0.552	54%	0.539	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.6	42.9	-170.1	56.7	0	0	0	0	116	M665	M665-S667 PolarHBondContact O-N 3.2Å
668	S	29.6	Very low	28.2	Very low	5 Å²	5	94.4 Å²	94.4	4%	0.035	51%	0.513	C	S	.	.	T	Hydrogen-bonded Turn	trans	-145.3	-21.4	175.5	-75	0	0	0	0	113.8	K264 S666	K264-S668 PolarHBondContact NZ-O 3.43Å; S666-S668 PolarHBondContact O-N 2.85Å
669	I	31.6	Very low	28.8	Very low	73 Å²	73	94.5 Å²	94.5	37%	0.374	50%	0.5	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.6	-38.3	-177	-50.2	-166.3	0	0	0	111.4	E311 S666 H671 Q672	E311-I669 WeakPolarHBondContact OE1-CA 3.44Å; S666-I669 PolarHBondContact O-N 3.25Å; I669-H671 PolarHBondContact O-N 3.43Å; I669-H671 VanDerWaalsContact O-N 3.14Å; I669-Q672 PolarHBondContact O-N 2.92Å
670	E	28.5	Very low	29.8	Very low	114 Å²	114	93.4 Å²	93.4	53%	0.533	49%	0.489	S	S	.	.	H	α-helix	trans	-59.2	-29.4	-179.1	-63.1	162	145.4	0	0	113	Q672 Q673 Q674	E670-Q672 PolarHBondContact O-N 3.45Å; E670-Q673 PolarHBondContact O-N 3.17Å; E670-Q673 VanDerWaalsContact O-N 3.15Å; E670-Q674 WeakPolarHBondContact O-CG 3.33Å; E670-Q674 PolarHBondContact O-N 2.97Å; E670-Q674 VanDerWaalsContact O-N 3.14Å
671	H	31.3	Very low	30.7	Very low	121 Å²	121	96.2 Å²	96.2	56%	0.56	49%	0.486	S	S	*	.	H	α-helix	trans	-67.9	-13.6	176.8	-87.9	-11.3	0	0	0	114.8	I669 Q674	I669-H671 PolarHBondContact O-N 3.43Å; I669-H671 VanDerWaalsContact O-N 3.14Å; H671-Q674 PolarHBondContact ND1-OE1 3.17Å
672	Q	30.2	Very low	31.6	Very low	74 Å²	74	90 Å²	90	35%	0.346	45%	0.453	S	S	.	.	H	α-helix	trans	-83.9	-39	166.5	-95.1	-170.9	14.5	0	0	112.1	Y261 I669 E670 Q674 Q675	Y261-Q672 HydrophobicContact CE2-CG 4.01Å; Y261-Q672 VanDerWaalsContact CE2-NE2 3.26Å; Y261-Q672 VanDerWaalsContact OH-CD 3.27Å; Y261-Q672 VanDerWaalsContact OH-CG 3.29Å; Y261-Q672 WeakPolarHBondContact OH-CG 3.38Å; Y261-Q672 PolarHBondContact OH-NE2 2.86Å; I669-Q672 PolarHBondContact O-N 2.92Å; E670-Q672 PolarHBondContact O-N 3.45Å; Q672-Q674 PolarHBondContact O-N 2.94Å; Q672-Q675 PolarHBondContact O-N 3.05Å
673	Q	29.2	Very low	32.5	Very low	124 Å²	124	89.2 Å²	89.2	58%	0.579	44%	0.44	S	S	*	.	H	α-helix	trans	-68.6	-25.8	-179.5	-57.7	-161	21.2	0	0	112.5	E670 Q675	E670-Q673 PolarHBondContact O-N 3.17Å; E670-Q673 VanDerWaalsContact O-N 3.15Å; Q673-Q675 PolarHBondContact O-N 3.37Å
674	Q	30.3	Very low	33.5	Very low	123 Å²	123	89.5 Å²	89.5	58%	0.575	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.3	-5.6	174.5	-72.3	171.1	-10.4	0	0	115	E670 H671 Q672 R676 P677	E670-Q674 WeakPolarHBondContact O-CG 3.33Å; E670-Q674 PolarHBondContact O-N 2.97Å; E670-Q674 VanDerWaalsContact O-N 3.14Å; H671-Q674 PolarHBondContact ND1-OE1 3.17Å; Q672-Q674 PolarHBondContact O-N 2.94Å; Q674-R676 VanDerWaalsContact C-N 3.34Å; Q674-P677 WeakPolarHBondContact O-CD 3.33Å
675	Q	33.5	Very low	34.3	Very low	76 Å²	76	85.1 Å²	85.1	36%	0.355	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-1.1	176.5	-66.8	-166.3	-4.1	0	0	114.9	Q672 Q673 P677 E678	Q672-Q675 PolarHBondContact O-N 3.05Å; Q673-Q675 PolarHBondContact O-N 3.37Å; Q675-P677 VanDerWaalsContact C-N 3.27Å; Q675-P677 WeakPolarHBondContact O-CD 3.41Å; Q675-P677 VanDerWaalsContact O-N 3.1Å; Q675-E678 PolarHBondContact O-N 2.94Å; Q675-E678 VanDerWaalsContact O-N 3.08Å
676	R	30.2	Very low	35	Very low	197 Å²	197	84 Å²	84	74%	0.743	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.5	-24.4	173.7	-84.9	-179.5	164.1	169.5	-4.7	117	Q674 E678	Q674-R676 VanDerWaalsContact C-N 3.34Å; R676-E678 VanDerWaalsContact C-N 3.31Å; R676-E678 PolarHBondContact O-N 2.67Å
677	P	32.6	Very low	36.1	Very low	80 Å²	80	89.4 Å²	89.4	52%	0.519	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-27.1	173.8	-24.1	35.9	0	0	0	115	Q674 Q675 N680	Q674-P677 WeakPolarHBondContact O-CD 3.33Å; Q675-P677 VanDerWaalsContact C-N 3.27Å; Q675-P677 WeakPolarHBondContact O-CD 3.41Å; Q675-P677 VanDerWaalsContact O-N 3.1Å; P677-N680 PolarHBondContact O-N 3.11Å
678	E	36.3	Very low	37.2	Very low	51 Å²	51	90.5 Å²	90.5	24%	0.238	41%	0.409	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.5	-66.9	179.6	47.7	156.7	112.2	0	0	112.2	Q253 Q675 R676 N680 R681	Q253-E678 PolarHBondContact NE2-OE2 3.41Å; Q675-E678 PolarHBondContact O-N 2.94Å; Q675-E678 VanDerWaalsContact O-N 3.08Å; R676-E678 VanDerWaalsContact C-N 3.31Å; R676-E678 PolarHBondContact O-N 2.67Å; E678-N680 PolarHBondContact O-N 2.81Å; E678-R681 HydrophobicContact CB-CG 4.45Å; E678-R681 WeakPolarHBondContact O-CB 3.39Å; E678-R681 PolarHBondContact O-N 2.96Å; E678-R681 IonicContact OE1-CZ 2.81Å; E678-R681 VanDerWaalsContact OE1-CZ 3.27Å; E678-R681 IonicContact OE1-NH1 2.72Å; E678-R681 PolarHBondContact OE1-NH1 2.68Å; E678-R681 IonicContact OE1-NH2 3.52Å
679	R	34.3	Very low	37.8	Very low	92 Å²	92	90.6 Å²	90.6	35%	0.347	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.3	-33.6	-178.7	-81.2	-172.6	-177.2	169	-0.7	113.6	H432 L540 R681	H432-R679 PolarHBondContact CE1-NH1 3.15Å; H432-R679 PolarHBondContact NE2-NH1 3.08Å; H432-R679 PolarHBondContact NE2-NH2 3.23Å; H432-R679 VanDerWaalsContact NE2-NH2 3.13Å; L540-R679 VanDerWaalsContact CD2-NH2 3.32Å; R679-R681 PolarHBondContact O-N 2.91Å
680	N	44.6	Very low	38.2	Very low	93 Å²	93	89 Å²	89	50%	0.497	40%	0.401	S	S	.	.	H	α-helix	trans	-66.3	-15.5	179.6	-90.8	-13.6	0	0	0	113.5	P677 E678 Q684	P677-N680 PolarHBondContact O-N 3.11Å; E678-N680 PolarHBondContact O-N 2.81Å; N680-Q684 WeakPolarHBondContact O-CB 3.32Å; N680-Q684 WeakPolarHBondContact O-CG 3.44Å; N680-Q684 PolarHBondContact O-N 2.79Å
681	R	41.9	Very low	39.1	Very low	148 Å²	148	86.4 Å²	86.4	56%	0.558	40%	0.396	S	S	*	.	H	α-helix	trans	-72.9	-57.8	179.1	-79.4	-167.3	177.5	144.7	12.3	113.5	E678 R679 W683 Q684 S685	E678-R681 HydrophobicContact CB-CG 4.45Å; E678-R681 WeakPolarHBondContact O-CB 3.39Å; E678-R681 PolarHBondContact O-N 2.96Å; E678-R681 IonicContact OE1-CZ 2.81Å; E678-R681 VanDerWaalsContact OE1-CZ 3.27Å; E678-R681 IonicContact OE1-NH1 2.72Å; E678-R681 PolarHBondContact OE1-NH1 2.68Å; E678-R681 IonicContact OE1-NH2 3.52Å; R679-R681 PolarHBondContact O-N 2.91Å; R681-W683 VanDerWaalsContact C-N 3.31Å; R681-W683 PolarHBondContact O-N 2.92Å; R681-Q684 CarbonylContact O-C 3.59Å; R681-Q684 PolarHBondContact O-N 2.94Å; R681-S685 WeakPolarHBondContact O-CB 3.14Å; R681-S685 PolarHBondContact O-N 2.74Å
682	L	41.1	Very low	39.8	Very low	15 Å²	15	85.6 Å²	85.6	8%	0.079	39%	0.391	C	S	.	.	H	α-helix	trans	-56.6	-47.6	175.1	179.3	69.1	0	0	0	111.2	E246 F532 Q684 S685 V686	E246-L682 HydrophobicContact CB-CB 4.01Å; E246-L682 HydrophobicContact CB-CD1 3.94Å; E246-L682 HydrophobicContact CB-CD2 4.29Å; E246-L682 HydrophobicContact CB-CG 4.31Å; E246-L682 HydrophobicContact CG-CB 3.63Å; E246-L682 HydrophobicContact CG-CD1 4.5Å; E246-L682 HydrophobicContact CG-CD2 4.23Å; E246-L682 HydrophobicContact CG-CG 4.34Å; E246-L682 VanDerWaalsContact OE1-CB 3.26Å; E246-L682 WeakPolarHBondContact OE1-CB 3.48Å; E246-L682 PolarHBondContact OE1-N 2.87Å; F532-L682 HydrophobicContact CE1-CD2 4.28Å; L682-Q684 VanDerWaalsContact C-N 3.27Å; L682-Q684 PolarHBondContact O-N 3.5Å; L682-S685 PolarHBondContact O-N 3.34Å; L682-V686 HydrophobicContact CD1-CG2 3.63Å; L682-V686 HydrophobicContact CG-CG2 4.01Å; L682-V686 WeakPolarHBondContact O-CB 3.34Å; L682-V686 WeakPolarHBondContact O-CG2 3.07Å; L682-V686 PolarHBondContact O-N 2.8Å
683	W	44.6	Very low	40.1	Very low	73 Å²	73	82.2 Å²	82.2	28%	0.277	38%	0.375	S	S	.	.	H	α-helix	trans	-62.1	-32.4	179.8	-76.5	87.2	0	0	0	112.6	L439 E533 R681 R687	L439-W683 HydrophobicContact CD1-CH2 4.16Å; L439-W683 HydrophobicContact CD2-CH2 4.44Å; E533-W683 HydrophobicContact CB-CH2 3.82Å; E533-W683 HydrophobicContact CB-CZ2 4.34Å; E533-W683 VanDerWaalsContact CD-CZ3 3.44Å; E533-W683 HydrophobicContact CG-CH2 3.77Å; E533-W683 HydrophobicContact CG-CZ2 4.21Å; E533-W683 HydrophobicContact CG-CZ3 4.09Å; E533-W683 WeakPolarHBondContact OE2-CZ3 3.44Å; R681-W683 VanDerWaalsContact C-N 3.31Å; R681-W683 PolarHBondContact O-N 2.92Å; W683-R687 WeakPolarHBondContact O-CB 3.31Å; W683-R687 PolarHBondContact O-N 2.83Å
684	Q	46.6	Very low	40.4	Very low	100 Å²	100	83.2 Å²	83.2	47%	0.467	37%	0.373	S	S	.	.	H	α-helix	trans	-78.1	-34.3	169.6	-73.3	173.7	13.4	0	0	113.2	N680 R681 L682 Q688	N680-Q684 WeakPolarHBondContact O-CB 3.32Å; N680-Q684 WeakPolarHBondContact O-CG 3.44Å; N680-Q684 PolarHBondContact O-N 2.79Å; R681-Q684 CarbonylContact O-C 3.59Å; R681-Q684 PolarHBondContact O-N 2.94Å; L682-Q684 VanDerWaalsContact C-N 3.27Å; L682-Q684 PolarHBondContact O-N 3.5Å; Q684-Q688 WeakPolarHBondContact O-CB 3.37Å; Q684-Q688 WeakPolarHBondContact O-CG 3.23Å; Q684-Q688 PolarHBondContact O-N 3.27Å
685	S	43	Very low	40.8	Very low	37 Å²	37	79.6 Å²	79.6	26%	0.259	36%	0.362	S	S	.	.	H	α-helix	trans	-69.1	-50.9	179.6	-157.4	0	0	0	0	111.1	E242 R681 L682 R687 Q688 S689	E242-S685 VanDerWaalsContact CD-OG 3.23Å; E242-S685 PolarHBondContact OE2-OG 3.19Å; R681-S685 WeakPolarHBondContact O-CB 3.14Å; R681-S685 PolarHBondContact O-N 2.74Å; L682-S685 PolarHBondContact O-N 3.34Å; S685-R687 PolarHBondContact O-N 2.82Å; S685-Q688 CarbonylContact O-C 3.59Å; S685-Q688 PolarHBondContact O-N 2.67Å; S685-S689 WeakPolarHBondContact O-CB 3.01Å; S685-S689 PolarHBondContact O-N 3.45Å; S685-S689 PolarHBondContact O-OG 3.18Å
686	V	41.1	Very low	40.9	Very low	4 Å²	4	78.7 Å²	78.7	2%	0.024	36%	0.358	C	S	.	.	H	α-helix	trans	-59.9	-47.5	175.5	176.1	0	0	0	0	110.4	I529 E533 L682 Q688 S689 M690	I529-V686 HydrophobicContact CG2-CG1 3.47Å; I529-V686 VanDerWaalsContact CG2-CG1 3.47Å; E533-V686 WeakPolarHBondContact OE1-CG1 3.49Å; L682-V686 HydrophobicContact CD1-CG2 3.63Å; L682-V686 HydrophobicContact CG-CG2 4.01Å; L682-V686 WeakPolarHBondContact O-CB 3.34Å; L682-V686 WeakPolarHBondContact O-CG2 3.07Å; L682-V686 PolarHBondContact O-N 2.8Å; V686-Q688 VanDerWaalsContact C-N 3.35Å; V686-Q688 PolarHBondContact O-N 2.94Å; V686-S689 PolarHBondContact O-N 3.39Å; V686-M690 WeakPolarHBondContact O-CB 3.45Å; V686-M690 WeakPolarHBondContact O-CG 3.34Å; V686-M690 PolarHBondContact O-N 3.31Å
687	R	50.8	Low	41	Very low	199 Å²	199	70.4 Å²	70.4	75%	0.751	33%	0.327	S	S	*	.	H	α-helix	trans	-66	-33.4	177.3	-165.2	170.1	-174.2	157.7	-0.8	112.8	W683 S685 S691	W683-R687 WeakPolarHBondContact O-CB 3.31Å; W683-R687 PolarHBondContact O-N 2.83Å; S685-R687 PolarHBondContact O-N 2.82Å; R687-S691 VanDerWaalsContact O-CB 3.23Å; R687-S691 WeakPolarHBondContact O-CB 3.37Å; R687-S691 PolarHBondContact O-N 2.75Å
688	Q	49.5	Very low	41.2	Very low	101 Å²	101	72.2 Å²	72.2	47%	0.472	33%	0.331	S	S	.	.	H	α-helix	trans	-69.1	-42.6	169.9	-84	-171.3	31.2	0	0	112.3	Q684 S685 V686 S691 K692	Q684-Q688 WeakPolarHBondContact O-CB 3.37Å; Q684-Q688 WeakPolarHBondContact O-CG 3.23Å; Q684-Q688 PolarHBondContact O-N 3.27Å; S685-Q688 CarbonylContact O-C 3.59Å; S685-Q688 PolarHBondContact O-N 2.67Å; V686-Q688 VanDerWaalsContact C-N 3.35Å; V686-Q688 PolarHBondContact O-N 2.94Å; Q688-S691 PolarHBondContact O-N 2.87Å; Q688-K692 WeakPolarHBondContact O-CB 3.28Å; Q688-K692 WeakPolarHBondContact O-CD 3.3Å; Q688-K692 WeakPolarHBondContact O-CG 3.37Å; Q688-K692 PolarHBondContact O-N 2.87Å
689	S	41.8	Very low	41.2	Very low	8 Å²	8	78.5 Å²	78.5	6%	0.056	35%	0.352	C	S	.	.	H	α-helix	trans	-65.3	-41.4	178.6	-72.8	0	0	0	0	110.3	E242 S685 V686 S691 K692 F693	E242-S689 PolarHBondContact OE2-OG 3.23Å; S685-S689 WeakPolarHBondContact O-CB 3.01Å; S685-S689 PolarHBondContact O-N 3.45Å; S685-S689 PolarHBondContact O-OG 3.18Å; V686-S689 PolarHBondContact O-N 3.39Å; S689-S691 PolarHBondContact O-N 2.87Å; S689-K692 PolarHBondContact O-N 2.87Å; S689-F693 WeakPolarHBondContact O-CB 3.19Å; S689-F693 PolarHBondContact O-N 2.96Å
690	M	41.4	Very low	41.3	Very low	38 Å²	38	78.3 Å²	78.3	19%	0.187	36%	0.359	C	S	.	.	H	α-helix	trans	-61.8	-38.1	168.6	-78	-77.8	-124.6	0	0	113.7	R526 I529 V686 F693 R694	R526-M690 HydrophobicContact CB-CE 4.33Å; R526-M690 HydrophobicContact CG-CE 4.08Å; R526-M690 HydrophobicContact CG-SD 4.19Å; R526-M690 PolarHBondContact NH1-SD 3.13Å; I529-M690 HydrophobicContact CB-CE 4.25Å; I529-M690 HydrophobicContact CD1-CE 3.91Å; I529-M690 HydrophobicContact CD1-CG 4.03Å; I529-M690 HydrophobicContact CD1-SD 3.8Å; I529-M690 HydrophobicContact CG2-CE 4.15Å; V686-M690 WeakPolarHBondContact O-CB 3.45Å; V686-M690 WeakPolarHBondContact O-CG 3.34Å; V686-M690 PolarHBondContact O-N 3.31Å; M690-F693 PolarHBondContact O-N 3.14Å; M690-R694 PolarHBondContact O-N 3.32Å
691	S	46.7	Very low	40.8	Very low	61 Å²	61	78.4 Å²	78.4	43%	0.427	36%	0.359	S	S	.	.	H	α-helix	trans	-71	-41.5	175.9	-175.5	0	0	0	0	112.2	R687 Q688 S689 F693 R694 S695	R687-S691 VanDerWaalsContact O-CB 3.23Å; R687-S691 WeakPolarHBondContact O-CB 3.37Å; R687-S691 PolarHBondContact O-N 2.75Å; Q688-S691 PolarHBondContact O-N 2.87Å; S689-S691 PolarHBondContact O-N 2.87Å; S691-F693 VanDerWaalsContact C-N 3.31Å; S691-F693 PolarHBondContact O-N 2.88Å; S691-R694 PolarHBondContact O-N 3.33Å; S691-S695 WeakPolarHBondContact O-CB 3.47Å; S691-S695 PolarHBondContact O-N 2.68Å; S691-S695 PolarHBondContact O-OG 2.82Å
692	K	45.7	Very low	40.2	Very low	104 Å²	104	77.5 Å²	77.5	45%	0.452	37%	0.365	S	S	.	.	H	α-helix	trans	-59.8	-41.8	170.9	-70.1	158.9	-165.8	161.5	0	110.4	Q688 S689 S695 H696	Q688-K692 WeakPolarHBondContact O-CB 3.28Å; Q688-K692 WeakPolarHBondContact O-CD 3.3Å; Q688-K692 WeakPolarHBondContact O-CG 3.37Å; Q688-K692 PolarHBondContact O-N 2.87Å; S689-K692 PolarHBondContact O-N 2.87Å; K692-S695 WeakPolarHBondContact CA-OG 3.4Å; K692-S695 PolarHBondContact O-N 3.17Å; K692-S695 PolarHBondContact O-OG 3.46Å; K692-H696 PolarHBondContact O-N 3.35Å
693	F	36	Very low	39.8	Very low	3 Å²	3	82.8 Å²	82.8	1%	0.013	39%	0.392	C	S	.	.	H	α-helix	trans	-65.1	-51.4	176.7	-157	-119.6	0	0	0	112.3	C232 C235 E522 F525 S689 M690 S691 S695 H696 F697	C232-F693 HydrophobicContact CB-CE2 4.49Å; C232-F693 HydrophobicContact CB-CZ 4.13Å; C235-F693 HydrophobicContact CB-CD2 3.8Å; C235-F693 HydrophobicContact CB-CE2 3.83Å; C235-F693 VanDerWaalsContact SG-CD2 3.51Å; E522-F693 HydrophobicContact CB-CE1 4.04Å; E522-F693 HydrophobicContact CG-CE1 3.83Å; F525-F693 HydrophobicContact CD1-CD1 4.16Å; F525-F693 AromaticContact CD1-CE1 3.88Å; F525-F693 HydrophobicContact CD1-CE1 3.88Å; F525-F693 HydrophobicContact CD1-CZ 4.2Å; F525-F693 HydrophobicContact CE1-CD1 4.15Å; F525-F693 HydrophobicContact CE1-CE1 4.25Å; F525-F693 HydrophobicContact CE1-CG 4.31Å; F525-F693 HydrophobicContact CE1-CZ 4.48Å; S689-F693 WeakPolarHBondContact O-CB 3.19Å; S689-F693 PolarHBondContact O-N 2.96Å; M690-F693 PolarHBondContact O-N 3.14Å; S691-F693 VanDerWaalsContact C-N 3.31Å; S691-F693 PolarHBondContact O-N 2.88Å; F693-S695 VanDerWaalsContact C-N 3.29Å; F693-S695 PolarHBondContact O-N 3.48Å; F693-H696 WeakPolarHBondContact O-CB 2.97Å; F693-H696 PolarHBondContact O-N 3.01Å; F693-H696 VanDerWaalsContact O-N 3.1Å; F693-F697 HydrophobicContact CD1-CE2 4.48Å; F693-F697 HydrophobicContact CD2-CE2 4.34Å; F693-F697 HydrophobicContact CE1-CD2 4.39Å; F693-F697 AromaticContact CE1-CE2 3.92Å; F693-F697 HydrophobicContact CE1-CE2 3.92Å; F693-F697 HydrophobicContact CE2-CD2 4.48Å; F693-F697 AromaticContact CE2-CE2 3.77Å; F693-F697 HydrophobicContact CE2-CE2 3.77Å; F693-F697 HydrophobicContact CZ-CD2 4.35Å; F693-F697 AromaticContact CZ-CE2 3.54Å; F693-F697 HydrophobicContact CZ-CE2 3.54Å; F693-F697 HydrophobicContact CZ-CZ 4.28Å; F693-F697 PolarHBondContact O-N 3.32Å
694	R	36.2	Very low	39.1	Very low	144 Å²	144	87.4 Å²	87.4	54%	0.543	41%	0.41	S	S	.	.	H	α-helix	trans	-55.1	-43.9	173.7	-81.6	-169.8	168.5	176	-2.1	112	R526 M690 S691 H696 I698	R526-R694 VanDerWaalsContact NH2-CG 3.31Å; M690-R694 PolarHBondContact O-N 3.32Å; S691-R694 PolarHBondContact O-N 3.33Å; R694-H696 VanDerWaalsContact C-N 3.33Å; R694-H696 PolarHBondContact O-N 3.36Å; R694-I698 WeakPolarHBondContact O-CB 3.15Å; R694-I698 WeakPolarHBondContact O-CD1 3.45Å; R694-I698 VanDerWaalsContact O-CG1 3.23Å; R694-I698 WeakPolarHBondContact O-CG1 3.35Å; R694-I698 PolarHBondContact O-N 3.26Å; R694-I698 VanDerWaalsContact O-N 3.09Å
695	S	39.4	Very low	38.1	Very low	48 Å²	48	86.9 Å²	86.9	34%	0.336	42%	0.417	S	S	.	.	H	α-helix	trans	-75.1	-16.9	-179.4	55	0	0	0	0	114.3	S691 K692 F693 R699	S691-S695 WeakPolarHBondContact O-CB 3.47Å; S691-S695 PolarHBondContact O-N 2.68Å; S691-S695 PolarHBondContact O-OG 2.82Å; K692-S695 WeakPolarHBondContact CA-OG 3.4Å; K692-S695 PolarHBondContact O-N 3.17Å; K692-S695 PolarHBondContact O-OG 3.46Å; F693-S695 VanDerWaalsContact C-N 3.29Å; F693-S695 PolarHBondContact O-N 3.48Å; S695-R699 WeakPolarHBondContact O-CB 3.49Å; S695-R699 VanDerWaalsContact O-CG 3.28Å; S695-R699 WeakPolarHBondContact O-CG 3.28Å; S695-R699 PolarHBondContact O-N 2.95Å
696	H	35.5	Very low	37.3	Very low	57 Å²	57	90.4 Å²	90.4	26%	0.264	44%	0.441	S	S	.	.	H	α-helix	trans	-71.1	-53.1	168	-168.7	-97.5	0	0	0	111.3	N231 K692 F693 R694 I698 R699 N700	N231-H696 VanDerWaalsContact CG-CE1 3.48Å; K692-H696 PolarHBondContact O-N 3.35Å; F693-H696 WeakPolarHBondContact O-CB 2.97Å; F693-H696 PolarHBondContact O-N 3.01Å; F693-H696 VanDerWaalsContact O-N 3.1Å; R694-H696 VanDerWaalsContact C-N 3.33Å; R694-H696 PolarHBondContact O-N 3.36Å; H696-I698 VanDerWaalsContact C-N 3.32Å; H696-I698 PolarHBondContact O-N 3.11Å; H696-R699 WeakPolarHBondContact O-CB 3.4Å; H696-R699 PolarHBondContact O-N 3.4Å; H696-N700 PolarHBondContact CE1-ND2 3.31Å; H696-N700 PolarHBondContact O-N 2.88Å; H696-N700 VanDerWaalsContact O-N 3.11Å
697	F	31.8	Very low	36.6	Very low	23 Å²	23	96 Å²	96	10%	0.101	48%	0.476	C	S	.	.	H	α-helix	trans	-63.8	-34.1	179.4	-83.1	-95.6	0	0	0	113.1	V518 F693 R699 N701	V518-F697 HydrophobicContact CG1-CE1 4.12Å; F693-F697 HydrophobicContact CD1-CE2 4.48Å; F693-F697 HydrophobicContact CD2-CE2 4.34Å; F693-F697 HydrophobicContact CE1-CD2 4.39Å; F693-F697 AromaticContact CE1-CE2 3.92Å; F693-F697 HydrophobicContact CE1-CE2 3.92Å; F693-F697 HydrophobicContact CE2-CD2 4.48Å; F693-F697 AromaticContact CE2-CE2 3.77Å; F693-F697 HydrophobicContact CE2-CE2 3.77Å; F693-F697 HydrophobicContact CZ-CD2 4.35Å; F693-F697 AromaticContact CZ-CE2 3.54Å; F693-F697 HydrophobicContact CZ-CE2 3.54Å; F693-F697 HydrophobicContact CZ-CZ 4.28Å; F693-F697 PolarHBondContact O-N 3.32Å; F697-R699 VanDerWaalsContact C-N 3.29Å; F697-R699 PolarHBondContact O-N 3.16Å; F697-N701 PolarHBondContact O-N 3.08Å; F697-N701 PolarHBondContact O-ND2 3.31Å; F697-N701 VanDerWaalsContact O-ND2 3.08Å
698	I	37.1	Very low	35.4	Very low	117 Å²	117	92.3 Å²	92.3	60%	0.6	48%	0.481	S	S	*	.	H	α-helix	trans	-67.7	-27	172.4	-68.4	166.3	0	0	0	112.1	R694 H696 N702	R694-I698 WeakPolarHBondContact O-CB 3.15Å; R694-I698 WeakPolarHBondContact O-CD1 3.45Å; R694-I698 VanDerWaalsContact O-CG1 3.23Å; R694-I698 WeakPolarHBondContact O-CG1 3.35Å; R694-I698 PolarHBondContact O-N 3.26Å; R694-I698 VanDerWaalsContact O-N 3.09Å; H696-I698 VanDerWaalsContact C-N 3.32Å; H696-I698 PolarHBondContact O-N 3.11Å; I698-N702 PolarHBondContact O-ND2 2.68Å
699	R	37.2	Very low	34.3	Very low	183 Å²	183	91.9 Å²	91.9	69%	0.691	49%	0.489	S	S	*	.	H	α-helix	trans	-80	-40.8	177.7	-82.7	175.1	173.9	171	0.1	113	S695 H696 F697 N702	S695-R699 WeakPolarHBondContact O-CB 3.49Å; S695-R699 VanDerWaalsContact O-CG 3.28Å; S695-R699 WeakPolarHBondContact O-CG 3.28Å; S695-R699 PolarHBondContact O-N 2.95Å; H696-R699 WeakPolarHBondContact O-CB 3.4Å; H696-R699 PolarHBondContact O-N 3.4Å; F697-R699 VanDerWaalsContact C-N 3.29Å; F697-R699 PolarHBondContact O-N 3.16Å; R699-N702 PolarHBondContact O-ND2 3.44Å
700	N	35.3	Very low	33.7	Very low	89 Å²	89	99 Å²	99	48%	0.476	52%	0.524	S	S	.	.	H	α-helix	trans	-78.6	-26.8	-174.5	-71.4	6.7	0	0	0	113.4	H696 N702	H696-N700 PolarHBondContact CE1-ND2 3.31Å; H696-N700 PolarHBondContact O-N 2.88Å; H696-N700 VanDerWaalsContact O-N 3.11Å; N700-N702 PolarHBondContact O-N 2.7Å
701	N	35	Very low	32.9	Very low	95 Å²	95	101.8 Å²	101.8	51%	0.508	55%	0.546	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.9	29.4	179.7	-75.9	-49.3	0	0	0	115.3	F697 I703	F697-N701 PolarHBondContact O-N 3.08Å; F697-N701 PolarHBondContact O-ND2 3.31Å; F697-N701 VanDerWaalsContact O-ND2 3.08Å; N701-I703 VanDerWaalsContact C-N 3.27Å; N701-I703 PolarHBondContact O-N 3.49Å
702	N	29.2	Very low	31.9	Very low	128 Å²	128	106.2 Å²	106.2	68%	0.684	56%	0.564	S	S	*	*			trans	-81.4	53.6	-174.9	-90.2	-70.2	0	0	0	114.9	I698 R699 N700	I698-N702 PolarHBondContact O-ND2 2.68Å; R699-N702 PolarHBondContact O-ND2 3.44Å; N700-N702 PolarHBondContact O-N 2.7Å
703	I	32.2	Very low	31.2	Very low	126 Å²	126	106.8 Å²	106.8	65%	0.646	58%	0.577	S	S	*	*	S	Bend	trans	-138.8	115	165.4	-57.7	-179	0	0	0	109.9	N701	N701-I703 VanDerWaalsContact C-N 3.27Å; N701-I703 PolarHBondContact O-N 3.49Å
704	R	28.7	Very low	30.8	Very low	171 Å²	171	117.1 Å²	117.1	65%	0.645	62%	0.616	S	S	*	*			trans	62.4	120.3	177.6	-69.5	177.9	153.7	165.3	-10.4	114.1
705	S	26.5	Very low	30.5	Very low	89 Å²	89	116 Å²	116	62%	0.622	63%	0.625	S	S	*	*				67.5	133.2	58.1	82.1	0	0	0	0	114.3
706	S	25.3	Very low	29.8	Very low	110 Å²	110	124.3 Å²	124.3	77%	0.769	65%	0.65	S	S	*	*			trans	62.7	67.3	174.9	63.5	0	0	0	0	118.3
707	T	27.9	Very low	29.4	Very low	121 Å²	121	129.7 Å²	129.7	74%	0.742	68%	0.676	S	S	*	*			trans	-128.5	44.4	153.7	47.1	0	0	0	0	111.7	S709	T707-S709 PolarHBondContact O-N 3.35Å
708	S	25.5	Very low	29.1	Very low	123 Å²	123	134 Å²	134	86%	0.86	71%	0.707	S	S	*	*			trans	-75	45.8	170.2	56.8	0	0	0	0	112.3
709	S	26.8	Very low	28.6	Very low	91 Å²	91	139.6 Å²	139.6	64%	0.636	72%	0.721	S	S	*	*			trans	-172.3	83.7	178.9	55.6	0	0	0	0	111	T707	T707-S709 PolarHBondContact O-N 3.35Å
710	I	27.7	Very low	28.1	Very low	157 Å²	157	139.1 Å²	139.1	81%	0.805	73%	0.731	S	S	*	*			trans	-98.2	103.6	139.2	-63	179.2	0	0	0	104.3
711	P	26.2	Very low	27.6	Very low	98 Å²	98	145.2 Å²	145.2	64%	0.636	75%	0.748	S	S	*	*			trans	-63.4	151.7	177.5	-19.9	33.1	0	0	0	110.6	T713	P711-T713 PolarHBondContact O-N 3.48Å
712	N	25.5	Very low	27.2	Very low	153 Å²	153	148.3 Å²	148.3	82%	0.818	76%	0.759	S	S	*	*			trans	-58.7	103.3	172.5	-68.1	-51.2	0	0	0	110.2	R714	N712-R714 PolarHBondContact O-N 2.82Å
713	T	29.8	Very low	27.1	Very low	117 Å²	117	148 Å²	148	72%	0.718	76%	0.762	S	S	*	*			trans	-75.1	48.7	174.3	40.1	0	0	0	0	111.8	P711 T715	P711-T713 PolarHBondContact O-N 3.48Å; T713-T715 PolarHBondContact O-N 2.99Å
714	R	28	Very low	26.9	Very low	220 Å²	220	147 Å²	147	83%	0.83	76%	0.757	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.2	30.2	-179	-144.6	179.9	-164.1	-173.8	4.7	112.7	N712	N712-R714 PolarHBondContact O-N 2.82Å
715	T	29.7	Very low	26.7	Very low	120 Å²	120	143.9 Å²	143.9	74%	0.736	75%	0.752	S	S	*	*	T	Hydrogen-bonded Turn	trans	-130.6	-2.8	-163.1	-9.8	0	0	0	0	114	T713	T713-T715 PolarHBondContact O-N 2.99Å
716	Y	25.8	Very low	26.7	Very low	222 Å²	222	142.7 Å²	142.7	87%	0.871	74%	0.741	S	S	*	*			trans	-105.2	32.9	168.9	-84.9	-75.6	0	0	0	113	C718	Y716-C718 PolarHBondContact O-N 3.43Å
717	Q	26	Very low	26.8	Very low	170 Å²	170	143.2 Å²	143.2	79%	0.794	74%	0.74	S	S	*	*			trans	-88.8	78.6	162	-76.4	-166.3	-46.5	0	0	110.9
718	C	26.6	Very low	26.7	Very low	113 Å²	113	144.8 Å²	144.8	76%	0.764	74%	0.742	S	S	*	*	S	Bend	trans	-172.9	140.9	153.2	-106.1	0	0	0	0	112.4	Y716	Y716-C718 PolarHBondContact O-N 3.43Å
719	R	25.9	Very low	26.8	Very low	236 Å²	236	144 Å²	144	89%	0.891	73%	0.734	S	S	*	*			trans	60.5	82.9	167.3	-54.7	178	-172.5	177.4	1.5	116.6
720	L	25.8	Very low	26.9	Very low	172 Å²	172	148 Å²	148	90%	0.901	75%	0.747	S	S	*	*				-161.2	118.5	107.5	-103.3	160.3	0	0	0	109.8
721	R	25.3	Very low	26.8	Very low	218 Å²	218	148 Å²	148	82%	0.823	75%	0.748	S	S	*	*			trans	-128.4	151.4	168	-145.8	-173.9	-163.8	-163.9	4	105.7
722	E	26.7	Very low	26.8	Very low	159 Å²	159	147.9 Å²	147.9	74%	0.743	74%	0.742	S	S	*	*			trans	72.8	149.1	177.1	-63.2	144.2	-139.4	0	0	116.9
723	T	27.3	Very low	26.8	Very low	123 Å²	123	145 Å²	145	76%	0.755	73%	0.73	S	S	*	*			trans	102.3	97.5	166.7	-39.7	0	0	0	0	118.2
724	I	27.4	Very low	26.8	Very low	105 Å²	105	147.4 Å²	147.4	54%	0.538	74%	0.737	S	S	.	*			trans	54.6	110.2	137.7	-55.5	176	0	0	0	117.2
725	I	25.7	Very low	26.7	Very low	104 Å²	104	143.9 Å²	143.9	53%	0.533	73%	0.734	S	S	.	*				73.2	156.5	70.3	-55.5	160.8	0	0	0	113.3	S620 Q621	S620-I725 WeakPolarHBondContact OG-CG2 3.21Å; Q621-I725 HydrophobicContact CG-CD1 4.17Å
726	T	26.5	Very low	26.7	Very low	64 Å²	64	145.2 Å²	145.2	39%	0.393	74%	0.737	S	S	.	*			trans	79.5	103.6	172.7	25.3	0	0	0	0	120.1
727	T	25.6	Very low	26.8	Very low	122 Å²	122	140.5 Å²	140.5	75%	0.748	73%	0.727	S	S	*	*				24.2	124.8	127.5	-21.3	0	0	0	0	120.7
728	I	27.8	Very low	27.1	Very low	153 Å²	153	139 Å²	139	79%	0.785	72%	0.724	S	S	*	*			trans	-132.5	114.7	152.2	-60	179.6	0	0	0	109
729	P	26.8	Very low	27.3	Very low	107 Å²	107	139.6 Å²	139.6	70%	0.695	72%	0.72	S	S	*	*			trans	-89.2	140.3	170.6	34.2	-31	0	0	0	111.3
730	L	28.3	Very low	27.5	Very low	174 Å²	174	135.1 Å²	135.1	91%	0.911	71%	0.714	S	S	*	*			trans	-105.7	97.4	172.5	-82.7	170.8	0	0	0	111.1
731	L	26.1	Very low	27.8	Very low	158 Å²	158	131.9 Å²	131.9	83%	0.827	71%	0.706	S	S	*	*			trans	-96.3	161.3	171.3	-143.7	82	0	0	0	111.7
732	N	27.1	Very low	28	Very low	95 Å²	95	128.2 Å²	128.2	51%	0.508	70%	0.702	S	S	.	*			trans	-51.3	136.3	-171.1	-53.4	-66.4	0	0	0	116.4	K369	K369-N732 WeakPolarHBondContact CE-OD1 3.17Å; K369-N732 PolarHBondContact NZ-OD1 3.12Å
733	T	25.3	Very low	28.3	Very low	94 Å²	94	127.3 Å²	127.3	58%	0.577	70%	0.703	S	S	*	*			trans	21.1	131.1	137.5	59.6	0	0	0	0	120.4
734	I	29.5	Very low	28.4	Very low	167 Å²	167	128.1 Å²	128.1	86%	0.856	70%	0.702	S	S	*	*				-168.1	152.5	116.1	-100.4	155.9	0	0	0	109.9
735	N	26.5	Very low	28.7	Very low	145 Å²	145	128.1 Å²	128.1	78%	0.775	71%	0.712	S	S	*	*			trans	-72.6	150.2	172.7	-66.9	-20.3	0	0	0	110.8
736	D	29.7	Very low	28.9	Very low	149 Å²	149	130 Å²	130	80%	0.797	72%	0.723	S	S	*	*				-162.4	172.8	103.1	-128.3	-46.3	0	0	0	114.2
737	N	27.9	Very low	29.2	Very low	122 Å²	122	134.5 Å²	134.5	65%	0.652	74%	0.744	S	S	*	*			trans	-86.3	144.5	-170.4	-59.6	-96.8	0	0	0	112.5
738	N	31.1	Very low	29.5	Very low	138 Å²	138	137.8 Å²	137.8	74%	0.738	75%	0.748	S	S	*	*				170.5	125.5	109.5	-94.5	-71.9	0	0	0	115.4
739	N	30.3	Very low	29.7	Very low	126 Å²	126	136.2 Å²	136.2	67%	0.674	75%	0.748	S	S	*	*				46.8	123.8	128.5	-69.1	-32.5	0	0	0	124.1
740	N	30.5	Very low	29.8	Very low	143 Å²	143	138.8 Å²	138.8	77%	0.765	76%	0.755	S	S	*	*				94	143.9	128	-72	-19.2	0	0	0	123.4
741	S	31.7	Very low	30	Very low	104 Å²	104	139.1 Å²	139.1	73%	0.727	75%	0.752	S	S	*	*			trans	98.1	85.3	149.4	-38.7	0	0	0	0	120.4
742	N	30	Very low	30.1	Very low	141 Å²	141	138.6 Å²	138.6	75%	0.754	75%	0.75	S	S	*	*				32.2	119.5	120.6	-54.5	-12	0	0	0	120.8
743	N	32.8	Very low	30.5	Very low	140 Å²	140	139.8 Å²	139.8	75%	0.749	76%	0.762	S	S	*	*				164.7	120.3	107	-86.9	-51.2	0	0	0	111.5
744	N	30.5	Very low	30.6	Very low	140 Å²	140	140.8 Å²	140.8	75%	0.749	77%	0.769	S	S	*	*				72.7	103.9	83.8	-100.3	-31.9	0	0	0	116.1
745	S	32.5	Very low	30.7	Very low	105 Å²	105	141.1 Å²	141.1	73%	0.734	77%	0.77	S	S	*	*				161.4	126.6	104.1	54.6	0	0	0	0	116.4
746	N	29.7	Very low	30.8	Very low	142 Å²	142	141.7 Å²	141.7	76%	0.759	77%	0.773	S	S	*	*			trans	34.8	125.6	139.5	-53.8	-30.4	0	0	0	122.8
747	N	32.6	Very low	30.7	Very low	159 Å²	159	137.2 Å²	137.2	85%	0.85	76%	0.763	S	S	*	*				-165.2	178.1	103.9	-101.9	-48.9	0	0	0	114.3
748	K	32.2	Very low	30.8	Very low	191 Å²	191	139.3 Å²	139.3	83%	0.83	77%	0.773	S	S	*	*			trans	-106.6	157.8	-155.2	-64.1	172.8	178.7	173.1	0	116.3
749	P	32.1	Very low	30.8	Very low	120 Å²	120	142 Å²	142	78%	0.779	78%	0.778	S	S	*	*			trans	-97	172.6	173.5	39.2	-36.4	0	0	0	114.7
750	L	28.6	Very low	30.5	Very low	162 Å²	162	144.3 Å²	144.3	85%	0.848	79%	0.785	S	S	*	*			trans	-148.3	127.5	172.9	-105.7	114.5	0	0	0	115.7
751	H	32.9	Very low	30.5	Very low	181 Å²	181	146 Å²	146	84%	0.838	79%	0.789	S	S	*	*			trans	56.7	139.5	144.5	-88.9	-90.4	0	0	0	126.5
752	N	29.1	Very low	30.3	Very low	146 Å²	146	147 Å²	147	78%	0.781	79%	0.785	S	S	*	*			trans	-98.7	163.7	170	-106	-14.4	0	0	0	110.7
753	P	34.2	Very low	30.3	Very low	120 Å²	120	147.6 Å²	147.6	78%	0.779	78%	0.783	S	S	*	*				-157.5	149.1	92.7	39.8	-19.2	0	0	0	120.9
754	T	28.6	Very low	30.1	Very low	115 Å²	115	148.8 Å²	148.8	71%	0.706	79%	0.789	S	S	*	*			trans	5.5	140.3	141.4	-36.3	0	0	0	0	123.8
755	I	30.9	Very low	29.9	Very low	174 Å²	174	145.1 Å²	145.1	89%	0.892	78%	0.784	S	S	*	*			trans	-131.9	153.3	147.7	-69.6	-177.2	0	0	0	109.4
756	N	28.1	Very low	29.6	Very low	157 Å²	157	148.7 Å²	148.7	84%	0.84	79%	0.792	S	S	*	*			trans	-147.9	151.4	-168.7	-139.6	-10.9	0	0	0	113.4
757	G	29.1	Very low	29.5	Very low	56 Å²	56	148 Å²	148	58%	0.577	79%	0.788	S	S	*	*			trans	178.7	111.7	173.3	0	0	0	0	0	113.1
758	L	28.9	Very low	29.3	Very low	165 Å²	165	146.6 Å²	146.6	86%	0.864	79%	0.785	S	S	*	*				71.6	123.5	88.6	-71.3	170.4	0	0	0	113.2
759	K	31.1	Very low	29.1	Very low	196 Å²	196	143 Å²	143	85%	0.852	78%	0.781	S	S	*	*			cis	-147.1	174.4	19.1	-101.2	169.8	-177.6	176.6	0	113.6
760	Q	24.6	Very low	29	Very low	173 Å²	173	147.6 Å²	147.6	81%	0.808	79%	0.789	S	S	*	*			trans	-113.7	159.4	179	-58.9	167.9	-24.2	0	0	113
761	Q	30.5	Very low	28.8	Very low	180 Å²	180	148.7 Å²	148.7	84%	0.841	78%	0.783	S	S	*	*			trans	173.7	124.5	138.5	-94.5	160	2.9	0	0	108.2
762	N	26.8	Very low	28.5	Very low	123 Å²	123	147.7 Å²	147.7	66%	0.658	78%	0.779	S	S	*	*				62.5	125.1	68.3	-65.7	3.9	0	0	0	112
763	H	31.4	Very low	28.4	Very low	154 Å²	154	149.3 Å²	149.3	71%	0.713	78%	0.782	S	S	*	*			cis	-160.6	170.7	42.2	-93.9	-73.8	0	0	0	114.1
764	L	26.8	Very low	27.8	Very low	166 Å²	166	151.1 Å²	151.1	87%	0.869	79%	0.785	S	S	*	*			trans	21.8	145.4	138.5	-53.4	162.9	0	0	0	120
765	G	26.3	Very low	27.7	Very low	63 Å²	63	157 Å²	157	65%	0.649	79%	0.794	S	S	*	*			cis	150.9	174.9	5.3	0	0	0	0	0	111
766	M	28.1	Very low	27.4	Very low	180 Å²	180	158.4 Å²	158.4	89%	0.887	79%	0.794	S	S	*	*			trans	67	163.5	177.2	-53.6	-63.8	-161.2	0	0	117.2
767	D	27.4	Very low	27.3	Very low	128 Å²	128	160.9 Å²	160.9	68%	0.684	80%	0.797	S	S	*	*				-162.2	151.2	-56.3	-131.7	-26.9	0	0	0	111.7
768	T	27.9	Very low	27	Very low	129 Å²	129	165 Å²	165	79%	0.791	81%	0.806	S	S	*	*			trans	62.1	144.1	164.7	62.7	0	0	0	0	121.6
769	P	28.2	Very low	27.1	Very low	115 Å²	115	165.2 Å²	165.2	75%	0.747	80%	0.802	S	S	*	*			trans	-112	166.8	178	41.5	-34.1	0	0	0	114.9
770	F	28.7	Very low	26.8	Very low	216 Å²	216	163.1 Å²	163.1	95%	0.947	80%	0.795	S	S	*	*			trans	-150.5	164.2	162.6	-113.6	-80.2	0	0	0	115.2
771	Y	24.7	Very low	27	Very low	185 Å²	185	161.9 Å²	161.9	73%	0.725	79%	0.794	S	S	*	*			trans	-88.4	160.1	-163.9	-103.6	-101	0	0	0	116.9
772	H	26.8	Very low	26.9	Very low	160 Å²	160	160 Å²	160	74%	0.741	79%	0.785	S	S	*	*			trans	57.3	117.2	146	-80.7	-27.2	0	0	0	121.1
773	Q	27.2	Very low	27.1	Very low	180 Å²	180	160.8 Å²	160.8	84%	0.841	79%	0.788	S	S	*	*				-173.5	147.7	90.9	-108	175.9	26.6	0	0	113.7
774	N	22.7	Very low	26.9	Very low	158 Å²	158	161 Å²	161	85%	0.845	79%	0.789	S	S	*	*			trans	-75.4	134.9	170.6	-85.2	-23.9	0	0	0	111.7
775	R	26.3	Very low	27.1	Very low	240 Å²	240	157.9 Å²	157.9	91%	0.906	78%	0.781	S	S	*	*			trans	-160.9	122.2	146.4	-110	162	-159	-153.2	3.3	112.1
776	K	23.1	Very low	27.3	Very low	203 Å²	203	160.5 Å²	160.5	88%	0.883	78%	0.781	S	S	*	*			trans	-69.1	137.2	166.2	-62.5	174.6	178	176.8	0	109.2
777	F	26.9	Very low	27.3	Very low	209 Å²	209	161.3 Å²	161.3	92%	0.917	77%	0.774	S	S	*	*			trans	-159.9	139.5	145	-111.5	-72.1	0	0	0	111
778	N	23	Very low	27.5	Very low	141 Å²	141	161.8 Å²	161.8	75%	0.754	77%	0.772	S	S	*	*			trans	-82.8	147.7	173.1	-64.9	-28.5	0	0	0	110.4
779	H	30.2	Very low	27.6	Very low	171 Å²	171	159.9 Å²	159.9	79%	0.792	76%	0.764	S	S	*	*				-171.6	164.5	109	-99.9	-44.3	0	0	0	113.2
780	Q	25.2	Very low	27.7	Very low	151 Å²	151	162.2 Å²	162.2	71%	0.706	77%	0.765	S	S	*	*			trans	-75.3	155.7	178.7	-51.2	104	-68	0	0	112.4
781	N	29.2	Very low	27.8	Very low	147 Å²	147	157.8 Å²	157.8	79%	0.786	75%	0.751	S	S	*	*				178	124.5	119.1	-88.9	-33.7	0	0	0	109.6
782	H	28.3	Very low	28.1	Very low	141 Å²	141	153 Å²	153	65%	0.653	75%	0.745	S	S	*	*				105.3	126.9	67.8	-154.9	-63.6	0	0	0	110.7
783	I	30.7	Very low	28.1	Very low	140 Å²	140	152 Å²	152	72%	0.718	75%	0.75	S	S	*	*			trans	147.6	103.6	142.4	-77.5	163.7	0	0	0	107.9
784	Q	28.3	Very low	28.1	Very low	158 Å²	158	148 Å²	148	74%	0.738	74%	0.742	S	S	*	*				61.4	136.8	92	-69.9	169.5	-34.9	0	0	113.9
785	S	30.5	Very low	28.3	Very low	100 Å²	100	147.5 Å²	147.5	70%	0.699	74%	0.738	S	S	*	*			cis	-146.2	-166.1	8.7	64.9	0	0	0	0	109.5
786	N	29.3	Very low	28.1	Very low	119 Å²	119	143 Å²	143	64%	0.636	73%	0.731	S	S	*	*			cis	-148.5	158.3	10.3	-122	1.5	0	0	0	107.2
787	R	28.9	Very low	28.1	Very low	197 Å²	197	139.2 Å²	139.2	74%	0.743	73%	0.725	S	S	*	*				65.3	143.2	71.8	-57	-161.6	-166.3	-171.9	0.4	116
788	E	30.4	Very low	28.1	Very low	137 Å²	137	135 Å²	135	64%	0.64	72%	0.721	S	S	*	*			cis	-153.4	152.4	20.1	-137.8	144.6	-138.6	0	0	113.2
789	S	30.8	Very low	28.2	Very low	90 Å²	90	137.7 Å²	137.7	63%	0.629	73%	0.727	S	S	*	*			trans	33.3	152.3	146	57.7	0	0	0	0	123.2
790	Q	30.7	Very low	28	Very low	164 Å²	164	135.3 Å²	135.3	77%	0.766	73%	0.727	S	S	*	*			cis	-168.3	172.2	-4.4	-108.3	168	-79.6	0	0	106.1
791	D	30.5	Very low	28.1	Very low	122 Å²	122	134.5 Å²	134.5	65%	0.652	73%	0.726	S	S	*	*			cis	-161.6	156.8	26.9	-138.1	-36.5	0	0	0	114.9
792	S	30.4	Very low	28	Very low	86 Å²	86	132 Å²	132	60%	0.601	72%	0.719	S	S	*	*			trans	58	115.4	143.5	-72.5	0	0	0	0	125.6
793	T	28.6	Very low	28.4	Very low	137 Å²	137	132.6 Å²	132.6	84%	0.84	73%	0.727	S	S	*	*			trans	76.4	137.7	136.5	57.7	0	0	0	0	121
794	S	26.2	Very low	29.4	Very low	98 Å²	98	130.9 Å²	130.9	69%	0.685	72%	0.717	S	S	*	*			cis	-163.8	164.4	-1.3	51.6	0	0	0	0	114.4
795	I	26	Very low	31.4	Very low	146 Å²	146	125.5 Å²	125.5	75%	0.749	69%	0.693	S	S	*	*			trans	83.6	105.1	154	-71	156.3	0	0	0	119.4
796	L	23.5	Very low	33.9	Very low	145 Å²	145	122.4 Å²	122.4	76%	0.759	67%	0.668	S	S	*	*			trans	67.6	103	140.9	-63.2	177.8	0	0	0	123.4
797	T	23.2	Very low	36.2	Very low	125 Å²	125	118.5 Å²	118.5	77%	0.767	65%	0.648	S	S	*	*				62	94.3	127.4	60.1	0	0	0	0	121.4
798	S	26.7	Very low	38.8	Very low	119 Å²	119	116.1 Å²	116.1	83%	0.832	64%	0.643	S	S	*	*				-150.8	148.4	122.1	59.4	0	0	0	0	109.8
799	F	25.1	Very low	41.7	Very low	198 Å²	198	110.1 Å²	110.1	87%	0.868	62%	0.615	S	S	*	*	P	Polyproline II helix	trans	-92.1	143.3	172.6	-77.3	-91.5	0	0	0	109.4	I801	F799-I801 PolarHBondContact O-N 3.3Å
800	P	26.1	Very low	44.5	Very low	122 Å²	122	108.8 Å²	108.8	79%	0.792	60%	0.604	S	S	*	*	P	Polyproline II helix	trans	-68.7	127.4	176.7	28.5	-33.6	0	0	0	110.4	C802	P800-C802 PolarHBondContact O-N 3.26Å
801	I	27	Very low	47.5	Very low	134 Å²	134	101.9 Å²	101.9	69%	0.687	57%	0.571	S	S	*	*	P	Polyproline II helix	trans	-68.6	129.2	168.8	-60.6	175.2	0	0	0	107.1	F799	F799-I801 PolarHBondContact O-N 3.3Å
802	C	27	Very low	50.5	Low	94 Å²	94	96.1 Å²	96.1	64%	0.635	54%	0.54	S	S	*	.			trans	-91.3	114	-171.9	-171.4	0	0	0	0	110.5	P800 M804	P800-C802 PolarHBondContact O-N 3.26Å; C802-M804 WeakPolarHBondContact O-CG 3.49Å; C802-M804 PolarHBondContact O-N 3.45Å
803	D	35.5	Very low	53.5	Low	154 Å²	154	92 Å²	92	82%	0.824	51%	0.511	S	S	*	.			trans	-59	104.1	174.7	-83.9	-46.1	0	0	0	111.1	D805	D803-D805 PolarHBondContact O-N 2.78Å
804	M	53.3	Low	56.4	Low	104 Å²	104	85.5 Å²	85.5	51%	0.512	47%	0.471	S	S	.	.			trans	-89.2	105.9	176.5	-60.3	-127.8	-160.9	0	0	109.7	C802 I806 R914	C802-M804 WeakPolarHBondContact O-CG 3.49Å; C802-M804 PolarHBondContact O-N 3.45Å; M804-I806 PolarHBondContact O-N 2.9Å; M804-R914 PolarHBondContact SD-NH1 3.28Å; M804-R914 PolarHBondContact SD-NH2 3.38Å
805	D	70.2	Confident	59.2	Low	44 Å²	44	81 Å²	81	24%	0.235	44%	0.44	C	S	.	.			trans	-44.3	109.7	170.3	168.6	22.3	0	0	0	111.4	D803 N807 K808 R949	D803-D805 PolarHBondContact O-N 2.78Å; D805-N807 PolarHBondContact O-N 3.25Å; D805-N807 VanDerWaalsContact O-N 3.1Å; D805-N807 VanDerWaalsContact OD1-CB 3.29Å; D805-N807 WeakPolarHBondContact OD1-CB 3.24Å; D805-N807 PolarHBondContact OD1-N 3.43Å; D805-N807 VanDerWaalsContact OD1-N 3.09Å; D805-N807 PolarHBondContact OD1-ND2 3.01Å; D805-K808 HydrophobicContact CB-CD 3.96Å; D805-K808 HydrophobicContact CB-CG 4.2Å; D805-K808 VanDerWaalsContact O-CB 3.28Å; D805-K808 WeakPolarHBondContact O-CB 3.4Å; D805-K808 PolarHBondContact O-N 3.42Å; D805-K808 WeakPolarHBondContact OD2-CE 3.38Å; D805-R949 IonicContact OD2-CZ 3.6Å; D805-R949 IonicContact OD2-NH1 3.79Å; D805-R949 PolarHBondContact OD2-NH1 3.01Å; D805-R949 IonicContact OD2-NH2 3.51Å
806	I	81.6	Confident	62.1	Low	35 Å²	35	74.1 Å²	74.1	18%	0.179	41%	0.405	C	S	.	.	G	3₁₀ helix	trans	-59.9	-23.5	-175.8	-169.1	170.1	0	0	0	113.2	M804 K808 E809 F812 M879 I913	M804-I806 PolarHBondContact O-N 2.9Å; I806-K808 PolarHBondContact O-N 3.06Å; I806-K808 VanDerWaalsContact O-N 3.11Å; I806-E809 HydrophobicContact CG1-CG 4.05Å; I806-E809 WeakPolarHBondContact O-CB 3.46Å; I806-E809 WeakPolarHBondContact O-CG 3.46Å; I806-E809 PolarHBondContact O-N 3.34Å; I806-F812 HydrophobicContact CD1-CD2 3.93Å; I806-F812 HydrophobicContact CD1-CE2 4.18Å; I806-F812 HydrophobicContact CG1-CB 4.35Å; I806-F812 HydrophobicContact CG1-CD2 3.94Å; I806-F812 HydrophobicContact CG1-CE2 4.41Å; I806-F812 HydrophobicContact CG1-CG 4.09Å; I806-M879 HydrophobicContact CD1-CE 4.14Å; I806-M879 HydrophobicContact CG2-CE 4.41Å; I806-I913 HydrophobicContact CD1-CB 3.99Å; I806-I913 HydrophobicContact CD1-CD1 3.67Å; I806-I913 HydrophobicContact CD1-CG1 4.22Å; I806-I913 HydrophobicContact CD1-CG2 4.32Å
807	N	78	Confident	64.7	Low	38 Å²	38	68 Å²	68	20%	0.203	37%	0.373	C	S	.	.	G	3₁₀ helix	trans	-64.6	-16.5	175.6	-57.3	-78.4	0	0	0	112.2	D805 F812 R941 R949 Q1017	D805-N807 PolarHBondContact O-N 3.25Å; D805-N807 VanDerWaalsContact O-N 3.1Å; D805-N807 VanDerWaalsContact OD1-CB 3.29Å; D805-N807 WeakPolarHBondContact OD1-CB 3.24Å; D805-N807 PolarHBondContact OD1-N 3.43Å; D805-N807 VanDerWaalsContact OD1-N 3.09Å; D805-N807 PolarHBondContact OD1-ND2 3.01Å; N807-F812 WeakPolarHBondContact OD1-CE1 3.35Å; N807-R941 PolarHBondContact O-NH1 2.94Å; N807-R941 PolarHBondContact O-NH2 3.26Å; N807-R949 VanDerWaalsContact CB-NH2 3.32Å; N807-Q1017 PolarHBondContact O-OE1 2.67Å
808	K	84.7	Confident	67.6	Low	146 Å²	146	68.2 Å²	68.2	64%	0.635	36%	0.36	S	S	*	.	G	3₁₀ helix	trans	-83.2	-12.4	174	-59.7	173.3	-174.7	163.7	0	113.5	D805 I806	D805-K808 HydrophobicContact CB-CD 3.96Å; D805-K808 HydrophobicContact CB-CG 4.2Å; D805-K808 VanDerWaalsContact O-CB 3.28Å; D805-K808 WeakPolarHBondContact O-CB 3.4Å; D805-K808 PolarHBondContact O-N 3.42Å; D805-K808 WeakPolarHBondContact OD2-CE 3.38Å; I806-K808 PolarHBondContact O-N 3.06Å; I806-K808 VanDerWaalsContact O-N 3.11Å
809	E	89.8	Confident	70	Confident	12 Å²	12	64.7 Å²	64.7	6%	0.056	34%	0.339	C	S	.	.			trans	-68.1	129.9	175.3	-61.3	-58.4	152.7	0	0	110	I806 W811 F812 R914 R941	I806-E809 HydrophobicContact CG1-CG 4.05Å; I806-E809 WeakPolarHBondContact O-CB 3.46Å; I806-E809 WeakPolarHBondContact O-CG 3.46Å; I806-E809 PolarHBondContact O-N 3.34Å; E809-W811 HydrophobicContact CB-CD2 3.95Å; E809-W811 HydrophobicContact CB-CE3 4.24Å; E809-W811 HydrophobicContact CB-CG 4.48Å; E809-W811 HydrophobicContact CB-CH2 4.15Å; E809-W811 HydrophobicContact CB-CZ2 3.83Å; E809-W811 HydrophobicContact CB-CZ3 4.33Å; E809-W811 VanDerWaalsContact CD-CZ2 3.44Å; E809-W811 HydrophobicContact CG-CD2 4.49Å; E809-W811 HydrophobicContact CG-CH2 3.69Å; E809-W811 HydrophobicContact CG-CZ2 3.45Å; E809-W811 VanDerWaalsContact CG-CZ2 3.45Å; E809-W811 HydrophobicContact CG-CZ3 4.3Å; E809-W811 PolarHBondContact O-N 3.48Å; E809-W811 VanDerWaalsContact OE2-CZ2 3.31Å; E809-W811 WeakPolarHBondContact OE2-CZ2 3.12Å; E809-W811 PolarHBondContact OE2-NE1 2.9Å; E809-F812 HydrophobicContact CB-CB 3.91Å; E809-F812 PolarHBondContact O-N 3.44Å; E809-R914 IonicContact OE1-CZ 3.27Å; E809-R914 IonicContact OE1-NE 3.12Å; E809-R914 PolarHBondContact OE1-NE 2.85Å; E809-R914 IonicContact OE1-NH2 2.68Å; E809-R914 PolarHBondContact OE1-NH2 3.25Å; E809-R914 IonicContact OE2-NE 3.71Å; E809-R914 PolarHBondContact OE2-NE 3.11Å; E809-R914 IonicContact OE2-NH2 2.7Å; E809-R941 PolarHBondContact O-NH1 3.32Å
810	P	90.9	Very high	72.7	Confident	62 Å²	62	56.2 Å²	56.2	40%	0.403	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-27.2	179.5	28.1	-34.3	0	0	0	111.9	F812 S940 R941	P810-F812 VanDerWaalsContact C-N 3.34Å; P810-S940 CarbonylContact O-C 3.49Å; P810-S940 VanDerWaalsContact O-CA 3.27Å; P810-S940 WeakPolarHBondContact O-CA 3.43Å; P810-R941 PolarHBondContact O-N 3.13Å
811	W	93.6	Very high	75.7	Confident	19 Å²	19	50.4 Å²	50.4	7%	0.072	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.3	6.2	178.9	49.2	-98.6	0	0	0	114	E809 H813 V833 I913 R914 I917 P938 I939	E809-W811 HydrophobicContact CB-CD2 3.95Å; E809-W811 HydrophobicContact CB-CE3 4.24Å; E809-W811 HydrophobicContact CB-CG 4.48Å; E809-W811 HydrophobicContact CB-CH2 4.15Å; E809-W811 HydrophobicContact CB-CZ2 3.83Å; E809-W811 HydrophobicContact CB-CZ3 4.33Å; E809-W811 VanDerWaalsContact CD-CZ2 3.44Å; E809-W811 HydrophobicContact CG-CD2 4.49Å; E809-W811 HydrophobicContact CG-CH2 3.69Å; E809-W811 HydrophobicContact CG-CZ2 3.45Å; E809-W811 VanDerWaalsContact CG-CZ2 3.45Å; E809-W811 HydrophobicContact CG-CZ3 4.3Å; E809-W811 PolarHBondContact O-N 3.48Å; E809-W811 VanDerWaalsContact OE2-CZ2 3.31Å; E809-W811 WeakPolarHBondContact OE2-CZ2 3.12Å; E809-W811 PolarHBondContact OE2-NE1 2.9Å; W811-H813 PolarHBondContact O-CD2 2.81Å; W811-V833 HydrophobicContact CE3-CB 3.81Å; W811-V833 HydrophobicContact CE3-CG2 3.64Å; W811-V833 HydrophobicContact CZ3-CB 3.76Å; W811-V833 HydrophobicContact CZ3-CG1 4.44Å; W811-V833 HydrophobicContact CZ3-CG2 3.55Å; W811-V833 PolarHBondContact O-N 2.94Å; W811-I913 HydrophobicContact CH2-CG2 3.94Å; W811-I913 HydrophobicContact CZ3-CG2 3.97Å; W811-R914 HydrophobicContact CZ2-CB 4.12Å; W811-R914 HydrophobicContact CZ2-CG 4.29Å; W811-I917 HydrophobicContact CH2-CG1 4.07Å; W811-I917 HydrophobicContact CZ2-CB 4.48Å; W811-I917 HydrophobicContact CZ2-CG1 4.5Å; W811-I917 HydrophobicContact CZ3-CG1 4.12Å; W811-P938 HydrophobicContact CB-CB 3.96Å; W811-P938 HydrophobicContact CG-CB 4.28Å; W811-I939 WeakPolarHBondContact CA-O 3.42Å
812	F	93.8	Very high	78.7	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	24%	0.243	C	C	.	.	B	Isolated β-bridge	trans	-96.1	122.8	171.4	-178.4	-102.6	0	0	0	111	I806 N807 E809 P810 V833 Q835 M879 R941	I806-F812 HydrophobicContact CD1-CD2 3.93Å; I806-F812 HydrophobicContact CD1-CE2 4.18Å; I806-F812 HydrophobicContact CG1-CB 4.35Å; I806-F812 HydrophobicContact CG1-CD2 3.94Å; I806-F812 HydrophobicContact CG1-CE2 4.41Å; I806-F812 HydrophobicContact CG1-CG 4.09Å; N807-F812 WeakPolarHBondContact OD1-CE1 3.35Å; E809-F812 HydrophobicContact CB-CB 3.91Å; E809-F812 PolarHBondContact O-N 3.44Å; P810-F812 VanDerWaalsContact C-N 3.34Å; F812-V833 CarbonylContact C-O 3.52Å; F812-V833 WeakPolarHBondContact CA-O 3.48Å; F812-V833 HydrophobicContact CD2-CB 4.39Å; F812-V833 HydrophobicContact CD2-CG1 4.16Å; F812-Q835 HydrophobicContact CE2-CG 4.35Å; F812-Q835 HydrophobicContact CZ-CG 4.1Å; F812-M879 HydrophobicContact CE2-CE 4.06Å; F812-M879 HydrophobicContact CE2-SD 3.85Å; F812-M879 HydrophobicContact CZ-CE 4.39Å; F812-R941 WeakPolarHBondContact O-CD 3.12Å; F812-R941 WeakPolarHBondContact O-CG 3.07Å; F812-R941 PolarHBondContact O-NH1 3.21Å
813	H	92.2	Very high	81.5	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	23%	0.233	C	C	.	.			trans	-114.1	24.6	-173	-67.2	-130.8	0	0	0	111.9	W811 V815 L816 L832 V833 I939 E945	W811-H813 PolarHBondContact O-CD2 2.81Å; H813-V815 PolarHBondContact O-N 3.41Å; H813-L816 HydrophobicContact CB-CB 4.06Å; H813-L816 HydrophobicContact CB-CD2 3.99Å; H813-L816 WeakPolarHBondContact O-CB 3.49Å; H813-L816 PolarHBondContact O-N 3.07Å; H813-L816 VanDerWaalsContact O-N 3.12Å; H813-L832 HydrophobicContact CB-CD1 4.25Å; H813-V833 PolarHBondContact N-O 3.41Å; H813-I939 PolarHBondContact NE2-O 3.21Å; H813-E945 WeakPolarHBondContact CA-OE1 3.31Å; H813-E945 IonicContact CE1-OE2 3.61Å; H813-E945 IonicContact CG-OE2 2.67Å; H813-E945 IonicContact ND1-OE2 2.68Å; H813-E945 PolarHBondContact ND1-OE2 3.43Å
814	G	89.6	Confident	84.1	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	49.6	-127.8	176.8	0	0	0	0	0	114.1	L816 R834 Q835 V1016 Q1017	G814-L816 PolarHBondContact O-N 2.76Å; G814-R834 CarbonylContact O-C 3.54Å; G814-R834 VanDerWaalsContact O-CA 3.3Å; G814-R834 WeakPolarHBondContact O-CA 3.48Å; G814-R834 VanDerWaalsContact O-CB 3.29Å; G814-R834 WeakPolarHBondContact O-CB 3.3Å; G814-Q835 PolarHBondContact O-N 3.19Å; G814-V1016 CarbonylContact C-O 3.52Å; G814-V1016 WeakPolarHBondContact CA-O 3.3Å; G814-Q1017 VanDerWaalsContact CA-O 3.3Å; G814-Q1017 WeakPolarHBondContact CA-O 3.39Å
815	V	85.9	Confident	86	Confident	5 Å²	5	36.4 Å²	36.4	3%	0.03	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.8	22.9	-176.6	-58.4	0	0	0	0	113.6	H813 Q835 V1016 Y1019 I1021	H813-V815 PolarHBondContact O-N 3.41Å; V815-Q835 HydrophobicContact CG1-CB 4.01Å; V815-V1016 VanDerWaalsContact CG2-O 3.24Å; V815-V1016 WeakPolarHBondContact CG2-O 3.18Å; V815-V1016 PolarHBondContact N-O 3.23Å; V815-Y1019 HydrophobicContact CB-CD2 4.48Å; V815-Y1019 HydrophobicContact CB-CE2 3.79Å; V815-Y1019 HydrophobicContact CG1-CD2 3.87Å; V815-Y1019 HydrophobicContact CG1-CE2 3.37Å; V815-Y1019 HydrophobicContact CG2-CD2 4.39Å; V815-Y1019 HydrophobicContact CG2-CE1 4.27Å; V815-Y1019 HydrophobicContact CG2-CE2 4.05Å; V815-I1021 HydrophobicContact CG2-CD1 4.14Å; V815-I1021 HydrophobicContact CG2-CG1 3.79Å
816	L	85.4	Confident	87.1	Confident	1 Å²	1	40.2 Å²	40.2	1%	0.005	19%	0.192	C	C	.	.			trans	-51.4	127.8	-177.4	-171.8	71.5	0	0	0	112.9	H813 G814 E820 V821 L824 V1016	H813-L816 HydrophobicContact CB-CB 4.06Å; H813-L816 HydrophobicContact CB-CD2 3.99Å; H813-L816 WeakPolarHBondContact O-CB 3.49Å; H813-L816 PolarHBondContact O-N 3.07Å; H813-L816 VanDerWaalsContact O-N 3.12Å; G814-L816 PolarHBondContact O-N 2.76Å; L816-E820 HydrophobicContact CD1-CB 4.1Å; L816-E820 HydrophobicContact CD1-CG 3.75Å; L816-E820 HydrophobicContact CD2-CB 4.44Å; L816-E820 HydrophobicContact CD2-CG 4.21Å; L816-E820 HydrophobicContact CG-CB 4.16Å; L816-E820 HydrophobicContact CG-CG 4.19Å; L816-V821 HydrophobicContact CB-CG2 4.27Å; L816-V821 HydrophobicContact CD2-CG2 3.78Å; L816-V821 HydrophobicContact CG-CG2 4.03Å; L816-L824 HydrophobicContact CD2-CD1 3.69Å; L816-V1016 HydrophobicContact CD1-CB 4.49Å; L816-V1016 HydrophobicContact CD1-CG1 4.34Å; L816-V1016 HydrophobicContact CD1-CG2 4.08Å
817	P	79.8	Confident	87.7	Confident	16 Å²	16	43.4 Å²	43.4	10%	0.104	21%	0.21	C	C	.	.			trans	-63.4	142.9	-179.4	-26.6	37.4	0	0	0	114	A819 E820 V821 R990 L994	P817-A819 VanDerWaalsContact C-N 3.3Å; P817-A819 PolarHBondContact O-N 3.04Å; P817-A819 VanDerWaalsContact O-N 3.11Å; P817-E820 WeakPolarHBondContact O-CB 3.41Å; P817-E820 PolarHBondContact O-N 3.3Å; P817-V821 PolarHBondContact O-N 2.87Å; P817-R990 HydrophobicContact CG-CB 4.27Å; P817-L994 HydrophobicContact CG-CD1 3.77Å
818	R	82.4	Confident	88.6	Confident	129 Å²	129	45.5 Å²	45.5	49%	0.487	22%	0.218	S	C	.	.	H	α-helix	trans	-49.7	-41.2	-175.2	178.2	177.2	166.4	147.7	12.2	114.8	E820 V821 E822 H890	R818-E820 VanDerWaalsContact C-N 3.27Å; R818-E820 PolarHBondContact O-N 2.72Å; R818-V821 WeakPolarHBondContact O-CB 3.42Å; R818-V821 PolarHBondContact O-N 3.42Å; R818-E822 HydrophobicContact CG-CG 4.27Å; R818-E822 IonicContact CZ-OE1 2.68Å; R818-E822 IonicContact NE-OE1 2.74Å; R818-E822 PolarHBondContact NE-OE1 2.88Å; R818-E822 IonicContact NE-OE2 3.82Å; R818-E822 IonicContact NH2-OE1 3.48Å; R818-E822 PolarHBondContact NH2-OE1 3.11Å; R818-E822 VanDerWaalsContact O-CG 3.26Å; R818-E822 WeakPolarHBondContact O-CG 3.47Å; R818-E822 PolarHBondContact O-N 2.95Å; R818-H890 VanDerWaalsContact CZ-NE2 3.26Å; R818-H890 PolarHBondContact NE-NE2 3.19Å; R818-H890 PolarHBondContact NH1-CD2 3.1Å; R818-H890 PolarHBondContact NH2-NE2 2.56Å
819	A	78	Confident	89	Confident	46 Å²	46	38.5 Å²	38.5	38%	0.38	19%	0.188	S	C	.	.	H	α-helix	trans	-65.8	-28.8	-179.3	0	0	0	0	0	113.4	P817 R823 R991	P817-A819 VanDerWaalsContact C-N 3.3Å; P817-A819 PolarHBondContact O-N 3.04Å; P817-A819 VanDerWaalsContact O-N 3.11Å; A819-R823 PolarHBondContact O-N 3.21Å; A819-R823 VanDerWaalsContact O-N 3.12Å; A819-R991 HydrophobicContact CB-CG 4.46Å
820	E	82.6	Confident	89.4	Confident	19 Å²	19	38.1 Å²	38.1	9%	0.089	19%	0.186	C	C	.	.	H	α-helix	trans	-80.8	-35.9	177.1	-171.4	55.6	-157	0	0	110.9	L816 P817 R818 E822 R823 L824 W944	L816-E820 HydrophobicContact CD1-CB 4.1Å; L816-E820 HydrophobicContact CD1-CG 3.75Å; L816-E820 HydrophobicContact CD2-CB 4.44Å; L816-E820 HydrophobicContact CD2-CG 4.21Å; L816-E820 HydrophobicContact CG-CB 4.16Å; L816-E820 HydrophobicContact CG-CG 4.19Å; P817-E820 WeakPolarHBondContact O-CB 3.41Å; P817-E820 PolarHBondContact O-N 3.3Å; R818-E820 VanDerWaalsContact C-N 3.27Å; R818-E820 PolarHBondContact O-N 2.72Å; E820-E822 VanDerWaalsContact C-N 3.3Å; E820-E822 PolarHBondContact O-N 2.81Å; E820-R823 VanDerWaalsContact CD-NE 3.3Å; E820-R823 WeakPolarHBondContact O-CA 3.48Å; E820-R823 WeakPolarHBondContact O-CB 3.2Å; E820-R823 PolarHBondContact O-N 3.31Å; E820-R823 VanDerWaalsContact O-N 3.09Å; E820-R823 IonicContact OE1-CZ 3.19Å; E820-R823 IonicContact OE1-NE 2.74Å; E820-R823 PolarHBondContact OE1-NE 3.2Å; E820-R823 IonicContact OE1-NH2 2.75Å; E820-R823 PolarHBondContact OE1-NH2 2.86Å; E820-R823 IonicContact OE2-NE 3.74Å; E820-R823 PolarHBondContact OE2-NE 3.45Å; E820-R823 VanDerWaalsContact OE2-NE 3.1Å; E820-L824 WeakPolarHBondContact O-CG 3.46Å; E820-L824 PolarHBondContact O-N 2.73Å; E820-W944 HydrophobicContact CG-CH2 4.08Å; E820-W944 WeakPolarHBondContact OE1-CZ2 3.49Å
821	V	89	Confident	89.7	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-57.8	-43.8	167.3	174.4	0	0	0	0	110.9	L816 P817 R818 R823 L824 L825 L832 R834	L816-V821 HydrophobicContact CB-CG2 4.27Å; L816-V821 HydrophobicContact CD2-CG2 3.78Å; L816-V821 HydrophobicContact CG-CG2 4.03Å; P817-V821 PolarHBondContact O-N 2.87Å; R818-V821 WeakPolarHBondContact O-CB 3.42Å; R818-V821 PolarHBondContact O-N 3.42Å; V821-R823 VanDerWaalsContact C-N 3.28Å; V821-R823 PolarHBondContact O-N 3.34Å; V821-L824 PolarHBondContact O-N 2.92Å; V821-L825 HydrophobicContact CG1-CD1 3.71Å; V821-L825 HydrophobicContact CG1-CG 4.32Å; V821-L825 VanDerWaalsContact O-CG 3.27Å; V821-L825 WeakPolarHBondContact O-CG 3.42Å; V821-L825 PolarHBondContact O-N 2.98Å; V821-L825 VanDerWaalsContact O-N 3.08Å; V821-L832 HydrophobicContact CG1-CD1 3.92Å; V821-L832 HydrophobicContact CG1-CD2 4.14Å; V821-L832 HydrophobicContact CG1-CG 4.23Å; V821-L832 HydrophobicContact CG2-CD1 4.19Å; V821-R834 VanDerWaalsContact CG2-CD 3.43Å
822	E	89.4	Confident	89.8	Confident	53 Å²	53	34.3 Å²	34.3	25%	0.248	16%	0.164	C	C	.	.	H	α-helix	trans	-66.3	-29.3	175.7	-69	168.6	148.6	0	0	111.9	R818 E820 H888 H890	R818-E822 HydrophobicContact CG-CG 4.27Å; R818-E822 IonicContact CZ-OE1 2.68Å; R818-E822 IonicContact NE-OE1 2.74Å; R818-E822 PolarHBondContact NE-OE1 2.88Å; R818-E822 IonicContact NE-OE2 3.82Å; R818-E822 IonicContact NH2-OE1 3.48Å; R818-E822 PolarHBondContact NH2-OE1 3.11Å; R818-E822 VanDerWaalsContact O-CG 3.26Å; R818-E822 WeakPolarHBondContact O-CG 3.47Å; R818-E822 PolarHBondContact O-N 2.95Å; E820-E822 VanDerWaalsContact C-N 3.3Å; E820-E822 PolarHBondContact O-N 2.81Å; E822-H888 HydrophobicContact CG-CB 3.94Å; E822-H888 PolarHBondContact O-CE1 3.07Å; E822-H890 IonicContact OE1-NE2 2.75Å
823	R	85.8	Confident	89.9	Confident	112 Å²	112	34.3 Å²	34.3	42%	0.423	16%	0.164	S	C	.	.	H	α-helix	trans	-72.9	-30.9	172.6	-161.1	-172.4	70.4	74.8	2.8	113.4	A819 E820 V821 Q826	A819-R823 PolarHBondContact O-N 3.21Å; A819-R823 VanDerWaalsContact O-N 3.12Å; E820-R823 VanDerWaalsContact CD-NE 3.3Å; E820-R823 WeakPolarHBondContact O-CA 3.48Å; E820-R823 WeakPolarHBondContact O-CB 3.2Å; E820-R823 PolarHBondContact O-N 3.31Å; E820-R823 VanDerWaalsContact O-N 3.09Å; E820-R823 IonicContact OE1-CZ 3.19Å; E820-R823 IonicContact OE1-NE 2.74Å; E820-R823 PolarHBondContact OE1-NE 3.2Å; E820-R823 IonicContact OE1-NH2 2.75Å; E820-R823 PolarHBondContact OE1-NH2 2.86Å; E820-R823 IonicContact OE2-NE 3.74Å; E820-R823 PolarHBondContact OE2-NE 3.45Å; E820-R823 VanDerWaalsContact OE2-NE 3.1Å; V821-R823 VanDerWaalsContact C-N 3.28Å; V821-R823 PolarHBondContact O-N 3.34Å; R823-Q826 PolarHBondContact O-NE2 2.85Å
824	L	90	Very high	89.8	Confident	27 Å²	27	35 Å²	35	14%	0.141	17%	0.166	C	C	.	.	H	α-helix	trans	-83.8	-31	-178.6	-71.3	174.8	0	0	0	113.8	L816 E820 V821 L832 I939	L816-L824 HydrophobicContact CD2-CD1 3.69Å; E820-L824 WeakPolarHBondContact O-CG 3.46Å; E820-L824 PolarHBondContact O-N 2.73Å; V821-L824 PolarHBondContact O-N 2.92Å; L824-L832 HydrophobicContact CB-CD2 4.38Å; L824-L832 HydrophobicContact CD1-CD2 4.3Å; L824-I939 HydrophobicContact CB-CG2 4.34Å
825	L	94.3	Very high	89.7	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	17%	0.169	C	C	.	.			trans	-93.6	99.6	-177.3	-59.3	177.6	0	0	0	110.6	V821 D830 L832 F884 H888 I939	V821-L825 HydrophobicContact CG1-CD1 3.71Å; V821-L825 HydrophobicContact CG1-CG 4.32Å; V821-L825 VanDerWaalsContact O-CG 3.27Å; V821-L825 WeakPolarHBondContact O-CG 3.42Å; V821-L825 PolarHBondContact O-N 2.98Å; V821-L825 VanDerWaalsContact O-N 3.08Å; L825-D830 HydrophobicContact CD2-CB 4.1Å; L825-L832 HydrophobicContact CD1-CG 4.41Å; L825-L832 HydrophobicContact CD2-CD2 3.94Å; L825-L832 HydrophobicContact CD2-CG 4.05Å; L825-L832 HydrophobicContact CG-CD2 4.17Å; L825-L832 HydrophobicContact CG-CG 4.44Å; L825-F884 HydrophobicContact CB-CB 4.03Å; L825-F884 VanDerWaalsContact O-CD2 3.26Å; L825-F884 WeakPolarHBondContact O-CD2 3.45Å; L825-H888 PolarHBondContact O-CE1 3.19Å; L825-H888 VanDerWaalsContact O-CE1 3.3Å; L825-I939 HydrophobicContact CD2-CB 4.37Å; L825-I939 HydrophobicContact CD2-CG1 3.77Å
826	Q	91.9	Very high	89.3	Confident	125 Å²	125	37.5 Å²	37.5	58%	0.584	18%	0.181	S	C	*	.			trans	-116.4	-28.8	-166.7	-61.2	-175.1	6.6	0	0	114.7	R823 D830	R823-Q826 PolarHBondContact O-NE2 2.85Å; Q826-D830 PolarHBondContact N-OD2 2.97Å; Q826-D830 VanDerWaalsContact N-OD2 3.17Å
827	N	95.4	Very high	88.3	Confident	101 Å²	101	38.4 Å²	38.4	54%	0.54	19%	0.188	S	C	.	.	S	Bend	trans	-111.6	156.7	-174.7	-46.6	-89.1	0	0	0	111.3	G829 D830 F884	N827-G829 PolarHBondContact O-N 2.96Å; N827-G829 VanDerWaalsContact O-N 3.15Å; N827-D830 WeakPolarHBondContact CB-OD2 3.49Å; N827-D830 PolarHBondContact N-OD2 3.29Å; N827-D830 PolarHBondContact ND2-OD2 2.77Å; N827-D830 WeakPolarHBondContact O-CB 3.38Å; N827-D830 PolarHBondContact O-N 3.22Å; N827-F884 WeakPolarHBondContact O-CB 3.13Å; N827-F884 WeakPolarHBondContact O-CD1 3.3Å
828	Q	95.1	Very high	87	Confident	82 Å²	82	44 Å²	44	38%	0.383	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.5	117.3	178.5	-68.7	-81.2	23.3	0	0	111.1	W885 H886	Q828-W885 VanDerWaalsContact OE1-CA 3.29Å; Q828-H886 PolarHBondContact NE2-CD2 3.32Å; Q828-H886 PolarHBondContact NE2-CE1 2.94Å; Q828-H886 PolarHBondContact NE2-ND1 3.43Å; Q828-H886 PolarHBondContact NE2-NE2 3.37Å
829	G	94.1	Very high	85	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	89.5	2.9	-178.5	0	0	0	0	0	115	N827 F884 C934 V936 T937	N827-G829 PolarHBondContact O-N 2.96Å; N827-G829 VanDerWaalsContact O-N 3.15Å; G829-F884 PolarHBondContact N-O 2.68Å; G829-C934 WeakPolarHBondContact CA-O 3.37Å; G829-V936 PolarHBondContact O-N 2.94Å; G829-T937 PolarHBondContact O-N 3.03Å
830	D	97.7	Very high	82.6	Confident	4 Å²	4	48.1 Å²	48.1	2%	0.021	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.2	134	165.2	-72.3	-5.6	0	0	0	109.7	L825 Q826 N827 V883 F884 T937 I939	L825-D830 HydrophobicContact CD2-CB 4.1Å; Q826-D830 PolarHBondContact N-OD2 2.97Å; Q826-D830 VanDerWaalsContact N-OD2 3.17Å; N827-D830 WeakPolarHBondContact CB-OD2 3.49Å; N827-D830 PolarHBondContact N-OD2 3.29Å; N827-D830 PolarHBondContact ND2-OD2 2.77Å; N827-D830 WeakPolarHBondContact O-CB 3.38Å; N827-D830 PolarHBondContact O-N 3.22Å; D830-V883 CarbonylContact O-C 3.37Å; D830-V883 WeakPolarHBondContact O-CA 3.49Å; D830-F884 PolarHBondContact O-N 3.39Å; D830-T937 WeakPolarHBondContact CA-O 3.07Å; D830-T937 WeakPolarHBondContact OD1-CB 3.46Å; D830-T937 PolarHBondContact OD1-OG1 3.11Å; D830-I939 HydrophobicContact CB-CD1 4.01Å; D830-I939 HydrophobicContact CB-CG1 3.98Å
831	F	97.4	Very high	80.2	Confident	0 Å²	0	50 Å²	50	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	160.7	179.4	79.1	-88.1	0	0	0	114.5	L881 S882 V883 I917 M921 L935 T937 P938 I939	F831-L881 HydrophobicContact CB-CD1 4.14Å; F831-L881 HydrophobicContact CD2-CD1 3.71Å; F831-L881 HydrophobicContact CG-CD1 4.28Å; F831-S882 CarbonylContact C-O 3.55Å; F831-S882 WeakPolarHBondContact CA-O 3.23Å; F831-S882 WeakPolarHBondContact CB-O 3.1Å; F831-V883 HydrophobicContact CB-CB 4.37Å; F831-V883 HydrophobicContact CB-CG1 4.27Å; F831-V883 HydrophobicContact CB-CG2 4Å; F831-I917 HydrophobicContact CD2-CD1 4.4Å; F831-I917 HydrophobicContact CE2-CD1 4.04Å; F831-I917 HydrophobicContact CE2-CG2 3.49Å; F831-I917 VanDerWaalsContact CE2-CG2 3.49Å; F831-I917 HydrophobicContact CZ-CG2 3.48Å; F831-I917 VanDerWaalsContact CZ-CG2 3.48Å; F831-M921 HydrophobicContact CE1-CE 4.43Å; F831-M921 HydrophobicContact CE1-CG 3.88Å; F831-M921 HydrophobicContact CE1-SD 3.75Å; F831-M921 HydrophobicContact CZ-CG 3.97Å; F831-M921 HydrophobicContact CZ-SD 3.52Å; F831-M921 VanDerWaalsContact CZ-SD 3.52Å; F831-L935 HydrophobicContact CB-CD2 3.8Å; F831-L935 HydrophobicContact CD1-CB 3.84Å; F831-L935 HydrophobicContact CD1-CD1 4.42Å; F831-L935 HydrophobicContact CD1-CD2 3.96Å; F831-L935 HydrophobicContact CD1-CG 4.29Å; F831-L935 HydrophobicContact CD2-CD1 4.28Å; F831-L935 HydrophobicContact CD2-CD2 4.33Å; F831-L935 HydrophobicContact CE1-CB 3.88Å; F831-L935 HydrophobicContact CE1-CD1 4.37Å; F831-L935 HydrophobicContact CE2-CD1 4.26Å; F831-L935 HydrophobicContact CG-CB 4.46Å; F831-L935 HydrophobicContact CG-CD1 4.37Å; F831-L935 HydrophobicContact CG-CD2 3.77Å; F831-L935 HydrophobicContact CG-CG 4.43Å; F831-L935 HydrophobicContact CZ-CD1 4.29Å; F831-T937 VanDerWaalsContact CD1-O 3.24Å; F831-T937 WeakPolarHBondContact CD1-O 3.32Å; F831-T937 PolarHBondContact N-O 3.2Å; F831-P938 HydrophobicContact CE1-CB 3.9Å; F831-P938 HydrophobicContact CE2-CB 4.3Å; F831-P938 HydrophobicContact CZ-CB 3.62Å; F831-I939 PolarHBondContact O-N 3.48Å
832	L	96.9	Very high	77.3	Confident	0 Å²	0	54 Å²	54	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	161.9	169	62.1	84	0	0	0	111.2	H813 V821 L824 L825 R834 S882	H813-L832 HydrophobicContact CB-CD1 4.25Å; V821-L832 HydrophobicContact CG1-CD1 3.92Å; V821-L832 HydrophobicContact CG1-CD2 4.14Å; V821-L832 HydrophobicContact CG1-CG 4.23Å; V821-L832 HydrophobicContact CG2-CD1 4.19Å; L824-L832 HydrophobicContact CB-CD2 4.38Å; L824-L832 HydrophobicContact CD1-CD2 4.3Å; L825-L832 HydrophobicContact CD1-CG 4.41Å; L825-L832 HydrophobicContact CD2-CD2 3.94Å; L825-L832 HydrophobicContact CD2-CG 4.05Å; L825-L832 HydrophobicContact CG-CD2 4.17Å; L825-L832 HydrophobicContact CG-CG 4.44Å; L832-R834 HydrophobicContact CD1-CB 4.19Å; L832-R834 HydrophobicContact CD1-CG 4.27Å; L832-S882 PolarHBondContact N-O 3.47Å; L832-S882 PolarHBondContact O-N 3.37Å
833	V	94.6	Very high	74.3	Confident	0 Å²	0	62 Å²	62	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	142.6	173.5	-179.2	0	0	0	0	110.2	W811 F812 H813 V880 L881 L893 I913 I917	W811-V833 HydrophobicContact CE3-CB 3.81Å; W811-V833 HydrophobicContact CE3-CG2 3.64Å; W811-V833 HydrophobicContact CZ3-CB 3.76Å; W811-V833 HydrophobicContact CZ3-CG1 4.44Å; W811-V833 HydrophobicContact CZ3-CG2 3.55Å; W811-V833 PolarHBondContact O-N 2.94Å; F812-V833 CarbonylContact C-O 3.52Å; F812-V833 WeakPolarHBondContact CA-O 3.48Å; F812-V833 HydrophobicContact CD2-CB 4.39Å; F812-V833 HydrophobicContact CD2-CG1 4.16Å; H813-V833 PolarHBondContact N-O 3.41Å; V833-V880 WeakPolarHBondContact CA-O 3.22Å; V833-L881 HydrophobicContact CG2-CB 4.49Å; V833-L881 HydrophobicContact CG2-CD1 4.05Å; V833-L893 HydrophobicContact CG1-CD1 4.14Å; V833-I913 HydrophobicContact CG1-CG2 4.37Å; V833-I913 HydrophobicContact CG2-CG2 4.38Å; V833-I917 HydrophobicContact CG2-CD1 3.9Å; V833-I917 HydrophobicContact CG2-CG1 4.26Å
834	R	91.6	Very high	71.7	Confident	14 Å²	14	62.4 Å²	62.4	5%	0.053	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	163.2	-177.5	65.3	-175.8	-175	79.6	4	111.9	G814 V821 L832 M879 V880 S882	G814-R834 CarbonylContact O-C 3.54Å; G814-R834 VanDerWaalsContact O-CA 3.3Å; G814-R834 WeakPolarHBondContact O-CA 3.48Å; G814-R834 VanDerWaalsContact O-CB 3.29Å; G814-R834 WeakPolarHBondContact O-CB 3.3Å; V821-R834 VanDerWaalsContact CG2-CD 3.43Å; L832-R834 HydrophobicContact CD1-CB 4.19Å; L832-R834 HydrophobicContact CD1-CG 4.27Å; R834-M879 CarbonylContact O-C 3.59Å; R834-V880 HydrophobicContact CG-CB 4.19Å; R834-V880 PolarHBondContact N-O 2.8Å; R834-V880 PolarHBondContact O-N 2.82Å; R834-S882 PolarHBondContact NE-OG 3.02Å; R834-S882 VanDerWaalsContact NE-OG 3.1Å
835	Q	86.9	Confident	68.7	Low	12 Å²	12	67.7 Å²	67.7	6%	0.056	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	156.3	169.3	-69.3	178.1	-9.5	0	0	111.9	F812 G814 V815 L877 R878 M879	F812-Q835 HydrophobicContact CE2-CG 4.35Å; F812-Q835 HydrophobicContact CZ-CG 4.1Å; G814-Q835 PolarHBondContact O-N 3.19Å; V815-Q835 HydrophobicContact CG1-CB 4.01Å; Q835-L877 HydrophobicContact CB-CB 4.49Å; Q835-R878 CarbonylContact C-O 3.53Å; Q835-R878 VanDerWaalsContact CA-O 3.3Å; Q835-R878 WeakPolarHBondContact CA-O 3.38Å; Q835-M879 HydrophobicContact CG-CE 4.13Å; Q835-M879 HydrophobicContact CG-SD 3.58Å; Q835-M879 VanDerWaalsContact CG-SD 3.58Å
836	T	76.8	Confident	65.4	Low	46 Å²	46	75.3 Å²	75.3	28%	0.282	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	140	171.5	-163.7	0	0	0	0	112.3	L877 R878 V880	T836-L877 WeakPolarHBondContact O-CA 3.13Å; T836-R878 HydrophobicContact CG2-CB 4.21Å; T836-R878 PolarHBondContact N-O 3.41Å; T836-R878 PolarHBondContact O-N 3.37Å; T836-V880 HydrophobicContact CG2-CG2 3.56Å
837	S	65.6	Low	62.3	Low	21 Å²	21	72.4 Å²	72.4	15%	0.147	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	133.5	172	57.3	0	0	0	0	111.3	R839 R990	S837-R839 PolarHBondContact O-N 3.08Å; S837-R990 PolarHBondContact OG-NH1 3.44Å; S837-R990 PolarHBondContact OG-NH2 3.27Å
838	K	50.9	Low	58.9	Low	134 Å²	134	75.5 Å²	75.5	58%	0.583	42%	0.416	S	S	*	.	P	Polyproline II helix	trans	-72	123.1	172.1	-168.1	176.2	-177.7	179.4	0	110.5	V876	K838-V876 PolarHBondContact N-O 2.99Å
839	R	40.2	Very low	55.5	Low	144 Å²	144	81.1 Å²	81.1	54%	0.543	43%	0.433	S	S	.	.	P	Polyproline II helix	trans	-63.7	137.4	163.7	-98	-173.7	172.2	156.4	4.9	108.3	S837 S841 D988	S837-R839 PolarHBondContact O-N 3.08Å; R839-S841 PolarHBondContact O-N 2.81Å; R839-D988 IonicContact CZ-OD2 3.79Å; R839-D988 IonicContact NH2-OD2 3.23Å; R839-D988 PolarHBondContact NH2-OD2 2.84Å
840	S	29.1	Very low	52.2	Low	117 Å²	117	89.3 Å²	89.3	82%	0.818	48%	0.477	S	S	*	.			trans	-76.4	43.7	167.6	47.4	0	0	0	0	112	G842	S840-G842 PolarHBondContact O-N 2.64Å
841	S	31.1	Very low	48.8	Very low	57 Å²	57	92.3 Å²	92.3	40%	0.399	51%	0.509	S	S	.	.			trans	-80.2	91.9	174.6	47.3	0	0	0	0	110.3	R839 R843 D844	R839-S841 PolarHBondContact O-N 2.81Å; S841-R843 PolarHBondContact O-N 3Å; S841-D844 VanDerWaalsContact CB-OD2 3.3Å; S841-D844 WeakPolarHBondContact CB-OD2 3.16Å; S841-D844 PolarHBondContact OG-OD2 3.08Å
842	G	28	Very low	45.6	Very low	84 Å²	84	98.6 Å²	98.6	87%	0.866	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	63.1	176.6	0	0	0	0	0	113.3	S840	S840-G842 PolarHBondContact O-N 2.64Å
843	R	27.3	Very low	42.3	Very low	221 Å²	221	106.5 Å²	106.5	83%	0.834	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-154	-15.6	175.7	-136.6	176.2	-73.4	-179.4	-1.7	115.8	S841 T845	S841-R843 PolarHBondContact O-N 3Å; R843-T845 PolarHBondContact O-N 2.88Å
844	D	29.9	Very low	39	Very low	122 Å²	122	109.7 Å²	109.7	65%	0.652	62%	0.623	S	S	*	*			trans	-98	25.2	-164.5	-46.5	-45	0	0	0	114.8	S841	S841-D844 VanDerWaalsContact CB-OD2 3.3Å; S841-D844 WeakPolarHBondContact CB-OD2 3.16Å; S841-D844 PolarHBondContact OG-OD2 3.08Å
845	T	28.4	Very low	36.1	Very low	137 Å²	137	115.9 Å²	115.9	84%	0.84	66%	0.657	S	S	*	*	S	Bend	trans	-119.1	29	-179.7	59.4	0	0	0	0	113.5	R843	R843-T845 PolarHBondContact O-N 2.88Å
846	I	25.2	Very low	33.2	Very low	161 Å²	161	122.6 Å²	122.6	83%	0.826	69%	0.692	S	S	*	*	S	Bend	trans	-133.9	117.7	172.2	-59.7	-179.9	0	0	0	108.7
847	G	25.5	Very low	30.8	Very low	64 Å²	64	127.1 Å²	127.1	66%	0.66	71%	0.713	S	S	*	*			trans	104.2	82.7	164.7	0	0	0	0	0	116.7
848	H	25.1	Very low	28.9	Very low	165 Å²	165	133.8 Å²	133.8	76%	0.764	75%	0.748	S	S	*	*				-176.6	74.3	126.3	-103.9	90.4	0	0	0	113.5
849	W	24	Very low	27.6	Very low	200 Å²	200	129.7 Å²	129.7	76%	0.758	74%	0.743	S	S	*	*			trans	-146.8	89	154.5	-88.5	115.8	0	0	0	110.4
850	N	23.5	Very low	26.9	Very low	172 Å²	172	127.5 Å²	127.5	92%	0.92	74%	0.742	S	S	*	*			trans	-81.3	116	152.7	-78.1	-13.8	0	0	0	106.5
851	G	28	Very low	26.8	Very low	67 Å²	67	130.2 Å²	130.2	69%	0.691	74%	0.742	S	S	*	*			trans	-165.5	118.9	178.8	0	0	0	0	0	109.5
852	T	29.5	Very low	26.7	Very low	133 Å²	133	131.7 Å²	131.7	82%	0.816	75%	0.745	S	S	*	*			trans	-89.6	129.3	-174.8	47.6	0	0	0	0	111.9
853	N	26.7	Very low	26.6	Very low	165 Å²	165	135 Å²	135	88%	0.882	74%	0.738	S	S	*	*			trans	28.4	117.1	150.4	-56.9	-3.7	0	0	0	119.1
854	G	26.7	Very low	26.6	Very low	67 Å²	67	129.8 Å²	129.8	69%	0.691	73%	0.731	S	S	*	*			trans	162.5	115.3	155	0	0	0	0	0	112.7
855	D	30.8	Very low	26.4	Very low	144 Å²	144	128.2 Å²	128.2	77%	0.77	72%	0.721	S	S	*	*			trans	51.3	111.4	157.3	-50.7	-30.2	0	0	0	118
856	L	24.6	Very low	26.3	Very low	153 Å²	153	124.2 Å²	124.2	80%	0.801	70%	0.695	S	S	*	*				56.8	119	80.7	-59.9	163	0	0	0	110.6
857	I	26.1	Very low	26.6	Very low	141 Å²	141	117.9 Å²	117.9	72%	0.723	66%	0.662	S	S	*	*				-161.8	146.1	57.1	-77.2	177.8	0	0	0	111.1
858	N	25.6	Very low	26.8	Very low	162 Å²	162	120.7 Å²	120.7	87%	0.866	66%	0.657	S	S	*	*			trans	64.6	145.4	162.4	-69.6	-13.2	0	0	0	121.2
859	G	25.1	Very low	27.1	Very low	47 Å²	47	118 Å²	118	49%	0.485	65%	0.648	S	S	.	*			trans	118	88.1	143.4	0	0	0	0	0	115.9
860	N	25.1	Very low	27.4	Very low	98 Å²	98	115.2 Å²	115.2	52%	0.524	64%	0.643	S	S	.	*			trans	33.5	133.7	158.9	-59.6	-5.9	0	0	0	120.1	E901	N860-E901 HydrophobicContact CB-CG 3.62Å; N860-E901 VanDerWaalsContact CB-OE1 3.28Å; N860-E901 WeakPolarHBondContact CB-OE1 3.49Å
861	H	27.8	Very low	28	Very low	175 Å²	175	109.3 Å²	109.3	81%	0.81	61%	0.611	S	S	*	*			trans	-126.1	65.9	163.7	-69.2	-15.9	0	0	0	110.3	E863	H861-E863 PolarHBondContact O-N 2.85Å
862	N	27.6	Very low	28.3	Very low	87 Å²	87	116 Å²	116	47%	0.465	63%	0.627	S	S	.	*			trans	-76.9	59.7	165.6	-77.5	-21.1	0	0	0	109.5	T864 T899 E901	N862-T864 PolarHBondContact O-N 3.02Å; N862-T899 HydrophobicContact CB-CG2 4.35Å; N862-T899 PolarHBondContact ND2-O 3.3Å; N862-T899 VanDerWaalsContact O-CG2 3.23Å; N862-T899 WeakPolarHBondContact O-CG2 3.49Å; N862-E901 WeakPolarHBondContact CB-OE1 3.45Å; N862-E901 PolarHBondContact N-OE1 3.42Å
863	E	27.3	Very low	28.6	Very low	154 Å²	154	113.1 Å²	113.1	72%	0.72	61%	0.607	S	S	*	*			trans	-73.8	46.8	175	-83.7	-134.3	114	0	0	112.5	H861	H861-E863 PolarHBondContact O-N 2.85Å
864	T	26.8	Very low	29	Very low	112 Å²	112	107.9 Å²	107.9	69%	0.687	59%	0.592	S	S	*	*	S	Bend	trans	-150.6	146.9	165.5	-63.5	0	0	0	0	107.3	N862	N862-T864 PolarHBondContact O-N 3.02Å
865	I	26	Very low	29.8	Very low	88 Å²	88	106.7 Å²	106.7	45%	0.451	57%	0.571	S	S	.	*			trans	73.8	77.8	-173.4	-31	168.1	0	0	0	113.3	K868 E898 T899	I865-K868 HydrophobicContact CG2-CD 4.26Å; I865-E898 HydrophobicContact CB-CB 4.45Å; I865-E898 HydrophobicContact CG2-CB 3.85Å; I865-E898 HydrophobicContact CG2-CG 4.33Å; I865-E898 CarbonylContact O-C 3.59Å; I865-E898 VanDerWaalsContact O-CB 3.24Å; I865-E898 WeakPolarHBondContact O-CB 3.44Å; I865-T899 VanDerWaalsContact O-CG2 3.23Å; I865-T899 WeakPolarHBondContact O-CG2 3.22Å
866	L	25.6	Very low	30.9	Very low	54 Å²	54	103.9 Å²	103.9	28%	0.283	56%	0.559	S	S	.	*			trans	-136.5	128.9	161.5	-78.3	178.7	0	0	0	111.7	G895 E898 T899	L866-G895 VanDerWaalsContact CD2-C 3.47Å; L866-G895 WeakPolarHBondContact CD2-O 3.46Å; L866-E898 HydrophobicContact CD2-CB 4.44Å; L866-T899 HydrophobicContact CD1-CG2 4.1Å; L866-T899 HydrophobicContact CD2-CG2 3.47Å; L866-T899 VanDerWaalsContact CD2-CG2 3.47Å; L866-T899 HydrophobicContact CG-CG2 3.5Å; L866-T899 VanDerWaalsContact CG-CG2 3.5Å
867	N	32.5	Very low	32.9	Very low	27 Å²	27	96.9 Å²	96.9	14%	0.144	52%	0.522	C	S	.	.			trans	61.9	67.7	-179.7	-50.2	-43.3	0	0	0	114.2	D869 L877 E898	N867-D869 PolarHBondContact O-N 3.14Å; N867-L877 WeakPolarHBondContact CB-O 3.44Å; N867-L877 PolarHBondContact ND2-O 2.85Å; N867-E898 VanDerWaalsContact CA-OE1 3.3Å; N867-E898 WeakPolarHBondContact CA-OE1 3.37Å; N867-E898 PolarHBondContact N-OE1 3.42Å; N867-E898 PolarHBondContact N-OE2 3.01Å
868	K	27.8	Very low	35.3	Very low	124 Å²	124	93.8 Å²	93.8	54%	0.539	50%	0.502	S	S	.	.			trans	-80.4	42.7	165.9	-84.9	-168.9	168	-172.7	0	113.9	I865 H870 E898	I865-K868 HydrophobicContact CG2-CD 4.26Å; K868-H870 WeakPolarHBondContact CE-NE2 3.49Å; K868-H870 PolarHBondContact O-N 2.98Å; K868-E898 VanDerWaalsContact N-CD 3.29Å; K868-E898 PolarHBondContact N-OE1 2.83Å; K868-E898 PolarHBondContact N-OE2 3.47Å
869	D	32.1	Very low	38.3	Very low	107 Å²	107	86.5 Å²	86.5	57%	0.572	46%	0.462	S	S	*	.			trans	-69.5	80.4	148.3	-84.9	-36.4	0	0	0	108.1	N867 N871	N867-D869 PolarHBondContact O-N 3.14Å; D869-N871 VanDerWaalsContact C-N 3.27Å; D869-N871 PolarHBondContact O-N 3.27Å; D869-N871 PolarHBondContact O-ND2 2.96Å
870	H	30.9	Very low	41.5	Very low	142 Å²	142	84.5 Å²	84.5	66%	0.657	44%	0.441	S	S	*	.			trans	-68	83	-179.8	-86.6	-50.2	0	0	0	111.1	K868	K868-H870 WeakPolarHBondContact CE-NE2 3.49Å; K868-H870 PolarHBondContact O-N 2.98Å
871	N	36.7	Very low	44.9	Very low	48 Å²	48	79.9 Å²	79.9	26%	0.257	42%	0.416	S	S	.	.			trans	-59.8	150.7	162.7	-76.2	-81.7	0	0	0	110.4	D869 D873 G874	D869-N871 VanDerWaalsContact C-N 3.27Å; D869-N871 PolarHBondContact O-N 3.27Å; D869-N871 PolarHBondContact O-ND2 2.96Å; N871-D873 WeakPolarHBondContact CB-OD1 3.47Å; N871-D873 PolarHBondContact O-N 2.9Å; N871-G874 PolarHBondContact O-N 2.85Å
872	M	32.9	Very low	48.1	Very low	207 Å²	207	71.5 Å²	71.5	100%	1.02	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	4.6	-171.7	-69.6	-79.1	-177	0	0	115.9
873	D	36.8	Very low	51.4	Low	73 Å²	73	67.4 Å²	67.4	39%	0.39	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.4	-13.1	-175.6	73	-30.6	0	0	0	114.3	N871 T875 V982	N871-D873 WeakPolarHBondContact CB-OD1 3.47Å; N871-D873 PolarHBondContact O-N 2.9Å; D873-T875 PolarHBondContact OD1-N 2.79Å; D873-T875 WeakPolarHBondContact OD2-CB 3.08Å; D873-T875 PolarHBondContact OD2-OG1 3.44Å; D873-V982 HydrophobicContact CB-CG1 4.12Å; D873-V982 WeakPolarHBondContact OD2-CG1 3.38Å
874	G	33.7	Very low	54.7	Low	56 Å²	56	62.1 Å²	62.1	58%	0.577	33%	0.33	S	S	*	.			trans	79.5	15.6	-176.5	0	0	0	0	0	115.4	N871 V876	N871-G874 PolarHBondContact O-N 2.85Å; G874-V876 PolarHBondContact O-N 2.88Å
875	T	43.9	Very low	57.9	Low	41 Å²	41	59.1 Å²	59.1	25%	0.252	31%	0.306	S	S	.	.	P	Polyproline II helix	trans	-75.6	116.1	178.8	-72.1	0	0	0	0	111.9	D873 L877	D873-T875 PolarHBondContact OD1-N 2.79Å; D873-T875 WeakPolarHBondContact OD2-CB 3.08Å; D873-T875 PolarHBondContact OD2-OG1 3.44Å; T875-L877 HydrophobicContact CG2-CD2 4.25Å; T875-L877 PolarHBondContact O-N 3.14Å
876	V	54.8	Low	61	Low	86 Å²	86	61.2 Å²	61.2	52%	0.521	31%	0.314	S	S	.	.	P	Polyproline II helix	trans	-72.6	125.6	173.6	-178	0	0	0	0	110.7	K838 G874	K838-V876 PolarHBondContact N-O 2.99Å; G874-V876 PolarHBondContact O-N 2.88Å
877	L	66.4	Low	64.1	Low	5 Å²	5	60 Å²	60	3%	0.026	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	138.7	176.8	-60.1	177	0	0	0	110.5	Q835 T836 N867 T875 Y1019	Q835-L877 HydrophobicContact CB-CB 4.49Å; T836-L877 WeakPolarHBondContact O-CA 3.13Å; N867-L877 WeakPolarHBondContact CB-O 3.44Å; N867-L877 PolarHBondContact ND2-O 2.85Å; T875-L877 HydrophobicContact CG2-CD2 4.25Å; T875-L877 PolarHBondContact O-N 3.14Å; L877-Y1019 HydrophobicContact CD1-CD2 4.44Å; L877-Y1019 HydrophobicContact CD1-CE2 4.37Å; L877-Y1019 HydrophobicContact CD2-CE2 3.96Å
878	R	76.8	Confident	66.9	Low	76 Å²	76	62 Å²	62	29%	0.287	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	136.3	173.5	-78.2	-177.1	161.4	-165.2	-12.5	110.1	Q835 T836	Q835-R878 CarbonylContact C-O 3.53Å; Q835-R878 VanDerWaalsContact CA-O 3.3Å; Q835-R878 WeakPolarHBondContact CA-O 3.38Å; T836-R878 HydrophobicContact CG2-CB 4.21Å; T836-R878 PolarHBondContact N-O 3.41Å; T836-R878 PolarHBondContact O-N 3.37Å
879	M	88.9	Confident	70	Confident	9 Å²	9	60.3 Å²	60.3	4%	0.044	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	141.8	168.7	-68.5	-63.9	-166.6	0	0	110.3	I806 F812 R834 Q835 L893 W903 I913	I806-M879 HydrophobicContact CD1-CE 4.14Å; I806-M879 HydrophobicContact CG2-CE 4.41Å; F812-M879 HydrophobicContact CE2-CE 4.06Å; F812-M879 HydrophobicContact CE2-SD 3.85Å; F812-M879 HydrophobicContact CZ-CE 4.39Å; R834-M879 CarbonylContact O-C 3.59Å; Q835-M879 HydrophobicContact CG-CE 4.13Å; Q835-M879 HydrophobicContact CG-SD 3.58Å; Q835-M879 VanDerWaalsContact CG-SD 3.58Å; M879-L893 HydrophobicContact CB-CB 3.98Å; M879-L893 HydrophobicContact CB-CD1 4.19Å; M879-L893 HydrophobicContact CB-CG 4.43Å; M879-L893 PolarHBondContact O-N 3.18Å; M879-W903 HydrophobicContact CB-CZ3 4.1Å; M879-W903 HydrophobicContact CG-CH2 3.81Å; M879-W903 HydrophobicContact CG-CZ3 3.89Å; M879-I913 HydrophobicContact CB-CD1 4.23Å; M879-I913 HydrophobicContact CE-CD1 4.36Å; M879-I913 HydrophobicContact CG-CD1 3.87Å; M879-I913 HydrophobicContact SD-CD1 4.32Å
880	V	92.2	Very high	72.9	Confident	6 Å²	6	57.5 Å²	57.5	4%	0.036	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	118.3	-174.8	179.8	0	0	0	0	110.1	V833 R834 T836 H890 F891 I892	V833-V880 WeakPolarHBondContact CA-O 3.22Å; R834-V880 HydrophobicContact CG-CB 4.19Å; R834-V880 PolarHBondContact N-O 2.8Å; R834-V880 PolarHBondContact O-N 2.82Å; T836-V880 HydrophobicContact CG2-CG2 3.56Å; V880-H890 HydrophobicContact CG1-CB 3.84Å; V880-F891 CarbonylContact C-O 3.34Å; V880-F891 VanDerWaalsContact CA-O 3.25Å; V880-F891 WeakPolarHBondContact CA-O 3.48Å; V880-F891 WeakPolarHBondContact CG1-O 3.41Å; V880-I892 HydrophobicContact CG2-CG1 4.46Å
881	L	95.1	Very high	75.8	Confident	0 Å²	0	52 Å²	52	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	122.3	164.8	171.2	56.4	0	0	0	108.7	F831 V833 V883 H890 F891 L893 L905 I917 V927 L935	F831-L881 HydrophobicContact CB-CD1 4.14Å; F831-L881 HydrophobicContact CD2-CD1 3.71Å; F831-L881 HydrophobicContact CG-CD1 4.28Å; V833-L881 HydrophobicContact CG2-CB 4.49Å; V833-L881 HydrophobicContact CG2-CD1 4.05Å; L881-V883 HydrophobicContact CD1-CG2 4Å; L881-V883 HydrophobicContact CD2-CG2 4.49Å; L881-V883 HydrophobicContact CG-CG2 3.9Å; L881-H890 CarbonylContact O-C 3.45Å; L881-H890 WeakPolarHBondContact O-CA 3.26Å; L881-F891 HydrophobicContact CB-CB 4.48Å; L881-F891 PolarHBondContact N-O 3.39Å; L881-F891 PolarHBondContact O-N 3.07Å; L881-L893 HydrophobicContact CB-CD2 4.09Å; L881-L893 HydrophobicContact CB-CG 4.39Å; L881-L905 HydrophobicContact CD2-CD1 4.15Å; L881-I917 HydrophobicContact CD1-CD1 3.8Å; L881-I917 HydrophobicContact CD2-CD1 4.03Å; L881-I917 HydrophobicContact CG-CD1 4.48Å; L881-V927 HydrophobicContact CD2-CG1 3.77Å; L881-V927 HydrophobicContact CD2-CG2 3.97Å; L881-L935 HydrophobicContact CD1-CD1 4.45Å; L881-L935 HydrophobicContact CD1-CD2 4.21Å; L881-L935 HydrophobicContact CD2-CD1 4.2Å; L881-L935 HydrophobicContact CD2-CD2 4.29Å
882	S	95.8	Very high	78.4	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	129.8	178.2	-57	0	0	0	0	109.3	F831 L832 R834 R889 H890	F831-S882 CarbonylContact C-O 3.55Å; F831-S882 WeakPolarHBondContact CA-O 3.23Å; F831-S882 WeakPolarHBondContact CB-O 3.1Å; L832-S882 PolarHBondContact N-O 3.47Å; L832-S882 PolarHBondContact O-N 3.37Å; R834-S882 PolarHBondContact NE-OG 3.02Å; R834-S882 VanDerWaalsContact NE-OG 3.1Å; S882-R889 CarbonylContact C-O 3.59Å; S882-R889 WeakPolarHBondContact CA-O 3.47Å; S882-H890 WeakPolarHBondContact CB-ND1 3.35Å; S882-H890 PolarHBondContact OG-ND1 3.43Å
883	V	96.5	Very high	81.1	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	137.4	-172.4	-168.1	0	0	0	0	109.6	D830 F831 L881 W885 R889 F891 L935	D830-V883 CarbonylContact O-C 3.37Å; D830-V883 WeakPolarHBondContact O-CA 3.49Å; F831-V883 HydrophobicContact CB-CB 4.37Å; F831-V883 HydrophobicContact CB-CG1 4.27Å; F831-V883 HydrophobicContact CB-CG2 4Å; L881-V883 HydrophobicContact CD1-CG2 4Å; L881-V883 HydrophobicContact CD2-CG2 4.49Å; L881-V883 HydrophobicContact CG-CG2 3.9Å; V883-W885 HydrophobicContact CG1-CB 4.41Å; V883-W885 PolarHBondContact O-N 2.98Å; V883-R889 PolarHBondContact N-O 3.45Å; V883-R889 PolarHBondContact O-N 2.78Å; V883-F891 HydrophobicContact CB-CE2 4.22Å; V883-F891 HydrophobicContact CG2-CD2 4.09Å; V883-F891 HydrophobicContact CG2-CE2 3.85Å; V883-L935 HydrophobicContact CG1-CD2 4.13Å; V883-L935 HydrophobicContact CG2-CD2 3.63Å
884	F	96.8	Very high	83.3	Confident	43 Å²	43	43.5 Å²	43.5	19%	0.189	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	108	163.8	-172.3	-82.4	0	0	0	109.1	L825 N827 G829 D830 H888	L825-F884 HydrophobicContact CB-CB 4.03Å; L825-F884 VanDerWaalsContact O-CD2 3.26Å; L825-F884 WeakPolarHBondContact O-CD2 3.45Å; N827-F884 WeakPolarHBondContact O-CB 3.13Å; N827-F884 WeakPolarHBondContact O-CD1 3.3Å; G829-F884 PolarHBondContact N-O 2.68Å; D830-F884 PolarHBondContact O-N 3.39Å; F884-H888 AromaticContact CD2-CE1 3.58Å; F884-H888 AromaticContact CD2-ND1 3.58Å; F884-H888 AromaticContact CE2-CE1 3.86Å
885	W	93.8	Very high	85.4	Confident	50 Å²	50	40.9 Å²	40.9	19%	0.189	20%	0.196	C	C	.	.	S	Bend	trans	-141.6	94.6	175.1	-163.2	-100.7	0	0	0	111.2	Q828 V883 G887 R889 G932 A933 C934	Q828-W885 VanDerWaalsContact OE1-CA 3.29Å; V883-W885 HydrophobicContact CG1-CB 4.41Å; V883-W885 PolarHBondContact O-N 2.98Å; W885-G887 VanDerWaalsContact C-N 3.34Å; W885-G887 CarbonylContact C-O 3.44Å; W885-G887 PolarHBondContact N-O 3.39Å; W885-R889 PolarHBondContact O-NE 2.92Å; W885-R889 PolarHBondContact O-NH2 3.19Å; W885-R889 VanDerWaalsContact O-NH2 3.15Å; W885-G932 WeakPolarHBondContact CZ2-O 3.36Å; W885-G932 PolarHBondContact NE1-O 3.12Å; W885-A933 HydrophobicContact CB-CB 3.6Å; W885-A933 HydrophobicContact CD2-CB 4.17Å; W885-A933 HydrophobicContact CG-CB 3.57Å; W885-C934 HydrophobicContact CH2-CB 3.86Å; W885-C934 HydrophobicContact CZ2-CB 4.5Å; W885-C934 HydrophobicContact CZ3-CB 4.05Å
886	H	90.9	Very high	86.7	Confident	132 Å²	132	39 Å²	39	61%	0.611	18%	0.184	S	C	*	.	S	Bend	trans	54.6	51.8	-169.7	-54.5	73.5	0	0	0	110.8	Q828	Q828-H886 PolarHBondContact NE2-CD2 3.32Å; Q828-H886 PolarHBondContact NE2-CE1 2.94Å; Q828-H886 PolarHBondContact NE2-ND1 3.43Å; Q828-H886 PolarHBondContact NE2-NE2 3.37Å
887	G	90.4	Very high	87.1	Confident	28 Å²	28	39.8 Å²	39.8	29%	0.289	19%	0.191	S	C	.	.	S	Bend	trans	100.7	166.3	-167.9	0	0	0	0	0	113	W885 R889	W885-G887 VanDerWaalsContact C-N 3.34Å; W885-G887 CarbonylContact C-O 3.44Å; W885-G887 PolarHBondContact N-O 3.39Å; G887-R889 PolarHBondContact O-N 2.96Å
888	H	91.8	Very high	86.6	Confident	69 Å²	69	42.8 Å²	42.8	32%	0.319	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	126.1	-175	-45.7	-83.1	0	0	0	112	E822 L825 F884	E822-H888 HydrophobicContact CG-CB 3.94Å; E822-H888 PolarHBondContact O-CE1 3.07Å; L825-H888 PolarHBondContact O-CE1 3.19Å; L825-H888 VanDerWaalsContact O-CE1 3.3Å; F884-H888 AromaticContact CD2-CE1 3.58Å; F884-H888 AromaticContact CD2-ND1 3.58Å; F884-H888 AromaticContact CE2-CE1 3.86Å
889	R	92.5	Very high	85.9	Confident	89 Å²	89	39.4 Å²	39.4	34%	0.336	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	149	176.5	-58.6	-172.6	-172	-104	-9.3	110.2	S882 V883 W885 G887 F891	S882-R889 CarbonylContact C-O 3.59Å; S882-R889 WeakPolarHBondContact CA-O 3.47Å; V883-R889 PolarHBondContact N-O 3.45Å; V883-R889 PolarHBondContact O-N 2.78Å; W885-R889 PolarHBondContact O-NE 2.92Å; W885-R889 PolarHBondContact O-NH2 3.19Å; W885-R889 VanDerWaalsContact O-NH2 3.15Å; G887-R889 PolarHBondContact O-N 2.96Å; R889-F891 HydrophobicContact CB-CD2 4.49Å; R889-F891 HydrophobicContact CB-CE2 3.65Å; R889-F891 HydrophobicContact CB-CZ 3.82Å
890	H	92.9	Very high	84.8	Confident	47 Å²	47	42 Å²	42	22%	0.218	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	119.5	177.9	-53.3	-72.1	0	0	0	109.4	R818 E822 V880 L881 S882	R818-H890 VanDerWaalsContact CZ-NE2 3.26Å; R818-H890 PolarHBondContact NE-NE2 3.19Å; R818-H890 PolarHBondContact NH1-CD2 3.1Å; R818-H890 PolarHBondContact NH2-NE2 2.56Å; E822-H890 IonicContact OE1-NE2 2.75Å; V880-H890 HydrophobicContact CG1-CB 3.84Å; L881-H890 CarbonylContact O-C 3.45Å; L881-H890 WeakPolarHBondContact O-CA 3.26Å; S882-H890 WeakPolarHBondContact CB-ND1 3.35Å; S882-H890 PolarHBondContact OG-ND1 3.43Å
891	F	92.9	Very high	83.7	Confident	27 Å²	27	42.8 Å²	42.8	12%	0.118	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	128.6	-178.9	-52.1	-89.3	0	0	0	108.1	V880 L881 V883 R889 L905 V927 T928 A933	V880-F891 CarbonylContact C-O 3.34Å; V880-F891 VanDerWaalsContact CA-O 3.25Å; V880-F891 WeakPolarHBondContact CA-O 3.48Å; V880-F891 WeakPolarHBondContact CG1-O 3.41Å; L881-F891 HydrophobicContact CB-CB 4.48Å; L881-F891 PolarHBondContact N-O 3.39Å; L881-F891 PolarHBondContact O-N 3.07Å; V883-F891 HydrophobicContact CB-CE2 4.22Å; V883-F891 HydrophobicContact CG2-CD2 4.09Å; V883-F891 HydrophobicContact CG2-CE2 3.85Å; R889-F891 HydrophobicContact CB-CD2 4.49Å; R889-F891 HydrophobicContact CB-CE2 3.65Å; R889-F891 HydrophobicContact CB-CZ 3.82Å; F891-L905 HydrophobicContact CB-CD2 3.66Å; F891-L905 HydrophobicContact CG-CD2 4.47Å; F891-V927 HydrophobicContact CB-CG1 4.19Å; F891-V927 HydrophobicContact CD1-CG1 3.88Å; F891-V927 HydrophobicContact CD2-CG1 3.57Å; F891-V927 HydrophobicContact CE1-CG1 4.09Å; F891-V927 HydrophobicContact CE2-CB 4.4Å; F891-V927 HydrophobicContact CE2-CG1 3.79Å; F891-V927 HydrophobicContact CG-CG1 3.61Å; F891-V927 HydrophobicContact CZ-CB 4.46Å; F891-V927 HydrophobicContact CZ-CG1 4.03Å; F891-T928 HydrophobicContact CD1-CG2 3.89Å; F891-T928 HydrophobicContact CE1-CG2 4.03Å; F891-T928 WeakPolarHBondContact CE1-OG1 3.24Å; F891-A933 HydrophobicContact CE2-CB 4.44Å; F891-A933 HydrophobicContact CZ-CB 4.08Å
892	I	90.3	Very high	82.9	Confident	55 Å²	55	43.8 Å²	43.8	28%	0.282	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	134.2	174.6	-63.4	174.5	0	0	0	107.3	V880 Y894	V880-I892 HydrophobicContact CG2-CG1 4.46Å; I892-Y894 HydrophobicContact CB-CE2 4.25Å; I892-Y894 HydrophobicContact CG2-CE1 4.09Å; I892-Y894 HydrophobicContact CG2-CE2 4.36Å; I892-Y894 WeakPolarHBondContact O-CD2 3.45Å; I892-Y894 VanDerWaalsContact O-CE2 3.32Å; I892-Y894 WeakPolarHBondContact O-CE2 3.27Å
893	L	88.9	Confident	82.5	Confident	7 Å²	7	44.7 Å²	44.7	4%	0.037	24%	0.239	C	C	.	.			trans	-87.6	135.1	171.4	-58.9	178.9	0	0	0	109.2	V833 M879 L881 W903 L905 I913 L916	V833-L893 HydrophobicContact CG1-CD1 4.14Å; M879-L893 HydrophobicContact CB-CB 3.98Å; M879-L893 HydrophobicContact CB-CD1 4.19Å; M879-L893 HydrophobicContact CB-CG 4.43Å; M879-L893 PolarHBondContact O-N 3.18Å; L881-L893 HydrophobicContact CB-CD2 4.09Å; L881-L893 HydrophobicContact CB-CG 4.39Å; L893-W903 HydrophobicContact CB-CE3 4.18Å; L893-W903 HydrophobicContact CB-CZ3 4.39Å; L893-L905 HydrophobicContact CD2-CD1 4.18Å; L893-L905 HydrophobicContact CD2-CD2 3.62Å; L893-L905 HydrophobicContact CD2-CG 3.67Å; L893-I913 HydrophobicContact CD1-CD1 3.85Å; L893-I913 HydrophobicContact CD1-CG1 4.28Å; L893-I913 HydrophobicContact CD1-CG2 3.76Å; L893-L916 HydrophobicContact CD2-CD1 4.24Å; L893-L916 HydrophobicContact CD2-CD2 4.17Å
894	Y	84.1	Confident	82	Confident	87 Å²	87	46.2 Å²	46.2	34%	0.341	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	169.6	179.7	-58.2	-85.9	0	0	0	110.2	I892 W903 H904	I892-Y894 HydrophobicContact CB-CE2 4.25Å; I892-Y894 HydrophobicContact CG2-CE1 4.09Å; I892-Y894 HydrophobicContact CG2-CE2 4.36Å; I892-Y894 WeakPolarHBondContact O-CD2 3.45Å; I892-Y894 VanDerWaalsContact O-CE2 3.32Å; I892-Y894 WeakPolarHBondContact O-CE2 3.27Å; Y894-W903 CarbonylContact O-C 3.47Å; Y894-W903 VanDerWaalsContact O-CA 3.27Å; Y894-W903 WeakPolarHBondContact O-CA 3.35Å; Y894-H904 WeakPolarHBondContact CB-NE2 3.44Å; Y894-H904 PolarHBondContact N-O 3.39Å; Y894-H904 PolarHBondContact O-N 3.16Å; Y894-H904 PolarHBondContact O-ND1 2.93Å
895	G	77	Confident	81.5	Confident	1 Å²	1	45 Å²	45	1%	0.01	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	63.5	-172.6	-171.4	0	0	0	0	0	113	L866 W903 H904	L866-G895 VanDerWaalsContact CD2-C 3.47Å; L866-G895 WeakPolarHBondContact CD2-O 3.46Å; G895-W903 VanDerWaalsContact O-CZ3 3.23Å; G895-W903 WeakPolarHBondContact O-CZ3 3.48Å; G895-H904 PolarHBondContact N-CE1 3.46Å
896	G	72.1	Confident	80.6	Confident	1 Å²	1	46.3 Å²	46.3	1%	0.01	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	134.7	162.2	-176	0	0	0	0	0	111.8	E898 T899 E901 W903	G896-E898 PolarHBondContact O-N 3.16Å; G896-T899 PolarHBondContact O-N 2.94Å; G896-T899 PolarHBondContact O-OG1 3.36Å; G896-E901 CarbonylContact C-O 3.33Å; G896-E901 WeakPolarHBondContact CA-O 3.21Å; G896-E901 PolarHBondContact N-O 3.18Å; G896-E901 VanDerWaalsContact O-O 3.1Å; G896-W903 VanDerWaalsContact CA-CE2 3.49Å
897	P	63.4	Low	79.5	Confident	103 Å²	103	46.6 Å²	46.6	67%	0.669	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-26.4	-167.8	21.6	-34.1	0	0	0	114.5	T899 G900	P897-T899 VanDerWaalsContact C-N 3.3Å; P897-T899 PolarHBondContact O-N 3.32Å; P897-G900 PolarHBondContact O-N 3.26Å
898	E	56.3	Low	78.6	Confident	68 Å²	68	47 Å²	47	32%	0.318	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-22.9	175.6	-74.3	178.9	-139.7	0	0	115	I865 L866 N867 K868 G896	I865-E898 HydrophobicContact CB-CB 4.45Å; I865-E898 HydrophobicContact CG2-CB 3.85Å; I865-E898 HydrophobicContact CG2-CG 4.33Å; I865-E898 CarbonylContact O-C 3.59Å; I865-E898 VanDerWaalsContact O-CB 3.24Å; I865-E898 WeakPolarHBondContact O-CB 3.44Å; L866-E898 HydrophobicContact CD2-CB 4.44Å; N867-E898 VanDerWaalsContact CA-OE1 3.3Å; N867-E898 WeakPolarHBondContact CA-OE1 3.37Å; N867-E898 PolarHBondContact N-OE1 3.42Å; N867-E898 PolarHBondContact N-OE2 3.01Å; K868-E898 VanDerWaalsContact N-CD 3.29Å; K868-E898 PolarHBondContact N-OE1 2.83Å; K868-E898 PolarHBondContact N-OE2 3.47Å; G896-E898 PolarHBondContact O-N 3.16Å
899	T	61.7	Low	78.2	Confident	6 Å²	6	48.8 Å²	48.8	4%	0.037	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.6	-17	177.9	52.5	0	0	0	0	114	N862 I865 L866 G896 P897 E901	N862-T899 HydrophobicContact CB-CG2 4.35Å; N862-T899 PolarHBondContact ND2-O 3.3Å; N862-T899 VanDerWaalsContact O-CG2 3.23Å; N862-T899 WeakPolarHBondContact O-CG2 3.49Å; I865-T899 VanDerWaalsContact O-CG2 3.23Å; I865-T899 WeakPolarHBondContact O-CG2 3.22Å; L866-T899 HydrophobicContact CD1-CG2 4.1Å; L866-T899 HydrophobicContact CD2-CG2 3.47Å; L866-T899 VanDerWaalsContact CD2-CG2 3.47Å; L866-T899 HydrophobicContact CG-CG2 3.5Å; L866-T899 VanDerWaalsContact CG-CG2 3.5Å; G896-T899 PolarHBondContact O-N 2.94Å; G896-T899 PolarHBondContact O-OG1 3.36Å; P897-T899 VanDerWaalsContact C-N 3.3Å; P897-T899 PolarHBondContact O-N 3.32Å; T899-E901 PolarHBondContact O-N 3.32Å; T899-E901 WeakPolarHBondContact OG1-CB 3.28Å; T899-E901 PolarHBondContact OG1-N 3.02Å; T899-E901 VanDerWaalsContact OG1-N 3.11Å; T899-E901 PolarHBondContact OG1-O 2.84Å
900	G	65.2	Low	78	Confident	64 Å²	64	46.3 Å²	46.3	66%	0.66	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.8	5.6	-163.2	0	0	0	0	0	114.3	P897	P897-G900 PolarHBondContact O-N 3.26Å
901	E	69.1	Low	77.5	Confident	21 Å²	21	46.9 Å²	46.9	10%	0.098	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	142.1	167.6	-66.4	158.2	-150.3	0	0	109.5	N860 N862 G896 T899 H904	N860-E901 HydrophobicContact CB-CG 3.62Å; N860-E901 VanDerWaalsContact CB-OE1 3.28Å; N860-E901 WeakPolarHBondContact CB-OE1 3.49Å; N862-E901 WeakPolarHBondContact CB-OE1 3.45Å; N862-E901 PolarHBondContact N-OE1 3.42Å; G896-E901 CarbonylContact C-O 3.33Å; G896-E901 WeakPolarHBondContact CA-O 3.21Å; G896-E901 PolarHBondContact N-O 3.18Å; G896-E901 VanDerWaalsContact O-O 3.1Å; T899-E901 PolarHBondContact O-N 3.32Å; T899-E901 WeakPolarHBondContact OG1-CB 3.28Å; T899-E901 PolarHBondContact OG1-N 3.02Å; T899-E901 VanDerWaalsContact OG1-N 3.11Å; T899-E901 PolarHBondContact OG1-O 2.84Å; E901-H904 IonicContact OE2-CE1 3.83Å
902	G	79.4	Confident	77.3	Confident	21 Å²	21	47.2 Å²	47.2	22%	0.216	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68	152	170.7	0	0	0	0	0	111.7	H904 H909 F910	G902-H904 PolarHBondContact O-N 3.42Å; G902-H904 PolarHBondContact O-ND1 2.92Å; G902-H909 PolarHBondContact O-ND1 3.31Å; G902-H909 VanDerWaalsContact O-ND1 3.11Å; G902-F910 CarbonylContact C-O 3.58Å; G902-F910 WeakPolarHBondContact CA-O 3.44Å
903	W	87.5	Confident	77.3	Confident	20 Å²	20	44.9 Å²	44.9	8%	0.076	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-54.1	133.1	173.1	-68.1	99	0	0	0	110.6	M879 L893 Y894 G895 G896 F910 I913 L916	M879-W903 HydrophobicContact CB-CZ3 4.1Å; M879-W903 HydrophobicContact CG-CH2 3.81Å; M879-W903 HydrophobicContact CG-CZ3 3.89Å; L893-W903 HydrophobicContact CB-CE3 4.18Å; L893-W903 HydrophobicContact CB-CZ3 4.39Å; Y894-W903 CarbonylContact O-C 3.47Å; Y894-W903 VanDerWaalsContact O-CA 3.27Å; Y894-W903 WeakPolarHBondContact O-CA 3.35Å; G895-W903 VanDerWaalsContact O-CZ3 3.23Å; G895-W903 WeakPolarHBondContact O-CZ3 3.48Å; G896-W903 VanDerWaalsContact CA-CE2 3.49Å; W903-F910 PolarHBondContact N-O 3.09Å; W903-F910 WeakPolarHBondContact O-CD2 3.34Å; W903-F910 PolarHBondContact O-N 2.87Å; W903-I913 HydrophobicContact CB-CG1 4.31Å; W903-I913 HydrophobicContact CD2-CD1 3.8Å; W903-I913 HydrophobicContact CD2-CG1 3.37Å; W903-I913 HydrophobicContact CE3-CD1 3.73Å; W903-I913 HydrophobicContact CE3-CG1 3.77Å; W903-I913 HydrophobicContact CG-CG1 3.64Å; W903-I913 HydrophobicContact CH2-CD1 3.83Å; W903-I913 HydrophobicContact CH2-CG1 4.45Å; W903-I913 HydrophobicContact CZ2-CD1 3.88Å; W903-I913 HydrophobicContact CZ2-CG1 4.11Å; W903-I913 HydrophobicContact CZ3-CD1 3.76Å; W903-I913 HydrophobicContact CZ3-CG1 4.29Å; W903-L916 HydrophobicContact CB-CD1 4.21Å
904	H	86.1	Confident	77.4	Confident	32 Å²	32	47.7 Å²	47.7	15%	0.148	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	172.8	-174.3	63.4	-85.9	0	0	0	113.3	Y894 G895 E901 G902 G908 H909	Y894-H904 WeakPolarHBondContact CB-NE2 3.44Å; Y894-H904 PolarHBondContact N-O 3.39Å; Y894-H904 PolarHBondContact O-N 3.16Å; Y894-H904 PolarHBondContact O-ND1 2.93Å; G895-H904 PolarHBondContact N-CE1 3.46Å; E901-H904 IonicContact OE2-CE1 3.83Å; G902-H904 PolarHBondContact O-N 3.42Å; G902-H904 PolarHBondContact O-ND1 2.92Å; H904-G908 WeakPolarHBondContact CB-O 3.32Å; H904-H909 AromaticContact CE1-CE1 3.8Å; H904-H909 AromaticContact CG-CE1 3.79Å; H904-H909 AromaticContact CG-ND1 3.71Å; H904-H909 AromaticContact ND1-CE1 3.53Å; H904-H909 AromaticContact ND1-ND1 3.36Å; H904-H909 PolarHBondContact ND1-ND1 3.19Å
905	L	84.4	Confident	77.7	Confident	16 Å²	16	47 Å²	47	8%	0.084	27%	0.272	C	S	.	.	S	Bend	trans	-130.5	-69.2	-174.4	-87.9	158.5	0	0	0	112.6	L881 F891 L893 L916 V927	L881-L905 HydrophobicContact CD2-CD1 4.15Å; F891-L905 HydrophobicContact CB-CD2 3.66Å; F891-L905 HydrophobicContact CG-CD2 4.47Å; L893-L905 HydrophobicContact CD2-CD1 4.18Å; L893-L905 HydrophobicContact CD2-CD2 3.62Å; L893-L905 HydrophobicContact CD2-CG 3.67Å; L905-L916 HydrophobicContact CD1-CD1 4.27Å; L905-L916 HydrophobicContact CD1-CD2 3.81Å; L905-L916 HydrophobicContact CD1-CG 4.3Å; L905-L916 HydrophobicContact CG-CD1 4.37Å; L905-V927 HydrophobicContact CD1-CG1 3.84Å; L905-V927 HydrophobicContact CD2-CG1 3.92Å; L905-V927 HydrophobicContact CG-CG1 4.49Å
906	E	75.2	Confident	78.5	Confident	78 Å²	78	47 Å²	47	36%	0.364	27%	0.272	S	S	.	.	S	Bend	trans	-122.8	-57.1	166.4	-88	177.3	174.8	0	0	107.9	T928 A929	E906-T928 VanDerWaalsContact CD-CG2 3.42Å; E906-T928 HydrophobicContact CG-CG2 3.74Å; E906-T928 WeakPolarHBondContact OE1-CB 3.22Å; E906-T928 WeakPolarHBondContact OE2-CA 3.44Å; E906-T928 WeakPolarHBondContact OE2-CB 3.49Å; E906-A929 PolarHBondContact OE2-N 2.66Å
907	D	68	Low	79.5	Confident	138 Å²	138	47 Å²	47	74%	0.738	27%	0.271	S	S	*	.	S	Bend	trans	-119.8	154.3	176	-67.5	-65.2	0	0	0	112.1
908	G	71.6	Confident	80.9	Confident	37 Å²	37	47.2 Å²	47.2	38%	0.381	26%	0.263	S	S	.	.			trans	84.8	122.6	170.4	0	0	0	0	0	114.8	H904 F910	H904-G908 WeakPolarHBondContact CB-O 3.32Å; G908-F910 WeakPolarHBondContact O-CD2 3.37Å; G908-F910 WeakPolarHBondContact O-CE2 3.12Å
909	H	83.4	Confident	82.6	Confident	107 Å²	107	48.9 Å²	48.9	50%	0.495	27%	0.267	S	S	.	.			trans	-103.9	125.3	177.6	-64.3	-77.9	0	0	0	111.1	G902 H904	G902-H909 PolarHBondContact O-ND1 3.31Å; G902-H909 VanDerWaalsContact O-ND1 3.11Å; H904-H909 AromaticContact CE1-CE1 3.8Å; H904-H909 AromaticContact CG-CE1 3.79Å; H904-H909 AromaticContact CG-ND1 3.71Å; H904-H909 AromaticContact ND1-CE1 3.53Å; H904-H909 AromaticContact ND1-ND1 3.36Å; H904-H909 PolarHBondContact ND1-ND1 3.19Å
910	F	88.2	Confident	84.1	Confident	37 Å²	37	49 Å²	49	16%	0.162	27%	0.268	C	S	.	.	B	Isolated β-bridge	trans	-117.9	147.3	-178	-58.8	-88	0	0	0	111	G902 W903 G908 T912 E915 L916 Y919	G902-F910 CarbonylContact C-O 3.58Å; G902-F910 WeakPolarHBondContact CA-O 3.44Å; W903-F910 PolarHBondContact N-O 3.09Å; W903-F910 WeakPolarHBondContact O-CD2 3.34Å; W903-F910 PolarHBondContact O-N 2.87Å; G908-F910 WeakPolarHBondContact O-CD2 3.37Å; G908-F910 WeakPolarHBondContact O-CE2 3.12Å; F910-T912 VanDerWaalsContact C-N 3.31Å; F910-T912 PolarHBondContact O-N 3.23Å; F910-E915 HydrophobicContact CB-CB 3.93Å; F910-E915 HydrophobicContact CD1-CB 3.99Å; F910-E915 HydrophobicContact CG-CB 4.35Å; F910-L916 HydrophobicContact CB-CB 3.98Å; F910-L916 HydrophobicContact CD2-CB 3.57Å; F910-L916 HydrophobicContact CD2-CD1 4.11Å; F910-L916 HydrophobicContact CD2-CG 3.94Å; F910-L916 HydrophobicContact CE2-CB 4.23Å; F910-L916 HydrophobicContact CE2-CG 4.29Å; F910-L916 HydrophobicContact CG-CB 3.81Å; F910-Y919 HydrophobicContact CE1-CD1 4.4Å; F910-Y919 HydrophobicContact CE1-CD2 4.08Å; F910-Y919 AromaticContact CE1-CG 3.76Å; F910-Y919 HydrophobicContact CE1-CG 3.76Å; F910-Y919 HydrophobicContact CE2-CD1 4.45Å; F910-Y919 AromaticContact CZ-CD1 3.66Å; F910-Y919 HydrophobicContact CZ-CD1 3.66Å; F910-Y919 HydrophobicContact CZ-CD2 4.01Å; F910-Y919 HydrophobicContact CZ-CE1 4.32Å; F910-Y919 AromaticContact CZ-CG 3.48Å; F910-Y919 HydrophobicContact CZ-CG 3.48Å; F910-Y919 VanDerWaalsContact CZ-CG 3.48Å
911	S	83.4	Confident	85.4	Confident	58 Å²	58	48.8 Å²	48.8	41%	0.406	25%	0.25	S	C	.	.	S	Bend	trans	-70.9	-31.2	-177.3	77.3	0	0	0	0	111.8	E915	S911-E915 WeakPolarHBondContact CA-OE2 3.4Å; S911-E915 VanDerWaalsContact CB-OE2 3.32Å; S911-E915 WeakPolarHBondContact CB-OE2 3.47Å; S911-E915 PolarHBondContact N-OE2 3.32Å; S911-E915 PolarHBondContact OG-OE1 3.37Å; S911-E915 PolarHBondContact OG-OE2 3.06Å
912	T	87.3	Confident	86.5	Confident	35 Å²	35	56.8 Å²	56.8	22%	0.215	29%	0.285	C	S	.	.	S	Bend	trans	-129.3	158.3	176.1	66.6	0	0	0	0	112.1	F910 R914 E915 L916	F910-T912 VanDerWaalsContact C-N 3.31Å; F910-T912 PolarHBondContact O-N 3.23Å; T912-R914 PolarHBondContact O-N 2.88Å; T912-E915 PolarHBondContact N-OE2 3.38Å; T912-E915 PolarHBondContact O-N 3.32Å; T912-E915 WeakPolarHBondContact OG1-CG 3.29Å; T912-E915 PolarHBondContact OG1-N 3.31Å; T912-L916 PolarHBondContact O-N 3.27Å
913	I	90.3	Very high	87.1	Confident	5 Å²	5	59 Å²	59	3%	0.026	29%	0.293	C	S	.	.	H	α-helix	trans	-62.3	-30.7	171.5	-60.1	-175.6	0	0	0	111	I806 W811 V833 M879 L893 W903 L916 I917	I806-I913 HydrophobicContact CD1-CB 3.99Å; I806-I913 HydrophobicContact CD1-CD1 3.67Å; I806-I913 HydrophobicContact CD1-CG1 4.22Å; I806-I913 HydrophobicContact CD1-CG2 4.32Å; W811-I913 HydrophobicContact CH2-CG2 3.94Å; W811-I913 HydrophobicContact CZ3-CG2 3.97Å; V833-I913 HydrophobicContact CG1-CG2 4.37Å; V833-I913 HydrophobicContact CG2-CG2 4.38Å; M879-I913 HydrophobicContact CB-CD1 4.23Å; M879-I913 HydrophobicContact CE-CD1 4.36Å; M879-I913 HydrophobicContact CG-CD1 3.87Å; M879-I913 HydrophobicContact SD-CD1 4.32Å; L893-I913 HydrophobicContact CD1-CD1 3.85Å; L893-I913 HydrophobicContact CD1-CG1 4.28Å; L893-I913 HydrophobicContact CD1-CG2 3.76Å; W903-I913 HydrophobicContact CB-CG1 4.31Å; W903-I913 HydrophobicContact CD2-CD1 3.8Å; W903-I913 HydrophobicContact CD2-CG1 3.37Å; W903-I913 HydrophobicContact CE3-CD1 3.73Å; W903-I913 HydrophobicContact CE3-CG1 3.77Å; W903-I913 HydrophobicContact CG-CG1 3.64Å; W903-I913 HydrophobicContact CH2-CD1 3.83Å; W903-I913 HydrophobicContact CH2-CG1 4.45Å; W903-I913 HydrophobicContact CZ2-CD1 3.88Å; W903-I913 HydrophobicContact CZ2-CG1 4.11Å; W903-I913 HydrophobicContact CZ3-CD1 3.76Å; W903-I913 HydrophobicContact CZ3-CG1 4.29Å; I913-L916 PolarHBondContact O-N 3.35Å; I913-I917 HydrophobicContact CG2-CG1 4.13Å; I913-I917 VanDerWaalsContact O-CG1 3.29Å; I913-I917 WeakPolarHBondContact O-CG1 3.31Å; I913-I917 PolarHBondContact O-N 3.24Å
914	R	92.1	Very high	87.3	Confident	66 Å²	66	62.1 Å²	62.1	25%	0.249	31%	0.309	C	S	.	.	H	α-helix	trans	-58.8	-49.6	175	-176.3	-169.6	-67.1	178.2	4.8	111.2	M804 E809 W811 T912 L916 I917 E918	M804-R914 PolarHBondContact SD-NH1 3.28Å; M804-R914 PolarHBondContact SD-NH2 3.38Å; E809-R914 IonicContact OE1-CZ 3.27Å; E809-R914 IonicContact OE1-NE 3.12Å; E809-R914 PolarHBondContact OE1-NE 2.85Å; E809-R914 IonicContact OE1-NH2 2.68Å; E809-R914 PolarHBondContact OE1-NH2 3.25Å; E809-R914 IonicContact OE2-NE 3.71Å; E809-R914 PolarHBondContact OE2-NE 3.11Å; E809-R914 IonicContact OE2-NH2 2.7Å; W811-R914 HydrophobicContact CZ2-CB 4.12Å; W811-R914 HydrophobicContact CZ2-CG 4.29Å; T912-R914 PolarHBondContact O-N 2.88Å; R914-L916 VanDerWaalsContact C-N 3.32Å; R914-L916 PolarHBondContact O-N 2.92Å; R914-I917 PolarHBondContact O-N 3.45Å; R914-I917 VanDerWaalsContact O-N 3.16Å; R914-E918 VanDerWaalsContact CD-OE1 3.23Å; R914-E918 WeakPolarHBondContact CD-OE1 3.47Å; R914-E918 HydrophobicContact CG-CG 4.07Å; R914-E918 WeakPolarHBondContact CG-OE1 3.24Å; R914-E918 WeakPolarHBondContact O-CB 3.39Å; R914-E918 WeakPolarHBondContact O-CG 3.13Å; R914-E918 PolarHBondContact O-N 2.87Å
915	E	90.9	Very high	87.5	Confident	74 Å²	74	62.6 Å²	62.6	35%	0.346	31%	0.314	S	S	.	.	H	α-helix	trans	-60	-40.4	-179.8	-73.1	171.1	163.6	0	0	112.4	F910 S911 T912 Y919	F910-E915 HydrophobicContact CB-CB 3.93Å; F910-E915 HydrophobicContact CD1-CB 3.99Å; F910-E915 HydrophobicContact CG-CB 4.35Å; S911-E915 WeakPolarHBondContact CA-OE2 3.4Å; S911-E915 VanDerWaalsContact CB-OE2 3.32Å; S911-E915 WeakPolarHBondContact CB-OE2 3.47Å; S911-E915 PolarHBondContact N-OE2 3.32Å; S911-E915 PolarHBondContact OG-OE1 3.37Å; S911-E915 PolarHBondContact OG-OE2 3.06Å; T912-E915 PolarHBondContact N-OE2 3.38Å; T912-E915 PolarHBondContact O-N 3.32Å; T912-E915 WeakPolarHBondContact OG1-CG 3.29Å; T912-E915 PolarHBondContact OG1-N 3.31Å; E915-Y919 VanDerWaalsContact O-CB 3.32Å; E915-Y919 WeakPolarHBondContact O-CB 3.46Å; E915-Y919 PolarHBondContact O-N 3.44Å
916	L	91.9	Very high	87.8	Confident	1 Å²	1	64.5 Å²	64.5	1%	0.005	33%	0.328	C	S	.	.	H	α-helix	trans	-60.5	-45.6	174.1	176.2	155	0	0	0	111.8	L893 W903 L905 F910 T912 I913 R914 H920	L893-L916 HydrophobicContact CD2-CD1 4.24Å; L893-L916 HydrophobicContact CD2-CD2 4.17Å; W903-L916 HydrophobicContact CB-CD1 4.21Å; L905-L916 HydrophobicContact CD1-CD1 4.27Å; L905-L916 HydrophobicContact CD1-CD2 3.81Å; L905-L916 HydrophobicContact CD1-CG 4.3Å; L905-L916 HydrophobicContact CG-CD1 4.37Å; F910-L916 HydrophobicContact CB-CB 3.98Å; F910-L916 HydrophobicContact CD2-CB 3.57Å; F910-L916 HydrophobicContact CD2-CD1 4.11Å; F910-L916 HydrophobicContact CD2-CG 3.94Å; F910-L916 HydrophobicContact CE2-CB 4.23Å; F910-L916 HydrophobicContact CE2-CG 4.29Å; F910-L916 HydrophobicContact CG-CB 3.81Å; T912-L916 PolarHBondContact O-N 3.27Å; I913-L916 PolarHBondContact O-N 3.35Å; R914-L916 VanDerWaalsContact C-N 3.32Å; R914-L916 PolarHBondContact O-N 2.92Å; L916-H920 PolarHBondContact O-CD2 2.88Å; L916-H920 VanDerWaalsContact O-CD2 3.32Å; L916-H920 PolarHBondContact O-N 2.91Å
917	I	93.1	Very high	88.5	Confident	1 Å²	1	60.9 Å²	60.9	1%	0.005	31%	0.311	C	S	.	.	H	α-helix	trans	-68.4	-46.2	179	-67.2	-64.2	0	0	0	111	W811 F831 V833 L881 I913 R914 Y919 H920 M921 L935	W811-I917 HydrophobicContact CH2-CG1 4.07Å; W811-I917 HydrophobicContact CZ2-CB 4.48Å; W811-I917 HydrophobicContact CZ2-CG1 4.5Å; W811-I917 HydrophobicContact CZ3-CG1 4.12Å; F831-I917 HydrophobicContact CD2-CD1 4.4Å; F831-I917 HydrophobicContact CE2-CD1 4.04Å; F831-I917 HydrophobicContact CE2-CG2 3.49Å; F831-I917 VanDerWaalsContact CE2-CG2 3.49Å; F831-I917 HydrophobicContact CZ-CG2 3.48Å; F831-I917 VanDerWaalsContact CZ-CG2 3.48Å; V833-I917 HydrophobicContact CG2-CD1 3.9Å; V833-I917 HydrophobicContact CG2-CG1 4.26Å; L881-I917 HydrophobicContact CD1-CD1 3.8Å; L881-I917 HydrophobicContact CD2-CD1 4.03Å; L881-I917 HydrophobicContact CG-CD1 4.48Å; I913-I917 HydrophobicContact CG2-CG1 4.13Å; I913-I917 VanDerWaalsContact O-CG1 3.29Å; I913-I917 WeakPolarHBondContact O-CG1 3.31Å; I913-I917 PolarHBondContact O-N 3.24Å; R914-I917 PolarHBondContact O-N 3.45Å; R914-I917 VanDerWaalsContact O-N 3.16Å; I917-Y919 VanDerWaalsContact C-N 3.29Å; I917-Y919 PolarHBondContact O-N 3.08Å; I917-H920 PolarHBondContact O-N 3.21Å; I917-M921 HydrophobicContact CG2-CG 4.34Å; I917-M921 HydrophobicContact CG2-SD 4.01Å; I917-M921 WeakPolarHBondContact O-CB 3.46Å; I917-M921 WeakPolarHBondContact O-CG 3.38Å; I917-M921 PolarHBondContact O-N 2.88Å; I917-L935 HydrophobicContact CD1-CD1 3.72Å; I917-L935 HydrophobicContact CG2-CD1 4.38Å
918	E	92.8	Very high	89.5	Confident	107 Å²	107	55.1 Å²	55.1	50%	0.5	28%	0.281	S	S	.	.	H	α-helix	trans	-60.1	-38.3	176.7	-76.3	-176.4	-176.1	0	0	111.9	R914 K922	R914-E918 VanDerWaalsContact CD-OE1 3.23Å; R914-E918 WeakPolarHBondContact CD-OE1 3.47Å; R914-E918 HydrophobicContact CG-CG 4.07Å; R914-E918 WeakPolarHBondContact CG-OE1 3.24Å; R914-E918 WeakPolarHBondContact O-CB 3.39Å; R914-E918 WeakPolarHBondContact O-CG 3.13Å; R914-E918 PolarHBondContact O-N 2.87Å; E918-K922 WeakPolarHBondContact O-CB 3.4Å; E918-K922 PolarHBondContact O-N 3.24Å
919	Y	92.9	Very high	90.2	Very high	102 Å²	102	57.5 Å²	57.5	40%	0.4	30%	0.297	S	S	.	.	H	α-helix	trans	-59.5	-56.2	174.1	172.2	-94.6	0	0	0	111.7	F910 E915 I917 M921 K922 T923 T925	F910-Y919 HydrophobicContact CE1-CD1 4.4Å; F910-Y919 HydrophobicContact CE1-CD2 4.08Å; F910-Y919 AromaticContact CE1-CG 3.76Å; F910-Y919 HydrophobicContact CE1-CG 3.76Å; F910-Y919 HydrophobicContact CE2-CD1 4.45Å; F910-Y919 AromaticContact CZ-CD1 3.66Å; F910-Y919 HydrophobicContact CZ-CD1 3.66Å; F910-Y919 HydrophobicContact CZ-CD2 4.01Å; F910-Y919 HydrophobicContact CZ-CE1 4.32Å; F910-Y919 AromaticContact CZ-CG 3.48Å; F910-Y919 HydrophobicContact CZ-CG 3.48Å; F910-Y919 VanDerWaalsContact CZ-CG 3.48Å; E915-Y919 VanDerWaalsContact O-CB 3.32Å; E915-Y919 WeakPolarHBondContact O-CB 3.46Å; E915-Y919 PolarHBondContact O-N 3.44Å; I917-Y919 VanDerWaalsContact C-N 3.29Å; I917-Y919 PolarHBondContact O-N 3.08Å; Y919-M921 PolarHBondContact O-N 3.48Å; Y919-K922 PolarHBondContact O-N 3.25Å; Y919-T923 HydrophobicContact CD2-CG2 4.01Å; Y919-T923 HydrophobicContact CE2-CG2 3.86Å; Y919-T923 WeakPolarHBondContact O-CB 3.28Å; Y919-T923 WeakPolarHBondContact O-CG2 3.4Å; Y919-T923 PolarHBondContact O-N 3.02Å; Y919-T923 PolarHBondContact O-OG1 3.47Å; Y919-T925 HydrophobicContact CE1-CG2 4.43Å; Y919-T925 VanDerWaalsContact CE1-OG1 3.26Å; Y919-T925 WeakPolarHBondContact CE1-OG1 3.31Å
920	H	92.6	Very high	90.3	Very high	10 Å²	10	59.2 Å²	59.2	5%	0.046	30%	0.303	C	S	.	.	H	α-helix	trans	-63.6	-40.2	-178.7	-78.8	-68	0	0	0	112.1	L916 I917 Q924 T925 P926 L935	L916-H920 PolarHBondContact O-CD2 2.88Å; L916-H920 VanDerWaalsContact O-CD2 3.32Å; L916-H920 PolarHBondContact O-N 2.91Å; I917-H920 PolarHBondContact O-N 3.21Å; H920-Q924 VanDerWaalsContact O-CA 3.3Å; H920-Q924 WeakPolarHBondContact O-CA 3.42Å; H920-Q924 PolarHBondContact O-N 3.23Å; H920-T925 PolarHBondContact ND1-O 3.2Å; H920-T925 PolarHBondContact ND1-OG1 3.44Å; H920-T925 VanDerWaalsContact ND1-OG1 3.16Å; H920-P926 PolarHBondContact CE1-O 2.87Å; H920-P926 VanDerWaalsContact CE1-O 3.31Å; H920-L935 HydrophobicContact CB-CB 4.42Å; H920-L935 HydrophobicContact CB-CD1 3.77Å; H920-L935 HydrophobicContact CB-CG 3.97Å
921	M	93.1	Very high	90.4	Very high	58 Å²	58	58.3 Å²	58.3	29%	0.286	30%	0.301	S	S	.	.	H	α-helix	trans	-61.8	-48.9	174.2	-75.3	-174.8	69.5	0	0	112.5	F831 I917 Y919 Q924 L935 P938	F831-M921 HydrophobicContact CE1-CE 4.43Å; F831-M921 HydrophobicContact CE1-CG 3.88Å; F831-M921 HydrophobicContact CE1-SD 3.75Å; F831-M921 HydrophobicContact CZ-CG 3.97Å; F831-M921 HydrophobicContact CZ-SD 3.52Å; F831-M921 VanDerWaalsContact CZ-SD 3.52Å; I917-M921 HydrophobicContact CG2-CG 4.34Å; I917-M921 HydrophobicContact CG2-SD 4.01Å; I917-M921 WeakPolarHBondContact O-CB 3.46Å; I917-M921 WeakPolarHBondContact O-CG 3.38Å; I917-M921 PolarHBondContact O-N 2.88Å; Y919-M921 PolarHBondContact O-N 3.48Å; M921-Q924 PolarHBondContact O-NE2 3.33Å; M921-L935 HydrophobicContact CG-CB 3.86Å; M921-P938 HydrophobicContact CE-CG 3.98Å; M921-P938 HydrophobicContact SD-CG 4.45Å
922	K	92.4	Very high	90.8	Very high	190 Å²	190	56.9 Å²	56.9	83%	0.826	30%	0.296	S	S	*	.	H	α-helix	trans	-74.1	-32.7	-173.3	-174.9	178.3	179.5	-179	0	113	E918 Y919	E918-K922 WeakPolarHBondContact O-CB 3.4Å; E918-K922 PolarHBondContact O-N 3.24Å; Y919-K922 PolarHBondContact O-N 3.25Å
923	T	91.9	Very high	91	Very high	66 Å²	66	55.2 Å²	55.2	41%	0.405	29%	0.286	S	S	.	.	H	α-helix	trans	-92.8	-15.9	-179	61.6	0	0	0	0	113.5	Y919 T925	Y919-T923 HydrophobicContact CD2-CG2 4.01Å; Y919-T923 HydrophobicContact CE2-CG2 3.86Å; Y919-T923 WeakPolarHBondContact O-CB 3.28Å; Y919-T923 WeakPolarHBondContact O-CG2 3.4Å; Y919-T923 PolarHBondContact O-N 3.02Å; Y919-T923 PolarHBondContact O-OG1 3.47Å; T923-T925 PolarHBondContact O-N 2.75Å; T923-T925 VanDerWaalsContact O-N 3.17Å; T923-T925 WeakPolarHBondContact OG1-CB 3.22Å; T923-T925 WeakPolarHBondContact OG1-CG2 3.31Å; T923-T925 PolarHBondContact OG1-N 2.94Å; T923-T925 PolarHBondContact OG1-OG1 3.1Å
924	Q	91.5	Very high	91.2	Very high	86 Å²	86	55.9 Å²	55.9	40%	0.402	29%	0.291	S	S	.	.			trans	54.6	21.9	-168.4	-66.1	-64.8	-61	0	0	113.6	H920 M921 C934 L935	H920-Q924 VanDerWaalsContact O-CA 3.3Å; H920-Q924 WeakPolarHBondContact O-CA 3.42Å; H920-Q924 PolarHBondContact O-N 3.23Å; M921-Q924 PolarHBondContact O-NE2 3.33Å; Q924-C934 PolarHBondContact O-SG 3.33Å; Q924-L935 PolarHBondContact NE2-O 2.83Å
925	T	90.3	Very high	91.3	Very high	42 Å²	42	52.8 Å²	52.8	26%	0.258	28%	0.279	S	S	.	.			trans	-66.9	137.1	172.8	48.5	0	0	0	0	110.3	Y919 H920 T923 V927	Y919-T925 HydrophobicContact CE1-CG2 4.43Å; Y919-T925 VanDerWaalsContact CE1-OG1 3.26Å; Y919-T925 WeakPolarHBondContact CE1-OG1 3.31Å; H920-T925 PolarHBondContact ND1-O 3.2Å; H920-T925 PolarHBondContact ND1-OG1 3.44Å; H920-T925 VanDerWaalsContact ND1-OG1 3.16Å; T923-T925 PolarHBondContact O-N 2.75Å; T923-T925 VanDerWaalsContact O-N 3.17Å; T923-T925 WeakPolarHBondContact OG1-CB 3.22Å; T923-T925 WeakPolarHBondContact OG1-CG2 3.31Å; T923-T925 PolarHBondContact OG1-N 2.94Å; T923-T925 PolarHBondContact OG1-OG1 3.1Å; T925-V927 PolarHBondContact O-N 2.97Å
926	P	91.8	Very high	91.5	Very high	56 Å²	56	52.6 Å²	52.6	36%	0.364	28%	0.283	S	S	.	.			trans	-55.5	136.8	174.3	-28.6	36.9	0	0	0	112.7	H920 T928 A933	H920-P926 PolarHBondContact CE1-O 2.87Å; H920-P926 VanDerWaalsContact CE1-O 3.31Å; P926-T928 WeakPolarHBondContact CB-O 3.49Å; P926-T928 PolarHBondContact O-N 3.02Å; P926-A933 CarbonylContact C-O 3.57Å; P926-A933 WeakPolarHBondContact CA-O 3.12Å
927	V	89.6	Confident	91.6	Very high	2 Å²	2	55.2 Å²	55.2	1%	0.012	30%	0.299	C	S	.	.	S	Bend	trans	-55.1	-33.3	172.9	168.8	0	0	0	0	111.9	L881 F891 L905 T925 A933 L935	L881-V927 HydrophobicContact CD2-CG1 3.77Å; L881-V927 HydrophobicContact CD2-CG2 3.97Å; F891-V927 HydrophobicContact CB-CG1 4.19Å; F891-V927 HydrophobicContact CD1-CG1 3.88Å; F891-V927 HydrophobicContact CD2-CG1 3.57Å; F891-V927 HydrophobicContact CE1-CG1 4.09Å; F891-V927 HydrophobicContact CE2-CB 4.4Å; F891-V927 HydrophobicContact CE2-CG1 3.79Å; F891-V927 HydrophobicContact CG-CG1 3.61Å; F891-V927 HydrophobicContact CZ-CB 4.46Å; F891-V927 HydrophobicContact CZ-CG1 4.03Å; L905-V927 HydrophobicContact CD1-CG1 3.84Å; L905-V927 HydrophobicContact CD2-CG1 3.92Å; L905-V927 HydrophobicContact CG-CG1 4.49Å; T925-V927 PolarHBondContact O-N 2.97Å; V927-A933 WeakPolarHBondContact CB-O 3.41Å; V927-A933 WeakPolarHBondContact CG2-O 3.43Å; V927-A933 PolarHBondContact N-O 3.37Å; V927-L935 HydrophobicContact CG2-CD1 4.31Å; V927-L935 HydrophobicContact CG2-CD2 3.51Å; V927-L935 HydrophobicContact CG2-CG 3.68Å
928	T	88.7	Confident	91.8	Very high	17 Å²	17	57.3 Å²	57.3	10%	0.104	31%	0.313	C	S	.	.	S	Bend	trans	-145.2	143.7	163.3	57.6	0	0	0	0	109.7	F891 E906 P926 K930 S931 G932	F891-T928 HydrophobicContact CD1-CG2 3.89Å; F891-T928 HydrophobicContact CE1-CG2 4.03Å; F891-T928 WeakPolarHBondContact CE1-OG1 3.24Å; E906-T928 VanDerWaalsContact CD-CG2 3.42Å; E906-T928 HydrophobicContact CG-CG2 3.74Å; E906-T928 WeakPolarHBondContact OE1-CB 3.22Å; E906-T928 WeakPolarHBondContact OE2-CA 3.44Å; E906-T928 WeakPolarHBondContact OE2-CB 3.49Å; P926-T928 WeakPolarHBondContact CB-O 3.49Å; P926-T928 PolarHBondContact O-N 3.02Å; T928-K930 PolarHBondContact O-N 3.21Å; T928-S931 PolarHBondContact O-N 2.69Å; T928-S931 PolarHBondContact O-OG 3.28Å; T928-S931 VanDerWaalsContact O-OG 3.09Å; T928-S931 WeakPolarHBondContact OG1-CB 3.33Å; T928-S931 PolarHBondContact OG1-N 3.43Å; T928-S931 PolarHBondContact OG1-OG 3.14Å; T928-G932 PolarHBondContact O-N 2.83Å
929	A	85.5	Confident	91.9	Very high	88 Å²	88	53.7 Å²	53.7	73%	0.727	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-35.9	179.9	0	0	0	0	0	111.4	E906	E906-A929 PolarHBondContact OE2-N 2.66Å
930	K	86.5	Confident	91.9	Very high	142 Å²	142	52 Å²	52	62%	0.617	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.7	-23.2	178.5	-174.1	173.3	179.3	177.4	0	114.5	T928	T928-K930 PolarHBondContact O-N 3.21Å
931	S	89.1	Confident	91.8	Very high	18 Å²	18	54.3 Å²	54.3	13%	0.126	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94	-26.5	179.7	68.2	0	0	0	0	113.9	T928 A933	T928-S931 PolarHBondContact O-N 2.69Å; T928-S931 PolarHBondContact O-OG 3.28Å; T928-S931 VanDerWaalsContact O-OG 3.09Å; T928-S931 WeakPolarHBondContact OG1-CB 3.33Å; T928-S931 PolarHBondContact OG1-N 3.43Å; T928-S931 PolarHBondContact OG1-OG 3.14Å; S931-A933 PolarHBondContact O-N 3.12Å; S931-A933 WeakPolarHBondContact OG-CB 3.39Å; S931-A933 PolarHBondContact OG-N 2.96Å
932	G	91.4	Very high	91.6	Very high	29 Å²	29	53.2 Å²	53.2	30%	0.299	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	62	15.2	-171.3	0	0	0	0	0	113.8	W885 T928	W885-G932 WeakPolarHBondContact CZ2-O 3.36Å; W885-G932 PolarHBondContact NE1-O 3.12Å; T928-G932 PolarHBondContact O-N 2.83Å
933	A	92.2	Very high	91.4	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	31%	0.309	C	S	.	.			trans	-84.3	113.7	-171.1	0	0	0	0	0	112.2	W885 F891 P926 V927 S931	W885-A933 HydrophobicContact CB-CB 3.6Å; W885-A933 HydrophobicContact CD2-CB 4.17Å; W885-A933 HydrophobicContact CG-CB 3.57Å; F891-A933 HydrophobicContact CE2-CB 4.44Å; F891-A933 HydrophobicContact CZ-CB 4.08Å; P926-A933 CarbonylContact C-O 3.57Å; P926-A933 WeakPolarHBondContact CA-O 3.12Å; V927-A933 WeakPolarHBondContact CB-O 3.41Å; V927-A933 WeakPolarHBondContact CG2-O 3.43Å; V927-A933 PolarHBondContact N-O 3.37Å; S931-A933 PolarHBondContact O-N 3.12Å; S931-A933 WeakPolarHBondContact OG-CB 3.39Å; S931-A933 PolarHBondContact OG-N 2.96Å
934	C	93.7	Very high	91.2	Very high	19 Å²	19	51.2 Å²	51.2	13%	0.128	30%	0.298	C	S	.	.			trans	-92.8	147.2	177	-58.2	0	0	0	0	111.1	G829 W885 Q924	G829-C934 WeakPolarHBondContact CA-O 3.37Å; W885-C934 HydrophobicContact CH2-CB 3.86Å; W885-C934 HydrophobicContact CZ2-CB 4.5Å; W885-C934 HydrophobicContact CZ3-CB 4.05Å; Q924-C934 PolarHBondContact O-SG 3.33Å
935	L	95.1	Very high	91.2	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	28%	0.281	C	S	.	.			trans	-89.3	122.7	174	-60	-168.2	0	0	0	110.2	F831 L881 V883 I917 H920 M921 Q924 V927	F831-L935 HydrophobicContact CB-CD2 3.8Å; F831-L935 HydrophobicContact CD1-CB 3.84Å; F831-L935 HydrophobicContact CD1-CD1 4.42Å; F831-L935 HydrophobicContact CD1-CD2 3.96Å; F831-L935 HydrophobicContact CD1-CG 4.29Å; F831-L935 HydrophobicContact CD2-CD1 4.28Å; F831-L935 HydrophobicContact CD2-CD2 4.33Å; F831-L935 HydrophobicContact CE1-CB 3.88Å; F831-L935 HydrophobicContact CE1-CD1 4.37Å; F831-L935 HydrophobicContact CE2-CD1 4.26Å; F831-L935 HydrophobicContact CG-CB 4.46Å; F831-L935 HydrophobicContact CG-CD1 4.37Å; F831-L935 HydrophobicContact CG-CD2 3.77Å; F831-L935 HydrophobicContact CG-CG 4.43Å; F831-L935 HydrophobicContact CZ-CD1 4.29Å; L881-L935 HydrophobicContact CD1-CD1 4.45Å; L881-L935 HydrophobicContact CD1-CD2 4.21Å; L881-L935 HydrophobicContact CD2-CD1 4.2Å; L881-L935 HydrophobicContact CD2-CD2 4.29Å; V883-L935 HydrophobicContact CG1-CD2 4.13Å; V883-L935 HydrophobicContact CG2-CD2 3.63Å; I917-L935 HydrophobicContact CD1-CD1 3.72Å; I917-L935 HydrophobicContact CG2-CD1 4.38Å; H920-L935 HydrophobicContact CB-CB 4.42Å; H920-L935 HydrophobicContact CB-CD1 3.77Å; H920-L935 HydrophobicContact CB-CG 3.97Å; M921-L935 HydrophobicContact CG-CB 3.86Å; Q924-L935 PolarHBondContact NE2-O 2.83Å; V927-L935 HydrophobicContact CG2-CD1 4.31Å; V927-L935 HydrophobicContact CG2-CD2 3.51Å; V927-L935 HydrophobicContact CG2-CG 3.68Å
936	V	95	Very high	91.3	Very high	70 Å²	70	46 Å²	46	42%	0.424	27%	0.27	S	S	.	.			trans	-120.8	-58	-177.2	-177.1	0	0	0	0	111	G829	G829-V936 PolarHBondContact O-N 2.94Å
937	T	95.1	Very high	91.2	Very high	57 Å²	57	44.2 Å²	44.2	35%	0.35	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	111.3	-172.9	-34.9	0	0	0	0	111.3	G829 D830 F831 I939	G829-T937 PolarHBondContact O-N 3.03Å; D830-T937 WeakPolarHBondContact CA-O 3.07Å; D830-T937 WeakPolarHBondContact OD1-CB 3.46Å; D830-T937 PolarHBondContact OD1-OG1 3.11Å; F831-T937 VanDerWaalsContact CD1-O 3.24Å; F831-T937 WeakPolarHBondContact CD1-O 3.32Å; F831-T937 PolarHBondContact N-O 3.2Å; T937-I939 HydrophobicContact CG2-CD1 4.09Å; T937-I939 PolarHBondContact O-N 3.04Å
938	P	96	Very high	91.2	Very high	45 Å²	45	44.8 Å²	44.8	29%	0.292	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	107.5	169.6	27.1	-30.7	0	0	0	109.5	W811 F831 M921 S940	W811-P938 HydrophobicContact CB-CB 3.96Å; W811-P938 HydrophobicContact CG-CB 4.28Å; F831-P938 HydrophobicContact CE1-CB 3.9Å; F831-P938 HydrophobicContact CE2-CB 4.3Å; F831-P938 HydrophobicContact CZ-CB 3.62Å; M921-P938 HydrophobicContact CE-CG 3.98Å; M921-P938 HydrophobicContact SD-CG 4.45Å; P938-S940 PolarHBondContact O-N 3.46Å; P938-S940 VanDerWaalsContact O-N 3.15Å
939	I	96.3	Very high	91.2	Very high	30 Å²	30	50.6 Å²	50.6	15%	0.154	28%	0.281	C	S	.	.			trans	-71.6	111.6	176.6	-60.3	-49.7	0	0	0	108.8	W811 H813 L824 L825 D830 F831 T937	W811-I939 WeakPolarHBondContact CA-O 3.42Å; H813-I939 PolarHBondContact NE2-O 3.21Å; L824-I939 HydrophobicContact CB-CG2 4.34Å; L825-I939 HydrophobicContact CD2-CB 4.37Å; L825-I939 HydrophobicContact CD2-CG1 3.77Å; D830-I939 HydrophobicContact CB-CD1 4.01Å; D830-I939 HydrophobicContact CB-CG1 3.98Å; F831-I939 PolarHBondContact O-N 3.48Å; T937-I939 HydrophobicContact CG2-CD1 4.09Å; T937-I939 PolarHBondContact O-N 3.04Å
940	S	92.8	Very high	91.5	Very high	68 Å²	68	50.4 Å²	50.4	48%	0.476	27%	0.268	S	S	.	.	P	Polyproline II helix	trans	-75.7	147.8	178.5	-61.2	0	0	0	0	111.4	P810 P938	P810-S940 CarbonylContact O-C 3.49Å; P810-S940 VanDerWaalsContact O-CA 3.27Å; P810-S940 WeakPolarHBondContact O-CA 3.43Å; P938-S940 PolarHBondContact O-N 3.46Å; P938-S940 VanDerWaalsContact O-N 3.15Å
941	R	89.9	Confident	91.8	Very high	58 Å²	58	44 Å²	44	22%	0.219	24%	0.241	C	C	.	.	P	Polyproline II helix	trans	-51.4	127.9	169.2	-70.2	-160.2	-67.1	-83.3	9.4	110.5	N807 E809 P810 F812 E945	N807-R941 PolarHBondContact O-NH1 2.94Å; N807-R941 PolarHBondContact O-NH2 3.26Å; E809-R941 PolarHBondContact O-NH1 3.32Å; P810-R941 PolarHBondContact O-N 3.13Å; F812-R941 WeakPolarHBondContact O-CD 3.12Å; F812-R941 WeakPolarHBondContact O-CG 3.07Å; F812-R941 PolarHBondContact O-NH1 3.21Å; R941-E945 HydrophobicContact CB-CB 4.3Å; R941-E945 VanDerWaalsContact CD-CD 3.43Å; R941-E945 WeakPolarHBondContact CD-OE1 3.49Å; R941-E945 WeakPolarHBondContact CG-OE1 3.29Å
942	P	88	Confident	92	Very high	35 Å²	35	48.7 Å²	48.7	23%	0.227	26%	0.261	C	S	.	.	P	Polyproline II helix	trans	-75.9	160.7	174.8	31.8	-35.1	0	0	0	111.6	W944 E945	P942-W944 HydrophobicContact CB-CG 4.46Å; P942-W944 HydrophobicContact CG-CD2 3.85Å; P942-W944 HydrophobicContact CG-CG 4.21Å; P942-W944 HydrophobicContact CG-CH2 4.25Å; P942-W944 HydrophobicContact CG-CZ2 3.51Å; P942-W944 VanDerWaalsContact CG-NE1 3.31Å; P942-W944 PolarHBondContact O-N 3.05Å; P942-E945 HydrophobicContact CG-CB 4.18Å; P942-E945 WeakPolarHBondContact O-CB 3.29Å; P942-E945 PolarHBondContact O-N 3.01Å
943	D	87.9	Confident	92.1	Very high	170 Å²	170	50.4 Å²	50.4	91%	0.909	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-17.3	-176.1	-70.1	-22.1	0	0	0	115.5
944	W	89.7	Confident	92.2	Very high	43 Å²	43	54.2 Å²	54.2	16%	0.163	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.5	-12.3	175.6	60.2	-104.2	0	0	0	113.9	E820 P942 L946 L1001 G1013 I1014	E820-W944 HydrophobicContact CG-CH2 4.08Å; E820-W944 WeakPolarHBondContact OE1-CZ2 3.49Å; P942-W944 HydrophobicContact CB-CG 4.46Å; P942-W944 HydrophobicContact CG-CD2 3.85Å; P942-W944 HydrophobicContact CG-CG 4.21Å; P942-W944 HydrophobicContact CG-CH2 4.25Å; P942-W944 HydrophobicContact CG-CZ2 3.51Å; P942-W944 VanDerWaalsContact CG-NE1 3.31Å; P942-W944 PolarHBondContact O-N 3.05Å; W944-L946 PolarHBondContact O-N 3.38Å; W944-L1001 HydrophobicContact CB-CD1 4.02Å; W944-L1001 HydrophobicContact CB-CD2 4.19Å; W944-L1001 HydrophobicContact CD2-CD1 3.55Å; W944-L1001 HydrophobicContact CE3-CD1 3.79Å; W944-L1001 HydrophobicContact CG-CD1 3.67Å; W944-G1013 CarbonylContact O-C 3.5Å; W944-G1013 WeakPolarHBondContact O-CA 3.49Å; W944-I1014 HydrophobicContact CE3-CB 4.37Å; W944-I1014 HydrophobicContact CE3-CD1 4.34Å; W944-I1014 HydrophobicContact CE3-CG1 4.25Å; W944-I1014 HydrophobicContact CZ3-CB 4.45Å; W944-I1014 HydrophobicContact CZ3-CD1 4.27Å; W944-I1014 PolarHBondContact O-N 2.92Å
945	E	90.8	Very high	92.2	Very high	12 Å²	12	60 Å²	60	6%	0.056	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	101.9	-179.2	-163	-171.1	141.2	0	0	110	H813 R941 P942 V1016	H813-E945 WeakPolarHBondContact CA-OE1 3.31Å; H813-E945 IonicContact CE1-OE2 3.61Å; H813-E945 IonicContact CG-OE2 2.67Å; H813-E945 IonicContact ND1-OE2 2.68Å; H813-E945 PolarHBondContact ND1-OE2 3.43Å; R941-E945 HydrophobicContact CB-CB 4.3Å; R941-E945 VanDerWaalsContact CD-CD 3.43Å; R941-E945 WeakPolarHBondContact CD-OE1 3.49Å; R941-E945 WeakPolarHBondContact CG-OE1 3.29Å; P942-E945 HydrophobicContact CG-CB 4.18Å; P942-E945 WeakPolarHBondContact O-CB 3.29Å; P942-E945 PolarHBondContact O-N 3.01Å; E945-V1016 HydrophobicContact CG-CG2 3.33Å; E945-V1016 WeakPolarHBondContact OE1-CG2 3.5Å
946	L	91.4	Very high	92.1	Very high	6 Å²	6	63.9 Å²	63.9	3%	0.031	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	154.5	-168.2	-48.7	-172.5	0	0	0	111.8	W944 Y970 I1014 A1015 V1024	W944-L946 PolarHBondContact O-N 3.38Å; L946-Y970 HydrophobicContact CD1-CD1 4.48Å; L946-Y970 HydrophobicContact CD1-CD2 4.46Å; L946-Y970 HydrophobicContact CD1-CE1 4.17Å; L946-Y970 HydrophobicContact CD1-CE2 4.19Å; L946-Y970 HydrophobicContact CD2-CE1 4.38Å; L946-Y970 HydrophobicContact CD2-CE2 4.47Å; L946-Y970 WeakPolarHBondContact CD2-OH 3.41Å; L946-I1014 PolarHBondContact N-O 3.44Å; L946-A1015 HydrophobicContact CB-CB 4.15Å; L946-A1015 WeakPolarHBondContact O-CA 3.5Å; L946-V1024 HydrophobicContact CD1-CB 3.83Å; L946-V1024 HydrophobicContact CD1-CG1 4.31Å; L946-V1024 HydrophobicContact CD1-CG2 3.78Å
947	D	89.6	Confident	91.9	Very high	20 Å²	20	64.3 Å²	64.3	11%	0.107	32%	0.324	C	S	.	.			trans	-76.6	132.1	166	-155.2	-47.9	0	0	0	110.4	R949 D950 Q1017	D947-R949 PolarHBondContact O-N 3.16Å; D947-R949 WeakPolarHBondContact OD1-CB 3.35Å; D947-R949 VanDerWaalsContact OD1-CG 3.22Å; D947-R949 WeakPolarHBondContact OD1-CG 3.39Å; D947-R949 IonicContact OD1-CZ 2.74Å; D947-R949 PolarHBondContact OD1-N 2.97Å; D947-R949 IonicContact OD1-NE 2.96Å; D947-R949 PolarHBondContact OD1-NE 2.86Å; D947-R949 IonicContact OD1-NH2 2.73Å; D947-R949 IonicContact OD2-CZ 3.6Å; D947-R949 VanDerWaalsContact OD2-CZ 3.31Å; D947-R949 IonicContact OD2-NE 3.74Å; D947-R949 PolarHBondContact OD2-NE 3.39Å; D947-R949 IonicContact OD2-NH2 3.37Å; D947-R949 PolarHBondContact OD2-NH2 3.09Å; D947-D950 HydrophobicContact CB-CB 4.32Å; D947-D950 WeakPolarHBondContact CB-OD2 3.48Å; D947-D950 PolarHBondContact O-N 3.5Å; D947-D950 VanDerWaalsContact O-N 3.16Å; D947-Q1017 VanDerWaalsContact CA-NE2 3.26Å; D947-Q1017 PolarHBondContact OD2-NE2 3.34Å; D947-Q1017 PolarHBondContact OD2-OE1 3.16Å
948	N	89.5	Confident	91.4	Very high	14 Å²	14	62.9 Å²	62.9	8%	0.075	32%	0.32	C	S	.	.	G	3₁₀ helix	trans	-61.8	-24.2	172.2	-64.8	67	0	0	0	111.6	D950 V1016 Q1017 S1018 P1020	N948-D950 VanDerWaalsContact C-N 3.35Å; N948-V1016 PolarHBondContact OD1-N 3.33Å; N948-Q1017 WeakPolarHBondContact OD1-CA 3.33Å; N948-Q1017 PolarHBondContact OD1-N 2.85Å; N948-S1018 WeakPolarHBondContact CB-OG 3.48Å; N948-S1018 PolarHBondContact ND2-O 3.5Å; N948-S1018 PolarHBondContact OD1-N 3.23Å; N948-P1020 PolarHBondContact ND2-O 2.84Å; N948-P1020 VanDerWaalsContact ND2-O 3.09Å
949	R	89.1	Confident	90.8	Very high	138 Å²	138	66.2 Å²	66.2	52%	0.521	33%	0.332	S	S	.	.	G	3₁₀ helix	trans	-72	-25.6	177.1	-61.1	174.8	-73	-169.7	4.2	113	D805 N807 D947	D805-R949 IonicContact OD2-CZ 3.6Å; D805-R949 IonicContact OD2-NH1 3.79Å; D805-R949 PolarHBondContact OD2-NH1 3.01Å; D805-R949 IonicContact OD2-NH2 3.51Å; N807-R949 VanDerWaalsContact CB-NH2 3.32Å; D947-R949 PolarHBondContact O-N 3.16Å; D947-R949 WeakPolarHBondContact OD1-CB 3.35Å; D947-R949 VanDerWaalsContact OD1-CG 3.22Å; D947-R949 WeakPolarHBondContact OD1-CG 3.39Å; D947-R949 IonicContact OD1-CZ 2.74Å; D947-R949 PolarHBondContact OD1-N 2.97Å; D947-R949 IonicContact OD1-NE 2.96Å; D947-R949 PolarHBondContact OD1-NE 2.86Å; D947-R949 IonicContact OD1-NH2 2.73Å; D947-R949 IonicContact OD2-CZ 3.6Å; D947-R949 VanDerWaalsContact OD2-CZ 3.31Å; D947-R949 IonicContact OD2-NE 3.74Å; D947-R949 PolarHBondContact OD2-NE 3.39Å; D947-R949 IonicContact OD2-NH2 3.37Å; D947-R949 PolarHBondContact OD2-NH2 3.09Å
950	D	92.1	Very high	89.6	Confident	85 Å²	85	66.1 Å²	66.1	46%	0.455	34%	0.338	S	S	.	.	G	3₁₀ helix	trans	-85.3	-10.7	-179.5	-63.9	-23.4	0	0	0	113	D947 N948 Y970	D947-D950 HydrophobicContact CB-CB 4.32Å; D947-D950 WeakPolarHBondContact CB-OD2 3.48Å; D947-D950 PolarHBondContact O-N 3.5Å; D947-D950 VanDerWaalsContact O-N 3.16Å; N948-D950 VanDerWaalsContact C-N 3.35Å; D950-Y970 HydrophobicContact CB-CD2 3.89Å; D950-Y970 HydrophobicContact CB-CE2 3.7Å; D950-Y970 WeakPolarHBondContact O-CD2 3.45Å
951	V	93.1	Very high	88.4	Confident	8 Å²	8	67.2 Å²	67.2	5%	0.048	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	96.6	-173.3	-177.1	0	0	0	0	110.5	L953 Y970 V977 A1015 M1022 V1024	V951-L953 PolarHBondContact O-N 3.34Å; V951-Y970 HydrophobicContact CG2-CD2 3.88Å; V951-V977 HydrophobicContact CG1-CG1 3.97Å; V951-V977 HydrophobicContact CG1-CG2 3.87Å; V951-A1015 HydrophobicContact CG2-CB 4.35Å; V951-M1022 HydrophobicContact CB-SD 4.38Å; V951-M1022 HydrophobicContact CG1-SD 3.96Å; V951-V1024 HydrophobicContact CG1-CG2 3.96Å; V951-V1024 HydrophobicContact CG2-CG2 3.86Å
952	Q	94.4	Very high	87.3	Confident	116 Å²	116	65.8 Å²	65.8	54%	0.542	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	112.4	177.5	-172.2	-179.5	16.7	0	0	110.9	L954 G968 V969	Q952-L954 HydrophobicContact CG-CD2 4.15Å; Q952-G968 CarbonylContact O-C 3.57Å; Q952-G968 WeakPolarHBondContact O-CA 3.41Å; Q952-V969 HydrophobicContact CB-CB 4.39Å; Q952-V969 PolarHBondContact N-O 2.88Å; Q952-V969 PolarHBondContact O-N 3.31Å
953	L	93.4	Very high	86.7	Confident	64 Å²	64	64.3 Å²	64.3	34%	0.335	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	134.2	169.7	-60.7	180	0	0	0	111	V951 Y966 V977 M1022	V951-L953 PolarHBondContact O-N 3.34Å; L953-Y966 HydrophobicContact CD2-CD2 4.36Å; L953-Y966 HydrophobicContact CD2-CG 4.22Å; L953-V977 HydrophobicContact CD2-CB 3.75Å; L953-V977 HydrophobicContact CD2-CG1 3.54Å; L953-V977 HydrophobicContact CD2-CG2 4.22Å; L953-M1022 HydrophobicContact CD1-CE 4.18Å; L953-M1022 HydrophobicContact CD1-SD 4.4Å; L953-M1022 HydrophobicContact CD2-SD 3.95Å; L953-M1022 HydrophobicContact CG-CE 4.44Å; L953-M1022 HydrophobicContact CG-SD 4.3Å
954	L	93.6	Very high	86.7	Confident	81 Å²	81	57.3 Å²	57.3	42%	0.424	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	-122.8	173.5	-56.3	175.8	0	0	0	110	Q952 R967 V969	Q952-L954 HydrophobicContact CG-CD2 4.15Å; L954-R967 WeakPolarHBondContact CA-O 3.47Å; L954-R967 VanDerWaalsContact CB-O 3.3Å; L954-R967 WeakPolarHBondContact CB-O 3.47Å; L954-R967 PolarHBondContact N-O 3.13Å; L954-V969 HydrophobicContact CD1-CG2 4.03Å
955	Q	92.6	Very high	86.8	Confident	140 Å²	140	56.6 Å²	56.6	65%	0.654	29%	0.289	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.8	137.9	-176.5	-171.9	179.5	10.5	0	0	112.2	I957 Y966 R967	Q955-I957 PolarHBondContact O-N 3.19Å; Q955-Y966 CarbonylContact O-C 3.57Å; Q955-Y966 VanDerWaalsContact O-CA 3.32Å; Q955-Y966 WeakPolarHBondContact O-CA 3.22Å; Q955-R967 PolarHBondContact O-N 3.33Å
956	K	93	Very high	87	Confident	82 Å²	82	58.7 Å²	58.7	36%	0.357	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	117.7	167	-177.4	175.3	172.2	175.4	0	110.1	G958 D964 V965 Y966	K956-G958 WeakPolarHBondContact CE-O 3.17Å; K956-G958 WeakPolarHBondContact CG-O 3.42Å; K956-D964 HydrophobicContact CD-CB 4.14Å; K956-D964 VanDerWaalsContact CE-OD2 3.26Å; K956-D964 WeakPolarHBondContact CE-OD2 3.5Å; K956-D964 IonicContact NZ-OD1 2.85Å; K956-D964 PolarHBondContact NZ-OD1 3.23Å; K956-D964 VanDerWaalsContact NZ-OD1 3.12Å; K956-D964 IonicContact NZ-OD2 2.72Å; K956-D964 PolarHBondContact NZ-OD2 3.4Å; K956-V965 CarbonylContact C-O 3.47Å; K956-Y966 HydrophobicContact CB-CD1 3.99Å; K956-Y966 HydrophobicContact CB-CE1 3.82Å
957	I	91.7	Very high	87.2	Confident	79 Å²	79	62.2 Å²	62.2	41%	0.405	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	-16.3	179.6	60.1	176.6	0	0	0	113.3	Q955 V965 R967 A976 Y1027	Q955-I957 PolarHBondContact O-N 3.19Å; I957-V965 HydrophobicContact CD1-CG1 4.12Å; I957-V965 HydrophobicContact CG1-CB 4.34Å; I957-V965 HydrophobicContact CG1-CG1 3.96Å; I957-V965 WeakPolarHBondContact CG1-O 3.37Å; I957-V965 PolarHBondContact N-O 3.19Å; I957-R967 HydrophobicContact CD1-CB 4.45Å; I957-R967 HydrophobicContact CG2-CB 3.83Å; I957-A976 HydrophobicContact CD1-CB 4.25Å; I957-Y1027 HydrophobicContact CD1-CD2 4.17Å; I957-Y1027 HydrophobicContact CD1-CE2 3.83Å
958	G	85.1	Confident	87.6	Confident	27 Å²	27	61.3 Å²	61.3	28%	0.278	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-165.6	-178.3	-177.7	0	0	0	0	0	114.2	K956 V965	K956-G958 WeakPolarHBondContact CE-O 3.17Å; K956-G958 WeakPolarHBondContact CG-O 3.42Å; G958-V965 PolarHBondContact N-O 3.04Å; G958-V965 PolarHBondContact O-N 3.26Å
959	Q	83.1	Confident	87.9	Confident	114 Å²	114	62.4 Å²	62.4	53%	0.533	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	122.9	176.7	179.8	172.8	-43.6	0	0	109	R981	Q959-R981 VanDerWaalsContact NE2-NH2 3.15Å
960	G	71.7	Confident	88.2	Confident	28 Å²	28	57.6 Å²	57.6	29%	0.289	29%	0.293	S	S	.	.			trans	-107.9	-169.1	177.5	0	0	0	0	0	112.5	F962 G963	G960-F962 VanDerWaalsContact C-N 3.33Å; G960-F962 PolarHBondContact O-N 3.05Å; G960-G963 PolarHBondContact N-O 3.08Å
961	N	67.5	Low	88.2	Confident	92 Å²	92	59.1 Å²	59.1	49%	0.492	30%	0.302	S	S	.	.	S	Bend	trans	-67.8	-29	-175.5	-66.2	-35	0	0	0	113.9	Q1108	N961-Q1108 VanDerWaalsContact CG-OE1 3.31Å; N961-Q1108 PolarHBondContact ND2-OE1 2.94Å
962	F	66.4	Low	88	Confident	28 Å²	28	62.1 Å²	62.1	12%	0.123	33%	0.334	C	S	.	.	S	Bend	trans	-100	-16.4	-176.5	-57	-87.9	0	0	0	114.1	G960 R981 L989 K992 F993	G960-F962 VanDerWaalsContact C-N 3.33Å; G960-F962 PolarHBondContact O-N 3.05Å; F962-R981 PolarHBondContact O-N 3.49Å; F962-R981 VanDerWaalsContact O-N 3.08Å; F962-L989 HydrophobicContact CD1-CD1 4.02Å; F962-L989 HydrophobicContact CE1-CD1 3.82Å; F962-K992 HydrophobicContact CE1-CB 4.12Å; F962-K992 HydrophobicContact CZ-CB 4.5Å; F962-F993 HydrophobicContact CB-CD2 3.41Å; F962-F993 VanDerWaalsContact CB-CD2 3.41Å; F962-F993 HydrophobicContact CB-CE2 3.77Å; F962-F993 HydrophobicContact CB-CG 4.42Å; F962-F993 HydrophobicContact CD1-CB 3.98Å; F962-F993 AromaticContact CD1-CD2 3.98Å; F962-F993 HydrophobicContact CD1-CD2 3.98Å; F962-F993 HydrophobicContact CD1-CG 4.46Å; F962-F993 AromaticContact CD2-CD2 3.85Å; F962-F993 HydrophobicContact CD2-CD2 3.85Å; F962-F993 HydrophobicContact CD2-CE2 4.48Å; F962-F993 HydrophobicContact CE1-CB 4.21Å; F962-F993 HydrophobicContact CG-CB 4.39Å; F962-F993 AromaticContact CG-CD2 3.51Å; F962-F993 HydrophobicContact CG-CD2 3.51Å; F962-F993 HydrophobicContact CG-CE2 4.26Å; F962-F993 HydrophobicContact CG-CG 4.4Å
963	G	75.4	Confident	88	Confident	4 Å²	4	60.4 Å²	60.4	4%	0.041	33%	0.334	C	S	.	.	S	Bend	trans	162.8	-154.6	-175.8	0	0	0	0	0	114.7	G960 T979	G960-G963 PolarHBondContact N-O 3.08Å; G963-T979 VanDerWaalsContact CA-O 3.3Å; G963-T979 WeakPolarHBondContact CA-O 3.34Å
964	D	88.3	Confident	88.1	Confident	22 Å²	22	61.7 Å²	61.7	12%	0.118	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	146.1	-165.9	-71.4	1.7	0	0	0	110.6	K956 Y966 T979 R981	K956-D964 HydrophobicContact CD-CB 4.14Å; K956-D964 VanDerWaalsContact CE-OD2 3.26Å; K956-D964 WeakPolarHBondContact CE-OD2 3.5Å; K956-D964 IonicContact NZ-OD1 2.85Å; K956-D964 PolarHBondContact NZ-OD1 3.23Å; K956-D964 VanDerWaalsContact NZ-OD1 3.12Å; K956-D964 IonicContact NZ-OD2 2.72Å; K956-D964 PolarHBondContact NZ-OD2 3.4Å; D964-Y966 HydrophobicContact CB-CD2 4.4Å; D964-Y966 HydrophobicContact CB-CE2 3.57Å; D964-T979 PolarHBondContact N-OG1 3.41Å; D964-T979 PolarHBondContact O-N 3.38Å; D964-T979 PolarHBondContact O-OG1 3.24Å; D964-T979 VanDerWaalsContact O-OG1 3.13Å; D964-R981 IonicContact OD1-CZ 2.71Å; D964-R981 IonicContact OD1-NE 3.96Å; D964-R981 IonicContact OD1-NH2 3.85Å; D964-R981 PolarHBondContact OD1-NH2 3.23Å
965	V	91.5	Very high	88.3	Confident	29 Å²	29	58 Å²	58	18%	0.176	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	126.8	178.5	-170.7	0	0	0	0	108.8	K956 I957 G958 V977 K978	K956-V965 CarbonylContact C-O 3.47Å; I957-V965 HydrophobicContact CD1-CG1 4.12Å; I957-V965 HydrophobicContact CG1-CB 4.34Å; I957-V965 HydrophobicContact CG1-CG1 3.96Å; I957-V965 WeakPolarHBondContact CG1-O 3.37Å; I957-V965 PolarHBondContact N-O 3.19Å; G958-V965 PolarHBondContact N-O 3.04Å; G958-V965 PolarHBondContact O-N 3.26Å; V965-V977 CarbonylContact C-O 3.53Å; V965-V977 WeakPolarHBondContact CA-O 3.49Å; V965-K978 HydrophobicContact CG2-CB 4.34Å; V965-K978 HydrophobicContact CG2-CG 4.29Å
966	Y	95.2	Very high	88.4	Confident	56 Å²	56	51.6 Å²	51.6	22%	0.22	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	152.1	-179.6	-63	-100.7	0	0	0	110.4	L953 Q955 K956 D964 A976 V977 T979	L953-Y966 HydrophobicContact CD2-CD2 4.36Å; L953-Y966 HydrophobicContact CD2-CG 4.22Å; Q955-Y966 CarbonylContact O-C 3.57Å; Q955-Y966 VanDerWaalsContact O-CA 3.32Å; Q955-Y966 WeakPolarHBondContact O-CA 3.22Å; K956-Y966 HydrophobicContact CB-CD1 3.99Å; K956-Y966 HydrophobicContact CB-CE1 3.82Å; D964-Y966 HydrophobicContact CB-CD2 4.4Å; D964-Y966 HydrophobicContact CB-CE2 3.57Å; Y966-A976 CarbonylContact O-C 3.54Å; Y966-A976 WeakPolarHBondContact O-CA 3.49Å; Y966-V977 PolarHBondContact N-O 3.47Å; Y966-V977 PolarHBondContact O-N 3.46Å; Y966-T979 HydrophobicContact CD2-CG2 4.09Å; Y966-T979 HydrophobicContact CE2-CG2 4.08Å
967	R	96.1	Very high	88.5	Confident	80 Å²	80	47.7 Å²	47.7	30%	0.302	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	145.8	152.3	-177.7	177.3	174.3	-140.1	6.1	107	L954 Q955 I957 E974 V975 Y1027	L954-R967 WeakPolarHBondContact CA-O 3.47Å; L954-R967 VanDerWaalsContact CB-O 3.3Å; L954-R967 WeakPolarHBondContact CB-O 3.47Å; L954-R967 PolarHBondContact N-O 3.13Å; Q955-R967 PolarHBondContact O-N 3.33Å; I957-R967 HydrophobicContact CD1-CB 4.45Å; I957-R967 HydrophobicContact CG2-CB 3.83Å; R967-E974 IonicContact CZ-OE1 3.37Å; R967-E974 IonicContact CZ-OE2 3.67Å; R967-E974 IonicContact NE-OE2 3.12Å; R967-E974 PolarHBondContact NE-OE2 3.03Å; R967-E974 IonicContact NH2-OE1 2.75Å; R967-E974 PolarHBondContact NH2-OE1 3.08Å; R967-E974 IonicContact NH2-OE2 3.23Å; R967-E974 PolarHBondContact NH2-OE2 3.33Å; R967-V975 CarbonylContact C-O 3.57Å; R967-Y1027 HydrophobicContact CB-CE2 4.29Å; R967-Y1027 HydrophobicContact CG-CD1 4.37Å; R967-Y1027 HydrophobicContact CG-CD2 4.21Å; R967-Y1027 HydrophobicContact CG-CE1 4.27Å; R967-Y1027 HydrophobicContact CG-CE2 4.14Å; R967-Y1027 HydrophobicContact CG-CG 4.36Å
968	G	96	Very high	88.5	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155	-178	-178.8	0	0	0	0	0	112.2	Q952 V975	Q952-G968 CarbonylContact O-C 3.57Å; Q952-G968 WeakPolarHBondContact O-CA 3.41Å; G968-V975 PolarHBondContact N-O 3.27Å; G968-V975 WeakPolarHBondContact O-CG2 3.46Å; G968-V975 PolarHBondContact O-N 2.88Å
969	V	96.7	Very high	88.6	Confident	38 Å²	38	43.7 Å²	43.7	23%	0.23	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	136.1	174.5	179.9	0	0	0	0	109.1	Q952 L954 C973	Q952-V969 HydrophobicContact CB-CB 4.39Å; Q952-V969 PolarHBondContact N-O 2.88Å; Q952-V969 PolarHBondContact O-N 3.31Å; L954-V969 HydrophobicContact CD1-CG2 4.03Å; V969-C973 WeakPolarHBondContact CA-O 3.38Å
970	Y	95.1	Very high	88.3	Confident	36 Å²	36	38.6 Å²	38.6	14%	0.141	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	127.6	172.4	171.3	-106.1	0	0	0	108.8	L946 D950 V951 G972 C973 V1012	L946-Y970 HydrophobicContact CD1-CD1 4.48Å; L946-Y970 HydrophobicContact CD1-CD2 4.46Å; L946-Y970 HydrophobicContact CD1-CE1 4.17Å; L946-Y970 HydrophobicContact CD1-CE2 4.19Å; L946-Y970 HydrophobicContact CD2-CE1 4.38Å; L946-Y970 HydrophobicContact CD2-CE2 4.47Å; L946-Y970 WeakPolarHBondContact CD2-OH 3.41Å; D950-Y970 HydrophobicContact CB-CD2 3.89Å; D950-Y970 HydrophobicContact CB-CE2 3.7Å; D950-Y970 WeakPolarHBondContact O-CD2 3.45Å; V951-Y970 HydrophobicContact CG2-CD2 3.88Å; Y970-G972 PolarHBondContact O-N 3.45Å; Y970-G972 VanDerWaalsContact O-N 3.14Å; Y970-C973 PolarHBondContact N-O 2.92Å; Y970-C973 PolarHBondContact O-N 3.22Å; Y970-V1012 HydrophobicContact CD1-CG1 3.73Å; Y970-V1012 HydrophobicContact CE1-CG1 3.77Å
971	N	92.1	Very high	88	Confident	118 Å²	118	41.6 Å²	41.6	63%	0.631	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	48.3	36.7	-173.8	-70.4	-23.1	0	0	0	114.5	C973	N971-C973 PolarHBondContact O-N 3.11Å
972	G	90	Very high	87.4	Confident	71 Å²	71	40 Å²	40	73%	0.732	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	76.9	-5.7	-178.3	0	0	0	0	0	115.4	Y970	Y970-G972 PolarHBondContact O-N 3.45Å; Y970-G972 VanDerWaalsContact O-N 3.14Å
973	C	93.3	Very high	86.7	Confident	80 Å²	80	44 Å²	44	54%	0.541	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	146.1	175	-67.5	0	0	0	0	111.3	V969 Y970 N971	V969-C973 WeakPolarHBondContact CA-O 3.38Å; Y970-C973 PolarHBondContact N-O 2.92Å; Y970-C973 PolarHBondContact O-N 3.22Å; N971-C973 PolarHBondContact O-N 3.11Å
974	E	95.6	Very high	85.5	Confident	91 Å²	91	45.6 Å²	45.6	43%	0.425	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	134.9	170.8	-65.6	-162.8	-163.1	0	0	111.9	R967 Y1027	R967-E974 IonicContact CZ-OE1 3.37Å; R967-E974 IonicContact CZ-OE2 3.67Å; R967-E974 IonicContact NE-OE2 3.12Å; R967-E974 PolarHBondContact NE-OE2 3.03Å; R967-E974 IonicContact NH2-OE1 2.75Å; R967-E974 PolarHBondContact NH2-OE1 3.08Å; R967-E974 IonicContact NH2-OE2 3.23Å; R967-E974 PolarHBondContact NH2-OE2 3.33Å; E974-Y1027 HydrophobicContact CB-CD1 4.26Å; E974-Y1027 VanDerWaalsContact OE2-CD1 3.23Å; E974-Y1027 WeakPolarHBondContact OE2-CD1 3.46Å
975	V	97.1	Very high	83.4	Confident	3 Å²	3	49.1 Å²	49.1	2%	0.018	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	150.2	-177.2	-71	0	0	0	0	111.1	R967 G968 V977 V1012 V1024 M1025	R967-V975 CarbonylContact C-O 3.57Å; G968-V975 PolarHBondContact N-O 3.27Å; G968-V975 WeakPolarHBondContact O-CG2 3.46Å; G968-V975 PolarHBondContact O-N 2.88Å; V975-V977 HydrophobicContact CB-CG2 4.43Å; V975-V977 HydrophobicContact CG2-CG2 3.74Å; V975-V1012 HydrophobicContact CG1-CG2 4.31Å; V975-V1024 HydrophobicContact CB-CG1 3.7Å; V975-V1024 HydrophobicContact CG1-CG1 3.7Å; V975-V1024 HydrophobicContact CG2-CG1 3.87Å; V975-M1025 CarbonylContact C-O 3.57Å; V975-M1025 VanDerWaalsContact CA-O 3.28Å; V975-M1025 WeakPolarHBondContact CA-O 3.22Å; V975-M1025 VanDerWaalsContact CB-O 3.32Å; V975-M1025 WeakPolarHBondContact CB-O 3.19Å
976	A	96.2	Very high	81.6	Confident	6 Å²	6	49.2 Å²	49.2	5%	0.05	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	139.3	158.8	0	0	0	0	0	108.7	I957 Y966 M1025 Y1027	I957-A976 HydrophobicContact CD1-CB 4.25Å; Y966-A976 CarbonylContact O-C 3.54Å; Y966-A976 WeakPolarHBondContact O-CA 3.49Å; A976-M1025 HydrophobicContact CB-CE 4.47Å; A976-M1025 HydrophobicContact CB-CG 3.87Å; A976-M1025 HydrophobicContact CB-SD 4.36Å; A976-M1025 PolarHBondContact N-O 3.25Å; A976-M1025 WeakPolarHBondContact O-CG 3.5Å; A976-M1025 PolarHBondContact O-N 3.46Å; A976-Y1027 HydrophobicContact CB-CD2 4.39Å
977	V	94.6	Very high	79.7	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	109.5	-173	-170.3	0	0	0	0	109.3	V951 L953 V965 Y966 V975 M1022 I1023 V1024	V951-V977 HydrophobicContact CG1-CG1 3.97Å; V951-V977 HydrophobicContact CG1-CG2 3.87Å; L953-V977 HydrophobicContact CD2-CB 3.75Å; L953-V977 HydrophobicContact CD2-CG1 3.54Å; L953-V977 HydrophobicContact CD2-CG2 4.22Å; V965-V977 CarbonylContact C-O 3.53Å; V965-V977 WeakPolarHBondContact CA-O 3.49Å; Y966-V977 PolarHBondContact N-O 3.47Å; Y966-V977 PolarHBondContact O-N 3.46Å; V975-V977 HydrophobicContact CB-CG2 4.43Å; V975-V977 HydrophobicContact CG2-CG2 3.74Å; V977-M1022 HydrophobicContact CG1-CB 3.68Å; V977-M1022 HydrophobicContact CG1-CG 4.23Å; V977-M1022 HydrophobicContact CG1-SD 3.74Å; V977-I1023 WeakPolarHBondContact CA-O 3.35Å; V977-V1024 HydrophobicContact CG1-CG2 4.37Å
978	K	91.3	Very high	77.9	Confident	10 Å²	10	47.9 Å²	47.9	4%	0.043	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	114.2	-177.2	176.6	178	-178.6	172.3	0	108.8	V965 F993 E997 M1022 I1023 D1090	V965-K978 HydrophobicContact CG2-CB 4.34Å; V965-K978 HydrophobicContact CG2-CG 4.29Å; K978-F993 HydrophobicContact CD-CE2 4.43Å; K978-F993 HydrophobicContact CG-CE2 4.08Å; K978-F993 HydrophobicContact CG-CZ 4.25Å; K978-E997 WeakPolarHBondContact CE-OE1 3.11Å; K978-E997 IonicContact NZ-OE1 3.14Å; K978-E997 PolarHBondContact NZ-OE1 2.95Å; K978-M1022 WeakPolarHBondContact O-CA 3.41Å; K978-I1023 HydrophobicContact CB-CB 4.36Å; K978-I1023 HydrophobicContact CD-CD1 4.48Å; K978-I1023 PolarHBondContact N-O 3.45Å; K978-I1023 PolarHBondContact O-N 2.84Å; K978-D1090 IonicContact NZ-OD1 3.1Å; K978-D1090 PolarHBondContact NZ-OD1 3.46Å; K978-D1090 IonicContact NZ-OD2 3.9Å; K978-D1090 PolarHBondContact NZ-OD2 2.96Å
979	T	87.8	Confident	76.1	Confident	12 Å²	12	50.6 Å²	50.6	7%	0.074	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	146.1	-177.3	65.5	0	0	0	0	112	G963 D964 Y966 P1020 M1022	G963-T979 VanDerWaalsContact CA-O 3.3Å; G963-T979 WeakPolarHBondContact CA-O 3.34Å; D964-T979 PolarHBondContact N-OG1 3.41Å; D964-T979 PolarHBondContact O-N 3.38Å; D964-T979 PolarHBondContact O-OG1 3.24Å; D964-T979 VanDerWaalsContact O-OG1 3.13Å; Y966-T979 HydrophobicContact CD2-CG2 4.09Å; Y966-T979 HydrophobicContact CE2-CG2 4.08Å; T979-P1020 HydrophobicContact CG2-CG 4.35Å; T979-M1022 HydrophobicContact CG2-CG 4.36Å
980	C	75.6	Confident	74.6	Confident	7 Å²	7	50 Å²	50	5%	0.047	29%	0.29	C	S	.	.	P	Polyproline II helix	trans	-89.3	132.6	165.5	-166.6	0	0	0	0	109.6	F993 I1021	C980-F993 HydrophobicContact CB-CD1 3.7Å; C980-F993 HydrophobicContact CB-CD2 4.34Å; C980-F993 HydrophobicContact CB-CE1 3.61Å; C980-F993 HydrophobicContact CB-CE2 4.23Å; C980-F993 HydrophobicContact CB-CG 4.07Å; C980-F993 HydrophobicContact CB-CZ 3.86Å; C980-I1021 HydrophobicContact CB-CB 4.4Å; C980-I1021 PolarHBondContact N-O 3.45Å
981	R	65.3	Low	73.3	Confident	90 Å²	90	54 Å²	54	34%	0.34	31%	0.305	S	S	.	.	P	Polyproline II helix	trans	-72.2	137.3	-179.8	-70.9	176	178.1	175.8	2.8	111.9	Q959 F962 D964 D983 M984	Q959-R981 VanDerWaalsContact NE2-NH2 3.15Å; F962-R981 PolarHBondContact O-N 3.49Å; F962-R981 VanDerWaalsContact O-N 3.08Å; D964-R981 IonicContact OD1-CZ 2.71Å; D964-R981 IonicContact OD1-NE 3.96Å; D964-R981 IonicContact OD1-NH2 3.85Å; D964-R981 PolarHBondContact OD1-NH2 3.23Å; R981-D983 VanDerWaalsContact C-N 3.26Å; R981-D983 WeakPolarHBondContact CB-OD1 3.44Å; R981-D983 PolarHBondContact O-N 3.03Å; R981-M984 HydrophobicContact CB-CE 4.49Å; R981-M984 HydrophobicContact CB-CG 4.37Å; R981-M984 VanDerWaalsContact O-CB 3.3Å; R981-M984 WeakPolarHBondContact O-CB 3.24Å; R981-M984 WeakPolarHBondContact O-CG 3.49Å; R981-M984 PolarHBondContact O-N 2.9Å; R981-M984 VanDerWaalsContact O-N 3.16Å
982	V	55.6	Low	72	Confident	60 Å²	60	53.3 Å²	53.3	36%	0.364	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-23.8	-172.9	-173.6	0	0	0	0	112.4	D873 M984 P1020	D873-V982 HydrophobicContact CB-CG1 4.12Å; D873-V982 WeakPolarHBondContact OD2-CG1 3.38Å; V982-M984 PolarHBondContact O-N 3.02Å; V982-M984 VanDerWaalsContact O-N 3.16Å; V982-P1020 HydrophobicContact CG2-CB 4.32Å
983	D	52.4	Low	70.9	Confident	110 Å²	110	50 Å²	50	59%	0.588	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	-10.7	174.3	63.6	-10.2	0	0	0	114	R981 T985	R981-D983 VanDerWaalsContact C-N 3.26Å; R981-D983 WeakPolarHBondContact CB-OD1 3.44Å; R981-D983 PolarHBondContact O-N 3.03Å; D983-T985 VanDerWaalsContact C-N 3.25Å; D983-T985 PolarHBondContact O-N 3.26Å
984	M	50.2	Low	70.1	Confident	39 Å²	39	46.5 Å²	46.5	19%	0.192	24%	0.237	C	C	.	.			trans	-80.4	61.4	178.4	-61.2	-166.9	172.6	0	0	112.9	R981 V982 A986 L989	R981-M984 HydrophobicContact CB-CE 4.49Å; R981-M984 HydrophobicContact CB-CG 4.37Å; R981-M984 VanDerWaalsContact O-CB 3.3Å; R981-M984 WeakPolarHBondContact O-CB 3.24Å; R981-M984 WeakPolarHBondContact O-CG 3.49Å; R981-M984 PolarHBondContact O-N 2.9Å; R981-M984 VanDerWaalsContact O-N 3.16Å; V982-M984 PolarHBondContact O-N 3.02Å; V982-M984 VanDerWaalsContact O-N 3.16Å; M984-A986 PolarHBondContact O-N 3.02Å; M984-L989 HydrophobicContact CB-CD2 3.95Å; M984-L989 HydrophobicContact CB-CG 4.36Å; M984-L989 HydrophobicContact CE-CD2 4.31Å; M984-L989 HydrophobicContact CG-CD2 3.83Å; M984-L989 HydrophobicContact SD-CD2 3.48Å; M984-L989 WeakPolarHBondContact SD-CD2 3.46Å; M984-L989 HydrophobicContact SD-CG 3.85Å
985	T	43.7	Very low	68.9	Low	96 Å²	96	46 Å²	46	59%	0.589	24%	0.235	S	C	*	.			trans	-58.5	-7.5	-174.1	56.1	0	0	0	0	116.4	D983 R990	D983-T985 VanDerWaalsContact C-N 3.25Å; D983-T985 PolarHBondContact O-N 3.26Å; T985-R990 PolarHBondContact O-NH2 3.48Å; T985-R990 VanDerWaalsContact O-NH2 3.13Å
986	A	53.2	Low	67.6	Low	30 Å²	30	45.9 Å²	45.9	25%	0.248	23%	0.234	C	C	.	.			trans	-77.2	129.4	176.6	0	0	0	0	0	112.9	M984 D988 L989 R990	M984-A986 PolarHBondContact O-N 3.02Å; A986-D988 HydrophobicContact CB-CB 4.49Å; A986-D988 PolarHBondContact O-N 3.25Å; A986-L989 HydrophobicContact CB-CB 4.12Å; A986-L989 PolarHBondContact O-N 3.12Å; A986-R990 PolarHBondContact O-N 2.98Å; A986-R990 PolarHBondContact O-NE 2.63Å
987	S	56.6	Low	66.7	Low	54 Å²	54	45.7 Å²	45.7	38%	0.378	23%	0.232	S	C	.	.	H	α-helix	trans	-51	-35.9	162	43	0	0	0	0	111.9	L989 R991	S987-L989 VanDerWaalsContact C-N 3.35Å; S987-L989 PolarHBondContact O-N 3.41Å; S987-R991 VanDerWaalsContact O-CB 3.3Å; S987-R991 WeakPolarHBondContact O-CB 3.42Å; S987-R991 PolarHBondContact O-N 3.13Å
988	D	58.2	Low	65.8	Low	54 Å²	54	46.3 Å²	46.3	29%	0.289	24%	0.236	S	C	.	.	H	α-helix	trans	-73.8	-26.2	-173.6	-50	-59.2	0	0	0	112.8	R839 A986 R991 K992	R839-D988 IonicContact CZ-OD2 3.79Å; R839-D988 IonicContact NH2-OD2 3.23Å; R839-D988 PolarHBondContact NH2-OD2 2.84Å; A986-D988 HydrophobicContact CB-CB 4.49Å; A986-D988 PolarHBondContact O-N 3.25Å; D988-R991 IonicContact OD1-CZ 3.77Å; D988-R991 IonicContact OD1-NE 3.51Å; D988-R991 IonicContact OD1-NH2 3.81Å; D988-R991 PolarHBondContact OD1-NH2 3.04Å; D988-K992 VanDerWaalsContact O-CG 3.29Å; D988-K992 WeakPolarHBondContact O-CG 3.39Å; D988-K992 PolarHBondContact O-N 2.91Å
989	L	57.4	Low	65	Low	57 Å²	57	47 Å²	47	30%	0.298	24%	0.241	S	C	.	.	H	α-helix	trans	-87	-36	177.1	-163.4	49.3	0	0	0	111.6	F962 M984 A986 S987 R991 K992 F993	F962-L989 HydrophobicContact CD1-CD1 4.02Å; F962-L989 HydrophobicContact CE1-CD1 3.82Å; M984-L989 HydrophobicContact CB-CD2 3.95Å; M984-L989 HydrophobicContact CB-CG 4.36Å; M984-L989 HydrophobicContact CE-CD2 4.31Å; M984-L989 HydrophobicContact CG-CD2 3.83Å; M984-L989 HydrophobicContact SD-CD2 3.48Å; M984-L989 WeakPolarHBondContact SD-CD2 3.46Å; M984-L989 HydrophobicContact SD-CG 3.85Å; A986-L989 HydrophobicContact CB-CB 4.12Å; A986-L989 PolarHBondContact O-N 3.12Å; S987-L989 VanDerWaalsContact C-N 3.35Å; S987-L989 PolarHBondContact O-N 3.41Å; L989-R991 VanDerWaalsContact C-N 3.33Å; L989-K992 HydrophobicContact CD1-CB 4.36Å; L989-K992 HydrophobicContact CD1-CD 4.46Å; L989-K992 PolarHBondContact O-N 2.91Å; L989-F993 WeakPolarHBondContact O-CB 3.35Å; L989-F993 PolarHBondContact O-N 2.97Å
990	R	66.4	Low	64.7	Low	27 Å²	27	46.5 Å²	46.5	10%	0.102	24%	0.238	C	C	.	.	H	α-helix	trans	-59.6	-41.6	165.3	-76.8	173	-76.4	-170.1	-5.8	112.2	P817 S837 T985 A986 F993 L994 Y1019 I1021	P817-R990 HydrophobicContact CG-CB 4.27Å; S837-R990 PolarHBondContact OG-NH1 3.44Å; S837-R990 PolarHBondContact OG-NH2 3.27Å; T985-R990 PolarHBondContact O-NH2 3.48Å; T985-R990 VanDerWaalsContact O-NH2 3.13Å; A986-R990 PolarHBondContact O-N 2.98Å; A986-R990 PolarHBondContact O-NE 2.63Å; R990-F993 WeakPolarHBondContact O-CB 3.49Å; R990-F993 PolarHBondContact O-N 2.98Å; R990-L994 PolarHBondContact O-N 3.07Å; R990-Y1019 PolarHBondContact NH1-OH 2.72Å; R990-I1021 HydrophobicContact CG-CD1 4.25Å
991	R	67.3	Low	65.1	Low	120 Å²	120	47.5 Å²	47.5	45%	0.453	24%	0.243	S	C	.	.	H	α-helix	trans	-59	-51.6	171.2	174.6	165.3	55.5	120.4	-7.9	111.3	A819 S987 D988 L989 F993 L994 Q995	A819-R991 HydrophobicContact CB-CG 4.46Å; S987-R991 VanDerWaalsContact O-CB 3.3Å; S987-R991 WeakPolarHBondContact O-CB 3.42Å; S987-R991 PolarHBondContact O-N 3.13Å; D988-R991 IonicContact OD1-CZ 3.77Å; D988-R991 IonicContact OD1-NE 3.51Å; D988-R991 IonicContact OD1-NH2 3.81Å; D988-R991 PolarHBondContact OD1-NH2 3.04Å; L989-R991 VanDerWaalsContact C-N 3.33Å; R991-F993 VanDerWaalsContact C-N 3.27Å; R991-F993 PolarHBondContact O-N 3.11Å; R991-L994 PolarHBondContact O-N 3.18Å; R991-Q995 VanDerWaalsContact O-CB 3.29Å; R991-Q995 WeakPolarHBondContact O-CB 3.27Å; R991-Q995 PolarHBondContact O-N 3.14Å
992	K	65.2	Low	66	Low	103 Å²	103	48.7 Å²	48.7	45%	0.448	26%	0.256	S	S	.	.	H	α-helix	trans	-61	-31	176.4	-76.2	173.9	-179.9	-175.9	0	113.6	F962 D988 L989	F962-K992 HydrophobicContact CE1-CB 4.12Å; F962-K992 HydrophobicContact CZ-CB 4.5Å; D988-K992 VanDerWaalsContact O-CG 3.29Å; D988-K992 WeakPolarHBondContact O-CG 3.39Å; D988-K992 PolarHBondContact O-N 2.91Å; L989-K992 HydrophobicContact CD1-CB 4.36Å; L989-K992 HydrophobicContact CD1-CD 4.46Å; L989-K992 PolarHBondContact O-N 2.91Å
993	F	66.4	Low	67.7	Low	1 Å²	1	46.1 Å²	46.1	0%	0.004	24%	0.24	C	C	.	.	H	α-helix	trans	-67.3	-45.1	177.8	179.4	-115.8	0	0	0	112.7	F962 K978 C980 L989 R990 R991 I1021 I1023	F962-F993 HydrophobicContact CB-CD2 3.41Å; F962-F993 VanDerWaalsContact CB-CD2 3.41Å; F962-F993 HydrophobicContact CB-CE2 3.77Å; F962-F993 HydrophobicContact CB-CG 4.42Å; F962-F993 HydrophobicContact CD1-CB 3.98Å; F962-F993 AromaticContact CD1-CD2 3.98Å; F962-F993 HydrophobicContact CD1-CD2 3.98Å; F962-F993 HydrophobicContact CD1-CG 4.46Å; F962-F993 AromaticContact CD2-CD2 3.85Å; F962-F993 HydrophobicContact CD2-CD2 3.85Å; F962-F993 HydrophobicContact CD2-CE2 4.48Å; F962-F993 HydrophobicContact CE1-CB 4.21Å; F962-F993 HydrophobicContact CG-CB 4.39Å; F962-F993 AromaticContact CG-CD2 3.51Å; F962-F993 HydrophobicContact CG-CD2 3.51Å; F962-F993 HydrophobicContact CG-CE2 4.26Å; F962-F993 HydrophobicContact CG-CG 4.4Å; K978-F993 HydrophobicContact CD-CE2 4.43Å; K978-F993 HydrophobicContact CG-CE2 4.08Å; K978-F993 HydrophobicContact CG-CZ 4.25Å; C980-F993 HydrophobicContact CB-CD1 3.7Å; C980-F993 HydrophobicContact CB-CD2 4.34Å; C980-F993 HydrophobicContact CB-CE1 3.61Å; C980-F993 HydrophobicContact CB-CE2 4.23Å; C980-F993 HydrophobicContact CB-CG 4.07Å; C980-F993 HydrophobicContact CB-CZ 3.86Å; L989-F993 WeakPolarHBondContact O-CB 3.35Å; L989-F993 PolarHBondContact O-N 2.97Å; R990-F993 WeakPolarHBondContact O-CB 3.49Å; R990-F993 PolarHBondContact O-N 2.98Å; R991-F993 VanDerWaalsContact C-N 3.27Å; R991-F993 PolarHBondContact O-N 3.11Å; F993-I1021 HydrophobicContact CD1-CG2 4.35Å; F993-I1021 HydrophobicContact CE1-CG2 4.02Å; F993-I1023 HydrophobicContact CD1-CD1 4.19Å; F993-I1023 HydrophobicContact CD2-CD1 4.4Å; F993-I1023 HydrophobicContact CE1-CD1 3.62Å; F993-I1023 HydrophobicContact CE1-CG1 3.85Å; F993-I1023 HydrophobicContact CE2-CD1 3.92Å; F993-I1023 HydrophobicContact CZ-CD1 3.49Å; F993-I1023 VanDerWaalsContact CZ-CD1 3.49Å; F993-I1023 HydrophobicContact CZ-CG1 3.94Å
994	L	75.1	Confident	69.6	Low	7 Å²	7	46.8 Å²	46.8	4%	0.037	24%	0.243	C	C	.	.	H	α-helix	trans	-85.7	-27.2	-179.6	-58.1	-169	0	0	0	113.8	P817 R990 R991 G996 E997 T998 I1014 I1021 I1023	P817-L994 HydrophobicContact CG-CD1 3.77Å; R990-L994 PolarHBondContact O-N 3.07Å; R991-L994 PolarHBondContact O-N 3.18Å; L994-G996 VanDerWaalsContact C-N 3.32Å; L994-G996 PolarHBondContact O-N 3.32Å; L994-E997 PolarHBondContact O-N 3.15Å; L994-T998 PolarHBondContact O-N 2.85Å; L994-T998 PolarHBondContact O-OG1 3.36Å; L994-I1014 HydrophobicContact CD1-CG2 4.49Å; L994-I1014 HydrophobicContact CD2-CD1 4.32Å; L994-I1014 HydrophobicContact CD2-CG2 3.82Å; L994-I1021 HydrophobicContact CD2-CG2 4.16Å; L994-I1023 HydrophobicContact CD2-CD1 4.14Å; L994-I1023 HydrophobicContact CD2-CG1 4.07Å
995	Q	72.3	Confident	71.7	Confident	80 Å²	80	46.9 Å²	46.9	37%	0.374	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.6	-39.7	-163.1	-175.5	172.5	14.8	0	0	116	R991 R1095	R991-Q995 VanDerWaalsContact O-CB 3.29Å; R991-Q995 WeakPolarHBondContact O-CB 3.27Å; R991-Q995 PolarHBondContact O-N 3.14Å; Q995-R1095 VanDerWaalsContact CD-CZ 3.48Å
996	G	69.4	Low	74.2	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.5	-18	177.4	0	0	0	0	0	114.5	L994 A1000 F1091 S1094	L994-G996 VanDerWaalsContact C-N 3.32Å; L994-G996 PolarHBondContact O-N 3.32Å; G996-A1000 PolarHBondContact O-N 3.27Å; G996-F1091 CarbonylContact C-O 3.37Å; G996-F1091 VanDerWaalsContact CA-O 3.24Å; G996-F1091 WeakPolarHBondContact CA-O 3.14Å; G996-S1094 WeakPolarHBondContact CA-O 3.45Å
997	E	77.1	Confident	76.3	Confident	2 Å²	2	44.7 Å²	44.7	1%	0.009	23%	0.228	C	C	.	.	H	α-helix	trans	-82.7	-35.2	-179.3	-58.9	-97.9	-150.5	0	0	110.2	K978 L994 T999 A1000 L1001 L1011 I1023	K978-E997 WeakPolarHBondContact CE-OE1 3.11Å; K978-E997 IonicContact NZ-OE1 3.14Å; K978-E997 PolarHBondContact NZ-OE1 2.95Å; L994-E997 PolarHBondContact O-N 3.15Å; E997-T999 VanDerWaalsContact C-N 3.3Å; E997-T999 PolarHBondContact O-N 2.95Å; E997-A1000 PolarHBondContact O-N 3.21Å; E997-L1001 PolarHBondContact O-N 3.31Å; E997-L1011 HydrophobicContact CB-CD2 4.09Å; E997-L1011 WeakPolarHBondContact O-CD2 3.29Å; E997-I1023 HydrophobicContact CB-CD1 3.75Å; E997-I1023 HydrophobicContact CG-CD1 3.61Å
998	T	75.4	Confident	78.2	Confident	14 Å²	14	42.3 Å²	42.3	9%	0.086	21%	0.211	C	C	.	.	H	α-helix	trans	-58.9	-40	170.5	-54.3	0	0	0	0	111.9	L994 A1000 L1001	L994-T998 PolarHBondContact O-N 2.85Å; L994-T998 PolarHBondContact O-OG1 3.36Å; T998-A1000 VanDerWaalsContact C-N 3.32Å; T998-A1000 PolarHBondContact O-N 2.74Å; T998-L1001 HydrophobicContact CG2-CD1 4.15Å; T998-L1001 WeakPolarHBondContact O-CB 3.48Å; T998-L1001 WeakPolarHBondContact O-CG 3.18Å; T998-L1001 PolarHBondContact O-N 2.88Å
999	T	75.3	Confident	80	Confident	24 Å²	24	39.8 Å²	39.8	15%	0.147	20%	0.197	C	C	.	.	H	α-helix	trans	-59	-44.5	171.4	-75.1	0	0	0	0	111.1	E997 L1001 N1002 F1003 E1096	E997-T999 VanDerWaalsContact C-N 3.3Å; E997-T999 PolarHBondContact O-N 2.95Å; T999-L1001 PolarHBondContact O-N 2.81Å; T999-N1002 PolarHBondContact O-N 3.45Å; T999-F1003 HydrophobicContact CG2-CE1 4.09Å; T999-F1003 HydrophobicContact CG2-CE2 4.38Å; T999-F1003 HydrophobicContact CG2-CZ 3.61Å; T999-E1096 HydrophobicContact CG2-CB 4Å; T999-E1096 HydrophobicContact CG2-CG 4.44Å; T999-E1096 WeakPolarHBondContact CG2-OE2 3.27Å
1000	A	81.4	Confident	81.7	Confident	1 Å²	1	42.2 Å²	42.2	1%	0.008	21%	0.206	C	C	.	.	H	α-helix	trans	-70.6	-12.1	-176.2	0	0	0	0	0	114.8	G996 E997 T998 N1002 F1003 L1011 F1091	G996-A1000 PolarHBondContact O-N 3.27Å; E997-A1000 PolarHBondContact O-N 3.21Å; T998-A1000 VanDerWaalsContact C-N 3.32Å; T998-A1000 PolarHBondContact O-N 2.74Å; A1000-N1002 PolarHBondContact O-N 3.26Å; A1000-F1003 HydrophobicContact CB-CD2 3.73Å; A1000-F1003 HydrophobicContact CB-CE2 3.96Å; A1000-F1003 HydrophobicContact CB-CG 4.43Å; A1000-F1003 WeakPolarHBondContact O-CB 3.43Å; A1000-F1003 PolarHBondContact O-N 3.25Å; A1000-L1011 HydrophobicContact CB-CD1 3.82Å; A1000-L1011 HydrophobicContact CB-CD2 3.97Å; A1000-F1091 HydrophobicContact CB-CB 3.79Å; A1000-F1091 HydrophobicContact CB-CD1 4.13Å; A1000-F1091 HydrophobicContact CB-CD2 3.78Å; A1000-F1091 HydrophobicContact CB-CE2 4.49Å; A1000-F1091 HydrophobicContact CB-CG 3.6Å
1001	L	83.9	Confident	82.9	Confident	29 Å²	29	41.3 Å²	41.3	15%	0.152	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-30.6	170.6	-67.2	172.1	0	0	0	113	W944 E997 T998 T999 F1003 L1011 I1014	W944-L1001 HydrophobicContact CB-CD1 4.02Å; W944-L1001 HydrophobicContact CB-CD2 4.19Å; W944-L1001 HydrophobicContact CD2-CD1 3.55Å; W944-L1001 HydrophobicContact CE3-CD1 3.79Å; W944-L1001 HydrophobicContact CG-CD1 3.67Å; E997-L1001 PolarHBondContact O-N 3.31Å; T998-L1001 HydrophobicContact CG2-CD1 4.15Å; T998-L1001 WeakPolarHBondContact O-CB 3.48Å; T998-L1001 WeakPolarHBondContact O-CG 3.18Å; T998-L1001 PolarHBondContact O-N 2.88Å; T999-L1001 PolarHBondContact O-N 2.81Å; L1001-F1003 VanDerWaalsContact C-N 3.33Å; L1001-L1011 HydrophobicContact CD2-CB 3.96Å; L1001-L1011 HydrophobicContact CD2-CD2 4.12Å; L1001-L1011 HydrophobicContact CG-CD2 4.43Å; L1001-I1014 HydrophobicContact CD1-CD1 3.97Å; L1001-I1014 HydrophobicContact CD1-CG1 4.29Å; L1001-I1014 HydrophobicContact CD2-CG1 4.13Å; L1001-I1014 HydrophobicContact CG-CD1 4.49Å
1002	N	83.8	Confident	84.1	Confident	115 Å²	115	38 Å²	38	62%	0.615	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.3	7.1	-179.9	-65.9	-59.3	0	0	0	113.6	T999 A1000 R1066	T999-N1002 PolarHBondContact O-N 3.45Å; A1000-N1002 PolarHBondContact O-N 3.26Å; N1002-R1066 PolarHBondContact O-NH2 3.28Å
1003	F	90.5	Very high	85.4	Confident	6 Å²	6	33.1 Å²	33.1	3%	0.026	18%	0.175	C	C	.	.			trans	-91.3	130	-179.4	-63.2	-10.3	0	0	0	111.7	T999 A1000 L1001 I1008 Y1062 L1063 R1066 C1068 F1091	T999-F1003 HydrophobicContact CG2-CE1 4.09Å; T999-F1003 HydrophobicContact CG2-CE2 4.38Å; T999-F1003 HydrophobicContact CG2-CZ 3.61Å; A1000-F1003 HydrophobicContact CB-CD2 3.73Å; A1000-F1003 HydrophobicContact CB-CE2 3.96Å; A1000-F1003 HydrophobicContact CB-CG 4.43Å; A1000-F1003 WeakPolarHBondContact O-CB 3.43Å; A1000-F1003 PolarHBondContact O-N 3.25Å; L1001-F1003 VanDerWaalsContact C-N 3.33Å; F1003-I1008 HydrophobicContact CB-CG2 4.05Å; F1003-I1008 HydrophobicContact CD2-CG2 4.35Å; F1003-Y1062 HydrophobicContact CB-CE1 4Å; F1003-Y1062 HydrophobicContact CD1-CE1 4.04Å; F1003-Y1062 HydrophobicContact CG-CE1 4.03Å; F1003-L1063 HydrophobicContact CD2-CD2 3.74Å; F1003-L1063 HydrophobicContact CE2-CD2 3.36Å; F1003-L1063 HydrophobicContact CZ-CD2 3.89Å; F1003-R1066 HydrophobicContact CE1-CB 4.26Å; F1003-R1066 HydrophobicContact CE1-CG 4.27Å; F1003-C1068 HydrophobicContact CE2-CB 4.38Å; F1003-C1068 HydrophobicContact CZ-CB 3.8Å; F1003-F1091 HydrophobicContact CD2-CD1 4.38Å; F1003-F1091 HydrophobicContact CD2-CE1 4.06Å; F1003-F1091 HydrophobicContact CD2-CZ 4.34Å; F1003-F1091 AromaticContact CE2-CD1 3.99Å; F1003-F1091 HydrophobicContact CE2-CD1 3.99Å; F1003-F1091 AromaticContact CE2-CE1 3.9Å; F1003-F1091 HydrophobicContact CE2-CE1 3.9Å
1004	N	92.1	Very high	86.5	Confident	123 Å²	123	33.1 Å²	33.1	66%	0.658	17%	0.174	S	C	*	.			trans	-146.1	97.9	180	-175.7	37.8	0	0	0	108.7	Y1062	N1004-Y1062 PolarHBondContact N-OH 3.4Å; N1004-Y1062 VanDerWaalsContact N-OH 3.08Å
1005	H	96	Very high	87.3	Confident	42 Å²	42	32.8 Å²	32.8	19%	0.194	17%	0.173	C	C	.	.			trans	-157.8	139.1	-177.3	-179.7	-92.9	0	0	0	108.5	N1007 I1008 N1058 Y1062	H1005-N1007 VanDerWaalsContact C-N 3.27Å; H1005-N1007 PolarHBondContact CE1-OD1 3.1Å; H1005-N1007 PolarHBondContact ND1-N 3.19Å; H1005-N1007 PolarHBondContact O-N 3.4Å; H1005-I1008 HydrophobicContact CB-CB 4.18Å; H1005-I1008 HydrophobicContact CB-CG1 3.85Å; H1005-I1008 PolarHBondContact O-N 2.94Å; H1005-I1008 VanDerWaalsContact O-O 3.13Å; H1005-N1058 PolarHBondContact CE1-O 2.99Å; H1005-Y1062 HydrophobicContact CB-CD1 3.99Å; H1005-Y1062 HydrophobicContact CB-CD2 3.73Å; H1005-Y1062 HydrophobicContact CB-CE1 4.22Å; H1005-Y1062 HydrophobicContact CB-CE2 3.94Å; H1005-Y1062 HydrophobicContact CB-CG 3.74Å; H1005-Y1062 AromaticContact CD2-CD2 3.69Å; H1005-Y1062 AromaticContact CD2-CG 3.93Å; H1005-Y1062 AromaticContact CG-CD2 3.87Å; H1005-Y1062 AromaticContact CG-CG 3.79Å
1006	P	95.8	Very high	88	Confident	72 Å²	72	29 Å²	29	47%	0.468	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-38.5	-173.7	20	-33.6	0	0	0	113.6	I1008 K1087	P1006-I1008 VanDerWaalsContact C-N 3.33Å; P1006-I1008 PolarHBondContact O-N 2.94Å; P1006-K1087 WeakPolarHBondContact O-CD 3.49Å; P1006-K1087 WeakPolarHBondContact O-CE 3.27Å; P1006-K1087 WeakPolarHBondContact O-CG 3.26Å
1007	N	97.6	Very high	88.8	Confident	8 Å²	8	29.2 Å²	29.2	4%	0.043	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.3	16.4	179.5	-49.2	107.2	0	0	0	114.5	H1005 D1055 L1086 K1087 I1088	H1005-N1007 VanDerWaalsContact C-N 3.27Å; H1005-N1007 PolarHBondContact CE1-OD1 3.1Å; H1005-N1007 PolarHBondContact ND1-N 3.19Å; H1005-N1007 PolarHBondContact O-N 3.4Å; N1007-D1055 WeakPolarHBondContact CB-O 3.39Å; N1007-D1055 VanDerWaalsContact CG-O 3.27Å; N1007-D1055 WeakPolarHBondContact ND2-CB 3.25Å; N1007-D1055 VanDerWaalsContact ND2-CG 3.31Å; N1007-D1055 PolarHBondContact ND2-OD1 2.97Å; N1007-L1086 WeakPolarHBondContact CA-O 3.36Å; N1007-L1086 WeakPolarHBondContact CB-O 3.49Å; N1007-L1086 PolarHBondContact ND2-O 3.32Å; N1007-K1087 CarbonylContact O-C 3.45Å; N1007-K1087 WeakPolarHBondContact O-CA 3.36Å; N1007-I1088 PolarHBondContact O-N 2.9Å
1008	I	96.5	Very high	89	Confident	3 Å²	3	31.4 Å²	31.4	2%	0.015	17%	0.172	C	C	.	.	B	Isolated β-bridge	trans	-117	134.7	170.7	-60.9	-59.9	0	0	0	107.7	F1003 H1005 P1006 K1010 Y1062 L1063 I1088 F1091	F1003-I1008 HydrophobicContact CB-CG2 4.05Å; F1003-I1008 HydrophobicContact CD2-CG2 4.35Å; H1005-I1008 HydrophobicContact CB-CB 4.18Å; H1005-I1008 HydrophobicContact CB-CG1 3.85Å; H1005-I1008 PolarHBondContact O-N 2.94Å; H1005-I1008 VanDerWaalsContact O-O 3.13Å; P1006-I1008 VanDerWaalsContact C-N 3.33Å; P1006-I1008 PolarHBondContact O-N 2.94Å; I1008-K1010 PolarHBondContact O-N 3.29Å; I1008-Y1062 HydrophobicContact CG1-CD1 4.04Å; I1008-L1063 HydrophobicContact CD1-CD1 3.94Å; I1008-L1063 HydrophobicContact CD1-CD2 4.19Å; I1008-L1063 HydrophobicContact CD1-CG 3.94Å; I1008-I1088 HydrophobicContact CD1-CB 3.99Å; I1008-I1088 HydrophobicContact CD1-CD1 4.29Å; I1008-I1088 HydrophobicContact CD1-CG1 4.48Å; I1008-F1091 HydrophobicContact CD1-CZ 4.34Å; I1008-F1091 HydrophobicContact CG2-CE2 4.06Å; I1008-F1091 HydrophobicContact CG2-CZ 3.77Å
1009	V	95.2	Very high	89.1	Confident	1 Å²	1	32.7 Å²	32.7	1%	0.006	18%	0.175	C	C	.	.	P	Polyproline II helix	trans	-70.9	118.3	174.6	-178.9	0	0	0	0	108.9	L1011 M1025 E1026 V1028 L1079 K1087 I1088 A1089	V1009-L1011 PolarHBondContact O-N 2.95Å; V1009-M1025 HydrophobicContact CB-CE 4.45Å; V1009-M1025 HydrophobicContact CG1-CE 3.46Å; V1009-M1025 VanDerWaalsContact CG1-CE 3.46Å; V1009-E1026 HydrophobicContact CG1-CG 3.64Å; V1009-V1028 HydrophobicContact CG1-CG2 4.31Å; V1009-V1028 HydrophobicContact CG2-CG2 4.29Å; V1009-L1079 HydrophobicContact CG2-CB 4.41Å; V1009-L1079 HydrophobicContact CG2-CD1 3.96Å; V1009-L1079 HydrophobicContact CG2-CG 4.24Å; V1009-K1087 HydrophobicContact CB-CB 4.48Å; V1009-K1087 HydrophobicContact CG2-CB 3.38Å; V1009-K1087 HydrophobicContact CG2-CD 4.23Å; V1009-K1087 HydrophobicContact CG2-CG 4.44Å; V1009-I1088 WeakPolarHBondContact CG2-O 3.36Å; V1009-I1088 PolarHBondContact N-O 3.37Å; V1009-A1089 HydrophobicContact CB-CB 4.15Å; V1009-A1089 HydrophobicContact CG2-CB 3.74Å
1010	K	93.3	Very high	89.4	Confident	109 Å²	109	33.4 Å²	33.4	47%	0.474	18%	0.18	S	C	.	.	P	Polyproline II helix	trans	-70.4	123.7	-178.1	177.9	171.7	179.6	178.8	0	111.3	I1008 M1025 E1026	I1008-K1010 PolarHBondContact O-N 3.29Å; K1010-M1025 WeakPolarHBondContact O-CA 3.3Å; K1010-E1026 HydrophobicContact CB-CG 4.24Å; K1010-E1026 WeakPolarHBondContact CB-OE1 3.34Å; K1010-E1026 PolarHBondContact N-OE1 3.06Å; K1010-E1026 PolarHBondContact O-N 3.36Å
1011	L	91.7	Very high	89.6	Confident	8 Å²	8	33.4 Å²	33.4	4%	0.042	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	143.6	163.2	-76.7	67.9	0	0	0	109.6	E997 A1000 L1001 V1009 I1023 M1025 F1091	E997-L1011 HydrophobicContact CB-CD2 4.09Å; E997-L1011 WeakPolarHBondContact O-CD2 3.29Å; A1000-L1011 HydrophobicContact CB-CD1 3.82Å; A1000-L1011 HydrophobicContact CB-CD2 3.97Å; L1001-L1011 HydrophobicContact CD2-CB 3.96Å; L1001-L1011 HydrophobicContact CD2-CD2 4.12Å; L1001-L1011 HydrophobicContact CG-CD2 4.43Å; V1009-L1011 PolarHBondContact O-N 2.95Å; L1011-I1023 HydrophobicContact CD2-CG2 4.11Å; L1011-I1023 HydrophobicContact CG-CG2 4.41Å; L1011-M1025 HydrophobicContact CG-CB 4.5Å; L1011-F1091 HydrophobicContact CD1-CD2 4.31Å
1012	V	92.3	Very high	89.9	Confident	51 Å²	51	32.6 Å²	32.6	31%	0.309	18%	0.176	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	-38.1	178.4	178.7	0	0	0	0	110.4	Y970 V975 V1024	Y970-V1012 HydrophobicContact CD1-CG1 3.73Å; Y970-V1012 HydrophobicContact CE1-CG1 3.77Å; V975-V1012 HydrophobicContact CG1-CG2 4.31Å; V1012-V1024 HydrophobicContact CB-CB 4.4Å; V1012-V1024 HydrophobicContact CB-CG1 4.06Å; V1012-V1024 HydrophobicContact CG1-CG1 4.37Å; V1012-V1024 PolarHBondContact N-O 3.22Å
1013	G	91.7	Very high	90.2	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	168.1	-172.9	178.7	0	0	0	0	0	112.4	W944 V1024	W944-G1013 CarbonylContact O-C 3.5Å; W944-G1013 WeakPolarHBondContact O-CA 3.49Å; G1013-V1024 PolarHBondContact N-O 2.93Å; G1013-V1024 VanDerWaalsContact N-O 3.14Å; G1013-V1024 PolarHBondContact O-N 3.03Å
1014	I	91.1	Very high	90.4	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	119.9	-179.9	-42.8	-179.9	0	0	0	108.2	W944 L946 L994 L1001 V1016 I1021 M1022 I1023	W944-I1014 HydrophobicContact CE3-CB 4.37Å; W944-I1014 HydrophobicContact CE3-CD1 4.34Å; W944-I1014 HydrophobicContact CE3-CG1 4.25Å; W944-I1014 HydrophobicContact CZ3-CB 4.45Å; W944-I1014 HydrophobicContact CZ3-CD1 4.27Å; W944-I1014 PolarHBondContact O-N 2.92Å; L946-I1014 PolarHBondContact N-O 3.44Å; L994-I1014 HydrophobicContact CD1-CG2 4.49Å; L994-I1014 HydrophobicContact CD2-CD1 4.32Å; L994-I1014 HydrophobicContact CD2-CG2 3.82Å; L1001-I1014 HydrophobicContact CD1-CD1 3.97Å; L1001-I1014 HydrophobicContact CD1-CG1 4.29Å; L1001-I1014 HydrophobicContact CD2-CG1 4.13Å; L1001-I1014 HydrophobicContact CG-CD1 4.49Å; I1014-V1016 HydrophobicContact CG2-CG1 3.83Å; I1014-I1021 HydrophobicContact CG2-CG2 4.32Å; I1014-M1022 CarbonylContact C-O 3.58Å; I1014-M1022 WeakPolarHBondContact CA-O 3.29Å; I1014-M1022 WeakPolarHBondContact CG2-O 3.3Å; I1014-I1023 HydrophobicContact CG2-CG1 4.16Å
1015	A	91.1	Very high	90.5	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	113.4	174.4	0	0	0	0	0	110	L946 V951 M1022	L946-A1015 HydrophobicContact CB-CB 4.15Å; L946-A1015 WeakPolarHBondContact O-CA 3.5Å; V951-A1015 HydrophobicContact CG2-CB 4.35Å; A1015-M1022 HydrophobicContact CB-CB 4.09Å; A1015-M1022 HydrophobicContact CB-CG 4.33Å; A1015-M1022 PolarHBondContact N-O 3.09Å; A1015-M1022 PolarHBondContact O-N 2.11Å
1016	V	87.4	Confident	90.5	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	12%	0.119	C	C	.	.			trans	-132.8	4.6	-175	-68	0	0	0	0	112.9	G814 V815 L816 E945 N948 I1014 S1018 I1021	G814-V1016 CarbonylContact C-O 3.52Å; G814-V1016 WeakPolarHBondContact CA-O 3.3Å; V815-V1016 VanDerWaalsContact CG2-O 3.24Å; V815-V1016 WeakPolarHBondContact CG2-O 3.18Å; V815-V1016 PolarHBondContact N-O 3.23Å; L816-V1016 HydrophobicContact CD1-CB 4.49Å; L816-V1016 HydrophobicContact CD1-CG1 4.34Å; L816-V1016 HydrophobicContact CD1-CG2 4.08Å; E945-V1016 HydrophobicContact CG-CG2 3.33Å; E945-V1016 WeakPolarHBondContact OE1-CG2 3.5Å; N948-V1016 PolarHBondContact OD1-N 3.33Å; I1014-V1016 HydrophobicContact CG2-CG1 3.83Å; V1016-S1018 PolarHBondContact O-N 3.18Å; V1016-I1021 HydrophobicContact CG1-CG2 3.91Å
1017	Q	84.9	Confident	90.5	Very high	6 Å²	6	21.1 Å²	21.1	3%	0.028	11%	0.107	C	C	.	.	S	Bend	trans	-61.5	-34.9	176.6	-70.4	-164.7	45.9	0	0	111.6	N807 G814 D947 N948	N807-Q1017 PolarHBondContact O-OE1 2.67Å; G814-Q1017 VanDerWaalsContact CA-O 3.3Å; G814-Q1017 WeakPolarHBondContact CA-O 3.39Å; D947-Q1017 VanDerWaalsContact CA-NE2 3.26Å; D947-Q1017 PolarHBondContact OD2-NE2 3.34Å; D947-Q1017 PolarHBondContact OD2-OE1 3.16Å; N948-Q1017 WeakPolarHBondContact OD1-CA 3.33Å; N948-Q1017 PolarHBondContact OD1-N 2.85Å
1018	S	81.7	Confident	90.4	Very high	48 Å²	48	21 Å²	21	34%	0.336	11%	0.107	S	C	.	.	S	Bend	trans	-146	-174	176.9	68.1	0	0	0	0	113.1	N948 V1016	N948-S1018 WeakPolarHBondContact CB-OG 3.48Å; N948-S1018 PolarHBondContact ND2-O 3.5Å; N948-S1018 PolarHBondContact OD1-N 3.23Å; V1016-S1018 PolarHBondContact O-N 3.18Å
1019	Y	77.6	Confident	90.2	Very high	40 Å²	40	23.7 Å²	23.7	16%	0.157	12%	0.124	C	C	.	.	S	Bend	trans	-92.4	151.2	174.4	-75.2	-77.9	0	0	0	112.4	V815 L877 R990 I1021	V815-Y1019 HydrophobicContact CB-CD2 4.48Å; V815-Y1019 HydrophobicContact CB-CE2 3.79Å; V815-Y1019 HydrophobicContact CG1-CD2 3.87Å; V815-Y1019 HydrophobicContact CG1-CE2 3.37Å; V815-Y1019 HydrophobicContact CG2-CD2 4.39Å; V815-Y1019 HydrophobicContact CG2-CE1 4.27Å; V815-Y1019 HydrophobicContact CG2-CE2 4.05Å; L877-Y1019 HydrophobicContact CD1-CD2 4.44Å; L877-Y1019 HydrophobicContact CD1-CE2 4.37Å; L877-Y1019 HydrophobicContact CD2-CE2 3.96Å; R990-Y1019 PolarHBondContact NH1-OH 2.72Å; Y1019-I1021 HydrophobicContact CD1-CG1 4.36Å; Y1019-I1021 HydrophobicContact CE1-CD1 4.25Å; Y1019-I1021 HydrophobicContact CE1-CG1 4.16Å
1020	P	82.6	Confident	90	Very high	39 Å²	39	24.9 Å²	24.9	25%	0.253	14%	0.137	S	C	.	.	S	Bend	cis	-72	150.1	-8	32.1	-35.1	0	0	0	111.2	N948 T979 V982 M1022	N948-P1020 PolarHBondContact ND2-O 2.84Å; N948-P1020 VanDerWaalsContact ND2-O 3.09Å; T979-P1020 HydrophobicContact CG2-CG 4.35Å; V982-P1020 HydrophobicContact CG2-CB 4.32Å; P1020-M1022 HydrophobicContact CG-CE 4.12Å; P1020-M1022 WeakPolarHBondContact O-CG 2.8Å; P1020-M1022 PolarHBondContact O-N 2.81Å
1021	I	85	Confident	90.1	Very high	1 Å²	1	21 Å²	21	1%	0.005	13%	0.128	C	C	.	.	P	Polyproline II helix	trans	-64.3	130.8	170.2	-61.7	174	0	0	0	108.1	V815 C980 R990 F993 L994 I1014 V1016 Y1019	V815-I1021 HydrophobicContact CG2-CD1 4.14Å; V815-I1021 HydrophobicContact CG2-CG1 3.79Å; C980-I1021 HydrophobicContact CB-CB 4.4Å; C980-I1021 PolarHBondContact N-O 3.45Å; R990-I1021 HydrophobicContact CG-CD1 4.25Å; F993-I1021 HydrophobicContact CD1-CG2 4.35Å; F993-I1021 HydrophobicContact CE1-CG2 4.02Å; L994-I1021 HydrophobicContact CD2-CG2 4.16Å; I1014-I1021 HydrophobicContact CG2-CG2 4.32Å; V1016-I1021 HydrophobicContact CG1-CG2 3.91Å; Y1019-I1021 HydrophobicContact CD1-CG1 4.36Å; Y1019-I1021 HydrophobicContact CE1-CD1 4.25Å; Y1019-I1021 HydrophobicContact CE1-CG1 4.16Å
1022	M	90.1	Very high	90.2	Very high	12 Å²	12	21.8 Å²	21.8	6%	0.059	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	134.7	-177.4	-38.4	-169.5	-167.7	0	0	111.2	V951 L953 V977 K978 T979 I1014 A1015 P1020	V951-M1022 HydrophobicContact CB-SD 4.38Å; V951-M1022 HydrophobicContact CG1-SD 3.96Å; L953-M1022 HydrophobicContact CD1-CE 4.18Å; L953-M1022 HydrophobicContact CD1-SD 4.4Å; L953-M1022 HydrophobicContact CD2-SD 3.95Å; L953-M1022 HydrophobicContact CG-CE 4.44Å; L953-M1022 HydrophobicContact CG-SD 4.3Å; V977-M1022 HydrophobicContact CG1-CB 3.68Å; V977-M1022 HydrophobicContact CG1-CG 4.23Å; V977-M1022 HydrophobicContact CG1-SD 3.74Å; K978-M1022 WeakPolarHBondContact O-CA 3.41Å; T979-M1022 HydrophobicContact CG2-CG 4.36Å; I1014-M1022 CarbonylContact C-O 3.58Å; I1014-M1022 WeakPolarHBondContact CA-O 3.29Å; I1014-M1022 WeakPolarHBondContact CG2-O 3.3Å; A1015-M1022 HydrophobicContact CB-CB 4.09Å; A1015-M1022 HydrophobicContact CB-CG 4.33Å; A1015-M1022 PolarHBondContact N-O 3.09Å; A1015-M1022 PolarHBondContact O-N 2.11Å; P1020-M1022 HydrophobicContact CG-CE 4.12Å; P1020-M1022 WeakPolarHBondContact O-CG 2.8Å; P1020-M1022 PolarHBondContact O-N 2.81Å
1023	I	91.1	Very high	90.4	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	125	164.6	-61.7	161	0	0	0	107.1	V977 K978 F993 L994 E997 L1011 I1014	V977-I1023 WeakPolarHBondContact CA-O 3.35Å; K978-I1023 HydrophobicContact CB-CB 4.36Å; K978-I1023 HydrophobicContact CD-CD1 4.48Å; K978-I1023 PolarHBondContact N-O 3.45Å; K978-I1023 PolarHBondContact O-N 2.84Å; F993-I1023 HydrophobicContact CD1-CD1 4.19Å; F993-I1023 HydrophobicContact CD2-CD1 4.4Å; F993-I1023 HydrophobicContact CE1-CD1 3.62Å; F993-I1023 HydrophobicContact CE1-CG1 3.85Å; F993-I1023 HydrophobicContact CE2-CD1 3.92Å; F993-I1023 HydrophobicContact CZ-CD1 3.49Å; F993-I1023 VanDerWaalsContact CZ-CD1 3.49Å; F993-I1023 HydrophobicContact CZ-CG1 3.94Å; L994-I1023 HydrophobicContact CD2-CD1 4.14Å; L994-I1023 HydrophobicContact CD2-CG1 4.07Å; E997-I1023 HydrophobicContact CB-CD1 3.75Å; E997-I1023 HydrophobicContact CG-CD1 3.61Å; L1011-I1023 HydrophobicContact CD2-CG2 4.11Å; L1011-I1023 HydrophobicContact CG-CG2 4.41Å; I1014-I1023 HydrophobicContact CG2-CG1 4.16Å
1024	V	94	Very high	90.7	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	129.2	-178.4	-173	0	0	0	0	108.6	L946 V951 V975 V977 V1012 G1013	L946-V1024 HydrophobicContact CD1-CB 3.83Å; L946-V1024 HydrophobicContact CD1-CG1 4.31Å; L946-V1024 HydrophobicContact CD1-CG2 3.78Å; V951-V1024 HydrophobicContact CG1-CG2 3.96Å; V951-V1024 HydrophobicContact CG2-CG2 3.86Å; V975-V1024 HydrophobicContact CB-CG1 3.7Å; V975-V1024 HydrophobicContact CG1-CG1 3.7Å; V975-V1024 HydrophobicContact CG2-CG1 3.87Å; V977-V1024 HydrophobicContact CG1-CG2 4.37Å; V1012-V1024 HydrophobicContact CB-CB 4.4Å; V1012-V1024 HydrophobicContact CB-CG1 4.06Å; V1012-V1024 HydrophobicContact CG1-CG1 4.37Å; V1012-V1024 PolarHBondContact N-O 3.22Å; G1013-V1024 PolarHBondContact N-O 2.93Å; G1013-V1024 VanDerWaalsContact N-O 3.14Å; G1013-V1024 PolarHBondContact O-N 3.03Å
1025	M	94.6	Very high	90.8	Very high	18 Å²	18	24.6 Å²	24.6	9%	0.089	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	161.5	-171.4	47.1	179.5	-65.9	0	0	109.6	V975 A976 V1009 K1010 L1011 Y1027	V975-M1025 CarbonylContact C-O 3.57Å; V975-M1025 VanDerWaalsContact CA-O 3.28Å; V975-M1025 WeakPolarHBondContact CA-O 3.22Å; V975-M1025 VanDerWaalsContact CB-O 3.32Å; V975-M1025 WeakPolarHBondContact CB-O 3.19Å; A976-M1025 HydrophobicContact CB-CE 4.47Å; A976-M1025 HydrophobicContact CB-CG 3.87Å; A976-M1025 HydrophobicContact CB-SD 4.36Å; A976-M1025 PolarHBondContact N-O 3.25Å; A976-M1025 WeakPolarHBondContact O-CG 3.5Å; A976-M1025 PolarHBondContact O-N 3.46Å; V1009-M1025 HydrophobicContact CB-CE 4.45Å; V1009-M1025 HydrophobicContact CG1-CE 3.46Å; V1009-M1025 VanDerWaalsContact CG1-CE 3.46Å; K1010-M1025 WeakPolarHBondContact O-CA 3.3Å; L1011-M1025 HydrophobicContact CG-CB 4.5Å; M1025-Y1027 PolarHBondContact O-N 2.78Å
1026	E	95.1	Very high	90.9	Very high	44 Å²	44	26.9 Å²	26.9	21%	0.206	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.3	140.8	178.4	65.6	173.6	133.1	0	0	111.6	V1009 K1010 V1028 K1087	V1009-E1026 HydrophobicContact CG1-CG 3.64Å; K1010-E1026 HydrophobicContact CB-CG 4.24Å; K1010-E1026 WeakPolarHBondContact CB-OE1 3.34Å; K1010-E1026 PolarHBondContact N-OE1 3.06Å; K1010-E1026 PolarHBondContact O-N 3.36Å; E1026-V1028 HydrophobicContact CG-CG2 4.04Å; E1026-K1087 IonicContact OE1-NZ 3Å; E1026-K1087 PolarHBondContact OE1-NZ 2.89Å; E1026-K1087 IonicContact OE2-NZ 3.06Å; E1026-K1087 PolarHBondContact OE2-NZ 3.46Å
1027	Y	95.9	Very high	91.3	Very high	55 Å²	55	26.9 Å²	26.9	22%	0.216	16%	0.157	C	C	.	.			trans	-79.5	125.8	171.5	-176.4	-124.4	0	0	0	109.9	I957 R967 E974 A976 M1025 P1029	I957-Y1027 HydrophobicContact CD1-CD2 4.17Å; I957-Y1027 HydrophobicContact CD1-CE2 3.83Å; R967-Y1027 HydrophobicContact CB-CE2 4.29Å; R967-Y1027 HydrophobicContact CG-CD1 4.37Å; R967-Y1027 HydrophobicContact CG-CD2 4.21Å; R967-Y1027 HydrophobicContact CG-CE1 4.27Å; R967-Y1027 HydrophobicContact CG-CE2 4.14Å; R967-Y1027 HydrophobicContact CG-CG 4.36Å; E974-Y1027 HydrophobicContact CB-CD1 4.26Å; E974-Y1027 VanDerWaalsContact OE2-CD1 3.23Å; E974-Y1027 WeakPolarHBondContact OE2-CD1 3.46Å; A976-Y1027 HydrophobicContact CB-CD2 4.39Å; M1025-Y1027 PolarHBondContact O-N 2.78Å; Y1027-P1029 HydrophobicContact CD1-CB 4.45Å; Y1027-P1029 HydrophobicContact CD1-CG 3.91Å; Y1027-P1029 HydrophobicContact CE1-CB 3.86Å; Y1027-P1029 HydrophobicContact CE1-CG 3.81Å
1028	V	95.6	Very high	91.8	Very high	7 Å²	7	32 Å²	32	4%	0.042	18%	0.176	C	C	.	.			trans	-113.2	98.7	179.3	-175.2	0	0	0	0	108.3	V1009 E1026 G1030 G1031 L1079 I1080 K1087	V1009-V1028 HydrophobicContact CG1-CG2 4.31Å; V1009-V1028 HydrophobicContact CG2-CG2 4.29Å; E1026-V1028 HydrophobicContact CG-CG2 4.04Å; V1028-G1030 PolarHBondContact O-N 3.14Å; V1028-G1031 PolarHBondContact O-N 3.06Å; V1028-G1031 VanDerWaalsContact O-N 3.15Å; V1028-L1079 HydrophobicContact CB-CB 3.95Å; V1028-L1079 HydrophobicContact CB-CD1 3.83Å; V1028-L1079 HydrophobicContact CG1-CB 3.71Å; V1028-L1079 HydrophobicContact CG2-CB 4.38Å; V1028-L1079 HydrophobicContact CG2-CD1 3.94Å; V1028-I1080 VanDerWaalsContact CG1-C 3.47Å; V1028-I1080 WeakPolarHBondContact CG1-O 3.36Å; V1028-K1087 HydrophobicContact CG2-CD 4.35Å
1029	P	92.1	Very high	92.2	Very high	58 Å²	58	37.8 Å²	37.8	38%	0.377	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-31.2	-157.9	-25.5	36.5	0	0	0	116	Y1027 G1031 D1082	Y1027-P1029 HydrophobicContact CD1-CB 4.45Å; Y1027-P1029 HydrophobicContact CD1-CG 3.91Å; Y1027-P1029 HydrophobicContact CE1-CB 3.86Å; Y1027-P1029 HydrophobicContact CE1-CG 3.81Å; P1029-G1031 PolarHBondContact O-N 3.32Å; P1029-G1031 VanDerWaalsContact O-N 3.12Å; P1029-D1082 WeakPolarHBondContact CB-OD2 3.23Å; P1029-D1082 WeakPolarHBondContact CG-OD2 3.5Å
1030	G	92	Very high	92.6	Very high	27 Å²	27	37.6 Å²	37.6	28%	0.278	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-12.7	176.7	0	0	0	0	0	114.7	V1028 I1080	V1028-G1030 PolarHBondContact O-N 3.14Å; G1030-I1080 WeakPolarHBondContact CA-O 3.43Å; G1030-I1080 PolarHBondContact N-O 3.34Å
1031	G	93.8	Very high	92.2	Very high	28 Å²	28	42.7 Å²	42.7	29%	0.289	22%	0.218	S	C	.	.			trans	72.8	-157.5	177.5	0	0	0	0	0	113	V1028 P1029 L1079 I1080	V1028-G1031 PolarHBondContact O-N 3.06Å; V1028-G1031 VanDerWaalsContact O-N 3.15Å; P1029-G1031 PolarHBondContact O-N 3.32Å; P1029-G1031 VanDerWaalsContact O-N 3.12Å; G1031-L1079 CarbonylContact O-C 3.54Å; G1031-L1079 VanDerWaalsContact O-CA 3.24Å; G1031-L1079 WeakPolarHBondContact O-CA 3.47Å; G1031-I1080 PolarHBondContact O-N 2.71Å
1032	S	95.1	Very high	91.8	Very high	24 Å²	24	48.7 Å²	48.7	17%	0.168	25%	0.25	C	S	.	.	B	Isolated β-bridge	trans	-73.2	140.4	-176	59.2	0	0	0	0	113.5	L1034 N1035 H1036 R1076 C1078	S1032-L1034 VanDerWaalsContact C-N 3.27Å; S1032-L1034 PolarHBondContact O-N 2.87Å; S1032-N1035 WeakPolarHBondContact O-CA 3.47Å; S1032-N1035 WeakPolarHBondContact O-CB 3.5Å; S1032-N1035 PolarHBondContact O-N 3Å; S1032-N1035 PolarHBondContact OG-ND2 3.05Å; S1032-N1035 VanDerWaalsContact OG-ND2 3.08Å; S1032-H1036 PolarHBondContact O-N 3.45Å; S1032-R1076 WeakPolarHBondContact CB-O 3.45Å; S1032-C1078 CarbonylContact C-O 3.53Å; S1032-C1078 VanDerWaalsContact CA-O 3.3Å; S1032-C1078 WeakPolarHBondContact CA-O 3.24Å
1033	L	96.9	Very high	91.4	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-54.4	-42.6	179.7	-179.6	74.9	0	0	0	111.5	N1035 H1036 L1037 M1052 A1075 C1078 I1080 L1086 L1136 I1140	L1033-N1035 PolarHBondContact O-N 3.16Å; L1033-H1036 PolarHBondContact O-N 3.39Å; L1033-H1036 VanDerWaalsContact O-N 3.1Å; L1033-L1037 HydrophobicContact CD1-CD1 4.35Å; L1033-L1037 HydrophobicContact CD1-CG 4.18Å; L1033-L1037 HydrophobicContact CD2-CD1 4.23Å; L1033-L1037 HydrophobicContact CG-CD1 3.8Å; L1033-L1037 HydrophobicContact CG-CG 4.08Å; L1033-L1037 WeakPolarHBondContact O-CB 3.43Å; L1033-L1037 VanDerWaalsContact O-CG 3.27Å; L1033-L1037 WeakPolarHBondContact O-CG 3.37Å; L1033-L1037 PolarHBondContact O-N 2.87Å; L1033-M1052 HydrophobicContact CD1-CE 4.12Å; L1033-M1052 HydrophobicContact CD1-CG 4.23Å; L1033-M1052 HydrophobicContact CD1-SD 3.83Å; L1033-A1075 WeakPolarHBondContact CB-O 3.42Å; L1033-A1075 HydrophobicContact CD2-CB 4.04Å; L1033-A1075 HydrophobicContact CG-CB 4.48Å; L1033-C1078 HydrophobicContact CB-CB 3.91Å; L1033-C1078 HydrophobicContact CD2-CB 4.04Å; L1033-C1078 PolarHBondContact N-O 3.1Å; L1033-I1080 HydrophobicContact CD1-CD1 4.32Å; L1033-L1086 HydrophobicContact CD1-CD1 4.19Å; L1033-L1086 HydrophobicContact CD2-CD1 3.53Å; L1033-L1086 HydrophobicContact CG-CD1 4.37Å; L1033-L1136 HydrophobicContact CD2-CD1 3.99Å; L1033-I1140 HydrophobicContact CD2-CD1 4.28Å; L1033-I1140 HydrophobicContact CD2-CG1 3.93Å
1034	L	96.1	Very high	91.2	Very high	24 Å²	24	53.5 Å²	53.5	13%	0.126	29%	0.288	C	S	.	.	H	α-helix	trans	-56.5	-38.8	176.3	-175	63.3	0	0	0	112.5	S1032 R1038 A1075 R1076	S1032-L1034 VanDerWaalsContact C-N 3.27Å; S1032-L1034 PolarHBondContact O-N 2.87Å; L1034-R1038 WeakPolarHBondContact O-CB 3.3Å; L1034-R1038 WeakPolarHBondContact O-CD 3.3Å; L1034-R1038 WeakPolarHBondContact O-CG 3.37Å; L1034-R1038 PolarHBondContact O-N 2.82Å; L1034-A1075 HydrophobicContact CB-CB 4.02Å; L1034-A1075 WeakPolarHBondContact CB-O 3.44Å; L1034-A1075 HydrophobicContact CD1-CB 4.28Å; L1034-A1075 PolarHBondContact N-O 3.06Å; L1034-R1076 HydrophobicContact CD2-CB 4.17Å
1035	N	94	Very high	91.1	Very high	85 Å²	85	57.5 Å²	57.5	46%	0.455	31%	0.314	S	S	.	.	H	α-helix	trans	-77.2	-36.2	176.3	-76.1	-30.1	0	0	0	111.8	S1032 L1033 K1039	S1032-N1035 WeakPolarHBondContact O-CA 3.47Å; S1032-N1035 WeakPolarHBondContact O-CB 3.5Å; S1032-N1035 PolarHBondContact O-N 3Å; S1032-N1035 PolarHBondContact OG-ND2 3.05Å; S1032-N1035 VanDerWaalsContact OG-ND2 3.08Å; L1033-N1035 PolarHBondContact O-N 3.16Å; N1035-K1039 WeakPolarHBondContact O-CB 3.47Å; N1035-K1039 WeakPolarHBondContact O-CG 3.46Å; N1035-K1039 PolarHBondContact O-N 3Å
1036	H	94.4	Very high	90.9	Very high	48 Å²	48	59.1 Å²	59.1	22%	0.222	33%	0.325	C	S	.	.	H	α-helix	trans	-61.8	-53.7	174.4	179.1	94.6	0	0	0	111.6	S1032 L1033 R1038 K1039 S1040 I1080	S1032-H1036 PolarHBondContact O-N 3.45Å; L1033-H1036 PolarHBondContact O-N 3.39Å; L1033-H1036 VanDerWaalsContact O-N 3.1Å; H1036-R1038 VanDerWaalsContact C-N 3.34Å; H1036-R1038 PolarHBondContact O-N 2.9Å; H1036-K1039 PolarHBondContact O-N 3.04Å; H1036-K1039 VanDerWaalsContact O-N 3.16Å; H1036-S1040 WeakPolarHBondContact O-CB 3.38Å; H1036-S1040 PolarHBondContact O-N 3.18Å; H1036-S1040 PolarHBondContact O-OG 3.27Å; H1036-S1040 VanDerWaalsContact O-OG 3.11Å; H1036-I1080 HydrophobicContact CB-CG2 3.81Å
1037	L	94.8	Very high	90.7	Very high	0 Å²	0	60.3 Å²	60.3	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-54	-48.6	177.7	-69.1	169.9	0	0	0	111.5	L1033 K1039 S1040 K1041 L1044 L1049 M1052 I1140 F1143	L1033-L1037 HydrophobicContact CD1-CD1 4.35Å; L1033-L1037 HydrophobicContact CD1-CG 4.18Å; L1033-L1037 HydrophobicContact CD2-CD1 4.23Å; L1033-L1037 HydrophobicContact CG-CD1 3.8Å; L1033-L1037 HydrophobicContact CG-CG 4.08Å; L1033-L1037 WeakPolarHBondContact O-CB 3.43Å; L1033-L1037 VanDerWaalsContact O-CG 3.27Å; L1033-L1037 WeakPolarHBondContact O-CG 3.37Å; L1033-L1037 PolarHBondContact O-N 2.87Å; L1037-K1039 PolarHBondContact O-N 2.79Å; L1037-S1040 PolarHBondContact O-N 2.75Å; L1037-K1041 PolarHBondContact O-N 3.12Å; L1037-L1044 HydrophobicContact CD2-CD1 3.89Å; L1037-L1049 HydrophobicContact CD2-CD2 4.04Å; L1037-M1052 HydrophobicContact CD2-SD 4.37Å; L1037-I1140 HydrophobicContact CD1-CG1 4.4Å; L1037-F1143 CarbonylContact C-O 3.46Å
1038	R	94.5	Very high	90.5	Very high	114 Å²	114	60.8 Å²	60.8	43%	0.43	33%	0.334	S	S	.	.	H	α-helix	trans	-66.1	-33.6	179	-73	174	177.2	174.7	2	114.1	L1034 H1036 F1143 G1144	L1034-R1038 WeakPolarHBondContact O-CB 3.3Å; L1034-R1038 WeakPolarHBondContact O-CD 3.3Å; L1034-R1038 WeakPolarHBondContact O-CG 3.37Å; L1034-R1038 PolarHBondContact O-N 2.82Å; H1036-R1038 VanDerWaalsContact C-N 3.34Å; H1036-R1038 PolarHBondContact O-N 2.9Å; R1038-F1143 PolarHBondContact N-O 2.92Å; R1038-G1144 PolarHBondContact NE-O 3.1Å; R1038-G1144 PolarHBondContact NH2-O 2.71Å
1039	K	91.6	Very high	90.4	Very high	169 Å²	169	60.4 Å²	60.4	74%	0.735	33%	0.332	S	S	*	.	H	α-helix	trans	-70.5	-47.6	174.6	-78.2	172.9	179.8	-178.8	0	111.2	N1035 H1036 L1037 K1041	N1035-K1039 WeakPolarHBondContact O-CB 3.47Å; N1035-K1039 WeakPolarHBondContact O-CG 3.46Å; N1035-K1039 PolarHBondContact O-N 3Å; H1036-K1039 PolarHBondContact O-N 3.04Å; H1036-K1039 VanDerWaalsContact O-N 3.16Å; L1037-K1039 PolarHBondContact O-N 2.79Å; K1039-K1041 VanDerWaalsContact C-N 3.29Å; K1039-K1041 PolarHBondContact O-N 3.25Å
1040	S	85.6	Confident	90.6	Very high	36 Å²	36	58 Å²	58	25%	0.252	32%	0.316	S	S	.	.	H	α-helix	trans	-69.9	-25.6	-178.9	-58.2	0	0	0	0	112.8	H1036 L1037 A1043	H1036-S1040 WeakPolarHBondContact O-CB 3.38Å; H1036-S1040 PolarHBondContact O-N 3.18Å; H1036-S1040 PolarHBondContact O-OG 3.27Å; H1036-S1040 VanDerWaalsContact O-OG 3.11Å; L1037-S1040 PolarHBondContact O-N 2.75Å; S1040-A1043 WeakPolarHBondContact O-CB 3.45Å; S1040-A1043 PolarHBondContact O-N 3.45Å
1041	K	73.9	Confident	90.7	Very high	146 Å²	146	59.8 Å²	59.8	64%	0.635	32%	0.317	S	S	*	.	G	3₁₀ helix	trans	51.8	-150.4	-172.1	-49	175.9	-175.8	174	0	109.9	L1037 K1039 A1043 F1143	L1037-K1041 PolarHBondContact O-N 3.12Å; K1039-K1041 VanDerWaalsContact C-N 3.29Å; K1039-K1041 PolarHBondContact O-N 3.25Å; K1041-A1043 PolarHBondContact O-N 3.21Å; K1041-F1143 WeakPolarHBondContact O-CD1 3.17Å; K1041-F1143 WeakPolarHBondContact O-CE1 3.46Å
1042	N	75.8	Confident	90.8	Very high	127 Å²	127	58.5 Å²	58.5	68%	0.679	30%	0.304	S	S	*	.	G	3₁₀ helix	trans	-67.9	10.8	178.6	-52.6	25.3	0	0	0	114.7	F1143	N1042-F1143 HydrophobicContact CB-CD2 4.36Å; N1042-F1143 HydrophobicContact CB-CE2 3.9Å; N1042-F1143 HydrophobicContact CB-CZ 4.16Å; N1042-F1143 WeakPolarHBondContact OD1-CD2 3.32Å
1043	A	82.7	Confident	90.9	Very high	85 Å²	85	57.4 Å²	57.4	70%	0.702	30%	0.296	S	S	*	.	G	3₁₀ helix	trans	-82.4	-11.1	-178.8	0	0	0	0	0	114.2	S1040 K1041	S1040-A1043 WeakPolarHBondContact O-CB 3.45Å; S1040-A1043 PolarHBondContact O-N 3.45Å; K1041-A1043 PolarHBondContact O-N 3.21Å
1044	L	87.8	Confident	90.9	Very high	28 Å²	28	58.8 Å²	58.8	15%	0.147	30%	0.303	C	S	.	.	S	Bend	trans	-76.8	126	175.1	-65.7	172.6	0	0	0	110.4	L1037 L1049 M1052 F1143	L1037-L1044 HydrophobicContact CD2-CD1 3.89Å; L1044-L1049 HydrophobicContact CB-CD2 4.04Å; L1044-L1049 HydrophobicContact CD1-CD2 4.06Å; L1044-M1052 HydrophobicContact CD1-CE 4.23Å; L1044-F1143 HydrophobicContact CB-CE1 4.25Å
1045	P	90.6	Very high	91	Very high	84 Å²	84	58 Å²	58	55%	0.545	30%	0.299	S	S	.	.			trans	-67.7	147.9	175.7	29.2	-34.7	0	0	0	110.5	M1047 K1048 L1049	P1045-M1047 PolarHBondContact O-N 3.21Å; P1045-K1048 HydrophobicContact CG-CB 4.27Å; P1045-K1048 PolarHBondContact O-N 3.32Å; P1045-L1049 PolarHBondContact O-N 3.28Å
1046	V	90.7	Very high	91.2	Very high	52 Å²	52	53.9 Å²	53.9	32%	0.315	28%	0.277	S	S	.	.	H	α-helix	trans	-50.2	-34.5	179.6	174.2	0	0	0	0	112.4	K1048 L1049 L1050 F1141 L1171 P1173	V1046-K1048 VanDerWaalsContact C-N 3.33Å; V1046-K1048 PolarHBondContact O-N 3.47Å; V1046-L1049 WeakPolarHBondContact O-CB 3.29Å; V1046-L1049 PolarHBondContact O-N 3.4Å; V1046-L1050 HydrophobicContact CG1-CD1 4.1Å; V1046-L1050 HydrophobicContact CG1-CG 4.24Å; V1046-L1050 WeakPolarHBondContact O-CG 3.43Å; V1046-L1050 PolarHBondContact O-N 3.03Å; V1046-F1141 HydrophobicContact CG1-CE1 4.18Å; V1046-L1171 HydrophobicContact CG2-CB 4.47Å; V1046-P1173 HydrophobicContact CG1-CG 4.4Å
1047	M	90.5	Very high	91.4	Very high	69 Å²	69	51.6 Å²	51.6	34%	0.34	27%	0.267	S	S	.	.	H	α-helix	trans	-58.9	-36.5	175.3	-64.1	-57.1	-67.1	0	0	114.2	P1045 L1050 Q1051 I1203 P1204	P1045-M1047 PolarHBondContact O-N 3.21Å; M1047-L1050 HydrophobicContact SD-CD1 4.28Å; M1047-Q1051 PolarHBondContact O-N 2.91Å; M1047-I1203 HydrophobicContact CE-CG2 3.5Å; M1047-P1204 HydrophobicContact CE-CB 4.27Å; M1047-P1204 WeakPolarHBondContact CE-O 3.44Å; M1047-P1204 HydrophobicContact SD-CG 4.44Å
1048	K	92	Very high	91.5	Very high	65 Å²	65	53.2 Å²	53.2	28%	0.283	28%	0.275	S	S	.	.	H	α-helix	trans	-78.9	-31.3	177.4	-165.8	57.9	158.5	174.2	0	111.4	P1045 V1046 Q1051 M1052 D1083 G1084	P1045-K1048 HydrophobicContact CG-CB 4.27Å; P1045-K1048 PolarHBondContact O-N 3.32Å; V1046-K1048 VanDerWaalsContact C-N 3.33Å; V1046-K1048 PolarHBondContact O-N 3.47Å; K1048-Q1051 HydrophobicContact CD-CB 4.46Å; K1048-Q1051 PolarHBondContact O-N 3Å; K1048-M1052 HydrophobicContact CG-CE 4.11Å; K1048-M1052 VanDerWaalsContact O-CG 3.28Å; K1048-M1052 WeakPolarHBondContact O-CG 3.49Å; K1048-M1052 PolarHBondContact O-N 3.44Å; K1048-D1083 PolarHBondContact NZ-O 3.1Å; K1048-G1084 WeakPolarHBondContact CE-O 3.3Å; K1048-G1084 VanDerWaalsContact NZ-C 3.31Å; K1048-G1084 PolarHBondContact NZ-O 3.44Å
1049	L	94.4	Very high	91.7	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-64.8	-40.5	169.9	-55.9	-179	0	0	0	111.5	L1037 L1044 P1045 V1046 M1052 S1053 I1140 F1141 F1143	L1037-L1049 HydrophobicContact CD2-CD2 4.04Å; L1044-L1049 HydrophobicContact CB-CD2 4.04Å; L1044-L1049 HydrophobicContact CD1-CD2 4.06Å; P1045-L1049 PolarHBondContact O-N 3.28Å; V1046-L1049 WeakPolarHBondContact O-CB 3.29Å; V1046-L1049 PolarHBondContact O-N 3.4Å; L1049-M1052 HydrophobicContact CD2-SD 4.4Å; L1049-M1052 PolarHBondContact O-N 2.82Å; L1049-S1053 WeakPolarHBondContact O-CB 3.39Å; L1049-S1053 PolarHBondContact O-N 3.49Å; L1049-S1053 PolarHBondContact O-OG 2.82Å; L1049-I1140 HydrophobicContact CB-CG2 3.82Å; L1049-I1140 HydrophobicContact CD2-CG2 3.93Å; L1049-I1140 HydrophobicContact CG-CG2 4.4Å; L1049-F1141 HydrophobicContact CB-CE1 4.15Å; L1049-F1141 HydrophobicContact CB-CE2 4.07Å; L1049-F1141 HydrophobicContact CB-CZ 3.83Å; L1049-F1141 HydrophobicContact CD1-CD1 4.11Å; L1049-F1141 HydrophobicContact CD1-CE1 4.18Å; L1049-F1143 HydrophobicContact CD1-CE1 3.83Å; L1049-F1143 HydrophobicContact CD1-CZ 4.05Å; L1049-F1143 HydrophobicContact CD2-CD1 4.44Å; L1049-F1143 HydrophobicContact CD2-CE1 4.09Å; L1049-F1143 HydrophobicContact CG-CE1 4.49Å
1050	L	95	Very high	92	Very high	7 Å²	7	39.7 Å²	39.7	4%	0.037	22%	0.219	C	C	.	.	H	α-helix	trans	-63.7	-42.8	172.5	-71.9	172.6	0	0	0	111.9	V1046 M1047 S1053 L1054 F1141 P1173 W1175 L1176 I1203	V1046-L1050 HydrophobicContact CG1-CD1 4.1Å; V1046-L1050 HydrophobicContact CG1-CG 4.24Å; V1046-L1050 WeakPolarHBondContact O-CG 3.43Å; V1046-L1050 PolarHBondContact O-N 3.03Å; M1047-L1050 HydrophobicContact SD-CD1 4.28Å; L1050-S1053 WeakPolarHBondContact O-CB 3.45Å; L1050-S1053 PolarHBondContact O-N 3.1Å; L1050-L1054 PolarHBondContact O-N 2.84Å; L1050-F1141 HydrophobicContact CD2-CZ 4.03Å; L1050-F1141 HydrophobicContact CG-CZ 4.3Å; L1050-P1173 HydrophobicContact CD2-CG 4.5Å; L1050-W1175 HydrophobicContact CD2-CH2 3.75Å; L1050-W1175 HydrophobicContact CD2-CZ2 3.76Å; L1050-L1176 HydrophobicContact CD2-CD2 3.75Å; L1050-I1203 HydrophobicContact CB-CG1 4.33Å
1051	Q	94.7	Very high	92.6	Very high	65 Å²	65	40.9 Å²	40.9	30%	0.304	22%	0.222	S	C	.	.	H	α-helix	trans	-61	-48.8	174.6	-172.2	64.4	56.3	0	0	111.9	M1047 K1048 S1053 L1054 D1055 I1203	M1047-Q1051 PolarHBondContact O-N 2.91Å; K1048-Q1051 HydrophobicContact CD-CB 4.46Å; K1048-Q1051 PolarHBondContact O-N 3Å; Q1051-S1053 PolarHBondContact O-N 2.66Å; Q1051-L1054 PolarHBondContact O-N 3.03Å; Q1051-L1054 VanDerWaalsContact O-N 3.13Å; Q1051-D1055 PolarHBondContact NE2-OD1 3.46Å; Q1051-D1055 WeakPolarHBondContact O-CB 3.45Å; Q1051-D1055 PolarHBondContact O-N 3.18Å; Q1051-I1203 HydrophobicContact CB-CD1 4.32Å
1052	M	96	Very high	93.7	Very high	1 Å²	1	35.8 Å²	35.8	1%	0.005	20%	0.199	C	C	.	.	H	α-helix	trans	-56.4	-37.3	174.4	-69.7	161.7	172.7	0	0	111.7	L1033 L1037 L1044 K1048 L1049 A1056 I1080 L1086 I1140	L1033-M1052 HydrophobicContact CD1-CE 4.12Å; L1033-M1052 HydrophobicContact CD1-CG 4.23Å; L1033-M1052 HydrophobicContact CD1-SD 3.83Å; L1037-M1052 HydrophobicContact CD2-SD 4.37Å; L1044-M1052 HydrophobicContact CD1-CE 4.23Å; K1048-M1052 HydrophobicContact CG-CE 4.11Å; K1048-M1052 VanDerWaalsContact O-CG 3.28Å; K1048-M1052 WeakPolarHBondContact O-CG 3.49Å; K1048-M1052 PolarHBondContact O-N 3.44Å; L1049-M1052 HydrophobicContact CD2-SD 4.4Å; L1049-M1052 PolarHBondContact O-N 2.82Å; M1052-A1056 WeakPolarHBondContact O-CB 3.3Å; M1052-A1056 PolarHBondContact O-N 2.71Å; M1052-A1056 VanDerWaalsContact O-N 3.15Å; M1052-I1080 HydrophobicContact CE-CD1 3.7Å; M1052-I1080 HydrophobicContact CE-CG1 4.3Å; M1052-I1080 HydrophobicContact CG-CD1 4.23Å; M1052-L1086 HydrophobicContact CB-CD1 4.2Å; M1052-I1140 HydrophobicContact CB-CD1 4.28Å
1053	S	97.2	Very high	94.6	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-67.2	-43.2	176.8	-55.8	0	0	0	0	112.5	L1049 L1050 Q1051 A1057 Y1133 L1137	L1049-S1053 WeakPolarHBondContact O-CB 3.39Å; L1049-S1053 PolarHBondContact O-N 3.49Å; L1049-S1053 PolarHBondContact O-OG 2.82Å; L1050-S1053 WeakPolarHBondContact O-CB 3.45Å; L1050-S1053 PolarHBondContact O-N 3.1Å; Q1051-S1053 PolarHBondContact O-N 2.66Å; S1053-A1057 PolarHBondContact O-N 2.97Å; S1053-Y1133 PolarHBondContact O-OH 3.48Å; S1053-L1137 WeakPolarHBondContact OG-CD2 3.48Å
1054	L	97.2	Very high	95.2	Very high	30 Å²	30	27.6 Å²	27.6	16%	0.157	14%	0.142	C	C	.	.	H	α-helix	trans	-67.1	-45	177.2	179.7	59	0	0	0	111.7	L1050 Q1051 A1056 A1057 N1058 I1201 I1203	L1050-L1054 PolarHBondContact O-N 2.84Å; Q1051-L1054 PolarHBondContact O-N 3.03Å; Q1051-L1054 VanDerWaalsContact O-N 3.13Å; L1054-A1056 VanDerWaalsContact C-N 3.31Å; L1054-A1056 PolarHBondContact O-N 3.22Å; L1054-A1057 WeakPolarHBondContact O-CB 3.44Å; L1054-A1057 PolarHBondContact O-N 3.26Å; L1054-A1057 VanDerWaalsContact O-N 3.07Å; L1054-N1058 VanDerWaalsContact O-CG 3.25Å; L1054-N1058 PolarHBondContact O-N 3Å; L1054-N1058 PolarHBondContact O-ND2 3.13Å; L1054-I1201 HydrophobicContact CB-CG2 3.81Å; L1054-I1201 HydrophobicContact CD1-CB 4.2Å; L1054-I1201 HydrophobicContact CD1-CG2 4.27Å; L1054-I1203 HydrophobicContact CB-CD1 4.08Å; L1054-I1203 HydrophobicContact CD2-CD1 3.54Å; L1054-I1203 HydrophobicContact CD2-CG1 4.23Å; L1054-I1203 HydrophobicContact CG-CD1 4.47Å
1055	D	97.7	Very high	95.5	Very high	6 Å²	6	30.3 Å²	30.3	3%	0.032	17%	0.168	C	C	.	.	H	α-helix	trans	-54	-48.1	175.9	-74.4	-3.9	0	0	0	111.1	N1007 Q1051 N1058 G1059 Q1085 L1086	N1007-D1055 WeakPolarHBondContact CB-O 3.39Å; N1007-D1055 VanDerWaalsContact CG-O 3.27Å; N1007-D1055 WeakPolarHBondContact ND2-CB 3.25Å; N1007-D1055 VanDerWaalsContact ND2-CG 3.31Å; N1007-D1055 PolarHBondContact ND2-OD1 2.97Å; Q1051-D1055 PolarHBondContact NE2-OD1 3.46Å; Q1051-D1055 WeakPolarHBondContact O-CB 3.45Å; Q1051-D1055 PolarHBondContact O-N 3.18Å; D1055-N1058 PolarHBondContact O-N 3.37Å; D1055-G1059 PolarHBondContact O-N 2.94Å; D1055-Q1085 WeakPolarHBondContact OD2-CA 3.25Å; D1055-L1086 HydrophobicContact CB-CB 3.73Å; D1055-L1086 HydrophobicContact CB-CD2 4.49Å; D1055-L1086 PolarHBondContact OD2-N 3.24Å
1056	A	98.3	Very high	95.5	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-64.9	-37.7	175.9	0	0	0	0	0	112.7	M1052 L1054 M1060 L1086 Y1133 L1136	M1052-A1056 WeakPolarHBondContact O-CB 3.3Å; M1052-A1056 PolarHBondContact O-N 2.71Å; M1052-A1056 VanDerWaalsContact O-N 3.15Å; L1054-A1056 VanDerWaalsContact C-N 3.31Å; L1054-A1056 PolarHBondContact O-N 3.22Å; A1056-M1060 WeakPolarHBondContact O-CB 3.49Å; A1056-M1060 WeakPolarHBondContact O-CG 3.46Å; A1056-M1060 PolarHBondContact O-N 3.15Å; A1056-L1086 HydrophobicContact CB-CD1 4.18Å; A1056-L1086 HydrophobicContact CB-CD2 3.81Å; A1056-Y1133 HydrophobicContact CB-CD2 4.39Å; A1056-Y1133 HydrophobicContact CB-CE2 3.85Å; A1056-L1136 HydrophobicContact CB-CD2 3.72Å
1057	A	98.3	Very high	95.5	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-64.9	-40.3	175.1	0	0	0	0	0	111.9	S1053 L1054 M1060 M1061 Y1133 I1197 I1201	S1053-A1057 PolarHBondContact O-N 2.97Å; L1054-A1057 WeakPolarHBondContact O-CB 3.44Å; L1054-A1057 PolarHBondContact O-N 3.26Å; L1054-A1057 VanDerWaalsContact O-N 3.07Å; A1057-M1060 PolarHBondContact O-N 3.47Å; A1057-M1061 VanDerWaalsContact O-CB 3.3Å; A1057-M1061 WeakPolarHBondContact O-CB 3.21Å; A1057-M1061 PolarHBondContact O-N 3.14Å; A1057-Y1133 HydrophobicContact CB-CE2 4.11Å; A1057-I1197 HydrophobicContact CB-CG2 3.7Å; A1057-I1201 HydrophobicContact CB-CD1 3.98Å
1058	N	98	Very high	95.5	Very high	33 Å²	33	28.4 Å²	28.4	18%	0.176	15%	0.146	C	C	.	.	H	α-helix	trans	-67.5	-43.6	177.9	-67.3	-19.5	0	0	0	111.6	H1005 L1054 D1055 M1061 Y1062 S1198	H1005-N1058 PolarHBondContact CE1-O 2.99Å; L1054-N1058 VanDerWaalsContact O-CG 3.25Å; L1054-N1058 PolarHBondContact O-N 3Å; L1054-N1058 PolarHBondContact O-ND2 3.13Å; D1055-N1058 PolarHBondContact O-N 3.37Å; N1058-M1061 PolarHBondContact O-N 3.29Å; N1058-Y1062 PolarHBondContact O-N 3.11Å; N1058-S1198 PolarHBondContact OD1-OG 3.22Å
1059	G	97.5	Very high	95.5	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-57.9	-47.9	172.2	0	0	0	0	0	112	D1055 M1061 Y1062 L1063	D1055-G1059 PolarHBondContact O-N 2.94Å; G1059-M1061 PolarHBondContact O-N 3.03Å; G1059-Y1062 WeakPolarHBondContact O-CB 3.25Å; G1059-Y1062 PolarHBondContact O-N 3.33Å; G1059-L1063 WeakPolarHBondContact O-CG 3.5Å; G1059-L1063 PolarHBondContact O-N 3.12Å; G1059-L1063 VanDerWaalsContact O-N 3.12Å
1060	M	98.2	Very high	95.5	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-69.7	-30.4	177.8	-71.1	-54.4	-48.1	0	0	113.9	A1056 A1057 Y1062 L1063 E1064 H1070 L1073 I1088 I1126 D1129 F1194	A1056-M1060 WeakPolarHBondContact O-CB 3.49Å; A1056-M1060 WeakPolarHBondContact O-CG 3.46Å; A1056-M1060 PolarHBondContact O-N 3.15Å; A1057-M1060 PolarHBondContact O-N 3.47Å; M1060-Y1062 VanDerWaalsContact C-N 3.34Å; M1060-L1063 HydrophobicContact CE-CB 4.36Å; M1060-L1063 HydrophobicContact CE-CD1 4.18Å; M1060-L1063 PolarHBondContact O-N 3.48Å; M1060-L1063 HydrophobicContact SD-CD1 3.8Å; M1060-E1064 WeakPolarHBondContact O-CB 3.18Å; M1060-E1064 PolarHBondContact O-N 2.73Å; M1060-H1070 HydrophobicContact CE-CB 4.2Å; M1060-H1070 HydrophobicContact SD-CB 4.39Å; M1060-L1073 HydrophobicContact CG-CD1 4.34Å; M1060-L1073 HydrophobicContact CG-CD2 3.71Å; M1060-L1073 HydrophobicContact SD-CD1 3.97Å; M1060-L1073 HydrophobicContact SD-CD2 3.77Å; M1060-L1073 HydrophobicContact SD-CG 4.35Å; M1060-I1088 HydrophobicContact CG-CD1 3.73Å; M1060-I1088 HydrophobicContact SD-CD1 3.8Å; M1060-I1126 HydrophobicContact CE-CD1 4.03Å; M1060-D1129 HydrophobicContact CE-CB 3.66Å; M1060-F1194 HydrophobicContact CB-CB 4.33Å; M1060-F1194 HydrophobicContact CB-CD1 3.32Å; M1060-F1194 HydrophobicContact CB-CD2 3.79Å; M1060-F1194 HydrophobicContact CB-CE1 3.34Å; M1060-F1194 HydrophobicContact CB-CE2 3.79Å; M1060-F1194 HydrophobicContact CB-CG 3.54Å; M1060-F1194 HydrophobicContact CB-CZ 3.56Å; M1060-F1194 HydrophobicContact CE-CD2 4.45Å; M1060-F1194 HydrophobicContact CE-CE2 3.72Å; M1060-F1194 HydrophobicContact CE-CZ 3.86Å; M1060-F1194 HydrophobicContact CG-CD1 4.21Å; M1060-F1194 HydrophobicContact CG-CE1 3.73Å; M1060-F1194 HydrophobicContact CG-CE2 4.35Å; M1060-F1194 HydrophobicContact CG-CZ 3.79Å
1061	M	97.6	Very high	95.3	Very high	60 Å²	60	25.7 Å²	25.7	30%	0.296	13%	0.134	S	C	.	.	H	α-helix	trans	-64.8	-38.4	171.7	-179.9	179.4	61.4	0	0	111.5	A1057 N1058 G1059 L1063 E1064 A1065 F1194	A1057-M1061 VanDerWaalsContact O-CB 3.3Å; A1057-M1061 WeakPolarHBondContact O-CB 3.21Å; A1057-M1061 PolarHBondContact O-N 3.14Å; N1058-M1061 PolarHBondContact O-N 3.29Å; G1059-M1061 PolarHBondContact O-N 3.03Å; M1061-L1063 VanDerWaalsContact C-N 3.35Å; M1061-E1064 PolarHBondContact O-N 3.14Å; M1061-A1065 WeakPolarHBondContact O-CB 3.47Å; M1061-A1065 PolarHBondContact O-N 3.05Å; M1061-F1194 HydrophobicContact CB-CB 3.9Å
1062	Y	97	Very high	95.3	Very high	39 Å²	39	23.2 Å²	23.2	15%	0.153	12%	0.122	C	C	.	.	H	α-helix	trans	-62.7	-41.3	172	178	-90.4	0	0	0	111.8	F1003 N1004 H1005 I1008 N1058 G1059 M1060 A1065 R1066	F1003-Y1062 HydrophobicContact CB-CE1 4Å; F1003-Y1062 HydrophobicContact CD1-CE1 4.04Å; F1003-Y1062 HydrophobicContact CG-CE1 4.03Å; N1004-Y1062 PolarHBondContact N-OH 3.4Å; N1004-Y1062 VanDerWaalsContact N-OH 3.08Å; H1005-Y1062 HydrophobicContact CB-CD1 3.99Å; H1005-Y1062 HydrophobicContact CB-CD2 3.73Å; H1005-Y1062 HydrophobicContact CB-CE1 4.22Å; H1005-Y1062 HydrophobicContact CB-CE2 3.94Å; H1005-Y1062 HydrophobicContact CB-CG 3.74Å; H1005-Y1062 AromaticContact CD2-CD2 3.69Å; H1005-Y1062 AromaticContact CD2-CG 3.93Å; H1005-Y1062 AromaticContact CG-CD2 3.87Å; H1005-Y1062 AromaticContact CG-CG 3.79Å; I1008-Y1062 HydrophobicContact CG1-CD1 4.04Å; N1058-Y1062 PolarHBondContact O-N 3.11Å; G1059-Y1062 WeakPolarHBondContact O-CB 3.25Å; G1059-Y1062 PolarHBondContact O-N 3.33Å; M1060-Y1062 VanDerWaalsContact C-N 3.34Å; Y1062-A1065 PolarHBondContact O-N 3.27Å; Y1062-R1066 HydrophobicContact CD1-CG 4.3Å; Y1062-R1066 HydrophobicContact CE1-CG 3.94Å; Y1062-R1066 VanDerWaalsContact O-CG 3.28Å; Y1062-R1066 WeakPolarHBondContact O-CG 3.42Å; Y1062-R1066 PolarHBondContact O-N 3.24Å; Y1062-R1066 VanDerWaalsContact O-N 3.16Å; Y1062-R1066 PolarHBondContact OH-NE 3.36Å; Y1062-R1066 PolarHBondContact OH-NH2 2.99Å
1063	L	94.9	Very high	95.3	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-69.5	-39.2	176.9	-63.4	175.3	0	0	0	112.4	F1003 I1008 G1059 M1060 M1061 A1065 R1066 N1067 C1068 F1091	F1003-L1063 HydrophobicContact CD2-CD2 3.74Å; F1003-L1063 HydrophobicContact CE2-CD2 3.36Å; F1003-L1063 HydrophobicContact CZ-CD2 3.89Å; I1008-L1063 HydrophobicContact CD1-CD1 3.94Å; I1008-L1063 HydrophobicContact CD1-CD2 4.19Å; I1008-L1063 HydrophobicContact CD1-CG 3.94Å; G1059-L1063 WeakPolarHBondContact O-CG 3.5Å; G1059-L1063 PolarHBondContact O-N 3.12Å; G1059-L1063 VanDerWaalsContact O-N 3.12Å; M1060-L1063 HydrophobicContact CE-CB 4.36Å; M1060-L1063 HydrophobicContact CE-CD1 4.18Å; M1060-L1063 PolarHBondContact O-N 3.48Å; M1060-L1063 HydrophobicContact SD-CD1 3.8Å; M1061-L1063 VanDerWaalsContact C-N 3.35Å; L1063-A1065 VanDerWaalsContact C-N 3.34Å; L1063-A1065 PolarHBondContact O-N 2.8Å; L1063-R1066 CarbonylContact O-C 3.51Å; L1063-R1066 WeakPolarHBondContact O-CA 3.31Å; L1063-R1066 PolarHBondContact O-N 3.2Å; L1063-N1067 PolarHBondContact O-N 3.4Å; L1063-C1068 HydrophobicContact CB-CB 4.14Å; L1063-C1068 HydrophobicContact CD2-CB 3.98Å; L1063-C1068 PolarHBondContact O-N 2.98Å; L1063-F1091 HydrophobicContact CD1-CE1 3.92Å; L1063-F1091 HydrophobicContact CD1-CZ 4.47Å; L1063-F1091 HydrophobicContact CD2-CE1 3.92Å
1064	E	95.2	Very high	95.3	Very high	41 Å²	41	23.1 Å²	23.1	19%	0.192	12%	0.122	C	C	.	.	H	α-helix	trans	-56.1	-46.6	171	-179.8	169.2	-118.4	0	0	110.8	M1060 M1061 R1066 N1067 I1126 S1193 F1194 S1195	M1060-E1064 WeakPolarHBondContact O-CB 3.18Å; M1060-E1064 PolarHBondContact O-N 2.73Å; M1061-E1064 PolarHBondContact O-N 3.14Å; E1064-R1066 PolarHBondContact O-N 3.05Å; E1064-N1067 PolarHBondContact O-N 3.31Å; E1064-I1126 HydrophobicContact CB-CD1 4.09Å; E1064-I1126 HydrophobicContact CB-CG1 3.88Å; E1064-I1126 HydrophobicContact CG-CG1 3.97Å; E1064-S1193 WeakPolarHBondContact OE1-CB 3.37Å; E1064-F1194 HydrophobicContact CB-CD2 4.29Å; E1064-F1194 PolarHBondContact OE1-N 2.77Å; E1064-F1194 WeakPolarHBondContact OE2-CA 3.26Å; E1064-F1194 WeakPolarHBondContact OE2-CB 3.37Å; E1064-F1194 PolarHBondContact OE2-N 3.38Å; E1064-S1195 PolarHBondContact OE2-N 3.13Å
1065	A	94.2	Very high	95.4	Very high	85 Å²	85	21.7 Å²	21.7	70%	0.702	12%	0.115	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.4	-12.5	175.9	0	0	0	0	0	114.6	M1061 Y1062 L1063	M1061-A1065 WeakPolarHBondContact O-CB 3.47Å; M1061-A1065 PolarHBondContact O-N 3.05Å; Y1062-A1065 PolarHBondContact O-N 3.27Å; L1063-A1065 VanDerWaalsContact C-N 3.34Å; L1063-A1065 PolarHBondContact O-N 2.8Å
1066	R	90.8	Very high	95.2	Very high	95 Å²	95	24.8 Å²	24.8	36%	0.358	13%	0.126	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.2	7.6	174.5	-70.9	-67.3	-161.4	147.7	14	113.2	N1002 F1003 Y1062 L1063 E1064 C1068	N1002-R1066 PolarHBondContact O-NH2 3.28Å; F1003-R1066 HydrophobicContact CE1-CB 4.26Å; F1003-R1066 HydrophobicContact CE1-CG 4.27Å; Y1062-R1066 HydrophobicContact CD1-CG 4.3Å; Y1062-R1066 HydrophobicContact CE1-CG 3.94Å; Y1062-R1066 VanDerWaalsContact O-CG 3.28Å; Y1062-R1066 WeakPolarHBondContact O-CG 3.42Å; Y1062-R1066 PolarHBondContact O-N 3.24Å; Y1062-R1066 VanDerWaalsContact O-N 3.16Å; Y1062-R1066 PolarHBondContact OH-NE 3.36Å; Y1062-R1066 PolarHBondContact OH-NH2 2.99Å; L1063-R1066 CarbonylContact O-C 3.51Å; L1063-R1066 WeakPolarHBondContact O-CA 3.31Å; L1063-R1066 PolarHBondContact O-N 3.2Å; E1064-R1066 PolarHBondContact O-N 3.05Å; R1066-C1068 HydrophobicContact CB-CB 4.32Å; R1066-C1068 PolarHBondContact O-N 2.87Å; R1066-C1068 VanDerWaalsContact O-N 3.11Å
1067	N	90.4	Very high	95.1	Very high	69 Å²	69	25.7 Å²	25.7	37%	0.369	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.7	25.7	-170.1	-68.5	-22.5	0	0	0	113.7	L1063 E1064 E1096 E1097 H1098	L1063-N1067 PolarHBondContact O-N 3.4Å; E1064-N1067 PolarHBondContact O-N 3.31Å; N1067-E1096 CarbonylContact O-C 3.55Å; N1067-E1096 WeakPolarHBondContact O-CA 3.01Å; N1067-E1097 PolarHBondContact O-N 2.68Å; N1067-H1098 PolarHBondContact ND2-CE1 2.99Å; N1067-H1098 VanDerWaalsContact ND2-CE1 3.25Å; N1067-H1098 PolarHBondContact ND2-NE2 2.98Å; N1067-H1098 PolarHBondContact OD1-CE1 2.95Å; N1067-H1098 PolarHBondContact OD1-ND1 2.73Å
1068	C	90.8	Very high	95.1	Very high	1 Å²	1	25.7 Å²	25.7	1%	0.007	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	110.2	-177.7	-172.4	0	0	0	0	110.5	F1003 L1063 R1066 R1095	F1003-C1068 HydrophobicContact CE2-CB 4.38Å; F1003-C1068 HydrophobicContact CZ-CB 3.8Å; L1063-C1068 HydrophobicContact CB-CB 4.14Å; L1063-C1068 HydrophobicContact CD2-CB 3.98Å; L1063-C1068 PolarHBondContact O-N 2.98Å; R1066-C1068 HydrophobicContact CB-CB 4.32Å; R1066-C1068 PolarHBondContact O-N 2.87Å; R1066-C1068 VanDerWaalsContact O-N 3.11Å; C1068-R1095 CarbonylContact C-O 3.57Å; C1068-R1095 WeakPolarHBondContact CA-O 3.38Å
1069	I	92.7	Very high	95	Very high	2 Å²	2	25.6 Å²	25.6	1%	0.01	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	123.9	169.2	-44.1	167	0	0	0	107.6	R1071 S1094 R1095 E1097 Y1124 D1129	I1069-R1071 HydrophobicContact CB-CG 4.12Å; I1069-R1071 HydrophobicContact CG2-CG 3.52Å; I1069-S1094 CarbonylContact O-C 3.52Å; I1069-S1094 WeakPolarHBondContact O-CA 3.38Å; I1069-S1094 WeakPolarHBondContact O-CB 3.21Å; I1069-R1095 PolarHBondContact N-O 3.4Å; I1069-R1095 PolarHBondContact O-N 3.45Å; I1069-E1097 WeakPolarHBondContact CD1-O 3.34Å; I1069-E1097 VanDerWaalsContact CG1-O 3.29Å; I1069-E1097 WeakPolarHBondContact CG1-O 3.22Å; I1069-Y1124 WeakPolarHBondContact CD1-O 3.32Å; I1069-D1129 WeakPolarHBondContact CA-OD2 3.41Å; I1069-D1129 WeakPolarHBondContact CG2-OD2 3.36Å
1070	H	93.1	Very high	95	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	13%	0.13	C	C	.	.			trans	-82.4	-42	-175.5	-175.3	-6.5	0	0	0	113	M1060 D1072 I1088 A1089 D1090 S1094 D1129	M1060-H1070 HydrophobicContact CE-CB 4.2Å; M1060-H1070 HydrophobicContact SD-CB 4.39Å; H1070-D1072 PolarHBondContact O-N 3.11Å; H1070-I1088 VanDerWaalsContact CD2-CG2 3.42Å; H1070-I1088 WeakPolarHBondContact CD2-CG2 3.43Å; H1070-I1088 WeakPolarHBondContact NE2-CG2 3.28Å; H1070-A1089 PolarHBondContact CE1-O 2.72Å; H1070-A1089 PolarHBondContact NE2-O 3.39Å; H1070-D1090 PolarHBondContact CE1-O 2.9Å; H1070-S1094 WeakPolarHBondContact CA-OG 3.29Å; H1070-S1094 PolarHBondContact ND1-OG 3.02Å; H1070-S1094 PolarHBondContact O-OG 3.42Å; H1070-D1129 PolarHBondContact N-OD2 3.3Å
1071	R	92.3	Very high	94.8	Very high	12 Å²	12	26.6 Å²	26.6	5%	0.045	14%	0.137	C	C	.	.	S	Bend	trans	66.9	-6.8	173.5	-49.8	178.8	52.3	-113.2	-4.3	117.3	I1069 M1093 Y1124 D1129	I1069-R1071 HydrophobicContact CB-CG 4.12Å; I1069-R1071 HydrophobicContact CG2-CG 3.52Å; R1071-M1093 HydrophobicContact CB-CB 4.37Å; R1071-M1093 WeakPolarHBondContact CD-O 3.39Å; R1071-M1093 PolarHBondContact NH1-O 3.05Å; R1071-Y1124 HydrophobicContact CB-CD1 4Å; R1071-Y1124 HydrophobicContact CB-CE1 4.16Å; R1071-Y1124 HydrophobicContact CG-CD1 3.66Å; R1071-Y1124 HydrophobicContact CG-CE1 4.32Å; R1071-Y1124 HydrophobicContact CG-CG 4.07Å; R1071-Y1124 VanDerWaalsContact NE-CG 3.31Å; R1071-D1129 WeakPolarHBondContact CA-OD1 3.35Å; R1071-D1129 PolarHBondContact N-OD1 3.41Å
1072	D	93.1	Very high	94.3	Very high	13 Å²	13	29.7 Å²	29.7	7%	0.07	16%	0.155	C	C	.	.			trans	-141.1	38.4	172.2	-162.8	25.4	0	0	0	113.2	H1070 A1074 R1076 N1077 M1093 P1110	H1070-D1072 PolarHBondContact O-N 3.11Å; D1072-A1074 PolarHBondContact O-N 3.25Å; D1072-R1076 IonicContact OD1-CZ 3.15Å; D1072-R1076 IonicContact OD1-NE 3.09Å; D1072-R1076 IonicContact OD1-NH2 2.65Å; D1072-R1076 PolarHBondContact OD1-NH2 2.84Å; D1072-R1076 IonicContact OD2-NE 2.73Å; D1072-N1077 PolarHBondContact O-ND2 3.17Å; D1072-N1077 PolarHBondContact OD2-ND2 3.44Å; D1072-M1093 HydrophobicContact CB-SD 3.94Å; D1072-P1110 HydrophobicContact CB-CG 4.41Å; D1072-P1110 WeakPolarHBondContact OD1-CB 3.33Å; D1072-P1110 VanDerWaalsContact OD1-CG 3.28Å; D1072-P1110 WeakPolarHBondContact OD1-CG 3.38Å
1073	L	97.3	Very high	93.8	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	17%	0.174	C	C	.	.			trans	-67.8	115.3	175.5	179.7	69.8	0	0	0	111	M1060 I1088 Y1133 L1136	M1060-L1073 HydrophobicContact CG-CD1 4.34Å; M1060-L1073 HydrophobicContact CG-CD2 3.71Å; M1060-L1073 HydrophobicContact SD-CD1 3.97Å; M1060-L1073 HydrophobicContact SD-CD2 3.77Å; M1060-L1073 HydrophobicContact SD-CG 4.35Å; L1073-I1088 HydrophobicContact CD1-CD1 4.16Å; L1073-I1088 HydrophobicContact CD1-CG1 4.44Å; L1073-I1088 HydrophobicContact CD1-CG2 4.13Å; L1073-Y1133 HydrophobicContact CD2-CD2 4.33Å; L1073-L1136 HydrophobicContact CD1-CD2 4Å; L1073-L1136 HydrophobicContact CD2-CD2 4.43Å; L1073-L1136 HydrophobicContact CG-CD2 4.17Å
1074	A	97.6	Very high	93.5	Very high	0 Å²	0	33 Å²	33	0%	0	18%	0.177	C	C	.	.	S	Bend	trans	-161.9	160.8	-179.1	0	0	0	0	0	110.8	D1072 R1076 N1077 C1078 W1113	D1072-A1074 PolarHBondContact O-N 3.25Å; A1074-R1076 HydrophobicContact CB-CG 3.74Å; A1074-R1076 PolarHBondContact O-N 3.19Å; A1074-N1077 PolarHBondContact O-N 3.28Å; A1074-C1078 PolarHBondContact O-N 3.1Å; A1074-W1113 HydrophobicContact CB-CD2 4.11Å; A1074-W1113 HydrophobicContact CB-CG 4.04Å; A1074-W1113 HydrophobicContact CB-CZ2 4.42Å; A1074-W1113 VanDerWaalsContact CB-NE1 3.32Å
1075	A	97.7	Very high	93.5	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-18.6	-177.8	0	0	0	0	0	114.1	L1033 L1034 N1077 L1136 E1139	L1033-A1075 WeakPolarHBondContact CB-O 3.42Å; L1033-A1075 HydrophobicContact CD2-CB 4.04Å; L1033-A1075 HydrophobicContact CG-CB 4.48Å; L1034-A1075 HydrophobicContact CB-CB 4.02Å; L1034-A1075 WeakPolarHBondContact CB-O 3.44Å; L1034-A1075 HydrophobicContact CD1-CB 4.28Å; L1034-A1075 PolarHBondContact N-O 3.06Å; A1075-N1077 VanDerWaalsContact C-N 3.32Å; A1075-L1136 HydrophobicContact CB-CD1 3.87Å; A1075-E1139 HydrophobicContact CB-CB 3.88Å; A1075-E1139 HydrophobicContact CB-CG 4.32Å; A1075-E1139 WeakPolarHBondContact CB-OE2 3.04Å; A1075-E1139 PolarHBondContact N-OE2 3.14Å
1076	R	95	Very high	93.6	Very high	71 Å²	71	30.3 Å²	30.3	27%	0.268	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-31.8	169.8	50.8	162.3	175.7	-68.2	-6.4	113.4	S1032 L1034 D1072 A1074	S1032-R1076 WeakPolarHBondContact CB-O 3.45Å; L1034-R1076 HydrophobicContact CD2-CB 4.17Å; D1072-R1076 IonicContact OD1-CZ 3.15Å; D1072-R1076 IonicContact OD1-NE 3.09Å; D1072-R1076 IonicContact OD1-NH2 2.65Å; D1072-R1076 PolarHBondContact OD1-NH2 2.84Å; D1072-R1076 IonicContact OD2-NE 2.73Å; A1074-R1076 HydrophobicContact CB-CG 3.74Å; A1074-R1076 PolarHBondContact O-N 3.19Å
1077	N	95.4	Very high	94	Very high	19 Å²	19	27.2 Å²	27.2	10%	0.102	14%	0.139	C	C	.	.	S	Bend	trans	-107.3	7	-171.9	-62.9	-6.1	0	0	0	111.8	D1072 A1074 A1075 A1089	D1072-N1077 PolarHBondContact O-ND2 3.17Å; D1072-N1077 PolarHBondContact OD2-ND2 3.44Å; A1074-N1077 PolarHBondContact O-N 3.28Å; A1075-N1077 VanDerWaalsContact C-N 3.32Å; N1077-A1089 CarbonylContact O-C 3.54Å; N1077-A1089 WeakPolarHBondContact O-CA 3.41Å; N1077-A1089 WeakPolarHBondContact O-CB 3.24Å; N1077-A1089 PolarHBondContact O-N 2.99Å
1078	C	97.8	Very high	94.3	Very high	0 Å²	0	24 Å²	24	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	139.1	161.8	-56.9	0	0	0	0	108.7	S1032 L1033 A1074 L1086 K1087	S1032-C1078 CarbonylContact C-O 3.53Å; S1032-C1078 VanDerWaalsContact CA-O 3.3Å; S1032-C1078 WeakPolarHBondContact CA-O 3.24Å; L1033-C1078 HydrophobicContact CB-CB 3.91Å; L1033-C1078 HydrophobicContact CD2-CB 4.04Å; L1033-C1078 PolarHBondContact N-O 3.1Å; A1074-C1078 PolarHBondContact O-N 3.1Å; C1078-L1086 HydrophobicContact CB-CD1 3.95Å; C1078-L1086 HydrophobicContact CB-CD2 4.04Å; C1078-L1086 HydrophobicContact CB-CG 3.9Å; C1078-K1087 CarbonylContact C-O 3.41Å; C1078-K1087 VanDerWaalsContact CA-O 3.3Å; C1078-K1087 WeakPolarHBondContact CA-O 3.47Å
1079	L	97.3	Very high	94.4	Very high	31 Å²	31	24.2 Å²	24.2	16%	0.162	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	160.5	171.9	-52.6	-173.9	0	0	0	110.3	V1009 V1028 G1031 L1086 K1087 A1089	V1009-L1079 HydrophobicContact CG2-CB 4.41Å; V1009-L1079 HydrophobicContact CG2-CD1 3.96Å; V1009-L1079 HydrophobicContact CG2-CG 4.24Å; V1028-L1079 HydrophobicContact CB-CB 3.95Å; V1028-L1079 HydrophobicContact CB-CD1 3.83Å; V1028-L1079 HydrophobicContact CG1-CB 3.71Å; V1028-L1079 HydrophobicContact CG2-CB 4.38Å; V1028-L1079 HydrophobicContact CG2-CD1 3.94Å; G1031-L1079 CarbonylContact O-C 3.54Å; G1031-L1079 VanDerWaalsContact O-CA 3.24Å; G1031-L1079 WeakPolarHBondContact O-CA 3.47Å; L1079-L1086 WeakPolarHBondContact O-CA 3.38Å; L1079-K1087 PolarHBondContact N-O 3.38Å; L1079-K1087 PolarHBondContact O-N 2.76Å; L1079-A1089 HydrophobicContact CD1-CB 4.28Å; L1079-A1089 HydrophobicContact CG-CB 4.05Å
1080	I	96.5	Very high	94.1	Very high	1 Å²	1	26.2 Å²	26.2	1%	0.005	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	125.3	179.1	-162.3	75.7	0	0	0	110.3	V1028 G1030 G1031 L1033 H1036 M1052 L1086	V1028-I1080 VanDerWaalsContact CG1-C 3.47Å; V1028-I1080 WeakPolarHBondContact CG1-O 3.36Å; G1030-I1080 WeakPolarHBondContact CA-O 3.43Å; G1030-I1080 PolarHBondContact N-O 3.34Å; G1031-I1080 PolarHBondContact O-N 2.71Å; L1033-I1080 HydrophobicContact CD1-CD1 4.32Å; H1036-I1080 HydrophobicContact CB-CG2 3.81Å; M1052-I1080 HydrophobicContact CE-CD1 3.7Å; M1052-I1080 HydrophobicContact CE-CG1 4.3Å; M1052-I1080 HydrophobicContact CG-CD1 4.23Å; I1080-L1086 HydrophobicContact CD1-CB 4.27Å
1081	S	93.4	Very high	93.7	Very high	20 Å²	20	26.3 Å²	26.3	14%	0.14	14%	0.135	C	C	.	.			trans	-78.1	173.7	175.6	58.5	0	0	0	0	112.1	D1083 G1084 Q1085	S1081-D1083 VanDerWaalsContact CB-OD1 3.27Å; S1081-D1083 WeakPolarHBondContact CB-OD1 3.12Å; S1081-D1083 PolarHBondContact OG-OD1 2.93Å; S1081-G1084 WeakPolarHBondContact O-CA 3.38Å; S1081-G1084 PolarHBondContact O-N 3.11Å; S1081-Q1085 PolarHBondContact N-O 2.94Å; S1081-Q1085 WeakPolarHBondContact OG-CB 3.23Å; S1081-Q1085 PolarHBondContact OG-N 2.77Å; S1081-Q1085 PolarHBondContact OG-O 3.09Å
1082	D	87.2	Confident	92.8	Very high	125 Å²	125	25.9 Å²	25.9	67%	0.668	13%	0.134	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.8	-26.7	-176.5	-60.1	-44.4	0	0	0	113.7	P1029 G1084	P1029-D1082 WeakPolarHBondContact CB-OD2 3.23Å; P1029-D1082 WeakPolarHBondContact CG-OD2 3.5Å; D1082-G1084 PolarHBondContact O-N 2.75Å
1083	D	87.6	Confident	91.9	Very high	102 Å²	102	26.7 Å²	26.7	55%	0.545	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-7.8	163.5	67.3	-34.9	0	0	0	112.4	K1048 S1081 Q1085	K1048-D1083 PolarHBondContact NZ-O 3.1Å; S1081-D1083 VanDerWaalsContact CB-OD1 3.27Å; S1081-D1083 WeakPolarHBondContact CB-OD1 3.12Å; S1081-D1083 PolarHBondContact OG-OD1 2.93Å; D1083-Q1085 WeakPolarHBondContact OD2-CG 3.44Å; D1083-Q1085 PolarHBondContact OD2-NE2 3.46Å
1084	G	88	Confident	91	Very high	7 Å²	7	26.7 Å²	26.7	7%	0.072	14%	0.138	C	C	.	.			trans	76	35.6	174.2	0	0	0	0	0	113.9	K1048 S1081 D1082	K1048-G1084 WeakPolarHBondContact CE-O 3.3Å; K1048-G1084 VanDerWaalsContact NZ-C 3.31Å; K1048-G1084 PolarHBondContact NZ-O 3.44Å; S1081-G1084 WeakPolarHBondContact O-CA 3.38Å; S1081-G1084 PolarHBondContact O-N 3.11Å; D1082-G1084 PolarHBondContact O-N 2.75Å
1085	Q	94.5	Very high	90.1	Very high	69 Å²	69	27.4 Å²	27.4	32%	0.322	14%	0.14	S	C	.	.			trans	-78.2	138.7	161.1	-64	179.7	43.4	0	0	109	D1055 S1081 D1083	D1055-Q1085 WeakPolarHBondContact OD2-CA 3.25Å; S1081-Q1085 PolarHBondContact N-O 2.94Å; S1081-Q1085 WeakPolarHBondContact OG-CB 3.23Å; S1081-Q1085 PolarHBondContact OG-N 2.77Å; S1081-Q1085 PolarHBondContact OG-O 3.09Å; D1083-Q1085 WeakPolarHBondContact OD2-CG 3.44Å; D1083-Q1085 PolarHBondContact OD2-NE2 3.46Å
1086	L	97.8	Very high	89.2	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	135.7	171	177.9	161	0	0	0	110.1	N1007 L1033 M1052 D1055 A1056 C1078 L1079 I1080 I1088	N1007-L1086 WeakPolarHBondContact CA-O 3.36Å; N1007-L1086 WeakPolarHBondContact CB-O 3.49Å; N1007-L1086 PolarHBondContact ND2-O 3.32Å; L1033-L1086 HydrophobicContact CD1-CD1 4.19Å; L1033-L1086 HydrophobicContact CD2-CD1 3.53Å; L1033-L1086 HydrophobicContact CG-CD1 4.37Å; M1052-L1086 HydrophobicContact CB-CD1 4.2Å; D1055-L1086 HydrophobicContact CB-CB 3.73Å; D1055-L1086 HydrophobicContact CB-CD2 4.49Å; D1055-L1086 PolarHBondContact OD2-N 3.24Å; A1056-L1086 HydrophobicContact CB-CD1 4.18Å; A1056-L1086 HydrophobicContact CB-CD2 3.81Å; C1078-L1086 HydrophobicContact CB-CD1 3.95Å; C1078-L1086 HydrophobicContact CB-CD2 4.04Å; C1078-L1086 HydrophobicContact CB-CG 3.9Å; L1079-L1086 WeakPolarHBondContact O-CA 3.38Å; I1080-L1086 HydrophobicContact CD1-CB 4.27Å; L1086-I1088 HydrophobicContact CD2-CG1 4.09Å
1087	K	98.1	Very high	88.4	Confident	30 Å²	30	32.6 Å²	32.6	13%	0.13	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	138.5	171.3	-56.7	-162.3	173.4	-167.5	0	111.8	P1006 N1007 V1009 E1026 V1028 C1078 L1079	P1006-K1087 WeakPolarHBondContact O-CD 3.49Å; P1006-K1087 WeakPolarHBondContact O-CE 3.27Å; P1006-K1087 WeakPolarHBondContact O-CG 3.26Å; N1007-K1087 CarbonylContact O-C 3.45Å; N1007-K1087 WeakPolarHBondContact O-CA 3.36Å; V1009-K1087 HydrophobicContact CB-CB 4.48Å; V1009-K1087 HydrophobicContact CG2-CB 3.38Å; V1009-K1087 HydrophobicContact CG2-CD 4.23Å; V1009-K1087 HydrophobicContact CG2-CG 4.44Å; E1026-K1087 IonicContact OE1-NZ 3Å; E1026-K1087 PolarHBondContact OE1-NZ 2.89Å; E1026-K1087 IonicContact OE2-NZ 3.06Å; E1026-K1087 PolarHBondContact OE2-NZ 3.46Å; V1028-K1087 HydrophobicContact CG2-CD 4.35Å; C1078-K1087 CarbonylContact C-O 3.41Å; C1078-K1087 VanDerWaalsContact CA-O 3.3Å; C1078-K1087 WeakPolarHBondContact CA-O 3.47Å; L1079-K1087 PolarHBondContact N-O 3.38Å; L1079-K1087 PolarHBondContact O-N 2.76Å
1088	I	97.6	Very high	87.6	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	137.7	178.2	-56.1	177.3	0	0	0	110.4	N1007 I1008 V1009 M1060 H1070 L1073 L1086 F1091	N1007-I1088 PolarHBondContact O-N 2.9Å; I1008-I1088 HydrophobicContact CD1-CB 3.99Å; I1008-I1088 HydrophobicContact CD1-CD1 4.29Å; I1008-I1088 HydrophobicContact CD1-CG1 4.48Å; V1009-I1088 WeakPolarHBondContact CG2-O 3.36Å; V1009-I1088 PolarHBondContact N-O 3.37Å; M1060-I1088 HydrophobicContact CG-CD1 3.73Å; M1060-I1088 HydrophobicContact SD-CD1 3.8Å; H1070-I1088 VanDerWaalsContact CD2-CG2 3.42Å; H1070-I1088 WeakPolarHBondContact CD2-CG2 3.43Å; H1070-I1088 WeakPolarHBondContact NE2-CG2 3.28Å; L1073-I1088 HydrophobicContact CD1-CD1 4.16Å; L1073-I1088 HydrophobicContact CD1-CG1 4.44Å; L1073-I1088 HydrophobicContact CD1-CG2 4.13Å; L1086-I1088 HydrophobicContact CD2-CG1 4.09Å; I1088-F1091 HydrophobicContact CG2-CZ 4.43Å
1089	A	93.3	Very high	87	Confident	7 Å²	7	41.8 Å²	41.8	6%	0.058	21%	0.211	C	C	.	.			trans	-141.7	177.8	-170.1	0	0	0	0	0	113.4	V1009 H1070 N1077 L1079	V1009-A1089 HydrophobicContact CB-CB 4.15Å; V1009-A1089 HydrophobicContact CG2-CB 3.74Å; H1070-A1089 PolarHBondContact CE1-O 2.72Å; H1070-A1089 PolarHBondContact NE2-O 3.39Å; N1077-A1089 CarbonylContact O-C 3.54Å; N1077-A1089 WeakPolarHBondContact O-CA 3.41Å; N1077-A1089 WeakPolarHBondContact O-CB 3.24Å; N1077-A1089 PolarHBondContact O-N 2.99Å; L1079-A1089 HydrophobicContact CD1-CB 4.28Å; L1079-A1089 HydrophobicContact CG-CB 4.05Å
1090	D	86.1	Confident	86.2	Confident	43 Å²	43	41.8 Å²	41.8	23%	0.23	21%	0.209	C	C	.	.			trans	56.1	76.5	-174.9	-152.5	-35.6	0	0	0	114.2	K978 H1070 G1092	K978-D1090 IonicContact NZ-OD1 3.1Å; K978-D1090 PolarHBondContact NZ-OD1 3.46Å; K978-D1090 IonicContact NZ-OD2 3.9Å; K978-D1090 PolarHBondContact NZ-OD2 2.96Å; H1070-D1090 PolarHBondContact CE1-O 2.9Å; D1090-G1092 PolarHBondContact O-N 3.23Å; D1090-G1092 PolarHBondContact OD1-N 3.44Å
1091	F	84.2	Confident	85.4	Confident	2 Å²	2	46.9 Å²	46.9	1%	0.009	23%	0.233	C	C	.	.	G	3₁₀ helix	trans	-81.2	7.3	178.5	-67.3	-86.8	0	0	0	113.5	G996 A1000 F1003 I1008 L1011 L1063 I1088 M1093 S1094	G996-F1091 CarbonylContact C-O 3.37Å; G996-F1091 VanDerWaalsContact CA-O 3.24Å; G996-F1091 WeakPolarHBondContact CA-O 3.14Å; A1000-F1091 HydrophobicContact CB-CB 3.79Å; A1000-F1091 HydrophobicContact CB-CD1 4.13Å; A1000-F1091 HydrophobicContact CB-CD2 3.78Å; A1000-F1091 HydrophobicContact CB-CE2 4.49Å; A1000-F1091 HydrophobicContact CB-CG 3.6Å; F1003-F1091 HydrophobicContact CD2-CD1 4.38Å; F1003-F1091 HydrophobicContact CD2-CE1 4.06Å; F1003-F1091 HydrophobicContact CD2-CZ 4.34Å; F1003-F1091 AromaticContact CE2-CD1 3.99Å; F1003-F1091 HydrophobicContact CE2-CD1 3.99Å; F1003-F1091 AromaticContact CE2-CE1 3.9Å; F1003-F1091 HydrophobicContact CE2-CE1 3.9Å; I1008-F1091 HydrophobicContact CD1-CZ 4.34Å; I1008-F1091 HydrophobicContact CG2-CE2 4.06Å; I1008-F1091 HydrophobicContact CG2-CZ 3.77Å; L1011-F1091 HydrophobicContact CD1-CD2 4.31Å; L1063-F1091 HydrophobicContact CD1-CE1 3.92Å; L1063-F1091 HydrophobicContact CD1-CZ 4.47Å; L1063-F1091 HydrophobicContact CD2-CE1 3.92Å; I1088-F1091 HydrophobicContact CG2-CZ 4.43Å; F1091-M1093 PolarHBondContact O-N 3.06Å; F1091-S1094 WeakPolarHBondContact CA-OG 3.49Å; F1091-S1094 WeakPolarHBondContact O-CB 3.36Å; F1091-S1094 PolarHBondContact O-N 2.85Å; F1091-S1094 PolarHBondContact O-OG 2.82Å
1092	G	74.3	Confident	84.5	Confident	3 Å²	3	47.2 Å²	47.2	3%	0.031	23%	0.234	C	C	.	.	G	3₁₀ helix	trans	-59.2	-26.3	-175	0	0	0	0	0	114.7	D1090	D1090-G1092 PolarHBondContact O-N 3.23Å; D1090-G1092 PolarHBondContact OD1-N 3.44Å
1093	M	72.6	Confident	83.4	Confident	30 Å²	30	47.3 Å²	47.3	15%	0.148	24%	0.244	C	C	.	.	G	3₁₀ helix	trans	-93.7	-10	175.3	-69.7	-172.4	59.7	0	0	114.5	R1071 D1072 F1091 R1095 Q1108	R1071-M1093 HydrophobicContact CB-CB 4.37Å; R1071-M1093 WeakPolarHBondContact CD-O 3.39Å; R1071-M1093 PolarHBondContact NH1-O 3.05Å; D1072-M1093 HydrophobicContact CB-SD 3.94Å; F1091-M1093 PolarHBondContact O-N 3.06Å; M1093-R1095 PolarHBondContact O-NH1 2.78Å; M1093-Q1108 VanDerWaalsContact CE-O 3.3Å; M1093-Q1108 WeakPolarHBondContact CE-O 3.46Å
1094	S	79.7	Confident	82.1	Confident	0 Å²	0	45 Å²	45	0%	0	23%	0.231	C	C	.	.			trans	-77.5	151.9	-167.7	-51.6	0	0	0	0	113.7	G996 I1069 H1070 F1091	G996-S1094 WeakPolarHBondContact CA-O 3.45Å; I1069-S1094 CarbonylContact O-C 3.52Å; I1069-S1094 WeakPolarHBondContact O-CA 3.38Å; I1069-S1094 WeakPolarHBondContact O-CB 3.21Å; H1070-S1094 WeakPolarHBondContact CA-OG 3.29Å; H1070-S1094 PolarHBondContact ND1-OG 3.02Å; H1070-S1094 PolarHBondContact O-OG 3.42Å; F1091-S1094 WeakPolarHBondContact CA-OG 3.49Å; F1091-S1094 WeakPolarHBondContact O-CB 3.36Å; F1091-S1094 PolarHBondContact O-N 2.85Å; F1091-S1094 PolarHBondContact O-OG 2.82Å
1095	R	79.1	Confident	80.5	Confident	15 Å²	15	51.5 Å²	51.5	6%	0.057	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	139	-177.3	-61.3	-66.2	178.7	-92.4	7.4	111.5	Q995 C1068 I1069 M1093 E1097 Y1100	Q995-R1095 VanDerWaalsContact CD-CZ 3.48Å; C1068-R1095 CarbonylContact C-O 3.57Å; C1068-R1095 WeakPolarHBondContact CA-O 3.38Å; I1069-R1095 PolarHBondContact N-O 3.4Å; I1069-R1095 PolarHBondContact O-N 3.45Å; M1093-R1095 PolarHBondContact O-NH1 2.78Å; R1095-E1097 VanDerWaalsContact C-N 3.31Å; R1095-E1097 PolarHBondContact O-N 3.3Å; R1095-Y1100 HydrophobicContact CB-CD2 4.32Å; R1095-Y1100 HydrophobicContact CB-CG 4.25Å; R1095-Y1100 HydrophobicContact CG-CD1 4.11Å; R1095-Y1100 HydrophobicContact CG-CD2 3.76Å; R1095-Y1100 HydrophobicContact CG-CE1 4.35Å; R1095-Y1100 HydrophobicContact CG-CE2 4.04Å; R1095-Y1100 HydrophobicContact CG-CG 3.8Å
1096	E	76.9	Confident	78.5	Confident	103 Å²	103	52.8 Å²	52.8	48%	0.481	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	61.7	178.9	-163.6	169.1	-171.5	0	0	110.5	T999 N1067	T999-E1096 HydrophobicContact CG2-CB 4Å; T999-E1096 HydrophobicContact CG2-CG 4.44Å; T999-E1096 WeakPolarHBondContact CG2-OE2 3.27Å; N1067-E1096 CarbonylContact O-C 3.55Å; N1067-E1096 WeakPolarHBondContact O-CA 3.01Å
1097	E	78.6	Confident	76.5	Confident	78 Å²	78	54.3 Å²	54.3	36%	0.364	28%	0.275	S	S	.	.	S	Bend	trans	-142.5	140.7	-171.9	-66.7	172.1	-142.2	0	0	109.3	N1067 I1069 R1095 I1099 Y1100	N1067-E1097 PolarHBondContact O-N 2.68Å; I1069-E1097 WeakPolarHBondContact CD1-O 3.34Å; I1069-E1097 VanDerWaalsContact CG1-O 3.29Å; I1069-E1097 WeakPolarHBondContact CG1-O 3.22Å; R1095-E1097 VanDerWaalsContact C-N 3.31Å; R1095-E1097 PolarHBondContact O-N 3.3Å; E1097-I1099 VanDerWaalsContact C-N 3.25Å; E1097-I1099 PolarHBondContact O-N 2.78Å; E1097-Y1100 WeakPolarHBondContact OE2-CD2 3.45Å
1098	H	79.7	Confident	75	Confident	135 Å²	135	59 Å²	59	63%	0.625	30%	0.297	S	S	*	.	S	Bend	trans	-63.6	-33.1	174.7	-77.2	-65.7	0	0	0	113	N1067	N1067-H1098 PolarHBondContact ND2-CE1 2.99Å; N1067-H1098 VanDerWaalsContact ND2-CE1 3.25Å; N1067-H1098 PolarHBondContact ND2-NE2 2.98Å; N1067-H1098 PolarHBondContact OD1-CE1 2.95Å; N1067-H1098 PolarHBondContact OD1-ND1 2.73Å
1099	I	83.8	Confident	74.3	Confident	76 Å²	76	60.7 Å²	60.7	39%	0.39	31%	0.306	S	S	.	.	S	Bend	trans	-141.6	118.5	-177	-65.4	152.6	0	0	0	106.3	E1097 E1101 R1123 Y1124 T1125	E1097-I1099 VanDerWaalsContact C-N 3.25Å; E1097-I1099 PolarHBondContact O-N 2.78Å; I1099-E1101 HydrophobicContact CG2-CG 4.27Å; I1099-R1123 HydrophobicContact CG2-CG 3.83Å; I1099-R1123 VanDerWaalsContact CG2-CZ 3.5Å; I1099-Y1124 WeakPolarHBondContact CA-O 3.22Å; I1099-T1125 HydrophobicContact CG1-CG2 4.11Å
1100	Y	81.2	Confident	74.2	Confident	31 Å²	31	61.2 Å²	61.2	12%	0.122	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	125.6	174.2	173.3	-105.7	0	0	0	110.3	R1095 E1097 L1102 Y1124	R1095-Y1100 HydrophobicContact CB-CD2 4.32Å; R1095-Y1100 HydrophobicContact CB-CG 4.25Å; R1095-Y1100 HydrophobicContact CG-CD1 4.11Å; R1095-Y1100 HydrophobicContact CG-CD2 3.76Å; R1095-Y1100 HydrophobicContact CG-CE1 4.35Å; R1095-Y1100 HydrophobicContact CG-CE2 4.04Å; R1095-Y1100 HydrophobicContact CG-CG 3.8Å; E1097-Y1100 WeakPolarHBondContact OE2-CD2 3.45Å; Y1100-L1102 HydrophobicContact CE1-CD2 3.97Å; Y1100-L1102 HydrophobicContact CE1-CG 4.32Å; Y1100-Y1124 HydrophobicContact CD1-CD2 4.4Å; Y1100-Y1124 PolarHBondContact N-O 3.49Å; Y1100-Y1124 PolarHBondContact O-N 2.87Å
1101	E	80.4	Confident	74.5	Confident	109 Å²	109	60.6 Å²	60.6	51%	0.509	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	130.1	177.8	-64.5	-167.3	165.4	0	0	111.7	I1099 S1103 R1123	I1099-E1101 HydrophobicContact CG2-CG 4.27Å; E1101-S1103 PolarHBondContact O-N 2.92Å; E1101-S1103 VanDerWaalsContact O-N 3.1Å; E1101-R1123 HydrophobicContact CG-CB 3.96Å; E1101-R1123 HydrophobicContact CG-CG 3.83Å; E1101-R1123 VanDerWaalsContact OE1-CD 3.22Å; E1101-R1123 WeakPolarHBondContact OE1-CD 3.35Å; E1101-R1123 WeakPolarHBondContact OE1-CG 3.41Å; E1101-R1123 IonicContact OE1-CZ 3.15Å; E1101-R1123 IonicContact OE1-NE 2.77Å; E1101-R1123 IonicContact OE1-NH1 2.69Å; E1101-R1123 PolarHBondContact OE1-NH1 3.21Å
1102	L	74	Confident	75.1	Confident	27 Å²	27	61.4 Å²	61.4	14%	0.141	31%	0.309	C	S	.	.			trans	-68.3	105.7	174.7	-82.2	175.8	0	0	0	110.7	Y1100 D1104 I1109 G1122 Y1124	Y1100-L1102 HydrophobicContact CE1-CD2 3.97Å; Y1100-L1102 HydrophobicContact CE1-CG 4.32Å; L1102-D1104 PolarHBondContact O-N 3.1Å; L1102-I1109 HydrophobicContact CD1-CD1 3.79Å; L1102-I1109 HydrophobicContact CD1-CG1 4.17Å; L1102-G1122 PolarHBondContact N-O 2.72Å; L1102-Y1124 HydrophobicContact CD1-CE2 3.73Å; L1102-Y1124 HydrophobicContact CG-CE2 4.03Å
1103	S	64.4	Low	76.2	Confident	126 Å²	126	62.8 Å²	62.8	88%	0.881	31%	0.313	S	S	*	.	S	Bend	trans	-59.7	-23	169.6	60.2	0	0	0	0	113.4	E1101	E1101-S1103 PolarHBondContact O-N 2.92Å; E1101-S1103 VanDerWaalsContact O-N 3.1Å
1104	D	59.4	Low	77.3	Confident	54 Å²	54	61.5 Å²	61.5	29%	0.289	31%	0.307	S	S	.	.	S	Bend	trans	-129.1	113.1	169.7	170.9	20.2	0	0	0	109.2	L1102 R1106	L1102-D1104 PolarHBondContact O-N 3.1Å; D1104-R1106 PolarHBondContact O-N 2.88Å; D1104-R1106 VanDerWaalsContact O-N 3.11Å; D1104-R1106 WeakPolarHBondContact OD1-CA 3.5Å; D1104-R1106 WeakPolarHBondContact OD1-CB 3.43Å; D1104-R1106 WeakPolarHBondContact OD1-CD 3.48Å; D1104-R1106 WeakPolarHBondContact OD1-CG 3.31Å; D1104-R1106 PolarHBondContact OD1-N 3.28Å
1105	K	55.6	Low	78	Confident	143 Å²	143	61.5 Å²	61.5	62%	0.622	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	-3.2	179.4	-62.7	-173.6	179.6	-174.2	0	113.5	T1121	K1105-T1121 VanDerWaalsContact CE-O 3.28Å; K1105-T1121 WeakPolarHBondContact CE-O 3.26Å
1106	R	52.1	Low	78.8	Confident	97 Å²	97	60.9 Å²	60.9	37%	0.366	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.4	0.8	-168.3	-46.8	171.9	98.6	-178.1	-1.2	112.7	N11 Y12 E14 D1104	N11-R1106 PolarHBondContact O-NH2 3.43Å; Y12-R1106 HydrophobicContact CE1-CB 3.66Å; Y12-R1106 VanDerWaalsContact CE1-CD 3.47Å; Y12-R1106 HydrophobicContact CE1-CG 4.03Å; Y12-R1106 VanDerWaalsContact CZ-CZ 3.44Å; Y12-R1106 WeakPolarHBondContact OH-CB 3.47Å; Y12-R1106 PolarHBondContact OH-NE 3.24Å; Y12-R1106 VanDerWaalsContact OH-NE 3.17Å; E14-R1106 WeakPolarHBondContact OE1-CD 3.27Å; E14-R1106 IonicContact OE1-CZ 3.17Å; E14-R1106 IonicContact OE1-NE 2.73Å; E14-R1106 IonicContact OE1-NH1 3.72Å; E14-R1106 PolarHBondContact OE1-NH1 2.98Å; D1104-R1106 PolarHBondContact O-N 2.88Å; D1104-R1106 VanDerWaalsContact O-N 3.11Å; D1104-R1106 WeakPolarHBondContact OD1-CA 3.5Å; D1104-R1106 WeakPolarHBondContact OD1-CB 3.43Å; D1104-R1106 WeakPolarHBondContact OD1-CD 3.48Å; D1104-R1106 WeakPolarHBondContact OD1-CG 3.31Å; D1104-R1106 PolarHBondContact OD1-N 3.28Å
1107	G	55.6	Low	79.6	Confident	31 Å²	31	57.1 Å²	57.1	32%	0.32	29%	0.287	S	S	.	.	S	Bend	trans	-60.1	164.8	169.7	0	0	0	0	0	113.3	I1109	G1107-I1109 PolarHBondContact O-N 3.09Å
1108	Q	65.7	Low	80.2	Confident	129 Å²	129	53.4 Å²	53.4	60%	0.603	27%	0.27	S	S	*	.			trans	-65.2	118.8	175.3	-68.3	175.9	-8.2	0	0	109.9	N961 M1093	N961-Q1108 VanDerWaalsContact CG-OE1 3.31Å; N961-Q1108 PolarHBondContact ND2-OE1 2.94Å; M1093-Q1108 VanDerWaalsContact CE-O 3.3Å; M1093-Q1108 WeakPolarHBondContact CE-O 3.46Å
1109	I	82.7	Confident	80.7	Confident	35 Å²	35	47.5 Å²	47.5	18%	0.179	24%	0.243	C	C	.	.			trans	-119.6	130.3	177.1	-63.4	173.4	0	0	0	108.2	L1102 G1107 I1111 T1114 L1119 Y1124	L1102-I1109 HydrophobicContact CD1-CD1 3.79Å; L1102-I1109 HydrophobicContact CD1-CG1 4.17Å; G1107-I1109 PolarHBondContact O-N 3.09Å; I1109-I1111 HydrophobicContact CB-CD1 3.96Å; I1109-I1111 HydrophobicContact CG2-CD1 3.76Å; I1109-I1111 PolarHBondContact O-N 3.03Å; I1109-T1114 HydrophobicContact CG2-CG2 3.83Å; I1109-T1114 VanDerWaalsContact CG2-OG1 3.31Å; I1109-T1114 WeakPolarHBondContact CG2-OG1 3.39Å; I1109-L1119 HydrophobicContact CG2-CD2 4.08Å; I1109-Y1124 WeakPolarHBondContact CG2-OH 3.27Å
1110	P	91.2	Very high	81	Confident	18 Å²	18	50.1 Å²	50.1	12%	0.117	25%	0.248	C	C	.	.			trans	-78.2	68.1	178	33.5	-36.2	0	0	0	110.5	D1072 K1112 W1113 T1114	D1072-P1110 HydrophobicContact CB-CG 4.41Å; D1072-P1110 WeakPolarHBondContact OD1-CB 3.33Å; D1072-P1110 VanDerWaalsContact OD1-CG 3.28Å; D1072-P1110 WeakPolarHBondContact OD1-CG 3.38Å; P1110-K1112 PolarHBondContact O-N 2.85Å; P1110-W1113 HydrophobicContact CB-CE3 4.33Å; P1110-W1113 PolarHBondContact O-N 3.27Å; P1110-T1114 PolarHBondContact O-N 3.45Å; P1110-T1114 VanDerWaalsContact O-N 3.16Å; P1110-T1114 PolarHBondContact O-OG1 3.08Å
1111	I	93.4	Very high	81.2	Confident	30 Å²	30	51.9 Å²	51.9	15%	0.154	26%	0.262	C	S	.	.	G	3₁₀ helix	trans	-42.3	-46.2	-165.5	-56	-66.9	0	0	0	113.7	I1109 W1113 T1114 L1119 N1153 R1157	I1109-I1111 HydrophobicContact CB-CD1 3.96Å; I1109-I1111 HydrophobicContact CG2-CD1 3.76Å; I1109-I1111 PolarHBondContact O-N 3.03Å; I1111-W1113 PolarHBondContact O-N 3.08Å; I1111-T1114 PolarHBondContact O-N 3.4Å; I1111-L1119 HydrophobicContact CB-CD2 4.49Å; I1111-L1119 HydrophobicContact CD1-CD2 3.51Å; I1111-L1119 HydrophobicContact CG2-CD1 4.36Å; I1111-L1119 HydrophobicContact CG2-CD2 4.1Å; I1111-N1153 HydrophobicContact CB-CB 4.18Å; I1111-N1153 HydrophobicContact CG1-CB 4.05Å; I1111-N1153 HydrophobicContact CG2-CB 4.3Å; I1111-N1153 WeakPolarHBondContact CG2-O 3.07Å; I1111-R1157 HydrophobicContact CG2-CB 4.36Å
1112	K	96.4	Very high	81.5	Confident	20 Å²	20	47 Å²	47	9%	0.087	24%	0.24	C	C	.	.	G	3₁₀ helix	trans	-69.4	-14.5	-176.6	-55.5	-158.2	165.3	-164.5	0	115.5	P1110 P1147 Y1148 W1151 T1156	P1110-K1112 PolarHBondContact O-N 2.85Å; K1112-P1147 VanDerWaalsContact CD-O 3.24Å; K1112-P1147 WeakPolarHBondContact CD-O 3.42Å; K1112-P1147 PolarHBondContact NZ-O 2.87Å; K1112-Y1148 HydrophobicContact CB-CD2 4.13Å; K1112-Y1148 PolarHBondContact NZ-O 3.19Å; K1112-Y1148 WeakPolarHBondContact O-CE2 3.39Å; K1112-W1151 WeakPolarHBondContact CE-O 3.28Å; K1112-W1151 PolarHBondContact NZ-O 2.93Å; K1112-T1156 HydrophobicContact CB-CG2 4.46Å; K1112-T1156 VanDerWaalsContact CE-OG1 3.32Å; K1112-T1156 WeakPolarHBondContact CE-OG1 3.42Å; K1112-T1156 HydrophobicContact CG-CG2 4.02Å
1113	W	97.3	Very high	82.2	Confident	32 Å²	32	50.8 Å²	50.8	12%	0.121	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-107.9	-7	172	-66.1	-102.1	0	0	0	112	A1074 P1110 I1111 W1131 S1132 V1135 E1139 P1147	A1074-W1113 HydrophobicContact CB-CD2 4.11Å; A1074-W1113 HydrophobicContact CB-CG 4.04Å; A1074-W1113 HydrophobicContact CB-CZ2 4.42Å; A1074-W1113 VanDerWaalsContact CB-NE1 3.32Å; P1110-W1113 HydrophobicContact CB-CE3 4.33Å; P1110-W1113 PolarHBondContact O-N 3.27Å; I1111-W1113 PolarHBondContact O-N 3.08Å; W1113-W1131 VanDerWaalsContact O-CD1 3.31Å; W1113-S1132 WeakPolarHBondContact O-CA 3.23Å; W1113-S1132 PolarHBondContact O-OG 3.48Å; W1113-S1132 VanDerWaalsContact O-OG 3.07Å; W1113-V1135 VanDerWaalsContact CD1-CG1 3.49Å; W1113-V1135 HydrophobicContact CD2-CG1 4.47Å; W1113-V1135 HydrophobicContact CG-CB 4.36Å; W1113-V1135 HydrophobicContact CG-CG1 4.05Å; W1113-E1139 WeakPolarHBondContact CZ2-OE1 3.47Å; W1113-E1139 PolarHBondContact NE1-OE2 2.93Å; W1113-P1147 HydrophobicContact CH2-CG 4.43Å; W1113-P1147 HydrophobicContact CZ2-CG 3.82Å
1114	T	95.2	Very high	83.6	Confident	3 Å²	3	45 Å²	45	2%	0.018	21%	0.212	C	C	.	.	S	Bend	trans	-89.8	137.4	-170.6	-52.8	0	0	0	0	111.8	I1109 P1110 I1111 A1118 L1119 Y1124 W1131	I1109-T1114 HydrophobicContact CG2-CG2 3.83Å; I1109-T1114 VanDerWaalsContact CG2-OG1 3.31Å; I1109-T1114 WeakPolarHBondContact CG2-OG1 3.39Å; P1110-T1114 PolarHBondContact O-N 3.45Å; P1110-T1114 VanDerWaalsContact O-N 3.16Å; P1110-T1114 PolarHBondContact O-OG1 3.08Å; I1111-T1114 PolarHBondContact O-N 3.4Å; T1114-A1118 HydrophobicContact CG2-CB 3.79Å; T1114-L1119 HydrophobicContact CG2-CD2 3.76Å; T1114-L1119 HydrophobicContact CG2-CG 3.88Å; T1114-Y1124 HydrophobicContact CG2-CE1 4.19Å; T1114-W1131 PolarHBondContact O-NE1 3.48Å
1115	A	96	Very high	85.2	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	21%	0.207	C	C	.	.			trans	-68.2	148.5	178.4	0	0	0	0	0	113.3	E1117 A1118 L1119 C1128 W1131	A1115-E1117 VanDerWaalsContact C-N 3.31Å; A1115-E1117 WeakPolarHBondContact CB-OE1 3.32Å; A1115-E1117 WeakPolarHBondContact CB-OE2 3.41Å; A1115-E1117 PolarHBondContact O-N 3.27Å; A1115-A1118 PolarHBondContact O-N 2.75Å; A1115-A1118 VanDerWaalsContact O-N 3.08Å; A1115-L1119 PolarHBondContact O-N 2.74Å; A1115-C1128 HydrophobicContact CB-CB 4.06Å; A1115-W1131 HydrophobicContact CB-CB 3.75Å; A1115-W1131 HydrophobicContact CB-CD2 4.09Å; A1115-W1131 HydrophobicContact CB-CG 3.74Å
1116	P	94.5	Very high	87.1	Confident	2 Å²	2	38.7 Å²	38.7	1%	0.013	19%	0.186	C	C	.	.	H	α-helix	trans	-62.2	-32.4	-172.5	22.7	-33.6	0	0	0	113.8	R1120 W1131 I1160	P1116-R1120 WeakPolarHBondContact O-CB 3.36Å; P1116-R1120 VanDerWaalsContact O-CG 3.28Å; P1116-R1120 WeakPolarHBondContact O-CG 3.44Å; P1116-R1120 PolarHBondContact O-N 3.12Å; P1116-R1120 PolarHBondContact O-NE 3.46Å; P1116-W1131 VanDerWaalsContact CD-CZ3 3.42Å; P1116-W1131 HydrophobicContact CG-CE3 4.39Å; P1116-W1131 HydrophobicContact CG-CH2 4.01Å; P1116-W1131 HydrophobicContact CG-CZ3 3.85Å; P1116-I1160 HydrophobicContact CB-CG2 3.97Å; P1116-I1160 HydrophobicContact CG-CG2 4.38Å
1117	E	93.8	Very high	89.3	Confident	23 Å²	23	35.9 Å²	35.9	11%	0.107	18%	0.176	C	C	.	.	H	α-helix	trans	-67.8	-38.5	175.8	70.6	-72.5	176.4	0	0	112.2	A1115 R1120 T1121 C1128 P1188 R1191	A1115-E1117 VanDerWaalsContact C-N 3.31Å; A1115-E1117 WeakPolarHBondContact CB-OE1 3.32Å; A1115-E1117 WeakPolarHBondContact CB-OE2 3.41Å; A1115-E1117 PolarHBondContact O-N 3.27Å; E1117-R1120 PolarHBondContact O-N 2.89Å; E1117-T1121 WeakPolarHBondContact O-CB 3.26Å; E1117-T1121 PolarHBondContact O-N 3.12Å; E1117-T1121 PolarHBondContact O-OG1 3.44Å; E1117-C1128 PolarHBondContact OE1-SG 3.26Å; E1117-P1188 HydrophobicContact CB-CG 4.38Å; E1117-P1188 HydrophobicContact CG-CG 3.8Å; E1117-R1191 IonicContact OE1-CZ 3.71Å; E1117-R1191 IonicContact OE1-NH1 3.1Å; E1117-R1191 PolarHBondContact OE1-NH1 3.04Å; E1117-R1191 IonicContact OE1-NH2 3.78Å; E1117-R1191 IonicContact OE2-CZ 3.59Å; E1117-R1191 IonicContact OE2-NH1 2.7Å; E1117-R1191 PolarHBondContact OE2-NH1 3.42Å; E1117-R1191 IonicContact OE2-NH2 3.62Å; E1117-R1191 PolarHBondContact OE2-NH2 2.85Å
1118	A	92.2	Very high	91.3	Very high	1 Å²	1	34.6 Å²	34.6	1%	0.008	16%	0.162	C	C	.	.	H	α-helix	trans	-70.9	-35.7	176.1	0	0	0	0	0	111.5	T1114 A1115 G1122 R1123 Y1124	T1114-A1118 HydrophobicContact CG2-CB 3.79Å; A1115-A1118 PolarHBondContact O-N 2.75Å; A1115-A1118 VanDerWaalsContact O-N 3.08Å; A1118-G1122 WeakPolarHBondContact O-CA 3.39Å; A1118-G1122 PolarHBondContact O-N 3.46Å; A1118-R1123 VanDerWaalsContact CA-O 3.32Å; A1118-R1123 WeakPolarHBondContact CA-O 3.39Å; A1118-R1123 WeakPolarHBondContact CB-O 3.33Å; A1118-Y1124 HydrophobicContact CB-CD1 4.12Å; A1118-Y1124 HydrophobicContact CB-CD2 4.4Å; A1118-Y1124 HydrophobicContact CB-CE1 3.96Å; A1118-Y1124 HydrophobicContact CB-CE2 4.19Å; A1118-Y1124 HydrophobicContact CB-CG 4.33Å
1119	L	90.4	Very high	92.8	Very high	11 Å²	11	28.4 Å²	28.4	6%	0.058	13%	0.133	C	C	.	.	H	α-helix	trans	-64.7	-40	170.8	-67.2	178	0	0	0	112.7	I1109 I1111 T1114 A1115 R1157	I1109-L1119 HydrophobicContact CG2-CD2 4.08Å; I1111-L1119 HydrophobicContact CB-CD2 4.49Å; I1111-L1119 HydrophobicContact CD1-CD2 3.51Å; I1111-L1119 HydrophobicContact CG2-CD1 4.36Å; I1111-L1119 HydrophobicContact CG2-CD2 4.1Å; T1114-L1119 HydrophobicContact CG2-CD2 3.76Å; T1114-L1119 HydrophobicContact CG2-CG 3.88Å; A1115-L1119 PolarHBondContact O-N 2.74Å; L1119-R1157 VanDerWaalsContact C-NH2 3.26Å; L1119-R1157 HydrophobicContact CD1-CB 4.39Å; L1119-R1157 HydrophobicContact CD1-CG 4.26Å; L1119-R1157 VanDerWaalsContact O-CZ 3.27Å; L1119-R1157 PolarHBondContact O-NH1 3.38Å; L1119-R1157 PolarHBondContact O-NH2 3.37Å
1120	R	89.1	Confident	93.5	Very high	130 Å²	130	26.8 Å²	26.8	49%	0.491	13%	0.125	S	C	.	.	H	α-helix	trans	-73.3	-44.5	179.7	-77.3	175.3	-74.5	140.9	-8.9	113.3	P1116 E1117 E1161	P1116-R1120 WeakPolarHBondContact O-CB 3.36Å; P1116-R1120 VanDerWaalsContact O-CG 3.28Å; P1116-R1120 WeakPolarHBondContact O-CG 3.44Å; P1116-R1120 PolarHBondContact O-N 3.12Å; P1116-R1120 PolarHBondContact O-NE 3.46Å; E1117-R1120 PolarHBondContact O-N 2.89Å; R1120-E1161 WeakPolarHBondContact CG-OE1 3.41Å
1121	T	86.4	Confident	93.9	Very high	69 Å²	69	25.9 Å²	25.9	42%	0.423	12%	0.119	S	C	.	.	H	α-helix	trans	-106.4	-31.5	-168	62	0	0	0	0	114	K1105 E1117 R1123	K1105-T1121 VanDerWaalsContact CE-O 3.28Å; K1105-T1121 WeakPolarHBondContact CE-O 3.26Å; E1117-T1121 WeakPolarHBondContact O-CB 3.26Å; E1117-T1121 PolarHBondContact O-N 3.12Å; E1117-T1121 PolarHBondContact O-OG1 3.44Å; T1121-R1123 WeakPolarHBondContact OG1-CB 3.11Å; T1121-R1123 PolarHBondContact OG1-N 3.36Å
1122	G	86	Confident	94.1	Very high	5 Å²	5	24.7 Å²	24.7	5%	0.052	11%	0.114	C	C	.	.	S	Bend	trans	86.7	1	-163.4	0	0	0	0	0	114.2	L1102 A1118 Y1124	L1102-G1122 PolarHBondContact N-O 2.72Å; A1118-G1122 WeakPolarHBondContact O-CA 3.39Å; A1118-G1122 PolarHBondContact O-N 3.46Å; G1122-Y1124 WeakPolarHBondContact O-CD2 3.47Å
1123	R	89.7	Confident	94.2	Very high	107 Å²	107	23.8 Å²	23.8	40%	0.404	11%	0.11	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	125	179	-174.1	-179.6	177	114	-12	111.1	I1099 E1101 A1118 T1121	I1099-R1123 HydrophobicContact CG2-CG 3.83Å; I1099-R1123 VanDerWaalsContact CG2-CZ 3.5Å; E1101-R1123 HydrophobicContact CG-CB 3.96Å; E1101-R1123 HydrophobicContact CG-CG 3.83Å; E1101-R1123 VanDerWaalsContact OE1-CD 3.22Å; E1101-R1123 WeakPolarHBondContact OE1-CD 3.35Å; E1101-R1123 WeakPolarHBondContact OE1-CG 3.41Å; E1101-R1123 IonicContact OE1-CZ 3.15Å; E1101-R1123 IonicContact OE1-NE 2.77Å; E1101-R1123 IonicContact OE1-NH1 2.69Å; E1101-R1123 PolarHBondContact OE1-NH1 3.21Å; A1118-R1123 VanDerWaalsContact CA-O 3.32Å; A1118-R1123 WeakPolarHBondContact CA-O 3.39Å; A1118-R1123 WeakPolarHBondContact CB-O 3.33Å; T1121-R1123 WeakPolarHBondContact OG1-CB 3.11Å; T1121-R1123 PolarHBondContact OG1-N 3.36Å
1124	Y	91.9	Very high	94.3	Very high	4 Å²	4	22.2 Å²	22.2	2%	0.016	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	146.5	177.9	-69.8	-103.2	0	0	0	110.4	I1069 R1071 I1099 Y1100 L1102 I1109 T1114 A1118 G1122 C1128	I1069-Y1124 WeakPolarHBondContact CD1-O 3.32Å; R1071-Y1124 HydrophobicContact CB-CD1 4Å; R1071-Y1124 HydrophobicContact CB-CE1 4.16Å; R1071-Y1124 HydrophobicContact CG-CD1 3.66Å; R1071-Y1124 HydrophobicContact CG-CE1 4.32Å; R1071-Y1124 HydrophobicContact CG-CG 4.07Å; R1071-Y1124 VanDerWaalsContact NE-CG 3.31Å; I1099-Y1124 WeakPolarHBondContact CA-O 3.22Å; Y1100-Y1124 HydrophobicContact CD1-CD2 4.4Å; Y1100-Y1124 PolarHBondContact N-O 3.49Å; Y1100-Y1124 PolarHBondContact O-N 2.87Å; L1102-Y1124 HydrophobicContact CD1-CE2 3.73Å; L1102-Y1124 HydrophobicContact CG-CE2 4.03Å; I1109-Y1124 WeakPolarHBondContact CG2-OH 3.27Å; T1114-Y1124 HydrophobicContact CG2-CE1 4.19Å; A1118-Y1124 HydrophobicContact CB-CD1 4.12Å; A1118-Y1124 HydrophobicContact CB-CD2 4.4Å; A1118-Y1124 HydrophobicContact CB-CE1 3.96Å; A1118-Y1124 HydrophobicContact CB-CE2 4.19Å; A1118-Y1124 HydrophobicContact CB-CG 4.33Å; G1122-Y1124 WeakPolarHBondContact O-CD2 3.47Å; Y1124-C1128 HydrophobicContact CD1-CB 4.39Å
1125	T	94.6	Very high	94.4	Very high	31 Å²	31	22.1 Å²	22.1	19%	0.19	10%	0.103	C	C	.	.			trans	-146.2	171.6	171.3	65.2	0	0	0	0	108.3	I1099 K1127 C1128	I1099-T1125 HydrophobicContact CG1-CG2 4.11Å; T1125-K1127 PolarHBondContact O-N 3.1Å; T1125-K1127 VanDerWaalsContact O-N 3.11Å; T1125-K1127 PolarHBondContact OG1-N 3.3Å; T1125-C1128 PolarHBondContact N-SG 3.06Å; T1125-C1128 WeakPolarHBondContact O-CB 3.34Å; T1125-C1128 PolarHBondContact O-N 3.37Å
1126	I	95.7	Very high	94.5	Very high	34 Å²	34	22.1 Å²	22.1	17%	0.174	10%	0.103	C	C	.	.	H	α-helix	trans	-57.4	-25.9	174.1	-164.1	65.7	0	0	0	113.2	M1060 E1064 C1128 D1129 V1130 F1194	M1060-I1126 HydrophobicContact CE-CD1 4.03Å; E1064-I1126 HydrophobicContact CB-CD1 4.09Å; E1064-I1126 HydrophobicContact CB-CG1 3.88Å; E1064-I1126 HydrophobicContact CG-CG1 3.97Å; I1126-C1128 PolarHBondContact O-N 2.97Å; I1126-D1129 HydrophobicContact CD1-CB 4.41Å; I1126-D1129 PolarHBondContact O-N 2.98Å; I1126-D1129 VanDerWaalsContact O-N 3.07Å; I1126-V1130 PolarHBondContact O-N 3.2Å; I1126-F1194 HydrophobicContact CD1-CD2 4.12Å; I1126-F1194 HydrophobicContact CD1-CE2 3.88Å; I1126-F1194 HydrophobicContact CG1-CD2 3.97Å; I1126-F1194 HydrophobicContact CG1-CE2 3.94Å
1127	K	97.4	Very high	94.7	Very high	39 Å²	39	22 Å²	22	17%	0.17	10%	0.103	C	C	.	.	H	α-helix	trans	-68.4	-18.8	174	-61.9	-62.1	-173.7	172.7	0	113.5	T1125 P1188 R1191 P1192	T1125-K1127 PolarHBondContact O-N 3.1Å; T1125-K1127 VanDerWaalsContact O-N 3.11Å; T1125-K1127 PolarHBondContact OG1-N 3.3Å; K1127-P1188 HydrophobicContact CB-CB 3.88Å; K1127-P1188 WeakPolarHBondContact CD-O 3.24Å; K1127-P1188 HydrophobicContact CG-CB 4.41Å; K1127-R1191 HydrophobicContact CD-CB 4.39Å; K1127-R1191 PolarHBondContact NZ-O 3.44Å; K1127-R1191 PolarHBondContact O-NH1 3.4Å; K1127-P1192 VanDerWaalsContact NZ-C 3.33Å; K1127-P1192 PolarHBondContact NZ-O 3.32Å
1128	C	96.9	Very high	94.9	Very high	3 Å²	3	21.8 Å²	21.8	2%	0.02	10%	0.101	C	C	.	.	H	α-helix	trans	-74.9	-37.2	169.8	-51	0	0	0	0	110.8	A1115 E1117 Y1124 T1125 I1126 W1131 S1132	A1115-C1128 HydrophobicContact CB-CB 4.06Å; E1117-C1128 PolarHBondContact OE1-SG 3.26Å; Y1124-C1128 HydrophobicContact CD1-CB 4.39Å; T1125-C1128 PolarHBondContact N-SG 3.06Å; T1125-C1128 WeakPolarHBondContact O-CB 3.34Å; T1125-C1128 PolarHBondContact O-N 3.37Å; I1126-C1128 PolarHBondContact O-N 2.97Å; C1128-W1131 WeakPolarHBondContact O-CB 3.45Å; C1128-W1131 PolarHBondContact O-N 2.91Å; C1128-S1132 PolarHBondContact O-N 3.27Å; C1128-S1132 PolarHBondContact O-OG 3.38Å; C1128-S1132 VanDerWaalsContact O-OG 3.08Å
1129	D	97.8	Very high	95.2	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-71.8	-30.1	174.7	-63.9	-40.4	0	0	0	112.4	M1060 I1069 H1070 R1071 I1126 W1131 S1132 Y1133 F1194	M1060-D1129 HydrophobicContact CE-CB 3.66Å; I1069-D1129 WeakPolarHBondContact CA-OD2 3.41Å; I1069-D1129 WeakPolarHBondContact CG2-OD2 3.36Å; H1070-D1129 PolarHBondContact N-OD2 3.3Å; R1071-D1129 WeakPolarHBondContact CA-OD1 3.35Å; R1071-D1129 PolarHBondContact N-OD1 3.41Å; I1126-D1129 HydrophobicContact CD1-CB 4.41Å; I1126-D1129 PolarHBondContact O-N 2.98Å; I1126-D1129 VanDerWaalsContact O-N 3.07Å; D1129-W1131 VanDerWaalsContact C-N 3.26Å; D1129-W1131 PolarHBondContact O-N 3.04Å; D1129-S1132 CarbonylContact O-C 3.55Å; D1129-S1132 WeakPolarHBondContact O-CB 3.39Å; D1129-S1132 PolarHBondContact O-N 2.68Å; D1129-S1132 VanDerWaalsContact O-N 3.17Å; D1129-Y1133 WeakPolarHBondContact O-CB 3.23Å; D1129-Y1133 PolarHBondContact O-N 3.11Å; D1129-F1194 HydrophobicContact CB-CE2 4.13Å; D1129-F1194 HydrophobicContact CB-CZ 4.16Å
1130	V	98.5	Very high	95.5	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-58.6	-39.5	170.5	170.7	0	0	0	0	111.2	I1126 Y1133 G1134 C1183 R1191 P1192 F1194 I1197	I1126-V1130 PolarHBondContact O-N 3.2Å; V1130-Y1133 WeakPolarHBondContact O-CB 3.39Å; V1130-Y1133 PolarHBondContact O-N 2.81Å; V1130-G1134 PolarHBondContact O-N 2.75Å; V1130-G1134 VanDerWaalsContact O-N 3.15Å; V1130-C1183 HydrophobicContact CG1-CB 4.06Å; V1130-C1183 WeakPolarHBondContact O-CB 3.15Å; V1130-R1191 HydrophobicContact CG1-CB 3.88Å; V1130-P1192 HydrophobicContact CG1-CG 4.18Å; V1130-F1194 HydrophobicContact CB-CE2 4.45Å; V1130-F1194 HydrophobicContact CB-CZ 4.29Å; V1130-F1194 HydrophobicContact CG2-CD2 3.88Å; V1130-F1194 HydrophobicContact CG2-CE1 4.26Å; V1130-F1194 HydrophobicContact CG2-CE2 3.47Å; V1130-F1194 VanDerWaalsContact CG2-CE2 3.47Å; V1130-F1194 HydrophobicContact CG2-CG 4.45Å; V1130-F1194 HydrophobicContact CG2-CZ 3.7Å; V1130-I1197 HydrophobicContact CG1-CD1 4.1Å; V1130-I1197 HydrophobicContact CG2-CD1 4.41Å
1131	W	98.4	Very high	95.8	Very high	0 Å²	0	15.3 Å²	15.3	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-65.2	-45.8	173	174.7	-71.9	0	0	0	111.6	W1113 T1114 A1115 P1116 C1128 D1129 Y1133 G1134 V1135 I1160 R1165 C1183 W1184	W1113-W1131 VanDerWaalsContact O-CD1 3.31Å; T1114-W1131 PolarHBondContact O-NE1 3.48Å; A1115-W1131 HydrophobicContact CB-CB 3.75Å; A1115-W1131 HydrophobicContact CB-CD2 4.09Å; A1115-W1131 HydrophobicContact CB-CG 3.74Å; P1116-W1131 VanDerWaalsContact CD-CZ3 3.42Å; P1116-W1131 HydrophobicContact CG-CE3 4.39Å; P1116-W1131 HydrophobicContact CG-CH2 4.01Å; P1116-W1131 HydrophobicContact CG-CZ3 3.85Å; C1128-W1131 WeakPolarHBondContact O-CB 3.45Å; C1128-W1131 PolarHBondContact O-N 2.91Å; D1129-W1131 VanDerWaalsContact C-N 3.26Å; D1129-W1131 PolarHBondContact O-N 3.04Å; W1131-Y1133 PolarHBondContact O-N 2.85Å; W1131-G1134 PolarHBondContact O-N 3.18Å; W1131-G1134 VanDerWaalsContact O-N 3.09Å; W1131-V1135 PolarHBondContact O-N 2.85Å; W1131-I1160 HydrophobicContact CH2-CG2 3.76Å; W1131-I1160 HydrophobicContact CZ2-CD1 4.21Å; W1131-I1160 HydrophobicContact CZ2-CG1 4.25Å; W1131-I1160 HydrophobicContact CZ2-CG2 3.62Å; W1131-R1165 VanDerWaalsContact CH2-CZ 3.42Å; W1131-C1183 WeakPolarHBondContact CA-O 3.44Å; W1131-W1184 AromaticContact CD2-CD1 3.61Å; W1131-W1184 HydrophobicContact CD2-CG 4.38Å; W1131-W1184 AromaticContact CE2-CD1 3.9Å; W1131-W1184 HydrophobicContact CE3-CB 4Å; W1131-W1184 AromaticContact CE3-CD1 3.93Å; W1131-W1184 HydrophobicContact CE3-CG 4.34Å; W1131-W1184 AromaticContact CG-CD1 3.84Å; W1131-W1184 HydrophobicContact CH2-CB 4.29Å; W1131-W1184 HydrophobicContact CZ3-CB 3.88Å; W1131-W1184 WeakPolarHBondContact CZ3-O 3.32Å; W1131-W1184 PolarHBondContact O-NE1 3.07Å; W1131-W1184 VanDerWaalsContact O-NE1 3.11Å
1132	S	98.4	Very high	96.2	Very high	5 Å²	5	13.7 Å²	13.7	4%	0.035	7%	0.065	C	C	.	.	H	α-helix	trans	-56.3	-39.5	174.6	-47.8	0	0	0	0	111.8	W1113 C1128 D1129 V1135 L1136	W1113-S1132 WeakPolarHBondContact O-CA 3.23Å; W1113-S1132 PolarHBondContact O-OG 3.48Å; W1113-S1132 VanDerWaalsContact O-OG 3.07Å; C1128-S1132 PolarHBondContact O-N 3.27Å; C1128-S1132 PolarHBondContact O-OG 3.38Å; C1128-S1132 VanDerWaalsContact O-OG 3.08Å; D1129-S1132 CarbonylContact O-C 3.55Å; D1129-S1132 WeakPolarHBondContact O-CB 3.39Å; D1129-S1132 PolarHBondContact O-N 2.68Å; D1129-S1132 VanDerWaalsContact O-N 3.17Å; S1132-V1135 CarbonylContact O-C 3.53Å; S1132-V1135 WeakPolarHBondContact O-CA 3.45Å; S1132-V1135 WeakPolarHBondContact O-CB 3.27Å; S1132-V1135 PolarHBondContact O-N 2.74Å; S1132-V1135 VanDerWaalsContact O-N 3.07Å; S1132-L1136 PolarHBondContact O-N 2.83Å
1133	Y	98.6	Very high	96.6	Very high	0 Å²	0	14.2 Å²	14.2	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-64.5	-37.8	176.1	178.1	-91.9	0	0	0	112.5	S1053 A1056 A1057 L1073 D1129 V1130 W1131 V1135 L1136 L1137 F1194 I1197 I1201	S1053-Y1133 PolarHBondContact O-OH 3.48Å; A1056-Y1133 HydrophobicContact CB-CD2 4.39Å; A1056-Y1133 HydrophobicContact CB-CE2 3.85Å; A1057-Y1133 HydrophobicContact CB-CE2 4.11Å; L1073-Y1133 HydrophobicContact CD2-CD2 4.33Å; D1129-Y1133 WeakPolarHBondContact O-CB 3.23Å; D1129-Y1133 PolarHBondContact O-N 3.11Å; V1130-Y1133 WeakPolarHBondContact O-CB 3.39Å; V1130-Y1133 PolarHBondContact O-N 2.81Å; W1131-Y1133 PolarHBondContact O-N 2.85Å; Y1133-V1135 VanDerWaalsContact C-N 3.25Å; Y1133-V1135 PolarHBondContact O-N 2.88Å; Y1133-L1136 HydrophobicContact CD2-CD2 4.35Å; Y1133-L1136 WeakPolarHBondContact O-CB 3.13Å; Y1133-L1136 PolarHBondContact O-N 2.8Å; Y1133-L1136 VanDerWaalsContact O-N 3.15Å; Y1133-L1137 HydrophobicContact CD1-CD1 4.24Å; Y1133-L1137 HydrophobicContact CD1-CG 4.21Å; Y1133-L1137 HydrophobicContact CE1-CD1 3.68Å; Y1133-L1137 HydrophobicContact CE1-CD2 3.99Å; Y1133-L1137 HydrophobicContact CE1-CG 3.68Å; Y1133-L1137 PolarHBondContact O-N 2.86Å; Y1133-F1194 HydrophobicContact CD1-CE1 4.38Å; Y1133-F1194 AromaticContact CD2-CE1 3.98Å; Y1133-F1194 HydrophobicContact CD2-CE1 3.98Å; Y1133-F1194 AromaticContact CG-CE1 3.74Å; Y1133-F1194 HydrophobicContact CG-CE1 3.74Å; Y1133-I1197 HydrophobicContact CD1-CD1 4.01Å; Y1133-I1197 HydrophobicContact CD1-CG2 4.15Å; Y1133-I1197 HydrophobicContact CE1-CD1 4.32Å; Y1133-I1197 HydrophobicContact CE1-CG2 3.39Å; Y1133-I1201 WeakPolarHBondContact OH-CD1 3.33Å
1134	G	98.2	Very high	96.9	Very high	0 Å²	0	9.3 Å²	9.3	0%	0	5%	0.049	C	C	.	.	H	α-helix	trans	-58.3	-38.3	169.7	0	0	0	0	0	112.4	V1130 W1131 L1137 W1138 M1180 W1184	V1130-G1134 PolarHBondContact O-N 2.75Å; V1130-G1134 VanDerWaalsContact O-N 3.15Å; W1131-G1134 PolarHBondContact O-N 3.18Å; W1131-G1134 VanDerWaalsContact O-N 3.09Å; G1134-L1137 PolarHBondContact O-N 3.46Å; G1134-W1138 PolarHBondContact O-N 3.01Å; G1134-M1180 WeakPolarHBondContact O-CG 3.38Å; G1134-W1184 WeakPolarHBondContact O-CZ2 3.1Å
1135	V	98.4	Very high	97	Very high	0 Å²	0	11.6 Å²	11.6	0%	0	6%	0.061	C	C	.	.	H	α-helix	trans	-71.7	-35.4	174.9	-171.6	0	0	0	0	111.7	W1113 W1131 S1132 Y1133 W1138 E1139 P1147 L1166 W1184	W1113-V1135 VanDerWaalsContact CD1-CG1 3.49Å; W1113-V1135 HydrophobicContact CD2-CG1 4.47Å; W1113-V1135 HydrophobicContact CG-CB 4.36Å; W1113-V1135 HydrophobicContact CG-CG1 4.05Å; W1131-V1135 PolarHBondContact O-N 2.85Å; S1132-V1135 CarbonylContact O-C 3.53Å; S1132-V1135 WeakPolarHBondContact O-CA 3.45Å; S1132-V1135 WeakPolarHBondContact O-CB 3.27Å; S1132-V1135 PolarHBondContact O-N 2.74Å; S1132-V1135 VanDerWaalsContact O-N 3.07Å; Y1133-V1135 VanDerWaalsContact C-N 3.25Å; Y1133-V1135 PolarHBondContact O-N 2.88Å; V1135-W1138 WeakPolarHBondContact O-CB 3.29Å; V1135-W1138 PolarHBondContact O-N 3.15Å; V1135-E1139 PolarHBondContact O-N 2.86Å; V1135-P1147 HydrophobicContact CG1-CB 3.88Å; V1135-P1147 HydrophobicContact CG1-CG 3.55Å; V1135-L1166 HydrophobicContact CG1-CD1 4.39Å; V1135-W1184 HydrophobicContact CG2-CZ2 4Å
1136	L	98.5	Very high	97	Very high	0 Å²	0	12.3 Å²	12.3	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-62.6	-41.7	172	176.7	61	0	0	0	112.3	L1033 A1056 L1073 A1075 S1132 Y1133 W1138 E1139 I1140	L1033-L1136 HydrophobicContact CD2-CD1 3.99Å; A1056-L1136 HydrophobicContact CB-CD2 3.72Å; L1073-L1136 HydrophobicContact CD1-CD2 4Å; L1073-L1136 HydrophobicContact CD2-CD2 4.43Å; L1073-L1136 HydrophobicContact CG-CD2 4.17Å; A1075-L1136 HydrophobicContact CB-CD1 3.87Å; S1132-L1136 PolarHBondContact O-N 2.83Å; Y1133-L1136 HydrophobicContact CD2-CD2 4.35Å; Y1133-L1136 WeakPolarHBondContact O-CB 3.13Å; Y1133-L1136 PolarHBondContact O-N 2.8Å; Y1133-L1136 VanDerWaalsContact O-N 3.15Å; L1136-W1138 VanDerWaalsContact C-N 3.28Å; L1136-W1138 PolarHBondContact O-N 3.35Å; L1136-E1139 PolarHBondContact O-N 2.81Å; L1136-I1140 HydrophobicContact CD1-CD1 4.12Å; L1136-I1140 HydrophobicContact CD1-CG1 4.27Å; L1136-I1140 HydrophobicContact CG-CD1 4.01Å; L1136-I1140 VanDerWaalsContact O-CG1 3.3Å; L1136-I1140 WeakPolarHBondContact O-CG1 3.38Å; L1136-I1140 PolarHBondContact O-N 2.8Å
1137	L	98.1	Very high	97.1	Very high	1 Å²	1	10.7 Å²	10.7	1%	0.005	6%	0.057	C	C	.	.	H	α-helix	trans	-57.4	-42.8	171.7	-72.8	-179	0	0	0	111.4	S1053 Y1133 G1134 I1140 F1141 M1172 L1176 M1180	S1053-L1137 WeakPolarHBondContact OG-CD2 3.48Å; Y1133-L1137 HydrophobicContact CD1-CD1 4.24Å; Y1133-L1137 HydrophobicContact CD1-CG 4.21Å; Y1133-L1137 HydrophobicContact CE1-CD1 3.68Å; Y1133-L1137 HydrophobicContact CE1-CD2 3.99Å; Y1133-L1137 HydrophobicContact CE1-CG 3.68Å; Y1133-L1137 PolarHBondContact O-N 2.86Å; G1134-L1137 PolarHBondContact O-N 3.46Å; L1137-I1140 PolarHBondContact O-N 2.91Å; L1137-F1141 WeakPolarHBondContact O-CD2 3.24Å; L1137-F1141 PolarHBondContact O-N 3.49Å; L1137-M1172 HydrophobicContact CB-CE 4.09Å; L1137-L1176 HydrophobicContact CD1-CD1 3.87Å; L1137-L1176 HydrophobicContact CD2-CD1 4.12Å; L1137-M1180 HydrophobicContact CB-CG 4.2Å; L1137-M1180 HydrophobicContact CB-SD 4.33Å; L1137-M1180 HydrophobicContact CD1-CB 3.87Å; L1137-M1180 HydrophobicContact CD1-CG 4.14Å
1138	W	97.9	Very high	97	Very high	18 Å²	18	9.3 Å²	9.3	7%	0.068	5%	0.051	C	C	.	.	H	α-helix	trans	-65.5	-43	176.6	-169.3	92.6	0	0	0	112.2	G1134 V1135 L1136 I1140 F1141 T1142 D1145 P1147 L1166 P1167 M1180 W1184	G1134-W1138 PolarHBondContact O-N 3.01Å; V1135-W1138 WeakPolarHBondContact O-CB 3.29Å; V1135-W1138 PolarHBondContact O-N 3.15Å; L1136-W1138 VanDerWaalsContact C-N 3.28Å; L1136-W1138 PolarHBondContact O-N 3.35Å; W1138-I1140 PolarHBondContact O-N 3.5Å; W1138-F1141 PolarHBondContact O-N 3.22Å; W1138-T1142 HydrophobicContact CD2-CG2 3.88Å; W1138-T1142 HydrophobicContact CE3-CG2 4.1Å; W1138-T1142 HydrophobicContact CH2-CG2 3.95Å; W1138-T1142 HydrophobicContact CZ2-CG2 3.72Å; W1138-T1142 HydrophobicContact CZ3-CG2 4.12Å; W1138-T1142 WeakPolarHBondContact O-CB 3.38Å; W1138-T1142 WeakPolarHBondContact O-CG2 3.35Å; W1138-T1142 PolarHBondContact O-N 3.37Å; W1138-T1142 PolarHBondContact O-OG1 3.45Å; W1138-D1145 HydrophobicContact CH2-CB 3.91Å; W1138-D1145 HydrophobicContact CZ3-CB 4Å; W1138-P1147 HydrophobicContact CE3-CB 4.48Å; W1138-P1147 HydrophobicContact CE3-CG 4.05Å; W1138-P1147 HydrophobicContact CZ3-CB 4.41Å; W1138-P1147 HydrophobicContact CZ3-CG 4.08Å; W1138-L1166 HydrophobicContact CB-CD1 4.17Å; W1138-L1166 HydrophobicContact CD2-CB 4.44Å; W1138-L1166 HydrophobicContact CD2-CD1 3.81Å; W1138-L1166 HydrophobicContact CE3-CD1 4.23Å; W1138-L1166 HydrophobicContact CG-CB 4.18Å; W1138-L1166 HydrophobicContact CG-CD1 3.77Å; W1138-L1166 HydrophobicContact CZ2-CD2 4.45Å; W1138-P1167 PolarHBondContact NE1-O 3.15Å; W1138-M1180 HydrophobicContact CB-SD 4.09Å; W1138-W1184 HydrophobicContact CB-CH2 4.26Å; W1138-W1184 HydrophobicContact CB-CZ2 4.46Å
1139	E	97.8	Very high	96.8	Very high	2 Å²	2	15.9 Å²	15.9	1%	0.009	8%	0.075	C	C	.	.	H	α-helix	trans	-59.9	-43.4	173.6	-73.2	-174.8	104.2	0	0	111.8	A1075 W1113 V1135 L1136 T1142 F1143 G1144 P1147	A1075-E1139 HydrophobicContact CB-CB 3.88Å; A1075-E1139 HydrophobicContact CB-CG 4.32Å; A1075-E1139 WeakPolarHBondContact CB-OE2 3.04Å; A1075-E1139 PolarHBondContact N-OE2 3.14Å; W1113-E1139 WeakPolarHBondContact CZ2-OE1 3.47Å; W1113-E1139 PolarHBondContact NE1-OE2 2.93Å; V1135-E1139 PolarHBondContact O-N 2.86Å; L1136-E1139 PolarHBondContact O-N 2.81Å; E1139-T1142 PolarHBondContact O-N 3.02Å; E1139-T1142 PolarHBondContact O-OG1 3.06Å; E1139-F1143 PolarHBondContact O-N 2.68Å; E1139-G1144 WeakPolarHBondContact O-CA 3.34Å; E1139-G1144 PolarHBondContact O-N 3.26Å; E1139-P1147 HydrophobicContact CG-CG 3.97Å
1140	I	96.9	Very high	96.4	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-60.7	-51.5	178.3	-71.6	167	0	0	0	110.9	L1033 L1037 L1049 M1052 L1136 L1137 W1138 T1142 F1143	L1033-I1140 HydrophobicContact CD2-CD1 4.28Å; L1033-I1140 HydrophobicContact CD2-CG1 3.93Å; L1037-I1140 HydrophobicContact CD1-CG1 4.4Å; L1049-I1140 HydrophobicContact CB-CG2 3.82Å; L1049-I1140 HydrophobicContact CD2-CG2 3.93Å; L1049-I1140 HydrophobicContact CG-CG2 4.4Å; M1052-I1140 HydrophobicContact CB-CD1 4.28Å; L1136-I1140 HydrophobicContact CD1-CD1 4.12Å; L1136-I1140 HydrophobicContact CD1-CG1 4.27Å; L1136-I1140 HydrophobicContact CG-CD1 4.01Å; L1136-I1140 VanDerWaalsContact O-CG1 3.3Å; L1136-I1140 WeakPolarHBondContact O-CG1 3.38Å; L1136-I1140 PolarHBondContact O-N 2.8Å; L1137-I1140 PolarHBondContact O-N 2.91Å; W1138-I1140 PolarHBondContact O-N 3.5Å; I1140-T1142 VanDerWaalsContact C-N 3.3Å; I1140-T1142 PolarHBondContact O-N 2.8Å; I1140-F1143 PolarHBondContact O-N 3.3Å
1141	F	96.2	Very high	96.1	Very high	4 Å²	4	25.9 Å²	25.9	2%	0.018	12%	0.124	C	C	.	.	H	α-helix	trans	-80.8	-3.8	-175.4	-80.4	-94.8	0	0	0	114.9	V1046 L1049 L1050 L1137 W1138 P1169 L1171 M1172 L1176	V1046-F1141 HydrophobicContact CG1-CE1 4.18Å; L1049-F1141 HydrophobicContact CB-CE1 4.15Å; L1049-F1141 HydrophobicContact CB-CE2 4.07Å; L1049-F1141 HydrophobicContact CB-CZ 3.83Å; L1049-F1141 HydrophobicContact CD1-CD1 4.11Å; L1049-F1141 HydrophobicContact CD1-CE1 4.18Å; L1050-F1141 HydrophobicContact CD2-CZ 4.03Å; L1050-F1141 HydrophobicContact CG-CZ 4.3Å; L1137-F1141 WeakPolarHBondContact O-CD2 3.24Å; L1137-F1141 PolarHBondContact O-N 3.49Å; W1138-F1141 PolarHBondContact O-N 3.22Å; F1141-P1169 HydrophobicContact CB-CB 4.07Å; F1141-P1169 HydrophobicContact CB-CG 3.89Å; F1141-P1169 WeakPolarHBondContact O-CB 3.16Å; F1141-L1171 HydrophobicContact CD1-CB 4.33Å; F1141-L1171 WeakPolarHBondContact CE1-O 3.15Å; F1141-M1172 HydrophobicContact CB-CB 4.38Å; F1141-M1172 HydrophobicContact CB-CE 3.84Å; F1141-M1172 HydrophobicContact CD1-CB 3.88Å; F1141-M1172 HydrophobicContact CD1-CG 4.41Å; F1141-M1172 HydrophobicContact CD2-CE 3.7Å; F1141-M1172 HydrophobicContact CE1-CB 4.41Å; F1141-M1172 HydrophobicContact CE2-CE 4.48Å; F1141-M1172 HydrophobicContact CG-CB 4.13Å; F1141-M1172 HydrophobicContact CG-CE 3.8Å; F1141-M1172 HydrophobicContact CG-CG 4.44Å; F1141-L1176 HydrophobicContact CD2-CD2 4.26Å; F1141-L1176 HydrophobicContact CE1-CD2 4.48Å; F1141-L1176 HydrophobicContact CE2-CD2 3.42Å; F1141-L1176 VanDerWaalsContact CE2-CD2 3.42Å; F1141-L1176 HydrophobicContact CZ-CD2 3.55Å
1142	T	94.9	Very high	95.9	Very high	34 Å²	34	28.7 Å²	28.7	21%	0.209	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104	7.7	167.2	56.4	0	0	0	0	113.5	W1138 E1139 I1140 G1144 D1145 P1169	W1138-T1142 HydrophobicContact CD2-CG2 3.88Å; W1138-T1142 HydrophobicContact CE3-CG2 4.1Å; W1138-T1142 HydrophobicContact CH2-CG2 3.95Å; W1138-T1142 HydrophobicContact CZ2-CG2 3.72Å; W1138-T1142 HydrophobicContact CZ3-CG2 4.12Å; W1138-T1142 WeakPolarHBondContact O-CB 3.38Å; W1138-T1142 WeakPolarHBondContact O-CG2 3.35Å; W1138-T1142 PolarHBondContact O-N 3.37Å; W1138-T1142 PolarHBondContact O-OG1 3.45Å; E1139-T1142 PolarHBondContact O-N 3.02Å; E1139-T1142 PolarHBondContact O-OG1 3.06Å; I1140-T1142 VanDerWaalsContact C-N 3.3Å; I1140-T1142 PolarHBondContact O-N 2.8Å; T1142-G1144 PolarHBondContact O-N 3.27Å; T1142-D1145 HydrophobicContact CG2-CB 4.43Å; T1142-D1145 PolarHBondContact O-N 2.9Å; T1142-D1145 PolarHBondContact OG1-N 3.38Å; T1142-P1169 HydrophobicContact CG2-CB 4.15Å; T1142-P1169 HydrophobicContact CG2-CG 3.52Å
1143	F	95.2	Very high	95.6	Very high	17 Å²	17	32.6 Å²	32.6	8%	0.075	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.9	36.1	-174.6	-49.9	-78.1	0	0	0	113.6	L1037 R1038 K1041 N1042 L1044 L1049 E1139 I1140 L1171	L1037-F1143 CarbonylContact C-O 3.46Å; R1038-F1143 PolarHBondContact N-O 2.92Å; K1041-F1143 WeakPolarHBondContact O-CD1 3.17Å; K1041-F1143 WeakPolarHBondContact O-CE1 3.46Å; N1042-F1143 HydrophobicContact CB-CD2 4.36Å; N1042-F1143 HydrophobicContact CB-CE2 3.9Å; N1042-F1143 HydrophobicContact CB-CZ 4.16Å; N1042-F1143 WeakPolarHBondContact OD1-CD2 3.32Å; L1044-F1143 HydrophobicContact CB-CE1 4.25Å; L1049-F1143 HydrophobicContact CD1-CE1 3.83Å; L1049-F1143 HydrophobicContact CD1-CZ 4.05Å; L1049-F1143 HydrophobicContact CD2-CD1 4.44Å; L1049-F1143 HydrophobicContact CD2-CE1 4.09Å; L1049-F1143 HydrophobicContact CG-CE1 4.49Å; E1139-F1143 PolarHBondContact O-N 2.68Å; I1140-F1143 PolarHBondContact O-N 3.3Å; F1143-L1171 HydrophobicContact CE2-CD1 3.52Å; F1143-L1171 HydrophobicContact CZ-CD1 3.48Å; F1143-L1171 VanDerWaalsContact CZ-CD1 3.48Å
1144	G	94.6	Very high	95.3	Very high	3 Å²	3	38 Å²	38	3%	0.031	19%	0.189	C	C	.	.	S	Bend	trans	83.5	33.8	176.9	0	0	0	0	0	114.2	R1038 E1139 T1142	R1038-G1144 PolarHBondContact NE-O 3.1Å; R1038-G1144 PolarHBondContact NH2-O 2.71Å; E1139-G1144 WeakPolarHBondContact O-CA 3.34Å; E1139-G1144 PolarHBondContact O-N 3.26Å; T1142-G1144 PolarHBondContact O-N 3.27Å
1145	D	94.3	Very high	95.1	Very high	53 Å²	53	42.5 Å²	42.5	28%	0.283	21%	0.21	S	C	.	.	P	Polyproline II helix	trans	-63.2	168.5	167.5	-165.8	22.4	0	0	0	111	W1138 T1142 P1147 R1149	W1138-D1145 HydrophobicContact CH2-CB 3.91Å; W1138-D1145 HydrophobicContact CZ3-CB 4Å; T1142-D1145 HydrophobicContact CG2-CB 4.43Å; T1142-D1145 PolarHBondContact O-N 2.9Å; T1142-D1145 PolarHBondContact OG1-N 3.38Å; D1145-P1147 WeakPolarHBondContact O-CD 3.47Å; D1145-R1149 IonicContact OD1-CZ 3.08Å; D1145-R1149 IonicContact OD1-NE 3.58Å; D1145-R1149 PolarHBondContact OD1-NE 3.01Å; D1145-R1149 IonicContact OD1-NH2 3.07Å; D1145-R1149 PolarHBondContact OD1-NH2 2.97Å; D1145-R1149 IonicContact OD2-NE 3.32Å
1146	V	94.9	Very high	94.9	Very high	45 Å²	45	42.5 Å²	42.5	27%	0.273	21%	0.21	S	C	.	.	P	Polyproline II helix	trans	-90.2	116.6	-178.9	176.1	0	0	0	0	109.4	Y1148 R1149	V1146-Y1148 PolarHBondContact O-N 2.74Å; V1146-R1149 HydrophobicContact CB-CB 4.36Å; V1146-R1149 WeakPolarHBondContact O-CB 3.34Å; V1146-R1149 PolarHBondContact O-N 2.98Å
1147	P	96.7	Very high	94.7	Very high	1 Å²	1	45.5 Å²	45.5	1%	0.006	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.2	137.7	173.6	-28.7	36.8	0	0	0	111.4	K1112 W1113 V1135 W1138 E1139 D1145 R1149 L1166	K1112-P1147 VanDerWaalsContact CD-O 3.24Å; K1112-P1147 WeakPolarHBondContact CD-O 3.42Å; K1112-P1147 PolarHBondContact NZ-O 2.87Å; W1113-P1147 HydrophobicContact CH2-CG 4.43Å; W1113-P1147 HydrophobicContact CZ2-CG 3.82Å; V1135-P1147 HydrophobicContact CG1-CB 3.88Å; V1135-P1147 HydrophobicContact CG1-CG 3.55Å; W1138-P1147 HydrophobicContact CE3-CB 4.48Å; W1138-P1147 HydrophobicContact CE3-CG 4.05Å; W1138-P1147 HydrophobicContact CZ3-CB 4.41Å; W1138-P1147 HydrophobicContact CZ3-CG 4.08Å; E1139-P1147 HydrophobicContact CG-CG 3.97Å; D1145-P1147 WeakPolarHBondContact O-CD 3.47Å; P1147-R1149 PolarHBondContact O-N 3.26Å; P1147-R1149 VanDerWaalsContact O-N 3.14Å; P1147-L1166 HydrophobicContact CB-CD1 4.16Å
1148	Y	95.7	Very high	94.5	Very high	9 Å²	9	49 Å²	49	4%	0.035	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	50.6	40.2	178.7	-48.7	-83	0	0	0	112.6	K1112 V1146 N1150 W1151 T1156 I1160 Y1164 L1166	K1112-Y1148 HydrophobicContact CB-CD2 4.13Å; K1112-Y1148 PolarHBondContact NZ-O 3.19Å; K1112-Y1148 WeakPolarHBondContact O-CE2 3.39Å; V1146-Y1148 PolarHBondContact O-N 2.74Å; Y1148-N1150 PolarHBondContact O-N 3.27Å; Y1148-W1151 AromaticContact CD1-CE3 3.84Å; Y1148-W1151 HydrophobicContact CD1-CE3 3.84Å; Y1148-W1151 AromaticContact CD1-CZ3 3.74Å; Y1148-W1151 HydrophobicContact CD1-CZ3 3.74Å; Y1148-W1151 HydrophobicContact CE1-CZ3 4.45Å; Y1148-W1151 HydrophobicContact CG-CE3 4.39Å; Y1148-W1151 PolarHBondContact O-N 3.36Å; Y1148-T1156 HydrophobicContact CD1-CG2 3.99Å; Y1148-T1156 HydrophobicContact CD2-CG2 3.47Å; Y1148-T1156 VanDerWaalsContact CD2-CG2 3.47Å; Y1148-T1156 HydrophobicContact CE1-CG2 4.47Å; Y1148-T1156 HydrophobicContact CE2-CG2 4.03Å; Y1148-T1156 HydrophobicContact CG-CG2 3.44Å; Y1148-T1156 VanDerWaalsContact CG-CG2 3.44Å; Y1148-I1160 HydrophobicContact CE1-CD1 4.43Å; Y1148-I1160 HydrophobicContact CE1-CG1 4.2Å; Y1148-I1160 HydrophobicContact CE2-CD1 4.09Å; Y1148-Y1164 HydrophobicContact CD1-CD1 4.34Å; Y1148-Y1164 HydrophobicContact CD1-CE1 4.08Å; Y1148-Y1164 AromaticContact CE1-CD1 3.99Å; Y1148-Y1164 HydrophobicContact CE1-CD1 3.99Å; Y1148-Y1164 AromaticContact CE1-CE1 3.97Å; Y1148-Y1164 HydrophobicContact CE1-CE1 3.97Å; Y1148-L1166 HydrophobicContact CD1-CD2 3.55Å; Y1148-L1166 HydrophobicContact CD1-CG 4.24Å; Y1148-L1166 HydrophobicContact CD2-CD1 4.48Å; Y1148-L1166 HydrophobicContact CD2-CD2 3.98Å; Y1148-L1166 HydrophobicContact CD2-CG 4.46Å; Y1148-L1166 HydrophobicContact CE1-CD2 3.56Å; Y1148-L1166 HydrophobicContact CE1-CG 3.72Å; Y1148-L1166 HydrophobicContact CE2-CD1 3.92Å; Y1148-L1166 HydrophobicContact CE2-CD2 3.98Å; Y1148-L1166 HydrophobicContact CE2-CG 3.95Å; Y1148-L1166 HydrophobicContact CG-CD2 3.78Å
1149	R	92.7	Very high	94.3	Very high	142 Å²	142	51 Å²	51	54%	0.536	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-44.7	-36.5	-171.4	176.6	172.6	-79.8	-79.4	9.3	115	D1145 V1146 P1147	D1145-R1149 IonicContact OD1-CZ 3.08Å; D1145-R1149 IonicContact OD1-NE 3.58Å; D1145-R1149 PolarHBondContact OD1-NE 3.01Å; D1145-R1149 IonicContact OD1-NH2 3.07Å; D1145-R1149 PolarHBondContact OD1-NH2 2.97Å; D1145-R1149 IonicContact OD2-NE 3.32Å; V1146-R1149 HydrophobicContact CB-CB 4.36Å; V1146-R1149 WeakPolarHBondContact O-CB 3.34Å; V1146-R1149 PolarHBondContact O-N 2.98Å; P1147-R1149 PolarHBondContact O-N 3.26Å; P1147-R1149 VanDerWaalsContact O-N 3.14Å
1150	N	90.2	Very high	94.1	Very high	141 Å²	141	50.9 Å²	50.9	75%	0.754	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.9	-0.1	-172.5	-60.7	-22.4	0	0	0	114.3	Y1148	Y1148-N1150 PolarHBondContact O-N 3.27Å
1151	W	92.6	Very high	93.8	Very high	68 Å²	68	54.9 Å²	54.9	26%	0.258	27%	0.269	S	S	.	.	S	Bend	trans	-123.9	145.2	-173.8	-64	-31	0	0	0	113	K1112 Y1148 Q1155 M1159 Y1164	K1112-W1151 WeakPolarHBondContact CE-O 3.28Å; K1112-W1151 PolarHBondContact NZ-O 2.93Å; Y1148-W1151 AromaticContact CD1-CE3 3.84Å; Y1148-W1151 HydrophobicContact CD1-CE3 3.84Å; Y1148-W1151 AromaticContact CD1-CZ3 3.74Å; Y1148-W1151 HydrophobicContact CD1-CZ3 3.74Å; Y1148-W1151 HydrophobicContact CE1-CZ3 4.45Å; Y1148-W1151 HydrophobicContact CG-CE3 4.39Å; Y1148-W1151 PolarHBondContact O-N 3.36Å; W1151-Q1155 HydrophobicContact CB-CB 3.77Å; W1151-Q1155 HydrophobicContact CG-CB 4.14Å; W1151-M1159 HydrophobicContact CD2-CG 3.97Å; W1151-M1159 HydrophobicContact CE3-CB 3.89Å; W1151-M1159 HydrophobicContact CE3-CG 3.8Å; W1151-M1159 HydrophobicContact CH2-CB 3.92Å; W1151-M1159 HydrophobicContact CH2-CE 3.8Å; W1151-M1159 HydrophobicContact CH2-CG 3.7Å; W1151-M1159 HydrophobicContact CH2-SD 4.34Å; W1151-M1159 HydrophobicContact CZ2-CE 4.07Å; W1151-M1159 HydrophobicContact CZ2-CG 3.85Å; W1151-M1159 HydrophobicContact CZ2-SD 4.25Å; W1151-M1159 HydrophobicContact CZ3-CB 3.52Å; W1151-M1159 HydrophobicContact CZ3-CG 3.65Å; W1151-Y1164 AromaticContact CH2-CD1 3.5Å; W1151-Y1164 HydrophobicContact CH2-CD1 3.5Å; W1151-Y1164 HydrophobicContact CH2-CD2 4.01Å; W1151-Y1164 AromaticContact CH2-CE1 3.43Å; W1151-Y1164 HydrophobicContact CH2-CE1 3.43Å; W1151-Y1164 VanDerWaalsContact CH2-CE1 3.43Å; W1151-Y1164 AromaticContact CH2-CE2 3.94Å; W1151-Y1164 HydrophobicContact CH2-CE2 3.94Å; W1151-Y1164 AromaticContact CH2-CG 3.79Å; W1151-Y1164 HydrophobicContact CH2-CG 3.79Å; W1151-Y1164 AromaticContact CH2-CZ 3.66Å; W1151-Y1164 AromaticContact CZ3-CD1 3.4Å; W1151-Y1164 HydrophobicContact CZ3-CD1 3.4Å; W1151-Y1164 AromaticContact CZ3-CE1 3.41Å; W1151-Y1164 HydrophobicContact CZ3-CE1 3.41Å; W1151-Y1164 VanDerWaalsContact CZ3-CE1 3.41Å; W1151-Y1164 HydrophobicContact CZ3-CG 4.09Å
1152	S	93.3	Very high	93.6	Very high	59 Å²	59	58.5 Å²	58.5	41%	0.413	30%	0.295	S	S	.	.			trans	-65.5	171.9	166.7	78.8	0	0	0	0	111.2	Q1154 Q1155 T1156	S1152-Q1154 VanDerWaalsContact C-N 3.34Å; S1152-Q1154 PolarHBondContact O-N 3.4Å; S1152-Q1154 PolarHBondContact OG-N 3.27Å; S1152-Q1155 PolarHBondContact O-N 3.48Å; S1152-Q1155 WeakPolarHBondContact OG-CG 3.04Å; S1152-Q1155 PolarHBondContact OG-N 3.21Å; S1152-Q1155 PolarHBondContact OG-OE1 3.22Å; S1152-T1156 VanDerWaalsContact O-CB 3.31Å; S1152-T1156 WeakPolarHBondContact O-CB 3.44Å; S1152-T1156 PolarHBondContact O-N 3.28Å; S1152-T1156 PolarHBondContact O-OG1 3.38Å
1153	N	92.2	Very high	93.5	Very high	88 Å²	88	58.8 Å²	58.8	47%	0.471	31%	0.305	S	S	.	.	H	α-helix	trans	-61.7	-41.2	175.4	-81.7	2.7	0	0	0	112.3	I1111 T1156 R1157	I1111-N1153 HydrophobicContact CB-CB 4.18Å; I1111-N1153 HydrophobicContact CG1-CB 4.05Å; I1111-N1153 HydrophobicContact CG2-CB 4.3Å; I1111-N1153 WeakPolarHBondContact CG2-O 3.07Å; N1153-T1156 PolarHBondContact O-N 3.34Å; N1153-R1157 PolarHBondContact O-N 2.62Å
1154	Q	91.7	Very high	93.5	Very high	113 Å²	113	62.1 Å²	62.1	53%	0.528	32%	0.317	S	S	.	.	H	α-helix	trans	-64.4	-52	176.1	-173.2	59.3	41	0	0	110.9	S1152 T1156 R1157 D1158	S1152-Q1154 VanDerWaalsContact C-N 3.34Å; S1152-Q1154 PolarHBondContact O-N 3.4Å; S1152-Q1154 PolarHBondContact OG-N 3.27Å; Q1154-T1156 PolarHBondContact O-N 2.78Å; Q1154-R1157 WeakPolarHBondContact O-CA 3.1Å; Q1154-R1157 VanDerWaalsContact O-CB 3.29Å; Q1154-R1157 WeakPolarHBondContact O-CB 3.44Å; Q1154-R1157 PolarHBondContact O-N 3.16Å; Q1154-D1158 PolarHBondContact NE2-OD1 2.81Å; Q1154-D1158 PolarHBondContact O-N 3.36Å; Q1154-D1158 VanDerWaalsContact O-OD2 3.11Å
1155	Q	95.2	Very high	93.5	Very high	95 Å²	95	64 Å²	64	44%	0.444	32%	0.324	S	S	.	.	H	α-helix	trans	-57.7	-35.4	176.9	-70.9	170.7	-32.6	0	0	112.6	W1151 S1152 D1158 M1159	W1151-Q1155 HydrophobicContact CB-CB 3.77Å; W1151-Q1155 HydrophobicContact CG-CB 4.14Å; S1152-Q1155 PolarHBondContact O-N 3.48Å; S1152-Q1155 WeakPolarHBondContact OG-CG 3.04Å; S1152-Q1155 PolarHBondContact OG-N 3.21Å; S1152-Q1155 PolarHBondContact OG-OE1 3.22Å; Q1155-D1158 WeakPolarHBondContact CA-OD2 3.4Å; Q1155-D1158 PolarHBondContact O-N 3.26Å; Q1155-M1159 WeakPolarHBondContact O-CB 3.36Å; Q1155-M1159 WeakPolarHBondContact O-CG 3.13Å; Q1155-M1159 PolarHBondContact O-N 3.45Å
1156	T	94.5	Very high	93.6	Very high	0 Å²	0	61.9 Å²	61.9	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-66.8	-41.8	176	-56.4	0	0	0	0	111.3	K1112 Y1148 S1152 N1153 Q1154 I1160	K1112-T1156 HydrophobicContact CB-CG2 4.46Å; K1112-T1156 VanDerWaalsContact CE-OG1 3.32Å; K1112-T1156 WeakPolarHBondContact CE-OG1 3.42Å; K1112-T1156 HydrophobicContact CG-CG2 4.02Å; Y1148-T1156 HydrophobicContact CD1-CG2 3.99Å; Y1148-T1156 HydrophobicContact CD2-CG2 3.47Å; Y1148-T1156 VanDerWaalsContact CD2-CG2 3.47Å; Y1148-T1156 HydrophobicContact CE1-CG2 4.47Å; Y1148-T1156 HydrophobicContact CE2-CG2 4.03Å; Y1148-T1156 HydrophobicContact CG-CG2 3.44Å; Y1148-T1156 VanDerWaalsContact CG-CG2 3.44Å; S1152-T1156 VanDerWaalsContact O-CB 3.31Å; S1152-T1156 WeakPolarHBondContact O-CB 3.44Å; S1152-T1156 PolarHBondContact O-N 3.28Å; S1152-T1156 PolarHBondContact O-OG1 3.38Å; N1153-T1156 PolarHBondContact O-N 3.34Å; Q1154-T1156 PolarHBondContact O-N 2.78Å; T1156-I1160 HydrophobicContact CG2-CD1 3.75Å; T1156-I1160 HydrophobicContact CG2-CG1 4.44Å; T1156-I1160 WeakPolarHBondContact O-CB 3.41Å; T1156-I1160 WeakPolarHBondContact O-CD1 3.42Å; T1156-I1160 VanDerWaalsContact O-CG1 3.22Å; T1156-I1160 WeakPolarHBondContact O-CG1 3.13Å; T1156-I1160 PolarHBondContact O-N 2.93Å
1157	R	92.9	Very high	93.5	Very high	62 Å²	62	63.9 Å²	63.9	23%	0.234	33%	0.326	C	S	.	.	H	α-helix	trans	-59	-51.9	171.7	173.5	-168.7	-178.7	114.8	26.6	110.7	I1111 L1119 N1153 Q1154 M1159 I1160 E1161	I1111-R1157 HydrophobicContact CG2-CB 4.36Å; L1119-R1157 VanDerWaalsContact C-NH2 3.26Å; L1119-R1157 HydrophobicContact CD1-CB 4.39Å; L1119-R1157 HydrophobicContact CD1-CG 4.26Å; L1119-R1157 VanDerWaalsContact O-CZ 3.27Å; L1119-R1157 PolarHBondContact O-NH1 3.38Å; L1119-R1157 PolarHBondContact O-NH2 3.37Å; N1153-R1157 PolarHBondContact O-N 2.62Å; Q1154-R1157 WeakPolarHBondContact O-CA 3.1Å; Q1154-R1157 VanDerWaalsContact O-CB 3.29Å; Q1154-R1157 WeakPolarHBondContact O-CB 3.44Å; Q1154-R1157 PolarHBondContact O-N 3.16Å; R1157-M1159 VanDerWaalsContact C-N 3.31Å; R1157-M1159 PolarHBondContact O-N 2.93Å; R1157-I1160 PolarHBondContact O-N 2.88Å; R1157-I1160 VanDerWaalsContact O-N 3.17Å; R1157-E1161 HydrophobicContact CG-CG 4.44Å; R1157-E1161 IonicContact CZ-OE1 3.61Å; R1157-E1161 IonicContact NE-OE1 3.64Å; R1157-E1161 PolarHBondContact NE-OE1 3.02Å; R1157-E1161 IonicContact NH2-OE1 3.49Å; R1157-E1161 PolarHBondContact NH2-OE1 2.8Å; R1157-E1161 WeakPolarHBondContact O-CB 3.13Å; R1157-E1161 WeakPolarHBondContact O-CG 2.99Å; R1157-E1161 PolarHBondContact O-N 2.79Å
1158	D	93.4	Very high	93.4	Very high	74 Å²	74	64.5 Å²	64.5	40%	0.396	33%	0.331	S	S	.	.	H	α-helix	trans	-58	-44.5	-176.8	-52.3	-31.9	0	0	0	111.1	Q1154 Q1155 E1161 S1162	Q1154-D1158 PolarHBondContact NE2-OD1 2.81Å; Q1154-D1158 PolarHBondContact O-N 3.36Å; Q1154-D1158 VanDerWaalsContact O-OD2 3.11Å; Q1155-D1158 WeakPolarHBondContact CA-OD2 3.4Å; Q1155-D1158 PolarHBondContact O-N 3.26Å; D1158-E1161 PolarHBondContact O-N 3.17Å; D1158-S1162 WeakPolarHBondContact O-CB 3.37Å; D1158-S1162 PolarHBondContact O-N 3.11Å
1159	M	94.2	Very high	93.3	Very high	60 Å²	60	64.8 Å²	64.8	30%	0.296	33%	0.334	S	S	.	.	H	α-helix	trans	-70.1	-36.5	177.7	-67.7	-61.2	-46.2	0	0	113	W1151 Q1155 R1157 S1162 G1163 Y1164	W1151-M1159 HydrophobicContact CD2-CG 3.97Å; W1151-M1159 HydrophobicContact CE3-CB 3.89Å; W1151-M1159 HydrophobicContact CE3-CG 3.8Å; W1151-M1159 HydrophobicContact CH2-CB 3.92Å; W1151-M1159 HydrophobicContact CH2-CE 3.8Å; W1151-M1159 HydrophobicContact CH2-CG 3.7Å; W1151-M1159 HydrophobicContact CH2-SD 4.34Å; W1151-M1159 HydrophobicContact CZ2-CE 4.07Å; W1151-M1159 HydrophobicContact CZ2-CG 3.85Å; W1151-M1159 HydrophobicContact CZ2-SD 4.25Å; W1151-M1159 HydrophobicContact CZ3-CB 3.52Å; W1151-M1159 HydrophobicContact CZ3-CG 3.65Å; Q1155-M1159 WeakPolarHBondContact O-CB 3.36Å; Q1155-M1159 WeakPolarHBondContact O-CG 3.13Å; Q1155-M1159 PolarHBondContact O-N 3.45Å; R1157-M1159 VanDerWaalsContact C-N 3.31Å; R1157-M1159 PolarHBondContact O-N 2.93Å; M1159-S1162 CarbonylContact O-C 3.53Å; M1159-S1162 PolarHBondContact O-N 3.46Å; M1159-S1162 PolarHBondContact O-OG 2.92Å; M1159-S1162 VanDerWaalsContact O-OG 3.09Å; M1159-G1163 PolarHBondContact O-N 2.88Å; M1159-Y1164 HydrophobicContact CE-CD2 4.25Å; M1159-Y1164 HydrophobicContact CE-CG 4.07Å; M1159-Y1164 VanDerWaalsContact O-CB 3.25Å; M1159-Y1164 WeakPolarHBondContact O-CB 3.48Å; M1159-Y1164 PolarHBondContact O-N 2.95Å
1160	I	93.5	Very high	93.1	Very high	0 Å²	0	65.7 Å²	65.7	0%	0	35%	0.349	C	S	.	.	H	α-helix	trans	-64.9	-43.9	173.9	-77	169.3	0	0	0	110.5	P1116 W1131 Y1148 T1156 R1157 S1162 G1163 R1165	P1116-I1160 HydrophobicContact CB-CG2 3.97Å; P1116-I1160 HydrophobicContact CG-CG2 4.38Å; W1131-I1160 HydrophobicContact CH2-CG2 3.76Å; W1131-I1160 HydrophobicContact CZ2-CD1 4.21Å; W1131-I1160 HydrophobicContact CZ2-CG1 4.25Å; W1131-I1160 HydrophobicContact CZ2-CG2 3.62Å; Y1148-I1160 HydrophobicContact CE1-CD1 4.43Å; Y1148-I1160 HydrophobicContact CE1-CG1 4.2Å; Y1148-I1160 HydrophobicContact CE2-CD1 4.09Å; T1156-I1160 HydrophobicContact CG2-CD1 3.75Å; T1156-I1160 HydrophobicContact CG2-CG1 4.44Å; T1156-I1160 WeakPolarHBondContact O-CB 3.41Å; T1156-I1160 WeakPolarHBondContact O-CD1 3.42Å; T1156-I1160 VanDerWaalsContact O-CG1 3.22Å; T1156-I1160 WeakPolarHBondContact O-CG1 3.13Å; T1156-I1160 PolarHBondContact O-N 2.93Å; R1157-I1160 PolarHBondContact O-N 2.88Å; R1157-I1160 VanDerWaalsContact O-N 3.17Å; I1160-S1162 VanDerWaalsContact C-N 3.28Å; I1160-S1162 PolarHBondContact O-N 2.82Å; I1160-G1163 PolarHBondContact O-N 3.03Å; I1160-G1163 VanDerWaalsContact O-N 3.12Å; I1160-R1165 PolarHBondContact O-NH1 2.71Å; I1160-R1165 VanDerWaalsContact O-NH1 3.08Å
1161	E	90.3	Very high	93	Very high	84 Å²	84	62.9 Å²	62.9	39%	0.393	33%	0.334	S	S	.	.	H	α-helix	trans	-67.1	-27.2	174.8	-70.8	-176.9	-167.3	0	0	111.9	R1120 R1157 D1158 G1163	R1120-E1161 WeakPolarHBondContact CG-OE1 3.41Å; R1157-E1161 HydrophobicContact CG-CG 4.44Å; R1157-E1161 IonicContact CZ-OE1 3.61Å; R1157-E1161 IonicContact NE-OE1 3.64Å; R1157-E1161 PolarHBondContact NE-OE1 3.02Å; R1157-E1161 IonicContact NH2-OE1 3.49Å; R1157-E1161 PolarHBondContact NH2-OE1 2.8Å; R1157-E1161 WeakPolarHBondContact O-CB 3.13Å; R1157-E1161 WeakPolarHBondContact O-CG 2.99Å; R1157-E1161 PolarHBondContact O-N 2.79Å; D1158-E1161 PolarHBondContact O-N 3.17Å; E1161-G1163 PolarHBondContact O-N 2.89Å
1162	S	92.5	Very high	93	Very high	80 Å²	80	59.9 Å²	59.9	56%	0.559	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.3	12	170.3	94.3	0	0	0	0	114.5	D1158 M1159 I1160 Y1164	D1158-S1162 WeakPolarHBondContact O-CB 3.37Å; D1158-S1162 PolarHBondContact O-N 3.11Å; M1159-S1162 CarbonylContact O-C 3.53Å; M1159-S1162 PolarHBondContact O-N 3.46Å; M1159-S1162 PolarHBondContact O-OG 2.92Å; M1159-S1162 VanDerWaalsContact O-OG 3.09Å; I1160-S1162 VanDerWaalsContact C-N 3.28Å; I1160-S1162 PolarHBondContact O-N 2.82Å; S1162-Y1164 PolarHBondContact O-N 2.87Å
1163	G	93.3	Very high	93	Very high	40 Å²	40	58.6 Å²	58.6	41%	0.412	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.5	2.8	176.9	0	0	0	0	0	116.1	M1159 I1160 E1161	M1159-G1163 PolarHBondContact O-N 2.88Å; I1160-G1163 PolarHBondContact O-N 3.03Å; I1160-G1163 VanDerWaalsContact O-N 3.12Å; E1161-G1163 PolarHBondContact O-N 2.89Å
1164	Y	94.4	Very high	92.9	Very high	87 Å²	87	59.8 Å²	59.8	34%	0.341	32%	0.324	S	S	.	.			trans	-68.3	146.3	175.4	178.9	-86.5	0	0	0	111.2	Y1148 W1151 M1159 S1162	Y1148-Y1164 HydrophobicContact CD1-CD1 4.34Å; Y1148-Y1164 HydrophobicContact CD1-CE1 4.08Å; Y1148-Y1164 AromaticContact CE1-CD1 3.99Å; Y1148-Y1164 HydrophobicContact CE1-CD1 3.99Å; Y1148-Y1164 AromaticContact CE1-CE1 3.97Å; Y1148-Y1164 HydrophobicContact CE1-CE1 3.97Å; W1151-Y1164 AromaticContact CH2-CD1 3.5Å; W1151-Y1164 HydrophobicContact CH2-CD1 3.5Å; W1151-Y1164 HydrophobicContact CH2-CD2 4.01Å; W1151-Y1164 AromaticContact CH2-CE1 3.43Å; W1151-Y1164 HydrophobicContact CH2-CE1 3.43Å; W1151-Y1164 VanDerWaalsContact CH2-CE1 3.43Å; W1151-Y1164 AromaticContact CH2-CE2 3.94Å; W1151-Y1164 HydrophobicContact CH2-CE2 3.94Å; W1151-Y1164 AromaticContact CH2-CG 3.79Å; W1151-Y1164 HydrophobicContact CH2-CG 3.79Å; W1151-Y1164 AromaticContact CH2-CZ 3.66Å; W1151-Y1164 AromaticContact CZ3-CD1 3.4Å; W1151-Y1164 HydrophobicContact CZ3-CD1 3.4Å; W1151-Y1164 AromaticContact CZ3-CE1 3.41Å; W1151-Y1164 HydrophobicContact CZ3-CE1 3.41Å; W1151-Y1164 VanDerWaalsContact CZ3-CE1 3.41Å; W1151-Y1164 HydrophobicContact CZ3-CG 4.09Å; M1159-Y1164 HydrophobicContact CE-CD2 4.25Å; M1159-Y1164 HydrophobicContact CE-CG 4.07Å; M1159-Y1164 VanDerWaalsContact O-CB 3.25Å; M1159-Y1164 WeakPolarHBondContact O-CB 3.48Å; M1159-Y1164 PolarHBondContact O-N 2.95Å; S1162-Y1164 PolarHBondContact O-N 2.87Å
1165	R	95.3	Very high	92.9	Very high	44 Å²	44	58.9 Å²	58.9	17%	0.166	32%	0.315	C	S	.	.			trans	-136.4	155.9	176.7	-58.7	-61.2	-178	-95.9	-2.9	110.2	W1131 I1160 W1184 D1186	W1131-R1165 VanDerWaalsContact CH2-CZ 3.42Å; I1160-R1165 PolarHBondContact O-NH1 2.71Å; I1160-R1165 VanDerWaalsContact O-NH1 3.08Å; R1165-W1184 HydrophobicContact CB-CE3 4Å; R1165-W1184 HydrophobicContact CB-CZ3 4.38Å; R1165-W1184 HydrophobicContact CG-CB 4.47Å; R1165-W1184 HydrophobicContact CG-CE3 4.42Å; R1165-W1184 PolarHBondContact NE-O 3.15Å; R1165-W1184 PolarHBondContact NH2-O 3.32Å; R1165-W1184 VanDerWaalsContact NH2-O 3.07Å; R1165-D1186 IonicContact CZ-OD1 3.31Å; R1165-D1186 IonicContact NH2-OD1 3.59Å; R1165-D1186 PolarHBondContact NH2-OD1 2.74Å; R1165-D1186 IonicContact NH2-OD2 2.69Å; R1165-D1186 PolarHBondContact NH2-OD2 2.78Å; R1165-D1186 VanDerWaalsContact NH2-OD2 3.1Å
1166	L	95.8	Very high	92.9	Very high	8 Å²	8	54.3 Å²	54.3	4%	0.042	29%	0.294	C	S	.	.	P	Polyproline II helix	trans	-64.8	140.2	179.5	-62.3	165	0	0	0	111	V1135 W1138 P1147 Y1148 A1168 W1184	V1135-L1166 HydrophobicContact CG1-CD1 4.39Å; W1138-L1166 HydrophobicContact CB-CD1 4.17Å; W1138-L1166 HydrophobicContact CD2-CB 4.44Å; W1138-L1166 HydrophobicContact CD2-CD1 3.81Å; W1138-L1166 HydrophobicContact CE3-CD1 4.23Å; W1138-L1166 HydrophobicContact CG-CB 4.18Å; W1138-L1166 HydrophobicContact CG-CD1 3.77Å; W1138-L1166 HydrophobicContact CZ2-CD2 4.45Å; P1147-L1166 HydrophobicContact CB-CD1 4.16Å; Y1148-L1166 HydrophobicContact CD1-CD2 3.55Å; Y1148-L1166 HydrophobicContact CD1-CG 4.24Å; Y1148-L1166 HydrophobicContact CD2-CD1 4.48Å; Y1148-L1166 HydrophobicContact CD2-CD2 3.98Å; Y1148-L1166 HydrophobicContact CD2-CG 4.46Å; Y1148-L1166 HydrophobicContact CE1-CD2 3.56Å; Y1148-L1166 HydrophobicContact CE1-CG 3.72Å; Y1148-L1166 HydrophobicContact CE2-CD1 3.92Å; Y1148-L1166 HydrophobicContact CE2-CD2 3.98Å; Y1148-L1166 HydrophobicContact CE2-CG 3.95Å; Y1148-L1166 HydrophobicContact CG-CD2 3.78Å; L1166-A1168 PolarHBondContact O-N 2.87Å; L1166-W1184 HydrophobicContact CB-CH2 3.71Å; L1166-W1184 HydrophobicContact CB-CZ3 4.04Å; L1166-W1184 HydrophobicContact CD1-CH2 3.93Å; L1166-W1184 HydrophobicContact CD1-CZ2 4.01Å; L1166-W1184 HydrophobicContact CG-CH2 4.23Å
1167	P	94.3	Very high	92.9	Very high	86 Å²	86	57.9 Å²	57.9	56%	0.558	31%	0.308	S	S	*	.	P	Polyproline II helix	trans	-67.2	131.2	173.6	29	-34.1	0	0	0	109.8	W1138	W1138-P1167 PolarHBondContact NE1-O 3.15Å
1168	A	93.4	Very high	93	Very high	14 Å²	14	58.2 Å²	58.2	12%	0.116	32%	0.316	C	S	.	.	P	Polyproline II helix	trans	-71.3	130	-178	0	0	0	0	0	111.7	L1166 M1172 R1177 M1180	L1166-A1168 PolarHBondContact O-N 2.87Å; A1168-M1172 HydrophobicContact CB-SD 4.37Å; A1168-R1177 HydrophobicContact CB-CB 4.15Å; A1168-R1177 HydrophobicContact CB-CG 3.55Å; A1168-R1177 VanDerWaalsContact O-CZ 3.3Å; A1168-R1177 PolarHBondContact O-NH1 2.94Å; A1168-R1177 VanDerWaalsContact O-NH1 3.15Å; A1168-R1177 PolarHBondContact O-NH2 3.09Å; A1168-M1180 HydrophobicContact CB-CE 3.51Å
1169	P	93.2	Very high	93.1	Very high	16 Å²	16	54.7 Å²	54.7	10%	0.104	30%	0.298	C	S	.	.	P	Polyproline II helix	trans	-66.6	151.9	-170.4	-22.8	35.2	0	0	0	114.2	F1141 T1142 L1171 M1172 R1177	F1141-P1169 HydrophobicContact CB-CB 4.07Å; F1141-P1169 HydrophobicContact CB-CG 3.89Å; F1141-P1169 WeakPolarHBondContact O-CB 3.16Å; T1142-P1169 HydrophobicContact CG2-CB 4.15Å; T1142-P1169 HydrophobicContact CG2-CG 3.52Å; P1169-L1171 VanDerWaalsContact C-N 3.26Å; P1169-L1171 PolarHBondContact O-N 2.87Å; P1169-M1172 VanDerWaalsContact O-CB 3.22Å; P1169-M1172 WeakPolarHBondContact O-CB 3.32Å; P1169-M1172 PolarHBondContact O-N 3.39Å; P1169-R1177 PolarHBondContact O-NH2 3.38Å
1170	D	88.5	Confident	93.2	Very high	160 Å²	160	51.9 Å²	51.9	86%	0.856	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-31.8	-173.5	-55.5	-33.9	0	0	0	113.8	M1172	D1170-M1172 VanDerWaalsContact C-N 3.28Å; D1170-M1172 PolarHBondContact O-N 3.46Å
1171	L	88.4	Confident	93.3	Very high	82 Å²	82	55.7 Å²	55.7	43%	0.429	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-8	176.9	-61.8	179.9	0	0	0	113.9	V1046 F1141 F1143 P1169 P1173	V1046-L1171 HydrophobicContact CG2-CB 4.47Å; F1141-L1171 HydrophobicContact CD1-CB 4.33Å; F1141-L1171 WeakPolarHBondContact CE1-O 3.15Å; F1143-L1171 HydrophobicContact CE2-CD1 3.52Å; F1143-L1171 HydrophobicContact CZ-CD1 3.48Å; F1143-L1171 VanDerWaalsContact CZ-CD1 3.48Å; P1169-L1171 VanDerWaalsContact C-N 3.26Å; P1169-L1171 PolarHBondContact O-N 2.87Å; L1171-P1173 WeakPolarHBondContact O-CD 3.5Å
1172	M	93.3	Very high	93.6	Very high	6 Å²	6	55.8 Å²	55.8	3%	0.03	30%	0.304	C	S	.	.	S	Bend	trans	-80.3	119.6	-178.3	-175	175.7	-79.3	0	0	110.7	L1137 F1141 A1168 P1169 D1170 L1176 R1177 M1180	L1137-M1172 HydrophobicContact CB-CE 4.09Å; F1141-M1172 HydrophobicContact CB-CB 4.38Å; F1141-M1172 HydrophobicContact CB-CE 3.84Å; F1141-M1172 HydrophobicContact CD1-CB 3.88Å; F1141-M1172 HydrophobicContact CD1-CG 4.41Å; F1141-M1172 HydrophobicContact CD2-CE 3.7Å; F1141-M1172 HydrophobicContact CE1-CB 4.41Å; F1141-M1172 HydrophobicContact CE2-CE 4.48Å; F1141-M1172 HydrophobicContact CG-CB 4.13Å; F1141-M1172 HydrophobicContact CG-CE 3.8Å; F1141-M1172 HydrophobicContact CG-CG 4.44Å; A1168-M1172 HydrophobicContact CB-SD 4.37Å; P1169-M1172 VanDerWaalsContact O-CB 3.22Å; P1169-M1172 WeakPolarHBondContact O-CB 3.32Å; P1169-M1172 PolarHBondContact O-N 3.39Å; D1170-M1172 VanDerWaalsContact C-N 3.28Å; D1170-M1172 PolarHBondContact O-N 3.46Å; M1172-L1176 HydrophobicContact CE-CG 4.5Å; M1172-L1176 HydrophobicContact CG-CB 3.99Å; M1172-L1176 HydrophobicContact CG-CD2 4.13Å; M1172-L1176 HydrophobicContact CG-CG 4Å; M1172-L1176 HydrophobicContact SD-CG 4.26Å; M1172-R1177 HydrophobicContact CG-CB 4.28Å; M1172-R1177 HydrophobicContact SD-CB 4.14Å; M1172-M1180 HydrophobicContact CE-SD 3.71Å; M1172-M1180 HydrophobicContact SD-CB 4.3Å; M1172-M1180 HydrophobicContact SD-CE 4.1Å; M1172-M1180 HydrophobicContact SD-SD 3.89Å
1173	P	91.9	Very high	93.9	Very high	32 Å²	32	52 Å²	52	21%	0.208	28%	0.278	C	S	.	.			trans	-53.9	144.5	176.1	-26.8	35.6	0	0	0	112.3	V1046 L1050 L1171 W1175 L1176 R1177	V1046-P1173 HydrophobicContact CG1-CG 4.4Å; L1050-P1173 HydrophobicContact CD2-CG 4.5Å; L1171-P1173 WeakPolarHBondContact O-CD 3.5Å; P1173-W1175 HydrophobicContact CB-CD2 4.46Å; P1173-W1175 HydrophobicContact CB-CG 4.38Å; P1173-W1175 HydrophobicContact CB-CZ2 4.46Å; P1173-W1175 PolarHBondContact O-N 3.1Å; P1173-L1176 HydrophobicContact CB-CB 4.43Å; P1173-L1176 PolarHBondContact O-N 3.1Å; P1173-R1177 PolarHBondContact O-N 2.98Å
1174	V	90.7	Very high	94.1	Very high	113 Å²	113	50.2 Å²	50.2	69%	0.685	26%	0.259	S	S	*	.	H	α-helix	trans	-56.7	-37.4	-174.7	-178.1	0	0	0	0	112.4	R1177 T1178	V1174-R1177 WeakPolarHBondContact O-CB 3.42Å; V1174-R1177 PolarHBondContact O-N 3.35Å; V1174-T1178 PolarHBondContact O-N 2.78Å; V1174-T1178 PolarHBondContact O-OG1 3.26Å
1175	W	92.2	Very high	94.2	Very high	93 Å²	93	49.5 Å²	49.5	35%	0.352	26%	0.258	S	S	.	.	H	α-helix	trans	-66.2	-38.3	175.8	63.8	-101.4	0	0	0	112.6	L1050 P1173 T1178 L1179 E1200 I1201 Q1202	L1050-W1175 HydrophobicContact CD2-CH2 3.75Å; L1050-W1175 HydrophobicContact CD2-CZ2 3.76Å; P1173-W1175 HydrophobicContact CB-CD2 4.46Å; P1173-W1175 HydrophobicContact CB-CG 4.38Å; P1173-W1175 HydrophobicContact CB-CZ2 4.46Å; P1173-W1175 PolarHBondContact O-N 3.1Å; W1175-T1178 WeakPolarHBondContact O-CB 3.46Å; W1175-T1178 PolarHBondContact O-N 3.14Å; W1175-L1179 PolarHBondContact O-N 2.77Å; W1175-E1200 WeakPolarHBondContact CZ3-O 3.35Å; W1175-I1201 HydrophobicContact CH2-CB 4.43Å; W1175-I1201 HydrophobicContact CH2-CG2 4.23Å; W1175-I1201 HydrophobicContact CZ3-CB 4.45Å; W1175-I1201 HydrophobicContact CZ3-CG1 4.24Å; W1175-Q1202 WeakPolarHBondContact CZ2-O 3.29Å
1176	L	94.8	Very high	94	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-74.2	-34	178.4	-175.1	58.8	0	0	0	111.5	L1050 L1137 F1141 M1172 P1173 T1178 L1179 M1180 I1201	L1050-L1176 HydrophobicContact CD2-CD2 3.75Å; L1137-L1176 HydrophobicContact CD1-CD1 3.87Å; L1137-L1176 HydrophobicContact CD2-CD1 4.12Å; F1141-L1176 HydrophobicContact CD2-CD2 4.26Å; F1141-L1176 HydrophobicContact CE1-CD2 4.48Å; F1141-L1176 HydrophobicContact CE2-CD2 3.42Å; F1141-L1176 VanDerWaalsContact CE2-CD2 3.42Å; F1141-L1176 HydrophobicContact CZ-CD2 3.55Å; M1172-L1176 HydrophobicContact CE-CG 4.5Å; M1172-L1176 HydrophobicContact CG-CB 3.99Å; M1172-L1176 HydrophobicContact CG-CD2 4.13Å; M1172-L1176 HydrophobicContact CG-CG 4Å; M1172-L1176 HydrophobicContact SD-CG 4.26Å; P1173-L1176 HydrophobicContact CB-CB 4.43Å; P1173-L1176 PolarHBondContact O-N 3.1Å; L1176-T1178 VanDerWaalsContact C-N 3.32Å; L1176-L1179 HydrophobicContact CD1-CB 4.42Å; L1176-L1179 HydrophobicContact CD1-CD2 4.13Å; L1176-L1179 PolarHBondContact O-N 2.93Å; L1176-M1180 WeakPolarHBondContact O-CB 3.3Å; L1176-M1180 PolarHBondContact O-N 3.48Å; L1176-I1201 HydrophobicContact CD1-CG1 4.44Å
1177	R	94.1	Very high	93.9	Very high	75 Å²	75	55.5 Å²	55.5	28%	0.283	29%	0.291	S	S	.	.	H	α-helix	trans	-57.7	-44.2	168.5	168.8	179.8	-51.6	-116.9	-6.1	111.2	A1168 P1169 M1172 P1173 V1174 N1181	A1168-R1177 HydrophobicContact CB-CB 4.15Å; A1168-R1177 HydrophobicContact CB-CG 3.55Å; A1168-R1177 VanDerWaalsContact O-CZ 3.3Å; A1168-R1177 PolarHBondContact O-NH1 2.94Å; A1168-R1177 VanDerWaalsContact O-NH1 3.15Å; A1168-R1177 PolarHBondContact O-NH2 3.09Å; P1169-R1177 PolarHBondContact O-NH2 3.38Å; M1172-R1177 HydrophobicContact CG-CB 4.28Å; M1172-R1177 HydrophobicContact SD-CB 4.14Å; P1173-R1177 PolarHBondContact O-N 2.98Å; V1174-R1177 WeakPolarHBondContact O-CB 3.42Å; V1174-R1177 PolarHBondContact O-N 3.35Å; R1177-N1181 WeakPolarHBondContact O-CB 3.08Å; R1177-N1181 VanDerWaalsContact O-CG 3.23Å; R1177-N1181 PolarHBondContact O-N 3.08Å
1178	T	94.8	Very high	93.9	Very high	68 Å²	68	52.5 Å²	52.5	42%	0.417	27%	0.271	S	S	.	.	H	α-helix	trans	-63.4	-44.4	173.4	-63.8	0	0	0	0	112.1	V1174 W1175 L1176 N1181 H1182	V1174-T1178 PolarHBondContact O-N 2.78Å; V1174-T1178 PolarHBondContact O-OG1 3.26Å; W1175-T1178 WeakPolarHBondContact O-CB 3.46Å; W1175-T1178 PolarHBondContact O-N 3.14Å; L1176-T1178 VanDerWaalsContact C-N 3.32Å; T1178-N1181 PolarHBondContact O-N 2.93Å; T1178-H1182 VanDerWaalsContact CG2-CE1 3.45Å; T1178-H1182 WeakPolarHBondContact CG2-CE1 3.48Å; T1178-H1182 PolarHBondContact O-N 3.31Å; T1178-H1182 PolarHBondContact O-ND1 3.01Å; T1178-H1182 VanDerWaalsContact O-ND1 3.09Å
1179	L	95.6	Very high	93.9	Very high	1 Å²	1	58.8 Å²	58.8	1%	0.005	30%	0.3	C	S	.	.	H	α-helix	trans	-62.8	-43.8	176.5	-179.7	54.7	0	0	0	112.7	W1175 L1176 N1181 H1182 C1183 P1192 I1197 E1200 I1201	W1175-L1179 PolarHBondContact O-N 2.77Å; L1176-L1179 HydrophobicContact CD1-CB 4.42Å; L1176-L1179 HydrophobicContact CD1-CD2 4.13Å; L1176-L1179 PolarHBondContact O-N 2.93Å; L1179-N1181 PolarHBondContact O-N 2.91Å; L1179-H1182 PolarHBondContact O-N 3.39Å; L1179-C1183 PolarHBondContact O-N 3.32Å; L1179-C1183 VanDerWaalsContact O-N 3.08Å; L1179-C1183 PolarHBondContact O-SG 3.25Å; L1179-P1192 HydrophobicContact CD1-CG 4.25Å; L1179-I1197 HydrophobicContact CD1-CG1 4.13Å; L1179-I1197 HydrophobicContact CD2-CG2 4.28Å; L1179-E1200 HydrophobicContact CD2-CB 4.07Å; L1179-I1201 HydrophobicContact CD2-CD1 4.43Å; L1179-I1201 HydrophobicContact CD2-CG1 3.9Å
1180	M	97.1	Very high	94.1	Very high	0 Å²	0	62.7 Å²	62.7	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-60.7	-42.8	175.3	-171.9	-169.5	66.3	0	0	111.5	G1134 L1137 W1138 A1168 M1172 L1176 H1182 C1183 W1184	G1134-M1180 WeakPolarHBondContact O-CG 3.38Å; L1137-M1180 HydrophobicContact CB-CG 4.2Å; L1137-M1180 HydrophobicContact CB-SD 4.33Å; L1137-M1180 HydrophobicContact CD1-CB 3.87Å; L1137-M1180 HydrophobicContact CD1-CG 4.14Å; W1138-M1180 HydrophobicContact CB-SD 4.09Å; A1168-M1180 HydrophobicContact CB-CE 3.51Å; M1172-M1180 HydrophobicContact CE-SD 3.71Å; M1172-M1180 HydrophobicContact SD-CB 4.3Å; M1172-M1180 HydrophobicContact SD-CE 4.1Å; M1172-M1180 HydrophobicContact SD-SD 3.89Å; L1176-M1180 WeakPolarHBondContact O-CB 3.3Å; L1176-M1180 PolarHBondContact O-N 3.48Å; M1180-H1182 PolarHBondContact O-N 2.89Å; M1180-C1183 VanDerWaalsContact O-CB 3.31Å; M1180-C1183 WeakPolarHBondContact O-CB 3.44Å; M1180-C1183 PolarHBondContact O-N 2.97Å; M1180-C1183 VanDerWaalsContact O-N 3.12Å; M1180-W1184 HydrophobicContact CE-CE3 4.45Å; M1180-W1184 HydrophobicContact CE-CH2 3.65Å; M1180-W1184 HydrophobicContact CE-CZ3 3.49Å; M1180-W1184 VanDerWaalsContact CE-CZ3 3.49Å; M1180-W1184 HydrophobicContact CG-CE3 4.46Å; M1180-W1184 HydrophobicContact CG-CH2 3.82Å; M1180-W1184 HydrophobicContact CG-CZ2 4.08Å; M1180-W1184 HydrophobicContact CG-CZ3 4.04Å; M1180-W1184 PolarHBondContact O-N 3.23Å; M1180-W1184 HydrophobicContact SD-CH2 3.49Å; M1180-W1184 WeakPolarHBondContact SD-CH2 3.38Å; M1180-W1184 HydrophobicContact SD-CZ2 4.15Å; M1180-W1184 HydrophobicContact SD-CZ3 3.94Å
1181	N	95.5	Very high	94.6	Very high	80 Å²	80	55.2 Å²	55.2	43%	0.428	28%	0.28	S	S	.	.	H	α-helix	trans	-63.2	-40.4	175.8	-72.1	-9.5	0	0	0	112.1	R1177 T1178 L1179 C1183 W1184 H1185	R1177-N1181 WeakPolarHBondContact O-CB 3.08Å; R1177-N1181 VanDerWaalsContact O-CG 3.23Å; R1177-N1181 PolarHBondContact O-N 3.08Å; T1178-N1181 PolarHBondContact O-N 2.93Å; L1179-N1181 PolarHBondContact O-N 2.91Å; N1181-C1183 VanDerWaalsContact C-N 3.25Å; N1181-C1183 PolarHBondContact O-N 2.8Å; N1181-W1184 PolarHBondContact O-N 2.81Å; N1181-W1184 VanDerWaalsContact O-N 3.07Å; N1181-H1185 PolarHBondContact O-N 3.33Å
1182	H	96.6	Very high	95	Very high	87 Å²	87	51.8 Å²	51.8	40%	0.403	26%	0.262	S	S	.	.	H	α-helix	trans	-62.7	-30.2	173.2	-68.9	132.5	0	0	0	113	T1178 L1179 M1180 W1184 H1185 P1192	T1178-H1182 VanDerWaalsContact CG2-CE1 3.45Å; T1178-H1182 WeakPolarHBondContact CG2-CE1 3.48Å; T1178-H1182 PolarHBondContact O-N 3.31Å; T1178-H1182 PolarHBondContact O-ND1 3.01Å; T1178-H1182 VanDerWaalsContact O-ND1 3.09Å; L1179-H1182 PolarHBondContact O-N 3.39Å; M1180-H1182 PolarHBondContact O-N 2.89Å; H1182-W1184 PolarHBondContact O-N 3.45Å; H1182-H1185 PolarHBondContact O-N 3.16Å; H1182-P1192 WeakPolarHBondContact O-CD 3.39Å
1183	C	98.1	Very high	95.2	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-66.6	-21.6	174.2	-63.3	0	0	0	0	113.1	V1130 W1131 L1179 M1180 N1181 R1191	V1130-C1183 HydrophobicContact CG1-CB 4.06Å; V1130-C1183 WeakPolarHBondContact O-CB 3.15Å; W1131-C1183 WeakPolarHBondContact CA-O 3.44Å; L1179-C1183 PolarHBondContact O-N 3.32Å; L1179-C1183 VanDerWaalsContact O-N 3.08Å; L1179-C1183 PolarHBondContact O-SG 3.25Å; M1180-C1183 VanDerWaalsContact O-CB 3.31Å; M1180-C1183 WeakPolarHBondContact O-CB 3.44Å; M1180-C1183 PolarHBondContact O-N 2.97Å; M1180-C1183 VanDerWaalsContact O-N 3.12Å; N1181-C1183 VanDerWaalsContact C-N 3.25Å; N1181-C1183 PolarHBondContact O-N 2.8Å; C1183-R1191 WeakPolarHBondContact O-CD 3.33Å
1184	W	97.4	Very high	95.5	Very high	3 Å²	3	52 Å²	52	1%	0.011	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.5	21.5	178.3	-56.8	-37.9	0	0	0	114.9	W1131 G1134 V1135 W1138 R1165 L1166 M1180 N1181 H1182 D1186	W1131-W1184 AromaticContact CD2-CD1 3.61Å; W1131-W1184 HydrophobicContact CD2-CG 4.38Å; W1131-W1184 AromaticContact CE2-CD1 3.9Å; W1131-W1184 HydrophobicContact CE3-CB 4Å; W1131-W1184 AromaticContact CE3-CD1 3.93Å; W1131-W1184 HydrophobicContact CE3-CG 4.34Å; W1131-W1184 AromaticContact CG-CD1 3.84Å; W1131-W1184 HydrophobicContact CH2-CB 4.29Å; W1131-W1184 HydrophobicContact CZ3-CB 3.88Å; W1131-W1184 WeakPolarHBondContact CZ3-O 3.32Å; W1131-W1184 PolarHBondContact O-NE1 3.07Å; W1131-W1184 VanDerWaalsContact O-NE1 3.11Å; G1134-W1184 WeakPolarHBondContact O-CZ2 3.1Å; V1135-W1184 HydrophobicContact CG2-CZ2 4Å; W1138-W1184 HydrophobicContact CB-CH2 4.26Å; W1138-W1184 HydrophobicContact CB-CZ2 4.46Å; R1165-W1184 HydrophobicContact CB-CE3 4Å; R1165-W1184 HydrophobicContact CB-CZ3 4.38Å; R1165-W1184 HydrophobicContact CG-CB 4.47Å; R1165-W1184 HydrophobicContact CG-CE3 4.42Å; R1165-W1184 PolarHBondContact NE-O 3.15Å; R1165-W1184 PolarHBondContact NH2-O 3.32Å; R1165-W1184 VanDerWaalsContact NH2-O 3.07Å; L1166-W1184 HydrophobicContact CB-CH2 3.71Å; L1166-W1184 HydrophobicContact CB-CZ3 4.04Å; L1166-W1184 HydrophobicContact CD1-CH2 3.93Å; L1166-W1184 HydrophobicContact CD1-CZ2 4.01Å; L1166-W1184 HydrophobicContact CG-CH2 4.23Å; M1180-W1184 HydrophobicContact CE-CE3 4.45Å; M1180-W1184 HydrophobicContact CE-CH2 3.65Å; M1180-W1184 HydrophobicContact CE-CZ3 3.49Å; M1180-W1184 VanDerWaalsContact CE-CZ3 3.49Å; M1180-W1184 HydrophobicContact CG-CE3 4.46Å; M1180-W1184 HydrophobicContact CG-CH2 3.82Å; M1180-W1184 HydrophobicContact CG-CZ2 4.08Å; M1180-W1184 HydrophobicContact CG-CZ3 4.04Å; M1180-W1184 PolarHBondContact O-N 3.23Å; M1180-W1184 HydrophobicContact SD-CH2 3.49Å; M1180-W1184 WeakPolarHBondContact SD-CH2 3.38Å; M1180-W1184 HydrophobicContact SD-CZ2 4.15Å; M1180-W1184 HydrophobicContact SD-CZ3 3.94Å; N1181-W1184 PolarHBondContact O-N 2.81Å; N1181-W1184 VanDerWaalsContact O-N 3.07Å; H1182-W1184 PolarHBondContact O-N 3.45Å; W1184-D1186 PolarHBondContact O-N 2.83Å
1185	H	96.5	Very high	95.7	Very high	71 Å²	71	49 Å²	49	33%	0.329	25%	0.249	S	C	.	.			trans	-58.1	135	169.4	-170	-66.2	0	0	0	110.1	N1181 H1182 E1187 N1190 R1191	N1181-H1185 PolarHBondContact O-N 3.33Å; H1182-H1185 PolarHBondContact O-N 3.16Å; H1185-E1187 PolarHBondContact ND1-N 3.22Å; H1185-E1187 VanDerWaalsContact ND1-N 3.15Å; H1185-E1187 PolarHBondContact ND1-O 3.17Å; H1185-N1190 HydrophobicContact CB-CB 4.36Å; H1185-N1190 PolarHBondContact CE1-ND2 3.41Å; H1185-N1190 PolarHBondContact NE2-ND2 3.46Å; H1185-R1191 HydrophobicContact CB-CG 4.07Å; H1185-R1191 PolarHBondContact O-NE 3.32Å; H1185-R1191 PolarHBondContact O-NH2 3.11Å
1186	D	91.8	Very high	95.9	Very high	82 Å²	82	49.4 Å²	49.4	44%	0.439	25%	0.253	S	S	.	.	S	Bend	trans	-57	-57.4	-176.9	-66.7	-83.3	0	0	0	112.1	R1165 W1184 P1188 R1191	R1165-D1186 IonicContact CZ-OD1 3.31Å; R1165-D1186 IonicContact NH2-OD1 3.59Å; R1165-D1186 PolarHBondContact NH2-OD1 2.74Å; R1165-D1186 IonicContact NH2-OD2 2.69Å; R1165-D1186 PolarHBondContact NH2-OD2 2.78Å; R1165-D1186 VanDerWaalsContact NH2-OD2 3.1Å; W1184-D1186 PolarHBondContact O-N 2.83Å; D1186-P1188 VanDerWaalsContact O-CD 3.3Å; D1186-P1188 WeakPolarHBondContact O-CD 3.35Å; D1186-R1191 PolarHBondContact O-NH2 2.92Å
1187	E	93.2	Very high	96	Very high	97 Å²	97	49.4 Å²	49.4	45%	0.453	25%	0.253	S	S	.	.	S	Bend	trans	-64.4	116.3	174.2	-178.6	46.1	-127.2	0	0	111	H1185 M1189 N1190	H1185-E1187 PolarHBondContact ND1-N 3.22Å; H1185-E1187 VanDerWaalsContact ND1-N 3.15Å; H1185-E1187 PolarHBondContact ND1-O 3.17Å; E1187-M1189 VanDerWaalsContact C-N 3.25Å; E1187-M1189 HydrophobicContact CG-CB 4.36Å; E1187-M1189 PolarHBondContact O-N 3.09Å; E1187-M1189 WeakPolarHBondContact OE1-CG 3.47Å; E1187-M1189 PolarHBondContact OE1-N 2.97Å; E1187-N1190 PolarHBondContact O-N 3.24Å
1188	P	95.1	Very high	96.1	Very high	22 Å²	22	46.7 Å²	46.7	14%	0.143	25%	0.246	C	C	.	.	G	3₁₀ helix	trans	-61	-29.6	-175.1	-25.5	34.8	0	0	0	114.4	E1117 K1127 D1186 N1190 R1191	E1117-P1188 HydrophobicContact CB-CG 4.38Å; E1117-P1188 HydrophobicContact CG-CG 3.8Å; K1127-P1188 HydrophobicContact CB-CB 3.88Å; K1127-P1188 WeakPolarHBondContact CD-O 3.24Å; K1127-P1188 HydrophobicContact CG-CB 4.41Å; D1186-P1188 VanDerWaalsContact O-CD 3.3Å; D1186-P1188 WeakPolarHBondContact O-CD 3.35Å; P1188-N1190 VanDerWaalsContact C-N 3.26Å; P1188-N1190 PolarHBondContact O-N 3.2Å; P1188-R1191 WeakPolarHBondContact O-CB 3.47Å; P1188-R1191 PolarHBondContact O-N 3.38Å
1189	M	94.1	Very high	96	Very high	146 Å²	146	49.4 Å²	49.4	72%	0.719	26%	0.258	S	S	*	.	G	3₁₀ helix	trans	-66.6	-27.5	-179.5	-63.2	-59.9	-73.7	0	0	113.1	E1187	E1187-M1189 VanDerWaalsContact C-N 3.25Å; E1187-M1189 HydrophobicContact CG-CB 4.36Å; E1187-M1189 PolarHBondContact O-N 3.09Å; E1187-M1189 WeakPolarHBondContact OE1-CG 3.47Å; E1187-M1189 PolarHBondContact OE1-N 2.97Å
1190	N	96.6	Very high	95.8	Very high	98 Å²	98	52.9 Å²	52.9	52%	0.524	27%	0.274	S	S	.	.	G	3₁₀ helix	trans	-83.7	-12.5	179.9	-70.6	4.1	0	0	0	113.3	H1185 E1187 P1188	H1185-N1190 HydrophobicContact CB-CB 4.36Å; H1185-N1190 PolarHBondContact CE1-ND2 3.41Å; H1185-N1190 PolarHBondContact NE2-ND2 3.46Å; E1187-N1190 PolarHBondContact O-N 3.24Å; P1188-N1190 VanDerWaalsContact C-N 3.26Å; P1188-N1190 PolarHBondContact O-N 3.2Å
1191	R	97.9	Very high	95.5	Very high	4 Å²	4	53.3 Å²	53.3	2%	0.015	28%	0.276	C	S	.	.	S	Bend	trans	-68.6	146.4	172.5	-56.7	175.8	-165.1	151.7	11.7	109.4	E1117 K1127 V1130 C1183 H1185 D1186 P1188	E1117-R1191 IonicContact OE1-CZ 3.71Å; E1117-R1191 IonicContact OE1-NH1 3.1Å; E1117-R1191 PolarHBondContact OE1-NH1 3.04Å; E1117-R1191 IonicContact OE1-NH2 3.78Å; E1117-R1191 IonicContact OE2-CZ 3.59Å; E1117-R1191 IonicContact OE2-NH1 2.7Å; E1117-R1191 PolarHBondContact OE2-NH1 3.42Å; E1117-R1191 IonicContact OE2-NH2 3.62Å; E1117-R1191 PolarHBondContact OE2-NH2 2.85Å; K1127-R1191 HydrophobicContact CD-CB 4.39Å; K1127-R1191 PolarHBondContact NZ-O 3.44Å; K1127-R1191 PolarHBondContact O-NH1 3.4Å; V1130-R1191 HydrophobicContact CG1-CB 3.88Å; C1183-R1191 WeakPolarHBondContact O-CD 3.33Å; H1185-R1191 HydrophobicContact CB-CG 4.07Å; H1185-R1191 PolarHBondContact O-NE 3.32Å; H1185-R1191 PolarHBondContact O-NH2 3.11Å; D1186-R1191 PolarHBondContact O-NH2 2.92Å; P1188-R1191 WeakPolarHBondContact O-CB 3.47Å; P1188-R1191 PolarHBondContact O-N 3.38Å
1192	P	97.5	Very high	94.7	Very high	10 Å²	10	56.1 Å²	56.1	7%	0.065	29%	0.287	C	S	.	.	P	Polyproline II helix	trans	-62.1	168.2	178.5	26.7	-35.2	0	0	0	112.8	K1127 V1130 L1179 H1182 K1196 I1197	K1127-P1192 VanDerWaalsContact NZ-C 3.33Å; K1127-P1192 PolarHBondContact NZ-O 3.32Å; V1130-P1192 HydrophobicContact CG1-CG 4.18Å; L1179-P1192 HydrophobicContact CD1-CG 4.25Å; H1182-P1192 WeakPolarHBondContact O-CD 3.39Å; P1192-K1196 HydrophobicContact CB-CB 4.14Å; P1192-K1196 HydrophobicContact CB-CD 4.01Å; P1192-K1196 HydrophobicContact CB-CG 4.19Å; P1192-I1197 HydrophobicContact CB-CG1 3.99Å; P1192-I1197 HydrophobicContact CG-CD1 4Å; P1192-I1197 HydrophobicContact CG-CG1 3.72Å
1193	S	97.4	Very high	93.7	Very high	41 Å²	41	54.6 Å²	54.6	29%	0.287	28%	0.281	S	S	.	.	P	Polyproline II helix	trans	-86.1	162.4	161	54.2	0	0	0	0	109.7	E1064 S1195 K1196 I1197	E1064-S1193 WeakPolarHBondContact OE1-CB 3.37Å; S1193-S1195 VanDerWaalsContact C-N 3.25Å; S1193-S1195 PolarHBondContact O-N 3.47Å; S1193-K1196 PolarHBondContact O-N 3.44Å; S1193-K1196 PolarHBondContact OG-N 3.14Å; S1193-I1197 WeakPolarHBondContact O-CG1 3.41Å; S1193-I1197 PolarHBondContact O-N 3.22Å
1194	F	98	Very high	92.1	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-66.7	-30.9	175.1	-75.8	-71	0	0	0	112.3	M1060 M1061 E1064 I1126 D1129 V1130 Y1133 K1196 I1197 S1198	M1060-F1194 HydrophobicContact CB-CB 4.33Å; M1060-F1194 HydrophobicContact CB-CD1 3.32Å; M1060-F1194 HydrophobicContact CB-CD2 3.79Å; M1060-F1194 HydrophobicContact CB-CE1 3.34Å; M1060-F1194 HydrophobicContact CB-CE2 3.79Å; M1060-F1194 HydrophobicContact CB-CG 3.54Å; M1060-F1194 HydrophobicContact CB-CZ 3.56Å; M1060-F1194 HydrophobicContact CE-CD2 4.45Å; M1060-F1194 HydrophobicContact CE-CE2 3.72Å; M1060-F1194 HydrophobicContact CE-CZ 3.86Å; M1060-F1194 HydrophobicContact CG-CD1 4.21Å; M1060-F1194 HydrophobicContact CG-CE1 3.73Å; M1060-F1194 HydrophobicContact CG-CE2 4.35Å; M1060-F1194 HydrophobicContact CG-CZ 3.79Å; M1061-F1194 HydrophobicContact CB-CB 3.9Å; E1064-F1194 HydrophobicContact CB-CD2 4.29Å; E1064-F1194 PolarHBondContact OE1-N 2.77Å; E1064-F1194 WeakPolarHBondContact OE2-CA 3.26Å; E1064-F1194 WeakPolarHBondContact OE2-CB 3.37Å; E1064-F1194 PolarHBondContact OE2-N 3.38Å; I1126-F1194 HydrophobicContact CD1-CD2 4.12Å; I1126-F1194 HydrophobicContact CD1-CE2 3.88Å; I1126-F1194 HydrophobicContact CG1-CD2 3.97Å; I1126-F1194 HydrophobicContact CG1-CE2 3.94Å; D1129-F1194 HydrophobicContact CB-CE2 4.13Å; D1129-F1194 HydrophobicContact CB-CZ 4.16Å; V1130-F1194 HydrophobicContact CB-CE2 4.45Å; V1130-F1194 HydrophobicContact CB-CZ 4.29Å; V1130-F1194 HydrophobicContact CG2-CD2 3.88Å; V1130-F1194 HydrophobicContact CG2-CE1 4.26Å; V1130-F1194 HydrophobicContact CG2-CE2 3.47Å; V1130-F1194 VanDerWaalsContact CG2-CE2 3.47Å; V1130-F1194 HydrophobicContact CG2-CG 4.45Å; V1130-F1194 HydrophobicContact CG2-CZ 3.7Å; Y1133-F1194 HydrophobicContact CD1-CE1 4.38Å; Y1133-F1194 AromaticContact CD2-CE1 3.98Å; Y1133-F1194 HydrophobicContact CD2-CE1 3.98Å; Y1133-F1194 AromaticContact CG-CE1 3.74Å; Y1133-F1194 HydrophobicContact CG-CE1 3.74Å; F1194-K1196 VanDerWaalsContact C-N 3.33Å; F1194-K1196 PolarHBondContact O-N 3.29Å; F1194-I1197 HydrophobicContact CD1-CD1 3.67Å; F1194-I1197 HydrophobicContact CE1-CD1 3.93Å; F1194-I1197 HydrophobicContact CG-CD1 4.39Å; F1194-I1197 PolarHBondContact O-N 3.05Å; F1194-S1198 WeakPolarHBondContact O-CB 3.5Å; F1194-S1198 PolarHBondContact O-N 3.33Å
1195	S	95.8	Very high	89.9	Confident	51 Å²	51	62.3 Å²	62.3	36%	0.357	33%	0.326	S	S	.	.	H	α-helix	trans	-58.1	-41.6	166.9	-176.9	0	0	0	0	113	E1064 S1193 N1199	E1064-S1195 PolarHBondContact OE2-N 3.13Å; S1193-S1195 VanDerWaalsContact C-N 3.25Å; S1193-S1195 PolarHBondContact O-N 3.47Å; S1195-N1199 PolarHBondContact O-N 2.66Å; S1195-N1199 PolarHBondContact O-ND2 2.94Å
1196	K	96	Very high	87.7	Confident	102 Å²	102	64.7 Å²	64.7	44%	0.443	35%	0.345	S	S	.	.	H	α-helix	trans	-68.6	-42.2	175.2	-178	173.6	174.9	-177.4	0	111.9	P1192 S1193 F1194 N1199 E1200	P1192-K1196 HydrophobicContact CB-CB 4.14Å; P1192-K1196 HydrophobicContact CB-CD 4.01Å; P1192-K1196 HydrophobicContact CB-CG 4.19Å; S1193-K1196 PolarHBondContact O-N 3.44Å; S1193-K1196 PolarHBondContact OG-N 3.14Å; F1194-K1196 VanDerWaalsContact C-N 3.33Å; F1194-K1196 PolarHBondContact O-N 3.29Å; K1196-N1199 PolarHBondContact O-N 3.45Å; K1196-E1200 WeakPolarHBondContact CE-OE1 3.48Å; K1196-E1200 IonicContact NZ-OE1 2.87Å; K1196-E1200 PolarHBondContact O-N 3.33Å; K1196-E1200 VanDerWaalsContact O-N 3.07Å
1197	I	97.4	Very high	85.1	Confident	0 Å²	0	68.1 Å²	68.1	0%	0	36%	0.363	C	S	.	.	H	α-helix	trans	-58	-51.5	177.1	-67.6	166.5	0	0	0	110.8	A1057 V1130 Y1133 L1179 P1192 S1193 F1194 N1199 E1200 I1201	A1057-I1197 HydrophobicContact CB-CG2 3.7Å; V1130-I1197 HydrophobicContact CG1-CD1 4.1Å; V1130-I1197 HydrophobicContact CG2-CD1 4.41Å; Y1133-I1197 HydrophobicContact CD1-CD1 4.01Å; Y1133-I1197 HydrophobicContact CD1-CG2 4.15Å; Y1133-I1197 HydrophobicContact CE1-CD1 4.32Å; Y1133-I1197 HydrophobicContact CE1-CG2 3.39Å; L1179-I1197 HydrophobicContact CD1-CG1 4.13Å; L1179-I1197 HydrophobicContact CD2-CG2 4.28Å; P1192-I1197 HydrophobicContact CB-CG1 3.99Å; P1192-I1197 HydrophobicContact CG-CD1 4Å; P1192-I1197 HydrophobicContact CG-CG1 3.72Å; S1193-I1197 WeakPolarHBondContact O-CG1 3.41Å; S1193-I1197 PolarHBondContact O-N 3.22Å; F1194-I1197 HydrophobicContact CD1-CD1 3.67Å; F1194-I1197 HydrophobicContact CE1-CD1 3.93Å; F1194-I1197 HydrophobicContact CG-CD1 4.39Å; F1194-I1197 PolarHBondContact O-N 3.05Å; I1197-N1199 PolarHBondContact O-N 3.44Å; I1197-E1200 PolarHBondContact O-N 2.81Å; I1197-I1201 HydrophobicContact CG2-CD1 3.75Å; I1197-I1201 WeakPolarHBondContact O-CG1 3.39Å; I1197-I1201 PolarHBondContact O-N 3.33Å
1198	S	95.5	Very high	82.3	Confident	18 Å²	18	67.3 Å²	67.3	13%	0.126	37%	0.368	C	S	.	.	H	α-helix	trans	-57.7	-46.8	179.9	173.6	0	0	0	0	111.8	N1058 F1194 E1200 I1201	N1058-S1198 PolarHBondContact OD1-OG 3.22Å; F1194-S1198 WeakPolarHBondContact O-CB 3.5Å; F1194-S1198 PolarHBondContact O-N 3.33Å; S1198-E1200 VanDerWaalsContact C-N 3.32Å; S1198-E1200 PolarHBondContact O-N 2.74Å; S1198-I1201 PolarHBondContact O-N 3.17Å
1199	N	93.2	Very high	79.3	Confident	125 Å²	125	74 Å²	74	67%	0.668	40%	0.396	S	S	*	.	H	α-helix	trans	-67.3	-24.9	178.8	-75.4	-58.1	0	0	0	114.4	S1195 K1196 I1197	S1195-N1199 PolarHBondContact O-N 2.66Å; S1195-N1199 PolarHBondContact O-ND2 2.94Å; K1196-N1199 PolarHBondContact O-N 3.45Å; I1197-N1199 PolarHBondContact O-N 3.44Å
1200	E	92	Very high	76.4	Confident	73 Å²	73	73.2 Å²	73.2	34%	0.341	40%	0.399	S	S	.	.	H	α-helix	trans	-86.6	-14.5	177	-75.9	-175	-171.7	0	0	113.6	W1175 L1179 K1196 I1197 S1198 Q1202	W1175-E1200 WeakPolarHBondContact CZ3-O 3.35Å; L1179-E1200 HydrophobicContact CD2-CB 4.07Å; K1196-E1200 WeakPolarHBondContact CE-OE1 3.48Å; K1196-E1200 IonicContact NZ-OE1 2.87Å; K1196-E1200 PolarHBondContact O-N 3.33Å; K1196-E1200 VanDerWaalsContact O-N 3.07Å; I1197-E1200 PolarHBondContact O-N 2.81Å; S1198-E1200 VanDerWaalsContact C-N 3.32Å; S1198-E1200 PolarHBondContact O-N 2.74Å; E1200-Q1202 PolarHBondContact O-N 3.22Å
1201	I	90.7	Very high	73.3	Confident	10 Å²	10	73.8 Å²	73.8	5%	0.051	41%	0.408	C	S	.	.			trans	-80.9	90.7	179.5	-67.3	164.5	0	0	0	110.7	L1054 A1057 Y1133 W1175 L1176 L1179 I1197 S1198	L1054-I1201 HydrophobicContact CB-CG2 3.81Å; L1054-I1201 HydrophobicContact CD1-CB 4.2Å; L1054-I1201 HydrophobicContact CD1-CG2 4.27Å; A1057-I1201 HydrophobicContact CB-CD1 3.98Å; Y1133-I1201 WeakPolarHBondContact OH-CD1 3.33Å; W1175-I1201 HydrophobicContact CH2-CB 4.43Å; W1175-I1201 HydrophobicContact CH2-CG2 4.23Å; W1175-I1201 HydrophobicContact CZ3-CB 4.45Å; W1175-I1201 HydrophobicContact CZ3-CG1 4.24Å; L1176-I1201 HydrophobicContact CD1-CG1 4.44Å; L1179-I1201 HydrophobicContact CD2-CD1 4.43Å; L1179-I1201 HydrophobicContact CD2-CG1 3.9Å; I1197-I1201 HydrophobicContact CG2-CD1 3.75Å; I1197-I1201 WeakPolarHBondContact O-CG1 3.39Å; I1197-I1201 PolarHBondContact O-N 3.33Å; S1198-I1201 PolarHBondContact O-N 3.17Å
1202	Q	78.9	Confident	70.1	Confident	138 Å²	138	81.2 Å²	81.2	65%	0.645	45%	0.448	S	S	*	.			trans	-79.9	120.4	177	-62.5	-179	10.3	0	0	110.9	W1175 E1200 P1204	W1175-Q1202 WeakPolarHBondContact CZ2-O 3.29Å; E1200-Q1202 PolarHBondContact O-N 3.22Å; Q1202-P1204 WeakPolarHBondContact O-CD 3.46Å
1203	I	75.5	Confident	67	Low	56 Å²	56	88.9 Å²	88.9	29%	0.287	49%	0.487	S	S	.	.			trans	-103.3	107.4	169.4	-58.4	-173	0	0	0	107.8	M1047 L1050 Q1051 L1054 N1205	M1047-I1203 HydrophobicContact CE-CG2 3.5Å; L1050-I1203 HydrophobicContact CB-CG1 4.33Å; Q1051-I1203 HydrophobicContact CB-CD1 4.32Å; L1054-I1203 HydrophobicContact CB-CD1 4.08Å; L1054-I1203 HydrophobicContact CD2-CD1 3.54Å; L1054-I1203 HydrophobicContact CD2-CG1 4.23Å; L1054-I1203 HydrophobicContact CG-CD1 4.47Å; I1203-N1205 PolarHBondContact O-N 2.82Å
1204	P	64.3	Low	63.7	Low	55 Å²	55	94.1 Å²	94.1	36%	0.357	51%	0.512	S	S	.	.			trans	-54.7	127	176.5	-28.3	35.4	0	0	0	112	M1047 Q1202 V1206 F1209	M1047-P1204 HydrophobicContact CE-CB 4.27Å; M1047-P1204 WeakPolarHBondContact CE-O 3.44Å; M1047-P1204 HydrophobicContact SD-CG 4.44Å; Q1202-P1204 WeakPolarHBondContact O-CD 3.46Å; P1204-V1206 PolarHBondContact O-N 3.29Å; P1204-F1209 HydrophobicContact CB-CD2 4.39Å; P1204-F1209 HydrophobicContact CB-CE2 4.43Å
1205	N	51.4	Low	60.6	Low	110 Å²	110	105.9 Å²	105.9	59%	0.588	56%	0.557	S	S	*	*			trans	-66.3	128.9	178.9	-167.6	-24.1	0	0	0	109.4	I1203 N1207 S1208	I1203-N1205 PolarHBondContact O-N 2.82Å; N1205-N1207 PolarHBondContact O-N 3.24Å; N1205-S1208 PolarHBondContact O-N 2.96Å; N1205-S1208 PolarHBondContact O-OG 3.13Å; N1205-S1208 VanDerWaalsContact O-OG 3.13Å
1206	V	49.4	Very low	57.5	Low	120 Å²	120	108.6 Å²	108.6	73%	0.727	58%	0.576	S	S	*	*	G	3₁₀ helix	trans	-59.2	-23.9	-170.6	-176.5	0	0	0	0	112.2	P1204 S1208	P1204-V1206 PolarHBondContact O-N 3.29Å; V1206-S1208 VanDerWaalsContact C-N 3.3Å; V1206-S1208 PolarHBondContact O-N 3.12Å
1207	N	36.6	Very low	54.7	Low	154 Å²	154	111.2 Å²	111.2	82%	0.824	59%	0.593	S	S	*	*	G	3₁₀ helix	trans	-77.8	-2.9	177.5	-64.8	-17.6	0	0	0	114.9	N1205	N1205-N1207 PolarHBondContact O-N 3.24Å
1208	S	35.5	Very low	51.6	Low	81 Å²	81	118.1 Å²	118.1	57%	0.566	63%	0.63	S	S	*	*	G	3₁₀ helix	trans	-113.2	11.6	-175.8	78.2	0	0	0	0	115.8	N1205 V1206	N1205-S1208 PolarHBondContact O-N 2.96Å; N1205-S1208 PolarHBondContact O-OG 3.13Å; N1205-S1208 VanDerWaalsContact O-OG 3.13Å; V1206-S1208 VanDerWaalsContact C-N 3.3Å; V1206-S1208 PolarHBondContact O-N 3.12Å
1209	F	32.4	Very low	48.7	Very low	163 Å²	163	123.8 Å²	123.8	72%	0.715	66%	0.659	S	S	*	*			trans	-133.9	115.7	173.6	-90.4	-85.4	0	0	0	112.5	P1204	P1204-F1209 HydrophobicContact CB-CD2 4.39Å; P1204-F1209 HydrophobicContact CB-CE2 4.43Å
1210	T	32.2	Very low	46	Very low	128 Å²	128	123 Å²	123	79%	0.785	67%	0.67	S	S	*	*			trans	-71.3	143.7	164.3	43.9	0	0	0	0	110.1	N1212	T1210-N1212 PolarHBondContact O-N 2.79Å; T1210-N1212 VanDerWaalsContact O-N 3.1Å
1211	P	30.7	Very low	43.4	Very low	110 Å²	110	128.8 Å²	128.8	71%	0.714	70%	0.697	S	S	*	*			trans	-79.1	103.4	-160.8	29.6	-35.9	0	0	0	112.8
1212	N	31.1	Very low	40.8	Very low	161 Å²	161	135.3 Å²	135.3	86%	0.861	73%	0.731	S	S	*	*			trans	-126.6	40.3	174.9	-121.3	-9.3	0	0	0	113.4	T1210	T1210-N1212 PolarHBondContact O-N 2.79Å; T1210-N1212 VanDerWaalsContact O-N 3.1Å
1213	L	32.8	Very low	38.7	Very low	170 Å²	170	138.1 Å²	138.1	89%	0.89	74%	0.741	S	S	*	*			trans	-142.8	14.1	163.4	-139.2	78.4	0	0	0	115.2	R1215	L1213-R1215 PolarHBondContact O-N 2.95Å
1214	N	29.1	Very low	36.8	Very low	152 Å²	152	145.7 Å²	145.7	81%	0.813	77%	0.772	S	S	*	*			trans	-89.9	68.2	171.2	-88.3	-3.8	0	0	0	110.9
1215	R	31.3	Very low	35.3	Very low	246 Å²	246	148.6 Å²	148.6	93%	0.928	79%	0.794	S	S	*	*			trans	-167.3	72.3	173.3	-117.5	174.3	-156.7	-166.8	7	116.3	L1213	L1213-R1215 PolarHBondContact O-N 2.95Å
1216	S	31.1	Very low	34.7	Very low	109 Å²	109	147.5 Å²	147.5	76%	0.762	80%	0.8	S	S	*	*	S	Bend	trans	-175.1	158.5	145.7	50.8	0	0	0	0	109.5
1217	I	36.6	Very low	34.2	Very low	156 Å²	156	149.7 Å²	149.7	80%	0.8	81%	0.806	S	S	*	*	S	Bend	trans	69	151.9	-164.4	-49.8	163.4	0	0	0	110.6
1218	D	34.3	Very low	34.2	Very low	145 Å²	145	149.1 Å²	149.1	78%	0.775	80%	0.803	S	S	*	*	S	Bend	trans	51	64.6	177.9	-62.2	-8.9	0	0	0	117.7
1219	N	34.6	Very low	34.4	Very low	137 Å²	137	152.3 Å²	152.3	73%	0.733	81%	0.814	S	S	*	*			trans	-165	9.9	144.8	-110.7	-76.2	0	0	0	115	Q1221	N1219-Q1221 VanDerWaalsContact C-N 3.33Å; N1219-Q1221 PolarHBondContact O-N 2.94Å
1220	A	34.9	Very low	34.6	Very low	110 Å²	110	151.8 Å²	151.8	91%	0.909	82%	0.818	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.5	2.1	-167.8	0	0	0	0	0	116.5
1221	Q	38.1	Very low	34.8	Very low	193 Å²	193	150.1 Å²	150.1	90%	0.902	81%	0.811	S	S	*	*	T	Hydrogen-bonded Turn	trans	-119	-0.8	-177.3	-76.1	-176.9	-28.9	0	0	114.9	N1219	N1219-Q1221 VanDerWaalsContact C-N 3.33Å; N1219-Q1221 PolarHBondContact O-N 2.94Å
1222	L	35.1	Very low	35.2	Very low	148 Å²	148	151 Å²	151	78%	0.775	82%	0.815	S	S	*	*	S	Bend	trans	-130.2	48.1	-172.2	-93.2	157.9	0	0	0	113.6
1223	K	35	Very low	35.5	Very low	197 Å²	197	149.4 Å²	149.4	86%	0.857	81%	0.811	S	S	*	*			trans	-174.5	87.3	158.6	-103.6	151	-173	175.3	0	110.8
1224	K	35.8	Very low	35.6	Very low	214 Å²	214	147.1 Å²	147.1	93%	0.93	81%	0.806	S	S	*	*			trans	-142.4	47.1	171.2	-154.1	176.6	-175.3	-178.8	0	111.9
1225	S	33.6	Very low	36	Very low	117 Å²	117	148.6 Å²	148.6	82%	0.818	81%	0.813	S	S	*	*	S	Bend	trans	-159	44	-172.7	58.8	0	0	0	0	112.1
1226	A	38.4	Very low	36.1	Very low	87 Å²	87	144.1 Å²	144.1	72%	0.719	80%	0.803	S	S	*	*	S	Bend	trans	-158	122.8	174.1	0	0	0	0	0	112.9
1227	I	39.2	Very low	36.2	Very low	166 Å²	166	147.5 Å²	147.5	85%	0.851	81%	0.811	S	S	*	*			trans	63.6	91.4	152.9	-49.7	169.5	0	0	0	116.5
1228	D	37.4	Very low	35.9	Very low	141 Å²	141	144 Å²	144	75%	0.754	80%	0.8	S	S	*	*			trans	-69.3	146.8	142.8	-63.8	-71.1	0	0	0	110.5
1229	N	39.4	Very low	35.9	Very low	149 Å²	149	144.2 Å²	144.2	80%	0.797	81%	0.806	S	S	*	*			trans	141.7	148.7	139.2	-76.9	-67	0	0	0	116
1230	L	36.5	Very low	35.7	Very low	152 Å²	152	143 Å²	143	80%	0.796	81%	0.809	S	S	*	*			trans	69.8	71.9	163.5	-93.9	66.4	0	0	0	120.7
1231	S	36.3	Very low	35.8	Very low	93 Å²	93	143.5 Å²	143.5	65%	0.65	80%	0.8	S	S	*	*				33.5	150.8	113.1	67	0	0	0	0	124.1
1232	T	37.7	Very low	35.7	Very low	128 Å²	128	143 Å²	143	79%	0.785	80%	0.795	S	S	*	*			trans	78	139.9	163.5	72.2	0	0	0	0	117.2
1233	T	38	Very low	35.7	Very low	128 Å²	128	141.5 Å²	141.5	79%	0.785	79%	0.788	S	S	*	*			cis	-155.1	149.6	-16.3	13.5	0	0	0	0	108.9
1234	P	35.8	Very low	35.8	Very low	122 Å²	122	142.1 Å²	142.1	79%	0.792	79%	0.785	S	S	*	*			trans	-93.6	160.5	-175.1	37	-35.4	0	0	0	114.4
1235	L	36.5	Very low	35.8	Very low	183 Å²	183	142.5 Å²	142.5	96%	0.958	78%	0.78	S	S	*	*			trans	-126.5	156.5	163.6	-97.7	171.9	0	0	0	111.4
1236	H	33.5	Very low	36	Very low	152 Å²	152	142.5 Å²	142.5	70%	0.704	78%	0.776	S	S	*	*			trans	-128.7	131.5	-156.3	169.9	-71.5	0	0	0	111.4	S1238	H1236-S1238 PolarHBondContact CE1-OG 3.35Å
1237	L	33	Very low	35.8	Very low	179 Å²	179	148.4 Å²	148.4	94%	0.937	78%	0.779	S	S	*	*			trans	-147.6	128	166.6	-114.5	159.2	0	0	0	110.7
1238	S	30.4	Very low	35.6	Very low	83 Å²	83	147.5 Å²	147.5	58%	0.58	77%	0.772	S	S	*	*			trans	-132	134.3	-167.3	57.6	0	0	0	0	111	H1236	H1236-S1238 PolarHBondContact CE1-OG 3.35Å
1239	V	34.1	Very low	35.3	Very low	149 Å²	149	152.5 Å²	152.5	90%	0.903	80%	0.798	S	S	*	*			trans	-132.3	138.7	163.1	-178	0	0	0	0	108.5
1240	S	30.6	Very low	35.1	Very low	111 Å²	111	152.7 Å²	152.7	78%	0.776	80%	0.798	S	S	*	*			trans	-146.9	138.3	-174.7	169.8	0	0	0	0	110.4
1241	V	36.6	Very low	35.1	Very low	122 Å²	122	152.7 Å²	152.7	74%	0.739	80%	0.798	S	S	*	*			trans	-171.9	115.8	160.1	132.8	0	0	0	0	104.8
1242	K	36.3	Very low	35	Very low	181 Å²	181	156 Å²	156	79%	0.787	81%	0.807	S	S	*	*				49.7	130.8	93.9	-60.1	178	-176.9	176.2	0	112
1243	D	36.6	Very low	34.8	Very low	117 Å²	117	157.6 Å²	157.6	63%	0.626	81%	0.808	S	S	*	*			cis	-148.4	-173.8	8.8	-146.1	5.7	0	0	0	105.9
1244	R	36.1	Very low	34.6	Very low	210 Å²	210	159.5 Å²	159.5	79%	0.792	81%	0.809	S	S	*	*			cis	-154.8	-175.6	14.9	-171.3	153.1	-80.6	-162.2	-5.5	109.5
1245	R	35.5	Very low	34.6	Very low	222 Å²	222	162 Å²	162	84%	0.838	81%	0.81	S	S	*	*			trans	-80.8	168	167.3	-54.2	169	-172.2	168.1	0.5	109.3
1246	T	37.4	Very low	34.4	Very low	117 Å²	117	160.5 Å²	160.5	72%	0.718	80%	0.8	S	S	*	*			cis	-165.4	158.6	44.9	49.4	0	0	0	0	113
1247	R	34.8	Very low	34.5	Very low	211 Å²	211	161.2 Å²	161.2	80%	0.796	81%	0.807	S	S	*	*			trans	69.7	154.5	156.4	-76.2	-170.9	144.4	144.2	0.3	117.6
1248	E	35	Very low	34.6	Very low	147 Å²	147	159.7 Å²	159.7	69%	0.687	80%	0.797	S	S	*	*			cis	-172.5	111.1	-31.8	-119.6	167.9	-173.3	0	0	104.6
1249	D	32	Very low	35	Very low	246 Å²	246	166.6 Å²	166.6	100%	1.316	82%	0.816	S	S	*	*			trans	-168.2	0	163.6	-97.1	-26.9	0	0	0	107.7

Retrieved 1,249 of 1,249 residues in 387.6 ms (Link to these results)

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